#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3v n THR 26 N 0.00 -0.48 -4.48 0.00 -1.04 -1.26 -5.14 114.28 101.88 3h3v n THR 26 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 3h3v n THR 26 Cb 0.00 -0.10 -0.09 0.00 -1.82 0.00 0.00 70.33 68.32 3h3v n THR 26 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 3h3v s LEU 27 N -0.86 2.02 0.19 -4.42 2.34 -1.26 -5.09 118.68 111.60 3h3v s LEU 27 Ca 0.00 -1.57 0.00 0.00 0.06 0.00 0.00 54.13 52.62 3h3v s LEU 27 Cb 0.00 -0.18 0.00 0.00 -0.56 0.00 0.00 46.19 45.45 3h3v s LEU 27 CO 0.00 -0.82 0.00 1.17 -1.06 0.00 0.00 176.35 175.64 3h3v n LYS 28 N -0.82 0.00 -4.71 1.48 4.81 -1.26 -5.03 118.16 112.63 3h3v n LYS 28 Ca -0.05 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.08 3h3v n LYS 28 Cb 0.66 -0.14 -0.08 0.00 0.02 0.00 0.00 35.03 35.48 3h3v n LYS 28 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 3h3v s TYR 29 N -2.00 1.94 0.20 5.64 4.12 -1.26 -4.33 117.35 121.66 3h3v s TYR 29 Ca 0.00 -0.96 -0.09 0.00 0.02 0.00 0.00 57.07 56.04 3h3v s TYR 29 Cb 0.00 -1.58 -0.01 0.00 -1.52 0.00 0.00 41.96 38.85 3h3v s TYR 29 CO 0.00 0.20 0.33 0.42 0.02 0.00 0.00 175.55 176.51 3h3v s ILE 30 N -2.90 0.03 0.06 2.71 1.01 -0.13 -1.96 121.20 120.02 3h3v s ILE 30 Ca 0.12 -1.48 0.01 0.00 0.00 0.00 0.00 60.65 59.30 3h3v s ILE 30 Cb 0.03 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 3h3v s ILE 30 CO 0.06 -0.15 0.12 0.00 0.00 0.00 0.00 174.94 174.97 3h3v h ALA 32 N 3.39 1.02 0.00 0.00 0.00 -1.91 -3.14 119.26 118.63 3h3v h ALA 32 Ca -0.47 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.15 3h3v h ALA 32 Cb 1.17 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3h3v h ALA 32 CO 0.68 0.60 -0.56 0.39 0.00 0.00 0.00 179.25 180.36 3h3v n GLU 33 N -4.19 0.30 -0.79 0.00 1.02 -1.26 -4.53 120.64 111.18 3h3v n GLU 33 Ca 0.02 0.12 -0.08 0.00 -0.02 0.00 0.00 57.16 57.20 3h3v n GLU 33 Cb 0.33 -1.00 -0.05 0.00 -0.02 0.00 0.00 31.44 30.70 3h3v n GLU 33 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h3v n SER 35 N 1.61 -1.25 -3.77 0.00 3.41 -1.19 -4.63 113.62 107.80 3h3v n SER 35 Ca 0.22 -0.82 -0.24 0.00 -0.26 0.00 0.00 58.87 57.76 3h3v n SER 35 Cb 0.65 -0.39 -0.17 0.00 -0.26 0.00 0.00 64.21 64.04 3h3v n SER 35 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3h3v s SER 36 N 0.00 1.88 0.46 4.04 1.04 -1.26 -4.84 113.70 115.02 3h3v s SER 36 Ca 0.16 -0.25 -0.09 0.00 0.48 0.00 0.00 55.95 56.26 3h3v s SER 36 Cb -0.10 -0.48 -0.08 0.00 0.10 0.00 0.00 66.02 65.45 3h3v s SER 36 CO 0.07 -0.22 -0.34 0.29 0.98 0.00 0.00 173.24 174.02 3h3v n LYS 37 N 5.12 0.00 0.00 4.02 5.02 -1.26 -4.17 118.16 126.90 3h3v n LYS 37 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 3h3v n LYS 37 Cb 0.49 -0.