#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jua s ASP 49 N 0.00 0.50 0.53 1.09 3.68 -1.26 -5.04 116.67 116.18 3jua s ASP 49 Ca 0.00 0.38 0.31 0.00 2.13 0.00 0.00 52.55 55.37 3jua s ASP 49 Cb 0.00 0.34 1.43 0.00 -1.45 0.00 0.00 42.92 43.24 3jua s ASP 49 CO 0.00 -0.23 2.03 0.17 0.13 0.00 0.00 175.17 177.27 3jua h LEU 50 N 8.12 0.00 -1.96 -1.34 -0.00 -2.09 -3.13 115.31 114.92 3jua h LEU 50 Ca -0.19 0.00 0.55 0.00 -0.00 0.00 0.00 57.88 58.24 3jua h LEU 50 Cb 1.12 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 41.71 3jua h LEU 50 CO 0.20 0.09 1.39 -0.08 -0.00 0.00 0.00 178.44 180.03 3jua h GLU 51 N 0.00 0.00 -0.64 0.17 4.57 -2.02 -0.29 114.58 116.37 3jua h GLU 51 Ca -0.00 0.00 0.19 0.00 -1.18 0.00 0.00 59.36 58.36 3jua h GLU 51 Cb 0.45 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.01 3jua h GLU 51 CO 0.01 0.00 0.54 0.00 -1.18 0.00 0.00 179.01 178.38 3jua h ALA 52 N 1.01 2.49 0.00 2.92 0.00 -2.01 -0.01 119.26 123.66 3jua h ALA 52 Ca 0.90 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.67 3jua h ALA 52 Cb 3.67 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 21.49 3jua h ALA 52 CO -0.01 -0.87 -0.96 -0.07 0.00 0.00 0.00 179.25 177.35 3jua h LEU 53 N 0.00 0.00 0.00 0.00 3.38 -1.35 -3.38 115.31 113.96 3jua h LEU 53 Ca 0.30 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.17 3jua h LEU 53 Cb 1.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 3jua h LEU 53 CO -0.00 0.46 -0.80 -0.26 0.09 0.00 0.00 178.44 177.92 3jua h PHE 54 N 0.00 0.00 -0.47 1.13 0.04 -1.16 -3.35 116.94 113.12 3jua h PHE 54 Ca -0.08 0.00 0.14 0.00 2.80 0.00 0.00 57.97 60.83 3jua h PHE 54 Cb 1.42 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.55 3jua h PHE 54 CO 0.00 0.70 0.37 -2.95 -0.60 0.00 0.00 178.31 175.83 3jua h ASN 55 N -1.00 0.00 -1.03 2.17 7.08 -1.77 0.21 115.58 121.23 3jua h ASN 55 Ca -0.16 0.00 0.42 0.00 -3.08 0.00 0.00 56.30 53.49 3jua h ASN 55 Cb 0.86 0.00 -0.17 0.00 -2.08 0.00 0.00 38.32 36.92 3jua h ASN 55 CO -0.09 0.00 0.57 0.00 -2.08 0.00 0.00 177.43 175.83 3jua n ALA 56 N -2.54 1.06 -2.78 4.14 0.00 -1.26 -1.71 120.51 117.42 3jua n ALA 56 Ca 0.08 1.00 0.01 0.00 0.00 0.00 0.00 53.44 54.53 3jua n ALA 56 Cb 0.58 -1.02 0.05 0.00 0.00 0.00 0.00 19.45 19.06 3jua n ALA 56 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3jua n VAL 57 N -5.19 1.05 0.25 0.00 0.24 0.61 -4.48 118.33 110.80 3jua n VAL 57 Ca 0.38 -2.59 0.04 0.00 -2.04 0.00 0.00 64.34 60.13 3jua n VAL 57 Cb 1.31 1.26 0.04 0.00 -1.47 0.00 0.00 33.84 34.98 3jua n VAL 57 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 3jua n MET 58 N -0.43 0.42 -4.40 7.34 2.81 -0.37 -5.06 117.12 117.43 3jua n MET 58 Ca 0.07 -1.07 -0.27 0.00 -1.81 0.00 0.00 57.70 54.63 3jua n MET 58 Cb 0.86 -1.15 -0.12 0.00 -0.71 0.00 0.00 33.22 32.10 3jua n MET 58 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3jua s ASN 59 N -0.66 3.31 0.00 7.83 0.01 -0.77 -5.00 114.94 119.65 3jua s ASN 59 Ca 0.09 -0.84 0.00 0.00 -0.71 0.00 0.00 52.86 51.40 3jua s ASN 59 Cb 0.06 -0.23 0.00 0.00 0.41 0.00 0.00 41.25 41.49 3jua s ASN 59 CO 0.09 0.11 0.21 -2.65 -1.51 0.00 0.00 177.10 173.36 3jua n PRO 60 N 0.40 0.00 -3.16 -0.60 -0.02 -1.26 -4.75 135.00 125.61 3jua n PRO 60 Ca -0.14 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.13 3jua n PRO 60 Cb 0.55 -0.70 -0.04 0.00 -0.02 0.00 0.00 33.50 33.30 3jua n PRO 60 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3jua n LYS 61 N -0.47 1.41 -3.26 -0.52 4.81 -1.26 -4.95 118.16 113.92 3jua n LYS 61 Ca 0.00 -3.69 -0.18 0.00 -0.87 0.00 0.00 58.31 53.58 3jua n LYS 61 Cb 0.00 -1.74 -0.07 0.00 0.02 0.00 0.00 35.03 33.24 3jua n LYS 61 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 3jua s THR 62 N -2.57 -0.25 -0.30 3.15 -1.32 -1.26 -5.06 115.64 108.03 3jua s THR 62 Ca 0.41 -1.50 -0.16 0.00 -1.21 0.00 0.00 61.69 59.22 3jua s THR 62 Cb 0.29 -0.72 0.19 0.00 -1.51 0.00 0.00 72.50 70.75 3jua s THR 62 CO -0.09 -0.68 1.18 0.00 -2.21 0.00 0.00 174.62 172.82 3jua s ALA 63 N 0.90 -2.54 -0.24 11.08 0.00 -1.26 -4.83 121.76 124.87 3jua s ALA 63 Ca 0.24 2.03 0.02 0.00 0.00 0.00 0.00 51.96 54.26 3jua s ALA 63 Cb -0.07 -1.90 0.05 0.00 0.00 0.00 0.00 23.12 21.20 3jua s ALA 63 CO -0.08 -0.31 -0.13 0.54 0.00 0.00 0.00 175.76 175.78 3jua s ASN 64 N 1.08 4.13 0.21 0.00 4.22 -1.26 -5.08 114.94 118.24 3jua s ASN 64 Ca -0.08 -1.20 0.01 0.00 -2.14 0.00 0.00 52.86 49.46 3jua s ASN 64 Cb -0.03 -1.54 -0.05 0.00 1.28 0.00 0.00 41.25 40.92 3jua s ASN 64 CO -0.11 -0.14 0.06 0.68 -2.04 0.00 0.00 177.10 175.55 3jua s VAL 65 N 1.16 0.46 0.66 3.54 -7.23 -1.26 -5.10 120.40 112.62 3jua s VAL 65 Ca -0.05 -1.98 -0.17 0.00 -1.81 0.00 0.00 61.98 57.96 3jua s VAL 65 Cb -0.18 -2.37 -0.00 0.00 0.56 0.00 0.00 36.38 34.39 3jua s VAL 65 CO -0.07 -0.22 1.23 -2.84 -0.31 0.00 0.00 175.10 172.90 3jua s PRO 66 N -4.01 2.55 -0.08 4.82 0.02 -1.26 -4.99 135.00 132.04 3jua s PRO 66 Ca 0.32 1.87 -0.04 0.00 0.02 0.00 0.00 61.00 63.16 3jua s PRO 66 Cb 0.07 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.68 3jua s PRO 66 CO 0.09 -1.55 0.11 -0.65 -0.33 0.00 0.00 177.00 174.67 3jua s GLN 67 N -3.56 3.30 0.14 5.54 -0.21 -1.26 -5.10 119.66 118.51 3jua s GLN 67 Ca 0.78 -0.26 -0.07 0.00 0.02 0.00 0.00 55.36 55.83 3jua s GLN 67 Cb -0.32 -3.06 -0.02 0.00 1.00 0.00 0.00 33.01 30.62 3jua s GLN 67 CO 0.39 0.73 0.20 -0.08 -2.12 0.00 0.00 175.29 174.42 3jua s THR 68 N -1.08 0.09 -0.19 -0.19 -1.32 -1.26 -5.14 115.64 106.56 3jua s THR 68 Ca 0.18 -1.50 -0.17 0.00 -1.21 0.00 0.00 61.69 59.00 3jua s THR 68 Cb -0.12 -1.80 -0.04 0.00 -1.51 0.00 0.00 72.50 69.03 3jua s THR 68 CO 0.08 -0.42 0.43 0.68 -2.21 0.00 0.00 174.62 173.18 3jua s VAL 69 N -3.97 5.18 0.45 5.08 -7.23 -1.26 -5.03 120.40 113.63 3jua s VAL 69 Ca 0.16 0.79 -0.25 0.00 -1.81 0.00 0.00 61.98 60.87 3jua s VAL 69 Cb 0.05 -3.76 -0.08 0.00 0.56 0.00 0.00 36.38 33.15 3jua s VAL 69 CO -0.02 0.25 1.36 -2.16 -0.31 0.00 0.00 175.10 174.23 3jua s PRO 70 N 1.23 3.73 0.25 4.82 0.04 -1.26 -4.90 135.00 138.91 3jua s PRO 70 Ca 0.21 2.26 -0.04 0.00 0.04 0.00 0.00 61.00 63.48 3jua s PRO 70 Cb -0.15 -2.63 0.40 0.00 0.04 0.00 0.00 34.50 32.16 3jua s PRO 70 CO 0.08 -0.73 1.82 1.98 0.04 0.00 0.00 177.00 180.19 3jua h MET 71 N 2.34 0.80 -3.14 4.56 4.05 -1.98 -1.24 114.93 120.32 3jua h MET 71 Ca -0.50 -0.05 -0.80 0.00 -0.28 0.00 0.00 59.70 58.07 3jua