#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 -0.13 -0.80 6.15 0.01 -1.26 -5.10 113.70 112.58 1are s SER 103 Ca 0.00 -0.16 -0.25 0.00 1.31 0.00 0.00 55.95 56.85 1are s SER 103 Cb 0.00 0.26 0.04 0.00 0.21 0.00 0.00 66.02 66.53 1are s SER 103 CO 0.00 -0.46 1.26 -0.36 0.41 0.00 0.00 173.24 174.09 1are s PHE 104 N -2.70 2.43 0.09 2.43 0.08 -1.26 -4.98 117.98 114.07 1are s PHE 104 Ca 0.12 -0.36 0.09 0.00 0.12 0.00 0.00 56.93 56.91 1are s PHE 104 Cb 0.02 -4.58 -0.03 0.00 -0.57 0.00 0.00 43.02 37.85 1are s PHE 104 CO -0.03 -1.96 -0.24 0.08 -0.10 0.00 0.00 175.22 172.97 1are s VAL 105 N 5.19 2.00 -0.65 -0.44 1.01 -1.26 -0.88 120.40 125.37 1are s VAL 105 Ca 0.35 -1.53 -0.23 0.00 0.00 0.00 0.00 61.98 60.57 1are s VAL 105 Cb -0.07 -1.76 0.06 0.00 0.00 0.00 0.00 36.38 34.60 1are s VAL 105 CO 0.08 0.13 1.00 0.00 0.00 0.00 0.00 175.10 176.31 1are h GLU 107 N 9.58 0.00 0.32 0.00 4.39 -1.90 3.98 114.58 130.96 1are h GLU 107 Ca -0.28 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.40 1are h GLU 107 Cb 1.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1are h GLU 107 CO 1.18 0.00 -0.15 0.28 -1.16 0.00 0.00 179.01 179.15 1are h VAL 108 N 0.00 0.00 0.00 3.13 2.07 -1.97 -3.41 116.25 116.07 1are h VAL 108 Ca 0.09 -0.09 -0.39 0.00 0.82 0.00 0.00 66.70 67.12 1are h VAL 108 Cb 0.53 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.24 1are h VAL 108 CO -0.00 0.00 -2.30 0.00 0.02 0.00 0.00 177.57 175.29 1are n THR 110 N -4.22 0.00 -1.69 0.00 5.66 1.31 -4.97 114.28 110.37 1are n THR 110 Ca -0.48 0.00 -0.55 0.00 -3.05 0.00 0.00 64.05 59.97 1are n THR 110 Cb 0.83 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.54 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 1.26 -3.74 1.09 5.12 -1.25 -3.68 116.66 115.47 1are n ARG 111 Ca 0.00 0.46 -0.34 0.00 -1.93 0.00 0.00 57.85 56.05 1are n ARG 111 Cb 0.00 -2.15 -0.05 0.00 -1.16 0.00 0.00 32.46 29.10 1are n ARG 111 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1are s ALA 112 N 2.98 3.84 0.05 7.54 0.00 -1.26 0.03 121.76 134.93 1are s ALA 112 Ca 0.95 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.35 1are s ALA 112 Cb -1.01 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 1are s ALA 112 CO 0.60 0.66 -0.08 -0.06 0.00 0.00 0.00 175.76 176.88 1are s PHE 113 N -1.40 0.76 0.04 0.00 0.08 -0.06 -4.99 117.98 112.41 1are s PHE 113 Ca 0.31 -0.53 -0.09 0.00 0.12 0.00 0.00 56.93 56.74 1are s PHE 113 Cb -0.13 -0.45 -0.31 0.00 -0.57 0.00 0.00 43.02 41.56 1are s PHE 113 CO 0.19 -0.07 1.03 0.00 -0.10 0.00 0.00 175.22 176.27 1are h ALA 114 N 4.33 0.02 -3.05 5.36 0.00 -1.98 -3.38 119.26 120.55 1are h ALA 114 Ca -0.36 -0.91 -0.64 0.00 0.00 0.00 0.00 54.91 53.00 1are h ALA 114 Cb 1.20 0.12 -0.20 0.00 0.00 0.00 0.00 17.79 18.92 1are h ALA 114 CO 0.43 0.89 -0.59 1.03 0.00 0.00 0.00 179.25 181.01 1are s ARG 115 N -2.63 3.80 0.21 0.00 1.81 -1.26 -4.99 118.95 115.89 1are s ARG 115 Ca -0.07 -0.41 -0.15 0.00 -1.72 0.00 0.00 55.73 53.38 1are s ARG 115 Cb 0.06 -3.34 0.22 0.00 -0.45 0.00 0.00 34.95 31.44 1are s ARG 115 CO 0.90 -0.04 1.61 1.96 -0.68 0.00 0.00 175.30 179.06 1are h GLN 116 N 7.76 -0.05 -1.01 3.54 4.20 -1.98 0.55 115.11 128.12 1are h GLN 116 Ca -0.37 0.00 0.24 0.00 0.06 0.00 0.00 58.65 58.59 1are h GLN 116 Cb 1.18 0.01 -0.11 0.00 0.30 0.00 0.00 27.48 28.85 1are h GLN 116 CO 0.61 -0.03 0.62 1.49 -0.67 0.00 0.00 178.83 180.85 1are h GLU 117 N -0.05 0.54 -0.03 1.46 4.81 -1.99 1.38 114.58 120.70 1are h GLU 117 Ca 0.29 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.47 1are h GLU 117 Cb 