#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ica n THR 2 N 0.00 0.00 0.03 0.00 -2.24 -1.26 -4.16 114.28 106.65 1ica n THR 2 Ca 0.00 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1ica n THR 2 Cb 0.00 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1ica n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ica n ASP 4 N -3.09 -0.76 -4.62 0.00 2.03 -0.52 -4.57 116.55 105.01 1ica n ASP 4 Ca 0.00 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.93 1ica n ASP 4 Cb 0.00 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.31 1ica n ASP 4 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ica s LEU 5 N 0.00 4.07 0.04 -2.67 1.43 -1.26 -4.68 118.68 115.60 1ica s LEU 5 Ca 0.00 0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 53.34 1ica s LEU 5 Cb 0.00 -2.35 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 1ica s LEU 5 CO 0.00 -0.11 -0.03 0.18 0.23 0.00 0.00 176.35 176.62 1ica n LEU 6 N 4.98 0.76 -4.33 1.79 4.77 -1.26 -5.10 117.00 118.61 1ica n LEU 6 Ca -0.10 0.10 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 1ica n LEU 6 Cb 0.51 -0.27 -0.12 0.00 -2.33 0.00 0.00 43.42 41.21 1ica n LEU 6 CO 0.37 -0.61 -0.52 -0.94 -1.33 0.00 0.00 177.39 174.35 1ica s SER 7 N -5.54 2.83 0.14 -1.43 1.04 -1.26 -5.06 113.70 104.41 1ica s SER 7 Ca -0.03 -0.76 -0.31 0.00 0.48 0.00 0.00 55.95 55.33 1ica s SER 7 Cb 0.00 -0.17 -0.08 0.00 0.10 0.00 0.00 66.02 65.88 1ica s SER 7 CO 0.04 0.07 1.55 1.23 0.98 0.00 0.00 173.24 177.11 1ica h GLY 8 N 3.73 -0.88 -4.97 7.32 0.00 -2.04 -1.79 103.07 104.44 1ica h GLY 8 Ca -0.46 0.69 -0.75 0.00 0.00 0.00 0.00 47.33 46.81 1ica h GLY 8 CO 0.43 -0.12 0.82 -1.30 0.00 0.00 0.00 176.54 176.37 1ica n THR 9 N -5.38 3.49 -1.64 4.70 -2.24 -1.26 -4.71 114.28 107.25 1ica n THR 9 Ca -0.02 -4.43 0.00 0.00 -2.27 0.00 0.00 64.05 57.32 1ica n THR 9 Cb 0.34 -1.25 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 1ica n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ica n GLY 10 N -0.52 4.23 0.11 3.38 0.00 -0.67 -4.93 105.19 106.78 1ica n GLY 10 Ca 0.52 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1ica n GLY 10 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ica n ILE 11 N 0.00 0.00 -0.98 -0.61 -6.64 -1.26 -4.81 119.36 105.06 1ica n ILE 11 Ca 0.00 0.61 0.00 0.00 -1.77 0.00 0.00 62.75 61.59 1ica n ILE 11 Cb 0.00 -1.49 0.00 0.00 -1.44 0.00 0.00 39.64 36.71 1ica n ILE 11 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 1ica n ASN 12 N -1.40 0.00 -2.41 7.28 4.05 -1.26 -4.79 115.26 116.73 1ica n ASN 12 Ca 0.00 0.00 -0.28 0.00 0.45 0.00 0.00 54.58 54.75 1ica n ASN 12 Cb 0.61 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.62 1ica n ASN 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ica n HIS 13 N -0.14 2.09 -0.05 1.20 1.44 -1.26 -4.57 115.22 113.93 1ica n HIS 13 Ca 0.00 -2.18 -0.12 0.00 -2.01 0.00 0.00 57.72 53.41 1ica n HIS 13 Cb 0.00 -1.26 -0.06 0.00 0.12 0.00 0.00 29.99 28.80 1ica n HIS 13 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1ica h SER 14 N 2.50 0.27 -0.50 4.39 0.87 -1.87 -3.15 113.55 116.06 1ica h SER 14 Ca 0.44 -0.28 0.05 0.00 -1.23 0.00 0.00 61.79 60.76 1ica h SER 14 Cb 0.64 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 62.47 1ica h SER 14 CO 1.07 0.48 -0.30 0.00 -0.53 0.00 0.00 176.83 177.55 1ica n ALA 15 N -2.30 -0.32 -0.01 6.23 0.00 -1.26 -0.30 120.51 122.54 1ica n ALA 15 Ca -0.05 0.43 -0.12 0.00 0.00 0.00 0.00 53.44 53.70 1ica n ALA 15 Cb 0.20 -0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.56 1ica n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ica h ALA 17 N 0.84 0.17 -0.22 0.00 0.00 -0.61 0.13 119.26 119.57 1ica h ALA 17 Ca 0.03 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1ica h ALA 17 Cb 0.21 0.62 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 1ica h ALA 17 CO -0.00 -0.56 -0.46 0.00 0.00 0.00 0.00 179.25 178.23 1ica h ALA 18 N 1.28 -0.63 -0.39 0.00 0.00 -0.90 0.60 119.26 119.22 1ica h ALA 18 Ca 0.26 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.25 1ica h ALA 18 Cb 0.51 0.89 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 1ica h ALA 18 CO -0.65 -0.96 -0.23 1.25 0.00 0.00 0.00 179.25 178.66 1ica h HIS 19 N -0.47 -0.60 -0.19 0.00 6.17 -0.92 -1.37 115.15 117.77 1ica h HIS 19 Ca 0.08 0.05 0.05 0.00 0.71 0.00 0.00 60.37 61.26 1ica h HIS 19 Cb 0.63 0.33 -0.07 0.00 2.52 0.00 0.00 27.41 30.82 1ica h HIS 19 CO -0.56 -0.31 -0.32 0.00 0.71 0.00 0.00 177.93 177.45 1ica h LEU 21 N -0.36 -0.85 -0.14 0.00 -0.00 -0.29 -0.49 115.31 113.17 1ica h LEU 21 Ca 0.11 0.15 0.05 0.00 -0.00 0.00 0.00 57.88 58.19 1ica h LEU 21 Cb 0.54 0.39 -0.06 0.00 -0.00 0.00 0.00 40.66 41.53 1ica h LEU 21 CO -0.39 -0.30 -0.30 -0.07 -0.00 0.00 0.00 178.44 177.38 1ica h LEU 22 N -0.27 -0.94 -0.73 1.67 3.38 -0.59 -1.47 115.31 116.36 1ica h LEU 22 Ca 0.14 0.14 0.16 0.00 0.09 0.00 0.00 57.88 58.41 1ica h LEU 22 Cb 0.49 0.40 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 1ica h LEU 22 CO -0.40 -0.34 0.03 0.03 0.09 0.00 0.00 178.44 177.85 1ica h ARG 23 N -0.37 0.13 0.00 1.13 3.08 -0.30 -3.45 114.38 114.60 1ica h ARG 23 Ca 0.10 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1ica h ARG 23 Cb 0.53 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1ica h ARG 23 CO -0.35 0.08 0.00 0.41 -1.07 0.00 0.00 179.97 179.04 1ica n GLY 24 N -1.40 0.50 3.34 0.04 0.00 -0.30 -5.11 105.19 102.26 1ica n GLY 24 Ca 0.13 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 1ica n GLY 24 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ica n ASN 25 N 0.00 1.69 -1.66 1.61 3.02 -0.58 -4.98 115.26 114.35 1ica n ASN 25 Ca 0.00 -3.14 0.02 0.00 -0.03 0.00 0.00 54.58 51.43 1ica n ASN 25 Cb 0.00 0.87 0.02 0.00 -0.61 0.00 0.00 39.78 40.06 1ica n ASN 25 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1ica n ARG 26 N -0.97 0.26 -0.10 3.52 1.85 -0.74 -4.08 116.66 116.40 1ica n ARG 26 Ca -0.09 -2.11 0.00 0.00 -1.00 0.00 0.00 57.85 54.65 1ica n ARG 26 Cb 0.61 -0.17 0.00 0.00 -1.05 0.00 0.00 32.46 31.84 1ica n ARG 26 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ica n GLY 27 N 0.27 6.99 0.00 2.89 0.00 -0.94 -4.83 105.19 109.58 1ica n GLY 27 Ca 0.03 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.17 1ica n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ica n GLY 28 N 3.65 0.27 3.40 -0.02 0.00 -1.24 -4.54 105.19 106.70 1ica n GLY 28 Ca 0.00 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 1ica n GLY 28 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ica s TYR 29 N 0.00 1.74 0.15 1.61 1.13 -0.87 -4.27 117.35 116.84 1ica s TYR 29 Ca 0.00 -1.47 0.09 0.00 -1.41 0.00 0.00 57.07 54.28 1ica s TYR 29 Cb 0.00 -0.93 -0.04 0.00 -1.10 0.00 0.00 41.96 39.89 1ica s TYR 29 CO 0.00 -0.58 -0.12 0.00 -2.51 0.00 0.00 175.55 172.34 1ica s ASN 31 N -2.54 2.40 0.00 0.00 6.03 -0.47 -1.44 114.94 118.92 1ica s ASN 31 Ca 0.22 -1.01 0.00 0.00 -1.03 0.00 0.00 52.86 51.05 1ica s ASN 31 Cb -0.10 -0.11 0.00 0.00 -3.03 0.00 0.00 41.25 38.01 1ica s ASN 31 CO 0.13 -0.20 0.00 0.61 -2.03 0.00 0.00 177.10 175.62 1ica n GLY 32 N -0.29 0.00 0.23 0.45 0.00 -1.26 -0.73 105.19 103.60 1ica n GLY 32 Ca -0.09 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.08 1ica n GLY 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ica n LYS 33 N -0.12 -0.05 0.00 1.61 4.01 -1.26 -4.70 118.16 117.65 1ica n LYS 33 Ca 0.00 0.99 0.00 0.00 -0.51 0.00 0.00 58.31 58.79 1ica n LYS 33 Cb 0.00 -1.65 0.00 0.00 -0.51 0.00 0.00 35.03 32.87 1ica n LYS 33 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ica n GLY 34 N -1.28 1.06 3.29 0.72 0.00 0.09 -5.13 105.19 103.95 1ica n GLY 34 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 1ica n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ica s VAL 35 N -2.00 1.26 0.06 1.61 1.01 -1.19 -4.97 120.40 116.19 1ica s VAL 35 Ca 0.00 -2.09 -0.15 0.00 0.00 0.00 0.00 61.98 59.75 1ica s VAL 35 Cb 0.00 -1.99 -0.06 0.00 0.00 0.00 0.00 36.38 34.33 1ica s VAL 35 CO 0.00 -0.63 0.48 0.00 0.00 0.00 0.00 175.10 174.94 1ica s VAL 37 N -1.23 0.63 0.13 0.00 1.01 0.04 -4.95 120.40 116.03 1ica s VAL 37 Ca 0.30 -1.41 0.06 0.00 0.00 0.00 0.00 61.98 60.93 1ica s VAL 37 Cb -0.16 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1ica s VAL 37 CO 0.17 -0.56 -0.01 0.00 0.00 0.00 0.00 175.10 174.70 1ica s ARG 39 N -2.56 1.68 0.00 0.00 1.81 -1.26 -4.85 118.95 113.77 1ica s ARG 39 Ca 0.26 -1.85 0.00 0.00 -1.72 0.00 0.00 55.73 52.42 1ica s ARG 39 Cb -0.11 0.35 0.00 0.00 -0.45 0.00 0.00 34.95 34.74 1ica s ARG 39 CO 0.18 -0.64 0.41 0.09 -0.68 0.00 0.00 175.30 174.66