#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gtl n THR 26 N 0.00 -0.05 -3.63 0.00 -1.04 -1.26 -4.88 114.28 103.42 3gtl n THR 26 Ca 0.00 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.62 3gtl n THR 26 Cb 0.00 -0.21 -0.06 0.00 -1.82 0.00 0.00 70.33 68.24 3gtl n THR 26 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 3gtl s LEU 27 N -3.46 4.42 0.08 -4.42 2.34 -1.26 -5.04 118.68 111.34 3gtl s LEU 27 Ca 0.26 0.77 -0.01 0.00 0.06 0.00 0.00 54.13 55.21 3gtl s LEU 27 Cb -0.15 -2.59 -0.00 0.00 -0.56 0.00 0.00 46.19 42.89 3gtl s LEU 27 CO 0.37 0.30 -0.02 0.29 -1.06 0.00 0.00 176.35 176.23 3gtl n LYS 28 N 1.54 0.02 -4.42 1.48 5.02 -1.25 -4.95 118.16 115.61 3gtl n LYS 28 Ca -0.13 0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 55.96 3gtl n LYS 28 Cb 0.53 -0.54 -0.10 0.00 -0.02 0.00 0.00 35.03 34.89 3gtl n LYS 28 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3gtl s TYR 29 N -2.04 1.94 -0.08 2.13 1.51 -0.30 -4.43 117.35 116.08 3gtl s TYR 29 Ca -0.01 -0.61 -0.05 0.00 -1.01 0.00 0.00 57.07 55.39 3gtl s TYR 29 Cb 0.00 -1.02 0.03 0.00 -0.11 0.00 0.00 41.96 40.86 3gtl s TYR 29 CO 0.02 0.37 0.19 0.42 -1.11 0.00 0.00 175.55 175.44 3gtl s ILE 30 N -2.92 -0.03 0.84 2.71 1.01 -1.14 -1.22 121.20 120.45 3gtl s ILE 30 Ca 0.28 0.11 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 3gtl s ILE 30 Cb 0.01 -0.29 0.14 0.00 0.01 0.00 0.00 42.46 42.33 3gtl s ILE 30 CO 0.11 0.04 1.18 0.00 0.00 0.00 0.00 174.94 176.27 3gtl h ALA 32 N -1.13 0.20 0.04 0.00 0.00 -1.92 -3.36 119.26 113.09 3gtl h ALA 32 Ca -0.43 -1.16 -0.35 0.00 0.00 0.00 0.00 54.91 52.97 3gtl h ALA 32 Cb 1.27 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.47 3gtl h ALA 32 CO 0.47 1.07 -2.05 0.39 0.00 0.00 0.00 179.25 179.13 3gtl n GLU 33 N -3.56 0.69 -0.06 0.00 1.02 -1.26 -4.74 120.64 112.72 3gtl n GLU 33 Ca -0.24 0.21 -0.08 0.00 -0.02 0.00 0.00 57.16 57.02 3gtl n GLU 33 Cb 1.07 -1.67 -0.03 0.00 -0.02 0.00 0.00 31.44 30.79 3gtl n GLU 33 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gtl n SER 35 N -4.25 0.00 -4.65 0.00 7.64 -1.26 -5.08 113.62 106.03 3gtl n SER 35 Ca -0.13 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.32 3gtl n SER 35 Cb 0.44 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 3gtl n SER 35 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3gtl s SER 36 N -0.18 6.97 -1.20 6.43 0.15 -1.26 -4.87 113.70 119.75 3gtl s SER 36 Ca 0.00 1.16 -0.10 0.00 0.70 0.00 0.00 55.95 57.72 3gtl s SER 36 Cb 0.00 -2.52 -0.07 0.00 -1.71 0.00 0.00 66.02 61.73 3gtl s SER 36 CO 0.00 -0.71 2.39 0.29 1.20 0.00 0.00 173.24 176.41 3gtl n LYS 37 N 6.44 2.65 -0.54 5.44 5.02 -1.26 -3.33 118.16 132.57 3gtl n LYS 37 Ca 0.10 -1.86 -0.29 0.00 -2.02 0.00 0.00 58.31 54.24 3gtl n LYS 37 Cb 0.47 -2.70 0.23 0.00 -0.02 0.00 0.00 35.03 33.01 3gtl n LYS 37 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3gtl s LEU 38 N 0.45 1.41 -0.30 -0.35 1.02 -0.36 -4.77 118.68 115.78 3gtl s LEU 38 Ca 0.53 1.76 -0.03 0.00 0.02 0.00 0.00 54.13 56.40 3gtl s LEU 38 Cb 0.14 -3.79 0.19 0.00 0.02 0.00 0.00 46.19 42.75 3gtl s LEU 38 CO -0.03 -3.96 0.80 -0.55 0.02 0.00 0.00 176.35 172.63 3gtl s SER 39 N -2.49 -1.04 0.02 2.29 0.15 -1.26 -1.15 113.70 110.21 3gtl s SER 39 Ca 0.68 0.28 0.02 0.00 0.70 0.00 0.00 55.95 57.64 3gtl s SER 39 Cb -0.25 1.72 -0.01 0.00 -1.71 0.00 0.00 66.02 65.77 3gtl s SER 39 CO 0.63 -0.19 -0.08 -0.76 1.20 0.00 0.00 173.24 174.04 3gtl s LEU 40 N 2.89 2.13 0.80 3.45 1.43 -1.26 -5.04 118.68 123.09 3gtl s LEU 40 Ca 0.15 -0.34 -0.08 0.00 -1.03 0.00 0.00 54.13 52.84 3gtl s LEU 40 Cb -0.08 -0.29 0.13 0.00 0.03 0.00 0.00 46.19 45.98 3gtl s LEU 40 CO -0.22 -0.05 1.12 -0.94 0.23 0.00 0.00 176.35 176.50 3gtl s SER 41 N -0.87 4.04 0.72 2.29 1.04 -1.26 -4.98 113.70 114.68 3gtl s SER 41 Ca -0.03 0.10 -0.15 0.00 0.48 0.00 0.00 55.95 56.36 3gtl s SER 41 Cb -0.06 -0.44 0.03 0.00 0.10 0.00 0.00 66.02 65.65 3gtl s SER 41 CO 0.00 -2.10 1.19 0.00 0.98 0.00 0.00 173.24 173.31 3gtl s ARG 42 N -5.44 2.23 -1.67 4.02 1.04 -1.26 -2.69 118.95 115.17 3gtl s ARG 42 Ca 0.67 1.68 0.00 0.00 -1.04 0.00 0.00 55.73 57.04 3gtl s ARG 42 Cb -0.06 -1.85 0.00 0.00 -2.04 0.00 0.00 34.95 30.99 3gtl s ARG 42 CO 0.48 -1.75 0.00 2.41 -0.04 0.00 0.00 175.30 176.40 3gtl n THR 43 N -2.71 -0.56 -0.68 4.99 -1.04 -1.26 -4.79 114.28 108.23 3gtl n THR 43 Ca 0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 3gtl n THR 43 Cb 0.51 -2.34 0.00 0.00 -1.82 0.00 0.00 70.33 66.67 3gtl n THR 43 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3gtl n ASP 44 N -1.26 0.54 0.00 8.00 2.03 -1.10 -5.08 116.55 119.68 3gtl n ASP 44 Ca -0.20 -1.21 0.00 0.00 0.52 0.00 0.00 54.79 53.89 3gtl n ASP 44 Cb 0.64 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.04 3gtl n ASP 44 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gtl n ALA 45 N -0.11 0.00 -3.74 -1.67 0.00 -1.26 -4.70 120.51 109.03 3gtl n ALA 45 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3gtl n ALA 45 Cb 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 3gtl n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3gtl n VAL 46 N 0.00 0.00 0.00 0.00 0.31 -1.26 -5.05 118.33 112.33 3gtl n VAL 46 Ca 0.00 -1.