#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 0.04 -1.11 1.61 0.02 -2.05 1.39 113.55 113.47 2k7y h SER 38 Ca 0.00 0.02 0.30 0.00 -0.84 0.00 0.00 61.79 61.28 2k7y h SER 38 Cb 0.00 0.02 -0.09 0.00 0.14 0.00 0.00 62.40 62.47 2k7y h SER 38 CO 0.00 -0.03 0.73 0.40 -1.14 0.00 0.00 176.83 176.79 2k7y h ILE 39 N 0.02 0.45 0.59 3.27 2.04 -2.07 0.55 117.51 122.36 2k7y h ILE 39 Ca 0.84 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 66.58 2k7y h ILE 39 Cb 3.24 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 39.47 2k7y h ILE 39 CO -0.08 0.05 -0.30 0.44 0.00 0.00 0.00 178.15 178.25 2k7y h ASP 40 N 0.27 -0.73 -0.42 1.72 5.19 0.15 -2.11 116.42 120.49 2k7y h ASP 40 Ca 0.62 0.03 -0.15 0.00 -0.62 0.00 0.00 57.03 56.91 2k7y h ASP 40 Cb 1.80 0.20 -0.09 0.00 0.18 0.00 0.00 39.33 41.42 2k7y h ASP 40 CO -0.26 -0.50 0.19 -2.11 -3.12 0.00 0.00 179.24 173.44 2k7y n ARG 41 N -5.45 2.28 -0.11 3.56 1.85 0.70 -4.02 116.66 115.48 2k7y n ARG 41 Ca -0.13 -1.61 -0.22 0.00 -1.00 0.00 0.00 57.85 54.89 2k7y n ARG 41 Cb 0.34 -1.75 -0.11 0.00 -1.05 0.00 0.00 32.46 29.89 2k7y n ARG 41 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2k7y n LEU 42 N -0.05 1.86 0.16 2.89 7.94 0.16 -3.90 117.00 126.06 2k7y n LEU 42 Ca 0.24 0.42 0.11 0.00 -1.11 0.00 0.00 56.01 55.67 2k7y n LEU 42 Cb 0.95 -0.96 0.58 0.00 0.53 0.00 0.00 43.42 44.52 2k7y n LEU 42 CO 0.25 0.28 0.84 -0.38 -1.11 0.00 0.00 177.39 177.28 2k7y n ILE 43 N -4.43 0.98 -0.30 1.96 5.41 -1.23 -1.43 119.36 120.31 2k7y n ILE 43 Ca -0.33 0.65 -0.04 0.00 1.00 0.00 0.00 62.75 64.04 2k7y n ILE 43 Cb 0.69 -1.64 0.08 0.00 -0.71 0.00 0.00 39.64 38.05 2k7y n ILE 43 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 2k7y h ASP 44 N 0.00 0.95 1.58 4.38 1.82 -1.78 1.89 116.42 125.26 2k7y h ASP 44 Ca 0.00 -0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.61 2k7y h ASP 44 Cb 0.07 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 39.84 2k7y h ASP 44 CO 0.00 0.69 -0.21 0.03 -1.61 0.00 0.00 179.24 178.14 2k7y h ARG 45 N 1.12 0.00 0.00 0.28 -0.00 -1.44 0.80 114.38 115.14 2k7y h ARG 45 Ca 0.30 0.00 -0.17 0.00 -0.50 0.00 0.00 59.98 59.61 2k7y h ARG 45 Cb -0.13 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 29.82 2k7y h ARG 45 CO -0.06 0.00 -1.32 0.82 0.00 0.00 0.00 179.97 179.41 2k7y h ILE 46 N 0.00 0.58 -0.01 2.04 1.08 -1.07 -3.34 117.51 116.79 2k7y h ILE 46 Ca 0.00 -2.08 0.00 0.00 -0.39 0.00 0.00 64.86 62.39 2k7y h ILE 46 Cb 0.90 2.11 0.00 0.00 -3.07 0.00 0.00 36.82 36.76 2k7y h ILE 46 CO 0.00 0.33 -0.23 1.07 -0.69 0.00 0.00 178.15 178.63 2k7y n THR 47 N -2.94 0.00 -0.62 -0.27 5.66 0.63 -4.58 114.28 112.16 2k7y n THR 47 Ca -0.09 -0.38 0.48 0.00 -3.05 0.00 0.00 64.05 61.01 2k7y n THR 47 Cb 0.84 1.14 0.76 0.00 -1.55 0.00 0.00 70.33 71.52 2k7y n THR 47 