#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x9v n THR 53 N 0.00 0.00 0.04 5.18 -2.24 -1.26 -0.53 114.28 115.48 1x9v n THR 53 Ca 0.00 1.25 -0.21 0.00 -2.27 0.00 0.00 64.05 62.82 1x9v n THR 53 Cb 0.00 -1.94 -0.14 0.00 -2.10 0.00 0.00 70.33 66.15 1x9v n THR 53 CO 0.00 0.00 0.00 -0.50 -0.57 0.00 0.00 175.07 174.00 1x9v h TRP 54 N 0.00 0.54 -0.25 4.78 -0.00 -2.05 -3.21 115.95 115.76 1x9v h TRP 54 Ca 0.00 -0.40 0.07 0.00 -0.00 0.00 0.00 58.89 58.57 1x9v h TRP 54 Cb 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 29.13 1x9v h TRP 54 CO -0.25 1.42 0.57 1.15 -0.00 0.00 0.00 178.44 181.33 1x9v h THR 55 N -0.31 0.12 0.00 1.49 2.02 -1.99 2.50 112.91 116.73 1x9v h THR 55 Ca -0.21 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.97 1x9v h THR 55 Cb 1.73 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.62 1x9v h THR 55 CO 0.13 0.00 -0.78 1.23 0.37 0.00 0.00 175.52 176.46 1x9v h GLY 56 N 0.00 0.00 0.00 2.16 0.00 -0.82 -3.26 103.07 101.15 1x9v h GLY 56 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.22 1x9v h GLY 56 CO -0.00 0.00 -1.73 -0.62 0.00 0.00 0.00 176.54 174.19 1x9v n VAL 57 N -2.18 1.51 -0.23 4.60 0.31 0.80 -3.49 118.33 119.65 1x9v n VAL 57 Ca 0.02 -0.11 0.04 0.00 -0.01 0.00 0.00 64.34 64.28 1x9v n VAL 57 Cb 0.46 -2.12 0.16 0.00 -0.91 0.00 0.00 33.84 31.42 1x9v n VAL 57 CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 1x9v h GLU 58 N -1.00 0.29 0.00 5.55 4.11 -0.42 1.97 114.58 125.08 1x9v h GLU 58 Ca -0.35 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.07 1x9v h GLU 58 Cb 1.29 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1x9v h GLU 58 CO -0.21 0.19 0.00 0.00 0.07 0.00 0.00 179.01 179.06 1x9v h ALA 59 N 1.55 1.00 0.00 1.06 0.00 -1.74 -1.87 119.26 119.27 1x9v h ALA 59 Ca 0.38 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 1x9v h ALA 59 Cb 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1x9v h ALA 59 CO -0.45 0.00 -0.99 -0.07 0.00 0.00 0.00 179.25 177.74 1x9v h LEU 60 N 0.00 0.00 -0.40 0.00 3.38 0.87 -0.06 115.31 119.10 1x9v h LEU 60 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1x9v h LEU 60 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1x9v h LEU 60 CO 0.00 0.24 -0.61 0.40 0.09 0.00 0.00 178.44 178.56 1x9v h ILE 61 N 0.00 1.31 0.11 1.22 2.04 0.34 -2.81 117.51 119.73 1x9v h ILE 61 Ca -0.05 -1.86 -0.31 0.00 1.00 0.00 0.00 64.86 63.63 1x9v h ILE 61 Cb 1.23 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.12 1x9v h ILE 61 CO 0.02 0.58 -1.65 0.08 0.00 0.00 0.00 178.15 177.19 1x9v h ARG 62 N 0.48 0.24 -0.88 2.37 0.11 -1.49 -3.03 114.38 112.17 1x9v h ARG 62 Ca -0.01 -0.41 0.15 0.00 0.10 0.00 0.00 59.98 59.81 1x9v h ARG 62 Cb 1.19 0.15 -0.07 0.00 1.11 0.00 0.00 29.97 32.35 1x9v h ARG 62 CO 0.12 1.20 0.57 0.82 0.10 0.00 0.00 179.97 182.78 1x9v h ILE 63 N -0.21 0.81 0.04 0.08 1.08 -1.08 2.19 117.51 120.43 