#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 -0.18 -0.61 0.55 0.01 -1.26 -5.11 113.70 107.10 1are s SER 103 Ca 0.00 -0.58 -0.25 0.00 1.31 0.00 0.00 55.95 56.43 1are s SER 103 Cb 0.00 0.54 0.04 0.00 0.21 0.00 0.00 66.02 66.81 1are s SER 103 CO 0.00 -1.01 1.06 -0.36 0.41 0.00 0.00 173.24 173.34 1are s PHE 104 N -3.90 2.64 0.07 2.43 0.08 -1.26 -5.00 117.98 113.05 1are s PHE 104 Ca 0.11 -0.04 0.06 0.00 0.12 0.00 0.00 56.93 57.18 1are s PHE 104 Cb 0.00 -4.31 -0.03 0.00 -0.57 0.00 0.00 43.02 38.12 1are s PHE 104 CO -0.02 -1.59 -0.16 0.08 -0.10 0.00 0.00 175.22 173.43 1are s VAL 105 N 4.49 1.25 -0.90 -0.44 1.01 -1.26 -1.59 120.40 122.97 1are s VAL 105 Ca 0.32 -1.31 -0.14 0.00 0.00 0.00 0.00 61.98 60.85 1are s VAL 105 Cb -0.12 -1.18 0.21 0.00 0.00 0.00 0.00 36.38 35.30 1are s VAL 105 CO 0.18 -0.15 0.91 0.00 0.00 0.00 0.00 175.10 176.04 1are h GLU 107 N 7.77 0.00 0.00 0.00 4.39 -1.90 11.43 114.58 136.27 1are h GLU 107 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1are h GLU 107 Cb 1.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.66 1are h GLU 107 CO 0.87 0.00 0.00 0.28 -1.16 0.00 0.00 179.01 179.00 1are n VAL 108 N -3.66 0.00 0.84 3.13 0.31 -1.26 -3.82 118.33 113.87 1are n VAL 108 Ca 0.32 1.35 0.10 0.00 -0.01 0.00 0.00 64.34 66.10 1are n VAL 108 Cb 1.68 -2.26 0.05 0.00 -0.91 0.00 0.00 33.84 32.40 1are n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1are n THR 110 N 0.62 -0.08 -2.24 0.00 -2.24 3.58 -4.96 114.28 108.95 1are n THR 110 Ca 0.10 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 1are n THR 110 Cb 0.46 -1.06 -0.03 0.00 -2.10 0.00 0.00 70.33 67.60 1are n THR 110 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1are s ARG 111 N -3.01 4.30 -0.11 -0.78 1.81 -1.06 -4.36 118.95 115.74 1are s ARG 111 Ca 0.00 1.94 -0.08 0.00 -1.72 0.00 0.00 55.73 55.88 1are s ARG 111 Cb 0.00 -3.54 -0.04 0.00 -0.45 0.00 0.00 34.95 30.92 1are s ARG 111 CO 0.00 -0.54 0.17 0.00 -0.68 0.00 0.00 175.30 174.25 1are s ALA 112 N 2.23 3.86 0.12 2.13 0.00 -1.26 0.16 121.76 128.99 1are s ALA 112 Ca 0.63 -0.60 0.05 0.00 0.00 0.00 0.00 51.96 52.04 1are s ALA 112 Cb -0.31 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.75 1are s ALA 112 CO 0.27 0.60 -0.12 -0.06 0.00 0.00 0.00 175.76 176.44 1are s PHE 113 N -1.01 1.26 -0.00 0.00 0.08 -0.62 -5.00 117.98 112.69 1are s PHE 113 Ca 0.16 -0.62 -0.10 0.00 0.12 0.00 0.00 56.93 56.49 1are s PHE 113 Cb -0.12 -0.66 -0.31 0.00 -0.57 0.00 0.00 43.02 41.35 1are s PHE 113 CO 0.05 0.09 0.85 0.00 -0.10 0.00 0.00 175.22 176.11 1are h ALA 114 N 3.42 0.09 -3.03 5.36 0.00 -1.99 -3.40 119.26 119.71 1are h ALA 114 Ca -0.38 -1.03 -0.64 0.00 0.00 0.00 0.00 54.91 52.85 1are h ALA 114 Cb 1.19 0.29 -0.20 0.00 0.00 0.00 0.00 17.79 19.08 1are h ALA 114 CO 0.53 0.96 -0.59 1.03 0.00 0.00 0.00 179.25 181.18 1are s ARG 115 N -2.60 3.80 0.21 0.00 1.81 -1.26 -4.99 118.95 115.92 1are s ARG 115 Ca -0.11 -0.41 -0.14 0.00 -1.72 0.00 0.00 55.73 53.35 1are s ARG 115 Cb 0.06 -3.35 0.24 0.00 -0.45 0.00 0.00 34.95 31.44 1are s ARG 115 CO 0.88 -0.06 1.61 1.96 -0.68 0.00 0.00 175.30 179.02 1are h GLN 116 N 7.83 -0.03 -1.05 3.54 1.08 -1.98 0.67 115.11 125.17 1are h GLN 116 Ca -0.37 0.00 0.27 0.00 -1.45 0.00 0.00 58.65 57.10 1are h GLN 116 Cb 1.18 0.01 -0.10 0.00 -0.05 0.00 0.00 27.48 28.51 1are h GLN 116 CO 0.61 -0.02 0.67 1.49 -0.95 0.00 0.00 178.83 180.62 1are h GLU 117 N -0.03 0.39 -0.01 1.46 4.81 -1.99 1.64 114.58 120.85 1are h GLU 117 Ca 0.31 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.49 1are h GLU 117 Cb 0.50 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 1are h GLU 117 CO -0.69 0.26 -0.14 0.00 -0.73 0.00 0.00 179.01 177.70 1are h ALA 118 N 1.64 1.74 0.07 2.92 0.00 -0.06 -1.07 119.26 124.51 1are h ALA 118 Ca 0.62 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 1are h ALA 118 Cb 1.