0.50 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1are h GLU 117 CO -0.68 0.36 -0.10 0.00 -0.73 0.00 0.00 179.01 177.86 1are h ALA 118 N 1.68 1.78 0.12 2.92 0.00 -0.31 -0.49 119.26 124.96 1are h ALA 118 Ca 0.62 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 1are h ALA 118 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1are h ALA 118 CO -0.40 0.17 -0.06 1.25 0.00 0.00 0.00 179.25 180.21 1are h LEU 119 N 0.05 -0.13 -0.81 0.00 5.85 0.22 -2.58 115.31 117.90 1are h LEU 119 Ca 0.01 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.83 1are h LEU 119 Cb 0.20 0.03 -0.12 0.00 0.37 0.00 0.00 40.66 41.15 1are h LEU 119 CO 0.01 0.17 -0.52 0.50 -0.34 0.00 0.00 178.44 178.27 1are h LYS 120 N -0.70 -0.11 -0.98 1.25 1.63 -0.91 1.15 116.57 117.89 1are h LYS 120 Ca -0.02 0.01 0.19 0.00 -0.85 0.00 0.00 60.65 59.98 1are h LYS 120 Cb 0.12 0.03 -0.11 0.00 -0.60 0.00 0.00 32.23 31.67 1are h LYS 120 CO 0.03 -0.07 0.58 -0.09 -3.45 0.00 0.00 179.45 176.44 1are h ARG 121 N -0.12 0.71 0.26 1.90 2.43 -1.23 -0.56 114.38 117.79 1are h ARG 121 Ca 0.18 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1are h ARG 121 Cb 0.50 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1are h ARG 121 CO -0.84 0.47 -0.13 1.25 -1.51 0.00 0.00 179.97 179.22 1are h HIS 122 N 0.73 -0.33 -0.87 2.20 2.76 0.15 -2.88 115.15 116.91 1are h HIS 122 Ca 0.57 -0.01 0.22 0.00 -2.20 0.00 0.00 60.37 58.95 1are h HIS 122 Cb 0.88 0.11 -0.13 0.00 1.55 0.00 0.00 27.41 29.82 1are h HIS 122 CO -0.02 -0.09 0.31 -0.92 -1.30 0.00 0.00 177.93 175.91 1are h TYR 123 N -0.53 0.50 -0.80 5.26 5.03 0.15 0.18 116.97 126.77 1are h TYR 123 Ca -0.04 0.04 0.19 0.00 2.58 0.00 0.00 58.73 61.51 1are h TYR 123 Cb 0.39 -0.08 -0.14 0.00 1.55 0.00 0.00 36.73 38.45 1are h TYR 123 CO -0.01 -0.11 0.04 -0.09 -1.32 0.00 0.00 178.16 176.67 1are h ARG 124 N 0.31 0.11 -0.83 1.82 2.43 -1.04 0.60 114.38 117.79 1are h ARG 124 Ca 0.54 -0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.88 1are h ARG 124 Cb 1.04 -0.03 -0.11 0.00 -0.42 0.00 0.00 29.97 30.46 1are h ARG 124 CO -0.57 0.07 0.33 0.66 -1.51 0.00 0.00 179.97 178.96 1are h SER 125 N 0.11 0.28 -0.57 -3.80 4.64 -0.67 0.25 113.55 113.80 1are h SER 125 Ca 0.45 0.13 -0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1are h SER 125 Cb 0.83 0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 63.01 1are h SER 125 CO -0.69 0.04 0.34 0.45 -0.87 0.00 0.00 176.83 176.11 1are h HIS 126 N 0.41 0.75 -0.55 4.77 3.86 0.16 -2.73 115.15 121.82 1are h HIS 126 Ca 0.48 -0.00 0.16 0.00 -1.16 0.00 0.00 60.37 59.85 1are h HIS 126 Cb 0.84 -0.25 -0.10 0.00 1.06 0.00 0.00 27.41 28.96 1are h HIS 126 CO -0.17 0.52 0.04 2.41 0.86 0.00 0.00 177.93 181.59 1are n THR 127 N -4.64 -0.23 -0.24 2.45 -1.04 0.89 0.18 114.28 111.64 1are n THR 127 Ca 0.03 1.19 -0.13 0.00 -2.04 0.00 0.00 64.05 63.11 1are n THR 127 Cb 0.06 -1.76 -0.10 0.00 -1.82 0.00 0.00 70.33 66.71 1are n THR 127 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1are h ASN 128 N 0.00 -1.96 0.00 8.00 2.35 -1.53 -3.44 115.58 119.00 1are h ASN 128 Ca 0.34 0.28 0.00 0.00 -0.55 0.00 0.00 56.30 56.37 1are h ASN 128 Cb 0.74 0.83 0.00 0.00 0.05 0.00 0.00 38.32 39.94 1are h ASN 128 CO -0.51 -0.34 0.00 -0.62 -1.65 0.00 0.00 177.43 174.31 1are n GLU 129 N -5.33 2.49 0.00 0.81 4.71 0.47 -5.19 120.64 118.59 1are n GLU 129 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 1are n GLU 129 Cb 0.31 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.74 1are n GLU 129 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39