#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mox h HIS 4 N 0.00 0.00 -3.00 1.43 -0.00 -2.00 -3.45 115.15 108.13 1mox h HIS 4 Ca 0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 60.37 59.74 1mox h HIS 4 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 27.41 27.26 1mox h HIS 4 CO 0.00 0.00 -0.74 -0.06 -0.00 0.00 0.00 177.93 177.13 1mox s PHE 5 N -3.22 2.56 0.00 2.45 0.40 -1.26 0.30 117.98 119.21 1mox s PHE 5 Ca 0.08 -0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.16 1mox s PHE 5 Cb 0.09 -1.25 0.00 0.00 0.51 0.00 0.00 43.02 42.37 1mox s PHE 5 CO 0.58 0.52 0.00 -1.71 0.70 0.00 0.00 175.22 175.31 1mox n ASN 6 N 0.05 0.00 -3.71 1.36 2.85 0.31 -4.72 115.26 111.41 1mox n ASN 6 Ca -0.11 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.22 1mox n ASN 6 Cb 0.56 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.49 1mox n ASN 6 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 1mox s ASP 7 N 1.00 -0.42 0.33 1.20 1.01 -1.26 -4.38 116.67 114.15 1mox s ASP 7 Ca 0.00 0.67 -0.26 0.00 0.71 0.00 0.00 52.55 53.67 1mox s ASP 7 Cb 0.00 0.72 -0.10 0.00 1.01 0.00 0.00 42.92 44.55 1mox s ASP 7 CO 0.00 -0.29 0.96 0.00 0.21 0.00 0.00 175.17 176.06 1mox n PRO 9 N 0.53 2.53 -1.48 0.00 -0.02 -1.26 -4.63 135.00 130.66 1mox n PRO 9 Ca 0.02 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.35 1mox n PRO 9 Cb 0.50 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.85 1mox n PRO 9 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1mox n ASP 10 N 0.00 0.20 -0.98 2.55 -0.08 -1.26 -4.74 116.55 112.25 1mox n ASP 10 Ca 0.00 -1.29 0.00 0.00 -1.51 0.00 0.00 54.79 51.99 1mox n ASP 10 Cb 0.00 -1.17 0.00 0.00 2.34 0.00 0.00 41.12 42.29 1mox n ASP 10 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1mox n SER 11 N 12.86 0.99 -4.74 1.67 7.64 -1.26 -4.83 113.62 125.94 1mox n SER 11 Ca 0.48 -0.68 -0.41 0.00 1.01 0.00 0.00 58.87 59.27 1mox n SER 11 Cb 0.34 -0.17 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1mox n SER 11 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 1mox s HIS 12 N 0.58 3.03 0.00 1.43 -3.43 -1.26 -4.25 115.29 111.39 1mox s HIS 12 Ca 0.00 1.00 0.00 0.00 -0.80 0.00 0.00 55.06 55.26 1mox s HIS 12 Cb 0.00 -3.82 0.00 0.00 -1.43 0.00 0.00 32.58 27.33 1mox s HIS 12 CO 0.00 -2.71 0.00 0.25 -2.00 0.00 0.00 174.74 170.28 1mox n THR 13 N 2.50 0.00 0.00 -5.38 -2.24 -1.26 -4.61 114.28 103.29 1mox n THR 13 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1mox n THR 13 Cb 0.40 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1mox n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mox n GLN 14 N 0.00 0.00 -0.00 -0.78 10.64 -1.26 -5.05 117.38 120.93 1mox n GLN 14 Ca 0.00 0.00 -0.12 0.00 -1.83 0.00 0.00 57.00 55.05 1mox n GLN 14 Cb 