#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hnr n GLN 91 N 0.00 -2.71 -4.02 0.00 7.27 -1.26 -4.99 117.38 111.67 1hnr n GLN 91 Ca 0.00 0.70 -0.31 0.00 0.07 0.00 0.00 57.00 57.46 1hnr n GLN 91 Cb 0.00 -5.20 -0.15 0.00 2.41 0.00 0.00 30.24 27.30 1hnr n GLN 91 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1hnr s ARG 92 N -5.21 1.50 0.47 3.69 1.81 -1.26 -4.98 118.95 114.97 1hnr s ARG 92 Ca 0.35 -1.87 0.12 0.00 -1.72 0.00 0.00 55.73 52.62 1hnr s ARG 92 Cb -0.08 -3.20 1.08 0.00 -0.45 0.00 0.00 34.95 32.30 1hnr s ARG 92 CO 0.79 -0.93 2.09 -1.35 -0.68 0.00 0.00 175.30 175.22 1hnr h PRO 93 N 7.61 0.20 -4.24 3.54 0.11 -2.04 -3.30 132.00 133.88 1hnr h PRO 93 Ca -0.04 -0.02 -0.68 0.00 0.11 0.00 0.00 66.00 65.37 1hnr h PRO 93 Cb 1.02 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 1hnr h PRO 93 CO 0.52 0.16 2.75 0.00 -0.21 0.00 0.00 178.00 181.22 1hnr n ALA 94 N -2.51 4.54 0.91 -0.75 0.00 -1.26 -4.56 120.51 116.87 1hnr n ALA 94 Ca -0.01 -3.63 0.13 0.00 0.00 0.00 0.00 53.44 49.93 1hnr n ALA 94 Cb 0.10 -3.58 0.42 0.00 0.00 0.00 0.00 19.45 16.39 1hnr n ALA 94 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1hnr n LYS 95 N 6.53 0.06 -2.56 0.00 5.02 -1.25 -4.48 118.16 121.49 1hnr n LYS 95 Ca 0.51 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 56.42 1hnr n LYS 95 Cb 0.40 -1.55 -0.04 0.00 -0.02 0.00 0.00 35.03 33.81 1hnr n LYS 95 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1hnr s TYR 96 N -3.03 3.65 0.18 2.13 2.02 -1.26 -4.13 117.35 116.91 1hnr s TYR 96 Ca 0.12 1.65 0.07 0.00 -0.37 0.00 0.00 57.07 58.54 1hnr s TYR 96 Cb 0.17 -3.22 -0.04 0.00 -0.40 0.00 0.00 41.96 38.47 1hnr s TYR 96 CO 0.62 -0.41 0.02 0.45 -1.57 0.00 0.00 175.55 174.66 1hnr s SER 97 N -0.19 4.86 0.16 2.29 0.15 0.09 -0.33 113.70 120.73 1hnr s SER 97 Ca 0.48 -0.38 0.09 0.00 0.70 0.00 0.00 55.95 56.84 1hnr s SER 97 Cb -0.28 -1.06 -0.04 0.00 -1.71 0.00 0.00 66.02 62.92 1hnr s SER 97 CO 0.34 0.08 -0.20 -0.72 1.20 0.00 0.00 173.24 173.93 1hnr s TYR 98 N -1.79 1.95 -0.05 3.44 -0.85 -0.31 -4.57 117.35 115.16 1hnr s TYR 98 Ca 0.28 -0.43 -0.00 0.00 -0.52 0.00 0.00 57.07 56.40 1hnr s TYR 98 Cb -0.09 -0.98 0.03 0.00 0.38 0.00 0.00 41.96 41.29 1hnr s TYR 98 CO 0.19 0.36 -0.01 0.08 -1.52 0.00 0.00 175.55 174.65 1hnr s VAL 99 N -1.81 0.35 0.00 -3.49 1.01 -1.26 -3.28 120.40 111.92 1hnr s VAL 99 Ca 0.16 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.19 1hnr s VAL 99 Cb -0.07 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.85 1hnr s VAL 99 CO 0.07 0.22 0.00 -0.90 0.00 0.00 0.00 175.10 174.49 1hnr n ASP 100 N 4.57 0.96 -0.20 3.32 5.75 -1.26 -4.71 116.55 124.98 1hnr n ASP 100 Ca -0.17 -0.70 -0.08 0.00 -0.01 0.00 0.00 54.79 53.84 1hnr n ASP 100 Cb 0.50 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.62 1hnr n ASP 100 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1hnr h GLU 101 N 0.00 0.85 -0.05 0.11 3.07 -2.00 -3.10 114.58 113.45 1hnr h GLU 101 Ca 0.00 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 1hnr h GLU 101 Cb 0.00 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 27.77 1hnr h GLU 101 CO 0.00 0.74 -0.01 -0.91 -1.40 0.00 0.00 179.01 177.43 