#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7y n SER 38 N 0.00 1.30 0.02 1.61 7.64 -1.26 -4.52 113.62 118.42 2k7y n SER 38 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 2k7y n SER 38 Cb 0.00 1.63 -0.04 0.00 -1.01 0.00 0.00 64.21 64.79 2k7y n SER 38 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2k7y h ILE 39 N 0.00 0.30 0.00 0.44 2.04 -2.06 2.10 117.51 120.34 2k7y h ILE 39 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2k7y h ILE 39 Cb 0.89 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2k7y h ILE 39 CO 0.00 0.00 0.17 0.44 0.00 0.00 0.00 178.15 178.76 2k7y h ASP 40 N -0.41 0.00 0.00 1.72 5.19 -1.96 0.77 116.42 121.72 2k7y h ASP 40 Ca 0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2k7y h ASP 40 Cb 0.54 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.05 2k7y h ASP 40 CO -0.32 0.00 -1.71 -1.14 -3.12 0.00 0.00 179.24 172.95 2k7y n ARG 41 N -2.71 0.51 0.23 3.56 0.00 0.25 -4.23 116.66 114.27 2k7y n ARG 41 Ca -0.02 -0.14 -0.15 0.00 -0.00 0.00 0.00 57.85 57.53 2k7y n ARG 41 Cb 0.21 -1.50 -0.08 0.00 0.00 0.00 0.00 32.46 31.09 2k7y n ARG 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2k7y h LEU 42 N 0.00 -0.55 -0.69 6.15 7.12 0.98 -2.42 115.31 125.90 2k7y h LEU 42 Ca 0.00 0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.11 2k7y h LEU 42 Cb 0.84 0.16 -0.06 0.00 -0.53 0.00 0.00 40.66 41.07 2k7y h LEU 42 CO 0.00 -0.36 0.37 0.40 -0.13 0.00 0.00 178.44 178.72 2k7y h ILE 43 N -0.58 0.92 -1.31 4.05 2.04 -1.74 0.15 117.51 121.04 2k7y h ILE 43 Ca -0.04 -0.23 0.38 0.00 1.00 0.00 0.00 64.86 65.97 2k7y h ILE 43 Cb 0.47 0.21 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 2k7y h ILE 43 CO 0.05 0.12 0.92 -0.78 0.00 0.00 0.00 178.15 178.47 2k7y h ASP 44 N 0.66 0.09 0.73 1.72 3.58 -1.62 2.57 116.42 124.16 2k7y h ASP 44 Ca 0.32 0.03 -0.26 0.00 0.42 0.00 0.00 57.03 57.54 2k7y h ASP 44 Cb 0.25 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 2k7y h ASP 44 CO -0.21 -0.01 -1.25 0.03 -2.88 0.00 0.00 179.24 174.93 2k7y h ARG 45 N 0.07 0.14 0.00 0.28 -0.00 -0.44 0.81 114.38 115.23 2k7y h ARG 45 Ca 0.66 -0.23 -0.16 0.00 -0.50 0.00 0.00 59.98 59.74 2k7y h ARG 45 Cb 2.44 0.09 -0.02 0.00 0.00 0.00 0.00 29.97 32.47 2k7y h ARG 45 CO -0.09 1.05 -0.75 0.82 0.00 0.00 0.00 179.97 180.99 2k7y h ILE 46 N 0.04 1.30 -0.02 2.04 1.08 0.31 -3.20 117.51 119.06 2k7y h ILE 46 Ca -0.12 -2.83 0.00 0.00 -0.39 0.00 0.00 64.86 61.52 2k7y h ILE 46 Cb 1.91 2.63 0.00 0.00 -3.07 0.00 0.00 36.82 38.29 2k7y h ILE 46 CO 0.16 0.74 -0.10 1.07 -0.69 0.00 0.00 178.15 179.32 2k7y n THR 47 N -3.30 0.00 -0.40 -0.27 5.66 0.73 -4.51 114.28 112.19 2k7y n THR 47 Ca 0.01 -0.45 0.33 0.00 -3.05 0.00 0.00 64.05 60.89 2k7y n THR 47 Cb 0.84 1.31 0.61 0.00 -1.55 0.00 0.00 70.33 71.54 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 2.92 0.17 -0.45 1.09 -0.00 0.65 1.65 114.58 120.61 2k7y h GLU 48 Ca 0.00 -0.01 0.13 0.00 -0.00 0.00 