#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 -0.37 0.00 0.03 5.09 -2.00 -3.47 116.57 115.85 2odx h LYS 95 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.77 2odx h LYS 95 Cb 0.00 0.08 0.00 0.00 0.10 0.00 0.00 32.23 32.41 2odx h LYS 95 CO 0.00 -0.25 0.00 -3.47 -2.09 0.00 0.00 179.45 173.64 2odx n ASP 96 N -4.52 0.00 -0.11 7.07 2.03 -1.26 -5.07 116.55 114.69 2odx n ASP 96 Ca -0.05 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.05 2odx n ASP 96 Cb 0.15 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.45 2odx n ASP 96 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2odx n PRO 97 N 0.00 0.56 -3.76 -0.67 -0.04 -1.26 -5.02 135.00 124.80 2odx n PRO 97 Ca 0.00 0.50 -0.13 0.00 -0.04 0.00 0.00 63.50 63.83 2odx n PRO 97 Cb 0.00 -1.68 -0.10 0.00 -0.04 0.00 0.00 33.50 31.67 2odx n PRO 97 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2odx s ILE 98 N -2.39 0.02 -0.12 0.52 -1.09 -1.26 -5.04 121.20 111.84 2odx s ILE 98 Ca -0.29 -0.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 2odx s ILE 98 Cb 0.07 -0.51 -0.02 0.00 -1.58 0.00 0.00 42.46 40.42 2odx s ILE 98 CO 0.53 -0.09 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.40 2odx s ILE 99 N -0.32 3.11 -0.28 2.92 -1.09 -1.26 -0.74 121.20 123.55 2odx s ILE 99 Ca -0.04 -0.65 -0.00 0.00 -2.23 0.00 0.00 60.65 57.72 2odx s ILE 99 Cb -0.03 -2.30 0.05 0.00 -1.58 0.00 0.00 42.46 38.60 2odx s ILE 99 CO 0.02 0.53 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.58 2odx s ILE 100 N 0.16 2.73 -0.28 2.92 -1.09 -0.26 -4.95 121.20 120.44 2odx s ILE 100 Ca -0.07 -1.36 -0.29 0.00 -2.23 0.00 0.00 60.65 56.70 2odx s ILE 100 Cb -0.15 -2.53 0.00 0.00 -1.58 0.00 0.00 42.46 38.20 2odx s ILE 100 CO 0.05 -0.01 1.24 -0.70 -1.23 0.00 0.00 174.94 174.29 2odx s GLU 101 N 1.23 4.01 -0.01 2.79 2.12 -1.26 -3.54 118.70 124.03 2odx s GLU 101 Ca -0.05 1.28 -0.02 0.00 0.36 0.00 0.00 54.97 56.54 2odx s GLU 101 Cb -0.19 -3.82 -0.01 0.00 0.26 0.00 0.00 34.13 30.37 2odx s GLU 101 CO -0.03 -0.99 -0.04 0.45 -0.54 0.00 0.00 175.26 174.11 2odx n SER 102 N 7.24 0.35 0.00 -1.70 2.88 -1.26 -5.00 113.62 116.13 2odx n SER 102 Ca 0.14 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 2odx n SER 102 Cb 0.46 -0.36 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 2odx n SER 102 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2odx n TYR 103 N -2.84 0.00 -4.27 0.66 4.01 -1.23 -5.00 117.16 108.49 2odx n TYR 103 Ca -0.02 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.44 2odx n TYR 103 Cb 0.07 -0.28 -0.10 0.00 -0.31 0.00 0.00 39.34 38.72 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 -3.10 4.24 0.24 7.72 1.01 -1.26 -4.88 116.67 