#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ard s SER 103 N 0.00 0.07 0.09 6.15 0.01 -1.26 -5.12 113.70 113.64 1ard s SER 103 Ca 0.00 -0.17 -0.36 0.00 1.31 0.00 0.00 55.95 56.73 1ard s SER 103 Cb 0.00 0.12 -0.16 0.00 0.21 0.00 0.00 66.02 66.19 1ard s SER 103 CO 0.00 -0.18 1.42 0.49 0.41 0.00 0.00 173.24 175.38 1ard n PHE 104 N 2.24 1.73 -3.89 2.43 3.72 -1.26 -4.87 117.46 117.56 1ard n PHE 104 Ca -0.18 0.54 -0.21 0.00 -0.05 0.00 0.00 57.45 57.54 1ard n PHE 104 Cb 0.57 -2.39 -0.17 0.00 -0.94 0.00 0.00 39.48 36.55 1ard n PHE 104 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1ard s VAL 105 N 0.77 0.37 -0.74 -4.37 1.01 -1.25 -1.85 120.40 114.33 1ard s VAL 105 Ca 0.84 0.07 -0.26 0.00 0.00 0.00 0.00 61.98 62.63 1ard s VAL 105 Cb -0.89 -0.48 -0.12 0.00 0.00 0.00 0.00 36.38 34.89 1ard s VAL 105 CO 0.46 0.23 2.37 0.00 0.00 0.00 0.00 175.10 178.15 1ard h GLU 107 N 13.90 0.00 0.00 0.00 4.11 -1.93 7.86 114.58 138.52 1ard h GLU 107 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.39 1ard h GLU 107 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1ard h GLU 107 CO 1.05 0.00 0.00 0.28 0.07 0.00 0.00 179.01 180.41 1ard n VAL 108 N -2.79 0.00 -0.85 -1.06 0.31 -1.26 -4.04 118.33 108.64 1ard n VAL 108 Ca 0.03 0.81 0.05 0.00 -0.01 0.00 0.00 64.34 65.21 1ard n VAL 108 Cb 0.84 -1.75 0.38 0.00 -0.91 0.00 0.00 33.84 32.40 1ard n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ard n THR 110 N 0.49 -1.57 -4.03 0.00 -2.24 2.50 -4.86 114.28 104.57 1ard n THR 110 Ca 0.29 -0.44 -0.35 0.00 -2.27 0.00 0.00 64.05 61.28 1ard n THR 110 Cb 1.20 -1.38 -0.13 0.00 -2.10 0.00 0.00 70.33 67.92 1ard n THR 110 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ard s ARG 111 N -6.81 3.59 0.01 -0.78 0.52 -1.07 -4.70 118.95 109.70 1ard s ARG 111 Ca 0.24 -0.53 -0.14 0.00 -0.52 0.00 0.00 55.73 54.77 1ard s ARG 111 Cb -0.13 -3.09 -0.06 0.00 0.52 0.00 0.00 34.95 32.19 1ard s ARG 111 CO 0.79 -0.03 0.41 0.00 0.02 0.00 0.00 175.30 176.49 1ard s ALA 112 N 1.11 3.70 0.22 2.13 0.00 -1.26 0.13 121.76 127.79 1ard s ALA 112 Ca 0.02 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.81 1ard s ALA 112 Cb -0.14 -2.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.54 1ard s ALA 112 CO 0.01 0.49 -0.04 -0.06 0.00 0.00 0.00 175.76 176.16 1ard s PHE 113 N -1.11 1.56 -0.70 0.00 0.08 -0.77 -4.99 117.98 112.06 1ard s PHE 113 Ca 0.25 -0.84 0.25 0.00 0.12 0.00 0.00 56.93 56.70 1ard s PHE 113 Cb -0.17 -0.88 0.50 0.00 -0.57 0.00 0.00 43.02 41.91 1ard s PHE 113 CO 0.14 0.05 1.46 0.00 -0.10 0.00 0.00 175.22 176.77 1ard n ALA 114 N -0.40 2.77 -2.41 5.36 0.00 -1.26 -4.40 120.51 120.18 1ard n ALA 114 Ca -0.06 -0.19 -0.13 0.00 0.00 0.00 0.00 53.44 53.06 1ard n ALA 114 Cb 0.63 -1.26 -0.11 0.00 0.00 0.00 0.00 19.45 18.72 1ard n ALA 114 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ard s ARG 115 N -3.13 0.80 -0.07 0.00 0.52 -1.26 -5.07 118.95 110.74 1ard s ARG 115 Ca 0.08 -1.18 -0.15 0.00 -0.52 0.00 0.00 55.73 53.96 1ard s ARG 115 Cb 0.13 -0.37 -0.11 0.00 0.52 0.00 0.00 34.95 35.12 1ard s ARG 115 CO 0.68 0.04 0.56 1.96 0.02 0.00 0.00 175.30 178.56 1ard h GLN 116 N 3.43 -0.20 -0.93 3.54 4.20 -1.98 -3.28 115.11 119.89 1ard h GLN 116 Ca -0.36 0.01 0.36 0.00 0.06 0.00 0.00 58.65 58.72 1ard h GLN 116 Cb 1.18 0.05 -0.17 0.00 0.30 0.00 0.00 27.48 28.84 1ard h GLN 116 CO 0.56 0.11 0.38 -0.85 -0.67 0.00 0.00 178.83 178.36 1ard n GLU 117 N -4.90 -0.06 -0.13 1.46 -0.00 -1.26 0.23 120.64 115.97 1ard n GLU 117 Ca -0.06 1.32 -0.04 0.00 -0.00 0.00 0.00 57.16 58.38 1ard n GLU 117 Cb 0.21 -2.29 0.04 0.00 -0.00 0.00 0.00 31.44 29.40 1ard n GLU 117 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1ard h HIS 118 N 0.00 0.12 0.69 -1.84 3.86 -1.97 1.06 115.15 117.07 1ard h HIS 118 Ca 0.73 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.94 1ard h HIS 118 Cb 1.86 0.01 0.01 0.00 1.06 0.00 0.00 27.41 30.35 1ard h HIS 118 CO -0.13 -0.01 -0.33 1.25 0.86 0.00 0.00 177.93 179.57 1ard h LEU 119 N 0.20 -0.78 -0.22 2.43 5.85 0.27 0.35 115.31 123.41 1ard h LEU 119 Ca 0.21 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.99 1ard h LEU 119 Cb 0.27 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 1ard h LEU 119 CO -0.29 -0.50 -0.50 0.50 -0.34 0.00 0.00 178.44 177.32 1ard h LYS 120 N -1.04 -0.44 -0.64 1.25 1.63 -0.99 0.95 116.57 117.28 1ard h LYS 120 Ca -0.09 0.03 0.19 0.00 -0.85 0.00 0.00 60.65 59.92 1ard h LYS 120 Cb 0.71 0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.42 1ard h LYS 120 CO 0.16 -0.30 0.46 -0.09 -3.45 0.00 0.00 179.45 176.23 1ard h ARG 121 N -0.46 0.00 -0.01 1.90 9.65 0.11 -0.24 114.38 125.34 1ard h ARG 121 Ca 0.04 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.92 1ard h ARG 121 Cb 0.58 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1ard h ARG 121 CO -0.45 0.00 -0.01 1.25 2.80 0.00 0.00 179.97 183.56 1ard h HIS 122 N 0.00 0.02 -1.23 2.20 -0.00 0.43 -3.03 115.15 113.53 1ard h HIS 122 Ca 0.30 -0.01 0.36 0.00 -0.00 0.00 0.00 60.37 61.03 1ard h HIS 122 Cb 1.23 -0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.58 1ard h HIS 122 CO 0.00 0.58 1.27 0.98 -0.00 0.00 0.00 177.93 180.76 1ard n TYR 123 N -4.80 0.00 -0.37 5.26 4.19 0.27 0.81 117.16 122.53 1ard n TYR 123 Ca -0.09 0.00 0.33 0.00 3.31 0.00 0.00 57.90 61.45 1ard n TYR 123 Cb 0.29 -0.31 0.67 0.00 0.49 0.00 0.00 39.34 40.48 1ard n TYR 123 CO 0.00 0.00 0.00 0.07 0.91 0.00 0.00 176.86 177.84 1ard h ARG 124 N 0.00 0.13 -0.15 2.98 -0.00 -1.49 3.71 114.38 119.56 1ard h ARG 124 Ca 0.59 -0.01 0.00 0.00 -0.00 0.00 0.00 59.98 60.56 1ard h ARG 124 Cb 3.11 -0.03 0.00 0.00 -0.00 0.00 0.00 29.97 33.06 1ard h ARG 124 CO -0.01 0.09 0.00 -1.13 -0.00 0.00 0.00 179.97 178.92 1ard n SER 125 N -4.37 0.73 -0.00 0.08 3.41 0.24 -2.71 113.62 110.99 1ard n SER 125 Ca 0.28 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 1ard n SER 125 Cb 1.22 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 65.07 1ard n SER 125 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ard n HIS 126 N -0.11 0.00 0.00 7.33 8.25 1.23 -5.03 115.22 126.89 1ard n HIS 126 Ca 0.04 -0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.19 1ard n HIS 126 Cb 0.12 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1ard n HIS 126 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1ard n THR 127 N -0.31 0.00 -1.61 1.59 5.66 -1.08 -5.02 114.28 113.50 1ard n THR 127 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1ard n THR 127 Cb 0.16 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.00 1ard n THR 127 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1ard n ASN 128 N 0.00 7.18 -3.73 1.09 6.94 -1.26 -4.52 115.26 120.96 1ard n ASN 128 Ca 0.00 -3.79 -0.49 0.00 -0.02 0.00 0.00 54.58 50.28 1ard n ASN 128 Cb 0.00 -0.90 -0.07 0.00 -2.36 0.00 0.00 39.78 36.46 1ard n ASN 128 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1ard n GLU 129 N -0.78 0.00 0.00 -3.83 -0.58 -1.26 -5.22 120.64 108.96 1ard n GLU 129 Ca 0.57 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.31 1ard n GLU 129 Cb 0.60 -1.24 0.00 0.00 -0.57 0.00 0.00 31.44 30.23 1ard n GLU 129 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01