#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tqe s PRO 104 N 0.00 3.03 -0.46 1.43 0.04 -1.26 -5.08 135.00 132.70 1tqe s PRO 104 Ca 0.00 -0.56 0.06 0.00 0.04 0.00 0.00 61.00 60.54 1tqe s PRO 104 Cb 0.00 -2.82 0.22 0.00 0.04 0.00 0.00 34.50 31.94 1tqe s PRO 104 CO 0.00 0.61 0.70 1.17 0.04 0.00 0.00 177.00 179.52 1tqe n LYS 105 N 0.80 0.64 -1.97 4.56 4.81 -1.26 -5.15 118.16 120.59 1tqe n LYS 105 Ca -0.10 -2.34 -0.34 0.00 -0.87 0.00 0.00 58.31 54.66 1tqe n LYS 105 Cb 0.52 -1.43 0.03 0.00 0.02 0.00 0.00 35.03 34.17 1tqe n LYS 105 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1tqe s GLY 106 N -0.79 2.37 -0.59 3.14 0.00 -1.26 -4.93 107.32 105.25 1tqe s GLY 106 Ca 0.32 0.68 -0.26 0.00 0.00 0.00 0.00 44.72 45.46 1tqe s GLY 106 CO -0.17 1.03 2.07 -1.59 0.00 0.00 0.00 173.10 174.45 1tqe s THR 107 N -2.08 3.23 0.00 0.90 2.01 -1.26 -4.67 115.64 113.77 1tqe s THR 107 Ca 0.70 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.79 1tqe s THR 107 Cb -0.22 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.69 1tqe s THR 107 CO 0.35 -0.58 0.00 0.61 -0.69 0.00 0.00 174.62 174.31 1tqe n GLY 108 N 5.90 2.95 0.00 4.40 0.00 -1.26 -4.23 105.19 112.95 1tqe n GLY 108 Ca 0.28 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1tqe n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tqe n ALA 109 N 8.98 0.00 -3.65 4.61 0.00 -1.26 -5.11 120.51 124.09 1tqe n ALA 109 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1tqe n ALA 109 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1tqe n ALA 109 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tqe s SER 110 N 0.00 -0.02 -0.04 0.00 1.04 -1.26 -5.09 113.70 108.33 1tqe s SER 110 Ca 0.00 0.03 0.05 0.00 0.48 0.00 0.00 55.95 56.50 1tqe s SER 110 Cb 0.00 0.02 -0.06 0.00 0.10 0.00 0.00 66.02 66.08 1tqe s SER 110 CO 0.00 -0.02 0.03 1.07 0.98 0.00 0.00 173.24 175.30 1tqe n THR 111 N 0.59 0.30 -0.07 2.02 5.66 -1.26 -4.51 114.28 117.00 1tqe n THR 111 Ca -0.00 -0.20 -0.07 0.00 -3.05 0.00 0.00 64.05 60.73 1tqe n THR 111 Cb 0.59 -0.70 -0.03 0.00 -1.55 0.00 0.00 70.33 68.64 1tqe n THR 111 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1tqe n GLU 112 N -2.12 0.46 -0.30 1.09 4.07 -1.26 -4.08 120.64 118.50 1tqe n GLU 112 Ca -0.07 0.54 0.14 0.00 -0.06 0.00 0.00 57.16 57.70 1tqe n GLU 112 Cb 0.59 -1.70 0.31 0.00 -0.06 0.00 0.00 31.44 30.58 1tqe n GLU 112 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1tqe h VAL 113 N -1.00 0.42 -0.94 6.31 2.07 -1.99 1.02 116.25 122.14 1tqe h VAL 113 Ca -0.04 -0.12 0.13 0.00 0.82 0.00 0.00 66.70 67.50 1tqe h VAL 113 Cb 0.59 0.