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2k7y n GLU 48 N -0.20 -0.01 0.16 1.09 -0.00 0.28 0.22 120.64 122.17 2k7y n GLU 48 Ca 0.05 1.13 0.17 0.00 -0.00 0.00 0.00 57.16 58.51 2k7y n GLU 48 Cb 0.24 -2.46 0.61 0.00 -0.00 0.00 0.00 31.44 29.83 2k7y n GLU 48 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.13 177.20 2k7y h ARG 49 N 0.00 0.00 0.00 3.44 0.11 -1.83 0.62 114.38 116.72 2k7y h ARG 49 Ca 0.91 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.99 2k7y h ARG 49 Cb 3.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 34.48 2k7y h ARG 49 CO -0.18 0.00 0.00 0.00 0.10 0.00 0.00 179.97 179.89 2k7y n ALA 50 N -2.04 0.00 -0.04 0.08 0.00 0.59 -3.94 120.51 115.15 2k7y n ALA 50 Ca 0.06 -0.02 0.24 0.00 0.00 0.00 0.00 53.44 53.73 2k7y n ALA 50 Cb 0.74 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.86 2k7y n ALA 50 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2k7y h GLU 51 N 0.00 0.00 -1.45 0.00 -0.00 -1.51 0.17 114.58 111.80 2k7y h GLU 51 Ca 0.00 0.00 0.42 0.00 -0.00 0.00 0.00 59.36 59.78 2k7y h GLU 51 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 28.75 28.69 2k7y h GLU 51 CO 0.00 0.00 1.19 0.22 -0.00 0.00 0.00 179.01 180.42 2k7y h ASP 52 N 0.00 0.00 0.00 3.06 1.82 0.10 -3.25 116.42 118.15 2k7y h ASP 52 Ca 0.32 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.96 2k7y h ASP 52 Cb 1.73 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.74 2k7y h ASP 52 CO -0.00 0.00 0.00 -0.24 -1.61 0.00 0.00 179.24 177.39 2k7y n SER 53 N -3.75 0.26 -0.76 2.28 2.88 0.45 -5.03 113.62 109.94 2k7y n SER 53 Ca 0.32 0.08 -0.02 0.00 -1.33 0.00 0.00 58.87 57.92 2k7y n SER 53 Cb 1.64 -0.05 -0.02 0.00 -0.75 0.00 0.00 64.21 65.03 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 3.00 -0.16 5.00 0.46 0.00 -0.95 -4.99 105.19 107.56 2k7y n GLY 54 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.04 0.00 -3.47 1.61 5.15 -0.30 -4.75 115.26 113.46 2k7y n ASN 55 Ca -0.09 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.53 2k7y n ASN 55 Cb 0.42 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.61 2k7y n ASN 55 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2k7y n GLU 56 N 0.00 1.18 0.00 1.20 1.02 -1.26 -2.14 120.64 120.64 2k7y n GLU 56 Ca 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 57.16 55.64 2k7y n GLU 56 Cb 0.00 -2.68 0.00 0.00 -0.02 0.00 0.00 31.44 28.74 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 7.02 0.00 -0.65 1.62 2.88 -1.26 -4.95 113.62 118.28 2k7y n SER 57 Ca 0.44 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 2k7y n SER 57 Cb 0.33 0.15 -0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 -1.90 0.00 0.00 -1.46 1.02 -1.09 -5.04 120.64 112.18 2k7y n GLU 58 Ca 0.00 -0.93 0.00 0.00 -0.02 0.00 0.00 57.16 56.21 2k7y n GLU 58 Cb 0.00 -0.30 0.00 0.00 -0.02 0.00 0.00 