#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e4s s HIS 34 N 0.00 -0.09 0.09 1.24 -3.43 -1.26 -4.55 115.29 107.29 1e4s s HIS 34 Ca 0.00 0.03 0.10 0.00 -0.80 0.00 0.00 55.06 54.38 1e4s s HIS 34 Cb 0.00 0.06 -0.03 0.00 -1.43 0.00 0.00 32.58 31.17 1e4s s HIS 34 CO 0.00 -0.42 -0.25 -0.47 -2.00 0.00 0.00 174.74 171.60 1e4s s TYR 35 N -1.94 2.16 -1.15 0.38 6.14 -1.26 -4.97 117.35 116.70 1e4s s TYR 35 Ca -0.09 -0.39 -0.07 0.00 0.64 0.00 0.00 57.07 57.15 1e4s s TYR 35 Cb -0.03 -1.22 -0.02 0.00 0.42 0.00 0.00 41.96 41.10 1e4s s TYR 35 CO 0.00 0.22 2.83 0.27 0.64 0.00 0.00 175.55 179.51 1e4s n ASN 36 N 1.31 7.76 0.21 4.32 6.94 -1.26 -4.64 115.26 129.89 1e4s n ASN 36 Ca -0.18 -2.84 -0.13 0.00 -0.02 0.00 0.00 54.58 51.41 1e4s n ASN 36 Cb 0.53 -1.43 -0.07 0.00 -2.36 0.00 0.00 39.78 36.44 1e4s n ASN 36 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1e4s h VAL 38 N -0.91 0.62 -0.00 0.00 2.07 -1.82 0.27 116.25 116.49 1e4s h VAL 38 Ca -0.06 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 1e4s h VAL 38 Cb 0.56 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1e4s h VAL 38 CO 0.09 0.00 -0.55 -1.28 0.02 0.00 0.00 177.57 175.86 1e4s h SER 39 N 0.00 0.01 1.75 0.57 0.87 -1.80 -2.82 113.55 112.13 1e4s h SER 39 Ca 0.29 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.81 1e4s h SER 39 Cb 1.20 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1e4s h SER 39 CO -0.00 0.55 -0.14 -1.28 -0.53 0.00 0.00 176.83 175.43 1e4s h SER 40 N 0.00 0.00 0.00 6.23 0.87 -0.18 -3.46 113.55 117.01 1e4s h SER 40 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1e4s h SER 40 Cb 0.97 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 1e4s h SER 40 CO 0.07 0.14 0.00 0.61 -0.53 0.00 0.00 176.83 177.12 1e4s n GLY 41 N 1.02 1.11 4.01 5.77 0.00 -0.98 -5.09 105.19 111.02 1e4s n GLY 41 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1e4s n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1e4s s GLY 42 N -0.80 1.91 0.18 -0.02 0.00 -1.08 -4.79 107.32 102.72 1e4s s GLY 42 Ca 0.00 -1.80 0.10 0.00 0.00 0.00 0.00 44.72 43.03 1e4s s GLY 42 CO 0.00 -1.56 -0.20 1.62 0.00 0.00 0.00 173.10 172.96 1e4s s GLN 43 N -4.42 1.68 -0.62 2.90 0.74 0.22 -3.38 119.66 116.78 1e4s s GLN 43 Ca 0.56 -1.41 -0.17 0.00 0.05 0.00 0.00 55.36 54.40 1e4s s GLN 43 Cb -0.08 -1.96 0.14 0.00 1.10 0.00 0.00 33.01 32.20 1e4s s GLN 43 CO 0.34 0.42 0.63 0.00 -0.55 0.00 0.00 175.29 176.13 1e4s s LEU 45 N 1.73 2.72 0.00 0.00 1.43 -0.35 -4.81 118.68 119.39 1e4s s LEU 45 Ca 0.09 0.36 0.15 0.00 -1.03 