#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7y h SER 38 N 0.00 0.87 -0.77 1.61 0.02 -2.04 -3.07 113.55 110.17 2k7y h SER 38 Ca 0.00 -0.69 0.22 0.00 -0.84 0.00 0.00 61.79 60.48 2k7y h SER 38 Cb 0.00 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 2k7y h SER 38 CO 0.00 1.49 0.82 0.40 -1.14 0.00 0.00 176.83 178.40 2k7y h ILE 39 N 0.39 0.21 0.49 3.27 2.04 -2.06 0.77 117.51 122.61 2k7y h ILE 39 Ca -0.12 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 2k7y h ILE 39 Cb 1.66 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2k7y h ILE 39 CO 0.20 0.00 -0.23 0.44 0.00 0.00 0.00 178.15 178.55 2k7y h ASP 40 N 0.00 -0.55 0.08 1.72 5.19 -1.95 -2.78 116.42 118.13 2k7y h ASP 40 Ca 0.36 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.79 2k7y h ASP 40 Cb 2.00 0.14 0.00 0.00 0.18 0.00 0.00 39.33 41.65 2k7y h ASP 40 CO -0.00 -0.37 0.00 -2.11 -3.12 0.00 0.00 179.24 173.64 2k7y n ARG 41 N -3.92 0.79 -0.11 3.56 1.85 0.18 -3.10 116.66 115.91 2k7y n ARG 41 Ca -0.08 0.01 -0.14 0.00 -1.00 0.00 0.00 57.85 56.64 2k7y n ARG 41 Cb 0.26 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.14 2k7y n ARG 41 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2k7y h LEU 42 N 0.00 0.96 -1.10 2.89 7.12 0.71 -2.83 115.31 123.06 2k7y h LEU 42 Ca 0.00 -0.48 -0.09 0.00 0.13 0.00 0.00 57.88 57.44 2k7y h LEU 42 Cb 0.04 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 39.89 2k7y h LEU 42 CO 0.00 1.24 -0.37 0.40 -0.13 0.00 0.00 178.44 179.59 2k7y h ILE 43 N 0.69 1.28 -1.03 4.05 2.04 -1.47 -2.53 117.51 120.55 2k7y h ILE 43 Ca 0.05 -1.36 0.26 0.00 1.00 0.00 0.00 64.86 64.81 2k7y h ILE 43 Cb 0.99 1.63 -0.09 0.00 -0.74 0.00 0.00 36.82 38.62 2k7y h ILE 43 CO 0.10 0.40 0.66 -0.78 0.00 0.00 0.00 178.15 178.53 2k7y h ASP 44 N 0.13 0.45 1.53 1.72 3.58 -1.63 2.24 116.42 124.44 2k7y h ASP 44 Ca 0.01 0.08 -0.09 0.00 0.42 0.00 0.00 57.03 57.45 2k7y h ASP 44 Cb 0.71 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.76 2k7y h ASP 44 CO 0.05 0.10 -0.43 0.03 -2.88 0.00 0.00 179.24 176.11 2k7y h ARG 45 N 0.40 0.00 0.00 0.28 -0.00 -1.51 1.34 114.38 114.90 2k7y h ARG 45 Ca 0.58 0.00 -0.13 0.00 -0.50 0.00 0.00 59.98 59.93 2k7y h ARG 45 Cb 1.47 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 31.42 2k7y h ARG 45 CO -0.28 0.43 -1.00 0.82 0.00 0.00 0.00 179.97 179.94 2k7y h ILE 46 N 0.00 0.61 -0.01 2.04 1.08 0.19 -3.31 117.51 118.11 2k7y h ILE 46 Ca -0.00 -2.00 0.00 0.00 -0.39 0.00 0.00 64.86 62.46 2k7y h ILE 46 Cb 1.32 2.15 0.00 0.00 -3.07 0.00 0.00 36.82 37.22 2k7y h ILE 46 CO 0.06 0.35 -0.18 1.07 -0.69 0.00 0.00 178.15 178.75 2k7y n THR 47 N -3.01 0.00 -0.57 -0.27 5.66 0.65 -4.56 114.28 112.18 2k7y n THR 47 Ca -0.04 -0.41 0.46 0.00 -3.05 0.00 0.00 64.05 61.01 2k7y n THR 47 Cb 0.77 1.17 0.78 0.00 -1.55 0.00 0.00 70.33 71.51 2k7y n THR 47 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 2k7y h GLU 48 N 1.63 0.02 -0.05 1.09 -0.00 0.17 1.64 114.58 119.08 2k7y h GLU 48 Ca 0.00 -0.00 0.01 0.00 -0.00 0.00 0.00 59.36 