#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jy2 s TRP 36 N 0.00 1.96 0.75 1.61 0.52 -1.26 -4.99 118.94 117.53 1jy2 s TRP 36 Ca 0.00 1.68 -0.12 0.00 0.02 0.00 0.00 56.10 57.67 1jy2 s TRP 36 Cb 0.00 -3.23 0.05 0.00 -1.15 0.00 0.00 33.47 29.14 1jy2 s TRP 36 CO 0.00 -2.49 1.12 -1.25 0.02 0.00 0.00 176.95 174.35 1jy2 s PRO 37 N -4.74 2.25 0.28 4.98 0.04 -1.26 -4.96 135.00 131.58 1jy2 s PRO 37 Ca 0.65 1.37 -0.29 0.00 0.04 0.00 0.00 61.00 62.77 1jy2 s PRO 37 Cb -0.21 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 1jy2 s PRO 37 CO 0.57 -1.68 0.98 -0.06 0.04 0.00 0.00 177.00 176.86 1jy2 s PHE 38 N -2.56 3.79 0.74 0.56 0.40 -1.26 -5.02 117.98 114.63 1jy2 s PHE 38 Ca 0.66 1.83 -0.13 0.00 -0.60 0.00 0.00 56.93 58.68 1jy2 s PHE 38 Cb -0.21 -3.03 0.04 0.00 0.51 0.00 0.00 43.02 40.34 1jy2 s PHE 38 CO 0.50 0.14 1.14 0.00 0.70 0.00 0.00 175.22 177.70 1jy2 s SER 40 N -2.63 4.59 0.51 0.00 1.04 -1.26 -5.01 113.70 110.94 1jy2 s SER 40 Ca 0.68 -0.85 0.23 0.00 0.48 0.00 0.00 55.95 56.48 1jy2 s SER 40 Cb -0.22 -0.65 1.36 0.00 0.10 0.00 0.00 66.02 66.61 1jy2 s SER 40 CO 0.48 -0.35 2.09 0.44 0.98 0.00 0.00 173.24 176.88 1jy2 h ASP 41 N 1.54 0.00 0.92 7.02 3.32 -2.00 -1.88 116.42 125.33 1jy2 h ASP 41 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1jy2 h ASP 41 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1jy2 h ASP 41 CO 0.65 0.11 0.00 1.05 -1.72 0.00 0.00 179.24 179.33 1jy2 h GLU 42 N 0.00 0.00 0.00 3.56 4.11 -2.03 -3.04 114.58 117.17 1jy2 h GLU 42 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.33 1jy2 h GLU 42 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1jy2 h GLU 42 CO 0.01 0.00 -0.48 -0.44 0.07 0.00 0.00 179.01 178.17 1jy2 h ASP 43 N 0.00 0.00 -3.29 3.06 3.45 -1.73 -3.44 116.42 114.48 1jy2 h ASP 43 Ca 0.00 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.89 1jy2 h ASP 43 Cb 0.46 0.00 0.12 0.00 -0.56 0.00 0.00 39.33 39.34 1jy2 h ASP 43 CO 0.00 0.48 0.44 1.87 -1.57 0.00 0.00 179.24 180.46 1jy2 n TRP 44 N -3.54 2.05 0.00 4.55 -0.00 -1.15 -1.20 117.44 118.14 1jy2 n TRP 44 Ca -0.00 0.55 0.00 0.00 -0.00 0.00 0.00 57.50 58.05 1jy2 n TRP 44 Cb 0.59 -2.37 0.00 0.00 -0.00 0.00 0.00 31.31 29.52 1jy2 n TRP 44 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1jy2 n ASN 45 N 0.62 0.00 -0.05 5.87 3.02 -1.26 -4.65 115.26 118.81 1jy2 n ASN 45 Ca 0.06 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.47 1jy2 n ASN 45 Cb 0.37 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.40 1jy2 n ASN 45 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1jy2 n THR 46 N -1.47 1.59 -4.84 3.41 -1.04 -0.54 -4.88 114.28 106.51 1jy2 n THR 46 Ca 0.00 -0.74 -0.26 0.00 -2.04 0.00 