#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vy4 s SER 52 N 0.00 4.11 0.10 1.61 0.15 -1.26 -5.11 113.70 113.30 2vy4 s SER 52 Ca 0.00 -1.61 -0.26 0.00 0.70 0.00 0.00 55.95 54.78 2vy4 s SER 52 Cb 0.00 -1.13 -0.06 0.00 -1.71 0.00 0.00 66.02 63.12 2vy4 s SER 52 CO 0.00 -0.35 0.82 -1.81 1.20 0.00 0.00 173.24 173.09 2vy4 s ASP 53 N 1.39 7.34 0.81 5.45 -0.00 -1.26 -5.04 116.67 125.37 2vy4 s ASP 53 Ca 0.05 1.60 -0.13 0.00 -0.00 0.00 0.00 52.55 54.08 2vy4 s ASP 53 Cb -0.18 -2.51 0.09 0.00 -0.00 0.00 0.00 42.92 40.32 2vy4 s ASP 53 CO -0.15 0.06 1.17 -1.61 -0.00 0.00 0.00 175.17 174.64 2vy4 s GLU 54 N -0.38 1.67 -0.02 8.23 2.02 -1.26 -4.97 118.70 123.99 2vy4 s GLU 54 Ca 0.40 1.63 0.02 0.00 0.02 0.00 0.00 54.97 57.04 2vy4 s GLU 54 Cb -0.22 -1.79 0.00 0.00 0.10 0.00 0.00 34.13 32.22 2vy4 s GLU 54 CO 0.26 -2.16 -0.08 0.08 0.02 0.00 0.00 175.26 173.37 2vy4 s VAL 55 N -2.33 0.69 0.24 2.63 1.01 -1.26 -3.65 120.40 117.72 2vy4 s VAL 55 Ca 0.70 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 62.41 2vy4 s VAL 55 Cb -0.26 -0.60 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 2vy4 s VAL 55 CO 0.52 0.21 -0.07 0.68 0.00 0.00 0.00 175.10 176.43 2vy4 s VAL 56 N 0.07 1.50 -0.18 2.92 -7.23 0.17 -4.89 120.40 112.76 2vy4 s VAL 56 Ca -0.01 -2.12 -0.03 0.00 -1.81 0.00 0.00 61.98 58.01 2vy4 s VAL 56 Cb -0.06 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.58 2vy4 s VAL 56 CO 0.00 -0.42 -0.05 -0.63 -0.31 0.00 0.00 175.10 173.69 2vy4 s ILE 57 N -3.11 3.59 0.06 -0.62 1.01 -1.25 -1.82 121.20 119.05 2vy4 s ILE 57 Ca 0.26 -0.45 -0.30 0.00 0.00 0.00 0.00 60.65 60.16 2vy4 s ILE 57 Cb 0.03 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 2vy4 s ILE 57 CO 0.09 0.46 1.08 0.00 0.00 0.00 0.00 174.94 176.57 2vy4 n PRO 59 N 3.59 0.68 0.05 0.00 -0.04 -1.26 -3.00 135.00 135.01 2vy4 n PRO 59 Ca 0.06 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.61 2vy4 n PRO 59 Cb 0.48 -1.35 0.37 0.00 -0.04 0.00 0.00 33.50 32.97 2vy4 n PRO 59 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2vy4 n TYR 60 N -0.85 0.28 -1.83 0.54 0.53 -1.26 -4.95 117.16 109.62 2vy4 n TYR 60 Ca 0.11 0.11 -0.01 0.00 -1.02 0.00 0.00 57.90 57.09 2vy4 n TYR 60 Cb 0.05 -0.68 -0.01 0.00 -1.03 0.00 0.00 39.34 37.68 2vy4 n TYR 60 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 2vy4 n ASP 61 N -1.76 -2.48 0.00 7.72 4.64 -1.16 -5.00 116.55 118.51 2vy4 n ASP 61 Ca 0.03 0.41 0.00 0.00 -1.38 0.00 0.00 54.79 53.85 2vy4 n ASP 61 Cb 0.19 -2.26 0.00 0.00 -1.04 0.00 0.00 41.12 38.02 2vy4 n ASP 61 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2vy4 n SER 62 N 0.37 0.00 -3.45 1.67 7.64 -1.26 -5.03 113.62 113.56 2vy4 n SER 62 Ca -0.07 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.63 2vy4 n SER 62 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2vy4 n SER 62 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2vy4 n ASN 63 N 0.00 -3.46 -4.34 6.43 5.03 -1.26 -4.92 115.26 112.73 2vy4 n ASN 63 Ca 0.00 -0.72 -0.32 0.00 0.87 0.00 0.00 54.58 54.41 2vy4 n ASN 63 Cb 0.00 -1.15 -0.15 0.00 -1.02 0.00 0.00 39.78 37.46 2vy4 n ASN 63 