1hnr h ASN 102 N 0.78 0.10 0.00 1.42 4.21 -2.04 -3.48 115.58 116.57 1hnr h ASN 102 Ca 0.19 -0.34 0.00 0.00 1.21 0.00 0.00 56.30 57.35 1hnr h ASN 102 Cb 0.21 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1hnr h ASN 102 CO -0.01 0.42 0.00 0.61 -1.29 0.00 0.00 177.43 177.16 1hnr n GLY 103 N -0.17 1.00 2.88 2.83 0.00 -1.17 -5.04 105.19 105.51 1hnr n GLY 103 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1hnr n GLY 103 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1hnr n GLU 104 N 0.00 2.67 -2.08 1.61 -0.58 -1.26 -4.88 120.64 116.12 1hnr n GLU 104 Ca 0.00 -2.55 -0.28 0.00 -0.42 0.00 0.00 57.16 53.91 1hnr n GLU 104 Cb 0.00 -3.26 -0.06 0.00 -0.57 0.00 0.00 31.44 27.55 1hnr n GLU 104 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1hnr s THR 105 N 3.69 3.55 0.22 2.62 2.01 -1.25 -4.46 115.64 122.02 1hnr s THR 105 Ca 0.50 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1hnr s THR 105 Cb 0.13 -4.52 -0.05 0.00 0.01 0.00 0.00 72.50 68.07 1hnr s THR 105 CO -0.04 -1.01 0.01 -0.54 -0.69 0.00 0.00 174.62 172.35 1hnr s LYS 106 N 6.49 1.30 0.75 4.92 1.02 -1.20 -4.94 119.74 128.08 1hnr s LYS 106 Ca 0.68 -1.66 -0.14 0.00 0.02 0.00 0.00 55.97 54.88 1hnr s LYS 106 Cb -0.01 -0.51 0.05 0.00 -0.52 0.00 0.00 37.83 36.84 1hnr s LYS 106 CO 0.12 -0.12 1.17 0.95 -0.92 0.00 0.00 175.35 176.54 1hnr s THR 107 N -3.50 2.53 0.02 2.17 -4.23 -1.26 -1.16 115.64 110.21 1hnr s THR 107 Ca 0.28 0.23 -0.20 0.00 -1.18 0.00 0.00 61.69 60.83 1hnr s THR 107 Cb 0.06 -2.69 -0.11 0.00 1.34 0.00 0.00 72.50 71.10 1hnr s THR 107 CO 0.08 -0.17 1.18 -0.50 -0.54 0.00 0.00 174.62 174.67 1hnr h TRP 108 N -0.60 -0.65 0.00 3.99 4.06 -0.90 -3.44 115.95 118.40 1hnr h TRP 108 Ca -0.46 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.47 1hnr h TRP 108 Cb 1.28 0.22 0.00 0.00 -1.00 0.00 0.00 29.16 29.65 1hnr h TRP 108 CO 0.50 -0.41 0.00 -2.37 -3.56 0.00 0.00 178.44 172.60 1hnr n THR 109 N -4.08 0.00 0.00 1.49 5.66 -1.26 -4.72 114.28 111.37 1hnr n THR 109 Ca -0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 1hnr n THR 109 Cb 0.28 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 1hnr n THR 109 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1hnr n GLY 110 N 0.00 1.36 0.00 1.09 0.00 -1.26 -1.11 105.19 105.27 1hnr n GLY 110 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1hnr n GLY 110 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1hnr n GLN 111 N 0.00 4.12 -2.63 1.61 3.00 -1.26 -5.07 117.38 117.15 1hnr n GLN 111 Ca 0.00 -0.02 -0.01 0.00 -0.01 0.00 0.00 57.00 56.96 1hnr n GLN 111 Cb 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 30.24 29.89 1hnr n GLN 111 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1hnr n GLY 112 N 0.60 -0.95 2.78 1.08 0.00 -0.26 -5.06 105.19 103.37 1hnr n GLY 112 Ca 0.00 0.29 -0.09 0.00 0.00 0.00 0.00 46.02 46.22 1hnr n GLY 112 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1hnr n ARG 113 N -1.62 0.74 -3.93 1.61 1.85 -1.26 -5.06 116.66 108.98 1hnr n ARG 113 Ca -0.00 -1.91 -0.30 0.00 -1.00 0.00 0.00 57.85 54.64 1hnr n ARG 113 Cb 0.51 2.12 -0.14 0.00 -1.05 0.00 0.00 32.46 33.90 1hnr n ARG 113 