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.06 3gtl n VAL 46 Cb 0.00 0.79 0.00 0.00 -0.91 0.00 0.00 33.84 33.72 3gtl n VAL 46 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3gtl n ARG 47 N -0.42 0.00 -1.44 5.55 0.63 -1.26 -5.09 116.66 114.63 3gtl n ARG 47 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.81 3gtl n ARG 47 Cb 0.42 0.00 0.07 0.00 0.45 0.00 0.00 32.46 33.41 3gtl n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3gtl s LYS 49 N -3.98 1.41 -0.91 0.00 -0.14 -1.26 -4.60 119.74 110.27 3gtl s LYS 49 Ca 0.35 -1.88 -0.03 0.00 -1.36 0.00 0.00 55.97 53.06 3gtl s LYS 49 Cb -0.02 -2.94 0.00 0.00 -1.68 0.00 0.00 37.83 33.20 3gtl s LYS 49 CO 0.24 -1.00 0.78 -3.47 -0.76 0.00 0.00 175.35 171.14 3gtl n ASP 50 N 4.10 -3.52 0.00 2.83 2.03 -1.26 -4.85 116.55 115.88 3gtl n ASP 50 Ca 0.03 -0.41 0.00 0.00 0.52 0.00 0.00 54.79 54.93 3gtl n ASP 50 Cb 0.40 -3.77 0.00 0.00 -0.72 0.00 0.00 41.12 37.03 3gtl n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gtl n GLY 52 N -0.85 2.59 3.62 0.00 0.00 -1.26 -5.00 105.19 104.28 3gtl n GLY 52 Ca 0.00 -0.58 -0.48 0.00 0.00 0.00 0.00 46.02 44.96 3gtl n GLY 52 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3gtl n HIS 53 N 0.00 2.10 0.00 1.61 8.25 -1.26 -3.16 115.22 122.77 3gtl n HIS 53 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3gtl n HIS 53 Cb 0.00 -2.64 0.00 0.00 1.12 0.00 0.00 29.99 28.47 3gtl n HIS 53 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3gtl n ARG 54 N 7.34 0.00 0.00 -0.41 1.74 -1.26 -4.45 116.66 119.62 3gtl n ARG 54 Ca 0.28 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 3gtl n ARG 54 Cb 0.30 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 3gtl n ARG 54 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 3gtl n ILE 55 N -0.14 0.00 0.00 0.55 -5.35 -1.26 -4.65 119.36 108.50 3gtl n ILE 55 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 3gtl n ILE 55 Cb 0.00 -0.09 0.00 0.00 -1.74 0.00 0.00 39.64 37.81 3gtl n ILE 55 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3gtl n LEU 56 N 0.00 -0.02 0.00 7.28 4.77 -1.26 -4.87 117.00 122.90 3gtl n LEU 56 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 3gtl n LEU 56 Cb 0.00 0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3gtl n LEU 56 CO 0.00 0.00 -0.05 0.18 -1.33 0.00 0.00 177.39 176.19 3gtl n LEU 57 N -0.02 0.00 -0.03 2.23 4.77 0.14 -4.95 117.00 119.15 3gtl n LEU 57 Ca 0.00 -0.74 0.03 0.00 -0.03 0.00 0.00 56.01 55.27 3gtl n LEU 57 Cb 0.00 0.17 0.04 0.00 -2.33 0.00 0.00 43.42 41.30 3gtl n LEU 57 CO 0.00 -0.11 0.52 1.17 -1.33 0.00 0.00 177.39 177.64 3gtl n LYS 58 N -0.25 2.59 0.00 3.23 4.81 -1.26 -2.87 118.16 124.41 3gtl n LYS 58 Ca -0.03 -1.78 0.00 0.00 -0.87 0.00 0.00 58.31 55.63 3gtl n LYS 58 Cb 0.15 -1.13 0.00 0.00 0.02 0.00 0.00 35.03 34.07 3gtl n LYS 58 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3gtl n ALA 59 N -0.71 0.00 0.00 3.14 0.00 -1.26 -4.77 120.51 116.91 3gtl n ALA 59 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3gtl n ALA 59 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 3gtl n ALA 