#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abm s THR 2 N 0.00 3.68 0.10 9.51 -4.23 -1.26 -5.13 115.64 118.30 3abm s THR 2 Ca 0.00 -1.70 -0.10 0.00 -1.18 0.00 0.00 61.69 58.71 3abm s THR 2 Cb 0.00 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.91 3abm s THR 2 CO 0.00 -0.30 0.22 0.00 -0.54 0.00 0.00 174.62 174.00 3abm s ALA 3 N -2.13 -0.33 0.67 3.99 0.00 -1.26 -5.15 121.76 117.55 3abm s ALA 3 Ca 0.30 -0.53 -0.12 0.00 0.00 0.00 0.00 51.96 51.61 3abm s ALA 3 Cb -0.07 0.52 -0.00 0.00 0.00 0.00 0.00 23.12 23.57 3abm s ALA 3 CO 0.20 -0.53 1.07 0.15 0.00 0.00 0.00 175.76 176.65 3abm s LYS 4 N -3.85 2.96 0.76 0.00 1.02 -1.26 -5.00 119.74 114.37 3abm s LYS 4 Ca 0.05 1.08 -0.13 0.00 0.02 0.00 0.00 55.97 56.99 3abm s LYS 4 Cb 0.04 -1.99 0.05 0.00 -0.52 0.00 0.00 37.83 35.42 3abm s LYS 4 CO -0.11 -1.09 1.13 -2.14 -0.92 0.00 0.00 175.35 172.22 3abm s PRO 5 N -4.67 2.14 0.04 -1.68 0.02 -1.26 -4.87 135.00 124.73 3abm s PRO 5 Ca 0.61 1.44 -0.36 0.00 0.02 0.00 0.00 61.00 62.70 3abm s PRO 5 Cb -0.15 -1.87 -0.15 0.00 0.02 0.00 0.00 34.50 32.35 3abm s PRO 5 CO 0.49 -1.77 1.50 0.00 -0.33 0.00 0.00 177.00 176.89 3abm n ALA 6 N -3.17 -0.07 0.03 -1.55 0.00 -1.26 -4.88 120.51 109.60 3abm n ALA 6 Ca 0.11 0.46 -0.06 0.00 0.00 0.00 0.00 53.44 53.95 3abm n ALA 6 Cb 0.52 -2.21 0.12 0.00 0.00 0.00 0.00 19.45 17.88 3abm n ALA 6 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3abm h LYS 7 N 5.66 0.46 -2.23 0.00 1.57 -2.05 -3.36 116.57 116.63 3abm h LYS 7 Ca -0.47 -0.25 -0.58 0.00 -1.87 0.00 0.00 60.65 57.48 3abm h LYS 7 Cb 1.31 0.01 -0.39 0.00 0.08 0.00 0.00 32.23 33.24 3abm h LYS 7 CO 0.85 0.83 -0.99 0.25 -0.57 0.00 0.00 179.45 179.81 3abm n THR 8 N -3.99 -0.63 -1.54 -0.16 -2.24 -1.26 -5.12 114.28 99.33 3abm n THR 8 Ca -0.02 -3.86 -0.44 0.00 -2.27 0.00 0.00 64.05 57.45 3abm n THR 8 Cb 0.54 -1.84 -0.01 0.00 -2.10 0.00 0.00 70.33 66.91 3abm n THR 8 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3abm n PRO 9 N 2.04 1.00 -3.76 -0.78 -0.02 -1.26 -4.95 135.00 127.27 3abm n PRO 9 Ca 0.25 0.35 -0.37 0.00 -2.02 0.00 0.00 63.50 61.72 3abm n PRO 9 Cb 0.49 -1.66 -0.12 0.00 -0.02 0.00 0.00 33.50 32.20 3abm n PRO 9 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3abm s THR 10 N -1.13 3.47 1.01 3.45 2.01 -1.26 -5.09 115.64 118.10 3abm s THR 10 Ca 0.60 -1.78 -0.12 0.00 0.31 0.00 0.00 61.69 60.71 3abm s THR 10 Cb -0.72 -3.24 0.20 0.00 0.01 0.00 0.00 72.50 68.75 3abm s THR 10 CO 0.59 -0.54 1.08 -0.94 -0.69 0.00 0.00 174.62 174.11 3abm s SER 11 N 1.81 2.41 0.33 3.53 1.04 -1.26 -4.67 113.70 116.88 3abm s SER 11 Ca 0.04 1.43 0.06 0.00 0.48 0.00 0.00 55.95 57.96 3abm s SER 11 Cb -0.22 -2.11 0.71 0.00 0.10 0.00 0.00 66.02 64.50 3abm s SER 11 CO -0.02 -3.30 1.86 -0.65 0.98 0.00 0.00 173.24 172.11 3abm h PRO 12 N -2.00 0.79 -0.36 4.02 0.11 -1.99 -0.19 132.00 132.38 3abm h PRO 12 Ca -0.54 