#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2odx h LYS 95 N 0.00 -0.28 0.00 0.03 5.09 -2.01 -3.45 116.57 115.96 2odx h LYS 95 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.76 2odx h LYS 95 Cb 0.00 0.06 0.00 0.00 0.10 0.00 0.00 32.23 32.39 2odx h LYS 95 CO 0.00 -0.18 0.00 -3.47 -2.09 0.00 0.00 179.45 173.71 2odx n ASP 96 N -5.41 0.00 -0.07 7.07 2.03 -1.26 -5.11 116.55 113.80 2odx n ASP 96 Ca 0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.20 2odx n ASP 96 Cb 0.35 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.66 2odx n ASP 96 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2odx h PRO 97 N 0.00 0.00 -3.11 -0.67 0.13 -1.86 -3.49 132.00 123.00 2odx h PRO 97 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 2odx h PRO 97 Cb 0.00 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 30.90 2odx h PRO 97 CO 0.00 0.67 -0.38 0.42 -0.23 0.00 0.00 178.00 178.48 2odx s ILE 98 N -2.08 0.02 -0.14 -3.56 -1.09 -1.26 -5.04 121.20 108.05 2odx s ILE 98 Ca -0.15 -0.20 -0.02 0.00 -2.23 0.00 0.00 60.65 58.05 2odx s ILE 98 Cb -0.00 -0.45 -0.02 0.00 -1.58 0.00 0.00 42.46 40.41 2odx s ILE 98 CO 0.46 -0.11 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.36 2odx s ILE 99 N -0.38 3.53 -0.39 2.92 -1.09 -1.26 -0.70 121.20 123.83 2odx s ILE 99 Ca -0.05 -0.49 -0.01 0.00 -2.23 0.00 0.00 60.65 57.87 2odx s ILE 99 Cb -0.03 -2.52 0.11 0.00 -1.58 0.00 0.00 42.46 38.43 2odx s ILE 99 CO 0.01 0.51 0.17 -0.63 -1.23 0.00 0.00 174.94 173.77 2odx s ILE 100 N 0.35 3.07 -0.01 2.92 -1.09 0.04 -4.94 121.20 121.54 2odx s ILE 100 Ca -0.07 -2.10 -0.30 0.00 -2.23 0.00 0.00 60.65 55.95 2odx s ILE 100 Cb -0.15 -3.12 -0.06 0.00 -1.58 0.00 0.00 42.46 37.54 2odx s ILE 100 CO 0.04 -0.66 1.63 -0.70 -1.23 0.00 0.00 174.94 174.02 2odx s GLU 101 N 1.09 4.20 -0.20 2.79 2.12 -1.26 -3.84 118.70 123.60 2odx s GLU 101 Ca 0.08 2.21 -0.04 0.00 0.36 0.00 0.00 54.97 57.59 2odx s GLU 101 Cb -0.22 -3.82 0.09 0.00 0.26 0.00 0.00 34.13 30.44 2odx s GLU 101 CO -0.05 -0.78 0.22 0.45 -0.54 0.00 0.00 175.26 174.56 2odx s SER 102 N 2.89 1.37 0.00 -1.70 0.15 -1.26 -5.01 113.70 110.14 2odx s SER 102 Ca 0.73 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.17 2odx s SER 102 Cb -0.35 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 2odx s SER 102 CO 0.30 -0.32 1.31 -1.22 1.20 0.00 0.00 173.24 174.51 2odx n TYR 103 N 5.32 0.00 -3.66 3.44 4.01 -1.26 -4.37 117.16 120.64 2odx n TYR 103 Ca -0.05 -0.66 -0.13 0.00 -0.16 0.00 0.00 57.90 56.90 2odx n TYR 103 Cb 0.50 -0.35 -0.08 0.00 -0.31 0.00 0.00 39.34 39.09 2odx n TYR 103 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2odx s ASP 104 N 1.53 -0.70 0.10 7.72 1.01 -1.26 -4.85 116.67 120.22 2odx s ASP 104 Ca 0.00 