0.00 0.00 54.13 53.70 1e4s s LEU 45 Cb -0.24 -2.67 0.14 0.00 0.03 0.00 0.00 46.19 43.45 1e4s s LEU 45 CO 0.02 -2.19 1.01 -1.22 0.23 0.00 0.00 176.35 174.20 1e4s n TYR 46 N -3.37 0.04 -4.53 0.29 4.01 -1.26 -1.74 117.16 110.60 1e4s n TYR 46 Ca 0.12 -0.03 -0.25 0.00 -0.16 0.00 0.00 57.90 57.58 1e4s n TYR 46 Cb 0.60 -0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.53 1e4s n TYR 46 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1e4s s SER 47 N -1.26 2.93 -0.23 7.72 1.04 -1.26 -4.59 113.70 118.05 1e4s s SER 47 Ca 0.19 -1.46 -0.42 0.00 0.48 0.00 0.00 55.95 54.74 1e4s s SER 47 Cb 0.13 0.01 -0.19 0.00 0.10 0.00 0.00 66.02 66.08 1e4s s SER 47 CO 0.19 -0.66 1.45 0.00 0.98 0.00 0.00 173.24 175.21 1e4s n ALA 48 N -0.84 -1.67 -1.53 5.32 0.00 -1.26 -4.55 120.51 115.97 1e4s n ALA 48 Ca -0.05 0.51 -0.56 0.00 0.00 0.00 0.00 53.44 53.33 1e4s n ALA 48 Cb 0.66 -1.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.08 1e4s n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1e4s s PRO 50 N 0.11 4.51 0.61 0.00 0.04 -1.26 -4.91 135.00 134.10 1e4s s PRO 50 Ca 0.88 1.86 0.37 0.00 0.04 0.00 0.00 61.00 64.15 1e4s s PRO 50 Cb -1.15 -3.08 1.98 0.00 0.04 0.00 0.00 34.50 32.29 1e4s s PRO 50 CO 0.54 0.07 2.24 -0.84 0.04 0.00 0.00 177.00 179.05 1e4s h ILE 51 N 2.96 0.23 0.00 0.56 3.07 -2.01 -1.93 117.51 120.39 1e4s h ILE 51 Ca -0.47 -0.17 0.00 0.00 1.55 0.00 0.00 64.86 65.77 1e4s h ILE 51 Cb 1.22 1.13 0.00 0.00 -0.27 0.00 0.00 36.82 38.90 1e4s h ILE 51 CO 0.66 0.02 0.18 -0.26 -1.05 0.00 0.00 178.15 177.70 1e4s h PHE 52 N 0.00 0.00 -3.96 0.16 0.04 -2.01 -3.42 116.94 107.75 1e4s h PHE 52 Ca -0.00 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.47 1e4s h PHE 52 Cb 0.13 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.13 1e4s h PHE 52 CO 0.00 0.00 -0.63 0.95 -0.60 0.00 0.00 178.31 178.03 1e4s s THR 53 N -3.78 0.46 0.19 -1.55 -4.23 -0.73 -5.08 115.64 100.92 1e4s s THR 53 Ca -0.03 -1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 58.47 1e4s s THR 53 Cb 0.08 -2.43 -0.05 0.00 1.34 0.00 0.00 72.50 71.44 1e4s s THR 53 CO 0.24 -0.17 0.39 -0.54 -0.54 0.00 0.00 174.62 174.01 1e4s s LYS 54 N -4.02 3.56 -0.37 3.99 1.02 0.28 -4.78 119.74 119.41 1e4s s LYS 54 Ca 0.33 -0.24 -0.18 0.00 0.02 0.00 0.00 55.97 55.91 1e4s s LYS 54 Cb 0.07 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.55 1e4s s LYS 54 CO 0.10 0.41 0.49 -1.50 -0.92 0.00 0.00 175.35 173.93 1e4s s ILE 55 N -1.81 5.03 0.05 2.17 2.07 -1.26 0.22 121.20 127.67 1e4s s ILE 55 Ca 0.40 0.15 0.15 0.00 -1.41 0.00 0.00 60.65 59.94 1e4s s ILE 55 Cb -0.11 -3.98 0.05 0.00 0.13 0.00 0.00 42.46 38.55 1e4s s ILE 55 CO 0.28 -0.28 1.56 1.56 -1.91 0.00 0.00 174.94 176.15 1e4s h GLN 56 N 8.55 0.00 0.00 3.50 1.08 -1.89 -3.47 115.11 122.88 1e4s h GLN 56 Ca -0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 1e4s h GLN 56 Cb 1.