#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1og7 s TYR 2 N 0.00 1.12 -0.91 5.64 1.13 -1.26 -4.27 117.35 118.80 1og7 s TYR 2 Ca 0.00 -0.49 0.17 0.00 -1.41 0.00 0.00 57.07 55.34 1og7 s TYR 2 Cb 0.00 -0.63 0.73 0.00 -1.10 0.00 0.00 41.96 40.96 1og7 s TYR 2 CO 0.00 0.03 1.55 0.66 -2.51 0.00 0.00 175.55 175.28 1og7 n TYR 3 N 1.21 0.16 0.00 -3.49 4.01 -0.03 -4.93 117.16 114.09 1og7 n TYR 3 Ca -0.21 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 1og7 n TYR 3 Cb 0.55 -0.60 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 1og7 n TYR 3 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1og7 n GLY 4 N 0.13 0.42 3.73 2.72 0.00 -1.26 -4.78 105.19 106.15 1og7 n GLY 4 Ca 0.04 -2.31 -0.42 0.00 0.00 0.00 0.00 46.02 43.33 1og7 n GLY 4 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1og7 n ASN 5 N 0.00 3.16 0.00 1.61 6.94 -1.26 -1.98 115.26 123.72 1og7 n ASN 5 Ca 0.00 1.21 0.00 0.00 -0.02 0.00 0.00 54.58 55.77 1og7 n ASN 5 Cb 0.00 -1.54 0.00 0.00 -2.36 0.00 0.00 39.78 35.88 1og7 n ASN 5 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1og7 n GLY 6 N 0.65 0.67 2.02 4.83 0.00 -0.82 -4.79 105.19 107.74 1og7 n GLY 6 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1og7 n GLY 6 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1og7 n VAL 7 N -2.25 0.00 0.00 1.61 0.24 -0.72 -4.45 118.33 112.76 1og7 n VAL 7 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1og7 n VAL 7 Cb 0.03 -0.42 0.00 0.00 -1.47 0.00 0.00 33.84 31.98 1og7 n VAL 7 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1og7 n HIS 8 N -3.43 0.00 0.00 6.34 8.25 -0.84 -2.22 115.22 123.32 1og7 n HIS 8 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1og7 n HIS 8 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1og7 n HIS 8 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1og7 n GLY 10 N 0.00 -1.06 0.10 0.00 0.00 -1.26 -2.46 105.19 100.51 1og7 n GLY 10 Ca 0.00 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1og7 n GLY 10 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1og7 h LYS 11 N 0.00 -0.15 0.00 1.61 3.64 -1.83 -3.47 116.57 116.37 1og7 h LYS 11 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1og7 h LYS 11 Cb 0.19 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1og7 h LYS 11 CO 0.00 0.12 0.00 1.58 -2.27 0.00 0.00 179.45 178.88 1og7 n HIS 12 N -5.04 -2.94 -4.04 1.91 -0.00 -1.06 -5.16 115.22 98.89 1og7 n HIS 12 Ca -0.08 0.46 -0.10 0.00 -0.00 0.00 0.00 57.72 58.00 1og7 n HIS 12 Cb 0.18 1.47 -0.06 0.00 -0.00 0.00 0.00 29.99 31.58 1og7 n HIS 12 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1og7 s SER 13 N -2.00 -0.04 -0.88 0.26 0.15 -1.03 -5.05 113.70 105.11 1og7 s SER 13 Ca 0.00 -1.02 -0.25 0.00 0.70 0.00 0.00 55.95 55.38 1og7 s SER 13 Cb 0.00 0.54 -0.19 0.00 -1.71 0.00 0.00 66.02 64.67 1og7 s SER 13 CO 0.00 -1.08 1.92 0.00 1.20 0.00 0.00 173.24 175.28 1og7 n THR 15 N 7.60 0.55 0.00 0.00 -1.04 -1.17 -4.85 114.28 115.38 1og7 n THR 15 Ca 0.45 0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 1og7 n THR 15 Cb 0.45 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 68.18 1og7 n THR 15 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1og7 n VAL 16 N -1.79 0.00 0.00 12.58 0.24 -0.94 -2.28 118.33 126.14 1og7 n VAL 16 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 1og7 n VAL 16 Cb 0.29 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.66 1og7 n VAL 16 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1og7 