0.00 0.00 -0.10 0.00 -0.86 0.00 0.00 30.24 29.28 1mox n GLN 14 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.06 175.58 1mox h PHE 15 N 0.00 -0.08 -3.46 2.61 3.57 -1.92 -3.43 116.94 114.22 1mox h PHE 15 Ca 0.00 -0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.96 1mox h PHE 15 Cb 0.00 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1mox h PHE 15 CO 0.00 0.50 0.22 0.00 -2.23 0.00 0.00 178.31 176.80 1mox h PHE 17 N 5.72 0.00 -1.66 0.00 0.04 -1.10 -3.41 116.94 116.54 1mox h PHE 17 Ca -0.43 0.00 -0.44 0.00 2.80 0.00 0.00 57.97 59.89 1mox h PHE 17 Cb 1.21 0.00 -0.36 0.00 2.20 0.00 0.00 35.95 39.00 1mox h PHE 17 CO 0.65 0.87 -1.07 0.72 -0.60 0.00 0.00 178.31 178.88 1mox n HIS 18 N -3.09 -0.37 0.00 -0.55 8.25 -1.15 -4.99 115.22 113.32 1mox n HIS 18 Ca -0.10 -3.51 0.00 0.00 -0.26 0.00 0.00 57.72 53.84 1mox n HIS 18 Cb 0.96 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 32.00 1mox n HIS 18 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mox n GLY 19 N 0.37 -0.97 3.89 -1.41 0.00 -1.26 0.16 105.19 105.98 1mox n GLY 19 Ca 0.22 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 1mox n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mox s THR 20 N -2.00 5.31 0.17 2.61 -4.23 0.16 -4.72 115.64 112.94 1mox s THR 20 Ca 0.00 0.13 -0.21 0.00 -1.18 0.00 0.00 61.69 60.43 1mox s THR 20 Cb 0.00 -3.56 -0.08 0.00 1.34 0.00 0.00 72.50 70.20 1mox s THR 20 CO 0.00 0.35 0.69 0.00 -0.54 0.00 0.00 174.62 175.13 1mox s ARG 22 N -1.59 0.36 -0.16 0.00 1.70 -0.93 -4.49 118.95 113.84 1mox s ARG 22 Ca 0.38 -0.05 -0.12 0.00 -0.47 0.00 0.00 55.73 55.47 1mox s ARG 22 Cb -0.19 0.16 -0.05 0.00 -0.57 0.00 0.00 34.95 34.30 1mox s ARG 22 CO 0.22 -0.07 0.23 0.12 -1.08 0.00 0.00 175.30 174.71 1mox s PHE 23 N -0.61 3.48 -0.88 5.89 5.36 -1.26 -1.34 117.98 128.62 1mox s PHE 23 Ca -0.07 0.53 -0.21 0.00 -0.96 0.00 0.00 56.93 56.22 1mox s PHE 23 Cb -0.04 -2.22 0.09 0.00 -0.34 0.00 0.00 43.02 40.51 1mox s PHE 23 CO 0.01 0.36 1.17 -0.51 -1.46 0.00 0.00 175.22 174.79 1mox s LEU 24 N 0.10 4.46 0.18 6.12 1.43 0.11 0.12 118.68 131.20 1mox s LEU 24 Ca 0.14 -1.60 -0.16 0.00 -1.03 0.00 0.00 54.13 51.49 1mox s LEU 24 Cb -0.12 -2.45 0.17 0.00 0.03 0.00 0.00 46.19 43.81 1mox s LEU 24 CO 0.03 -1.29 1.28 0.52 0.23 0.00 0.00 176.35 177.12 1mox n VAL 25 N 5.95 -0.45 0.00 -1.59 0.31 0.15 0.15 118.33 122.84 1mox n VAL 25 Ca 0.19 1.94 0.00 0.00 -0.01 0.00 0.00 64.34 66.46 1mox n VAL 25 Cb 0.49 -2.54 0.00 0.00 -0.91 0.00 0.00 33.84 30.87 1mox n VAL 25 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1mox n GLN 26 N -5.19 0.00 0.00 5.55 -0.06 -1.22 -3.18 117.38 113.27 1mox n GLN 26 Ca 0.08 0.03 0.00 0.00 -2.00 0.00 0.00 57.00 55.10 1mox n GLN 26 Cb 0.32 -0.70 0.00 0.00 -4.06 0.00 0.00 30.24 