59.37 2k7y h GLU 48 Cb 0.44 -0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.18 2k7y h GLU 48 CO 0.00 0.01 0.39 0.07 -0.00 0.00 0.00 179.01 179.48 2k7y h ARG 49 N 0.02 0.00 0.31 1.06 -0.00 -1.82 1.46 114.38 115.40 2k7y h ARG 49 Ca 0.83 0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 60.79 2k7y h ARG 49 Cb 3.21 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 33.18 2k7y h ARG 49 CO -0.07 0.00 -0.15 0.00 -0.00 0.00 0.00 179.97 179.75 2k7y h ALA 50 N 1.26 -0.42 0.00 0.08 0.00 0.21 -3.31 119.26 117.08 2k7y h ALA 50 Ca 0.02 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 2k7y h ALA 50 Cb 0.80 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2k7y h ALA 50 CO -0.00 -0.39 -0.40 1.05 0.00 0.00 0.00 179.25 179.51 2k7y h GLU 51 N -1.08 0.00 -1.31 0.00 4.11 -1.29 1.06 114.58 116.07 2k7y h GLU 51 Ca -0.04 0.00 0.38 0.00 0.07 0.00 0.00 59.36 59.77 2k7y h GLU 51 Cb 0.32 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 2k7y h GLU 51 CO 0.07 0.40 1.07 0.22 0.07 0.00 0.00 179.01 180.84 2k7y h ASP 52 N 0.00 0.00 0.00 3.06 3.58 0.19 -3.14 116.42 120.11 2k7y h ASP 52 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k7y h ASP 52 Cb 0.84 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.89 2k7y h ASP 52 CO 0.05 0.00 -0.09 -0.24 -2.88 0.00 0.00 179.24 176.08 2k7y n SER 53 N -3.83 0.39 0.00 2.28 2.88 -1.10 -5.04 113.62 109.20 2k7y n SER 53 Ca 0.29 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 2k7y n SER 53 Cb 1.48 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.69 2k7y n SER 53 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2k7y n GLY 54 N 2.85 0.00 5.00 0.46 0.00 -0.78 -4.99 105.19 107.73 2k7y n GLY 54 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2k7y n GLY 54 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k7y n ASN 55 N 0.00 0.00 -3.81 1.61 2.85 0.36 -4.68 115.26 111.59 2k7y n ASN 55 Ca 0.00 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.09 2k7y n ASN 55 Cb 0.00 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 40.92 2k7y n ASN 55 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2k7y n GLU 56 N 0.00 0.56 0.00 1.20 1.02 -1.26 -2.31 120.64 119.84 2k7y n GLU 56 Ca 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 57.16 55.66 2k7y n GLU 56 Cb 0.00 -2.96 0.00 0.00 -0.02 0.00 0.00 31.44 28.46 2k7y n GLU 56 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2k7y n SER 57 N 10.95 0.00 -0.82 1.62 3.41 -1.26 -4.96 113.62 122.56 2k7y n SER 57 Ca 0.46 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 59.07 2k7y n SER 57 Cb 0.43 0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.46 2k7y n SER 57 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k7y n GLU 58 N -1.61 0.00 -0.54 4.33 4.71 -1.02 -4.98 120.64 121.52 2k7y n GLU 58 Ca 0.00 -0.98 -0.17 0.00 -0.01 0.00 0.00 57.16 56.00 2k7y n GLU 58 Cb 0.00 -0.09 -0.02 0.00 -1.01 0.00 0.00 31.44 30.32 2k7y n GLU 58 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2k7y n GLY 59 