#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fjs n LEU 88 N 0.00 0.00 0.31 -0.35 4.77 -1.26 -0.96 117.00 119.51 1fjs n LEU 88 Ca 0.00 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.18 1fjs n LEU 88 Cb 0.00 0.00 0.98 0.00 -2.33 0.00 0.00 43.42 42.07 1fjs n LEU 88 CO 0.00 0.00 1.09 0.00 -1.33 0.00 0.00 177.39 177.15 1fjs n SER 90 N -3.04 0.32 -4.23 0.00 7.64 -0.13 -2.75 113.62 111.44 1fjs n SER 90 Ca -0.01 0.54 -0.41 0.00 1.01 0.00 0.00 58.87 59.99 1fjs n SER 90 Cb 0.17 -0.62 -0.08 0.00 -1.01 0.00 0.00 64.21 62.66 1fjs n SER 90 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1fjs s LEU 91 N -3.62 5.69 -1.37 -3.43 2.96 0.03 -4.65 118.68 114.29 1fjs s LEU 91 Ca 0.12 -1.86 -0.07 0.00 -0.22 0.00 0.00 54.13 52.10 1fjs s LEU 91 Cb 0.15 -2.03 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1fjs s LEU 91 CO 0.52 -0.69 0.43 -0.67 -1.32 0.00 0.00 176.35 174.62 1fjs n ASP 92 N 4.94 -1.25 -2.46 3.68 2.03 -1.26 -0.72 116.55 121.50 1fjs n ASP 92 Ca -0.09 -1.09 -0.12 0.00 0.52 0.00 0.00 54.79 54.01 1fjs n ASP 92 Cb 0.41 -2.69 -0.01 0.00 -0.72 0.00 0.00 41.12 38.11 1fjs n ASP 92 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1fjs n ASN 93 N -2.83 -3.77 -1.68 1.67 5.15 -1.11 -0.37 115.26 112.33 1fjs n ASN 93 Ca -0.26 0.20 -0.19 0.00 -0.60 0.00 0.00 54.58 53.72 1fjs n ASN 93 Cb 0.66 -3.21 -0.07 0.00 -0.53 0.00 0.00 39.78 36.63 1fjs n ASN 93 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1fjs n GLY 94 N -0.80 1.53 2.49 8.20 0.00 0.10 -1.42 105.19 115.30 1fjs n GLY 94 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1fjs n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fjs n ASP 95 N -1.31 -3.27 -4.80 1.61 4.64 0.50 -4.98 116.55 108.94 1fjs n ASP 95 Ca -0.20 0.00 -0.35 0.00 -1.38 0.00 0.00 54.79 52.86 1fjs n ASP 95 Cb 0.64 -1.34 -0.06 0.00 -1.04 0.00 0.00 41.12 39.32 1fjs n ASP 95 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1fjs h ASP 97 N 2.58 0.71 0.00 0.00 5.19 -1.51 -3.47 116.42 119.92 1fjs h ASP 97 Ca -0.48 -0.39 0.00 0.00 -0.62 0.00 0.00 57.03 55.54 1fjs h ASP 97 Cb 1.19 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.50 1fjs h ASP 97 CO 0.63 1.14 0.00 0.00 -3.12 0.00 0.00 179.24 177.89 1fjs n GLN 98 N -3.95 0.00 -2.26 3.56 6.02 -1.26 -5.01 117.38 114.48 1fjs n GLN 98 Ca -0.04 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.54 1fjs n GLN 98 Cb 0.63 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.86 1fjs n GLN 98 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1fjs s PHE 99 N 1.90 3.30 -0.02 1.08 0.08 -0.79 -4.90 117.98 118.62 1fjs s PHE 99 Ca 0.00 1.22 0.05 0.00 0.12 0.00 0.00 56.93 58.32 1fjs s PHE 99 Cb 0.00 -3.57 -0.01 0.00 -0.57 0.00 0.00 43.02 38.87 1fjs s PHE 99 CO 0.00 -1.79 -0.16 0.00 -0.10 0.00 0.00 175.22 173.17 1fjs s HIS 101 N -0.19 0.14 -0.20 0.00 0.09 0.14 -4.97 115.29 110.30 1fjs s HIS 101 Ca 0.02 -0.30 -0.08 0.00 -0.00 0.00 0.00 55.06 54.71 1fjs s HIS 101 Cb -0.08 -0.11 -0.04 0.00 -0.00 0.00 0.00 32.58 32.34 1fjs s HIS 101 CO 0.00 -0.18 0.07 -1.21 -0.00 0.00 0.00 174.74 173.42 1fjs s GLU 102 N -1.14 3.91 -0.09 1.40 2.02 -1.26 0.47 118.70 124.01 1fjs s GLU 102 Ca -0.12 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 54.50 1fjs s GLU 102 Cb -0.07 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.92 1fjs s GLU 102 CO -0.00 0.16 -0.08 -1.21 0.02 0.00 0.00 175.26 174.14 1fjs s GLU 103 N 0.70 1.46 -1.31 1.61 2.02 0.14 -4.83 118.70 118.47 1fjs s GLU 103 Ca 0.04 -0.27 -0.07 0.00 0.02 0.00 0.00 54.97 54.69 1fjs s GLU 103 Cb -0.13 -1.42 -0.00 0.00 0.10 0.00 0.00 34.13 32.67 1fjs s GLU 103 CO 0.02 -0.16 0.55 1.04 0.02 0.00 0.00 175.26 176.73 1fjs n GLN 104 N 4.52 -2.71 -2.41 1.61 1.13 -1.26 -1.03 117.38 117.23 1fjs n GLN 104 Ca -0.17 0.42 -0.20 0.00 -1.94 0.00 0.00 57.00 55.11 1fjs n GLN 104 Cb 0.51 -4.39 -0.01 0.00 0.11 0.00 0.00 30.24 26.46 1fjs n GLN 104 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1fjs n ASN 105 N -2.87 -5.81 -4.18 1.08 4.05 -1.26 -4.99 115.26 101.28 1fjs n ASN 105 Ca -0.24 -0.03 -0.11 0.00 0.45 0.00 0.00 54.58 54.65 1fjs n ASN 105 Cb 0.65 -4.82 -0.10 0.00 1.23 0.00 0.00 39.78 36.75 1fjs n ASN 105 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1fjs s SER 106 N -2.10 0.16 -0.06 1.20 1.04 -0.20 -5.05 113.70 108.70 1fjs s SER 106 Ca 0.01 -1.33 -0.07 0.00 0.48 0.00 0.00 55.95 55.04 1fjs s SER 106 Cb -0.00 0.38 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 1fjs s SER 106 CO 0.01 -0.84 0.21 -0.69 0.98 0.00 0.00 173.24 172.92 1fjs s VAL 107 N -4.13 5.39 -0.11 5.02 1.01 -1.26 0.23 120.40 126.55 1fjs s VAL 107 Ca 0.35 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.58 1fjs s VAL 107 Cb 0.07 -3.50 0.02 0.00 0.00 0.00 0.00 36.38 32.97 1fjs s VAL 107 CO 0.10 0.52 -0.09 -0.69 0.00 0.00 0.00 175.10 174.93 1fjs s VAL 108 N -1.13 1.11 0.14 2.92 1.01 0.18 -4.88 120.40 119.74 1fjs s VAL 108 Ca 0.21 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.84 1fjs s VAL 108 Cb -0.13 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1fjs s VAL 108 CO 0.10 0.38 0.23 0.00 0.00 0.00 0.00 175.10 175.80 1fjs s SER 110 N -3.08 0.02 0.30 0.00 1.04 -0.08 -4.95 113.70 106.94 1fjs s SER 110 Ca 0.33 -1.02 0.05 0.00 0.48 0.00 0.00 55.95 55.80 1fjs s SER 110 Cb -0.11 0.59 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 1fjs s SER 110 CO 0.27 -1.15 -0.01 0.00 0.98 0.00 0.00 173.24 173.32 1fjs s ALA 112 N -3.12 2.71 0.36 0.00 0.00 -1.26 -4.94 121.76 115.52 1fjs s ALA 112 Ca 0.32 -0.25 -0.28 0.00 0.00 0.00 0.00 51.96 51.74 1fjs s ALA 112 Cb 0.06 -3.06 -0.11 0.00 0.00 0.00 0.00 23.12 20.01 1fjs s ALA 112 CO 0.13 -1.27 1.47 1.03 0.00 0.00 0.00 175.76 177.12 1fjs s ARG 113 N -5.26 4.15 0.00 0.00 3.00 -1.26 -1.84 118.95 117.74 1fjs s ARG 113 Ca 0.59 2.52 0.00 0.00 0.00 0.00 0.00 55.73 58.83 1fjs s ARG 113 Cb -0.12 -2.99 0.00 0.00 0.00 0.00 0.00 34.95 31.83 1fjs s ARG 113 CO 0.53 -0.49 0.00 0.41 0.00 0.00 0.00 175.30 175.75 