#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 0.00 0.13 1.61 0.02 -2.04 -2.69 113.55 110.59 2k7y h SER 38 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2k7y h SER 38 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2k7y h SER 38 CO 0.00 0.51 -0.09 0.40 -1.14 0.00 0.00 176.83 176.51 2k7y h ILE 39 N 0.00 0.87 0.16 3.27 2.04 -2.07 1.12 117.51 122.90 2k7y h ILE 39 Ca -0.01 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2k7y h ILE 39 Cb 1.03 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2k7y h ILE 39 CO 0.07 0.09 -0.08 -0.78 0.00 0.00 0.00 178.15 177.45 2k7y h ASP 40 N 0.00 -0.18 -0.21 1.72 3.58 -1.97 -3.13 116.42 116.23 2k7y h ASP 40 Ca -0.00 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2k7y h ASP 40 Cb 0.18 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2k7y h ASP 40 CO 0.01 0.36 0.00 -2.11 -2.88 0.00 0.00 179.24 174.63 2k7y n ARG 41 N -4.93 1.68 0.12 0.28 1.85 -0.98 -3.70 116.66 110.98 2k7y n ARG 41 Ca -0.08 -0.85 -0.03 0.00 -1.00 0.00 0.00 57.85 55.89 2k7y n ARG 41 Cb 0.27 -1.31 0.16 0.00 -1.05 0.00 0.00 32.46 30.53 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 1.30 0.13 -1.69 2.89 5.85 0.14 -2.73 115.31 121.19 2k7y h LEU 42 Ca 0.00 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.70 2k7y h LEU 42 Cb 0.46 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2k7y h LEU 42 CO 0.04 0.69 0.30 0.40 -0.34 0.00 0.00 178.44 179.53 2k7y h ILE 43 N 0.08 0.97 -0.87 4.05 2.04 -1.74 0.71 117.51 122.76 2k7y h ILE 43 Ca -0.01 -0.13 0.18 0.00 1.00 0.00 0.00 64.86 65.90 2k7y h ILE 43 Cb 1.06 0.55 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 2k7y h ILE 43 CO 0.08 0.07 0.57 -0.78 0.00 0.00 0.00 178.15 178.09 2k7y h ASP 44 N 0.38 0.48 1.94 1.72 3.58 -1.76 1.88 116.42 124.64 2k7y h ASP 44 Ca 0.20 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.69 2k7y h ASP 44 Cb 0.29 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.29 2k7y h ASP 44 CO -0.05 0.22 -0.04 0.03 -2.88 0.00 0.00 179.24 176.52 2k7y h ARG 45 N 0.49 0.00 0.00 0.28 2.47 -1.01 1.48 114.38 118.10 2k7y h ARG 45 Ca 0.45 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 59.04 2k7y h ARG 45 Cb 0.98 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.27 2k7y h ARG 45 CO -0.18 0.00 -1.39 -0.89 0.56 0.00 0.00 179.97 178.07 2k7y n ILE 46 N -3.05 1.00 0.38 2.04 2.08 0.31 -4.01 119.36 118.10 2k7y n ILE 46 Ca 0.04 -0.65 0.04 0.00 0.56 0.00 0.00 62.75 62.74 2k7y n ILE 46 Cb 0.53 -0.60 0.03 0.00 -0.75 0.00 0.00 39.64 38.84 2k7y n ILE 46 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2k7y n THR 47 N -2.80 0.00 -0.32 1.39 5.66 0.56 -4.66 114.28 114.10 2k7y n THR 47 Ca -0.08 -0.47 0.14 0.00 -3.05 0.00 0.00 64.05 60.59 2k7y n THR 47 Cb 0.77 1.16 0.27 0.00 -1.55 0.00 0.00 70.33 70.98 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 0.26 -0.07 -0.65 1.09 0.28 0.51 0.22 120.64 122.27 