#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 -0.02 -1.07 0.55 0.01 -1.26 -5.08 113.70 106.83 1are s SER 103 Ca 0.00 -0.01 -0.13 0.00 1.31 0.00 0.00 55.95 57.11 1are s SER 103 Cb 0.00 0.03 0.20 0.00 0.21 0.00 0.00 66.02 66.46 1are s SER 103 CO 0.00 -0.05 1.19 -0.36 0.41 0.00 0.00 173.24 174.43 1are s PHE 104 N -2.08 3.69 0.07 2.43 0.08 -1.26 -5.00 117.98 115.90 1are s PHE 104 Ca 0.13 -2.13 0.05 0.00 0.12 0.00 0.00 56.93 55.10 1are s PHE 104 Cb 0.02 -4.10 -0.04 0.00 -0.57 0.00 0.00 43.02 38.33 1are s PHE 104 CO -0.04 -1.23 -0.07 0.08 -0.10 0.00 0.00 175.22 173.86 1are s VAL 105 N 0.78 3.59 -0.42 -0.44 1.01 -1.26 -0.63 120.40 123.03 1are s VAL 105 Ca 0.34 -1.05 -0.24 0.00 0.00 0.00 0.00 61.98 61.02 1are s VAL 105 Cb -0.06 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.69 1are s VAL 105 CO -0.05 0.20 0.85 0.00 0.00 0.00 0.00 175.10 176.10 1are h GLU 107 N 8.82 0.00 0.49 0.00 4.39 -1.90 2.33 114.58 128.71 1are h GLU 107 Ca -0.24 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 1are h GLU 107 Cb 1.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1are h GLU 107 CO 0.97 0.12 -0.23 0.28 -1.16 0.00 0.00 179.01 178.99 1are h VAL 108 N 0.00 0.00 0.00 3.13 2.07 -1.98 -3.41 116.25 116.06 1are h VAL 108 Ca -0.00 -0.11 -0.24 0.00 0.82 0.00 0.00 66.70 67.17 1are h VAL 108 Cb 0.32 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.05 1are h VAL 108 CO 0.02 0.00 -1.72 0.00 0.02 0.00 0.00 177.57 175.89 1are n THR 110 N -4.12 0.00 -1.71 0.00 5.66 0.79 -4.97 114.28 109.93 1are n THR 110 Ca -0.32 0.00 -0.60 0.00 -3.05 0.00 0.00 64.05 60.08 1are n THR 110 Cb 0.67 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.37 1are n THR 110 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1are n ARG 111 N 0.00 0.85 -3.60 1.09 1.74 -1.25 -3.51 116.66 111.99 1are n ARG 111 Ca 0.00 0.31 -0.33 0.00 -0.77 0.00 0.00 57.85 57.06 1are n ARG 111 Cb 0.00 -1.96 -0.05 0.00 -1.02 0.00 0.00 32.46 29.43 1are n ARG 111 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1are s ALA 112 N 3.59 3.73 -0.00 7.54 0.00 -1.26 -0.64 121.76 134.72 1are s ALA 112 Ca 1.01 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.53 1are s ALA 112 Cb -1.18 -2.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.71 1are s ALA 112 CO 0.69 0.61 -0.03 -0.06 0.00 0.00 0.00 175.76 176.97 1are s PHE 113 N -1.60 0.29 0.19 0.00 0.08 0.20 -4.99 117.98 112.15 1are s PHE 113 Ca 0.39 -0.08 -0.01 0.00 0.12 0.00 0.00 56.93 57.36 1are s PHE 113 Cb -0.13 -0.19 0.12 0.00 -0.57 0.00 0.00 43.02 42.25 1are s PHE 113 CO 0.22 -0.01 1.49 0.00 -0.10 0.00 0.00 175.22 176.81 1are h ALA 114 N 5.99 0.69 -2.96 5.36 0.00 -1.98 -3.39 119.26 122.96 1are h ALA 114 Ca -0.27 -0.56 -0.65 0.00 0.00 0.00 0.00 54.91 53.44 1are h ALA 114 Cb 1.20 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 1are h ALA 114 CO 0.50 0.72 -0.62 1.03 0.00 0.00 0.00 179.25 180.89 1are s ARG 115 N -3.79 3.68 0.21 0.00 1.81 -1.26 -4.99 118.95 114.61 1are s ARG 115 Ca -0.06 -0.46 -0.15 0.00 -1.72 0.00 0.00 55.73 53.34 1are s ARG 115 Cb 0.11 -3.33 0.23 0.00 -0.45 0.00 0.00 34.95 31.51 1are s ARG 115 CO 0.83 -0.17 1.61 1.96 -0.68 0.00 0.00 175.30 178.85 1are h GLN 116 N 8.17 -0.05 -1.00 3.54 4.20 -1.96 0.83 115.11 128.83 1are h GLN 116 Ca -0.38 0.00 0.25 0.00 0.06 0.00 0.00 58.65 58.58 1are h GLN 116 Cb 1.18 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.89 1are h GLN 116 CO 0.58 -0.03 0.66 1.49 -0.67 0.00 0.00 178.83 180.86 1are h GLU 117 N -0.05 0.34 0.00 1.46 4.81 -1.97 1.54 114.58 120.71 1are h GLU 117 Ca 0.30 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1are h