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 2vy4 s HIS 64 N -2.71 2.67 -0.25 3.10 3.76 -1.26 -5.07 115.29 115.53 2vy4 s HIS 64 Ca 0.00 -0.64 0.02 0.00 -0.15 0.00 0.00 55.06 54.29 2vy4 s HIS 64 Cb -0.00 -1.73 0.06 0.00 1.11 0.00 0.00 32.58 32.02 2vy4 s HIS 64 CO 0.65 -0.17 -0.09 -1.01 -0.85 0.00 0.00 174.74 173.27 2vy4 s HIS 65 N 0.03 2.93 0.05 1.40 3.76 -1.25 -3.41 115.29 118.79 2vy4 s HIS 65 Ca -0.07 -2.11 -0.04 0.00 -0.15 0.00 0.00 55.06 52.70 2vy4 s HIS 65 Cb -0.15 -1.80 -0.02 0.00 1.11 0.00 0.00 32.58 31.72 2vy4 s HIS 65 CO 0.05 -0.84 0.05 0.00 -0.85 0.00 0.00 174.74 173.15 2vy4 s MET 66 N 1.22 0.61 0.58 1.40 0.23 -0.75 -4.86 119.30 117.72 2vy4 s MET 66 Ca -0.08 -0.94 -0.20 0.00 -1.03 0.00 0.00 55.69 53.44 2vy4 s MET 66 Cb -0.20 0.23 -0.03 0.00 -1.53 0.00 0.00 34.83 33.30 2vy4 s MET 66 CO -0.05 -0.14 1.35 -2.30 -2.03 0.00 0.00 175.02 171.84 2vy4 n PRO 67 N 0.48 1.50 0.19 3.16 -0.02 -1.24 0.42 135.00 139.49 2vy4 n PRO 67 Ca -0.17 0.56 0.17 0.00 -2.02 0.00 0.00 63.50 62.05 2vy4 n PRO 67 Cb 0.60 -2.57 0.72 0.00 -0.02 0.00 0.00 33.50 32.22 2vy4 n PRO 67 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2vy4 h LYS 68 N 1.12 0.00 -0.89 -0.52 3.64 -1.90 0.50 116.57 118.52 2vy4 h LYS 68 Ca -0.51 0.00 -0.42 0.00 -1.27 0.00 0.00 60.65 58.45 2vy4 h LYS 68 Cb 1.32 0.00 -0.25 0.00 -0.41 0.00 0.00 32.23 32.88 2vy4 h LYS 68 CO 0.56 0.00 0.51 0.43 -2.27 0.00 0.00 179.45 178.68 2vy4 n SER 69 N -3.27 3.91 0.00 4.20 7.64 -1.26 -4.10 113.62 120.74 2vy4 n SER 69 Ca 0.04 -3.53 0.00 0.00 1.01 0.00 0.00 58.87 56.39 2vy4 n SER 69 Cb 0.59 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2vy4 n SER 69 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2vy4 n SER 70 N -0.92 0.10 -0.05 6.43 7.64 0.18 -4.87 113.62 122.14 2vy4 n SER 70 Ca 0.53 -1.05 -0.10 0.00 1.01 0.00 0.00 58.87 59.27 2vy4 n SER 70 Cb 1.56 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 64.73 2vy4 n SER 70 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2vy4 h LEU 71 N 0.00 0.23 -0.51 -3.43 -0.00 -1.70 0.20 115.31 110.10 2vy4 h LEU 71 Ca 0.00 -0.00 0.08 0.00 -0.00 0.00 0.00 57.88 57.95 2vy4 h LEU 71 Cb 0.91 -0.06 -0.06 0.00 -0.00 0.00 0.00 40.66 41.46 2vy4 h LEU 71 CO 0.00 0.17 0.16 0.00 -0.00 0.00 0.00 178.44 178.77 2vy4 h ALA 72 N 1.08 0.62 -0.02 1.53 0.00 -1.90 0.46 119.26 121.02 2vy4 h ALA 72 Ca 0.08 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2vy4 h ALA 72 Cb -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2vy4 h ALA 72 CO -0.02 -0.24 -0.01 -0.22 0.00 0.00 0.00 179.25 178.77 2vy4 h LYS 73 N 0.33 0.03 -0.06 0.00 1.63 -1.79 -1.89 116.57 114.82 2vy4 h LYS 73 Ca 0.25 -0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.03 2vy4 h LYS 73 Cb 0.29 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.91 2vy4 h LYS 73 CO -0.27 0.04 -0.04 1.25 -3.45 0.00 0.00 179.45 176.98 2vy4 h HIS 74 N 0.03 0.16 -0.85 1.91 -0.00 0.19 -3.13 115.15 113.45 2vy4 h HIS 74 Ca 0.01 -0.04 0.09 0.00 -0.00 0.00 0.00 60.37 60.43 2vy4 h HIS 74 Cb 0.03 -0.04 -0.07 0.00 -0.00 0.00 0.00 27.41 27.34 2vy4 h HIS 74 CO 0.00 0.53 