#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3e s SER 2 N 0.00 6.39 0.10 1.61 0.15 -1.26 -4.99 113.70 115.70 1l3e s SER 2 Ca 0.00 -0.14 -0.31 0.00 0.70 0.00 0.00 55.95 56.20 1l3e s SER 2 Cb 0.00 -2.49 -0.09 0.00 -1.71 0.00 0.00 66.02 61.73 1l3e s SER 2 CO 0.00 -1.35 1.73 -0.32 1.20 0.00 0.00 173.24 174.49 1l3e s MET 3 N 4.44 4.17 0.99 5.44 -2.45 -1.26 -4.95 119.30 125.68 1l3e s MET 3 Ca 0.36 2.45 -0.14 0.00 -1.25 0.00 0.00 55.69 57.11 1l3e s MET 3 Cb -0.10 -3.57 0.06 0.00 1.25 0.00 0.00 34.83 32.46 1l3e s MET 3 CO 0.22 -0.78 0.34 -0.25 1.05 0.00 0.00 175.02 175.60 1l3e n ASP 4 N 5.56 -2.11 -4.76 1.11 9.92 -1.26 -4.96 116.55 120.04 1l3e n ASP 4 Ca 0.17 0.23 -0.30 0.00 -0.53 0.00 0.00 54.79 54.35 1l3e n ASP 4 Cb 0.39 -1.16 0.11 0.00 -0.64 0.00 0.00 41.12 39.82 1l3e n ASP 4 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1l3e s GLU 5 N -3.62 1.89 -0.72 -1.24 0.41 -1.26 -5.01 118.70 109.15 1l3e s GLU 5 Ca 0.57 0.87 0.04 0.00 -0.41 0.00 0.00 54.97 56.04 1l3e s GLU 5 Cb -0.19 -1.88 0.21 0.00 -1.78 0.00 0.00 34.13 30.49 1l3e s GLU 5 CO 0.67 -1.82 0.64 0.43 -0.49 0.00 0.00 175.26 174.69 1l3e n SER 6 N -3.60 3.51 0.01 -0.19 7.64 -1.26 -4.80 113.62 114.93 1l3e n SER 6 Ca 0.08 -3.30 0.00 0.00 1.01 0.00 0.00 58.87 56.66 1l3e n SER 6 Cb 0.55 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 1l3e n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1l3e n GLY 7 N 1.58 -0.01 3.73 0.23 0.00 -1.26 -5.05 105.19 104.40 1l3e n GLY 7 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 1l3e n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1l3e s LEU 8 N -5.81 4.37 -0.43 0.99 2.96 -1.26 -4.87 118.68 114.63 1l3e s LEU 8 Ca 0.00 2.64 -0.29 0.00 -0.22 0.00 0.00 54.13 56.26 1l3e s LEU 8 Cb 0.00 -3.61 -0.09 0.00 0.50 0.00 0.00 46.19 43.00 1l3e s LEU 8 CO 0.00 -0.78 2.34 -0.81 -1.32 0.00 0.00 176.35 175.78 1l3e n PRO 9 N 3.31 1.21 -3.45 0.98 -0.04 -1.26 -4.93 135.00 130.82 1l3e n PRO 9 Ca 0.11 0.21 -0.37 0.00 -0.04 0.00 0.00 63.50 63.41 1l3e n PRO 9 Cb 0.39 -2.99 -0.06 0.00 -0.04 0.00 0.00 33.50 30.80 1l3e n PRO 9 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1l3e s GLN 10 N 7.36 4.19 0.50 0.54 0.00 -1.26 -5.09 119.66 125.90 1l3e s GLN 10 Ca 1.05 0.31 0.08 0.00 -0.00 0.00 0.00 55.36 56.80 1l3e s GLN 10 Cb -0.48 -3.37 0.05 0.00 0.00 0.00 0.00 33.01 29.21 1l3e s GLN 10 CO 0.36 0.33 0.69 -0.51 0.00 0.00 0.00 175.29 176.17 1l3e s LEU 11 N 0.10 3.37 0.24 2.60 1.43 -1.26 -5.11 118.68 120.05 1l3e s LEU 11 Ca 0.22 -0.59 -0.10 0.00 -1.03 0.00 0.00 54.13 52.63 1l3e s LEU 11 Cb -0.15 -2.19 -0.07 0.00 0.03 0.00 0.00 46.19 43.81 1l3e s LEU 11 CO 0.09 -1.07 0.57 -0.89 0.23 0.00 0.00 176.35 175.27 