0.00 64.05 61.01 1jy2 n THR 46 Cb 0.00 -1.16 -0.16 0.00 -1.82 0.00 0.00 70.33 67.19 1jy2 n THR 46 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1jy2 s LYS 47 N -2.55 1.81 0.14 -2.82 1.02 -0.34 -5.15 119.74 111.84 1jy2 s LYS 47 Ca -0.15 -0.61 0.01 0.00 0.02 0.00 0.00 55.97 55.23 1jy2 s LYS 47 Cb 0.07 -1.57 -0.04 0.00 -0.52 0.00 0.00 37.83 35.77 1jy2 s LYS 47 CO 0.78 0.24 -0.01 0.00 -0.92 0.00 0.00 175.35 175.44 1jy2 s PRO 49 N -3.92 1.35 0.34 0.00 0.02 -1.26 -4.98 135.00 126.55 1jy2 s PRO 49 Ca 0.20 1.02 -0.29 0.00 0.02 0.00 0.00 61.00 61.95 1jy2 s PRO 49 Cb 0.06 -1.80 -0.11 0.00 0.02 0.00 0.00 34.50 32.67 1jy2 s PRO 49 CO 0.00 -2.23 1.37 0.45 -0.33 0.00 0.00 177.00 176.26 1jy2 s SER 50 N -3.25 6.64 0.51 2.53 0.15 -1.26 -4.91 113.70 114.11 1jy2 s SER 50 Ca 0.64 2.80 0.21 0.00 0.70 0.00 0.00 55.95 60.30 1jy2 s SER 50 Cb -0.19 -2.65 1.36 0.00 -1.71 0.00 0.00 66.02 62.82 1jy2 s SER 50 CO 0.57 -0.64 2.11 1.23 1.20 0.00 0.00 173.24 177.71 1jy2 h GLY 51 N 3.32 0.00 1.61 9.45 0.00 -1.99 -1.04 103.07 114.42 1jy2 h GLY 51 Ca -0.49 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 46.65 1jy2 h GLY 51 CO 0.65 0.00 -0.73 0.00 0.00 0.00 0.00 176.54 176.47 1jy2 h ARG 53 N 0.26 0.63 -0.58 0.00 9.65 -1.78 -1.54 114.38 121.02 1jy2 h ARG 53 Ca -0.03 -0.23 -0.07 0.00 -1.10 0.00 0.00 59.98 58.54 1jy2 h ARG 53 Cb 1.30 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.81 1jy2 h ARG 53 CO 0.12 0.79 0.06 0.52 2.80 0.00 0.00 179.97 184.27 1jy2 h MET 54 N 0.42 0.95 -0.58 0.20 2.86 -1.09 -0.74 114.93 116.95 1jy2 h MET 54 Ca 0.09 -0.25 -0.05 0.00 -2.06 0.00 0.00 59.70 57.43 1jy2 h MET 54 Cb 0.55 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1jy2 h MET 54 CO 0.03 0.90 0.15 -0.22 1.06 0.00 0.00 176.91 178.83 1jy2 h LYS 55 N 0.89 0.89 -0.62 1.72 1.63 -1.14 0.12 116.57 120.06 1jy2 h LYS 55 Ca 0.18 -0.18 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 1jy2 h LYS 55 Cb 0.43 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.90 1jy2 h LYS 55 CO 0.01 0.78 0.23 0.78 -3.45 0.00 0.00 179.45 177.81 1jy2 h GLY 56 N 1.00 1.01 1.53 5.01 0.00 -0.42 -1.21 103.07 109.98 1jy2 h GLY 56 Ca 0.19 -0.56 -0.16 0.00 0.00 0.00 0.00 47.33 46.79 1jy2 h GLY 56 CO -0.00 0.53 -0.58 1.41 0.00 0.00 0.00 176.54 177.90 1jy2 h LEU 57 N 0.87 0.55 -0.45 3.11 3.38 -0.77 -1.55 115.31 120.46 1jy2 h LEU 57 Ca 0.20 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1jy2 h LEU 57 Cb 0.23 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1jy2 h LEU 57 CO -0.01 1.01 0.16 0.40 0.09 0.00 0.00 178.44 180.09 1jy2 h ILE 58 N 0.37 1.21 -0.66 1.22 2.04 -0.57 -1.57 117.51 119.55 1jy2 h ILE 58 Ca 0.00 -0.67 -0.08 0.00 1.00 0.00 