#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oco n PRO 7 N 0.00 1.21 -2.04 0.00 -0.02 -1.26 -4.96 135.00 127.93 1oco n PRO 7 Ca 0.00 0.44 -0.28 0.00 -2.02 0.00 0.00 63.50 61.63 1oco n PRO 7 Cb 0.00 -2.09 0.14 0.00 -0.02 0.00 0.00 33.50 31.53 1oco n PRO 7 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1oco s ASP 8 N 0.85 3.78 0.23 2.55 1.47 -1.26 -4.87 116.67 119.43 1oco s ASP 8 Ca 0.86 0.33 -0.09 0.00 1.18 0.00 0.00 52.55 54.83 1oco s ASP 8 Cb -0.95 -0.59 0.38 0.00 -0.34 0.00 0.00 42.92 41.42 1oco s ASP 8 CO 0.48 -2.31 1.65 0.15 0.68 0.00 0.00 175.17 175.83 1oco h PHE 9 N -1.25 -0.04 0.00 2.11 3.04 -2.00 0.32 116.94 119.12 1oco h PHE 9 Ca -0.44 0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.56 1oco h PHE 9 Cb 1.27 0.13 0.00 0.00 2.56 0.00 0.00 35.95 39.91 1oco h PHE 9 CO -0.53 -0.21 0.00 0.72 -2.02 0.00 0.00 178.31 176.28 1oco n HIS 10 N -5.32 0.40 0.12 0.41 -0.00 -1.26 -1.06 115.22 108.50 1oco n HIS 10 Ca 0.12 0.15 -0.20 0.00 -0.00 0.00 0.00 57.72 57.78 1oco n HIS 10 Cb 0.42 -0.74 -0.14 0.00 -0.00 0.00 0.00 29.99 29.54 1oco n HIS 10 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1oco h ASP 11 N 0.00 0.67 0.09 0.41 3.32 -0.70 -2.66 116.42 117.55 1oco h ASP 11 Ca 0.00 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.37 1oco h ASP 11 Cb 0.36 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1oco h ASP 11 CO 0.00 1.52 -1.66 2.29 -1.72 0.00 0.00 179.24 179.67 1oco n LYS 12 N -3.66 0.49 -0.00 3.56 2.85 -1.10 -4.63 118.16 115.67 1oco n LYS 12 Ca -0.12 -0.12 0.00 0.00 -1.05 0.00 0.00 58.31 57.02 1oco n LYS 12 Cb 1.03 -1.54 -0.01 0.00 -0.65 0.00 0.00 35.03 33.86 1oco n LYS 12 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1oco n TYR 13 N -2.11 0.00 -0.17 5.58 4.01 -0.23 -4.80 117.16 119.44 1oco n TYR 13 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.62 1oco n TYR 13 Cb 0.51 -0.02 -0.08 0.00 -0.31 0.00 0.00 39.34 39.44 1oco n TYR 13 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1oco h GLY 14 N 0.19 -1.20 1.17 2.72 0.00 -1.60 -0.23 103.07 104.11 1oco h GLY 14 Ca 0.00 0.78 0.07 0.00 0.00 0.00 0.00 47.33 48.18 1oco h GLY 14 CO 0.00 -0.22 0.39 3.43 0.00 0.00 0.00 176.54 180.14 1oco h ASN 15 N -0.23 0.46 0.67 0.19 4.21 -1.88 0.11 115.58 119.10 1oco h ASN 15 Ca 0.08 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.56 1oco h ASN 15 Cb 0.44 -0.09 0.01 0.00 -1.12 0.00 0.00 38.32 37.55 1oco h ASN 15 CO -0.56 0.29 -0.32 0.00 -1.29 0.00 0.00 177.43 175.56 1oco h ALA 16 N 1.69 -0.94 -0.41 -0.83 0.00 -1.59 -1.74 119.26 115.44 1oco h ALA 16 Ca 0.26 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1oco h ALA 16 Cb 0.34 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1oco h ALA 16 CO -0.07 -0.88 -0.28 0.28 0.00 0.00 0.00 179.25 178.30 1oco h VAL 17 N -1.17 0.28 -0.05 0.00 2.07 -0.66 0.22 116.25 116.94 1oco h VAL 17 Ca -0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1oco h VAL 17 Cb 0.69 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 1oco h VAL 17 CO 0.15 0.00 -0.20 0.25 0.02 0.00 0.00 177.57 177.79 1oco h LEU 18 N -0.21 -0.61 0.43 2.57 5.85 -0.84 0.38 115.31 122.89 1oco h LEU 18 Ca 0.19 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.98 