1.30 0.07 0.00 0.71 0.00 0.00 52.55 54.63 2odx s ASP 104 Cb 0.00 1.29 0.39 0.00 1.01 0.00 0.00 42.92 45.61 2odx s ASP 104 CO 0.00 -0.22 1.22 0.47 0.21 0.00 0.00 175.17 176.85 2odx n ASP 105 N 3.06 0.18 -3.75 0.27 9.92 -1.26 -4.60 116.55 120.37 2odx n ASP 105 Ca -0.15 0.59 -0.18 0.00 -0.53 0.00 0.00 54.79 54.52 2odx n ASP 105 Cb 0.56 -0.61 -0.17 0.00 -0.64 0.00 0.00 41.12 40.26 2odx n ASP 105 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2odx s TYR 106 N -3.18 0.16 0.29 1.24 -0.85 -1.26 -0.71 117.35 113.05 2odx s TYR 106 Ca -0.01 0.11 -0.03 0.00 -0.52 0.00 0.00 57.07 56.62 2odx s TYR 106 Cb 0.02 -0.40 -0.01 0.00 0.38 0.00 0.00 41.96 41.95 2odx s TYR 106 CO 0.07 -0.15 0.38 1.03 -1.52 0.00 0.00 175.55 175.36 2odx s ARG 107 N 1.44 1.66 0.38 -3.49 0.52 -1.18 -5.03 118.95 113.25 2odx s ARG 107 Ca -0.04 -1.64 0.07 0.00 -0.52 0.00 0.00 55.73 53.60 2odx s ARG 107 Cb -0.13 0.40 0.00 0.00 0.52 0.00 0.00 34.95 35.74 2odx s ARG 107 CO -0.03 -0.65 0.52 1.52 0.02 0.00 0.00 175.30 176.68 2odx s TYR 108 N -3.56 2.93 0.03 -0.53 1.13 -1.26 -3.45 117.35 112.63 2odx s TYR 108 Ca 0.32 -0.33 0.03 0.00 -1.41 0.00 0.00 57.07 55.68 2odx s TYR 108 Cb 0.01 -2.21 -0.02 0.00 -1.10 0.00 0.00 41.96 38.65 2odx s TYR 108 CO 0.17 -0.24 -0.11 0.54 -2.51 0.00 0.00 175.55 173.40 2odx s VAL 109 N -2.29 0.81 -0.24 -3.49 0.11 0.36 -4.91 120.40 110.75 2odx s VAL 109 Ca 0.51 -0.87 -0.01 0.00 -2.93 0.00 0.00 61.98 58.68 2odx s VAL 109 Cb -0.09 -0.76 0.07 0.00 -1.53 0.00 0.00 36.38 34.06 2odx s VAL 109 CO 0.32 -0.09 0.01 -0.83 -3.33 0.00 0.00 175.10 171.18 2odx s GLY 110 N -1.07 1.09 0.32 6.54 0.00 -1.26 -0.78 107.32 112.16 2odx s GLY 110 Ca -0.02 -1.25 0.08 0.00 0.00 0.00 0.00 44.72 43.53 2odx s GLY 110 CO 0.01 1.21 0.17 0.00 0.00 0.00 0.00 173.10 174.49 2odx n THR 112 N -1.19 0.42 0.00 0.00 -2.24 -1.26 -2.81 114.28 107.20 2odx n THR 112 Ca -0.03 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2odx n THR 112 Cb 0.60 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 2odx n THR 112 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2odx n GLY 113 N -0.21 2.25 3.90 3.38 0.00 -1.26 -0.74 105.19 112.51 2odx n GLY 113 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2odx n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2odx s SER 114 N -1.57 -0.01 0.58 1.61 1.04 -1.22 -4.65 113.70 109.48 2odx s SER 114 Ca 0.00 -0.21 0.27 0.00 0.48 0.00 0.00 55.95 56.49 2odx s SER 114 Cb 0.00 0.17 1.70 0.00 0.10 0.00 0.00 66.02 67.99 2odx s SER 114 CO 0.00 -0.33 2.22 1.55 0.98 0.00 0.00 173.24 177.65 2odx h PRO 115 N 2.00 0.00 -0.01 4.02 0.13 -2.05 -0.65 132.00 135.44 2odx h PRO 115 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2odx h PRO 115 