0.00 64.86 65.10 1jy2 h ILE 58 Cb 1.11 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 37.98 1jy2 h ILE 58 CO 0.10 0.25 0.09 0.44 0.00 0.00 0.00 178.15 179.03 1jy2 h ASP 59 N 0.59 1.07 -0.73 1.72 3.45 -1.17 -1.05 116.42 120.30 1jy2 h ASP 59 Ca 0.15 -0.26 -0.01 0.00 0.43 0.00 0.00 57.03 57.33 1jy2 h ASP 59 Cb 0.22 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 1jy2 h ASP 59 CO -0.01 1.07 0.40 -0.08 -1.57 0.00 0.00 179.24 179.05 1jy2 h GLU 60 N 1.03 1.02 -0.55 3.56 4.81 -1.08 -0.01 114.58 123.36 1jy2 h GLU 60 Ca 0.20 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 1jy2 h GLU 60 Cb 0.46 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1jy2 h GLU 60 CO 0.02 0.76 -0.04 0.28 -0.73 0.00 0.00 179.01 179.29 1jy2 h VAL 61 N 1.01 1.27 -0.72 0.32 2.07 -1.04 -1.75 116.25 117.40 1jy2 h VAL 61 Ca 0.26 -1.18 -0.04 0.00 0.82 0.00 0.00 66.70 66.56 1jy2 h VAL 61 Cb 0.04 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1jy2 h VAL 61 CO -0.04 0.42 0.30 -0.78 0.02 0.00 0.00 177.57 177.49 1jy2 h ASP 62 N 0.89 0.99 -0.66 0.57 1.82 -0.73 -0.79 116.42 118.50 1jy2 h ASP 62 Ca 0.15 -0.17 -0.08 0.00 -0.39 0.00 0.00 57.03 56.55 1jy2 h ASP 62 Cb 0.60 -0.26 -0.03 0.00 0.68 0.00 0.00 39.33 40.33 1jy2 h ASP 62 CO 0.04 0.88 0.11 -0.61 -1.61 0.00 0.00 179.24 178.05 1jy2 h GLN 63 N 1.03 1.09 -0.42 0.28 5.75 -0.88 -0.18 115.11 121.79 1jy2 h GLN 63 Ca 0.24 -0.29 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 1jy2 h GLN 63 Cb 0.20 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 1jy2 h GLN 63 CO -0.02 1.00 0.13 0.22 -2.65 0.00 0.00 178.83 177.51 1jy2 h ASP 64 N 1.01 0.61 -0.33 -0.69 1.82 -0.94 -0.81 116.42 117.08 1jy2 h ASP 64 Ca 0.20 -0.21 -0.17 0.00 -0.39 0.00 0.00 57.03 56.46 1jy2 h ASP 64 Cb 0.44 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 40.29 1jy2 h ASP 64 CO 0.01 0.65 -0.46 -0.26 -1.61 0.00 0.00 179.24 177.58 1jy2 h PHE 65 N 0.53 1.10 -0.51 0.28 0.04 -0.97 -1.07 116.94 116.34 1jy2 h PHE 65 Ca 0.14 -0.36 -0.08 0.00 2.80 0.00 0.00 57.97 60.47 1jy2 h PHE 65 Cb 0.26 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 1jy2 h PHE 65 CO 0.01 1.19 0.02 1.79 -0.60 0.00 0.00 178.31 180.72 1jy2 h THR 66 N 0.70 1.26 -0.72 -1.55 1.35 -0.97 -0.27 112.91 112.71 1jy2 h THR 66 Ca 0.04 -1.05 -0.05 0.00 -0.55 0.00 0.00 66.41 64.80 1jy2 h THR 66 Cb 1.06 0.92 -0.03 0.00 -1.73 0.00 0.00 68.15 68.37 1jy2 h THR 66 CO 0.11 0.37 0.25 -1.28 -0.25 0.00 0.00 175.52 174.72 1jy2 h SER 67 N 0.76 1.02 -0.06 5.36 0.87 -1.05 -0.78 113.55 119.67 1jy2 h SER 67 Ca 0.15 -0.19 -0.13 0.00 -1.23 0.00 0.00 61.79 60.39 1jy2 h SER 67 Cb 0.49 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 1jy2 h SER 67 