1oco h LEU 18 Cb 0.51 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.81 1oco h LEU 18 CO -0.53 -0.26 -0.21 0.00 -0.34 0.00 0.00 178.44 177.10 1oco h ALA 19 N 0.63 -0.94 -0.90 1.25 0.00 -0.30 0.62 119.26 119.62 1oco h ALA 19 Ca 0.07 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.97 1oco h ALA 19 Cb 0.40 0.22 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 1oco h ALA 19 CO -0.22 -0.90 0.53 0.66 0.00 0.00 0.00 179.25 179.32 1oco h SER 20 N -0.69 0.75 0.11 0.00 4.64 -0.63 0.10 113.55 117.83 1oco h SER 20 Ca -0.06 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1oco h SER 20 Cb 0.44 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1oco h SER 20 CO 0.10 0.40 -0.05 1.23 -0.87 0.00 0.00 176.83 177.63 1oco h GLY 21 N 0.84 -0.15 1.26 -0.77 0.00 -0.19 -0.89 103.07 103.18 1oco h GLY 21 Ca 0.45 0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.85 1oco h GLY 21 CO -0.27 -0.05 0.48 0.00 0.00 0.00 0.00 176.54 176.69 1oco h ALA 22 N 0.63 1.51 -0.14 3.60 0.00 -0.35 -2.12 119.26 122.39 1oco h ALA 22 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1oco h ALA 22 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1oco h ALA 22 CO 0.02 0.45 0.01 1.15 0.00 0.00 0.00 179.25 180.89 1oco h THR 23 N 0.96 1.24 -0.18 0.00 2.02 -0.64 -2.31 112.91 113.99 1oco h THR 23 Ca 0.27 -0.76 -0.05 0.00 0.77 0.00 0.00 66.41 66.64 1oco h THR 23 Cb -0.08 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1oco h THR 23 CO -0.06 0.22 -0.12 0.15 0.37 0.00 0.00 175.52 176.08 1oco h PHE 24 N -0.01 0.30 0.55 3.16 3.57 -0.95 -2.73 116.94 120.83 1oco h PHE 24 Ca 0.04 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1oco h PHE 24 Cb 0.33 -0.09 0.01 0.00 2.79 0.00 0.00 35.95 38.99 1oco h PHE 24 CO 0.03 0.41 -0.26 0.00 -2.23 0.00 0.00 178.31 176.25 1oco h VAL 26 N -0.94 0.42 0.00 0.00 3.04 -1.40 -1.90 116.25 115.48 1oco h VAL 26 Ca -0.07 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.62 1oco h VAL 26 Cb 0.56 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.52 1oco h VAL 26 CO 0.12 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.68 1oco n ALA 27 N -2.38 -0.04 -0.53 3.17 0.00 -1.04 -2.23 120.51 117.47 1oco n ALA 27 Ca 0.07 0.00 0.44 0.00 0.00 0.00 0.00 53.44 53.95 1oco n ALA 27 Cb 0.59 0.00 0.76 0.00 0.00 0.00 0.00 19.45 20.80 1oco n ALA 27 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1oco h VAL 28 N 0.00 0.18 0.10 0.00 2.07 -1.31 0.20 116.25 117.49 1oco h VAL 28 Ca 0.00 -0.01 -0.15 0.00 0.82 0.00 0.00 66.70 67.37 1oco h VAL 28 Cb 0.00 0.15 0.02 0.00 -1.52 0.00 0.00 31.29 29.93 1oco h VAL 28 CO 0.00 0.01 -0.63 -0.50 0.02 0.00 0.00 177.57 176.47 1oco h TRP 29 N 0.03 0.45 -0.33 1.57 4.06 -1.46 -2.50 115.95 117.77 1oco h TRP 29 Ca 0.79 -0.31 0.01 0.00 2.06 0.00 0.00 58.89 61.43 1oco h TRP 29 Cb 3.01 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 31.13 1oco h TRP 29 CO -0.00 1.22 0.22 0.28 -3.56 0.00 0.00 178.44 176.60 1oco h VAL 30 N -0.45 1.07 0.04 1.49 2.07 -0.21 -0.27 116.25 119.98 1oco h VAL 30 Ca -0.11 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 1oco h VAL 30 Cb 1.47 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1oco