25.80 1mox n GLN 26 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 1mox n GLU 27 N -0.22 0.00 -3.24 3.69 -0.58 -1.16 -4.84 120.64 114.29 1mox n GLU 27 Ca 0.00 0.14 -0.26 0.00 -0.42 0.00 0.00 57.16 56.62 1mox n GLU 27 Cb 0.00 -1.56 0.03 0.00 -0.57 0.00 0.00 31.44 29.34 1mox n GLU 27 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1mox n ASP 28 N -1.06 -6.52 0.00 1.62 2.03 0.12 -5.01 116.55 107.73 1mox n ASP 28 Ca 0.00 0.12 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1mox n ASP 28 Cb 0.06 -3.22 0.00 0.00 -0.72 0.00 0.00 41.12 37.24 1mox n ASP 28 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1mox n LYS 29 N -0.28 0.00 -2.63 -0.67 2.85 -1.22 -4.99 118.16 111.22 1mox n LYS 29 Ca -0.00 0.00 -0.39 0.00 -1.05 0.00 0.00 58.31 56.87 1mox n LYS 29 Cb 0.59 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.92 1mox n LYS 29 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 1mox s PRO 30 N -2.00 4.63 0.18 -1.58 0.02 -1.26 -0.71 135.00 134.27 1mox s PRO 30 Ca 0.00 1.57 0.00 0.00 0.02 0.00 0.00 61.00 62.59 1mox s PRO 30 Cb 0.00 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.43 1mox s PRO 30 CO 0.00 0.27 0.06 0.00 -0.33 0.00 0.00 177.00 177.00 1mox s ALA 31 N -1.33 1.21 0.38 -1.55 0.00 -0.45 -4.91 121.76 115.11 1mox s ALA 31 Ca 0.46 -1.61 0.08 0.00 0.00 0.00 0.00 51.96 50.89 1mox s ALA 31 Cb -0.26 0.88 -0.07 0.00 0.00 0.00 0.00 23.12 23.66 1mox s ALA 31 CO 0.33 -0.44 -0.03 0.00 0.00 0.00 0.00 175.76 175.61 1mox s VAL 33 N -2.70 0.28 0.43 0.00 1.01 -0.90 -4.97 120.40 113.55 1mox s VAL 33 Ca 0.34 -0.43 -0.16 0.00 0.00 0.00 0.00 61.98 61.73 1mox s VAL 33 Cb 0.07 -0.86 -0.08 0.00 0.00 0.00 0.00 36.38 35.50 1mox s VAL 33 CO 0.17 -0.26 0.87 0.00 0.00 0.00 0.00 175.10 175.89 1mox s HIS 35 N -2.33 2.93 0.33 0.00 3.76 0.43 -4.86 115.29 115.55 1mox s HIS 35 Ca 0.57 1.57 -0.27 0.00 -0.15 0.00 0.00 55.06 56.78 1mox s HIS 35 Cb -0.10 -3.12 -0.13 0.00 1.11 0.00 0.00 32.58 30.34 1mox s HIS 35 CO 0.24 -0.99 0.96 -1.13 -0.85 0.00 0.00 174.74 172.97 1mox n SER 36 N -0.99 1.05 0.00 1.40 3.41 -1.26 -2.93 113.62 114.30 1mox n SER 36 Ca 0.10 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.83 1mox n SER 36 Cb 0.52 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.19 1mox n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mox n GLY 37 N 1.27 0.83 3.08 5.00 0.00 -1.26 -5.07 105.19 109.04 1mox n GLY 37 Ca 0.10 -0.