GLU 117 Cb 0.52 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1are h GLU 117 CO -0.71 0.23 -0.18 0.00 -0.73 0.00 0.00 179.01 177.62 1are h ALA 118 N 1.60 1.40 0.03 2.92 0.00 0.27 -1.21 119.26 124.27 1are h ALA 118 Ca 0.55 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1are h ALA 118 Cb 1.47 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1are h ALA 118 CO -0.22 0.23 -0.01 1.25 0.00 0.00 0.00 179.25 180.49 1are h LEU 119 N 0.00 -0.03 -0.94 0.00 5.85 0.25 -2.74 115.31 117.70 1are h LEU 119 Ca -0.00 0.00 0.21 0.00 0.84 0.00 0.00 57.88 58.92 1are h LEU 119 Cb 0.40 0.01 -0.18 0.00 0.37 0.00 0.00 40.66 41.27 1are h LEU 119 CO 0.02 0.22 -0.16 0.11 -0.34 0.00 0.00 178.44 178.30 1are h LYS 120 N -0.54 0.01 -0.26 1.25 1.57 -1.18 2.82 116.57 120.24 1are h LYS 120 Ca -0.00 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1are h LYS 120 Cb 0.03 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1are h LYS 120 CO 0.01 0.01 0.16 -0.09 -0.57 0.00 0.00 179.45 178.96 1are h ARG 121 N 0.01 0.35 0.17 3.15 2.43 -1.35 -2.48 114.38 116.66 1are h ARG 121 Ca 0.48 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.62 1are h ARG 121 Cb 0.81 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1are h ARG 121 CO -0.94 0.24 -0.08 1.25 -1.51 0.00 0.00 179.97 178.93 1are h HIS 122 N 0.36 -0.21 -0.62 2.20 2.76 0.52 -2.89 115.15 117.26 1are h HIS 122 Ca 0.10 -0.00 0.18 0.00 -2.20 0.00 0.00 60.37 58.44 1are h HIS 122 Cb -0.02 0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.98 1are h HIS 122 CO 0.00 0.19 0.74 1.88 -1.30 0.00 0.00 177.93 179.44 1are h TYR 123 N -0.68 0.00 0.00 5.26 0.05 -0.16 1.35 116.97 122.79 1are h TYR 123 Ca -0.02 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.72 1are h TYR 123 Cb 0.49 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.23 1are h TYR 123 CO 0.06 0.00 -0.18 0.00 -1.05 0.00 0.00 178.16 176.99 1are h ARG 124 N 0.00 0.00 0.00 4.88 2.47 -1.26 -0.79 114.38 119.68 1are h ARG 124 Ca 0.30 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.98 1are h ARG 124 Cb 1.77 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 30.09 1are h ARG 124 CO -0.00 0.18 -0.15 0.66 0.56 0.00 0.00 179.97 181.22 1are h SER 125 N 0.00 0.00 -0.05 7.04 4.64 0.17 0.11 113.55 125.46 1are h SER 125 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1are h SER 125 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1are h SER 125 CO 0.02 0.15 0.00 1.41 -0.87 0.00 0.00 176.83 177.55 1are n HIS 126 N -3.25 0.06 0.00 4.77 8.25 -0.30 -4.51 115.22 120.24 1are n HIS 126 Ca 0.01 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1are n HIS 126 Cb 0.43 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.54 1are n HIS 126 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1are n THR 127 N -0.46 0.00 -3.29 1.59 -2.24 -0.80 -5.09 114.28 103.99 1are n THR 127 Ca 0.15 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.85 1are n THR 127 Cb 0.15 -0.20 -0.05 0.00 -2.10 0.00 0.00 70.33 68.12 1are n THR 127 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1are s ASN 128 N 1.00 0.17 -0.36 3.42 3.84 0.32 -5.06 114.94 118.27 1are s ASN 128 Ca 0.00 -0.57 -0.05 0.00 0.21 0.00 0.00 52.86 52.45 1are s ASN 128 Cb 0.00 1.17 0.20 0.00 -0.55 0.00 0.00 41.25 42.07 1are s ASN 128 CO 0.00 -0.32 1.01 -1.61 -2.79 0.00 0.00 177.10 173.40 1are s GLU 129 N 2.33 0.35 0.00 0.43 0.41 -1.10 -4.79 118.70 116.32 1are s GLU 129 Ca 0.11 -0.29 0.00 0.00 -0.41 0.00 0.00 54.97 54.39 1are s GLU 129 Cb -0.12 -0.00 0.00 0.00 -1.78 0.00 0.00 34.13 32.23 1are s GLU 129 CO -0.24 -0.45 0.05 0.36 -0.49 0.00 0.00 175.26 174.49