1x9v h ILE 63 Ca -0.36 -0.22 -0.25 0.00 -0.39 0.00 0.00 64.86 63.64 1x9v h ILE 63 Cb 1.84 0.11 0.02 0.00 -3.07 0.00 0.00 36.82 35.73 1x9v h ILE 63 CO 0.05 0.12 -1.00 -0.07 -0.69 0.00 0.00 178.15 176.56 1x9v h LEU 64 N 0.64 0.81 -0.43 1.44 3.38 -1.63 -1.99 115.31 117.53 1x9v h LEU 64 Ca 0.45 -0.78 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 1x9v h LEU 64 Cb 0.77 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1x9v h LEU 64 CO -0.20 1.49 -0.29 0.06 0.09 0.00 0.00 178.44 179.59 1x9v h GLN 65 N 0.23 0.96 0.24 1.13 3.07 -1.00 -2.41 115.11 117.32 1x9v h GLN 65 Ca -0.14 -0.45 -0.00 0.00 0.09 0.00 0.00 58.65 58.15 1x9v h GLN 65 Cb 1.68 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 29.22 1x9v h GLN 65 CO 0.20 1.12 -0.20 0.37 0.09 0.00 0.00 178.83 180.40 1x9v h GLN 66 N 0.80 -0.44 0.19 0.06 4.15 0.35 -0.49 115.11 119.73 1x9v h GLN 66 Ca 0.09 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1x9v h GLN 66 Cb 0.87 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.63 1x9v h GLN 66 CO 0.08 -0.29 -0.43 -0.07 -1.93 0.00 0.00 178.83 176.19 1x9v h LEU 67 N -0.45 -1.27 -0.79 -2.39 3.38 -1.29 -1.69 115.31 110.81 1x9v h LEU 67 Ca -0.01 0.13 0.17 0.00 0.09 0.00 0.00 57.88 58.26 1x9v h LEU 67 Cb 0.41 0.45 -0.14 0.00 0.09 0.00 0.00 40.66 41.47 1x9v h LEU 67 CO -0.03 -0.48 -0.09 -0.07 0.09 0.00 0.00 178.44 177.86 1x9v h LEU 68 N -0.68 -0.54 -1.77 1.67 -0.00 -1.32 1.15 115.31 113.82 1x9v h LEU 68 Ca -0.02 0.22 0.35 0.00 -0.00 0.00 0.00 57.88 58.43 1x9v h LEU 68 Cb 0.65 0.43 -0.07 0.00 -0.00 0.00 0.00 40.66 41.67 1x9v h LEU 68 CO -0.19 -0.23 0.84 -0.26 -0.00 0.00 0.00 178.44 178.60 1x9v h PHE 69 N 0.04 0.22 0.00 1.13 -1.00 -0.15 -0.73 116.94 116.46 1x9v h PHE 69 Ca 0.41 0.01 -0.06 0.00 2.81 0.00 0.00 57.97 61.14 1x9v h PHE 69 Cb 0.70 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.19 1x9v h PHE 69 CO -0.52 -0.00 -0.33 0.82 -1.61 0.00 0.00 178.31 176.66 1x9v h ILE 70 N 0.11 1.25 -0.81 -0.55 5.03 0.16 -2.87 117.51 119.84 1x9v h ILE 70 Ca 0.62 -2.06 0.20 0.00 -0.12 0.00 0.00 64.86 63.50 1x9v h ILE 70 Cb 2.19 2.48 -0.13 0.00 -3.03 0.00 0.00 36.82 38.33 1x9v h ILE 70 CO -0.12 0.42 0.15 -0.74 -0.68 0.00 0.00 178.15 177.18 1x9v h HIS 71 N -1.00 0.21 -0.09 1.37 -0.00 -0.08 1.25 115.15 116.81 1x9v h HIS 71 Ca -0.09 0.05 -0.22 0.00 -0.00 0.00 0.00 60.37 60.11 1x9v h HIS 71 Cb 0.92 0.04 0.01 0.00 -0.00 0.00 0.00 27.41 28.37 1x9v h HIS 71 CO 0.17 -0.19 -0.84 0.27 -0.00 0.00 0.00 177.93 177.34 1x9v h PHE 72 N 0.19 0.89 -0.01 5.26 -5.15 -1.42 1.20 116.94 117.91 1x9v h PHE 72 Ca 0.48 -0.42 0.00 0.00 -0.20 0.00 0.00 57.97 57.82 1x9v h PHE 72 Cb 0.89 -0.13 0.00 0.00 0.22 0.00 0.00 35.95 36.94 1x9v h PHE 72 CO -0.32 1.24 -0.02 2.89 -2.00 0.00 0.00 178.31 180.10 1x9v n ARG 73 N -3.87 1.20 0.00 6.09 -4.01 -0.12 -2.36 116.66 113.58 1x9v n ARG 73 Ca -0.07 -0.42 0.00 0.00 -1.04 0.00 0.00 