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 1mox n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mox s TYR 38 N -2.00 0.52 0.25 1.61 1.51 -1.15 -1.73 117.35 116.35 1mox s TYR 38 Ca 0.00 -0.93 -0.05 0.00 -1.01 0.00 0.00 57.07 55.07 1mox s TYR 38 Cb 0.00 -0.37 -0.02 0.00 -0.11 0.00 0.00 41.96 41.46 1mox s TYR 38 CO 0.00 -0.31 0.32 0.14 -1.11 0.00 0.00 175.55 174.59 1mox s VAL 39 N -3.35 0.00 0.00 0.71 -7.23 0.82 -4.80 120.40 106.55 1mox s VAL 39 Ca 0.03 -1.72 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 1mox s VAL 39 Cb 0.04 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.57 1mox s VAL 39 CO -0.07 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1mox n GLY 40 N -0.38 2.96 0.39 2.32 0.00 -1.26 -1.97 105.19 107.26 1mox n GLY 40 Ca 0.01 -1.74 0.21 0.00 0.00 0.00 0.00 46.02 44.49 1mox n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mox h ALA 41 N 0.00 2.14 0.00 4.61 0.00 -2.01 0.16 119.26 124.16 1mox h ALA 41 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1mox h ALA 41 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1mox h ALA 41 CO 0.00 -0.72 -0.07 0.54 0.00 0.00 0.00 179.25 179.00 1mox n ARG 42 N -3.63 1.42 -3.69 0.00 1.74 -1.26 -4.43 116.66 106.82 1mox n ARG 42 Ca 0.08 -2.04 -0.28 0.00 -0.77 0.00 0.00 57.85 54.84 1mox n ARG 42 Cb 0.68 -1.22 0.01 0.00 -1.02 0.00 0.00 32.46 30.91 1mox n ARG 42 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mox h GLU 44 N -1.61 0.00 -5.68 0.00 9.09 -1.72 -3.04 114.58 111.61 1mox h GLU 44 Ca -0.53 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.22 1mox h GLU 44 Cb 1.35 0.00 -0.16 0.00 -1.65 0.00 0.00 28.75 28.29 1mox h GLU 44 CO 0.63 0.37 -0.62 -1.01 0.05 0.00 0.00 179.01 178.44 1mox s HIS 45 N -3.01 3.16 0.26 2.06 3.76 -0.83 -4.98 115.29 115.71 1mox s HIS 45 Ca 0.03 0.08 -0.30 0.00 -0.15 0.00 0.00 55.06 54.72 1mox s HIS 45 Cb 0.08 -1.89 -0.09 0.00 1.11 0.00 0.00 32.58 31.79 1mox s HIS 45 CO 0.75 0.31 1.16 0.00 -0.85 0.00 0.00 174.74 176.11 1mox s ALA 46 N -0.38 3.43 -1.29 -1.40 0.00 -1.26 -0.13 121.76 120.73 1mox s ALA 46 Ca 0.08 0.96 -0.17 0.00 0.00 0.00 0.00 51.96 52.83 1mox s ALA 46 Cb -0.12 -3.37 0.09 0.00 0.00 0.00 0.00 23.12 19.71 1mox s ALA 46 CO 0.02 -0.29 1.70 -0.40 0.00 0.00 0.00 175.76 176.79 1mox n ASP 47 N 1.57 4.95 -0.53 0.00 3.85 -0.71 -4.81 116.55 120.87 1mox n ASP 47 Ca 0.01 -2.93 0.42 0.00 -0.71 0.00 0.00 54.79 51.57 1mox n ASP 47 Cb 0.44 -1.71 0.66 0.00 -1.35 0.00 0.00 41.12 39.17 1mox n ASP 47 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1mox n LEU 48 N 7.66 0.08 -4.05 -2.12 4.77 -1.26 -3.54 117.00 118.55 1mox n LEU 48 Ca 0.47 1.03 -0.33 0.00 -0.03 0.00 0.00 56.01 57.14 1mox n LEU 48 Cb 0.45 -0.51 -0.09 0.00 -2.33 0.00 0.00 43.42 40.94 1mox n LEU 48 CO 0.75 -1.07 1.54 0.18 -1.33 0.00 0.00 177.39 177.45 1mox n LEU 49 N -4.03 2.31 0.00 2.23 4.77 -1.26 -5.26 117.00 115.76 1mox n LEU 49 Ca 0.37 -2.47 0.00 0.00 -0.03 0.00 0.00 56.01 53.88 1mox n LEU 49 Cb 1.59 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1mox n LEU 49 CO 0.29 -1.98 0.00 0.00 -1.33 0.00 0.00 177.39 174.37