#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 5.30 -0.58 1.61 0.01 -1.26 -5.04 113.70 113.74 2vy4 s SER 52 Ca 0.00 -0.17 -0.27 0.00 1.31 0.00 0.00 55.95 56.82 2vy4 s SER 52 Cb 0.00 -1.33 -0.02 0.00 0.21 0.00 0.00 66.02 64.88 2vy4 s SER 52 CO 0.00 0.10 1.89 -1.81 0.41 0.00 0.00 173.24 173.84 2vy4 s ASP 53 N -2.85 5.27 0.28 2.44 1.11 -1.26 -4.96 116.67 116.70 2vy4 s ASP 53 Ca 0.29 0.48 -0.29 0.00 0.18 0.00 0.00 52.55 53.22 2vy4 s ASP 53 Cb -0.10 -2.53 -0.09 0.00 1.07 0.00 0.00 42.92 41.27 2vy4 s ASP 53 CO 0.21 -2.35 1.01 -1.61 1.18 0.00 0.00 175.17 173.61 2vy4 s GLU 54 N 7.00 4.67 -0.06 8.23 0.41 -1.26 -5.05 118.70 132.63 2vy4 s GLU 54 Ca 0.70 1.59 0.05 0.00 -0.41 0.00 0.00 54.97 56.91 2vy4 s GLU 54 Cb -0.14 -3.11 -0.01 0.00 -1.78 0.00 0.00 34.13 29.09 2vy4 s GLU 54 CO 0.22 0.30 -0.23 0.08 -0.49 0.00 0.00 175.26 175.15 2vy4 s VAL 55 N -1.28 2.23 0.24 2.63 1.01 -1.26 -3.76 120.40 120.22 2vy4 s VAL 55 Ca 0.45 -1.00 0.10 0.00 0.00 0.00 0.00 61.98 61.53 2vy4 s VAL 55 Cb -0.27 -1.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 2vy4 s VAL 55 CO 0.34 0.57 -0.18 0.54 0.00 0.00 0.00 175.10 176.37 2vy4 s VAL 56 N -0.15 2.18 -0.14 2.92 0.11 0.78 -4.88 120.40 121.22 2vy4 s VAL 56 Ca -0.04 -2.30 -0.04 0.00 -2.93 0.00 0.00 61.98 56.67 2vy4 s VAL 56 Cb -0.14 -2.18 -0.03 0.00 -1.53 0.00 0.00 36.38 32.50 2vy4 s VAL 56 CO 0.04 -0.46 0.02 -0.63 -3.33 0.00 0.00 175.10 170.74 2vy4 s ILE 57 N -2.62 4.39 0.28 7.04 1.09 -1.26 -1.81 121.20 128.32 2vy4 s ILE 57 Ca 0.26 -0.19 -0.19 0.00 -1.10 0.00 0.00 60.65 59.43 2vy4 s ILE 57 Cb -0.04 -2.92 -0.09 0.00 -1.06 0.00 0.00 42.46 38.36 2vy4 s ILE 57 CO 0.11 0.52 0.78 0.00 -0.10 0.00 0.00 174.94 176.26 2vy4 n PRO 59 N 0.28 1.59 -0.06 0.00 -0.04 -1.26 -1.16 135.00 134.35 2vy4 n PRO 59 Ca 0.01 -0.61 -0.05 0.00 -0.04 0.00 0.00 63.50 62.80 2vy4 n PRO 59 Cb 0.52 -1.38 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 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 0.04 0.00 0.00 0.54 4.01 -1.26 -4.77 117.16 115.72 2vy4 n TYR 60 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2vy4 n TYR 60 Cb 0.29 -0.68 0.00 0.00 -0.31 0.00 0.00 39.34 38.63 2vy4 n TYR 60 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2vy4 n ASP 61 N -2.48 3.71 0.00 7.72 8.00 -1.22 -5.01 116.55 127.26 2vy4 n ASP 61 Ca -0.21 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.29 2vy4 n ASP 61 Cb 0.91 0.12 0.00 0.00 -0.02 0.00 0.00 41.12 42.13 2vy4 n ASP 61 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2vy4 n SER 62 N -2.21 0.00 -2.25 -2.24 2.88 -0.31 -4.66 113.62 104.83 2vy4 n SER 62 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 2vy4 n SER 62 Cb 0.43 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.95 2vy4 n SER 62 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2vy4 n ASN 63 N 2.64 7.22 -4.26 -3.46 5.15 -1.26 -4.64 115.26 116.65 2vy4 n ASN 63 Ca 0.00 -3.52 -0.33 0.00 -0.60 0.00 0.00 54.58 50.13 2vy4 n ASN 63 Cb 0.00 -1.03 -0.16 0.00 -0.53 0.00 0.00 39.78 38.06 2vy4 n ASN 63 