h VAL 30 CO 0.12 0.08 -0.02 0.22 0.02 0.00 0.00 177.57 177.99 1oco h TYR 31 N 0.43 -0.05 -0.77 1.57 5.03 -1.21 -2.83 116.97 119.15 1oco h TYR 31 Ca 0.13 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.52 1oco h TYR 31 Cb -0.01 0.01 -0.07 0.00 1.55 0.00 0.00 36.73 38.22 1oco h TYR 31 CO -0.00 0.49 0.43 1.98 -1.32 0.00 0.00 178.16 179.74 1oco h MET 32 N -0.61 0.71 0.00 1.82 4.05 -0.94 0.77 114.93 120.74 1oco h MET 32 Ca -0.00 -0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.32 1oco h MET 32 Cb 0.56 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.19 1oco h MET 32 CO 0.01 0.47 -0.26 0.00 0.23 0.00 0.00 176.91 177.36 1oco h ALA 33 N 1.42 1.39 0.00 0.39 0.00 -1.11 -3.37 119.26 117.98 1oco h ALA 33 Ca 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1oco h ALA 33 Cb 0.31 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1oco h ALA 33 CO -0.23 0.33 -1.03 0.25 0.00 0.00 0.00 179.25 178.57 1oco n THR 34 N -3.97 0.03 1.03 0.00 -2.24 -0.81 -4.81 114.28 103.52 1oco n THR 34 Ca -0.02 -0.01 0.10 0.00 -2.27 0.00 0.00 64.05 61.85 1oco n THR 34 Cb 0.33 -0.77 0.54 0.00 -2.10 0.00 0.00 70.33 68.34 1oco n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oco n GLN 35 N -2.64 0.35 -4.78 -0.78 1.13 0.26 -4.85 117.38 106.07 1oco n GLN 35 Ca -0.01 0.08 -0.34 0.00 -1.94 0.00 0.00 57.00 54.79 1oco n GLN 35 Cb 0.51 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 29.29 1oco n GLN 35 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1oco s ILE 36 N -2.48 1.01 -2.00 5.09 -4.36 -1.25 -5.02 121.20 112.19 1oco s ILE 36 Ca 0.22 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.63 1oco s ILE 36 Cb 0.14 -2.00 0.06 0.00 1.25 0.00 0.00 42.46 41.91 1oco s ILE 36 CO 0.30 0.00 0.48 0.61 0.24 0.00 0.00 174.94 176.57 1oco n GLY 37 N -1.32 -0.32 3.65 6.27 0.00 -1.26 -4.87 105.19 107.34 1oco n GLY 37 Ca -0.22 -0.01 -0.48 0.00 0.00 0.00 0.00 46.02 45.31 1oco n GLY 37 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1oco n ILE 38 N -0.61 0.04 -3.63 -0.61 5.41 -1.26 -4.94 119.36 113.76 1oco n ILE 38 Ca 0.02 -0.01 -0.39 0.00 1.00 0.00 0.00 62.75 63.37 1oco n ILE 38 Cb 0.01 -1.34 -0.09 0.00 -0.71 0.00 0.00 39.64 37.51 1oco n ILE 38 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1oco s GLU 39 N 1.02 2.38 0.08 0.38 -6.30 -1.26 -4.92 118.70 110.08 1oco s GLU 39 Ca 0.82 -1.88 0.28 0.00 -2.50 0.00 0.00 54.97 51.68 1oco s GLU 39 Cb -0.77 -3.83 1.07 0.00 0.00 0.00 0.00 34.13 30.61 1oco s GLU 39 CO 0.42 -1.16 1.87 0.91 0.02 0.00 0.00 175.26 177.32 1oco n TRP 40 N 4.65 0.36 -3.85 5.30 7.02 -1.26 -4.94 117.44 124.71 1oco n TRP 40 Ca -0.04 0.10 -0.38 0.00 -1.02 0.00 0.00 57.50 56.17 1oco n TRP 40 Cb 0.41 -0.67 0.03 0.00 -2.42 0.00 0.00 31.31 28.66 1oco n TRP 40 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1oco n ASN 41 N -1.79 -4.76 -4.22 -0.99 5.15 -1.26 -4.93 115.26 102.46 1oco n ASN 41 Ca 0.06 -1.14 -0.29 0.00 -0.60 0.00 0.00 54.58 52.62 1oco n ASN 41 Cb 0.37 -2.67 0.24 0.00 -0.53 0.00 0.00 39.78 37.19 1oco n ASN 41 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1oco s PRO 42 N -6.59 -1.03 0.23 1.20 0.04 -1.26 -4.94 135.00 122.64 1oco s PRO 42 Ca 0.48 0.41 -0.30 