31.44 31.12 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 0.06 -2.36 5.00 0.62 0.00 -0.91 -4.55 105.19 103.05 2k7y n GLY 59 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.26 1.61 8.00 -1.26 -4.11 116.55 120.53 2k7y n ASP 60 Ca 0.00 0.00 0.24 0.00 0.71 0.00 0.00 54.79 55.74 2k7y n ASP 60 Cb 0.00 0.00 0.58 0.00 -0.02 0.00 0.00 41.12 41.68 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 0.27 0.00 -1.24 5.75 -2.01 -3.40 115.11 114.48 2k7y h GLN 61 Ca 0.00 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 2k7y h GLN 61 Cb 0.00 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.49 2k7y h GLN 61 CO 0.00 0.18 0.00 -0.85 -2.65 0.00 0.00 178.83 175.51 2k7y n GLU 62 N -4.46 2.27 0.00 1.69 0.28 -1.26 -3.48 120.64 115.69 2k7y n GLU 62 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 2k7y n GLU 62 Cb 0.85 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.72 2k7y n GLU 62 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2k7y n GLU 63 N 0.00 0.00 -0.00 3.44 2.13 -1.26 -2.95 120.64 122.00 2k7y n GLU 63 Ca 0.00 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.91 2k7y n GLU 63 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 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 0.00 0.77 -0.01 4.31 -0.00 -1.26 -3.96 117.00 116.86 2k7y n LEU 64 Ca 0.00 -0.45 0.07 0.00 -0.00 0.00 0.00 56.01 55.63 2k7y n LEU 64 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.31 2k7y n LEU 64 CO 0.00 0.19 -0.66 -1.20 -0.00 0.00 0.00 177.39 175.72 2k7y n SER 65 N -1.50 1.75 -0.35 1.45 7.64 -1.15 -3.77 113.62 117.69 2k7y n SER 65 Ca 0.03 -0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.04 2k7y n SER 65 Cb 0.30 1.64 0.43 0.00 -1.01 0.00 0.00 64.21 65.58 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 -1.99 2.87 -0.11 -0.43 0.00 -1.26 -2.90 120.51 116.68 2k7y n ALA 66 Ca -0.03 -0.43 -0.18 0.00 0.00 0.00 0.00 53.44 52.80 2k7y n ALA 66 Cb 0.37 -1.14 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.28 2.42 -0.12 0.00 -0.00 -1.25 -2.38 117.00 115.39 2k7y n LEU 67 Ca 0.15 0.04 -0.10 0.00 -0.00 0.00 0.00 56.01 56.10 2k7y n LEU 67 Cb 0.36 -0.70 -0.02 0.00 -0.00 0.00 0.00 43.42 43.05 2k7y n LEU 67 CO 0.22 0.70 0.84 1.62 -0.00 0.00 0.00 177.39 180.77 2k7y h VAL 68 N -0.33 1.23 0.00 1.96 3.04 -1.69 -3.39 116.25 117.07 2k7y h VAL 68 Ca -0.51 -0.79 0.00 0.00 -1.01 0.00 0.00 66.70 64.39 2k7y h VAL 68 Cb 1.63 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 31.98 2k7y h VAL 68 CO -0.18 0.27 0.00 -0.62 -1.01 0.00 0.00 177.57 176.02 2k7y n GLU 69 N -4.59 0.00 0.00 4.17 -0.58 -1.14 -5.01 120.64 113.48 2k7y n GLU 69 Ca -0.01 0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 2k7y n GLU 69 Cb 0.21 -0.