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.51 3abm h PRO 12 Cb 1.31 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3abm h PRO 12 CO 0.54 0.52 0.18 -0.22 -0.21 0.00 0.00 178.00 178.81 3abm h LYS 13 N 0.82 0.52 -0.55 1.05 3.11 -2.00 -1.48 116.57 118.03 3abm h LYS 13 Ca 0.47 -0.07 0.02 0.00 -2.81 0.00 0.00 60.65 58.25 3abm h LYS 13 Cb 0.62 -0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 31.72 3abm h LYS 13 CO -0.23 0.46 0.36 0.93 -2.81 0.00 0.00 179.45 178.16 3abm h GLU 14 N 0.45 0.66 -0.22 1.90 5.08 -1.74 -2.24 114.58 118.47 3abm h GLU 14 Ca 0.13 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 3abm h GLU 14 Cb 0.10 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3abm h GLU 14 CO -0.02 0.44 -0.49 1.96 -1.00 0.00 0.00 179.01 179.90 3abm h GLN 15 N 0.68 0.60 -0.34 2.33 4.20 -0.14 -1.35 115.11 121.08 3abm h GLN 15 Ca 0.21 -0.35 -0.14 0.00 0.06 0.00 0.00 58.65 58.43 3abm h GLN 15 Cb 0.02 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 3abm h GLN 15 CO -0.05 0.95 -0.37 0.00 -0.67 0.00 0.00 178.83 178.69 3abm h ALA 16 N 0.99 0.71 0.71 3.87 0.00 -1.01 -0.47 119.26 124.06 3abm h ALA 16 Ca 0.02 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3abm h ALA 16 Cb 1.02 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.70 3abm h ALA 16 CO 0.10 0.66 -0.34 0.82 0.00 0.00 0.00 179.25 180.49 3abm h ILE 17 N 0.66 0.30 -0.37 0.00 2.04 -1.25 -0.16 117.51 118.72 3abm h ILE 17 Ca 0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.99 3abm h ILE 17 Cb 0.92 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 3abm h ILE 17 CO 0.08 0.00 -0.02 1.23 0.00 0.00 0.00 178.15 179.45 3abm h GLY 18 N -0.96 0.35 0.57 5.37 0.00 -1.12 -0.67 103.07 106.61 3abm h GLY 18 Ca -0.10 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 3abm h GLY 18 CO 0.16 -0.10 -0.46 -2.00 0.00 0.00 0.00 176.54 174.15 3abm h LEU 19 N 0.08 -1.24 -0.72 3.11 5.85 -1.09 -0.63 115.31 120.67 3abm h LEU 19 Ca 0.18 0.10 0.16 0.00 0.84 0.00 0.00 57.88 59.16 3abm h LEU 19 Cb 0.26 0.41 -0.11 0.00 0.37 0.00 0.00 40.66 41.59 3abm h LEU 19 CO -0.32 -0.62 0.16 0.28 -0.34 0.00 0.00 178.44 177.61 3abm h SER 20 N -0.93 -0.00 -0.03 1.25 0.02 -0.81 0.38 113.55 113.43 3abm h SER 20 Ca -0.05 0.14 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 3abm h SER 20 Cb 0.81 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 3abm h SER 20 CO -0.06 -0.04 -0.34 0.58 -1.14 0.00 0.00 176.83 175.84 3abm h VAL 21 N 0.26 1.29 0.00 2.27 2.07 -1.03 -0.96 116.25 120.15 3abm h VAL 21 Ca 0.40 -1.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 3abm h VAL 21 Cb 0.68 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3abm h VAL 21 CO -0.51 0.46 -0.00 0.74 0.02 0.00 0.00 177.57 178.28 3abm h THR 22 N 0.44 1.38 -0.64 2.57 2.02 0.59 -0.49 112.91 118.78 3abm h THR 22 Ca 0.05 -1.