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.34 1tqe h VAL 113 CO -0.02 0.06 0.60 0.11 0.02 0.00 0.00 177.57 178.34 1tqe h LYS 114 N 0.34 0.81 0.18 1.57 1.57 -1.79 0.29 116.57 119.53 1tqe h LYS 114 Ca 0.56 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.29 1tqe h LYS 114 Cb 1.11 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1tqe h LYS 114 CO -0.57 0.54 -0.09 1.96 -0.57 0.00 0.00 179.45 180.72 1tqe h GLN 115 N 0.83 -0.23 -0.80 3.15 1.08 0.93 -2.28 115.11 117.79 1tqe h GLN 115 Ca 0.47 0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.67 1tqe h GLN 115 Cb 0.60 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.05 1tqe h GLN 115 CO -0.23 -0.07 0.45 -0.22 -0.95 0.00 0.00 178.83 177.81 1tqe h LYS 116 N -0.35 1.11 -0.68 1.46 1.63 -0.76 -2.46 116.57 116.53 1tqe h LYS 116 Ca -0.02 -0.12 -0.00 0.00 -0.85 0.00 0.00 60.65 59.66 1tqe h LYS 116 Cb 0.27 -0.22 -0.03 0.00 -0.60 0.00 0.00 32.23 31.64 1tqe h LYS 116 CO 0.04 0.80 0.42 1.25 -3.45 0.00 0.00 179.45 178.51 1tqe h LEU 117 N 1.12 0.80 0.33 5.20 5.85 -0.31 -3.12 115.31 125.18 1tqe h LEU 117 Ca 0.28 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 1tqe h LEU 117 Cb 0.01 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1tqe h LEU 117 CO -0.05 0.61 -0.16 -0.61 -0.34 0.00 0.00 178.44 177.89 1tqe h GLN 118 N 0.93 -0.43 -1.16 1.25 4.15 -0.93 -1.96 115.11 116.97 1tqe h GLN 118 Ca 0.25 0.03 0.33 0.00 0.77 0.00 0.00 58.65 60.02 1tqe h GLN 118 Cb -0.05 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 27.66 1tqe h GLN 118 CO -0.05 -0.10 0.78 0.93 -1.93 0.00 0.00 178.83 178.47 1tqe h GLU 119 N -0.86 0.18 0.47 1.69 5.08 -1.53 -0.43 114.58 119.19 1tqe h GLU 119 Ca -0.05 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1tqe h GLU 119 Cb 0.53 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1tqe h GLU 119 CO 0.07 0.12 -0.23 0.35 -1.00 0.00 0.00 179.01 178.33 1tqe h PHE 120 N 0.19 -0.59 -0.84 4.33 3.57 -1.47 -2.58 116.94 119.54 1tqe h PHE 120 Ca 0.62 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 62.32 1tqe h PHE 120 Cb 2.00 0.19 -0.14 0.00 2.79 0.00 0.00 35.95 40.80 1tqe h PHE 120 CO -0.00 -0.37 0.17 -0.07 -2.23 0.00 0.00 178.31 175.81 1tqe h LEU 121 N -1.01 -0.09 0.18 0.59 4.07 -0.33 0.38 115.31 119.10 1tqe h LEU 121 Ca -0.06 0.19 -0.01 0.00 0.08 0.00 0.00 57.88 58.08 1tqe h LEU 121 Cb 0.49 0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.51 1tqe h LEU 121 CO 0.11 -0.15 -0.09 -0.07 -1.08 0.00 0.00 178.44 177.16 1tqe h LEU 122 N 0.19 -0.21 -2.12 1.67 4.07 -1.30 -3.06 115.31 114.55 1tqe h LEU 122 Ca 0.51 -0.25 0.02 0.00 0.08 0.00 0.00 57.88 58.24 1tqe h LEU 122 Cb 0.99 0.05 -0.00 0.00 1.08 0.00 0.00 40.66 42.78 1tqe h LEU 122 CO -0.65 0.15 0.05 0.77 -1.08 0.00 0.00 178.44 177.68 1tqe h SER 123 N -0.59 0.00 0.00 -0.43 4.64 -0.99 -1.74 113.55 114.43 1tqe h SER 123 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1tqe h SER 123 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1tqe h SER 123 CO 0.04 0.00 0.00 1.17 -0.87 0.00 0.00 176.83 177.17 1tqe n LYS 124 N -4.32 0.00 0.00 4.77 4.81 0.07 -5.10 118.16 118.39 1tqe n LYS 124 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 1tqe n LYS 124 Cb 0.16 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.21 1tqe n LYS 124 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00