120.64 2odx s ASP 104 Ca 0.00 -0.51 0.24 0.00 0.71 0.00 0.00 52.55 52.99 2odx s ASP 104 Cb 0.00 -0.73 0.94 0.00 1.01 0.00 0.00 42.92 44.14 2odx s ASP 104 CO 0.00 0.14 1.73 0.47 0.21 0.00 0.00 175.17 177.71 2odx n ASP 105 N 0.36 0.69 0.00 0.27 9.92 -1.26 -4.20 116.55 122.34 2odx n ASP 105 Ca -0.12 0.64 0.00 0.00 -0.53 0.00 0.00 54.79 54.78 2odx n ASP 105 Cb 0.54 -0.80 0.00 0.00 -0.64 0.00 0.00 41.12 40.22 2odx n ASP 105 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2odx n TYR 106 N -2.23 0.00 -1.33 1.24 0.18 -1.26 0.16 117.16 113.92 2odx n TYR 106 Ca 0.03 -0.10 -0.34 0.00 1.88 0.00 0.00 57.90 59.37 2odx n TYR 106 Cb 0.28 -0.01 0.10 0.00 -0.38 0.00 0.00 39.34 39.33 2odx n TYR 106 CO 0.00 0.00 0.00 0.50 -2.08 0.00 0.00 176.86 175.28 2odx s ARG 107 N -0.19 1.98 0.90 -3.48 3.52 -1.25 -4.72 118.95 115.70 2odx s ARG 107 Ca 0.00 1.75 -0.13 0.00 -0.13 0.00 0.00 55.73 57.22 2odx s ARG 107 Cb 0.00 -1.82 0.14 0.00 -1.56 0.00 0.00 34.95 31.71 2odx s ARG 107 CO 0.00 -1.95 1.18 1.52 -0.81 0.00 0.00 175.30 175.24 2odx s TYR 108 N -2.05 2.41 0.04 5.12 1.13 -1.26 -3.68 117.35 119.05 2odx s TYR 108 Ca 0.74 0.72 0.02 0.00 -1.41 0.00 0.00 57.07 57.14 2odx s TYR 108 Cb -0.29 -3.54 -0.02 0.00 -1.10 0.00 0.00 41.96 37.01 2odx s TYR 108 CO 0.47 -2.30 -0.08 0.54 -2.51 0.00 0.00 175.55 171.67 2odx s VAL 109 N -3.45 0.57 -0.17 -3.49 0.11 0.74 -4.91 120.40 109.79 2odx s VAL 109 Ca 0.65 -1.01 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2odx s VAL 109 Cb -0.12 -0.62 0.02 0.00 -1.53 0.00 0.00 36.38 34.13 2odx s VAL 109 CO 0.52 -0.32 -0.20 -0.83 -3.33 0.00 0.00 175.10 170.94 2odx s GLY 110 N -1.44 1.39 0.28 6.54 0.00 -1.26 -1.38 107.32 111.44 2odx s GLY 110 Ca -0.08 -1.18 0.10 0.00 0.00 0.00 0.00 44.72 43.56 2odx s GLY 110 CO 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 173.10 173.27 2odx n THR 112 N -0.86 1.38 0.00 0.00 -2.24 -1.26 -2.31 114.28 108.99 2odx n THR 112 Ca -0.06 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.37 2odx n THR 112 Cb 0.60 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 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 -0.27 0.90 0.00 3.38 0.00 -1.26 -0.78 105.19 107.16 2odx n GLY 113 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2odx n GLY 113 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2odx n SER 114 N 0.01 0.00 0.32 1.61 2.88 -1.26 -4.89 113.62 112.29 2odx n SER 114 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 2odx n SER 114 Cb 0.00 0.00 0.91 0.00 -0.75 0.00 0.00 64.21 64.37 2odx n SER 114 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2odx h PRO 115 N 0.00 0.00 -1.56 -1.46 0.13 -2.03 -2.54 132.00 124.54 2odx h PRO 