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 3abm h THR 22 Cb 0.80 2.16 -0.03 0.00 -1.74 0.00 0.00 68.15 69.34 3abm h THR 22 CO 0.07 0.30 0.36 -0.26 0.37 0.00 0.00 175.52 176.35 3abm h PHE 23 N -0.49 0.86 0.00 3.16 0.05 -0.20 -1.39 116.94 118.93 3abm h PHE 23 Ca -0.00 -0.01 -0.08 0.00 3.82 0.00 0.00 57.97 61.70 3abm h PHE 23 Cb 0.49 -0.28 -0.01 0.00 2.00 0.00 0.00 35.95 38.15 3abm h PHE 23 CO 0.10 0.59 -0.40 -0.07 -0.18 0.00 0.00 178.31 178.35 3abm h LEU 24 N 0.89 0.00 -1.09 1.54 3.38 -0.85 -1.99 115.31 117.19 3abm h LEU 24 Ca 0.23 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.11 3abm h LEU 24 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3abm h LEU 24 CO -0.04 0.40 -0.43 0.77 0.09 0.00 0.00 178.44 179.23 3abm h SER 25 N 0.00 0.00 0.38 -0.43 4.64 0.07 -0.93 113.55 117.28 3abm h SER 25 Ca -0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 3abm h SER 25 Cb 0.81 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3abm h SER 25 CO 0.05 0.43 -1.58 -0.26 -0.87 0.00 0.00 176.83 174.60 3abm h PHE 26 N 0.00 0.53 0.17 4.77 -1.00 -1.40 -3.40 116.94 116.61 3abm h PHE 26 Ca -0.00 -0.39 -0.31 0.00 2.81 0.00 0.00 57.97 60.08 3abm h PHE 26 Cb 0.82 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 40.37 3abm h PHE 26 CO 0.00 1.45 -1.51 -0.07 -1.61 0.00 0.00 178.31 176.57 3abm h LEU 27 N 0.08 0.56 0.26 1.54 3.38 -1.21 -3.34 115.31 116.58 3abm h LEU 27 Ca -0.27 -0.91 -0.01 0.00 0.09 0.00 0.00 57.88 56.78 3abm h LEU 27 Cb 2.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.61 3abm h LEU 27 CO 0.17 1.69 -0.13 -0.07 0.09 0.00 0.00 178.44 180.19 3abm h LEU 28 N -0.07 -0.30 0.00 1.67 3.38 -1.38 0.41 115.31 119.03 3abm h LEU 28 Ca -0.30 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.62 3abm h LEU 28 Cb 1.95 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 42.74 3abm h LEU 28 CO 0.15 -0.10 -0.22 -0.65 0.09 0.00 0.00 178.44 177.70 3abm h PRO 29 N -0.48 -0.34 -0.81 1.13 0.11 -1.77 -1.02 132.00 128.82 3abm h PRO 29 Ca -0.04 0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.17 3abm h PRO 29 Cb 0.36 0.08 -0.06 0.00 0.11 0.00 0.00 31.00 31.49 3abm h PRO 29 CO 0.06 -0.23 0.48 0.00 -0.21 0.00 0.00 178.00 178.10 3abm h ALA 30 N 0.51 1.12 -1.00 -0.75 0.00 -1.67 -1.85 119.26 115.61 3abm h ALA 30 Ca 0.06 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3abm h ALA 30 Cb 0.43 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 3abm h ALA 30 CO -0.20 0.17 0.65 0.78 0.00 0.00 0.00 179.25 180.65 3abm h GLY 31 N 0.85 1.51 0.66 0.00 0.00 -0.01 -0.06 103.07 106.01 3abm h GLY 31 Ca 0.37 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 3abm h GLY 31 CO -0.20 0.36 -0.26 -0.25 0.00 0.00 0.00 176.54 176.19 3abm h TRP 32 N 1.20 0.40 -0.03 5.60 7.01 -0.81 0.11 115.95 129.43 3abm h TRP 32 Ca 0.42 -0.17 0.04 0.00 2.11 0.00 0.00 58.89 61.29 3abm h TRP 32 Cb 0.12 -0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 27.06 3abm h TRP 32 CO -0.00 0.88 -0.29 0.28 -2.79 