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1e4s h GLN 56 CO 0.78 0.52 0.00 0.41 -0.95 0.00 0.00 178.83 179.59 1e4s n GLY 57 N 0.75 -0.60 3.96 3.46 0.00 -1.26 -5.10 105.19 106.41 1e4s n GLY 57 Ca 0.01 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1e4s n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1e4s s THR 58 N -3.82 3.79 0.00 2.61 -4.23 -1.26 -3.34 115.64 109.39 1e4s s THR 58 Ca 0.00 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1e4s s THR 58 Cb 0.00 -3.39 0.00 0.00 1.34 0.00 0.00 72.50 70.45 1e4s s THR 58 CO 0.00 -0.26 0.00 0.00 -0.54 0.00 0.00 174.62 173.82 1e4s h TYR 60 N 0.00 -0.73 -2.26 0.00 0.05 -1.87 -3.40 116.97 108.76 1e4s h TYR 60 Ca 0.00 0.01 -0.60 0.00 0.05 0.00 0.00 58.73 58.19 1e4s h TYR 60 Cb 0.00 0.29 -0.13 0.00 1.01 0.00 0.00 36.73 37.90 1e4s h TYR 60 CO 0.00 -0.39 -0.73 0.50 -1.05 0.00 0.00 178.16 176.48 1e4s s ARG 61 N -6.06 1.84 0.39 4.88 3.52 -1.26 -4.43 118.95 117.83 1e4s s ARG 61 Ca -0.16 -1.66 0.27 0.00 -0.13 0.00 0.00 55.73 54.05 1e4s s ARG 61 Cb 0.07 -1.88 1.37 0.00 -1.56 0.00 0.00 34.95 32.94 1e4s s ARG 61 CO 0.64 0.34 1.82 0.78 -0.81 0.00 0.00 175.30 178.08 1e4s h GLY 62 N 2.22 0.00 2.00 8.12 0.00 -2.00 -1.48 103.07 111.93 1e4s h GLY 62 Ca -0.41 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 1e4s h GLY 62 CO 0.59 0.00 -0.40 0.50 0.00 0.00 0.00 176.54 177.23 1e4s h LYS 63 N 0.00 0.00 -6.09 4.80 1.57 -1.94 -3.44 116.57 111.47 1e4s h LYS 63 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1e4s h LYS 63 Cb 0.13 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.37 1e4s h LYS 63 CO 0.00 0.40 -0.50 0.00 -0.57 0.00 0.00 179.45 178.78 1e4s s ALA 64 N -3.82 3.64 0.02 3.86 0.00 -0.56 -4.40 121.76 120.48 1e4s s ALA 64 Ca -0.01 -1.85 -0.02 0.00 0.00 0.00 0.00 51.96 50.08 1e4s s ALA 64 Cb 0.12 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1e4s s ALA 64 CO 0.70 -0.03 0.02 0.15 0.00 0.00 0.00 175.76 176.60 1e4s s LYS 65 N -3.91 0.37 0.09 0.00 -0.14 -0.71 -3.93 119.74 111.50 1e4s s LYS 65 Ca 0.40 -0.57 -0.12 0.00 -1.36 0.00 0.00 55.97 54.31 1e4s s LYS 65 Cb -0.02 0.14 -0.06 0.00 -1.68 0.00 0.00 37.83 36.21 1e4s s LYS 65 CO 0.24 -0.07 0.46 0.00 -0.76 0.00 0.00 175.35 175.22