#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ard s SER 103 N 0.00 4.73 0.04 2.89 0.01 -1.26 -5.05 113.70 115.06 1ard s SER 103 Ca 0.00 -0.12 -0.29 0.00 1.31 0.00 0.00 55.95 56.85 1ard s SER 103 Cb 0.00 -1.68 -0.15 0.00 0.21 0.00 0.00 66.02 64.40 1ard s SER 103 CO 0.00 0.20 0.73 0.49 0.41 0.00 0.00 173.24 175.07 1ard n PHE 104 N 3.31 0.28 -3.65 2.43 3.72 -1.26 -4.81 117.46 117.48 1ard n PHE 104 Ca -0.18 0.81 -0.24 0.00 -0.05 0.00 0.00 57.45 57.80 1ard n PHE 104 Cb 0.53 -1.62 -0.17 0.00 -0.94 0.00 0.00 39.48 37.28 1ard n PHE 104 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1ard s VAL 105 N -0.19 -0.01 -0.77 -4.37 1.01 -1.26 -3.05 120.40 111.75 1ard s VAL 105 Ca 0.66 -0.01 -0.25 0.00 0.00 0.00 0.00 61.98 62.38 1ard s VAL 105 Cb -0.93 -0.49 -0.16 0.00 0.00 0.00 0.00 36.38 34.79 1ard s VAL 105 CO 0.45 -0.11 2.47 0.00 0.00 0.00 0.00 175.10 177.90 1ard h GLU 107 N 14.97 0.00 0.19 0.00 4.11 -1.93 8.33 114.58 140.25 1ard h GLU 107 Ca -0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 1ard h GLU 107 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1ard h GLU 107 CO 1.27 0.00 -0.09 0.28 0.07 0.00 0.00 179.01 180.54 1ard h VAL 108 N 0.00 0.00 0.03 -1.06 2.07 -1.98 -3.38 116.25 111.93 1ard h VAL 108 Ca 0.00 -0.11 -0.34 0.00 0.82 0.00 0.00 66.70 67.07 1ard h VAL 108 Cb 0.43 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 1ard h VAL 108 CO 0.00 0.00 -2.04 0.00 0.02 0.00 0.00 177.57 175.55 1ard n THR 110 N -3.12 0.00 -3.54 0.00 -2.24 2.66 -5.02 114.28 103.02 1ard n THR 110 Ca -0.28 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.13 1ard n THR 110 Cb 1.07 -0.28 -0.09 0.00 -2.10 0.00 0.00 70.33 68.93 1ard n THR 110 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ard s ARG 111 N -1.35 4.11 0.24 -0.78 0.52 -1.16 -4.70 118.95 115.83 1ard s ARG 111 Ca 0.00 -0.06 -0.05 0.00 -0.52 0.00 0.00 55.73 55.10 1ard s ARG 111 Cb 0.00 -3.54 -0.05 0.00 0.52 0.00 0.00 34.95 31.88 1ard s ARG 111 CO 0.00 0.01 0.49 0.00 0.02 0.00 0.00 175.30 175.83 1ard s ALA 112 N 1.18 3.68 0.24 2.13 0.00 -1.26 -0.78 121.76 126.95 1ard s ALA 112 Ca 0.13 -0.57 -0.04 0.00 0.00 0.00 0.00 51.96 51.47 1ard s ALA 112 Cb -0.14 -2.23 -0.03 0.00 0.00 0.00 0.00 23.12 20.72 1ard s ALA 112 CO 0.06 0.38 0.27 -0.06 0.00 0.00 0.00 175.76 176.41 1ard s PHE 113 N -1.94 0.97 -0.07 0.00 0.08 -1.17 -5.00 117.98 110.85 1ard s PHE 113 Ca 0.43 -1.21 -0.04 0.00 0.12 0.00 0.00 56.93 56.24 1ard s PHE 113 Cb -0.11 -0.32 -0.27 0.00 -0.57 0.00 0.00 43.02 41.75 1ard s PHE 113 CO 0.28 -0.80 0.58 0.00 -0.10 0.00 0.00 175.22 175.17 1ard h ALA 114 N 2.43 0.40 -2.78 5.36 0.00 -1.99 -3.41 119.26 119.27 1ard h ALA 114 Ca -0.32 -1.30 -0.59 0.00 0.00 0.00 0.00 54.91 52.71 1ard h ALA 114 Cb 1.25 0.53 -0.09 0.00 0.00 0.00 0.00 17.79 19.48 1ard h ALA 114 CO 0.45 1.27 -0.61 1.03 0.00 0.00 0.00 179.25 181.40 1ard s ARG 115 N -2.58 2.68 0.13 0.00 0.52 -1.26 -5.02 118.95 113.43 1ard s ARG 115 Ca -0.15 -0.97 -0.06 0.00 -0.52 0.00 0.00 55.73 54.03 1ard s ARG 115 Cb 0.07 -2.52 -0.07 0.00 0.52 0.00 0.00 34.95 32.95 1ard s ARG 115 CO 0.81 0.47 1.33 1.96 0.02 0.00 0.00 175.30 179.90 1ard h GLN 116 N 2.55 0.50 -0.95 3.54 7.50 -1.99 -3.16 115.11 123.10 1ard h GLN 116 Ca -0.47 -0.48 0.13 0.00 0.50 0.00 0.00 58.65 58.33 1ard h GLN 116 Cb 1.20 0.12 -0.08 0.00 0.05 0.00 0.00 27.48 28.77 1ard h GLN 116 CO 0.61 1.11 0.61 0.93 -1.50 0.00 0.00 178.83 180.59 1ard h GLU 117 N 0.31 0.85 -0.44 1.46 4.39 -1.98 -0.49 114.58 118.69 1ard h GLU 117 Ca -0.07 -0.05 0.08 0.00 0.34 0.00 0.00 59.36 59.66 1ard h GLU 117 Cb 