1fjs n GLY 114 N 0.76 0.21 3.37 -3.53 0.00 -1.26 -4.58 105.19 100.17 1fjs n GLY 114 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 1fjs n GLY 114 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fjs s TYR 115 N -2.00 2.19 -0.07 1.61 2.02 -0.77 -0.35 117.35 119.99 1fjs s TYR 115 Ca 0.00 -0.39 0.04 0.00 -0.37 0.00 0.00 57.07 56.36 1fjs s TYR 115 Cb 0.00 -1.17 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 1fjs s TYR 115 CO 0.00 0.34 -0.20 0.99 -1.57 0.00 0.00 175.55 175.11 1fjs s THR 116 N -1.21 2.53 0.20 -0.71 2.01 0.70 -4.78 115.64 114.38 1fjs s THR 116 Ca 0.14 -0.89 -0.30 0.00 0.31 0.00 0.00 61.69 60.95 1fjs s THR 116 Cb -0.10 -1.97 -0.08 0.00 0.01 0.00 0.00 72.50 70.36 1fjs s THR 116 CO 0.06 0.57 1.20 -0.22 -0.69 0.00 0.00 174.62 175.54 1fjs s LEU 117 N -0.24 4.46 0.86 4.42 2.96 -1.26 -0.05 118.68 129.83 1fjs s LEU 117 Ca -0.00 2.25 -0.12 0.00 -0.22 0.00 0.00 54.13 56.04 1fjs s LEU 117 Cb -0.13 -3.61 0.11 0.00 0.50 0.00 0.00 46.19 43.06 1fjs s LEU 117 CO 0.03 -0.36 1.12 0.00 -1.32 0.00 0.00 176.35 175.82 1fjs s ALA 118 N -0.16 2.00 0.55 5.97 0.00 0.12 -4.87 121.76 125.37 1fjs s ALA 118 Ca 0.52 -0.39 0.28 0.00 0.00 0.00 0.00 51.96 52.37 1fjs s ALA 118 Cb -0.33 -3.06 1.46 0.00 0.00 0.00 0.00 23.12 21.19 1fjs s ALA 118 CO 0.37 -2.03 1.95 -0.44 0.00 0.00 0.00 175.76 175.62 1fjs h ASP 119 N -1.31 0.00 0.07 0.00 5.19 -1.95 0.39 116.42 118.82 1fjs h ASP 119 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1fjs h ASP 119 Cb 1.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.81 1fjs h ASP 119 CO 0.61 0.00 0.00 -0.46 -3.12 0.00 0.00 179.24 176.27 1fjs n ASN 120 N -4.11 0.00 -1.44 6.45 0.23 -1.26 -4.88 115.26 110.25 1fjs n ASN 120 Ca 0.10 -0.71 -0.18 0.00 -0.53 0.00 0.00 54.58 53.27 1fjs n ASN 120 Cb 0.68 -0.04 -0.07 0.00 -2.08 0.00 0.00 39.78 38.26 1fjs n ASN 120 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fjs n GLY 121 N 0.67 1.63 1.13 4.83 0.00 0.14 -4.80 105.19 108.79 1fjs n GLY 121 Ca 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1fjs n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fjs n LYS 122 N -2.49 0.00 -1.91 1.61 5.02 -1.26 -4.28 118.16 114.85 1fjs n LYS 122 Ca -0.18 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.79 1fjs n LYS 122 Cb 0.60 -0.35 0.02 0.00 -0.02 0.00 0.00 35.03 35.29 1fjs n LYS 122 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fjs s ALA 123 N -1.83 2.75 -0.19 7.82 0.00 -1.26 -1.28 121.76 127.77 1fjs s ALA 123 Ca 0.00 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.24 1fjs s ALA 123 Cb 0.00 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.94 1fjs s ALA 123 CO 0.00 -0.91 -0.19 0.00 0.00 0.00 0.00 175.76 174.66 1fjs s ILE 125 N 1.27 4.46 0.60 0.00 -1.09 0.93 -4.87 121.20 122.51 1fjs s ILE 125 Ca 0.04 -0.13 -0.19 0.00 -2.23 0.00 0.00 60.65 58.13 1fjs s ILE 125 Cb -0.14 -3.05 -0.03 0.00 -1.58 0.00 0.00 42.46 37.66 1fjs s ILE 125 CO -0.12 0.39 1.31 -2.84 -1.23 0.00 0.00 174.94 