0.50 0.52 -0.00 0.00 0.00 177.93 179.48 2vy4 h MET 75 N -0.26 0.82 -0.40 5.26 2.86 -0.12 1.64 114.93 124.73 2vy4 h MET 75 Ca 0.01 -0.05 0.12 0.00 -2.06 0.00 0.00 59.70 57.72 2vy4 h MET 75 Cb 0.50 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 2vy4 h MET 75 CO 0.01 0.54 0.52 0.00 1.06 0.00 0.00 176.91 179.05 2vy4 h ALA 76 N 1.45 2.08 0.00 6.32 0.00 -1.32 0.39 119.26 128.18 2vy4 h ALA 76 Ca 0.40 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.17 2vy4 h ALA 76 Cb 0.34 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2vy4 h ALA 76 CO -0.24 -0.73 -1.32 0.43 0.00 0.00 0.00 179.25 177.39 2vy4 n SER 77 N -3.50 0.72 0.05 0.00 7.64 0.24 -4.17 113.62 114.59 2vy4 n SER 77 Ca 0.07 0.12 -0.13 0.00 1.01 0.00 0.00 58.87 59.94 2vy4 n SER 77 Cb 0.69 -0.28 -0.09 0.00 -1.01 0.00 0.00 64.21 63.52 2vy4 n SER 77 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vy4 h ARG 79 N -0.40 0.07 -0.16 0.00 2.43 -0.41 0.11 114.38 116.02 2vy4 h ARG 79 Ca -0.01 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 58.98 2vy4 h ARG 79 Cb 0.35 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2vy4 h ARG 79 CO 0.02 0.60 -0.47 1.25 -1.51 0.00 0.00 179.97 179.86 2vy4 h LEU 80 N 0.06 0.42 0.06 3.80 5.85 -0.99 -1.60 115.31 122.90 2vy4 h LEU 80 Ca -0.00 -0.20 -0.27 0.00 0.84 0.00 0.00 57.88 58.25 2vy4 h LEU 80 Cb 0.99 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 2vy4 h LEU 80 CO 0.08 0.83 -1.38 0.03 -0.34 0.00 0.00 178.44 177.66 2vy4 h ARG 81 N 0.32 0.12 -0.29 1.25 2.47 -0.97 -3.01 114.38 114.27 2vy4 h ARG 81 Ca 0.02 -0.20 -0.08 0.00 -1.26 0.00 0.00 59.98 58.46 2vy4 h ARG 81 Cb 0.94 0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 29.33 2vy4 h ARG 81 CO 0.08 0.95 -0.12 -0.22 0.56 0.00 0.00 179.97 181.23 2vy4 h LYS 82 N 0.03 0.60 -0.97 0.04 3.11 -0.91 -3.02 116.57 115.44 2vy4 h LYS 82 Ca -0.17 -0.25 -0.45 0.00 -2.81 0.00 0.00 60.65 56.98 2vy4 h LYS 82 Cb 1.93 -0.02 -0.27 0.00 -1.00 0.00 0.00 32.23 32.87 2vy4 h LYS 82 CO 0.14 0.82 0.57 -0.12 -2.81 0.00 0.00 179.45 178.04 2vy4 n MET 83 N -4.44 2.31 -3.47 1.90 1.56 -0.61 -4.73 117.12 109.65 2vy4 n MET 83 Ca -0.03 -2.77 -0.35 0.00 -0.27 0.00 0.00 57.70 54.28 2vy4 n MET 83 Cb 0.35 -2.09 -0.05 0.00 2.15 0.00 0.00 33.22 33.58 2vy4 n MET 83 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2vy4 n GLY 84 N -0.91 4.49 1.36 -5.12 0.00 -1.14 -4.99 105.19 98.90 2vy4 n GLY 84 Ca 0.53 -2.65 0.13 0.00 0.00 0.00 0.00 46.02 44.03 2vy4 n GLY 84 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vy4 n TYR 85 N 1.76 -3.68 -0.04 1.61 4.02 -1.26 -4.96 117.16 114.61 2vy4 n TYR 85 Ca 0.25 2.03 -0.05 0.00 -0.01 0.00 0.00 57.90 60.12 2vy4 n TYR 85 Cb 0.37 -3.31 -0.02 0.00 -0.02 0.00 0.00 39.34 36.36 2vy4 n TYR 85 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 2vy4 n THR 86 N -3.90 1.03 -0.74 -0.72 -1.04 -1.26 -4.99 114.28 102.66 2vy4 n THR 86 Ca -0.07 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 2vy4 n THR 86 Cb 0.61 -1.91 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 2vy4 n THR 86 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72