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2vy4 s HIS 64 N -3.06 2.73 -0.30 1.20 2.46 -1.26 -5.08 115.29 111.97 2vy4 s HIS 64 Ca 0.52 -1.01 -0.03 0.00 0.47 0.00 0.00 55.06 55.02 2vy4 s HIS 64 Cb 0.41 -1.84 0.04 0.00 -0.13 0.00 0.00 32.58 31.07 2vy4 s HIS 64 CO -0.06 -0.43 0.02 -1.01 -2.47 0.00 0.00 174.74 170.79 2vy4 s HIS 65 N 0.63 3.23 0.03 3.88 3.76 -1.26 -3.51 115.29 122.06 2vy4 s HIS 65 Ca -0.09 -1.69 -0.02 0.00 -0.15 0.00 0.00 55.06 53.11 2vy4 s HIS 65 Cb -0.16 -2.15 -0.02 0.00 1.11 0.00 0.00 32.58 31.36 2vy4 s HIS 65 CO 0.03 -0.77 0.01 0.00 -0.85 0.00 0.00 174.74 173.16 2vy4 s MET 66 N 1.31 0.49 0.31 1.40 0.23 -0.75 -4.92 119.30 117.38 2vy4 s MET 66 Ca -0.03 -0.83 -0.29 0.00 -1.03 0.00 0.00 55.69 53.50 2vy4 s MET 66 Cb -0.19 0.18 -0.12 0.00 -1.53 0.00 0.00 34.83 33.17 2vy4 s MET 66 CO -0.00 -0.10 1.42 -2.30 -2.03 0.00 0.00 175.02 172.01 2vy4 n PRO 67 N 0.88 2.32 0.06 3.16 -0.02 -1.26 -0.15 135.00 140.00 2vy4 n PRO 67 Ca -0.19 0.82 0.21 0.00 -2.02 0.00 0.00 63.50 62.32 2vy4 n PRO 67 Cb 0.58 -2.49 0.72 0.00 -0.02 0.00 0.00 33.50 32.29 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 3.54 0.00 -0.74 -0.52 1.63 -1.90 0.79 116.57 119.36 2vy4 h LYS 68 Ca -0.47 0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.04 2vy4 h LYS 68 Cb 1.26 0.00 -0.18 0.00 -0.60 0.00 0.00 32.23 32.71 2vy4 h LYS 68 CO 0.70 0.00 0.33 0.45 -3.45 0.00 0.00 179.45 177.48 2vy4 n SER 69 N -3.68 4.12 -0.12 4.20 2.88 -1.26 -4.15 113.62 115.61 2vy4 n SER 69 Ca 0.09 -3.41 0.00 0.00 -1.33 0.00 0.00 58.87 54.22 2vy4 n SER 69 Cb 0.69 -0.75 0.01 0.00 -0.75 0.00 0.00 64.21 63.41 2vy4 n SER 69 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2vy4 n SER 70 N -0.63 0.33 -0.15 -3.46 7.64 0.27 -4.86 113.62 112.77 2vy4 n SER 70 Ca 0.45 -1.44 -0.05 0.00 1.01 0.00 0.00 58.87 58.84 2vy4 n SER 70 Cb 1.41 -0.07 0.04 0.00 -1.01 0.00 0.00 64.21 64.58 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 0.28 -0.49 -3.43 -0.00 -1.70 -0.19 115.31 109.79 2vy4 h LEU 71 Ca 0.00 0.03 0.07 0.00 -0.00 0.00 0.00 57.88 57.99 2vy4 h LEU 71 Cb 1.04 -0.01 -0.06 0.00 -0.00 0.00 0.00 40.66 41.62 2vy4 h LEU 71 CO 0.00 0.20 0.15 0.00 -0.00 0.00 0.00 178.44 178.79 2vy4 h ALA 72 N 1.27 0.58 -0.02 1.53 0.00 -1.92 0.38 119.26 121.08 2vy4 h ALA 72 Ca 0.21 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2vy4 h ALA 72 Cb 0.15 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2vy4 h ALA 72 CO -0.17 -0.26 -0.08 -0.22 0.00 0.00 0.00 179.25 178.52 2vy4 h LYS 73 N 0.30 0.03 -0.02 0.00 3.64 -1.72 -1.96 116.57 116.84 2vy4 h LYS 73 Ca 0.24 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2vy4 h LYS 73 Cb 0.28 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2vy4 h LYS 73 CO -0.27 0.12 -0.12 1.12 -2.27 0.00 0.00 179.45 178.02 2vy4 h HIS 74 N 0.03 0.17 -1.00 1.91 2.07 0.12 -3.25 115.15 115.20 2vy4 h HIS 74 Ca 0.01 -0.07 0.10 0.00 -2.85 0.00 0.00 60.37 57.56 2vy4 h HIS 74 Cb 0.17 -0.03 -0.08 0.00 2.57 0.00 0.00 27.41 30.05 2vy4 h HIS 74 CO 0.00 0.78 0.64 0.52 -3.07 0.00 0.00 177.93 