172.45 1fjs s PRO 126 N 1.07 2.82 -0.02 2.79 0.02 -1.26 -0.21 135.00 140.20 1fjs s PRO 126 Ca 0.04 2.10 0.22 0.00 0.02 0.00 0.00 61.00 63.38 1fjs s PRO 126 Cb -0.14 -2.01 -0.31 0.00 0.02 0.00 0.00 34.50 32.06 1fjs s PRO 126 CO 0.03 -1.40 0.55 0.25 -0.33 0.00 0.00 177.00 176.10 1fjs n THR 127 N -1.54 0.02 -4.39 0.99 -2.24 0.53 -4.81 114.28 102.84 1fjs n THR 127 Ca 0.14 -0.44 -0.22 0.00 -2.27 0.00 0.00 64.05 61.26 1fjs n THR 127 Cb 0.47 0.11 -0.08 0.00 -2.10 0.00 0.00 70.33 68.73 1fjs n THR 127 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1fjs s GLY 128 N -4.33 2.40 0.45 3.38 0.00 -1.26 -5.07 107.32 102.89 1fjs s GLY 128 Ca -0.06 -1.66 0.23 0.00 0.00 0.00 0.00 44.72 43.23 1fjs s GLY 128 CO 0.90 -1.64 1.90 -0.56 0.00 0.00 0.00 173.10 173.70 1fjs h PRO 129 N 2.01 0.00 -2.18 2.90 0.13 -1.98 -3.33 132.00 129.55 1fjs h PRO 129 Ca -0.31 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.26 1fjs h PRO 129 Cb 1.25 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.97 1fjs h PRO 129 CO 0.47 0.24 -0.80 0.66 -0.23 0.00 0.00 178.00 178.34 1fjs n TYR 130 N -3.60 2.72 -1.75 1.56 4.01 -1.26 -5.10 117.16 113.74 1fjs n TYR 130 Ca -0.01 -3.95 -0.34 0.00 -0.16 0.00 0.00 57.90 53.44 1fjs n TYR 130 Cb 0.37 -0.48 0.05 0.00 -0.31 0.00 0.00 39.34 38.98 1fjs n TYR 130 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1fjs s PRO 131 N -2.85 2.68 0.52 -0.72 0.04 -1.25 -4.95 135.00 128.46 1fjs s PRO 131 Ca 0.44 1.60 -0.22 0.00 0.04 0.00 0.00 61.00 62.86 1fjs s PRO 131 Cb 0.26 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.83 1fjs s PRO 131 CO -0.10 -1.38 1.27 0.00 0.04 0.00 0.00 177.00 176.83 1fjs n GLY 133 N 0.60 0.79 3.47 0.00 0.00 -1.26 -5.01 105.19 103.78 1fjs n GLY 133 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 1fjs n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fjs s LYS 134 N -0.11 3.63 0.41 1.61 -0.14 -1.19 -5.08 119.74 118.85 1fjs s LYS 134 Ca 0.00 -0.54 -0.26 0.00 -1.36 0.00 0.00 55.97 53.81 1fjs s LYS 134 Cb 0.00 -2.93 -0.09 0.00 -1.68 0.00 0.00 37.83 33.14 1fjs s LYS 134 CO 0.00 0.18 1.33 -0.65 -0.76 0.00 0.00 175.35 175.45 1fjs s GLN 135 N 0.52 3.95 -1.27 1.68 -0.21 -1.26 -4.90 119.66 118.17 1fjs s GLN 135 Ca -0.03 2.23 -0.12 0.00 0.02 0.00 0.00 55.36 57.46 1fjs s GLN 135 Cb -0.14 -2.77 0.15 0.00 1.00 0.00 0.00 33.01 31.25 1fjs s GLN 135 CO 0.03 -0.54 1.73 0.25 -2.12 0.00 0.00 175.29 174.64 1fjs n THR 136 N 0.12 4.23 -2.84 -0.19 -2.24 -1.26 -4.83 114.28 107.28 1fjs n THR 136 Ca 0.04 -4.41 -0.42 0.00 -2.27 0.00 0.00 64.05 56.99 1fjs n THR 136 Cb 0.43 -2.41 0.01 0.00 -2.10 0.00 0.00 70.33 66.26 1fjs n THR 136 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1fjs n LEU 137 N 4.94 6.86 0.00 3.22 4.77 -1.26 -5.27 117.00 130.26 1fjs n LEU 137 Ca 0.40 -5.29 0.00 0.00 -0.03 0.00 0.00 56.01 51.09 1fjs n LEU 137 Cb 0.39 -1.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 1fjs n LEU 137 CO 0.75 1.85 0.05 -1.84 -1.33 0.00 0.00 177.39 176.87