#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vy4 n SER 52 N 0.00 0.00 -4.42 1.61 2.88 -1.26 -4.66 113.62 107.77 2vy4 n SER 52 Ca 0.00 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.10 2vy4 n SER 52 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2vy4 n SER 52 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2vy4 s ASP 53 N 0.00 6.29 0.21 -3.46 1.01 -1.26 -5.02 116.67 114.44 2vy4 s ASP 53 Ca 0.00 -1.41 0.07 0.00 0.71 0.00 0.00 52.55 51.92 2vy4 s ASP 53 Cb 0.00 -2.37 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 2vy4 s ASP 53 CO 0.00 -1.23 0.06 -0.70 0.21 0.00 0.00 175.17 173.50 2vy4 s GLU 54 N 3.22 2.55 -0.05 8.23 2.12 -1.26 -5.13 118.70 128.38 2vy4 s GLU 54 Ca 0.21 -1.14 0.04 0.00 0.36 0.00 0.00 54.97 54.44 2vy4 s GLU 54 Cb -0.16 -2.39 -0.00 0.00 0.26 0.00 0.00 34.13 31.83 2vy4 s GLU 54 CO 0.04 0.43 -0.17 0.14 -0.54 0.00 0.00 175.26 175.15 2vy4 s VAL 55 N -1.95 1.47 0.18 3.70 -7.23 -1.26 -3.84 120.40 111.48 2vy4 s VAL 55 Ca 0.30 -0.73 0.06 0.00 -1.81 0.00 0.00 61.98 59.80 2vy4 s VAL 55 Cb -0.08 -1.27 -0.05 0.00 0.56 0.00 0.00 36.38 35.54 2vy4 s VAL 55 CO 0.21 0.42 -0.12 0.54 -0.31 0.00 0.00 175.10 175.85 2vy4 s VAL 56 N 0.11 1.46 -0.11 1.32 0.11 0.12 -4.86 120.40 118.55 2vy4 s VAL 56 Ca -0.06 -2.14 -0.01 0.00 -2.93 0.00 0.00 61.98 56.84 2vy4 s VAL 56 Cb -0.12 -2.00 -0.03 0.00 -1.53 0.00 0.00 36.38 32.70 2vy4 s VAL 56 CO 0.03 -0.63 -0.05 -0.63 -3.33 0.00 0.00 175.10 170.48 2vy4 s ILE 57 N -3.15 3.80 -0.07 7.04 1.01 -1.25 -1.50 121.20 127.08 2vy4 s ILE 57 Ca 0.21 -0.42 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 2vy4 s ILE 57 Cb 0.01 -2.60 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2vy4 s ILE 57 CO 0.04 0.55 1.07 0.00 0.00 0.00 0.00 174.94 176.61 2vy4 n PRO 59 N 4.91 0.73 0.00 0.00 -0.04 -1.26 -3.31 135.00 136.03 2vy4 n PRO 59 Ca 0.09 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.64 2vy4 n PRO 59 Cb 0.48 -1.18 0.51 0.00 -0.04 0.00 0.00 33.50 33.27 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 -0.68 0.00 -1.04 0.54 4.01 -1.26 -4.92 117.16 113.81 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 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 2vy4 n TYR 60 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2vy4 n ASP 61 N -0.79 -1.38 0.00 7.72 4.64 -1.21 -5.02 116.55 120.51 2vy4 n ASP 61 Ca 0.13 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.54 2vy4 n ASP 61 Cb 0.06 -0.69 0.00 0.00 -1.04 0.00 0.00 41.12 39.45 2vy4 n ASP 61 CO 0.00 0.00 0.00 -0.24 -0.82 0.00 0.00 177.20 176.14 2vy4 n SER 62 N 0.00 0.00 -3.48 1.67 2.88 -1.26 -5.01 113.62 108.42 2vy4 n SER 62 Ca 0.00 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.18 2vy4 n SER 62 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 2vy4 n SER 62 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2vy4 n ASN 63 N 0.00 2.97 -4.67 -3.46 4.13 -1.26 -4.44 115.26 108.53 2vy4 n ASN 63 Ca 0.00 -2.55 -0.35 0.00 1.68 0.00 0.00 54.58 53.36 2vy4 n ASN 63 Cb 0.00 -1.05 -0.09 0.00 -1.54 0.00 