N 0.12 2.66 0.03 0.62 0.00 -0.98 -3.63 105.19 104.01 2k7y n GLY 59 Ca -0.03 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.32 2k7y n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k7y n ASP 60 N 4.62 3.45 -0.07 1.61 8.00 -1.26 -4.54 116.55 128.35 2k7y n ASP 60 Ca 0.32 -0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.68 2k7y n ASP 60 Cb 0.11 0.20 -0.09 0.00 -0.02 0.00 0.00 41.12 41.31 2k7y n ASP 60 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2k7y h GLN 61 N 0.00 0.00 -0.34 -1.24 5.75 -2.02 -3.30 115.11 113.96 2k7y h GLN 61 Ca -0.17 0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.43 2k7y h GLN 61 Cb 1.31 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 2k7y h GLN 61 CO -0.01 0.71 0.64 1.05 -2.65 0.00 0.00 178.83 178.57 2k7y h GLU 62 N -1.00 0.00 -0.85 1.69 4.11 -1.86 -1.30 114.58 115.37 2k7y h GLU 62 Ca -0.08 0.00 0.21 0.00 0.07 0.00 0.00 59.36 59.56 2k7y h GLU 62 Cb 0.83 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.92 2k7y h GLU 62 CO -0.05 0.00 -0.07 -1.91 0.07 0.00 0.00 179.01 177.05 2k7y n GLU 63 N -3.19 -0.07 0.00 1.06 2.13 -1.24 0.13 120.64 119.45 2k7y n GLU 63 Ca 0.06 1.29 0.00 0.00 0.66 0.00 0.00 57.16 59.18 2k7y n GLU 63 Cb 0.78 -2.00 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2k7y n GLU 63 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 2k7y n LEU 64 N -5.28 0.81 -0.05 4.31 -0.00 -0.65 -4.60 117.00 111.54 2k7y n LEU 64 Ca 0.17 -0.82 -0.12 0.00 -0.00 0.00 0.00 56.01 55.24 2k7y n LEU 64 Cb 0.57 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.84 2k7y n LEU 64 CO -0.08 0.20 -0.82 -1.20 -0.00 0.00 0.00 177.39 175.50 2k7y n SER 65 N -0.03 1.03 -0.05 1.45 7.64 -0.10 -3.88 113.62 119.68 2k7y n SER 65 Ca 0.00 0.22 0.15 0.00 1.01 0.00 0.00 58.87 60.25 2k7y n SER 65 Cb 0.04 -0.00 0.81 0.00 -1.01 0.00 0.00 64.21 64.05 2k7y n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k7y n ALA 66 N -2.76 2.63 0.04 -0.43 0.00 0.35 -2.71 120.51 117.63 2k7y n ALA 66 Ca -0.27 -0.21 0.10 0.00 0.00 0.00 0.00 53.44 53.06 2k7y n ALA 66 Cb 1.07 -1.46 -0.09 0.00 0.00 0.00 0.00 19.45 18.98 2k7y n ALA 66 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2k7y n LEU 67 N -0.99 0.45 0.01 0.00 -0.00 -1.25 -1.37 117.00 113.85 2k7y n LEU 67 Ca 0.19 0.18 -0.18 0.00 -0.00 0.00 0.00 56.01 56.20 2k7y n LEU 67 Cb 0.19 -0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.53 2k7y n LEU 67 CO 0.20 -0.06 0.20 0.58 -0.00 0.00 0.00 177.39 178.32 2k7y h VAL 68 N 0.00 1.29 0.00 1.96 2.07 -1.62 -3.41 116.25 116.54 2k7y h VAL 68 Ca -0.03 -2.09 0.00 0.00 0.82 0.00 0.00 66.70 65.40 2k7y h VAL 68 Cb 1.09 2.14 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 2k7y h VAL 68 CO 0.00 0.66 -0.52 1.21 0.02 0.00 0.00 177.57 178.94 2k7y n GLU 69 N -3.90 0.28 0.00 1.57 2.13 -1.24 -5.05 120.64 114.44 2k7y n GLU 69 Ca -0.09 0.11 0.00 0.00 0.66 0.00 0.00 57.16 57.84 2k7y n GLU 69 Cb 0.80 -0.96 0.00 0.00 0.27 0.00 0.00 31.44 31.54 2k7y n GLU 69 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2k7y