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1hnr s THR 114 N -2.49 2.55 0.00 8.89 2.01 -1.26 -5.00 115.64 120.34 1hnr s THR 114 Ca 0.17 -3.41 0.00 0.00 0.31 0.00 0.00 61.69 58.76 1hnr s THR 114 Cb -0.03 -2.76 0.00 0.00 0.01 0.00 0.00 72.50 69.72 1hnr s THR 114 CO 0.12 -0.83 0.60 -0.81 -0.69 0.00 0.00 174.62 173.00 1hnr n PRO 115 N 2.98 0.00 0.00 4.92 -0.04 -1.26 -4.92 135.00 136.67 1hnr n PRO 115 Ca 0.07 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1hnr n PRO 115 Cb 0.33 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1hnr n PRO 115 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hnr n ALA 116 N -1.45 0.08 -0.08 0.55 0.00 -1.26 -4.91 120.51 113.44 1hnr n ALA 116 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1hnr n ALA 116 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1hnr n ALA 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1hnr h VAL 117 N 0.00 0.29 -0.15 0.00 2.07 -1.94 0.15 116.25 116.67 1hnr h VAL 117 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1hnr h VAL 117 Cb 0.00 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1hnr h VAL 117 CO 0.00 0.00 0.06 0.40 0.02 0.00 0.00 177.57 178.05 1hnr h ILE 118 N -0.26 0.98 -0.68 4.57 2.04 -1.93 -1.12 117.51 121.11 1hnr h ILE 118 Ca 0.16 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 66.02 1hnr h ILE 118 Cb 0.52 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.38 1hnr h ILE 118 CO -0.47 0.02 0.39 0.11 0.00 0.00 0.00 178.15 178.21 1hnr h LYS 119 N 0.14 0.72 0.40 2.37 1.57 -1.72 0.12 116.57 120.17 1hnr h LYS 119 Ca 0.06 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1hnr h LYS 119 Cb 0.02 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1hnr h LYS 119 CO -0.05 0.48 -0.19 -0.22 -0.57 0.00 0.00 179.45 178.89 1hnr h LYS 120 N 0.74 -0.52 -0.78 3.15 3.64 -0.41 -0.31 116.57 122.09 1hnr h LYS 120 Ca 0.29 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.77 1hnr h LYS 120 Cb 0.13 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.02 1hnr h LYS 120 CO -0.16 -0.30 0.51 0.00 -2.27 0.00 0.00 179.45 177.23 1hnr h ALA 121 N -0.07 1.64 -0.13 5.00 0.00 -0.91 0.19 119.26 124.99 1hnr h ALA 121 Ca -0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1hnr h ALA 121 Cb 0.47 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1hnr h ALA 121 CO 0.09 0.24 -0.01 1.98 0.00 0.00 0.00 179.25 181.55 1hnr h MET 122 N 0.84 0.24 -0.25 0.00 1.85 -0.50 0.07 114.93 117.18 1hnr h MET 122 Ca 0.33 -0.08 -0.01 0.00 -0.61 0.00 0.00 59.70 59.33 1hnr h MET 122 Cb 0.23 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.23 1hnr h MET 122 CO -0.11 0.49 0.10 0.22 -0.40 0.00 0.00 176.91 177.21 1hnr h ASP 123 N -0.04 0.34 -0.57 1.39 3.58 -0.47 -1.46 116.42 119.18 1hnr h ASP 123 Ca 0.04 -0.16 -0.03 0.00 0.42 0.00 0.00 57.03 57.29 1hnr h ASP 123 Cb 0.39 -0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.33 1hnr h ASP 123 CO 0.01 0.41 0.23 -0.33 -2.88 0.00 0.00 179.24 176.68 1hnr h GLU 124 N 0.25 0.85 0.00 0.28 5.08 -0.97 -3.44 114.58 116.63 1hnr h GLU 124 Ca 0.08 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1hnr h GLU 124 Cb 0.17 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1hnr