0.00 39.78 37.09 2vy4 n ASN 63 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2vy4 s HIS 64 N 4.69 3.31 -0.28 3.10 2.46 -1.26 -5.07 115.29 122.24 2vy4 s HIS 64 Ca 0.51 0.17 0.01 0.00 0.47 0.00 0.00 55.06 56.22 2vy4 s HIS 64 Cb 0.13 -2.12 0.06 0.00 -0.13 0.00 0.00 32.58 30.51 2vy4 s HIS 64 CO 0.09 0.19 -0.06 -1.01 -2.47 0.00 0.00 174.74 171.48 2vy4 s HIS 65 N 0.43 3.27 0.05 3.88 3.76 -1.26 -3.52 115.29 121.90 2vy4 s HIS 65 Ca 0.05 -2.12 -0.04 0.00 -0.15 0.00 0.00 55.06 52.80 2vy4 s HIS 65 Cb -0.12 -2.02 -0.02 0.00 1.11 0.00 0.00 32.58 31.53 2vy4 s HIS 65 CO -0.00 -0.85 0.06 0.00 -0.85 0.00 0.00 174.74 173.10 2vy4 s MET 66 N 1.17 0.62 0.29 1.40 0.23 -0.56 -4.88 119.30 117.57 2vy4 s MET 66 Ca -0.07 -0.94 -0.30 0.00 -1.03 0.00 0.00 55.69 53.35 2vy4 s MET 66 Cb -0.20 0.24 -0.12 0.00 -1.53 0.00 0.00 34.83 33.21 2vy4 s MET 66 CO -0.03 -0.15 1.46 -2.30 -2.03 0.00 0.00 175.02 171.96 2vy4 n PRO 67 N 0.45 2.33 0.14 3.16 -0.02 -1.25 0.13 135.00 139.93 2vy4 n PRO 67 Ca -0.17 0.83 0.19 0.00 -2.02 0.00 0.00 63.50 62.33 2vy4 n PRO 67 Cb 0.60 -2.52 0.72 0.00 -0.02 0.00 0.00 33.50 32.28 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 4.01 0.00 -0.71 -0.52 3.64 -1.89 0.88 116.57 121.98 2vy4 h LYS 68 Ca -0.46 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.88 2vy4 h LYS 68 Cb 1.26 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 2vy4 h LYS 68 CO 0.74 0.00 0.05 0.43 -2.27 0.00 0.00 179.45 178.40 2vy4 n SER 69 N -3.45 4.54 0.00 4.20 7.64 -1.26 -3.86 113.62 121.43 2vy4 n SER 69 Ca 0.06 -2.77 0.00 0.00 1.01 0.00 0.00 58.87 57.17 2vy4 n SER 69 Cb 0.63 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 2vy4 n SER 69 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2vy4 n SER 70 N 0.35 0.82 0.09 6.43 2.88 0.31 -4.78 113.62 119.73 2vy4 n SER 70 Ca 0.24 -1.37 0.17 0.00 -1.33 0.00 0.00 58.87 56.58 2vy4 n SER 70 Cb 1.02 0.00 0.71 0.00 -0.75 0.00 0.00 64.21 65.19 2vy4 n SER 70 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2vy4 h LEU 71 N 0.00 0.00 -0.35 2.46 -0.00 -1.66 0.12 115.31 115.88 2vy4 h LEU 71 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.78 2vy4 h LEU 71 Cb 0.69 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 2vy4 h LEU 71 CO 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 178.44 178.27 2vy4 h ALA 72 N 1.78 0.49 -0.22 1.53 0.00 -1.90 0.35 119.26 121.30 2vy4 h ALA 72 Ca 0.17 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2vy4 h ALA 72 Cb 0.72 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2vy4 h ALA 72 CO -0.00 0.41 -0.11 0.87 0.00 0.00 0.00 179.25 180.42 2vy4 h LYS 73 N 0.51 0.46 -0.09 0.00 1.79 -1.27 -1.41 116.57 116.56 2vy4 h LYS 73 Ca 0.08 -0.20 -0.01 0.00 -2.18 0.00 0.00 60.65 58.34 2vy4 h LYS 73 Cb 0.71 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2vy4 h LYS 73 CO 0.05 0.74 0.03 1.12 -1.08 0.00 0.00 179.45 180.31 2vy4 h HIS 74 N 0.16 0.14 -1.00 -1.35 2.07 -0.84 -2.98 115.15 111.34 2vy4 h HIS 74 Ca 0.05 -0.01 0.06 0.00 -2.85 0.00 0.00 60.37 57.62 2vy4 h HIS 74 Cb 