1l3e s THR 12 N -2.54 4.90 0.63 5.49 2.01 -1.26 -4.95 115.64 119.93 1l3e s THR 12 Ca 0.59 0.53 0.28 0.00 0.31 0.00 0.00 61.69 63.39 1l3e s THR 12 Cb -0.08 -3.62 0.32 0.00 0.01 0.00 0.00 72.50 69.13 1l3e s THR 12 CO 0.36 -0.07 1.85 0.28 -0.69 0.00 0.00 174.62 176.35 1l3e h SER 13 N 2.55 0.00 0.00 3.53 0.02 -2.00 -1.85 113.55 115.81 1l3e h SER 13 Ca -0.47 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.05 1l3e h SER 13 Cb 1.17 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.64 1l3e h SER 13 CO 0.69 0.00 -2.45 0.00 -1.14 0.00 0.00 176.83 173.93 1l3e n TYR 14 N -3.21 0.09 -0.07 3.45 9.36 -1.26 -3.67 117.16 121.85 1l3e n TYR 14 Ca 0.03 0.03 0.26 0.00 3.32 0.00 0.00 57.90 61.53 1l3e n TYR 14 Cb 0.55 -1.01 0.71 0.00 -0.63 0.00 0.00 39.34 38.96 1l3e n TYR 14 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1l3e h ASP 15 N -0.61 0.00 0.00 2.98 5.19 -1.75 0.45 116.42 122.68 1l3e h ASP 15 Ca -0.64 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 55.68 1l3e h ASP 15 Cb 1.72 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.21 1l3e h ASP 15 CO -0.28 0.00 -0.52 0.00 -3.12 0.00 0.00 179.24 175.32 1l3e h GLU 17 N -1.00 0.43 -0.33 0.00 4.57 -1.22 0.80 114.58 117.84 1l3e h GLU 17 Ca -0.14 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.01 1l3e h GLU 17 Cb 1.06 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.54 1l3e h GLU 17 CO -0.08 0.29 0.19 0.28 -1.18 0.00 0.00 179.01 178.50 1l3e h VAL 18 N 0.45 1.13 0.00 0.32 2.07 -0.33 0.80 116.25 120.68 1l3e h VAL 18 Ca 0.21 -0.33 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 1l3e h VAL 18 Cb 0.13 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1l3e h VAL 18 CO -0.16 0.13 -0.53 -1.13 0.02 0.00 0.00 177.57 175.90 1l3e h ASN 19 N 0.41 0.00 -1.09 0.57 -0.73 -1.31 -3.40 115.58 110.03 1l3e h ASN 19 Ca 0.12 0.00 -0.13 0.00 1.87 0.00 0.00 56.30 58.15 1l3e h ASN 19 Cb 0.05 0.00 -0.19 0.00 0.27 0.00 0.00 38.32 38.45 1l3e h ASN 19 CO -0.02 0.53 -0.50 0.00 -0.37 0.00 0.00 177.43 177.08 1l3e s ALA 20 N -3.64 -2.04 0.57 1.57 0.00 0.27 -5.08 121.76 113.41 1l3e s ALA 20 Ca -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1l3e s ALA 20 Cb 0.12 -2.66 0.02 0.00 0.00 0.00 0.00 23.12 20.60 1l3e s ALA 20 CO 0.74 -2.22 0.85 -1.25 0.00 0.00 0.00 175.76 173.88 1l3e s PRO 21 N 1.33 2.80 0.01 0.00 0.04 0.27 -4.22 135.00 135.24 1l3e s PRO 21 Ca 0.23 -0.26 0.24 0.00 0.04 0.00 0.00 61.00 61.26 1l3e s PRO 21 Cb -0.03 -2.35 0.40 0.00 0.04 0.00 0.00 34.50 32.56 1l3e s PRO 21 CO -0.06 -0.68 1.34 -0.89 0.04 0.00 0.00 177.00 176.75 1l3e n ILE 22 N -2.48 0.03 -2.26 0.56 5.41 -1.26 -4.97 119.36 114.39 1l3e n ILE 22 Ca 0.05 -0.03 -0.01 0.00 1.00 0.00 0.00 