57.85 56.32 1x9v n ARG 73 Cb 0.78 -1.49 0.00 0.00 -3.04 0.00 0.00 32.46 28.71 1x9v n ARG 73 CO 0.00 0.00 0.00 -0.89 -3.04 0.00 0.00 177.63 173.70 1x9v n ILE 74 N -0.53 0.00 0.00 8.89 2.08 0.41 -3.49 119.36 126.72 1x9v n ILE 74 Ca 0.20 -0.12 0.00 0.00 0.56 0.00 0.00 62.75 63.39 1x9v n ILE 74 Cb 0.24 1.60 0.00 0.00 -0.75 0.00 0.00 39.64 40.73 1x9v n ILE 74 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1x9v n GLY 75 N 0.05 0.00 0.46 7.39 0.00 0.41 -4.11 105.19 109.39 1x9v n GLY 75 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1x9v n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9v n ARG 77 N 0.11 0.48 -1.07 0.00 1.85 -1.10 -5.00 116.66 111.92 1x9v n ARG 77 Ca 0.08 -0.69 -0.35 0.00 -1.00 0.00 0.00 57.85 55.89 1x9v n ARG 77 Cb 0.39 0.37 0.09 0.00 -1.05 0.00 0.00 32.46 32.26 1x9v n ARG 77 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 1x9v n HIS 78 N -0.54 -1.12 -3.89 2.89 1.44 -1.23 -4.63 115.22 108.15 1x9v n HIS 78 Ca -0.14 0.30 -0.27 0.00 -2.01 0.00 0.00 57.72 55.60 1x9v n HIS 78 Cb 0.64 -1.86 -0.03 0.00 0.12 0.00 0.00 29.99 28.87 1x9v n HIS 78 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1x9v s SER 79 N -1.68 6.36 -0.42 4.39 0.01 -1.26 -4.98 113.70 116.11 1x9v s SER 79 Ca 0.62 0.24 -0.03 0.00 1.31 0.00 0.00 55.95 58.09 1x9v s SER 79 Cb -0.29 -1.94 0.14 0.00 0.21 0.00 0.00 66.02 64.14 1x9v s SER 79 CO 0.62 0.05 2.47 0.54 0.41 0.00 0.00 173.24 177.33 1x9v n ARG 80 N -0.43 2.22 -1.54 12.44 1.74 -1.26 -4.95 116.66 124.88 1x9v n ARG 80 Ca -0.06 -2.15 -0.46 0.00 -0.77 0.00 0.00 57.85 54.41 1x9v n ARG 80 Cb 0.53 -1.97 -0.05 0.00 -1.02 0.00 0.00 32.46 29.96 1x9v n ARG 80 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1x9v n ILE 81 N 0.58 0.29 0.00 0.55 -5.35 -1.26 -2.55 119.36 111.62 1x9v n ILE 81 Ca 0.43 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 1x9v n ILE 81 Cb 0.56 -2.18 0.00 0.00 -1.74 0.00 0.00 39.64 36.28 1x9v n ILE 81 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1x9v n GLY 82 N 6.04 3.11 0.32 3.28 0.00 -1.26 -4.95 105.19 111.73 1x9v n GLY 82 Ca 0.34 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 1x9v n GLY 82 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1x9v h ILE 83 N 0.00 0.00 -6.27 -0.61 2.04 -1.82 -3.48 117.51 107.37 1x9v h ILE 83 Ca 0.00 -0.18 -0.32 0.00 1.00 0.00 0.00 64.86 65.37 1x9v h ILE 83 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1x9v h ILE 83 CO 0.00 0.00 -0.77 -0.38 0.00 0.00 0.00 178.15 177.00 1x9v n ILE 84 N -4.64 -5.71 -3.10 -0.67 2.08 -1.25 -3.48 119.36 102.60 1x9v n ILE 84 Ca -0.10 -0.02 -0.01 0.00 0.56 0.00 0.00 62.75 63.18 1x9v n ILE 84 Cb 0.32 -4.34 0.00 0.00 -0.75 0.00 0.00 39.64 34.87 1x9v n ILE 84 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1x9v n GLN 85 N -2.03 -1.35 -2.67 0.38 6.02 -1.26 -5.00 117.38 111.48 1x9v n GLN 85 Ca -0.19 1.46 -0.04 0.00 -0.01 0.00 