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.99 3h3v n LYS 37 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3h3v n LEU 38 N 1.69 0.00 0.00 -0.35 7.94 -0.83 -4.89 117.00 120.56 3h3v n LEU 38 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3h3v n LEU 38 Cb 0.28 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.23 3h3v n LEU 38 CO 0.27 0.00 0.00 -0.24 -1.11 0.00 0.00 177.39 176.31 3h3v n SER 39 N -0.14 -0.32 0.00 1.96 2.88 -1.26 -4.77 113.62 111.98 3h3v n SER 39 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 3h3v n SER 39 Cb 0.00 0.48 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 3h3v n SER 39 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3h3v n LEU 40 N -0.56 0.00 0.00 2.46 4.77 -1.26 -4.95 117.00 117.46 3h3v n LEU 40 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3h3v n LEU 40 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h3v n LEU 40 CO 0.00 0.00 0.04 -1.54 -1.33 0.00 0.00 177.39 174.56 3h3v n SER 41 N 0.00 -0.08 -4.54 -1.43 3.41 -1.26 -5.12 113.62 104.60 3h3v n SER 41 Ca 0.00 -1.04 -0.44 0.00 -0.26 0.00 0.00 58.87 57.13 3h3v n SER 41 Cb 0.00 0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 64.07 3h3v n SER 41 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3h3v n ARG 42 N -0.04 1.01 -3.61 4.33 1.74 -1.26 -3.60 116.66 115.23 3h3v n ARG 42 Ca -0.00 0.36 -0.30 0.00 -0.77 0.00 0.00 57.85 57.13 3h3v n ARG 42 Cb 0.03 -1.68 0.02 0.00 -1.02 0.00 0.00 32.46 29.81 3h3v n ARG 42 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3h3v n THR 43 N -0.10 -4.06 -1.30 0.55 -1.04 -1.26 -4.89 114.28 102.19 3h3v n THR 43 Ca 0.11 0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 3h3v n THR 43 Cb 0.33 -3.48 0.00 0.00 -1.82 0.00 0.00 70.33 65.36 3h3v n THR 43 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3h3v n ASP 44 N -1.38 0.00 0.00 8.00 8.00 -1.24 -5.13 116.55 124.80 3h3v n ASP 44 Ca -0.19 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.22 3h3v n ASP 44 Cb 0.68 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 3h3v n ASP 44 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h3v n ALA 45 N 0.00 0.00 -2.56 2.24 0.00 -1.26 -4.68 120.51 114.25 3h3v n ALA 45 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3h3v n ALA 45 Cb 0.52 0.00 0.06 0.00 0.00 0.00 0.00 19.45 20.03 3h3v n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h3v n VAL 46 N 0.00 0.31 -3.77 0.00 0.31 -1.26 -5.03 118.33 108.89 3h3v n VAL 46 Ca 0.00 -1.26 -0.25 0.00 -0.01 0.00 0.00 64.34 62.82 3h3v n VAL 46 Cb 0.00 0.98 -0.01 0.00 -0.91 0.00 0.00 33.84 33.90 3h3v n VAL 46 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3h3v s ARG 47 N -0.86 2.31 0.38 5.55 0.52 -1.26 -4.44 118.95 121.15 3h3v s ARG 47 Ca 0.14 -1.88 0.08 0.00 -0.52 0.00 0.00 55.73 53.55 3h3v s ARG 47 Cb 0.32 -2.19 -0.04 0.00 0.52 0.00 0.00 34.95 33.57 3h3v s ARG 47 CO -0.09 -0.52 0.24 0.00 0.02 0.00 0.00 175.30 174.95 3h3v n LYS 49 N -1.32 2.04 0.00 0.00 4.76 -1.26 -4.16 118.16 118.22 3h3v n LYS 49 Ca -0.01 -2.61 0.00 0.00 -2.87 0.00 0.00 58.31 52.82 3h3v n LYS 49 Cb 0.62 -3.57 0.00 0.00 -1.84 0.00 0.00 35.03 30.24 3h3v n LYS 49 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3h3v n ASP 50 N 11.81 0.00 -4.73 4.39 2.03 -1.26 -5.08 116.55 123.71 3h3v n ASP 50 Ca 0.47 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 55.36 3h3v n ASP 50 Cb 0.45 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.83 3h3v n ASP 50 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3h3v h GLY 52 N 6.17 0.83 -2.07 0.00 0.00 -1.98 -2.90 103.07 103.12 3h3v h GLY 52 Ca -0.44 -1.26 -0.08 0.00 0.00 0.00 0.00 47.33 45.55 3h3v h GLY 52 CO 0.90 1.12 0.52 1.42 0.00 0.00 0.00 176.54 180.49 3h3v n HIS 53 N -3.94 0.00 -0.18 5.60 8.25 -1.26 -4.44 115.22 119.25 3h3v n HIS 53 Ca -0.09 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.37 3h3v n HIS 53 Cb 0.78 -0.15 -0.00 0.00 1.12 0.00 0.00 29.99 31.74 3h3v n HIS 53 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3h3v n ARG 54 N 1.54 0.35 0.00 -0.41 1.74 -1.26 -4.55 116.66 114.07 3h3v n ARG 54 Ca 0.15 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 3h3v n ARG 54 Cb 0.07 -1.35 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 3h3v n ARG 54 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 3h3v n ILE 55 N 1.87 0.00 0.00 0.55 -5.35 -1.26 -4.93 119.36 110.24 3h3v n ILE 55 Ca 0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 3h3v n ILE 55 Cb 0.17 -0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.01 3h3v n ILE 55 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3h3v n LEU 56 N 0.00 -0.82 -4.75 7.28 4.77 -1.25 -4.94 117.00 117.29 3h3v n LEU 56 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 3h3v n LEU 56 Cb 0.00 0.43 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 3h3v n LEU 56 CO 0.00 0.00 -0.15 -0.76 -1.33 0.00 0.00 177.39 175.15 3h3v s LEU 57 N -0.47 3.04 -0.01 2.23 1.43 -0.44 -4.91 118.68 119.56 3h3v s LEU 57 Ca 0.00 -1.13 0.18 0.00 -1.03 0.00 0.00 54.13 52.15 3h3v s LEU 57 Cb 0.00 -1.37 -0.22 0.00 0.03 0.00 0.00 46.19 44.63 3h3v s LEU 57 CO 0.00 -0.59 0.63 1.17 0.23 0.00 0.00 176.35 177.79 3h3v n LYS 58 N -1.27 1.01 -1.63 1.70 4.81 -1.26 -0.96 118.16 120.56 3h3v n LYS 58 Ca -0.02 -0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 3h3v n LYS 58 Cb 0.65 -1.36 0.00 0.00 0.02 0.00 0.00 35.03 34.34 3h3v n LYS 58 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3h3v n ALA 59 N -1.65 -1.86 -0.33 3.14 0.00 -1.26 -4.47 120.51 114.08 3h3v n ALA 59 Ca 0.01 0.43 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 3h3v n ALA 59 Cb 0.34 -1.36 0.01 0.00 0.00 0.00 0.00 19.45 18.44 3h3v n ALA 59 