0.00 0.00 178.44 176.51 3abm h VAL 33 N -0.18 0.35 -0.77 2.65 2.07 -1.18 -2.52 116.25 116.67 3abm h VAL 33 Ca -0.01 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 3abm h VAL 33 Cb 0.89 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 3abm h VAL 33 CO 0.05 0.00 0.30 -0.07 0.02 0.00 0.00 177.57 177.87 3abm h LEU 34 N -0.42 1.07 -2.07 2.57 4.07 -0.98 -2.07 115.31 117.47 3abm h LEU 34 Ca 0.07 -0.18 0.04 0.00 0.08 0.00 0.00 57.88 57.90 3abm h LEU 34 Cb 0.52 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 3abm h LEU 34 CO -0.27 0.96 0.12 0.22 -1.08 0.00 0.00 178.44 178.38 3abm h TYR 35 N 1.11 0.00 -0.39 1.13 3.20 -0.71 -2.77 116.97 118.55 3abm h TYR 35 Ca 0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.12 3abm h TYR 35 Cb 0.23 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.50 3abm h TYR 35 CO 0.02 0.00 0.00 0.72 -1.64 0.00 0.00 178.16 177.26 3abm n HIS 36 N -4.35 0.50 -0.34 -3.82 8.25 -0.80 -4.60 115.22 110.06 3abm n HIS 36 Ca 0.01 -0.25 0.11 0.00 -0.26 0.00 0.00 57.72 57.32 3abm n HIS 36 Cb 0.24 -0.00 0.30 0.00 1.12 0.00 0.00 29.99 31.65 3abm n HIS 36 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3abm h LEU 37 N 4.50 0.82 -0.62 2.41 3.38 -1.28 -1.24 115.31 123.27 3abm h LEU 37 Ca 0.00 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 3abm h LEU 37 Cb 0.99 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 3abm h LEU 37 CO 0.00 0.38 0.02 -0.78 0.09 0.00 0.00 178.44 178.15 3abm h ASP 38 N 0.84 1.06 0.38 -0.43 3.58 -1.84 -2.55 116.42 117.46 3abm h ASP 38 Ca 0.52 -0.30 -0.06 0.00 0.42 0.00 0.00 57.03 57.62 3abm h ASP 38 Cb 0.70 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 3abm h ASP 38 CO -0.29 1.10 -0.27 0.78 -2.88 0.00 0.00 179.24 177.68 3abm h ASN 39 N 0.99 0.00 -0.05 2.28 2.35 -1.61 -2.80 115.58 116.74 3abm h ASN 39 Ca 0.18 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 3abm h ASN 39 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 3abm h ASN 39 CO 0.03 0.27 -0.10 1.88 -1.65 0.00 0.00 177.43 177.86 3abm h TYR 40 N 0.00 0.20 0.00 1.19 0.99 -1.08 -3.40 116.97 114.86 3abm h TYR 40 Ca -0.00 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.66 3abm h TYR 40 Cb 0.53 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 38.22 3abm h TYR 40 CO 0.00 0.68 0.00 1.63 -0.00 0.00 0.00 178.16 180.47 3abm n LYS 41 N -4.67 0.00 -2.86 4.88 5.02 -0.98 -3.68 118.16 115.86 3abm n LYS 41 Ca -0.08 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 55.89 3abm n LYS 41 Cb 0.35 -0.84 -0.03 0.00 -0.02 0.00 0.00 35.03 34.48 3abm n LYS 41 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3abm s LYS 42 N -0.69 3.39 0.00 1.97 2.47 -1.25 -5.15 119.74 120.49 3abm s LYS 42 Ca 0.00 -1.30 0.00 0.00 -1.56 0.00 0.00 55.97 53.11 3abm s LYS 42 Cb 0.00 -4.67 0.00 0.00 -1.46 0.00 0.00 37.83 31.70 3abm s LYS 42 CO 0.00 -1.84 0.00 0.43 0.16 0.00 0.00 175.35 174.10