115 Ca 0.00 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.70 2odx h PRO 115 Cb 0.00 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 30.96 2odx h PRO 115 CO 0.00 0.00 0.50 0.00 -0.23 0.00 0.00 178.00 178.27 2odx n ALA 116 N -1.97 5.64 -3.06 -0.56 0.00 -1.26 -4.94 120.51 114.36 2odx n ALA 116 Ca -0.02 -2.31 -0.20 0.00 0.00 0.00 0.00 53.44 50.92 2odx n ALA 116 Cb 0.32 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.15 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 0.24 -0.49 0.09 0.00 0.00 -0.96 -4.82 105.19 99.25 2odx n GLY 117 Ca 0.40 0.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.34 2odx n GLY 117 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2odx h SER 118 N -0.75 0.18 0.00 1.61 0.02 -1.37 -3.46 113.55 109.78 2odx h SER 118 Ca -0.40 -0.77 0.00 0.00 -0.84 0.00 0.00 61.79 59.78 2odx h SER 118 Cb 1.28 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2odx h SER 118 CO 0.48 0.93 0.00 0.00 -1.14 0.00 0.00 176.83 177.10 2odx n HIS 119 N -4.54 0.00 0.00 3.45 1.44 0.04 -5.02 115.22 110.59 2odx n HIS 119 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 2odx n HIS 119 Cb 0.48 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.59 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 -4.24 0.61 5.66 -1.26 -4.94 114.28 110.11 2odx n THR 120 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 2odx n THR 120 Cb 0.00 -1.39 -0.08 0.00 -1.55 0.00 0.00 70.33 67.31 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 4.49 0.32 1.09 1.10 -1.26 -4.18 121.20 122.76 2odx s ILE 121 Ca 0.00 -0.34 -0.10 0.00 -0.51 0.00 0.00 60.65 59.70 2odx s ILE 121 Cb 0.00 -2.97 0.01 0.00 0.15 0.00 0.00 42.46 39.66 2odx s ILE 121 CO 0.00 0.48 0.56 0.00 -2.11 0.00 0.00 174.94 173.87 2odx s MET 122 N -1.29 1.86 -0.03 3.50 0.23 -0.98 -5.03 119.30 117.56 2odx s MET 122 Ca 0.18 -1.48 -0.01 0.00 -1.03 0.00 0.00 55.69 53.35 2odx s MET 122 Cb -0.12 0.50 0.03 0.00 -1.53 0.00 0.00 34.83 33.72 2odx s MET 122 CO 0.08 -0.80 0.05 -1.58 -2.03 0.00 0.00 175.02 170.74 2odx s TRP 123 N -3.25 -0.01 0.34 3.16 0.52 -1.26 -3.06 118.94 115.37 2odx s TRP 123 Ca 0.23 0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.58 2odx s TRP 123 Cb -0.02 -0.19 -0.04 0.00 -1.15 0.00 0.00 33.47 32.07 2odx s TRP 123 CO 0.14 -0.10 0.12 -0.51 0.02 0.00 0.00 176.95 176.62 2odx s LEU 124 N 1.02 1.87 -0.27 2.99 1.43 -0.48 -4.97 118.68 120.28 2odx s LEU 124 Ca -0.08 -1.54 -0.03 0.00 -1.03 0.00 0.00 54.13 51.45 2odx s LEU 124 Cb -0.12 -0.03 0.11 0.00 0.03 0.00 0.00 46.19 46.18 2odx s LEU 124 CO -0.03 -0.83 0.20 -1.59 0.23 0.00 0.00 176.35 174.33 2odx s LYS 125 N -3.82 0.23 1.16 1.70 -2.85 -1.26 -0.19 119.74 