0.00 57.00 58.22 1x9v n GLN 85 Cb 0.63 -5.62 0.05 0.00 1.02 0.00 0.00 30.24 26.32 1x9v n GLN 85 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1x9v n GLN 86 N -1.84 0.11 -1.53 -1.09 0.00 -1.23 -5.14 117.38 106.67 1x9v n GLN 86 Ca -0.02 -0.74 -0.44 0.00 -0.00 0.00 0.00 57.00 55.81 1x9v n GLN 86 Cb 0.51 -0.03 -0.01 0.00 0.00 0.00 0.00 30.24 30.71 1x9v n GLN 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1x9v n ARG 87 N 2.07 0.95 -0.99 3.69 1.74 -1.26 -4.73 116.66 118.13 1x9v n ARG 87 Ca 0.07 0.34 -0.32 0.00 -0.77 0.00 0.00 57.85 57.17 1x9v n ARG 87 Cb 0.68 -1.66 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 1x9v n ARG 87 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1x9v n ARG 88 N 0.64 2.14 -4.07 5.56 1.74 -1.26 -4.49 116.66 116.91 1x9v n ARG 88 Ca 0.11 -1.74 -0.35 0.00 -0.77 0.00 0.00 57.85 55.11 1x9v n ARG 88 Cb 0.34 -2.69 -0.06 0.00 -1.02 0.00 0.00 32.46 29.03 1x9v n ARG 88 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1x9v n THR 89 N 4.74 0.00 -2.25 0.55 5.66 -1.26 -4.42 114.28 117.30 1x9v n THR 89 Ca 0.50 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.62 1x9v n THR 89 Cb 0.24 -0.41 -0.03 0.00 -1.55 0.00 0.00 70.33 68.58 1x9v n THR 89 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1x9v n ARG 90 N -3.59 -1.83 -0.18 1.09 1.74 -1.26 -3.89 116.66 108.74 1x9v n ARG 90 Ca 0.10 1.21 -0.07 0.00 -0.77 0.00 0.00 57.85 58.31 1x9v n ARG 90 Cb 0.42 -2.23 0.02 0.00 -1.02 0.00 0.00 32.46 29.64 1x9v n ARG 90 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 1x9v h ASN 91 N -0.84 0.65 0.00 0.55 -0.00 -2.02 -3.43 115.58 110.49 1x9v h ASN 91 Ca 0.02 -0.09 0.00 0.00 -0.00 0.00 0.00 56.30 56.22 1x9v h ASN 91 Cb 0.83 -0.17 0.00 0.00 -0.00 0.00 0.00 38.32 38.98 1x9v h ASN 91 CO 0.01 0.56 0.00 0.61 -0.00 0.00 0.00 177.43 178.60 1x9v n GLY 92 N -1.02 -2.00 2.30 1.57 0.00 -1.25 -5.03 105.19 99.75 1x9v n GLY 92 Ca 0.02 1.05 -0.33 0.00 0.00 0.00 0.00 46.02 46.76 1x9v n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x9v n ALA 93 N 0.00 6.25 -0.68 4.61 0.00 -1.25 -5.04 120.51 124.39 1x9v n ALA 93 Ca 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 53.44 50.10 1x9v n ALA 93 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1x9v n ALA 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x9v n SER 94 N -0.84 -2.22 -3.85 0.00 2.88 -1.26 -4.72 113.62 103.61 1x9v n SER 94 Ca 0.61 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.92 1x9v n SER 94 Cb 0.68 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.97 1x9v n SER 94 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1x9v s LYS 95 N 0.00 0.87 0.00 -1.46 1.02 -1.26 -5.15 119.74 113.76 1x9v s LYS 95 Ca 0.00 -0.05 0.00 0.00 0.02 0.00 0.00 55.97 55.94 1x9v s LYS 95 Cb 0.00 -1.01 0.00 0.00 -0.52 0.00 0.00 37.83 36.30 1x9v s LYS 95 CO 0.00 -0.19 0.00 0.45 -0.92 0.00 0.00 175.35 174.69