h GLU 124 CO -0.01 0.73 0.00 0.94 -1.00 0.00 0.00 179.01 179.67 1hnr n GLN 125 N -4.49 0.00 -3.70 2.33 -0.06 -0.02 -5.07 117.38 106.36 1hnr n GLN 125 Ca 0.03 0.00 -0.27 0.00 -2.00 0.00 0.00 57.00 54.76 1hnr n GLN 125 Cb 0.16 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 26.35 1hnr n GLN 125 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1hnr n GLY 126 N 2.79 -1.00 0.06 1.69 0.00 -0.56 -4.90 105.19 103.28 1hnr n GLY 126 Ca 0.00 0.69 -0.13 0.00 0.00 0.00 0.00 46.02 46.58 1hnr n GLY 126 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hnr h LYS 127 N 0.17 -0.03 0.00 1.61 1.57 -1.92 -3.48 116.57 114.49 1hnr h LYS 127 Ca -0.61 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.03 1hnr h LYS 127 Cb 1.36 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.65 1hnr h LYS 127 CO 0.33 0.44 -0.01 0.45 -0.57 0.00 0.00 179.45 180.10 1hnr n SER 128 N -4.88 -1.17 0.22 0.86 2.88 -1.26 -5.02 113.62 105.26 1hnr n SER 128 Ca -0.08 -2.26 0.07 0.00 -1.33 0.00 0.00 58.87 55.27 1hnr n SER 128 Cb 0.25 2.08 0.53 0.00 -0.75 0.00 0.00 64.21 66.31 1hnr n SER 128 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1hnr h LEU 129 N 0.00 0.00 -2.08 2.46 3.38 -1.96 -2.36 115.31 114.75 1hnr h LEU 129 Ca -0.20 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.86 1hnr h LEU 129 Cb 0.84 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1hnr h LEU 129 CO 0.27 0.22 0.26 0.44 0.09 0.00 0.00 178.44 179.72 1hnr h ASP 130 N 0.00 0.00 -0.19 -0.43 5.19 -1.96 0.12 116.42 119.15 1hnr h ASP 130 Ca -0.00 0.00 0.05 0.00 -0.62 0.00 0.00 57.03 56.46 1hnr h ASP 130 Cb 0.43 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1hnr h ASP 130 CO 0.03 0.00 0.17 0.44 -3.12 0.00 0.00 179.24 176.76 1hnr h ASP 131 N 0.00 0.00 0.00 6.45 5.19 -1.83 -3.26 116.42 122.97 1hnr h ASP 131 Ca 0.15 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.49 1hnr h ASP 131 Cb 0.68 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.18 1hnr h ASP 131 CO -0.00 0.00 -1.27 0.49 -3.12 0.00 0.00 179.24 175.34 1hnr n PHE 132 N -4.03 0.00 -2.78 4.55 3.72 -0.34 -4.92 117.46 113.66 1hnr n PHE 132 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 1hnr n PHE 132 Cb 0.30 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 1hnr n PHE 132 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1hnr s LEU 133 N -5.63 4.33 0.00 4.37 2.96 0.27 -0.73 118.68 124.25 1hnr s LEU 133 Ca -0.07 1.53 -0.05 0.00 -0.22 0.00 0.00 54.13 55.33 1hnr s LEU 133 Cb 0.02 -3.46 -0.23 0.00 0.50 0.00 0.00 46.19 43.01 1hnr s LEU 133 CO 0.10 -0.27 3.40 2.30 -1.32 0.00 0.00 176.35 180.56 1hnr n ILE 134 N 4.00 2.85 0.00 6.68 -5.35 -1.26 -4.37 119.36 121.92 1hnr n ILE 134 Ca 0.05 -1.36 0.00 0.00 -0.27 0.00 0.00 62.75 61.17 1hnr n ILE 134 Cb 0.51 -1.93 0.00 0.00 -1.74 0.00 0.00 39.64 36.47 1hnr n ILE 134 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1hnr n LYS 135 N 2.37 0.00 0.00 6.28 4.01 -1.26 -5.15 118.16 124.41 1hnr n LYS 135 Ca 0.37 0.00 0.07 0.00 -0.51 0.00 0.00 58.31 58.24 1hnr n LYS 135 Cb 0.86 0.00 0.41 0.00 -0.51 0.00 0.00 35.03 35.79 1hnr n LYS 135 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29