176.80 2vy4 h MET 75 N -0.49 1.01 -0.36 5.12 2.86 -0.04 1.53 114.93 124.56 2vy4 h MET 75 Ca -0.01 -0.06 0.10 0.00 -2.06 0.00 0.00 59.70 57.67 2vy4 h MET 75 Cb 0.80 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2vy4 h MET 75 CO 0.03 0.67 0.49 0.00 1.06 0.00 0.00 176.91 179.15 2vy4 h ALA 76 N 1.52 2.01 0.00 6.32 0.00 -1.40 0.39 119.26 128.10 2vy4 h ALA 76 Ca 0.48 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.27 2vy4 h ALA 76 Cb 0.40 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2vy4 h ALA 76 CO -0.24 -0.67 -1.31 0.45 0.00 0.00 0.00 179.25 177.48 2vy4 n SER 77 N -3.48 0.51 0.01 0.00 2.88 0.38 -4.15 113.62 109.78 2vy4 n SER 77 Ca 0.06 0.09 -0.13 0.00 -1.33 0.00 0.00 58.87 57.56 2vy4 n SER 77 Cb 0.64 -0.21 -0.09 0.00 -0.75 0.00 0.00 64.21 63.81 2vy4 n SER 77 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2vy4 h ARG 79 N -0.32 0.72 -0.11 0.00 2.43 -0.50 -1.04 114.38 115.56 2vy4 h ARG 79 Ca -0.00 -0.60 -0.06 0.00 -0.81 0.00 0.00 59.98 58.51 2vy4 h ARG 79 Cb 0.31 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 2vy4 h ARG 79 CO 0.00 1.21 -0.21 1.25 -1.51 0.00 0.00 179.97 180.71 2vy4 h LEU 80 N 0.49 0.18 0.10 3.80 5.85 -0.71 0.39 115.31 125.41 2vy4 h LEU 80 Ca -0.05 -0.05 -0.29 0.00 0.84 0.00 0.00 57.88 58.33 2vy4 h LEU 80 Cb 1.41 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 2vy4 h LEU 80 CO 0.16 0.41 -1.45 0.03 -0.34 0.00 0.00 178.44 177.25 2vy4 h ARG 81 N 0.17 0.21 0.00 1.25 3.08 -1.03 -3.41 114.38 114.64 2vy4 h ARG 81 Ca 0.03 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2vy4 h ARG 81 Cb 0.48 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2vy4 h ARG 81 CO 0.03 1.07 0.00 1.63 -1.07 0.00 0.00 179.97 181.63 2vy4 n LYS 82 N -3.42 0.00 -2.12 0.04 4.01 -0.40 -4.96 118.16 111.31 2vy4 n LYS 82 Ca -0.14 0.34 -0.29 0.00 -0.51 0.00 0.00 58.31 57.71 2vy4 n LYS 82 Cb 1.03 -0.83 0.02 0.00 -0.51 0.00 0.00 35.03 34.74 2vy4 n LYS 82 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 2vy4 s MET 83 N -0.89 3.29 0.12 1.97 -1.94 0.14 -4.94 119.30 117.05 2vy4 s MET 83 Ca 0.00 0.44 0.00 0.00 -1.71 0.00 0.00 55.69 54.42 2vy4 s MET 83 Cb 0.00 -2.16 0.00 0.00 2.01 0.00 0.00 34.83 34.68 2vy4 s MET 83 CO 0.00 -0.63 0.00 0.41 -0.01 0.00 0.00 175.02 174.79 2vy4 n GLY 84 N -2.69 -2.89 0.11 -0.03 0.00 -1.26 -4.25 105.19 94.18 2vy4 n GLY 84 Ca 0.05 -1.30 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2vy4 n GLY 84 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2vy4 n TYR 85 N -2.12 0.00 -3.16 1.61 9.36 -1.26 -4.93 117.16 116.66 2vy4 n TYR 85 Ca -0.01 0.00 -0.39 0.00 3.32 0.00 0.00 57.90 60.82 2vy4 n TYR 85 Cb 0.11 -0.97 -0.06 0.00 -0.63 0.00 0.00 39.34 37.79 2vy4 n TYR 85 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2vy4 s THR 86 N -2.49 4.59 0.00 2.97 2.01 -1.26 -5.14 115.64 116.33 2vy4 s THR 86 Ca -0.20 1.38 0.00 0.00 0.31 0.00 0.00 61.69 63.19 2vy4 s THR 86 Cb 0.07 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.60 2vy4 s THR 86 CO 0.72 0.50 0.00 2.29 -0.69 0.00 0.00 174.62 177.44