#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 -3.83 0.00 -2.24 -1.26 -5.02 114.28 101.93 1ica n THR 2 Ca 0.00 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 1ica n THR 2 Cb 0.00 -0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.10 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 4.70 0.00 -0.01 0.00 5.75 -1.26 -4.57 116.55 121.16 1ica n ASP 4 Ca -0.12 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.66 1ica n ASP 4 Cb 0.44 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.52 1ica n ASP 4 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1ica n LEU 5 N 0.00 2.06 0.00 -2.12 4.77 -1.26 -4.54 117.00 115.91 1ica n LEU 5 Ca 0.00 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1ica n LEU 5 Cb 0.00 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1ica n LEU 5 CO 0.00 0.36 0.00 0.18 -1.33 0.00 0.00 177.39 176.60 1ica n LEU 6 N -2.37 0.00 -4.12 2.23 4.77 -1.26 -4.03 117.00 112.21 1ica n LEU 6 Ca -0.02 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.74 1ica n LEU 6 Cb 0.52 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.46 1ica n LEU 6 CO 0.01 0.00 -0.48 -0.44 -1.33 0.00 0.00 177.39 175.16 1ica s SER 7 N 0.00 1.73 0.01 -1.43 0.01 -1.26 -5.04 113.70 107.72 1ica s SER 7 Ca 0.00 -0.29 -0.02 0.00 1.31 0.00 0.00 55.95 56.95 1ica s SER 7 Cb 0.00 -0.18 -0.00 0.00 0.21 0.00 0.00 66.02 66.04 1ica s SER 7 CO 0.00 0.17 0.10 0.61 0.41 0.00 0.00 173.24 174.53 1ica n GLY 8 N 2.62 -0.17 2.69 3.44 0.00 -1.26 -0.28 105.19 112.23 1ica n GLY 8 Ca -0.15 0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1ica n GLY 8 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ica n THR 9 N -4.09 2.73 -0.88 2.61 -2.24 -1.26 -4.94 114.28 106.21 1ica n THR 9 Ca 0.00 -5.23 0.00 0.00 -2.27 0.00 0.00 64.05 56.56 1ica n THR 9 Cb 0.02 -1.33 0.00 0.00 -2.10 0.00 0.00 70.33 66.92 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 -0.38 2.61 0.00 3.38 0.00 0.62 -4.89 105.19 106.53 1ica n GLY 10 Ca 0.36 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1ica n GLY 10 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1ica n ILE 11 N 0.00 0.00 -3.73 -0.61 0.00 -1.26 -4.78 119.36 108.98 1ica n ILE 11 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 62.75 62.44 1ica n ILE 11 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 39.64 39.67 1ica n ILE 11 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1ica n ASN 12 N -3.38 -5.22 0.00 9.51 4.05 -1.26 -4.83 115.26 114.12 1ica n ASN 12 Ca 0.00 -0.99 0.04 0.00 0.45 0.00 0.00 54.58 54.08 1ica n ASN 12 Cb 0.00 -2.90 0.21 0.00 1.23 0.00 0.00 39.78 38.32 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 -3.94 0.00 0.00 1.20 1.44 -1.26 -4.31 115.22 108.35 1ica n HIS 13 Ca -0.12 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.59 1ica n HIS 13 Cb 0.59 -0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.39 1ica n HIS 13 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1ica n SER 14 N -1.31 0.00 -0.29 4.39 2.88 -1.26 -0.86 113.62 117.18 1ica n SER 14 Ca 0.04 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.66 1ica n SER 14 Cb 0.07 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.70 1ica n SER 14 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ica n ALA 15 N -3.53 0.29 0.06 -1.46 0.00 -1.26 0.03 120.51 114.64 1ica n ALA 15 Ca 0.00 0.89 -0.13 0.00 0.00 0.00 0.00 53.44 54.20 1ica n ALA 15 Cb 0.00 -0.58 -0.09 0.00 0.00 0.00 0.00 19.45 18.78 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 0.13 -0.24 -0.17 0.00 0.00 -0.19 -0.38 119.26 118.40 1ica h ALA 17 Ca -0.02 0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1ica h ALA 17 Cb 0.48 0.92 -0.05 0.00 0.00 0.00 0.00 17.79 19.14 1ica h ALA 17 CO 0.03 -0.79 -0.37 0.00 0.00 0.00 0.00 179.25 178.13 1ica h ALA 18 N 0.73 -0.69 -0.84 0.00 0.00 -1.01 0.72 119.26 118.18 1ica h ALA 18 Ca 0.20 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.22 1ica h ALA 18 Cb 0.56 0.92 -0.14 0.00 0.00 0.00 0.00 17.79 19.13 1ica h ALA 18 CO -0.70 -0.84 -0.39 1.25 0.00 0.00 0.00 179.25 178.57 1ica h HIS 19 N -0.33 -1.10 -0.02 0.00 6.17 -0.91 -0.92 115.15 118.04 1ica h HIS 19 Ca 0.03 0.10 0.02 0.00 0.71 0.00 