n ARG 70 N -3.60 1.67 0.00 5.31 5.12 -0.47 -5.04 116.66 119.65 2k7y n ARG 70 Ca -0.07 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.85 2k7y n ARG 70 Cb 0.27 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.57 2k7y n ARG 70 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k7y n GLY 71 N 5.00 0.05 0.06 -0.13 0.00 -1.06 -4.15 105.19 104.95 2k7y n GLY 71 Ca 0.00 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.08 2k7y n GLY 71 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2k7y n HIS 72 N -0.53 0.37 -4.51 1.61 -0.00 -1.26 -4.84 115.22 106.06 2k7y n HIS 72 Ca 0.00 0.15 -0.41 0.00 -0.00 0.00 0.00 57.72 57.45 2k7y n HIS 72 Cb 0.00 -0.74 -0.08 0.00 -0.00 0.00 0.00 29.99 29.18 2k7y n HIS 72 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2k7y n LEU 73 N -1.84 -0.90 -3.19 2.39 4.77 -1.26 -4.82 117.00 112.15 2k7y n LEU 73 Ca 0.03 -1.24 -0.23 0.00 -0.03 0.00 0.00 56.01 54.54 2k7y n LEU 73 Cb 0.19 -1.63 -0.05 0.00 -2.33 0.00 0.00 43.42 39.59 2k7y n LEU 73 CO 0.16 0.15 -0.12 0.00 -1.33 0.00 0.00 177.39 176.24 2k7y n ALA 74 N -4.13 3.03 0.07 -1.18 0.00 -1.26 -4.89 120.51 112.14 2k7y n ALA 74 Ca 0.07 -3.91 -0.10 0.00 0.00 0.00 0.00 53.44 49.50 2k7y n ALA 74 Cb 0.48 -0.85 -0.00 0.00 0.00 0.00 0.00 19.45 19.08 2k7y n ALA 74 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2k7y h PRO 75 N 3.55 0.34 0.18 0.00 0.13 -1.97 -0.88 132.00 133.35 2k7y h PRO 75 Ca 0.12 -0.33 -0.33 0.00 -0.87 0.00 0.00 66.00 64.59 2k7y h PRO 75 Cb 0.80 0.08 0.01 0.00 0.13 0.00 0.00 31.00 32.02 2k7y h PRO 75 CO 0.61 1.00 -1.56 0.11 -0.23 0.00 0.00 178.00 177.93 2k7y h TRP 76 N 0.21 0.69 -2.16 1.56 0.09 -1.92 -3.35 115.95 111.07 2k7y h TRP 76 Ca -0.05 -0.50 -0.69 0.00 0.09 0.00 0.00 58.89 57.74 2k7y h TRP 76 Cb 1.44 -0.03 -0.35 0.00 0.08 0.00 0.00 29.16 30.31 2k7y h TRP 76 CO 0.04 1.52 0.18 -3.47 0.09 0.00 0.00 178.44 176.80 2k7y n ASP 77 N -3.57 5.95 0.06 0.11 -0.08 -1.22 -4.74 116.55 113.05 2k7y n ASP 77 Ca -0.18 -3.71 0.07 0.00 -1.51 0.00 0.00 54.79 49.46 2k7y n ASP 77 Cb 1.07 -0.84 0.33 0.00 2.34 0.00 0.00 41.12 44.02 2k7y n ASP 77 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 2k7y n VAL 78 N -0.23 1.20 -0.30 5.18 0.24 -0.34 -1.90 118.33 122.18 2k7y n VAL 78 Ca 0.40 0.38 -0.03 0.00 -2.04 0.00 0.00 64.34 63.06 2k7y n VAL 78 Cb 0.35 -1.28 0.13 0.00 -1.47 0.00 0.00 33.84 31.57 2k7y n VAL 78 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2k7y h ASP 79 N 0.00 1.06 -1.14 -1.34 3.58 -1.85 -3.15 116.42 113.57 2k7y h ASP 79 Ca 0.00 -0.08 -0.75 0.00 0.42 0.00 0.00 57.03 56.62 2k7y h ASP 79 Cb 0.18 -0.27 -0.13 0.00 1.72 0.00 0.00 39.33 40.83 2k7y h ASP 79 CO 0.00 0.83 2.21 -0.67 -2.88 0.00 0.00 179.24 178.74 2k7y n ASP 80 N -4.35 4.88 -0.38 2.28 -0.08 -0.80 -5.25 116.55 112.84 2k7y n ASP 80 Ca 0.09 -3.06 0.05 0.00 -1.51 0.00 0.00 54.79 50.36 2k7y n ASP 80 Cb 0.08 -1.51 0.04 0.00 2.34 0.00 0.00 41.12 42.07 2k7y n ASP 80 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21