114.70 2odx s LYS 125 Ca 0.32 -0.24 -0.18 0.00 -1.00 0.00 0.00 55.97 54.87 2odx s LYS 125 Cb 0.05 -1.04 0.27 0.00 -2.06 0.00 0.00 37.83 35.05 2odx s LYS 125 CO 0.16 -0.94 1.13 -1.25 0.10 0.00 0.00 175.35 174.55 2odx s PRO 126 N 2.23 -0.85 0.05 1.78 0.04 -1.24 -4.67 135.00 132.33 2odx s PRO 126 Ca 0.08 -0.04 -0.01 0.00 0.04 0.00 0.00 61.00 61.07 2odx s PRO 126 Cb -0.15 -1.64 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 2odx s PRO 126 CO -0.29 -3.47 -0.03 0.99 0.04 0.00 0.00 177.00 174.23 2odx s THR 127 N -3.10 0.24 0.36 1.26 2.01 -1.26 -3.92 115.64 111.24 2odx s THR 127 Ca 0.71 -1.73 0.14 0.00 0.31 0.00 0.00 61.69 61.12 2odx s THR 127 Cb -0.10 -1.40 0.35 0.00 0.01 0.00 0.00 72.50 71.36 2odx s THR 127 CO 0.56 -0.94 1.76 1.62 -0.69 0.00 0.00 174.62 176.93 2odx h VAL 128 N 3.29 0.56 -0.00 3.82 3.04 -0.56 0.20 116.25 126.60 2odx h VAL 128 Ca -0.34 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 2odx h VAL 128 Cb 1.15 0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.44 2odx h VAL 128 CO 0.63 0.09 -0.04 0.59 -1.01 0.00 0.00 177.57 177.84 2odx n ASN 129 N -4.72 0.06 -1.78 3.17 3.02 -1.26 -4.73 115.26 109.02 2odx n ASN 129 Ca 0.25 0.17 -0.07 0.00 -0.03 0.00 0.00 54.58 54.91 2odx n ASN 129 Cb 0.79 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.58 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 -1.39 0.16 -4.14 3.52 1.02 0.70 -5.14 120.64 115.37 2odx n GLU 130 Ca 0.10 -1.16 -0.10 0.00 -0.02 0.00 0.00 57.16 55.97 2odx n GLU 130 Cb 0.30 0.97 -0.09 0.00 -0.02 0.00 0.00 31.44 32.60 2odx n GLU 130 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2odx s VAL 131 N -2.49 0.05 -0.08 2.62 -7.23 -1.26 -4.00 120.40 108.01 2odx s VAL 131 Ca 0.14 -1.86 -0.11 0.00 -1.81 0.00 0.00 61.98 58.34 2odx s VAL 131 Cb 0.01 -2.20 0.03 0.00 0.56 0.00 0.00 36.38 34.77 2odx s VAL 131 CO 0.10 -0.25 0.29 0.00 -0.31 0.00 0.00 175.10 174.93 2odx s ALA 132 N -4.08 -0.71 -0.06 1.32 0.00 -0.24 -4.54 121.76 113.46 2odx s ALA 132 Ca 0.29 0.67 -0.05 0.00 0.00 0.00 0.00 51.96 52.87 2odx s ALA 132 Cb 0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 2odx s ALA 132 CO 0.06 -0.17 0.16 0.50 0.00 0.00 0.00 175.76 176.31 2odx s ARG 133 N -0.23 3.44 1.24 0.00 3.52 -1.26 -0.50 118.95 125.15 2odx s ARG 133 Ca -0.04 -0.24 -0.18 0.00 -0.13 0.00 0.00 55.73 55.14 2odx s ARG 133 Cb -0.03 -3.13 0.30 0.00 -1.56 0.00 0.00 34.95 30.53 2odx s ARG 133 CO 0.01 0.72 1.03 0.00 -0.81 0.00 0.00 175.30 176.25 2odx n TRP 135 N -5.02 0.00 -0.07 0.00 4.27 -1.26 -4.27 117.44 111.08 2odx n TRP 135 Ca 0.09 0.00 -0.06 0.00 -3.89 0.00 0.00 57.50 53.64 2odx n TRP 135 Cb 0.58 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.51 