0.00 60.37 61.23 1ica h HIS 19 Cb 0.43 0.60 -0.02 0.00 2.52 0.00 0.00 27.41 30.94 1ica h HIS 19 CO -0.61 -0.40 -0.10 0.00 0.71 0.00 0.00 177.93 177.54 1ica h LEU 21 N -0.16 -1.05 -0.74 0.00 -0.00 0.43 -1.55 115.31 112.24 1ica h LEU 21 Ca 0.04 0.19 0.15 0.00 -0.00 0.00 0.00 57.88 58.26 1ica h LEU 21 Cb 0.21 0.50 -0.14 0.00 -0.00 0.00 0.00 40.66 41.23 1ica h LEU 21 CO -0.11 -0.31 -0.20 -0.07 -0.00 0.00 0.00 178.44 177.75 1ica h LEU 22 N -0.24 -0.73 -0.31 1.67 3.38 -1.17 0.19 115.31 118.10 1ica h LEU 22 Ca 0.18 0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.40 1ica h LEU 22 Cb 0.53 0.47 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 1ica h LEU 22 CO -0.54 -0.25 0.15 -0.09 0.09 0.00 0.00 178.44 177.80 1ica h ARG 23 N -0.01 0.30 0.00 1.13 2.43 -1.25 -3.46 114.38 113.52 1ica h ARG 23 Ca 0.35 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 1ica h ARG 23 Cb 0.55 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1ica h ARG 23 CO -0.77 0.20 0.00 0.41 -1.51 0.00 0.00 179.97 178.30 1ica n GLY 24 N -1.19 0.39 3.59 2.80 0.00 0.65 -5.15 105.19 106.28 1ica n GLY 24 Ca -0.00 -0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1ica n GLY 24 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ica s ASN 25 N 0.00 3.21 -0.12 1.61 0.01 -1.01 -4.98 114.94 113.66 1ica s ASN 25 Ca 0.00 -1.72 0.24 0.00 -0.71 0.00 0.00 52.86 50.67 1ica s ASN 25 Cb 0.00 0.61 0.47 0.00 0.41 0.00 0.00 41.25 42.73 1ica s ASN 25 CO 0.00 -0.97 1.14 -2.11 -1.51 0.00 0.00 177.10 173.66 1ica n ARG 26 N -1.04 0.81 -2.43 -0.60 0.00 -1.16 -4.06 116.66 108.18 1ica n ARG 26 Ca -0.10 -2.70 -0.04 0.00 -0.00 0.00 0.00 57.85 55.01 1ica n ARG 26 Cb 0.65 -0.75 -0.01 0.00 -0.00 0.00 0.00 32.46 32.35 1ica n ARG 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ica n GLY 27 N -0.01 3.88 0.00 2.89 0.00 -1.00 -4.80 105.19 106.15 1ica n GLY 27 Ca 0.07 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 0.73 0.30 1.75 -0.02 0.00 -1.22 -4.26 105.19 102.46 1ica n GLY 28 Ca 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1ica n GLY 28 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1ica n TYR 29 N 0.00 -0.04 -3.57 1.61 0.18 -0.73 -2.72 117.16 111.89 1ica n TYR 29 Ca 0.00 -1.40 -0.37 0.00 1.88 0.00 0.00 57.90 58.01 1ica n TYR 29 Cb 0.00 0.03 -0.08 0.00 -0.38 0.00 0.00 39.34 38.91 1ica n TYR 29 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ica s ASN 31 N 0.90 4.44 0.00 0.00 6.03 -0.47 -4.20 114.94 121.64 1ica s ASN 31 Ca 0.12 0.01 0.00 0.00 -1.03 0.00 0.00 52.86 51.96 1ica s ASN 31 Cb -0.13 -0.49 0.00 0.00 -3.03 0.00 0.00 41.25 37.59 1ica s ASN 31 CO 0.05 -1.81 0.00 0.61 -2.03 0.00 0.00 177.10 173.92 1ica n GLY 32 N -2.92 0.00 0.07 0.45 0.00 -1.26 0.91 105.19 102.44 1ica n GLY 32 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1ica n GLY 32 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ica h LYS 33 N 0.00 -0.04 0.00 1.61 3.11 -2.04 -3.48 116.57 115.73 1ica h LYS 33 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1ica h LYS 33 Cb 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.24 1ica h LYS 33 CO 0.00 0.56 0.00 0.41 -2.81 0.00 0.00 179.45 177.61 1ica n GLY 34 N 1.45 -0.03 3.39 5.01 0.00 0.26 -5.16 105.19 110.10 1ica n GLY 34 Ca -0.07 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 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 0.00 2.17 -0.37 1.61 1.01 -1.25 -4.82 120.40 118.74 1ica s VAL 35 Ca 0.00 -1.98 -0.25 0.00 0.00 0.00 0.00 61.98 59.75 1ica s VAL 35 Cb 0.00 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.38 1ica s VAL 35 CO 0.00 -0.18 0.89 0.00 0.00 0.00 0.00 175.10 175.82 1ica s VAL 37 N 3.41 2.04 0.29 0.00 -7.23 -0.72 -4.98 120.40 113.21 1ica s VAL 37 Ca 0.37 -1.84 0.08 0.00 -1.81 0.00 0.00 61.98 58.78 1ica s VAL 37 Cb -0.12 -1.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 1ica s VAL 37 CO 0.19 -0.12 0.12 0.00 -0.31 0.00 0.00 175.10 174.97 1ica s ARG 39 N -3.80 1.18 0.00 0.00 1.81 -1.26 -4.76 118.95 112.12 1ica s ARG 39 Ca 0.34 -1.62 0.00 0.00 -1.72 0.00 0.00 55.73 52.74 1ica s ARG 39 Cb -0.06 0.18 0.00 0.00 -0.45 0.00 0.00 34.95 34.63 1ica s ARG 39 CO 0.23 -0.35 0.47 0.27 -0.68 0.00 0.00 175.30 175.23