#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 -0.08 -0.61 0.55 0.01 -1.26 -5.11 113.70 107.20 1are s SER 103 Ca 0.00 -0.06 -0.04 0.00 1.31 0.00 0.00 55.95 57.16 1are s SER 103 Cb 0.00 0.13 0.16 0.00 0.21 0.00 0.00 66.02 66.52 1are s SER 103 CO 0.00 -0.23 0.43 -0.36 0.41 0.00 0.00 173.24 173.49 1are s PHE 104 N -2.36 3.46 0.09 2.43 0.08 -1.22 -5.02 117.98 115.44 1are s PHE 104 Ca 0.12 -2.59 0.03 0.00 0.12 0.00 0.00 56.93 54.61 1are s PHE 104 Cb 0.02 -3.26 -0.04 0.00 -0.57 0.00 0.00 43.02 39.18 1are s PHE 104 CO -0.04 -0.87 0.09 0.08 -0.10 0.00 0.00 175.22 174.37 1are s VAL 105 N 0.16 4.54 -0.06 -0.44 1.01 -1.26 0.50 120.40 124.85 1are s VAL 105 Ca 0.15 -0.80 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 1are s VAL 105 Cb -0.20 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 1are s VAL 105 CO -0.04 0.09 0.55 0.00 0.00 0.00 0.00 175.10 175.71 1are n GLU 107 N 3.22 0.53 -0.03 0.00 -0.58 -1.26 -1.74 120.64 120.78 1are n GLU 107 Ca -0.07 -0.12 -0.01 0.00 -0.42 0.00 0.00 57.16 56.54 1are n GLU 107 Cb 0.51 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.88 1are n GLU 107 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1are h VAL 108 N 0.30 0.00 0.00 2.62 2.07 -1.98 -3.45 116.25 115.81 1are h VAL 108 Ca 0.00 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 1are h VAL 108 Cb 0.34 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1are h VAL 108 CO 0.00 0.00 -0.91 0.00 0.02 0.00 0.00 177.57 176.68 1are n THR 110 N -4.51 0.00 -2.27 0.00 5.66 -0.71 -4.98 114.28 107.47 1are n THR 110 Ca -0.15 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.43 1are n THR 110 Cb 0.45 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.20 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 0.00 4.34 0.15 1.09 0.52 -1.26 -4.37 118.95 119.43 1are s ARG 111 Ca 0.00 1.94 -0.04 0.00 -0.52 0.00 0.00 55.73 57.11 1are s ARG 111 Cb 0.00 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 32.04 1are s ARG 111 CO 0.00 -0.43 0.38 0.00 0.02 0.00 0.00 175.30 175.27 1are s ALA 112 N 1.50 3.80 0.16 2.13 0.00 -1.26 -0.78 121.76 127.31 1are s ALA 112 Ca 0.62 -0.61 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 1are s ALA 112 Cb -0.33 -2.10 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 1are s ALA 112 CO 0.29 0.63 0.14 -0.06 0.00 0.00 0.00 175.76 176.75 1are s PHE 113 N -1.70 0.79 -0.13 0.00 0.08 0.18 -4.96 117.98 112.24 1are s PHE 113 Ca 0.41 -1.14 0.03 0.00 0.12 0.00 0.00 56.93 56.35 1are s PHE 113 Cb -0.12 -0.37 -0.24 0.00 -0.57 0.00 0.00 43.02 41.72 1are s PHE 113 CO 0.26 -0.61 0.31 0.00 -0.10 0.00 0.00 175.22 175.08 1are n ALA 114 N -0.16 1.22 -2.82 5.36 0.00 -1.26 -3.37 120.51 119.47 1are n ALA 114 Ca -0.04 -0.81 -0.34 0.00 0.00 0.00 0.00 53.44 52.24 1are n ALA 114 Cb 0.64 -0.57 -0.11 0.00 0.00 0.00 0.00 19.45 19.41 1are n ALA 114 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1are s ARG 115 N -2.55 3.35 0.35 0.00 1.81 -1.26 -4.90 118.95 115.74 1are s ARG 115 Ca -0.18 -0.50 0.05 0.00 -1.72 0.00 0.00 55.73 53.38 1are s ARG 115 Cb 0.07 -2.83 0.70 0.00 -0.45 0.00 0.00 34.95 32.44 1are s ARG 115 CO 0.76 0.43 1.93 0.37 -0.68 0.00 0.00 175.30 178.11 1are h GLN 116 N 6.08 0.79 -0.94 3.54 4.15 -1.97 -0.35 115.11 126.40 1are h GLN 116 Ca -0.39 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 58.99 1are h GLN 116 Cb 1.19 -0.18 -0.05 0.00 0.21 0.00 0.00 27.48 28.65 1are h GLN 116 CO 0.59 0.52 0.62 1.49 -1.93 0.00 0.00 178.83 180.13 1are h GLU 117 N 0.81 1.24 0.00 1.69 4.81 -1.99 0.77 114.58 121.92 1are h GLU 117 Ca 0.36 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1are h GLU 117 Cb 0.33 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 1are h GLU 117 CO -0.13 0.83 -0.02 0.00 -0.73 0.00 0.00 179.01 178.96 1are h ALA 118 N 1.41 1.53 0.00 2.92 0.00 -1.47 -1.52 119.26 122.12 1are h ALA 118 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1are h ALA 118 Cb -0.