62.75 63.75 1l3e n ILE 22 Cb 0.58 0.29 0.00 0.00 -0.71 0.00 0.00 39.64 39.81 1l3e n ILE 22 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1l3e n GLN 23 N -1.57 -0.38 -0.82 0.38 7.27 -1.26 -4.89 117.38 116.11 1l3e n GLN 23 Ca 0.05 0.05 0.10 0.00 0.07 0.00 0.00 57.00 57.26 1l3e n GLN 23 Cb 0.35 -2.68 -0.05 0.00 2.41 0.00 0.00 30.24 30.26 1l3e n GLN 23 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l3e n GLY 24 N -0.84 -2.99 2.41 1.69 0.00 -1.26 -5.02 105.19 99.18 1l3e n GLY 24 Ca -0.01 -1.23 -0.04 0.00 0.00 0.00 0.00 46.02 44.75 1l3e n GLY 24 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1l3e n SER 25 N -3.35 -1.87 -4.03 1.61 2.88 -1.26 -4.91 113.62 102.68 1l3e n SER 25 Ca -0.05 1.12 -0.36 0.00 -1.33 0.00 0.00 58.87 58.25 1l3e n SER 25 Cb 0.39 -4.51 0.05 0.00 -0.75 0.00 0.00 64.21 59.38 1l3e n SER 25 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1l3e n ARG 26 N 1.23 -0.02 -2.44 -1.46 0.00 -1.26 -4.95 116.66 107.75 1l3e n ARG 26 Ca -0.28 -0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.31 1l3e n ARG 26 Cb 0.43 -1.07 0.04 0.00 -0.00 0.00 0.00 32.46 31.86 1l3e n ARG 26 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1l3e s ASN 27 N -1.08 5.46 -0.12 2.89 3.84 -1.26 -5.05 114.94 119.62 1l3e s ASN 27 Ca 0.41 0.58 -0.13 0.00 0.21 0.00 0.00 52.86 53.93 1l3e s ASN 27 Cb -0.18 -1.53 -0.11 0.00 -0.55 0.00 0.00 41.25 38.88 1l3e s ASN 27 CO 0.82 -1.12 0.30 -0.07 -2.79 0.00 0.00 177.10 174.24 1l3e h LEU 28 N -0.17 0.00 -9.72 3.21 3.38 -2.01 -3.46 115.31 106.55 1l3e h LEU 28 Ca -0.45 -0.42 -0.53 0.00 0.09 0.00 0.00 57.88 56.58 1l3e h LEU 28 Cb 1.27 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.07 1l3e h LEU 28 CO 0.60 0.75 0.78 -1.48 0.09 0.00 0.00 178.44 179.18 1l3e s LEU 29 N -8.38 4.38 0.00 1.67 2.34 -1.26 -4.87 118.68 112.56 1l3e s LEU 29 Ca -0.09 2.66 0.00 0.00 0.06 0.00 0.00 54.13 56.75 1l3e s LEU 29 Cb -0.01 -3.62 0.00 0.00 -0.56 0.00 0.00 46.19 42.00 1l3e s LEU 29 CO 0.31 -0.73 0.00 1.67 -1.06 0.00 0.00 176.35 176.54 1l3e n GLN 30 N 2.68 0.00 0.00 1.48 7.27 -1.26 -4.68 117.38 122.87 1l3e n GLN 30 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 1l3e n GLN 30 Cb 0.40 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.05 1l3e n GLN 30 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l3e n GLY 31 N 0.12 1.19 0.17 1.69 0.00 -1.26 -3.99 105.19 103.11 1l3e n GLY 31 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1l3e n GLY 31 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1l3e h GLU 32 N 0.00 0.00 0.00 1.61 5.08 -1.99 -3.23 114.58 116.06 1l3e h GLU 32 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1l3e h GLU 32 