0.00 0.04 0.00 0.00 61.00 61.63 1oco s PRO 42 Cb -0.21 -1.58 -0.09 0.00 0.04 0.00 0.00 34.50 32.67 1oco s PRO 42 CO 0.91 -3.69 1.11 0.45 0.04 0.00 0.00 177.00 175.82 1oco s SER 43 N -3.18 7.25 0.33 6.66 0.15 -1.26 -4.95 113.70 118.70 1oco s SER 43 Ca 0.68 2.19 0.09 0.00 0.70 0.00 0.00 55.95 59.61 1oco s SER 43 Cb -0.18 -2.62 0.57 0.00 -1.71 0.00 0.00 66.02 62.08 1oco s SER 43 CO 0.60 -0.19 1.76 1.55 1.20 0.00 0.00 173.24 178.16 1oco h PRO 44 N 4.47 0.16 -6.24 5.44 0.13 -1.96 -3.42 132.00 130.57 1oco h PRO 44 Ca -0.46 -0.07 -0.66 0.00 -0.87 0.00 0.00 66.00 63.95 1oco h PRO 44 Cb 1.21 -0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.36 1oco h PRO 44 CO 0.70 0.51 0.98 1.55 -0.23 0.00 0.00 178.00 181.52 1oco n VAL 45 N -4.07 0.42 0.00 1.56 3.14 -1.26 -0.15 118.33 117.97 1oco n VAL 45 Ca -0.01 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 1oco n VAL 45 Cb 0.44 -1.58 0.00 0.00 -1.06 0.00 0.00 33.84 31.63 1oco n VAL 45 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1oco n GLY 46 N 4.19 2.97 0.02 7.55 0.00 -1.26 -4.75 105.19 113.91 1oco n GLY 46 Ca 0.23 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.27 1oco n GLY 46 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1oco n ARG 47 N -0.83 1.07 -4.36 1.61 1.85 0.70 -5.01 116.66 111.69 1oco n ARG 47 Ca 0.00 -0.06 -0.34 0.00 -1.00 0.00 0.00 57.85 56.45 1oco n ARG 47 Cb 0.00 -1.25 -0.11 0.00 -1.05 0.00 0.00 32.46 30.06 1oco n ARG 47 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1oco s VAL 48 N -2.55 4.14 -0.47 8.89 1.01 0.79 -5.07 120.40 127.14 1oco s VAL 48 Ca -0.04 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 1oco s VAL 48 Cb 0.05 -2.79 0.05 0.00 0.00 0.00 0.00 36.38 33.69 1oco s VAL 48 CO 0.42 0.54 0.53 -0.89 0.00 0.00 0.00 175.10 175.70 1oco s THR 49 N -0.17 4.99 0.32 3.92 2.01 -1.26 -4.85 115.64 120.60 1oco s THR 49 Ca 0.04 -0.48 -0.29 0.00 0.31 0.00 0.00 61.69 61.27 1oco s THR 49 Cb -0.13 -4.19 -0.11 0.00 0.01 0.00 0.00 72.50 68.09 1oco s THR 49 CO 0.02 -0.64 1.51 -2.16 -0.69 0.00 0.00 174.62 172.66 1oco s PRO 50 N 2.34 4.16 0.17 4.92 0.04 -1.26 -5.02 135.00 140.35 1oco s PRO 50 Ca 0.13 2.51 0.06 0.00 0.04 0.00 0.00 61.00 63.74 1oco s PRO 50 Cb -0.19 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 1oco s PRO 50 CO 0.12 -0.53 0.06 0.15 0.04 0.00 0.00 177.00 176.85 1oco s LYS 51 N -1.21 2.64 0.22 4.56 1.02 -1.26 -5.10 119.74 120.62 1oco s LYS 51 Ca 0.57 -0.99 -0.30 0.00 0.02 0.00 0.00 55.97 55.27 1oco s LYS 51 Cb -0.46 -2.50 -0.10 0.00 -0.52 0.00 0.00 37.83 34.26 1oco s LYS 51 CO 0.54 0.47 1.45 -2.00 -0.92 0.00 0.00 175.35 174.88 1oco s GLU 52 N -3.00 4.27 0.00 1.68 2.56 -1.26 -4.91 118.70 118.04 1oco s GLU 52 Ca 0.29 2.28 0.17 0.00 0.00 0.00 0.00 54.97 57.71 1oco s GLU 52 Cb -0.10 -3.13 -0.10 0.00 2.00 0.00 0.00 34.13 32.80 1oco s GLU 52 CO 0.21 -0.44 0.79 -2.67 -0.56 0.00 0.00 175.26 172.59 1oco n TRP 53 N 2.70 0.00 -0.29 5.30 4.27 -1.26 -5.34 117.44 122.82 1oco n TRP 53 Ca 0.08 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.69 1oco n TRP 53 Cb 0.40 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.35 1oco n TRP 53 CO 0.00 0.00 0.00 -2.13 -2.29 0.00 0.00 177.69 173.27