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2odx h PRO 115 CO 0.31 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 178.00 2odx n ALA 116 N -2.37 2.73 -0.36 -0.56 0.00 -1.26 -5.07 120.51 113.63 2odx n ALA 116 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.05 2odx n ALA 116 Cb 0.12 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2odx n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2odx n GLY 117 N 1.21 -1.57 0.00 0.00 0.00 -0.25 -5.00 105.19 99.57 2odx n GLY 117 Ca 0.17 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2odx n GLY 117 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2odx n SER 118 N -0.51 0.00 0.00 1.61 2.88 0.08 -3.44 113.62 114.24 2odx n SER 118 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2odx n SER 118 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2odx n SER 118 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2odx n HIS 119 N -0.40 0.00 0.00 0.66 1.44 -0.04 -4.99 115.22 111.90 2odx n HIS 119 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2odx n HIS 119 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2odx n HIS 119 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 2odx n THR 120 N 0.00 0.00 -4.25 0.61 5.66 -1.26 -4.87 114.28 110.17 2odx n THR 120 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 2odx n THR 120 Cb 0.00 -0.80 -0.09 0.00 -1.55 0.00 0.00 70.33 67.90 2odx n THR 120 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 2odx s ILE 121 N 0.00 4.09 0.34 1.09 1.10 -1.26 -4.21 121.20 122.35 2odx s ILE 121 Ca 0.00 -0.73 0.06 0.00 -0.51 0.00 0.00 60.65 59.47 2odx s ILE 121 Cb 0.00 -2.86 -0.02 0.00 0.15 0.00 0.00 42.46 39.73 2odx s ILE 121 CO 0.00 0.30 0.33 1.15 -2.11 0.00 0.00 174.94 174.61 2odx n MET 122 N 1.15 0.48 -3.71 3.50 0.00 -1.12 -5.04 117.12 112.37 2odx n MET 122 Ca -0.13 -3.28 -0.18 0.00 0.00 0.00 0.00 57.70 54.11 2odx n MET 122 Cb 0.52 2.77 -0.17 0.00 0.00 0.00 0.00 33.22 36.35 2odx n MET 122 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 2odx s TRP 123 N -3.27 0.03 0.44 3.17 0.52 -1.26 -3.88 118.94 114.70 2odx s TRP 123 Ca 0.38 0.23 0.05 0.00 0.02 0.00 0.00 56.10 56.79 2odx s TRP 123 Cb 0.01 -0.37 -0.05 0.00 -1.15 0.00 0.00 33.47 31.91 2odx s TRP 123 CO 0.27 -0.16 0.05 -0.51 0.02 0.00 0.00 176.95 176.62 2odx s LEU 124 N 1.74 2.74 -0.35 2.99 1.43 0.04 -4.93 118.68 122.34 2odx s LEU 124 Ca -0.01 -1.40 -0.00 0.00 -1.03 0.00 0.00 54.13 51.68 2odx s LEU 124 Cb -0.12 -0.94 0.14 0.00 0.03 0.00 0.00 46.19 45.29 2odx s LEU 124 CO -0.03 -0.60 0.20 -0.54 0.23 0.00 0.00 176.35 175.61 2odx s LYS 125 N -3.80 0.54 0.65 1.70 1.02 -1.26 -0.49 119.74 118.09 2odx s LYS 125 Ca 0.28 -1.27 -0.06 0.00 0.02 0.00 0.00 55.97 54.93 2odx s LYS 125 Cb 0.06 -1.32 0.03 0.00 -0.52 0.00 0.00 37.83 36.09 2odx s LYS 125 CO 0.15 -1.19 0.96 -1.25 -0.92 0.00 0.00 175.35 173.09 2odx s PRO 126 N 1.15 2.58 0.03 -1.68 0.04 -1.22 -4.70 135.00 131.19 2odx s PRO 126 Ca 0.17 -0.12 -0.00 0.00 0.04 0.00 0.00 61.00 61.09 2odx s PRO 126 Cb -0.22 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 2odx s PRO 126 CO -0.03 -0.96 -0.03 0.99 0.04 0.00 0.00 177.00 177.01 2odx s THR 127 N -3.12 0.17 0.32 1.26 2.01 -1.26 -3.08 115.64 111.94 2odx s THR 127 Ca 0.57 -1.17 0.07 0.00 0.31 0.00 0.00 61.69 61.47 2odx s THR 127 Cb -0.11 -0.62 0.36 0.00 0.01 0.00 0.00 72.50 72.14 2odx s THR 127 CO 0.45 -0.63 1.61 1.62 -0.69 0.00 0.00 174.62 176.98 2odx h VAL 128 N 4.23 0.14 -0.13 3.82 3.04 -1.18 0.58 116.25 126.76 2odx h VAL 128 Ca -0.33 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 2odx h VAL 128 Cb 1.19 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2odx h VAL 128 CO 0.48 0.02 0.00 0.59 -1.01 0.00 0.00 177.57 177.65 2odx n ASN 129 N -5.31 1.59 -2.78 3.17 3.02 -1.26 -4.59 115.26 109.10 2odx n ASN 129 Ca 0.26 -1.65 -0.15 0.00 -0.03 0.00 0.00 54.58 53.01 2odx n ASN 129 Cb 0.87 -0.08 -0.06 0.00 -0.61 0.00 0.00 39.78 39.90 2odx n ASN 129 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2odx n GLU 130 N 0.26 0.35 -4.00 3.52 -0.58 0.19 -5.13 120.64 115.26 2odx n GLU 130 Ca 0.17 -2.65 -0.09 0.00 -0.42 0.00 0.00 57.16 54.17 2odx n GLU 130 Cb 0.33 2.21 -0.11 0.00 -0.57 0.00 0.00 31.44 33.30 2odx n GLU 130 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2odx s VAL 131 N -3.06 0.14 0.02 2.62 -7.23 -1.26 -4.03 120.40 107.59 2odx s VAL 131 Ca 0.31 -1.11 0.05 0.00 -1.81 0.00 0.00 61.98 59.42 2odx s VAL 131 Cb 0.01 -0.54 -0.02 0.00 0.56 0.00 0.00 36.38 36.40 2odx s VAL 131 CO 0.22 -0.61 -0.15 0.00 -0.31 0.00 0.00 175.10 174.26 2odx s ALA 132 N -2.00 1.22 -0.04 1.32 0.00 -0.74 -4.82 121.76 116.69 2odx s ALA 132 Ca -0.11 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.11 2odx s ALA 132 Cb -0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 2odx s ALA 132 CO -0.03 0.26 -0.09 0.50 0.00 0.00 0.00 175.76 176.40 2odx s ARG 133 N -0.83 2.62 0.90 0.00 3.52 -1.26 -0.75 118.95 123.15 2odx s ARG 133 Ca 0.04 -0.64 -0.11 0.00 -0.13 0.00 0.00 55.73 54.89 2odx s ARG 133 Cb -0.07 -2.51 0.13 0.00 -1.56 0.00 0.00 34.95 30.95 2odx s ARG 133 CO 0.01 0.64 1.14 0.00 -0.81 0.00 0.00 175.30 176.27 2odx n TRP 135 N -4.06 0.00 0.00 0.00 4.27 -1.26 -4.22 117.44 112.17 2odx n TRP 135 Ca 0.12 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.73 2odx n TRP 135 Cb 0.52 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.47 2odx n TRP 135 CO 0.00 0.00 0.00 0.39 -2.29 0.00 0.00 177.69 175.79 2odx n GLU 136 N -1.11 0.00 0.21 -2.67 -0.58 -1.26 -4.70 120.64 110.53 2odx n GLU 136 Ca 0.03 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.92 2odx n GLU 136 Cb 0.23 0.00 0.73 0.00 -0.57 0.00 0.00 31.44 31.83 2odx n GLU 136 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2odx n GLY 138 N -0.95 0.15 3.73 0.00 0.00 -1.26 -4.96 105.19 101.90 2odx n GLY 138 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 2odx n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2odx s SER 139 N -2.23 6.77 0.48 1.61 1.04 -1.26 -4.67 113.70 115.44 2odx s SER 139 Ca 0.00 2.48 -0.20 0.00 0.48 0.00 0.00 55.95 58.71 2odx s SER 139 Cb 0.00 -2.60 -0.09 0.00 0.10 0.00 0.00 66.02 63.43 2odx s SER 139 CO 0.00 -0.65 1.01 -0.69 0.98 0.00 0.00 173.24 173.88 2odx s VAL 140 N 0.53 4.05 0.04 5.02 1.01 -1.26 -1.45 120.40 128.34 2odx s VAL 140 Ca 0.62 1.22 0.03 0.00 0.00 0.00 0.00 61.98 63.85 2odx s VAL 140 Cb -0.39 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2odx s VAL 140 CO 0.36 -0.33 -0.09 -0.31 0.00 0.00 0.00 175.10 174.73 2odx s TYR 141 N -2.15 0.81 0.05 5.22 1.51 0.08 -4.24 117.35 118.62 2odx s TYR 141 Ca 0.64 -0.39 0.07 0.00 -1.01 0.00 0.00 57.07 56.39 2odx s TYR 141 Cb -0.13 -0.48 -0.03 0.00 -0.11 0.00 0.00 41.96 41.21 2odx s TYR 141 CO 0.20 -0.03 -0.21 0.21 -1.11 0.00 0.00 175.55 174.62 2odx s LYS 142 N -1.23 1.34 0.29 -0.62 2.20 0.12 -1.80 119.74 120.05 2odx s LYS 142 Ca -0.04 -0.97 -0.06 0.00 -0.36 0.00 0.00 55.97 54.54 2odx s LYS 142 Cb -0.08 -1.47 -0.05 0.00 -1.51 0.00 0.00 37.83 34.71 2odx s LYS 142 CO 0.01 0.37 0.57 -1.17 -0.36 0.00 0.00 175.35 174.77 2odx s LEU 143 N -1.29 4.05 0.16 5.43 0.20 -1.26 -0.78 118.68 125.20 2odx s LEU 143 Ca 0.07 0.76 0.10 0.00 0.69 0.00 0.00 54.13 55.75 2odx s LEU 143 Cb -0.09 -3.57 -0.04 0.00 -0.43 0.00 0.00 46.19 42.06 2odx s LEU 143 CO 0.02 -0.20 -0.18 0.54 -0.29 0.00 0.00 176.35 176.24 2odx s ASN 144 N -3.11 3.81 0.00 3.68 2.20 -1.25 -4.63 114.94 115.63 2odx s ASN 144 Ca 0.45 -0.68 0.16 0.00 -0.94 0.00 0.00 52.86 51.85 2odx s ASN 144 Cb -0.11 -0.48 0.85 0.00 -2.00 0.00 0.00 41.25 39.51 2odx s ASN 144 CO 0.29 0.14 1.44 -0.81 -2.94 0.00 0.00 177.10 175.22 2odx n PRO 145 N 0.41 0.29 -1.34 3.55 -0.04 -1.26 -4.57 135.00 132.04 2odx n PRO 145 Ca -0.13 0.10 -0.39 0.00 -0.04 0.00 0.00 63.50 63.04 2odx n PRO 145 Cb 0.55 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 2odx n PRO 145 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2odx n VAL 146 N -1.22 0.97 -1.89 0.52 3.14 -1.26 -4.97 118.33 113.62 2odx n VAL 146 Ca 0.09 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.97 2odx n VAL 146 Cb 0.11 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 32.61 2odx n VAL 146 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98