0.60 -0.04 -0.07 0.00 2.57 0.00 0.00 27.41 30.48 2vy4 h HIS 74 CO 0.06 0.29 0.65 1.98 -3.07 0.00 0.00 177.93 177.85 2vy4 h MET 75 N -0.06 1.15 0.00 5.12 1.85 -0.30 1.63 114.93 124.32 2vy4 h MET 75 Ca 0.03 -0.07 0.00 0.00 -0.61 0.00 0.00 59.70 59.05 2vy4 h MET 75 Cb 0.22 -0.26 0.00 0.00 0.43 0.00 0.00 31.60 31.99 2vy4 h MET 75 CO -0.00 0.76 0.09 0.00 -0.40 0.00 0.00 176.91 177.36 2vy4 h ALA 76 N 1.46 1.09 0.00 0.39 0.00 -1.09 0.42 119.26 121.52 2vy4 h ALA 76 Ca 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 2vy4 h ALA 76 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2vy4 h ALA 76 CO -0.17 -0.09 -0.59 0.45 0.00 0.00 0.00 179.25 178.85 2vy4 n SER 77 N -2.83 0.81 -0.20 0.00 2.88 0.05 -4.26 113.62 110.08 2vy4 n SER 77 Ca -0.02 0.11 -0.07 0.00 -1.33 0.00 0.00 58.87 57.56 2vy4 n SER 77 Cb 0.15 -0.27 0.03 0.00 -0.75 0.00 0.00 64.21 63.37 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 0.77 0.00 -0.01 0.00 1.12 -1.02 -1.77 114.38 113.48 2vy4 h ARG 79 Ca 0.20 0.00 -0.23 0.00 -1.11 0.00 0.00 59.98 58.85 2vy4 h ARG 79 Cb 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 29.97 2vy4 h ARG 79 CO -0.04 0.59 -0.93 -0.07 -3.11 0.00 0.00 179.97 176.42 2vy4 h LEU 80 N 0.00 0.58 0.10 3.80 4.07 -1.06 0.26 115.31 123.05 2vy4 h LEU 80 Ca -0.01 -0.45 -0.17 0.00 0.08 0.00 0.00 57.88 57.33 2vy4 h LEU 80 Cb 1.34 -0.18 0.02 0.00 1.08 0.00 0.00 40.66 42.92 2vy4 h LEU 80 CO 0.08 1.25 -0.73 0.03 -1.08 0.00 0.00 178.44 177.98 2vy4 h ARG 81 N 0.26 0.33 0.01 1.13 -0.00 -0.78 -3.33 114.38 112.00 2vy4 h ARG 81 Ca -0.08 -0.48 -0.21 0.00 -0.50 0.00 0.00 59.98 58.71 2vy4 h ARG 81 Cb 1.56 0.17 -0.01 0.00 0.00 0.00 0.00 29.97 31.69 2vy4 h ARG 81 CO 0.16 1.19 -0.91 -0.22 0.00 0.00 0.00 179.97 180.19 2vy4 h LYS 82 N -0.31 0.24 -4.03 0.04 3.64 -1.42 -3.50 116.57 111.24 2vy4 h LYS 82 Ca -0.12 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 2vy4 h LYS 82 Cb 1.53 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 2vy4 h LYS 82 CO 0.14 1.00 -0.86 -0.12 -2.27 0.00 0.00 179.45 177.34 2vy4 n MET 83 N -3.66 -5.03 0.00 1.90 1.56 0.91 -5.06 117.12 107.74 2vy4 n MET 83 Ca -0.04 3.62 0.00 0.00 -0.27 0.00 0.00 57.70 61.00 2vy4 n MET 83 Cb 0.83 -3.86 0.00 0.00 2.15 0.00 0.00 33.22 32.33 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 1.71 1.11 3.10 -5.12 0.00 -1.25 -5.04 105.19 99.70 2vy4 n GLY 84 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2vy4 n GLY 84 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vy4 s TYR 85 N 2.54 0.70 0.42 1.61 5.04 -1.26 -5.14 117.35 121.27 2vy4 s TYR 85 Ca 0.00 -0.76 -0.25 0.00 -2.44 0.00 0.00 57.07 53.62 2vy4 s TYR 85 Cb 0.00 -0.43 -0.08 0.00 0.35 0.00 0.00 41.96 41.80 2vy4 s TYR 85 CO 0.00 -0.16 1.28 0.99 -1.34 0.00 0.00 175.55 176.32 2vy4 s THR 86 N -2.72 2.65 -2.00 4.34 2.01 -1.26 -5.25 115.64 113.42 2vy4 s THR 86 Ca 0.01 0.56 0.27 0.00 0.31 0.00 0.00 61.69 62.84 2vy4 s THR 86 Cb -0.01 -3.32 0.76 0.00 0.01 0.00 0.00 72.50 69.94 2vy4 s THR 86 CO -0.03 0.06 1.94 0.29 -0.69 0.00 0.00 174.62 176.19