0.00 59.36 59.48 2k7y h GLU 48 Cb 0.67 -0.04 -0.02 0.00 -0.00 0.00 0.00 28.75 29.36 2k7y h GLU 48 CO 0.00 0.11 0.50 0.07 -0.00 0.00 0.00 179.01 179.70 2k7y h ARG 49 N 0.17 0.00 0.02 1.06 -0.00 -1.81 1.39 114.38 115.22 2k7y h ARG 49 Ca 0.75 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 60.73 2k7y h ARG 49 Cb 2.25 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 32.22 2k7y h ARG 49 CO -0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 179.97 179.59 2k7y h ALA 50 N 1.42 -0.33 -0.01 0.08 0.00 0.21 -3.28 119.26 117.35 2k7y h ALA 50 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2k7y h ALA 50 Cb 1.22 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k7y h ALA 50 CO -0.00 -0.32 0.02 1.05 0.00 0.00 0.00 179.25 180.00 2k7y h GLU 51 N -0.08 0.00 0.00 0.00 4.11 -1.47 1.63 114.58 118.77 2k7y h GLU 51 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2k7y h GLU 51 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2k7y h GLU 51 CO 0.00 0.00 0.08 0.22 0.07 0.00 0.00 179.01 179.38 2k7y h ASP 52 N 0.00 0.00 0.00 3.06 3.58 0.18 -3.31 116.42 119.93 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 0.05 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2k7y h ASP 52 CO -0.00 0.00 -0.07 -1.20 -2.88 0.00 0.00 179.24 175.09 2k7y n SER 53 N -2.68 0.10 0.00 2.28 7.64 0.14 -5.05 113.62 116.05 2k7y n SER 53 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2k7y n SER 53 Cb 0.13 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 2k7y n SER 53 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k7y n GLY 54 N 1.61 -0.89 0.61 0.23 0.00 0.53 -4.99 105.19 102.30 2k7y n GLY 54 Ca 0.00 0.76 0.40 0.00 0.00 0.00 0.00 46.02 47.18 2k7y n GLY 54 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2k7y h ASN 55 N 0.00 0.00 -0.36 1.61 -0.00 -1.63 1.43 115.58 116.63 2k7y h ASN 55 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 56.30 56.07 2k7y h ASN 55 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 38.32 38.22 2k7y h ASN 55 CO 0.00 0.00 0.30 -0.62 -0.00 0.00 0.00 177.43 177.11 2k7y n GLU 56 N -3.69 1.57 0.00 6.67 1.02 -1.26 -1.09 120.64 123.86 2k7y n GLU 56 Ca 0.32 -1.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.31 2k7y n GLU 56 Cb 1.68 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 31.65 2k7y n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2k7y n SER 57 N 0.49 2.31 -0.90 1.62 2.88 0.49 -4.90 113.62 115.60 2k7y n SER 57 Ca 0.22 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.75 2k7y n SER 57 Cb 0.63 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.07 2k7y n SER 57 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k7y n GLU 58 N -2.20 0.00 0.00 -1.46 1.02 -1.24 -5.05 120.64 111.72 2k7y n GLU 58 Ca 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 57.16 56.18 2k7y n GLU 58 Cb 0.32 0.10 0.00 0.00 -0.02 0.00 0.00 31.44 31.84 2k7y n GLU 58 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k7y