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3h3v n ARG 60 N -1.08 0.00 -3.57 0.00 0.63 -1.26 -4.97 116.66 106.41 3h3v n ARG 60 Ca 0.00 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.66 3h3v n ARG 60 Cb 0.05 -0.33 -0.03 0.00 0.45 0.00 0.00 32.46 32.59 3h3v n ARG 60 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3h3v s THR 61 N -0.67 5.14 0.04 5.15 2.01 -1.26 -5.01 115.64 121.04 3h3v s THR 61 Ca 0.12 -0.26 -0.23 0.00 0.31 0.00 0.00 61.69 61.63 3h3v s THR 61 Cb 0.01 -3.75 -0.15 0.00 0.01 0.00 0.00 72.50 68.62 3h3v s THR 61 CO 0.24 -0.25 1.45 0.11 -0.69 0.00 0.00 174.62 175.47 3h3v h LYS 62 N 1.79 0.15 -7.12 4.92 6.56 -2.00 -3.43 116.57 117.44 3h3v h LYS 62 Ca -0.48 -0.05 -0.55 0.00 -1.06 0.00 0.00 60.65 58.51 3h3v h LYS 62 Cb 1.19 -0.01 0.15 0.00 -0.57 0.00 0.00 32.23 32.99 3h3v h LYS 62 CO 0.67 0.44 0.49 -0.98 -2.06 0.00 0.00 179.45 178.01 3h3v s ARG 63 N -4.88 2.57 0.23 3.15 1.70 -1.26 -4.97 118.95 115.50 3h3v s ARG 63 Ca -0.15 1.98 -0.19 0.00 -0.47 0.00 0.00 55.73 56.91 3h3v s ARG 63 Cb 0.04 -1.86 -0.08 0.00 -0.57 0.00 0.00 34.95 32.48 3h3v s ARG 63 CO 0.70 -1.56 0.72 -0.51 -1.08 0.00 0.00 175.30 173.57 3h3v s LEU 64 N -4.42 4.31 -0.22 -1.89 1.43 -1.26 -5.06 118.68 111.56 3h3v s LEU 64 Ca 0.81 1.39 -0.05 0.00 -1.03 0.00 0.00 54.13 55.25 3h3v s LEU 64 Cb -0.35 -3.65 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 3h3v s LEU 64 CO 0.39 0.00 -0.01 0.68 0.23 0.00 0.00 176.35 177.65 3h3v s VAL 65 N -1.58 3.73 0.22 -1.59 -7.23 -1.26 -5.10 120.40 107.59 3h3v s VAL 65 Ca 0.44 -0.38 -0.06 0.00 -1.81 0.00 0.00 61.98 60.18 3h3v s VAL 65 Cb -0.16 -2.70 -0.06 0.00 0.56 0.00 0.00 36.38 34.02 3h3v s VAL 65 CO 0.20 0.41 0.49 -1.58 -0.31 0.00 0.00 175.10 174.31 3h3v s GLN 66 N 1.36 3.67 0.21 4.82 0.74 -1.26 -5.10 119.66 124.10 3h3v s GLN 66 Ca 0.04 0.04 0.05 0.00 0.05 0.00 0.00 55.36 55.54 3h3v s GLN 66 Cb -0.15 -2.72 -0.05 0.00 1.10 0.00 0.00 33.01 31.19 3h3v s GLN 66 CO -0.00 0.34 -0.08 -0.06 -0.55 0.00 0.00 175.29 174.94 3h3v s PHE 67 N -1.86 1.59 0.29 1.67 0.40 -1.26 -5.13 117.98 113.69 3h3v s PHE 67 Ca 0.44 -0.74 -0.29 0.00 -0.60 0.00 0.00 56.93 55.74 3h3v s PHE 67 Cb -0.11 -0.84 -0.09 0.00 0.51 0.00 0.00 43.02 42.48 3h3v s PHE 67 CO 0.25 0.16 1.04 -1.21 0.70 0.00 0.00 175.22 176.16 3h3v s GLU 68 N -3.75 4.64 0.00 0.44 8.01 -1.26 -4.95 118.70 121.83 3h3v s GLU 68 Ca 0.24 1.64 0.27 0.00 0.01 0.00 0.00 54.97 57.13 3h3v s GLU 68 Cb 0.03 -3.10 0.81 0.00 -4.31 0.00 0.00 34.13 27.55 3h3v s GLU 68 CO 0.07 0.26 1.61 0.00 0.01 0.00 0.00 175.26 177.20 3h3v n ALA 69 N 1.06 2.58 1.02 5.21 0.00 -1.26 -5.34 120.51 123.78 3h3v n ALA 69 Ca -0.00 -0.51 0.12 0.00 0.00 0.00 0.00 53.44 53.05 3h3v n ALA 69 Cb 0.46 -1.07 0.12 0.00 0.00 0.00 0.00 19.45 18.96 3h3v n ALA 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04