CO 0.02 0.94 -0.37 0.03 -0.53 0.00 0.00 176.83 176.92 1jy2 h ARG 68 N 1.04 0.56 -0.44 2.24 3.08 -0.97 -1.67 114.38 118.23 1jy2 h ARG 68 Ca 0.23 -0.27 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 1jy2 h ARG 68 Cb 0.26 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1jy2 h ARG 68 CO -0.01 0.85 0.07 0.82 -1.07 0.00 0.00 179.97 180.62 1jy2 h ILE 69 N 0.47 1.25 -0.32 2.04 2.04 -0.81 -1.79 117.51 120.39 1jy2 h ILE 69 Ca 0.05 -0.90 -0.07 0.00 1.00 0.00 0.00 64.86 64.94 1jy2 h ILE 69 Cb 0.86 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 1jy2 h ILE 69 CO 0.07 0.31 -0.10 0.78 0.00 0.00 0.00 178.15 179.22 1jy2 h ASN 70 N 0.59 0.51 -0.57 1.72 2.35 -0.89 -0.63 115.58 118.65 1jy2 h ASN 70 Ca 0.13 -0.13 -0.10 0.00 -0.55 0.00 0.00 56.30 55.66 1jy2 h ASN 70 Cb 0.38 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 1jy2 h ASN 70 CO 0.01 0.65 -0.02 0.11 -1.65 0.00 0.00 177.43 176.53 1jy2 h LYS 71 N 0.50 1.04 -0.49 0.81 1.57 -1.07 -0.90 116.57 118.02 1jy2 h LYS 71 Ca 0.09 -0.34 -0.05 0.00 -1.87 0.00 0.00 60.65 58.48 1jy2 h LYS 71 Cb 0.47 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1jy2 h LYS 71 CO 0.03 1.03 0.10 -0.07 -0.57 0.00 0.00 179.45 179.96 1jy2 h LEU 72 N 0.95 0.77 -0.52 2.94 3.38 -0.90 -2.20 115.31 119.72 1jy2 h LEU 72 Ca 0.16 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1jy2 h LEU 72 Cb 0.58 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1jy2 h LEU 72 CO 0.03 0.82 0.31 0.03 0.09 0.00 0.00 178.44 179.72 1jy2 h ARG 73 N 0.68 0.71 -1.00 1.13 3.08 -0.98 -0.39 114.38 117.62 1jy2 h ARG 73 Ca 0.15 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.18 1jy2 h ARG 73 Cb 0.37 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 1jy2 h ARG 73 CO 0.01 0.52 0.65 -0.44 -1.07 0.00 0.00 179.97 179.63 1jy2 h ASP 74 N 0.69 1.06 0.00 7.04 3.45 -1.00 0.03 116.42 127.70 1jy2 h ASP 74 Ca 0.19 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.64 1jy2 h ASP 74 Cb -0.00 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 38.54 1jy2 h ASP 74 CO -0.03 0.70 -0.00 0.28 -1.57 0.00 0.00 179.24 178.62 1jy2 h SER 75 N 1.22 -0.00 -0.08 6.45 0.02 -1.01 -3.34 113.55 116.81 1jy2 h SER 75 Ca 0.41 -0.66 -0.10 0.00 -0.84 0.00 0.00 61.79 60.60 1jy2 h SER 75 Cb 0.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1jy2 h SER 75 CO -0.15 0.66 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.87 1jy2 h LEU 76 N -0.67 0.53 0.00 5.07 3.38 -0.96 -3.52 115.31 119.14 1jy2 h LEU 76 Ca -0.00 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1jy2 h LEU 76 Cb 0.67 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1jy2 h LEU 76 CO 0.00 0.78 0.00 2.22 0.09 0.00 0.00 178.44 181.53