n GLY 59 N 0.11 0.00 5.16 0.62 0.00 -0.25 -4.52 105.19 106.32 2k7y n GLY 59 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 0.00 0.00 -0.35 1.61 9.92 -1.26 -3.75 116.55 122.72 2k7y n ASP 60 Ca 0.00 0.00 0.23 0.00 -0.53 0.00 0.00 54.79 54.49 2k7y n ASP 60 Cb 0.00 0.00 0.47 0.00 -0.64 0.00 0.00 41.12 40.95 2k7y n ASP 60 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 2k7y h GLN 61 N 0.00 0.41 0.00 -1.24 5.75 -1.99 1.45 115.11 119.48 2k7y h GLN 61 Ca 0.00 -0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 58.37 2k7y h GLN 61 Cb 0.00 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 2k7y h GLN 61 CO 0.00 0.27 -0.50 1.05 -2.65 0.00 0.00 178.83 177.00 2k7y h GLU 62 N 0.42 0.00 -0.23 1.69 4.11 -1.92 0.20 114.58 118.85 2k7y h GLU 62 Ca 0.66 0.00 0.07 0.00 0.07 0.00 0.00 59.36 60.16 2k7y h GLU 62 Cb 1.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.78 2k7y h GLU 62 CO -0.43 0.50 0.60 1.49 0.07 0.00 0.00 179.01 181.24 2k7y h GLU 63 N 0.00 0.00 0.00 1.06 4.81 0.17 1.62 114.58 122.24 2k7y h GLU 63 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2k7y h GLU 63 Cb 0.93 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.31 2k7y h GLU 63 CO 0.06 0.00 -0.92 1.47 -0.73 0.00 0.00 179.01 178.90 2k7y n LEU 64 N -3.08 2.13 -0.03 1.64 -0.00 -1.07 -4.41 117.00 112.17 2k7y n LEU 64 Ca 0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.91 2k7y n LEU 64 Cb 0.70 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 44.03 2k7y n LEU 64 CO 0.16 0.35 0.55 0.28 -0.00 0.00 0.00 177.39 178.74 2k7y h SER 65 N 0.00 0.22 0.17 1.45 0.02 0.11 -2.76 113.55 112.75 2k7y h SER 65 Ca 0.00 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 2k7y h SER 65 Cb 0.92 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2k7y h SER 65 CO 0.00 0.75 0.00 0.00 -1.14 0.00 0.00 176.83 176.44 2k7y n ALA 66 N -2.43 2.35 -0.94 3.77 0.00 0.55 -2.06 120.51 121.74 2k7y n ALA 66 Ca -0.08 -0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.30 2k7y n ALA 66 Cb 0.37 -1.40 0.32 0.00 0.00 0.00 0.00 19.45 18.74 2k7y n ALA 66 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k7y n LEU 67 N -1.11 4.63 0.00 0.00 7.99 -1.02 -3.41 117.00 124.08 2k7y n LEU 67 Ca 0.16 -2.96 0.00 0.00 -0.01 0.00 0.00 56.01 53.20 2k7y n LEU 67 Cb 0.12 -0.60 0.00 0.00 -0.11 0.00 0.00 43.42 42.84 2k7y n LEU 67 CO 0.16 0.66 -0.28 0.52 -1.51 0.00 0.00 177.39 176.94 2k7y n VAL 68 N -0.02 0.00 -0.11 4.08 0.31 -0.87 -4.94 118.33 116.78 2k7y n VAL 68 Ca 0.24 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.34 2k7y n VAL 68 Cb 1.01 -1.