h MET 71 Cb 1.26 -0.18 -0.26 0.00 -0.80 0.00 0.00 31.60 31.62 3jua h MET 71 CO 0.61 0.53 0.89 2.89 0.23 0.00 0.00 176.91 182.07 3jua n ARG 72 N -4.72 4.21 -2.99 0.39 1.85 -1.26 0.33 116.66 114.47 3jua n ARG 72 Ca 0.14 -4.40 -0.15 0.00 -1.00 0.00 0.00 57.85 52.44 3jua n ARG 72 Cb 0.27 -2.58 -0.02 0.00 -1.05 0.00 0.00 32.46 29.09 3jua n ARG 72 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 3jua n LEU 73 N 1.95 -1.74 -4.95 2.89 -0.00 -0.47 -5.17 117.00 109.51 3jua n LEU 73 Ca 0.28 -3.80 -0.28 0.00 -0.00 0.00 0.00 56.01 52.21 3jua n LEU 73 Cb 0.35 0.72 0.15 0.00 -0.00 0.00 0.00 43.42 44.63 3jua n LEU 73 CO 0.69 1.98 0.76 -0.13 -0.00 0.00 0.00 177.39 180.70 3jua s ARG 74 N 0.09 1.17 -1.22 1.47 0.52 0.15 -4.95 118.95 116.17 3jua s ARG 74 Ca 0.33 -0.54 -0.21 0.00 -0.52 0.00 0.00 55.73 54.78 3jua s ARG 74 Cb 0.13 -2.02 -0.04 0.00 0.52 0.00 0.00 34.95 33.55 3jua s ARG 74 CO -0.16 -1.98 1.87 1.63 0.02 0.00 0.00 175.30 176.68 3jua n LYS 75 N -3.40 2.15 -4.60 3.54 5.02 -1.26 -4.90 118.16 114.70 3jua n LYS 75 Ca 0.14 -2.74 -0.28 0.00 -2.02 0.00 0.00 58.31 53.41 3jua n LYS 75 Cb 0.60 -3.64 -0.09 0.00 -0.02 0.00 0.00 35.03 31.87 3jua n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3jua s LEU 76 N 8.59 2.37 0.17 -0.35 1.43 -1.26 -5.13 118.68 124.51 3jua s LEU 76 Ca 0.63 -1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.10 3jua s LEU 76 Cb 0.01 -0.58 -0.07 0.00 0.03 0.00 0.00 46.19 45.59 3jua s LEU 76 CO 0.12 -0.70 0.53 -2.16 0.23 0.00 0.00 176.35 174.36 3jua s PRO 77 N -3.80 3.87 0.57 1.29 0.04 -1.26 -4.93 135.00 130.77 3jua s PRO 77 Ca 0.25 0.34 0.29 0.00 0.04 0.00 0.00 61.00 61.92 3jua s PRO 77 Cb 0.06 -2.82 1.46 0.00 0.04 0.00 0.00 34.50 33.24 3jua s PRO 77 CO 0.12 0.42 1.89 -0.44 0.04 0.00 0.00 177.00 179.03 3jua h ASP 78 N 3.13 0.00 0.36 6.66 3.32 -2.00 0.26 116.42 128.15 3jua h ASP 78 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 3jua h ASP 78 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3jua h ASP 78 CO 0.67 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.65 3jua n SER 79 N -3.94 0.00 0.23 6.45 3.41 -1.26 -3.14 113.62 115.37 3jua n SER 79 Ca 0.12 -0.20 0.13 0.00 -0.26 0.00 0.00 58.87 58.66 3jua n SER 79 Cb 0.78 -0.23 0.28 0.00 -0.26 0.00 0.00 64.21 64.78 3jua n SER 79 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3jua h PHE 80 N 0.00 0.00 0.00 7.33 3.04 -0.85 -3.08 116.94 123.38 3jua h PHE 80 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 3jua h PHE 80 Cb 0.18 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.69 3jua h PHE 80 CO 0.00 0.03 0.00 1.19 -2.02 0.00 0.00 178.31 177.51 3jua n PHE 81 N -3.11 0.00 -4.01 0.41 3.72 -1.19 -4.90 117.46 108.39 3jua n PHE 81 Ca 0.03 -0.37 -0.31 0.00 -0.05 0.00 0.00 57.45 56.75 3jua n PHE 81 Cb 0.49 -0.04 -0.15 0.00 -0.94 0.00 0.00 39.48 38.84 3jua n PHE 81 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3jua s LYS 82 N -0.75 1.58 0.00 -1.08 1.02 -1.17 -5.17 119.74 114.17 3jua s LYS 82 Ca 0.00 -2.02 0.24 0.00 0.02 0.00 0.00 55.97 54.20 3jua s LYS 82 Cb 0.00 -3.23 1.40 0.00 -0.52 0.00 0.00 37.83 35.48 3jua s LYS 82 CO 0.00 -0.97 1.77 -0.35 -0.92 0.00 0.00 175.35 174.88