#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1are s SER 103 N 0.00 -0.16 -0.96 0.55 0.01 -1.26 -5.08 113.70 106.80 1are s SER 103 Ca 0.00 -0.65 -0.24 0.00 1.31 0.00 0.00 55.95 56.37 1are s SER 103 Cb 0.00 0.55 -0.01 0.00 0.21 0.00 0.00 66.02 66.77 1are s SER 103 CO 0.00 -1.04 1.77 -0.36 0.41 0.00 0.00 173.24 174.03 1are s PHE 104 N -3.92 2.07 0.12 2.43 0.08 -1.26 -4.93 117.98 112.57 1are s PHE 104 Ca 0.13 0.09 0.10 0.00 0.12 0.00 0.00 56.93 57.37 1are s PHE 104 Cb -0.00 -4.28 -0.04 0.00 -0.57 0.00 0.00 43.02 38.13 1are s PHE 104 CO 0.00 -1.80 -0.26 0.08 -0.10 0.00 0.00 175.22 173.15 1are s VAL 105 N 8.28 2.13 -0.74 -0.44 1.01 -1.26 -0.14 120.40 129.22 1are s VAL 105 Ca 0.62 -1.69 -0.17 0.00 0.00 0.00 0.00 61.98 60.74 1are s VAL 105 Cb -0.04 -1.89 0.15 0.00 0.00 0.00 0.00 36.38 34.60 1are s VAL 105 CO -0.03 0.07 0.81 0.00 0.00 0.00 0.00 175.10 175.95 1are h GLU 107 N 8.63 0.04 0.23 0.00 3.07 -1.91 7.87 114.58 132.52 1are h GLU 107 Ca -0.06 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1are h GLU 107 Cb 1.06 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.95 1are h GLU 107 CO 0.99 0.03 -0.23 0.28 -1.40 0.00 0.00 179.01 178.68 1are h VAL 108 N 0.04 0.00 0.00 3.13 2.07 -1.98 -3.38 116.25 116.14 1are h VAL 108 Ca 0.48 0.00 -0.37 0.00 0.82 0.00 0.00 66.70 67.63 1are h VAL 108 Cb 1.84 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.55 1are h VAL 108 CO -0.03 0.00 -2.33 0.00 0.02 0.00 0.00 177.57 175.23 1are n THR 110 N -3.59 0.00 -1.99 0.00 5.66 2.51 -4.99 114.28 111.88 1are n THR 110 Ca -0.44 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.14 1are n THR 110 Cb 0.89 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.64 1are n THR 110 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1are s ARG 111 N -0.02 4.11 0.09 1.09 1.81 -1.21 -4.30 118.95 120.52 1are s ARG 111 Ca 0.00 2.15 -0.13 0.00 -1.72 0.00 0.00 55.73 56.02 1are s ARG 111 Cb 0.00 -4.01 -0.06 0.00 -0.45 0.00 0.00 34.95 30.43 1are s ARG 111 CO 0.00 -0.94 0.47 0.00 -0.68 0.00 0.00 175.30 174.15 1are s ALA 112 N 4.31 3.66 0.11 2.13 0.00 -1.26 -0.29 121.76 130.42 1are s ALA 112 Ca 0.75 -0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.51 1are s ALA 112 Cb -0.33 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 1are s ALA 112 CO 0.30 0.50 -0.09 -0.06 0.00 0.00 0.00 175.76 176.41 1are s PHE 113 N -1.34 1.07 -0.07 0.00 0.08 0.80 -4.99 117.98 113.53 1are s PHE 113 Ca 0.33 -0.75 -0.11 0.00 0.12 0.00 0.00 56.93 56.51 1are s PHE 113 Cb -0.15 -0.58 -0.29 0.00 -0.57 0.00 0.00 43.02 41.43 1are s PHE 113 CO 0.18 -0.01 0.59 0.00 -0.10 0.00 0.00 175.22 175.87 1are h ALA 114 N 3.18 0.21 -3.06 5.36 0.00 -1.99 -3.38 119.26 119.57 1are h ALA 114 Ca -0.36 -1.18 -0.63 0.00 0.00 0.00 0.00 54.91 52.73 1are h ALA 114 Cb 1.18 0.51 -0.18 0.00 0.00 0.00 0.00 17.79 19.30 1are h ALA 114 CO 0.59 1.04 -0.57 1.03 0.00 0.00 0.00 179.25 181.34 1are s ARG 115 N -2.56 3.87 0.18 0.00 1.81 -1.26 -4.98 118.95 116.02 1are s ARG 115 Ca -0.18 -0.38 -0.24 0.00 -1.72 0.00 0.00 55.73 53.21 1are s ARG 115 Cb 0.05 -3.38 0.08 0.00 -0.45 0.00 0.00 34.95 31.25 1are s ARG 115 CO 0.82 -0.01 1.56 1.96 -0.68 0.00 0.00 175.30 178.95 1are h GLN 116 N 7.68 -0.13 -0.95 3.54 7.50 -1.97 0.60 115.11 131.38 1are h GLN 116 Ca -0.37 0.01 0.29 0.00 0.50 0.00 0.00 58.65 59.08 1are h GLN 116 Cb 1.18 0.03 -0.16 0.00 0.05 0.00 0.00 27.48 28.57 1are h GLN 116 CO 0.62 -0.08 0.28 1.49 -1.50 0.00 0.00 178.83 179.64 1are h GLU 117 N -0.13 0.13 -0.83 1.46 4.81 -1.98 2.17 114.58 120.20 1are h GLU 117 Ca 0.22 -0.01 0.13 0.00 -0.13 0.00 0.00 59.36 59.58 1are