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.86 2k7y n VAL 68 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2k7y n GLU 69 N -2.73 0.45 -2.12 5.55 1.02 -1.13 -4.96 120.64 116.73 2k7y n GLU 69 Ca 0.00 0.20 -0.42 0.00 -0.02 0.00 0.00 57.16 56.92 2k7y n GLU 69 Cb 0.28 -1.26 -0.03 0.00 -0.02 0.00 0.00 31.44 30.42 2k7y n GLU 69 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2k7y s ARG 70 N -2.39 4.28 -0.04 3.49 1.81 -1.22 -4.88 118.95 120.01 2k7y s ARG 70 Ca -0.30 2.12 0.03 0.00 -1.72 0.00 0.00 55.73 55.86 2k7y s ARG 70 Cb 0.11 -3.34 -0.04 0.00 -0.45 0.00 0.00 34.95 31.23 2k7y s ARG 70 CO 0.37 -0.52 -0.00 0.41 -0.68 0.00 0.00 175.30 174.88 2k7y n GLY 71 N 3.62 -0.15 0.10 -3.53 0.00 -1.26 -4.23 105.19 99.75 2k7y n GLY 71 Ca 0.13 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.25 0.69 -3.58 1.61 -0.00 -1.26 -4.85 115.22 105.57 2k7y n HIS 72 Ca -0.06 0.26 -0.25 0.00 -0.00 0.00 0.00 57.72 57.66 2k7y n HIS 72 Cb 0.61 -0.91 -0.03 0.00 -0.00 0.00 0.00 29.99 29.66 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 -2.11 -1.07 -3.20 2.39 4.77 -1.26 -4.83 117.00 111.68 2k7y n LEU 73 Ca 0.03 -0.50 -0.23 0.00 -0.03 0.00 0.00 56.01 55.28 2k7y n LEU 73 Cb 0.26 -1.76 -0.06 0.00 -2.33 0.00 0.00 43.42 39.53 2k7y n LEU 73 CO 0.21 0.12 -0.15 0.00 -1.33 0.00 0.00 177.39 176.24 2k7y n ALA 74 N -3.53 2.95 0.17 -1.18 0.00 -1.26 -4.89 120.51 112.77 2k7y n ALA 74 Ca 0.03 -3.85 0.04 0.00 0.00 0.00 0.00 53.44 49.66 2k7y n ALA 74 Cb 0.50 -0.85 0.22 0.00 0.00 0.00 0.00 19.45 19.33 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 3.63 0.00 0.04 0.00 0.13 -1.98 1.44 132.00 135.26 2k7y h PRO 75 Ca 0.11 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.91 2k7y h PRO 75 Cb 0.81 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.90 2k7y h PRO 75 CO 0.59 0.43 -1.84 -2.67 -0.23 0.00 0.00 178.00 174.29 2k7y n TRP 76 N -3.41 0.83 -0.06 1.56 2.14 -1.26 -4.33 117.44 112.90 2k7y n TRP 76 Ca 0.01 0.27 -0.15 0.00 2.07 0.00 0.00 57.50 59.69 2k7y n TRP 76 Cb 0.60 -1.09 -0.06 0.00 -0.81 0.00 0.00 31.31 29.94 2k7y n TRP 76 CO 0.00 0.00 0.00 0.22 2.07 0.00 0.00 177.69 179.98 2k7y h ASP 77 N -0.54 0.85 -6.89 -0.67 1.82 -1.93 -3.48 116.42 105.58 2k7y h ASP 77 Ca -0.46 -0.56 -0.57 0.00 -0.39 0.00 0.00 57.03 55.06 2k7y h ASP 77 Cb 1.66 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 41.41 2k7y h ASP 77 CO -0.14 1.25 -1.04 1.33 -1.61 0.00 0.00 179.24 179.03 2k7y n VAL 78 N -4.10 -2.92 -0.03 2.25 0.24 0.49 -4.88 118.33 109.38 2k7y n VAL 78 Ca -0.06 -0.41 -0.08 0.00 -2.04 0.00 0.00 64.34 61.75 2k7y n VAL 78 Cb 0.61 -2.50 -0.03 0.00 -1.47 0.00 0.00 33.84 30.45 2k7y n VAL 78 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2k7y n ASP 79 N -2.30 1.05 -4.15 -1.34 2.03 -1.26 -4.79 116.55 105.78 2k7y n ASP 79 Ca -0.18 0.17 -0.41 0.00 0.52 0.00 0.00 54.79 54.88 2k7y n ASP 79 Cb 0.61 -0.39 -0.01 0.00 -0.72 0.00 0.00 41.12 40.60 2k7y n ASP 79 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2k7y n ASP 80 N -3.65 4.12 0.00 1.67 -0.08 -1.26 -5.19 116.55 112.15 2k7y n ASP 80 Ca -0.15 -2.85 0.00 0.00 -1.51 0.00 0.00 54.79 50.29 2k7y n ASP 80 Cb 0.47 -1.65 0.00 0.00 2.34 0.00 0.00 41.12 42.27 2k7y n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32