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1l3e h GLU 32 CO 0.00 0.00 -0.28 0.93 -1.00 0.00 0.00 179.01 178.66 1l3e h GLU 33 N 0.00 0.00 -0.46 2.33 5.08 -1.92 -2.53 114.58 117.08 1l3e h GLU 33 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1l3e h GLU 33 Cb 0.94 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 1l3e h GLU 33 CO 0.00 0.28 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.15 1l3e h LEU 34 N 0.00 0.80 0.04 1.33 3.38 -1.69 0.83 115.31 120.01 1l3e h LEU 34 Ca -0.00 -0.23 -0.28 0.00 0.09 0.00 0.00 57.88 57.46 1l3e h LEU 34 Cb 0.92 -0.21 0.02 0.00 0.09 0.00 0.00 40.66 41.48 1l3e h LEU 34 CO 0.04 0.91 -1.15 -0.07 0.09 0.00 0.00 178.44 178.25 1l3e h LEU 35 N 0.75 0.82 -0.73 1.67 3.38 -1.68 0.62 115.31 120.13 1l3e h LEU 35 Ca 0.13 -0.72 -0.14 0.00 0.09 0.00 0.00 57.88 57.25 1l3e h LEU 35 Cb 0.55 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1l3e h LEU 35 CO 0.03 1.53 -0.55 -0.09 0.09 0.00 0.00 178.44 179.45 1l3e h ARG 36 N 0.30 0.24 0.00 1.13 9.65 -1.28 -2.95 114.38 121.47 1l3e h ARG 36 Ca -0.15 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 58.57 1l3e h ARG 36 Cb 1.81 0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 30.41 1l3e h ARG 36 CO 0.22 0.73 -0.03 0.00 2.80 0.00 0.00 179.97 183.68 1l3e h ALA 37 N 1.24 0.01 -0.89 2.80 0.00 0.69 -3.29 119.26 119.82 1l3e h ALA 37 Ca 0.00 -0.45 0.26 0.00 0.00 0.00 0.00 54.91 54.72 1l3e h ALA 37 Cb 1.03 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 1l3e h ALA 37 CO 0.09 0.02 0.81 -0.07 0.00 0.00 0.00 179.25 180.10 1l3e h LEU 38 N -1.00 0.00 -3.99 0.00 3.38 0.21 0.17 115.31 114.07 1l3e h LEU 38 Ca -0.01 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 1l3e h LEU 38 Cb 0.87 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.45 1l3e h LEU 38 CO -0.00 0.00 0.49 -0.67 0.09 0.00 0.00 178.44 178.34 1l3e n ASP 39 N -3.76 6.66 -2.63 -0.43 2.03 -1.11 -4.29 116.55 113.02 1l3e n ASP 39 Ca 0.19 -3.23 -0.11 0.00 0.52 0.00 0.00 54.79 52.15 1l3e n ASP 39 Cb 1.11 -1.12 0.03 0.00 -0.72 0.00 0.00 41.12 40.42 1l3e n ASP 39 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1l3e n GLN 40 N 0.36 1.67 -1.64 -0.67 -0.06 0.59 -5.03 117.38 112.61 1l3e n GLN 40 Ca 0.42 -3.52 -0.55 0.00 -2.00 0.00 0.00 57.00 51.35 1l3e n GLN 40 Cb 0.56 -1.49 -0.07 0.00 -4.06 0.00 0.00 30.24 25.19 1l3e n GLN 40 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1l3e n VAL 41 N -0.22 0.13 -1.34 1.69 0.31 -1.26 -5.12 118.33 112.52 1l3e n VAL 41 Ca 0.15 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1l3e n VAL 41 Cb 0.80 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.77 1l3e n VAL 41 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31