1.48 -0.19 -0.07 0.00 -0.10 0.00 0.00 28.75 29.87 1ard h GLU 117 CO 0.16 0.56 0.04 0.45 -1.16 0.00 0.00 179.01 179.06 1ard h HIS 118 N 0.88 0.05 0.70 4.33 3.86 -1.96 0.71 115.15 123.71 1ard h HIS 118 Ca 0.47 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.68 1ard h HIS 118 Cb 0.56 0.05 0.01 0.00 1.06 0.00 0.00 27.41 29.09 1ard h HIS 118 CO -0.00 -0.05 -0.33 1.25 0.86 0.00 0.00 177.93 179.65 1ard h LEU 119 N 0.16 -0.79 -0.04 2.43 5.85 -1.24 0.31 115.31 121.99 1ard h LEU 119 Ca 0.22 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1ard h LEU 119 Cb 0.30 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1ard h LEU 119 CO -0.33 -0.52 -0.06 0.50 -0.34 0.00 0.00 178.44 177.68 1ard h LYS 120 N -1.02 -0.05 -1.17 1.25 1.63 -1.00 0.89 116.57 117.11 1ard h LYS 120 Ca -0.10 0.00 0.33 0.00 -0.85 0.00 0.00 60.65 60.04 1ard h LYS 120 Cb 0.72 0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 32.27 1ard h LYS 120 CO 0.16 -0.03 0.78 -0.09 -3.45 0.00 0.00 179.45 176.81 1ard h ARG 121 N -0.05 0.21 0.17 1.90 9.65 0.36 0.29 114.38 126.91 1ard h ARG 121 Ca 0.01 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 1ard h ARG 121 Cb 0.07 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 1ard h ARG 121 CO -0.06 0.14 -0.08 1.25 2.80 0.00 0.00 179.97 184.01 1ard h HIS 122 N 0.21 -0.22 -1.04 2.20 -0.00 0.30 -2.93 115.15 113.68 1ard h HIS 122 Ca 0.65 -0.01 0.40 0.00 -0.00 0.00 0.00 60.37 61.41 1ard h HIS 122 Cb 2.00 0.07 -0.17 0.00 -0.00 0.00 0.00 27.41 29.32 1ard h HIS 122 CO -0.00 0.09 0.59 1.88 -0.00 0.00 0.00 177.93 180.49 1ard h TYR 123 N -0.53 0.82 -0.61 5.26 0.05 0.44 0.17 116.97 122.56 1ard h TYR 123 Ca -0.02 0.04 0.24 0.00 0.05 0.00 0.00 58.73 59.04 1ard h TYR 123 Cb 0.41 -0.20 -0.11 0.00 1.01 0.00 0.00 36.73 37.84 1ard h TYR 123 CO 0.02 -0.37 0.28 2.89 -1.05 0.00 0.00 178.16 179.93 1ard n ARG 124 N -5.14 -0.04 -0.12 4.88 0.00 -1.08 0.46 116.66 115.62 1ard n ARG 124 Ca 0.36 0.86 -0.11 0.00 -0.00 0.00 0.00 57.85 58.96 1ard n ARG 124 Cb 1.23 -1.51 -0.02 0.00 -0.00 0.00 0.00 32.46 32.16 1ard n ARG 124 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1ard h SER 125 N 0.00 0.61 0.24 2.89 4.64 -0.86 -1.63 113.55 119.44 1ard h SER 125 Ca 0.50 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1ard h SER 125 Cb 1.29 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1ard h SER 125 CO -0.49 0.77 0.00 1.41 -0.87 0.00 0.00 176.83 177.65 1ard n HIS 126 N -4.50 0.00 -3.88 4.77 8.25 1.62 -4.20 115.22 117.28 1ard n HIS 126 Ca -0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.15 1ard n HIS 126 Cb 0.27 -0.43 -0.16 0.00 1.12 0.00 0.00 29.99 30.80 1ard n HIS 126 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ard s THR 127 N -2.86 1.27 0.57 1.59 -4.23 -0.31 -4.97 115.64 106.70 1ard s THR 127 Ca 0.05 -1.15 0.32 0.00 -1.18 0.00 0.00 61.69 59.73 1ard s THR 127 Cb 0.05 -1.66 0.45 0.00 1.34 0.00 0.00 72.50 72.69 1ard s THR 127 CO 0.14 -0.21 1.79 0.78 -0.54 0.00 0.00 174.62 176.58 1ard h ASN 128 N 8.02 0.00 -2.06 3.99 2.35 -1.73 -3.34 115.58 122.80 1ard h ASN 128 Ca -0.16 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.07 1ard h ASN 128 Cb 1.07 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.38 1ard h ASN 128 CO 0.41 0.00 1.18 -1.61 -1.65 0.00 0.00 177.43 175.76 1ard s GLU 129 N -4.74 2.98 0.00 0.81 8.01 -1.26 -5.07 118.70 119.42 1ard s GLU 129 Ca -0.04 0.02 0.00 0.00 0.01 0.00 0.00 54.97 54.95 1ard s GLU 129 Cb 0.19 -4.37 0.00 0.00 -4.31 0.00 0.00 34.13 25.63 1ard s GLU 129 CO 0.65 -2.43 0.31 1.17 0.01 0.00 0.00 175.26 174.97