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 -0.72 0.45 0.16 -2.67 -0.58 -1.26 -4.46 120.64 111.55 2odx n GLU 136 Ca 0.00 0.34 0.05 0.00 -0.42 0.00 0.00 57.16 57.14 2odx n GLU 136 Cb 0.00 -1.48 0.06 0.00 -0.57 0.00 0.00 31.44 29.45 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 1.20 1.05 3.75 0.00 0.00 -1.26 -4.99 105.19 104.94 2odx n GLY 138 Ca 0.02 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2odx n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2odx s SER 139 N -2.51 6.87 0.34 1.61 0.01 -1.26 -4.55 113.70 114.20 2odx s SER 139 Ca 0.00 2.52 -0.22 0.00 1.31 0.00 0.00 55.95 59.56 2odx s SER 139 Cb 0.00 -2.63 -0.10 0.00 0.21 0.00 0.00 66.02 63.50 2odx s SER 139 CO 0.00 -0.50 0.87 -0.69 0.41 0.00 0.00 173.24 173.33 2odx s VAL 140 N -0.51 4.41 0.06 3.43 1.01 -1.26 -0.96 120.40 126.58 2odx s VAL 140 Ca 0.53 1.48 0.04 0.00 0.00 0.00 0.00 61.98 64.03 2odx s VAL 140 Cb -0.38 -3.79 -0.03 0.00 0.00 0.00 0.00 36.38 32.18 2odx s VAL 140 CO 0.44 -0.04 -0.13 -0.31 0.00 0.00 0.00 175.10 175.07 2odx s TYR 141 N -1.83 1.08 0.09 5.22 1.51 0.34 -4.20 117.35 119.56 2odx s TYR 141 Ca 0.53 -0.47 0.07 0.00 -1.01 0.00 0.00 57.07 56.19 2odx s TYR 141 Cb -0.14 -0.61 -0.03 0.00 -0.11 0.00 0.00 41.96 41.06 2odx s TYR 141 CO 0.19 0.02 -0.19 0.21 -1.11 0.00 0.00 175.55 174.67 2odx s LYS 142 N -1.70 1.02 0.30 -0.62 2.20 0.08 -1.07 119.74 119.95 2odx s LYS 142 Ca -0.04 -1.09 -0.04 0.00 -0.36 0.00 0.00 55.97 54.44 2odx s LYS 142 Cb -0.10 -1.19 -0.05 0.00 -1.51 0.00 0.00 37.83 34.98 2odx s LYS 142 CO 0.02 0.27 0.55 -1.17 -0.36 0.00 0.00 175.35 174.67 2odx s LEU 143 N -1.86 4.04 0.14 5.43 0.20 -1.26 -1.10 118.68 124.28 2odx s LEU 143 Ca 0.04 0.67 0.07 0.00 0.69 0.00 0.00 54.13 55.59 2odx s LEU 143 Cb -0.10 -3.49 -0.04 0.00 -0.43 0.00 0.00 46.19 42.13 2odx s LEU 143 CO 0.04 -0.22 -0.04 0.54 -0.29 0.00 0.00 176.35 176.37 2odx s ASN 144 N -3.34 4.63 0.00 3.68 2.20 -1.23 -4.67 114.94 116.21 2odx s ASN 144 Ca 0.43 -0.37 0.12 0.00 -0.94 0.00 0.00 52.86 52.09 2odx s ASN 144 Cb -0.11 -0.95 0.59 0.00 -2.00 0.00 0.00 41.25 38.78 2odx s ASN 144 CO 0.31 0.14 1.29 -0.81 -2.94 0.00 0.00 177.10 175.09 2odx n PRO 145 N 0.30 0.15 -1.23 3.55 -0.04 -1.26 -4.64 135.00 131.83 2odx n PRO 145 Ca -0.11 0.18 -0.47 0.00 -0.04 0.00 0.00 63.50 63.07 2odx n PRO 145 Cb 0.54 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.30 0.57 -0.40 0.52 3.14 -1.26 -4.97 118.33 114.63 2odx n VAL 146 Ca 0.05 -0.14 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 2odx n VAL 146 Cb 0.10 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.88 2odx n VAL 146 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98