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.66 2k7y n GLU 69 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2k7y n ARG 70 N -1.73 -0.97 0.00 3.49 5.12 -1.18 -5.00 116.66 116.39 2k7y n ARG 70 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2k7y n ARG 70 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 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 2.22 0.09 0.03 -0.13 0.00 -1.00 -4.01 105.19 102.38 2k7y n GLY 71 Ca 0.00 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.69 0.18 -4.35 1.61 -0.00 -1.26 -4.85 115.22 105.86 2k7y n HIS 72 Ca 0.00 0.07 -0.37 0.00 -0.00 0.00 0.00 57.72 57.41 2k7y n HIS 72 Cb 0.00 -0.61 -0.06 0.00 -0.00 0.00 0.00 29.99 29.32 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 -1.66 -1.28 -3.17 2.39 4.77 -1.26 -4.85 117.00 111.94 2k7y n LEU 73 Ca 0.04 -1.15 -0.22 0.00 -0.03 0.00 0.00 56.01 54.64 2k7y n LEU 73 Cb 0.20 -1.83 -0.05 0.00 -2.33 0.00 0.00 43.42 39.42 2k7y n LEU 73 CO 0.16 0.25 -0.13 0.00 -1.33 0.00 0.00 177.39 176.34 2k7y n ALA 74 N -4.28 2.90 0.21 -1.18 0.00 -1.26 -4.88 120.51 112.01 2k7y n ALA 74 Ca 0.01 -3.83 0.09 0.00 0.00 0.00 0.00 53.44 49.71 2k7y n ALA 74 Cb 0.52 -0.86 0.33 0.00 0.00 0.00 0.00 19.45 19.44 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 3.39 0.00 0.00 0.00 0.13 -1.96 0.23 132.00 133.79 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 0.82 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.88 2k7y h PRO 75 CO 0.59 0.22 -2.11 -2.67 -0.23 0.00 0.00 178.00 173.80 2k7y n TRP 76 N -3.26 0.39 -1.62 1.56 2.14 -1.26 -4.19 117.44 111.20 2k7y n TRP 76 Ca 0.01 0.14 -0.24 0.00 2.07 0.00 0.00 57.50 59.49 2k7y n TRP 76 Cb 0.51 -1.07 0.09 0.00 -0.81 0.00 0.00 31.31 30.03 2k7y n TRP 76 CO 0.00 0.00 0.00 -3.47 2.07 0.00 0.00 177.69 176.29 2k7y n ASP 77 N -2.86 5.35 -0.36 -0.67 2.03 -1.17 -4.77 116.55 114.10 2k7y n ASP 77 Ca -0.26 -3.77 0.06 0.00 0.52 0.00 0.00 54.79 51.34 2k7y n ASP 77 Cb 1.11 -0.65 0.14 0.00 -0.72 0.00 0.00 41.12 40.99 2k7y n ASP 77 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2k7y h VAL 78 N 1.46 0.01 -5.01 5.18 -1.51 -0.71 -3.43 116.25 112.25 2k7y h VAL 78 Ca 0.44 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.83 2k7y h VAL 78 Cb 1.37 0.01 -0.05 0.00 -2.13 0.00 0.00 31.29 30.49 2k7y h VAL 78 CO 1.00 0.00 -0.11 -0.67 -1.23 0.00 0.00 177.57 176.56 2k7y n ASP 79 N -5.62 -1.03 0.00 4.19 -0.08 -1.26 -3.51 116.55 109.24 2k7y n ASP 79 Ca 0.16 0.26 0.00 0.00 -1.51 0.00 0.00 54.79 53.69 2k7y n ASP 79 Cb 0.49 -1.00 0.00 0.00 2.34 0.00 0.00 41.12 42.95 2k7y n ASP 79 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2k7y n ASP 80 N -1.50 -0.08 0.00 1.67 -0.08 -1.26 -5.27 116.55 110.02 2k7y n ASP 80 Ca 0.01 0.04 0.16 0.00 -1.51 0.00 0.00 54.79 53.49 2k7y n ASP 80 Cb 0.46 0.23 0.94 0.00 2.34 0.00 0.00 41.12 45.09 2k7y n ASP 80 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50