2k7y n GLU 48 Ca 0.05 1.39 0.50 0.00 -0.16 0.00 0.00 57.16 58.93 2k7y n GLU 48 Cb 0.21 -2.20 0.77 0.00 1.43 0.00 0.00 31.44 31.65 2k7y n GLU 48 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 2k7y n ARG 49 N -5.37 0.00 0.10 3.44 -4.01 -1.26 0.19 116.66 109.76 2k7y n ARG 49 Ca 0.22 1.06 -0.04 0.00 -1.04 0.00 0.00 57.85 58.04 2k7y n ARG 49 Cb 0.71 -2.46 -0.02 0.00 -3.04 0.00 0.00 32.46 27.65 2k7y n ARG 49 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2k7y h ALA 50 N 0.93 -0.76 0.00 2.89 0.00 0.22 -3.04 119.26 119.50 2k7y h ALA 50 Ca 0.88 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.73 2k7y h ALA 50 Cb 3.63 0.10 0.00 0.00 0.00 0.00 0.00 17.79 21.53 2k7y h ALA 50 CO -0.01 -0.74 0.00 -0.85 0.00 0.00 0.00 179.25 177.65 2k7y n GLU 51 N -2.95 0.24 -1.23 0.00 0.00 0.10 0.15 120.64 116.96 2k7y n GLU 51 Ca -0.03 0.12 -0.24 0.00 0.00 0.00 0.00 57.16 57.01 2k7y n GLU 51 Cb 0.10 -1.50 0.15 0.00 0.00 0.00 0.00 31.44 30.20 2k7y n GLU 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2k7y n ASP 52 N -1.29 4.54 0.00 -1.84 9.92 0.51 -4.62 116.55 123.77 2k7y n ASP 52 Ca 0.08 -3.68 0.00 0.00 -0.53 0.00 0.00 54.79 50.66 2k7y n ASP 52 Cb 0.14 -0.83 0.00 0.00 -0.64 0.00 0.00 41.12 39.79 2k7y n ASP 52 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2k7y n SER 53 N -1.08 0.00 0.00 -2.24 2.88 -0.97 -4.82 113.62 107.38 2k7y n SER 53 Ca 0.57 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.11 2k7y n SER 53 Cb 1.35 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.81 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 0.00 -0.96 0.54 0.46 0.00 0.41 -4.99 105.19 100.65 2k7y n GLY 54 Ca 0.00 0.68 0.33 0.00 0.00 0.00 0.00 46.02 47.03 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 -0.35 1.61 -1.24 -0.43 0.65 115.58 115.82 2k7y h ASN 55 Ca 0.00 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 56.78 2k7y h ASN 55 Cb 0.00 0.00 -0.10 0.00 0.73 0.00 0.00 38.32 38.95 2k7y h ASN 55 CO 0.00 0.00 0.24 -0.62 -1.29 0.00 0.00 177.43 175.76 2k7y n GLU 56 N -3.61 1.63 0.00 6.67 1.02 -1.26 -1.37 120.64 123.71 2k7y n GLU 56 Ca 0.25 -1.13 0.00 0.00 -0.02 0.00 0.00 57.16 56.26 2k7y n GLU 56 Cb 1.41 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 31.32 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 0.89 1.29 -1.17 1.62 2.88 0.23 -4.91 113.62 114.44 2k7y n SER 57 Ca 0.24 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.77 2k7y n SER 57 Cb 0.57 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.02 2k7y n SER 57 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2k7y n GLU 58 N -2.15 0.00 -0.58 -1.46 4.07 -1.23 -4.99 120.64 114.30 2k7y n GLU 58 Ca 0.00 -1.46 -0.18 0.00 -0.06 0.00 0.00 57.16 55.46 2k7y n GLU 58 Cb 0.22 0.10 -0.02 0.00 -0.06 0.00 0.00 31.44 31.69 2k7y n GLU 58 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k7y n GLY 59 N 0.26 2.70 0.08 8.31 0.00 -0.47 -4.28 105.19 111.78 2k7y n GLY 59 Ca -0.06 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 2k7y n GLY 59 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2k7y h ASP 60 N 6.86 0.10 0.07 1.61 3.32 -1.94 -3.24 116.42 123.20 2k7y h ASP 60 Ca 0.37 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 57.19 2k7y h ASP 60 Cb 0.16 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.68 2k7y h ASP 60 CO 1.38 1.10 -0.50 -0.61 -1.72 0.00 0.00 179.24 178.88 2k7y h GLN 61 N 0.02 0.15 0.00 3.56 4.15 -1.99 -3.24 115.11 117.76 2k7y h GLN 61 Ca -0.10 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2k7y h GLN 61 Cb 1.87 0.09 0.00 0.00 0.21 0.00 0.00 27.48 29.65 2k7y h GLN 61 CO 0.13 1.12 0.29 0.93 -1.93 0.00 0.00 178.83 179.38 2k7y h GLU 62 N -0.68 0.00 -0.80 1.69 5.08 -1.90 -2.41 114.58 115.56 2k7y h GLU 62 Ca -0.10 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.51 2k7y h GLU 62 Cb 1.34 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.45 2k7y h GLU 62 CO 0.06 0.00 0.11 -1.91 -1.00 0.00 0.00 179.01 176.27 2k7y n GLU 63 N -2.66 -0.06 0.00 2.33 2.13 -1.22 0.18 120.64 121.33 2k7y n GLU 63 Ca -0.02 1.17 0.00 0.00 0.66 0.00 0.00 57.16 58.98 2k7y n GLU 63 Cb 0.33 -1.92 0.00 0.00 0.27 0.00 0.00 31.44 30.12 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 -5.06 0.77 0.01 4.31 -0.00 -0.97 -4.66 117.00 111.41 2k7y n LEU 64 Ca 0.21 -0.77 0.11 0.00 -0.00 0.00 0.00 56.01 55.56 2k7y n LEU 64 Cb 0.71 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 44.06 2k7y n LEU 64 CO -0.04 0.19 -0.20 -1.20 -0.00 0.00 0.00 177.39 176.13 2k7y n SER 65 N -0.12 0.58 0.03 1.45 7.64 0.07 -3.03 113.62 120.23 2k7y n SER 65 Ca 0.00 -0.40 0.12 0.00 1.01 0.00 0.00 58.87 59.60 2k7y n SER 65 Cb 0.23 1.16 0.30 0.00 -1.01 0.00 0.00 64.21 64.88 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 -1.83 3.00 -0.12 -0.43 0.00 0.13 -3.31 120.51 117.94 2k7y n ALA 66 Ca 0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 53.44 53.05 2k7y n ALA 66 Cb 0.44 -1.23 -0.12 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.80 2.65 0.04 0.00 -0.00 -1.25 -2.73 117.00 113.91 2k7y n LEU 67 Ca 0.05 -0.12 -0.11 0.00 -0.00 0.00 0.00 56.01 55.84 2k7y n LEU 67 Cb 0.38 -0.70 -0.04 0.00 -0.00 0.00 0.00 43.42 43.07 2k7y n LEU 67 CO 0.34 0.86 0.75 -0.37 -0.00 0.00 0.00 177.39 178.97 2k7y h VAL 68 N 0.00 0.59 0.00 1.96 -1.51 -1.65 -3.40 116.25 112.25 2k7y h VAL 68 Ca -0.53 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.94 2k7y h VAL 68 Cb 1.87 0.59 0.00 0.00 -2.13 0.00 0.00 31.29 31.62 2k7y h VAL 68 CO -0.07 0.00 0.00 1.21 -1.23 0.00 0.00 177.57 177.48 2k7y n GLU 69 N -5.30 0.00 -0.07 5.19 2.13 -1.21 -5.03 120.64 116.36 2k7y n GLU 69 Ca -0.05 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.74 2k7y n GLU 69 Cb 0.22 -0.04 0.03 0.00 0.27 0.00 0.00 31.44 31.92 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 -1.38 -1.00 0.00 5.31 5.12 -1.20 -4.99 116.66 118.52 2k7y n ARG 70 Ca 0.00 -0.17 0.00 0.00 -1.93 0.00 0.00 57.85 55.75 2k7y n ARG 70 Cb 0.00 -0.28 0.00 0.00 -1.16 0.00 0.00 32.46 31.02 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 -0.50 0.21 0.28 -0.13 0.00 -1.10 -4.21 105.19 99.74 2k7y n GLY 71 Ca 0.02 -0.11 0.18 0.00 0.00 0.00 0.00 46.02 46.11 2k7y n GLY 71 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2k7y h HIS 72 N 0.00 0.00 -6.30 1.61 -0.00 -1.86 -3.46 115.15 105.14 2k7y h HIS 72 Ca 0.00 0.00 -0.47 0.00 -0.00 0.00 0.00 60.37 59.90 2k7y h HIS 72 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 2k7y h HIS 72 CO 0.00 0.00 -0.79 1.28 -0.00 0.00 0.00 177.93 178.42 2k7y n LEU 73 N -3.00 -2.60 -3.16 6.12 4.77 -1.26 -4.91 117.00 112.97 2k7y n LEU 73 Ca -0.00 -0.82 -0.22 0.00 -0.03 0.00 0.00 56.01 54.94 2k7y n LEU 73 Cb 0.22 -2.53 -0.04 0.00 -2.33 0.00 0.00 43.42 38.74 2k7y n LEU 73 CO 0.24 0.44 -0.14 0.00 -1.33 0.00 0.00 177.39 176.60 2k7y n ALA 74 N -4.55 2.82 0.18 -1.18 0.00 -1.26 -4.88 120.51 111.63 2k7y n ALA 74 Ca -0.06 -3.79 0.06 0.00 0.00 0.00 0.00 53.44 49.65 2k7y n ALA 74 Cb 0.57 -0.86 0.25 0.00 0.00 0.00 0.00 19.45 19.41 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 3.29 0.00 0.04 0.00 0.13 -1.98 1.49 132.00 134.97 2k7y h PRO 75 Ca 0.11 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.89 2k7y h PRO 75 Cb 0.83 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.92 2k7y h PRO 75 CO 0.59 0.38 -1.94 -2.67 -0.23 0.00 0.00 178.00 174.13 2k7y n TRP 76 N -3.37 0.74 -0.05 1.56 2.14 -1.26 -4.35 117.44 112.85 2k7y n TRP 76 Ca 0.01 0.23 -0.16 0.00 2.07 0.00 0.00 57.50 59.65 2k7y n TRP 76 Cb 0.57 -1.09 -0.06 0.00 -0.81 0.00 0.00 31.31 29.92 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 -0.51 0.85 -7.02 -0.67 3.58 -1.93 -3.47 116.42 107.25 2k7y h ASP 77 Ca -0.48 -0.58 -0.60 0.00 0.42 0.00 0.00 57.03 55.79 2k7y h ASP 77 Cb 1.69 -0.25 -0.22 0.00 1.72 0.00 0.00 39.33 42.27 2k7y h ASP 77 CO -0.14 1.29 -0.93 1.33 -2.88 0.00 0.00 179.24 177.90 2k7y n VAL 78 N -4.08 -0.86 -0.05 2.25 0.24 0.51 -4.83 118.33 111.52 2k7y n VAL 78 Ca -0.06 -0.43 -0.04 0.00 -2.04 0.00 0.00 64.34 61.76 2k7y n VAL 78 Cb 0.64 -0.91 -0.01 0.00 -1.47 0.00 0.00 33.84 32.08 2k7y n VAL 78 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2k7y n ASP 79 N -2.73 1.00 -3.61 -1.34 8.00 -1.26 -4.63 116.55 111.97 2k7y n ASP 79 Ca -0.27 0.19 -0.41 0.00 0.71 0.00 0.00 54.79 55.02 2k7y n ASP 79 Cb 0.65 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 41.10 2k7y n ASP 79 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2k7y n ASP 80 N -3.51 4.00 0.00 -2.24 2.03 -1.26 -5.20 116.55 110.38 2k7y n ASP 80 Ca -0.07 -2.72 0.00 0.00 0.52 0.00 0.00 54.79 52.52 2k7y n ASP 80 Cb 0.26 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.23 2k7y n ASP 80 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17