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1are h ALA 118 CO -0.07 0.02 -0.01 1.25 0.00 0.00 0.00 179.25 180.43 1are h LEU 119 N 0.00 0.00 -0.73 0.00 5.85 -0.76 -2.91 115.31 116.76 1are h LEU 119 Ca -0.00 0.00 0.11 0.00 0.84 0.00 0.00 57.88 58.83 1are h LEU 119 Cb 0.04 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 40.95 1are h LEU 119 CO 0.00 0.07 -0.28 1.17 -0.34 0.00 0.00 178.44 179.06 1are n LYS 120 N -2.39 -0.17 -0.05 1.25 4.81 -0.31 0.22 118.16 121.52 1are n LYS 120 Ca -0.00 1.12 -0.08 0.00 -0.87 0.00 0.00 58.31 58.48 1are n LYS 120 Cb 0.01 -1.67 -0.02 0.00 0.02 0.00 0.00 35.03 33.37 1are n LYS 120 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1are h ARG 121 N 0.00 -0.04 -0.54 1.64 9.65 -1.44 -1.67 114.38 121.99 1are h ARG 121 Ca 0.26 0.00 0.11 0.00 -1.10 0.00 0.00 59.98 59.25 1are h ARG 121 Cb 0.44 0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 28.94 1are h ARG 121 CO -0.73 -0.02 -0.00 1.25 2.80 0.00 0.00 179.97 183.27 1are h HIS 122 N -0.04 -0.04 -0.89 2.20 2.76 0.29 0.77 115.15 120.20 1are h HIS 122 Ca 0.11 0.04 0.19 0.00 -2.20 0.00 0.00 60.37 58.52 1are h HIS 122 Cb 0.21 0.10 -0.11 0.00 1.55 0.00 0.00 27.41 29.16 1are h HIS 122 CO -0.25 -0.13 0.43 -0.92 -1.30 0.00 0.00 177.93 175.76 1are h TYR 123 N 0.11 0.74 -0.71 5.26 5.03 0.17 0.61 116.97 128.18 1are h TYR 123 Ca 0.27 0.04 0.21 0.00 2.58 0.00 0.00 58.73 61.83 1are h TYR 123 Cb 0.42 -0.19 -0.03 0.00 1.55 0.00 0.00 36.73 38.48 1are h TYR 123 CO -0.33 0.06 0.57 0.07 -1.32 0.00 0.00 178.16 177.21 1are h ARG 124 N 0.51 0.00 0.00 1.82 0.11 -0.39 1.14 114.38 117.58 1are h ARG 124 Ca 0.53 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 60.54 1are h ARG 124 Cb 0.91 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.98 1are h ARG 124 CO -0.46 0.00 -0.33 0.66 0.10 0.00 0.00 179.97 179.94 1are h SER 125 N 0.00 0.00 0.00 0.08 4.64 0.27 -1.32 113.55 117.22 1are h SER 125 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1are h SER 125 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 1are h SER 125 CO -0.00 0.33 0.00 1.41 -0.87 0.00 0.00 176.83 177.70 1are n HIS 126 N -3.74 0.00 0.00 4.77 8.25 0.39 -4.55 115.22 120.35 1are n HIS 126 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 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 -0.92 0.00 0.00 1.59 -2.24 -0.56 -5.13 114.28 107.02 1are n THR 127 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1are n THR 127 Cb 0.07 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1are n THR 127 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1are n ASN 128 N 0.00 0.00 -2.84 3.42 2.85 -0.84 -5.10 115.26 112.75 1are n ASN 128 Ca 0.00 0.00 -0.02 0.00 -0.11 0.00 0.00 54.58 54.45 1are n ASN 128 Cb 0.00 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.03 1are n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 1are s GLU 129 N 0.00 0.78 0.00 1.20 0.41 -1.25 -5.07 118.70 114.77 1are s GLU 129 Ca 0.00 -0.65 0.00 0.00 -0.41 0.00 0.00 54.97 53.91 1are s GLU 129 Cb 0.00 -0.00 0.00 0.00 -1.78 0.00 0.00 34.13 32.35 1are s GLU 129 CO 0.00 -1.00 0.49 0.36 -0.49 0.00 0.00 175.26 174.62