h GLU 117 Cb 0.55 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.84 1are h GLU 117 CO -0.80 0.08 0.54 0.00 -0.73 0.00 0.00 179.01 178.10 1are h ALA 118 N 1.89 1.89 0.21 2.92 0.00 -0.21 0.44 119.26 126.39 1are h ALA 118 Ca 0.64 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.55 1are h ALA 118 Cb 1.43 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1are h ALA 118 CO -0.74 -0.10 -0.10 1.25 0.00 0.00 0.00 179.25 179.56 1are h LEU 119 N 0.63 -0.24 -0.75 0.00 5.85 0.38 -1.79 115.31 119.39 1are h LEU 119 Ca 0.40 0.01 0.12 0.00 0.84 0.00 0.00 57.88 59.25 1are h LEU 119 Cb 0.68 0.06 -0.13 0.00 0.37 0.00 0.00 40.66 41.64 1are h LEU 119 CO -0.16 -0.01 -0.39 0.50 -0.34 0.00 0.00 178.44 178.03 1are h LYS 120 N -0.59 -0.11 -0.70 1.25 3.64 -0.89 1.60 116.57 120.77 1are h LYS 120 Ca -0.03 0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.49 1are h LYS 120 Cb 0.21 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 1are h LYS 120 CO 0.05 -0.07 0.47 0.00 -2.27 0.00 0.00 179.45 177.63 1are h ARG 121 N -0.11 0.39 0.18 1.90 3.08 -0.23 -1.57 114.38 118.03 1are h ARG 121 Ca 0.26 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 1are h ARG 121 Cb 0.56 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1are h ARG 121 CO -0.81 0.26 -0.09 1.25 -1.07 0.00 0.00 179.97 179.51 1are h HIS 122 N 0.40 -0.23 -1.23 3.04 2.76 0.30 -3.00 115.15 117.19 1are h HIS 122 Ca 0.34 -0.01 0.36 0.00 -2.20 0.00 0.00 60.37 58.86 1are h HIS 122 Cb 0.77 0.08 -0.05 0.00 1.55 0.00 0.00 27.41 29.75 1are h HIS 122 CO -0.00 0.17 0.88 -0.92 -1.30 0.00 0.00 177.93 176.76 1are h TYR 123 N -0.73 0.00 0.00 5.26 5.03 0.91 1.56 116.97 129.00 1are h TYR 123 Ca -0.03 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.28 1are h TYR 123 Cb 0.50 -0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.78 1are h TYR 123 CO 0.06 0.00 -0.04 -0.09 -1.32 0.00 0.00 178.16 176.77 1are h ARG 124 N 0.00 0.00 0.00 1.82 1.12 -1.23 -0.15 114.38 115.94 1are h ARG 124 Ca 0.58 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 59.31 1are h ARG 124 Cb 2.34 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 32.28 1are h ARG 124 CO -0.01 0.04 -0.70 0.66 -3.11 0.00 0.00 179.97 176.85 1are h SER 125 N 0.00 0.00 0.04 -3.80 4.64 0.22 -3.22 113.55 111.43 1are h SER 125 Ca -0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1are h SER 125 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1are h SER 125 CO 0.01 0.70 -0.66 0.45 -0.87 0.00 0.00 176.83 176.46 1are h HIS 126 N 0.00 0.59 -0.98 4.77 3.86 -1.08 -2.99 115.15 119.32 1are h HIS 126 Ca -0.01 -0.35 0.34 0.00 -1.16 0.00 0.00 60.37 59.20 1are h HIS 126 Cb 1.26 -0.06 -0.10 0.00 1.06 0.00 0.00 27.41 29.58 1are h HIS 126 CO 0.00 1.19 0.63 2.41 0.86 0.00 0.00 177.93 183.02 1are n THR 127 N -4.20 -0.18 -3.15 2.45 -1.04 -0.75 -3.91 114.28 103.50 1are n THR 127 Ca -0.11 1.28 0.06 0.00 -2.04 0.00 0.00 64.05 63.24 1are n THR 127 Cb 0.71 -2.10 -0.01 0.00 -1.82 0.00 0.00 70.33 67.11 1are n THR 127 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1are s ASN 128 N -4.36 -0.19 -1.09 8.00 3.84 -1.23 -5.07 114.94 114.84 1are s ASN 128 Ca -0.05 0.05 -0.26 0.00 0.21 0.00 0.00 52.86 52.81 1are s ASN 128 Cb 0.22 1.13 -0.19 0.00 -0.55 0.00 0.00 41.25 41.86 1are s ASN 128 CO 0.58 -0.04 2.09 -1.61 -2.79 0.00 0.00 177.10 175.33 1are s GLU 129 N 2.98 1.47 0.00 0.43 8.01 -1.13 -4.86 118.70 125.60 1are s GLU 129 Ca 0.18 -0.55 0.00 0.00 0.01 0.00 0.00 54.97 54.60 1are s GLU 129 Cb -0.03 -5.03 0.00 0.00 -4.31 0.00 0.00 34.13 24.76 1are s GLU 129 CO -0.18 -5.14 0.00 0.36 0.01 0.00 0.00 175.26 170.31