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3gtl n ARG 60 N 0.00 -3.06 -0.96 0.00 3.00 -1.26 -5.14 116.66 109.24 3gtl n ARG 60 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 3gtl n ARG 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3gtl n ARG 60 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 3gtl n THR 61 N 0.08 0.00 -2.72 5.15 -2.24 -1.26 -5.02 114.28 108.26 3gtl n THR 61 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 3gtl n THR 61 Cb 0.00 -0.92 0.05 0.00 -2.10 0.00 0.00 70.33 67.36 3gtl n THR 61 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3gtl n LYS 62 N -0.81 1.68 -3.25 -0.78 4.01 -1.26 -4.86 118.16 112.90 3gtl n LYS 62 Ca 0.00 -3.39 -0.35 0.00 -0.51 0.00 0.00 58.31 54.06 3gtl n LYS 62 Cb 0.00 -1.48 -0.04 0.00 -0.51 0.00 0.00 35.03 33.00 3gtl n LYS 62 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 3gtl n ARG 63 N -0.49 3.44 -1.34 1.97 1.85 -1.26 -5.08 116.66 115.76 3gtl n ARG 63 Ca 0.10 -4.61 -0.39 0.00 -1.00 0.00 0.00 57.85 51.95 3gtl n ARG 63 Cb 0.85 -2.39 0.02 0.00 -1.05 0.00 0.00 32.46 29.89 3gtl n ARG 63 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 3gtl n LEU 64 N 1.18 -1.96 -4.74 2.89 4.77 -1.26 -4.91 117.00 112.96 3gtl n LEU 64 Ca 0.27 0.73 -0.35 0.00 -0.03 0.00 0.00 56.01 56.63 3gtl n LEU 64 Cb 0.37 -0.97 -0.08 0.00 -2.33 0.00 0.00 43.42 40.41 3gtl n LEU 64 CO 0.55 -4.04 -0.18 0.68 -1.33 0.00 0.00 177.39 173.07 3gtl s VAL 65 N -1.83 5.39 0.70 4.08 -7.23 -1.26 -5.08 120.40 115.16 3gtl s VAL 65 Ca 0.61 0.18 -0.09 0.00 -1.81 0.00 0.00 61.98 60.87 3gtl s VAL 65 Cb -0.51 -3.45 0.03 0.00 0.56 0.00 0.00 36.38 33.01 3gtl s VAL 65 CO 0.62 0.46 1.05 -1.58 -0.31 0.00 0.00 175.10 175.33 3gtl s GLN 66 N 0.24 2.57 -0.07 4.82 0.74 -1.26 -5.09 119.66 121.60 3gtl s GLN 66 Ca 0.08 0.13 -0.04 0.00 0.05 0.00 0.00 55.36 55.59 3gtl s GLN 66 Cb -0.11 -2.10 0.04 0.00 1.10 0.00 0.00 33.01 31.93 3gtl s GLN 66 CO -0.01 -1.10 0.17 -0.06 -0.55 0.00 0.00 175.29 173.74 3gtl s PHE 67 N -3.29 -0.20 -0.09 1.67 0.40 -1.26 -5.11 117.98 110.10 3gtl s PHE 67 Ca 0.58 0.54 -0.38 0.00 -0.60 0.00 0.00 56.93 57.07 3gtl s PHE 67 Cb -0.11 -0.03 -0.16 0.00 0.51 0.00 0.00 43.02 43.24 3gtl s PHE 67 CO 0.48 -0.17 1.56 0.39 0.70 0.00 0.00 175.22 178.19 3gtl n GLU 68 N 3.99 1.22 0.00 0.44 4.71 -1.26 -4.88 120.64 124.85 3gtl n GLU 68 Ca -0.24 0.44 0.14 0.00 -0.01 0.00 0.00 57.16 57.50 3gtl n GLU 68 Cb 0.53 -2.12 0.59 0.00 -1.01 0.00 0.00 31.44 29.43 3gtl n GLU 68 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3gtl n ALA 69 N 4.07 2.78 1.99 0.62 0.00 -1.26 -5.34 120.51 123.37 3gtl n ALA 69 Ca 0.22 -0.26 0.16 0.00 0.00 0.00 0.00 53.44 53.56 3gtl n ALA 69 Cb 0.17 -1.33 0.94 0.00 0.00 0.00 0.00 19.45 19.23 3gtl n ALA 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04