n ASP 17 N 0.00 0.00 -1.22 -1.34 5.68 -1.26 -1.76 116.55 116.65 1og7 n ASP 17 Ca 0.00 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.38 1og7 n ASP 17 Cb 0.00 0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.26 1og7 n ASP 17 CO 0.00 0.00 0.00 -2.67 -1.33 0.00 0.00 177.20 173.20 1og7 n TRP 18 N 0.00 0.99 0.29 2.11 -0.00 -0.96 -4.41 117.44 115.45 1og7 n TRP 18 Ca 0.00 -0.44 0.18 0.00 -0.00 0.00 0.00 57.50 57.24 1og7 n TRP 18 Cb 0.00 -0.09 0.92 0.00 -0.00 0.00 0.00 31.31 32.15 1og7 n TRP 18 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 1og7 h GLY 19 N 4.59 0.00 1.64 -1.67 0.00 -1.97 0.18 103.07 105.84 1og7 h GLY 19 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 1og7 h GLY 19 CO 0.08 0.00 -0.61 -0.91 0.00 0.00 0.00 176.54 175.10 1og7 h THR 20 N 0.00 1.36 0.17 4.70 1.35 -1.95 -1.48 112.91 117.06 1og7 h THR 20 Ca 0.00 -1.95 -0.01 0.00 -0.55 0.00 0.00 66.41 63.90 1og7 h THR 20 Cb 0.12 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1og7 h THR 20 CO 0.00 0.59 -0.08 0.00 -0.25 0.00 0.00 175.52 175.78 1og7 h ALA 21 N 1.08 -0.87 -0.98 6.62 0.00 -0.97 -0.79 119.26 123.34 1og7 h ALA 21 Ca -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.94 1og7 h ALA 21 Cb 1.14 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 1og7 h ALA 21 CO 0.10 -0.86 0.62 -0.84 0.00 0.00 0.00 179.25 178.28 1og7 h ILE 22 N -0.26 1.02 -0.22 0.00 3.07 -1.67 -1.53 117.51 117.92 1og7 h ILE 22 Ca -0.02 -0.37 0.03 0.00 1.55 0.00 0.00 64.86 66.04 1og7 h ILE 22 Cb 0.17 -0.15 -0.05 0.00 -0.27 0.00 0.00 36.82 36.52 1og7 h ILE 22 CO 0.04 0.20 -0.35 1.23 -1.05 0.00 0.00 178.15 178.21 1og7 h GLY 23 N 1.08 -1.33 1.42 0.16 0.00 -1.33 -0.50 103.07 102.57 1og7 h GLY 23 Ca 0.45 0.74 -0.06 0.00 0.00 0.00 0.00 47.33 48.45 1og7 h GLY 23 CO -0.21 -0.34 0.01 3.43 0.00 0.00 0.00 176.54 179.43 1og7 h ASN 24 N -0.28 0.68 -0.01 0.19 2.35 -0.81 -2.27 115.58 115.43 1og7 h ASN 24 Ca 0.04 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1og7 h ASN 24 Cb 0.39 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 1og7 h ASN 24 CO -0.36 0.75 -0.01 0.40 -1.65 0.00 0.00 177.43 176.56 1og7 h ILE 25 N 0.68 0.96 -0.41 2.81 2.04 -1.18 -0.06 117.51 122.35 1og7 h ILE 25 Ca 0.14 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.08 1og7 h ILE 25 Cb 0.40 0.96 -0.08 0.00 -0.74 0.00 0.00 36.82 37.37 1og7 h ILE 25 CO 0.01 0.00 -0.11 1.23 0.00 0.00 0.00 178.15 179.28 1og7 h GLY 26 N -0.02 0.27 0.24 5.37 0.00 -0.94 -0.56 103.07 107.43 1og7 h GLY 26 Ca 0.01 0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.51 1og7 h GLY 26 CO -0.02 -0.16 -0.42 -0.57 0.00 0.00 0.00 176.54 175.36 1og7 h ASN 27 N -0.02 -1.26 -0.62 0.19 -1.24 -1.27 -0.59 115.58 110.78 1og7 h ASN 27 Ca 0.20 0.14 -0.06 0.00 0.71 0.00 0.00 56.30 57.29 1og7 h ASN 27 Cb 0.32 0.48 -0.03 0.00 0.73 0.00 0.00 38.32 39.82 1og7 h ASN 27 CO -0.43 -0.49 0.15 -1.13 -1.29 0.00 0.00 177.43 174.24 1og7 h ASN 28 N -0.64 0.94 -0.22 1.15 -1.24 -0.65 -2.39 115.58 112.53 1og7 h ASN 28 Ca 0.03 -0.23 -0.05 0.00 0.71 0.00 0.00 56.30 56.75 1og7 h ASN 28 Cb 0.68 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.47 1og7 h ASN 28 CO -0.26 0.93 -0.06 0.00 -1.29 0.00 0.00 177.43 176.74 1og7 h ALA 29 N 1.04 0.30 0.00 1.57 0.00 -1.13 0.29 119.26 121.34 1og7 h ALA 29 Ca 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1og7 h ALA 29 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1og7 h ALA 29 CO 0.00 0.10 0.02 