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1are h ALA 118 CO -0.33 0.19 -0.04 1.25 0.00 0.00 0.00 179.25 180.33 1are h LEU 119 N 0.02 -0.08 -0.98 0.00 5.85 0.26 -2.19 115.31 118.19 1are h LEU 119 Ca 0.00 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1are h LEU 119 Cb 0.26 0.02 -0.12 0.00 0.37 0.00 0.00 40.66 41.20 1are h LEU 119 CO 0.02 0.12 -0.57 1.17 -0.34 0.00 0.00 178.44 178.83 1are n LYS 120 N -3.25 -0.43 -0.27 1.25 4.81 -0.37 0.13 118.16 120.03 1are n LYS 120 Ca -0.01 1.48 0.05 0.00 -0.87 0.00 0.00 58.31 58.95 1are n LYS 120 Cb 0.04 -2.17 0.19 0.00 0.02 0.00 0.00 35.03 33.11 1are n LYS 120 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1are h ARG 121 N 0.00 0.55 0.21 1.64 3.08 -1.34 -1.24 114.38 117.28 1are h ARG 121 Ca 0.16 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1are h ARG 121 Cb 0.40 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1are h ARG 121 CO -0.92 0.37 -0.20 1.25 -1.07 0.00 0.00 179.97 179.40 1are h HIS 122 N 0.57 -0.52 -0.97 3.04 2.76 0.17 -1.23 115.15 118.97 1are h HIS 122 Ca 0.42 0.00 0.27 0.00 -2.20 0.00 0.00 60.37 58.86 1are h HIS 122 Cb 0.56 0.20 -0.05 0.00 1.55 0.00 0.00 27.41 29.67 1are h HIS 122 CO -0.12 -0.30 0.68 -0.92 -1.30 0.00 0.00 177.93 175.97 1are h TYR 123 N -0.44 0.18 0.00 5.26 5.03 0.12 1.28 116.97 128.40 1are h TYR 123 Ca -0.00 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 1are h TYR 123 Cb 0.41 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.63 1are h TYR 123 CO -0.15 0.03 -0.12 0.00 -1.32 0.00 0.00 178.16 176.61 1are h ARG 124 N 0.12 0.00 0.00 1.82 2.47 -0.37 -1.74 114.38 116.68 1are h ARG 124 Ca 0.48 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 59.14 1are h ARG 124 Cb 1.69 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.00 1are h ARG 124 CO -0.07 0.12 -0.29 0.66 0.56 0.00 0.00 179.97 180.95 1are h SER 125 N 0.00 0.00 0.00 7.04 4.64 0.19 -2.37 113.55 123.05 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 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1are h SER 125 CO 0.02 0.29 0.00 1.41 -0.87 0.00 0.00 176.83 177.67 1are n HIS 126 N -3.26 0.00 0.00 4.77 8.25 -0.65 -4.29 115.22 120.03 1are n HIS 126 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1are n HIS 126 Cb 0.57 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.68 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 -0.92 0.00 -3.64 1.59 -2.24 -1.02 -5.13 114.28 102.92 1are n THR 127 Ca 0.17 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.87 1are n THR 127 Cb 0.08 -0.44 -0.07 0.00 -2.10 0.00 0.00 70.33 67.79 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 0.98 -0.39 -0.99 3.42 3.04 -0.92 -5.09 114.94 114.98 1are s ASN 128 Ca 0.00 0.75 -0.17 0.00 0.04 0.00 0.00 52.86 53.48 1are s ASN 128 Cb 0.00 0.78 0.15 0.00 -1.54 0.00 0.00 41.25 40.64 1are s ASN 128 CO 0.00 -0.13 1.16 -1.61 -3.04 0.00 0.00 177.10 173.48 1are s GLU 129 N 0.25 3.73 0.00 0.43 8.01 -1.26 -4.79 118.70 125.07 1are s GLU 129 Ca 0.03 -2.05 0.00 0.00 0.01 0.00 0.00 54.97 52.96 1are s GLU 129 Cb -0.05 -4.90 0.00 0.00 -4.31 0.00 0.00 34.13 24.87 1are s GLU 129 CO -0.08 -1.71 0.12 1.63 0.01 0.00 0.00 175.26 175.23