0.00 0.00 0.00 0.00 179.25 179.37 1og7 n ALA 30 N -2.38 0.99 -0.10 0.00 0.00 -0.23 -2.61 120.51 116.17 1og7 n ALA 30 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1og7 n ALA 30 Cb 0.30 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1og7 n ALA 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1og7 n ALA 31 N -1.44 1.61 0.36 0.00 0.00 -1.03 -4.89 120.51 115.11 1og7 n ALA 31 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.39 1og7 n ALA 31 Cb 0.02 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.68 1og7 n ALA 31 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1og7 n ASN 32 N -2.37 0.00 0.08 0.00 3.02 0.10 -0.60 115.26 115.49 1og7 n ASN 32 Ca 0.00 0.42 -0.08 0.00 -0.03 0.00 0.00 54.58 54.89 1og7 n ASN 32 Cb 0.00 -0.45 -0.09 0.00 -0.61 0.00 0.00 39.78 38.63 1og7 n ASN 32 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1og7 h TRP 33 N 0.00 0.12 0.00 3.10 -0.00 -1.62 -3.18 115.95 114.37 1og7 h TRP 33 Ca 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 58.89 58.81 1og7 h TRP 33 Cb 0.15 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 29.30 1og7 h TRP 33 CO 0.00 1.02 0.00 0.00 -0.00 0.00 0.00 178.44 179.46 1og7 n ALA 34 N -2.40 0.28 0.00 1.49 0.00 -0.99 -4.48 120.51 114.41 1og7 n ALA 34 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1og7 n ALA 34 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.37 1og7 n ALA 34 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1og7 n THR 35 N -0.19 0.00 1.40 0.00 -1.04 0.04 -3.49 114.28 111.00 1og7 n THR 35 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 1og7 n THR 35 Cb 0.00 -0.20 0.71 0.00 -1.82 0.00 0.00 70.33 69.02 1og7 n THR 35 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1og7 n GLY 36 N 1.89 -1.01 2.69 3.41 0.00 0.23 -4.27 105.19 108.14 1og7 n GLY 36 Ca 0.00 -0.14 -0.06 0.00 0.00 0.00 0.00 46.02 45.82 1og7 n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1og7 n GLY 37 N 0.80 -0.27 0.31 -0.02 0.00 -1.22 -1.62 105.19 103.18 1og7 n GLY 37 Ca 0.15 0.33 0.19 0.00 0.00 0.00 0.00 46.02 46.69 1og7 n GLY 37 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1og7 h ASN 38 N 2.40 0.00 0.79 1.61 -0.73 -1.74 0.41 115.58 118.31 1og7 h ASN 38 Ca -0.25 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.92 1og7 h ASN 38 Cb 1.18 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.77 1og7 h ASN 38 CO 0.02 0.02 0.00 0.00 -0.37 0.00 0.00 177.43 177.10 1og7 h ALA 39 N 1.98 1.00 0.00 1.57 0.00 -1.90 -3.47 119.26 118.44 1og7 h ALA 39 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1og7 h ALA 39 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1og7 h ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1og7 n GLY 40 N 0.03 1.37 3.45 0.00 0.00 0.12 -5.12 105.19 105.04 1og7 n GLY 40 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1og7 n GLY 40 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1og7 s TRP 41 N -0.65 0.22 -0.09 1.61 0.51 -1.13 -4.73 118.94 114.67 1og7 s TRP 41 Ca 0.00 -0.57 -0.39 0.00 -2.12 0.00 0.00 56.10 53.01 1og7 s TRP 41 Cb 0.00 0.14 -0.17 0.00 -0.81 0.00 0.00 33.47 32.63 1og7 s TRP 41 CO 0.00 -0.84 1.43 -1.71 -0.51 0.00 0.00 176.95 175.32 1og7 n ASN 42 N -0.29 1.49 0.00 2.95 2.85 -1.21 -4.13 115.26 116.93 1og7 n ASN 42 Ca -0.07 1.12 0.00 0.00 -0.11 0.00 0.00 54.58 55.52 1og7 n ASN 42 Cb 0.63 -1.09 0.00 0.00 1.24 0.00 0.00 39.78 40.55 1og7 n ASN 42 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32