#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vy5 s SER 52 N 0.00 4.57 -0.47 1.61 1.04 -1.26 -4.58 113.70 114.61 2vy5 s SER 52 Ca 0.00 -1.08 0.06 0.00 0.48 0.00 0.00 55.95 55.41 2vy5 s SER 52 Cb 0.00 -2.58 0.28 0.00 0.10 0.00 0.00 66.02 63.82 2vy5 s SER 52 CO 0.00 -3.46 0.98 0.47 0.98 0.00 0.00 173.24 172.21 2vy5 n ASP 53 N 15.95 -2.51 -4.67 7.02 10.43 -1.26 -5.12 116.55 136.39 2vy5 n ASP 53 Ca 0.43 -3.47 -0.42 0.00 2.57 0.00 0.00 54.79 53.90 2vy5 n ASP 53 Cb 0.46 1.78 -0.03 0.00 1.84 0.00 0.00 41.12 45.17 2vy5 n ASP 53 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 2vy5 s GLU 54 N 0.40 4.15 0.01 -1.24 2.02 -1.26 -4.90 118.70 117.88 2vy5 s GLU 54 Ca 0.28 2.50 -0.19 0.00 0.02 0.00 0.00 54.97 57.58 2vy5 s GLU 54 Cb 0.26 -4.00 -0.06 0.00 0.10 0.00 0.00 34.13 30.43 2vy5 s GLU 54 CO -0.15 -0.90 0.55 0.08 0.02 0.00 0.00 175.26 174.86 2vy5 s VAL 55 N 3.98 4.88 0.18 2.63 1.01 -1.26 -1.29 120.40 130.54 2vy5 s VAL 55 Ca 0.83 1.16 0.06 0.00 0.00 0.00 0.00 61.98 64.03 2vy5 s VAL 55 Cb -0.41 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 2vy5 s VAL 55 CO 0.38 0.48 -0.11 0.54 0.00 0.00 0.00 175.10 176.38 2vy5 s VAL 56 N -0.55 1.44 -0.08 2.92 0.11 0.10 -4.82 120.40 119.52 2vy5 s VAL 56 Ca 0.29 -2.13 -0.02 0.00 -2.93 0.00 0.00 61.98 57.18 2vy5 s VAL 56 Cb -0.18 -1.99 -0.04 0.00 -1.53 0.00 0.00 36.38 32.64 2vy5 s VAL 56 CO 0.17 -0.63 0.04 -0.63 -3.33 0.00 0.00 175.10 170.71 2vy5 s ILE 57 N -3.16 4.57 0.04 7.04 1.01 -1.26 -1.76 121.20 127.69 2vy5 s ILE 57 Ca 0.21 -0.21 -0.16 0.00 0.00 0.00 0.00 60.65 60.48 2vy5 s ILE 57 Cb 0.01 -2.97 -0.06 0.00 0.01 0.00 0.00 42.46 39.46 2vy5 s ILE 57 CO 0.04 0.56 0.48 0.00 0.00 0.00 0.00 174.94 176.03 2vy5 n PRO 59 N 1.65 2.03 0.00 0.00 -0.04 -1.26 -3.76 135.00 133.62 2vy5 n PRO 59 Ca -0.12 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 61.91 2vy5 n PRO 59 Cb 0.52 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.06 2vy5 n PRO 59 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2vy5 n TYR 60 N 1.62 0.00 0.00 0.54 4.01 -1.26 -5.02 117.16 117.05 2vy5 n TYR 60 Ca 0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.14 2vy5 n TYR 60 Cb 0.72 0.33 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 2vy5 n TYR 60 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2vy5 n ASP 61 N -2.57 0.00 0.00 7.72 8.00 -1.25 -5.00 116.55 123.45 2vy5 n ASP 61 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2vy5 n ASP 61 Cb 0.14 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 2vy5 n ASP 61 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2vy5 n SER 62 N -1.56 0.00 -2.47 -2.24 2.88 -1.25 -4.97 113.62 104.02 2vy5 n SER 62 Ca 0.00 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.24 2vy5 n SER 62 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2vy5 n SER 62 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2vy5 n ASN 63 N 0.00 7.01 -4.18 -3.46 4.13 -1.26 -4.75 115.26 112.75 2vy5 n ASN 63 Ca 0.00 -3.47 -0.34 0.00 1.68 0.00 0.00 54.58 52.45 2vy5 n ASN 63 Cb 0.00 -1.11 -0.14 0.00 -1.54 0.00 0.00 39.78 36.99 2vy5 n ASN 63 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2vy5 s HIS 64 N -2.80 3.10 -0.30 3.10 2.46 -1.26 -5.08 115.29 114.50 2vy5 s HIS 64 Ca 0.53 -1.69 -0.03 0.00 0.47 0.00 0.00 55.06 54.35 2vy5 s HIS 64 Cb 0.40 -2.04 0.04 0.00 -0.13 0.00 0.00 32.58 30.85 2vy5 s HIS 64 CO -0.20 -0.76 0.01 -1.01 -2.47 0.00 0.00 174.74 170.31 2vy5 s HIS 65 N 1.29 3.23 0.05 3.88 3.76 -1.26 -3.40 115.29 122.84 2vy5 s HIS 65 Ca -0.01 -1.74 -0.03 0.00 -0.15 0.00 0.00 55.06 53.13 2vy5 s HIS 65 Cb -0.17 -2.13 -0.02 0.00 1.11 0.00 0.00 32.58 31.37 2vy5 s HIS 65 CO -0.04 -0.78 0.04 0.00 -0.85 0.00 0.00 174.74 173.11 2vy5 s MET 66 N 1.29 0.59 0.24 1.40 0.23 -0.72 -4.89 119.30 117.44 2vy5 s MET 66 Ca -0.04 -0.96 -0.31 0.00 -1.03 0.00 0.00 55.69 53.35 2vy5 s MET 66 Cb -0.19 0.22 -0.14 0.00 -1.53 0.00 0.00 34.83 33.19 2vy5 s MET 66 CO -0.01 -0.13 1.29 -2.30 -2.03 0.00 0.00 175.02 171.84 2vy5 n PRO 67 N 0.50 1.74 0.10 3.16 -0.02 -1.26 0.02 135.00 139.24 2vy5 n PRO 67 Ca -0.17 0.62 0.20 0.00 -2.02 0.00 0.00 63.50 62.13 2vy5 n PRO 67 Cb 0.60 -2.20 0.72 0.00 -0.02 0.00 0.00 33.50 32.60 2vy5 n PRO 67 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2vy5 h LYS 68 N 3.62 0.00 -0.94 -0.52 3.64 -1.51 0.56 116.57 121.41 2vy5 h LYS 68 Ca -0.44 0.00 -0.44 0.00 -1.27 0.00 0.00 60.65 58.50 2vy5 h LYS 68 Cb 1.30 0.00 -0.26 0.00 -0.41 0.00 0.00 32.23 32.86 2vy5 h LYS 68 CO 0.71 0.00 0.56 0.43 -2.27 0.00 0.00 179.45 178.88 2vy5 n SER 69 N -3.57 4.00 -0.18 4.20 7.64 -1.26 -4.07 113.62 120.37 2vy5 n SER 69 Ca 0.07 -3.49 0.00 0.00 1.01 0.00 0.00 58.87 56.47 2vy5 n SER 69 Cb 0.66 -0.81 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2vy5 n SER 69 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2vy5 n SER 70 N -0.88 0.05 -0.24 6.43 7.64 0.20 -4.87 113.62 121.95 2vy5 n SER 70 Ca 0.55 -1.39 -0.02 0.00 1.01 0.00 0.00 58.87 59.01 2vy5 n SER 70 Cb 1.59 -0.08 0.09 0.00 -1.01 0.00 0.00 64.21 64.81 2vy5 n SER 70 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2vy5 h LEU 71 N 0.00 0.62 -0.53 -3.43 -0.00 -1.70 -0.39 115.31 109.88 2vy5 h LEU 71 Ca 0.00 0.02 0.08 0.00 -0.00 0.00 0.00 57.88 57.97 2vy5 h LEU 71 Cb 1.14 -0.11 -0.06 0.00 -0.00 0.00 0.00 40.66 41.63 2vy5 h LEU 71 CO 0.00 0.41 0.18 0.00 -0.00 0.00 0.00 178.44 179.03 2vy5 h ALA 72 N 1.33 0.65 -0.01 1.53 0.00 -1.91 0.35 119.26 121.19 2vy5 h ALA 72 Ca 0.29 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 2vy5 h ALA 72 Cb 0.12 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2vy5 h ALA 72 CO -0.15 -0.22 -0.19 -0.22 0.00 0.00 0.00 179.25 178.46 2vy5 h LYS 73 N 0.35 0.01 -0.02 0.00 3.64 -1.70 -1.98 116.57 116.87 2vy5 h LYS 73 Ca 0.26 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2vy5 h LYS 73 Cb 0.30 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2vy5 h LYS 73 CO -0.27 0.21 -0.07 1.12 -2.27 0.00 0.00 179.45 178.17 2vy5 h HIS 74 N 0.01 0.11 -0.85 1.91 2.07 0.98 -3.23 115.15 116.15 2vy5 h HIS 74 Ca 0.00 -0.05 0.06 0.00 -2.85 0.00 0.00 60.37 57.53 2vy5 h HIS 74 Cb 0.35 -0.02 -0.05 0.00 2.57 0.00 0.00 27.41 30.26 2vy5 h HIS 74 CO 0.00 0.70 0.55 0.00 -3.07 0.00 0.00 177.93 176.11 2vy5 h MET 75 N -0.51 0.94 -0.31 5.12 -0.00 -0.23 1.61 114.93 121.54 2vy5 h MET 75 Ca -0.00 -0.06 0.09 0.00 -0.00 0.00 0.00 59.70 59.73 2vy5 h MET 75 Cb 0.70 -0.21 -0.01 0.00 -0.00 0.00 0.00 31.60 32.08 2vy5 h MET 75 CO 0.01 0.62 0.45 0.00 -0.00 0.00 0.00 176.91 177.99 2vy5 h ALA 76 N 1.53 1.93 0.00 -3.00 0.00 -1.38 0.25 119.26 118.60 2vy5 h ALA 76 Ca 0.36 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 2vy5 h ALA 76 Cb 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2vy5 h ALA 76 CO -0.12 -0.61 -0.84 0.45 0.00 0.00 0.00 179.25 178.13 2vy5 n SER 77 N -3.45 0.88 0.02 0.00 2.88 0.21 -4.19 113.62 109.98 2vy5 n SER 77 Ca 0.05 0.13 -0.12 0.00 -1.33 0.00 0.00 58.87 57.61 2vy5 n SER 77 Cb 0.59 -0.31 -0.06 0.00 -0.75 0.00 0.00 64.21 63.67 2vy5 n SER 77 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2vy5 h ARG 79 N 0.05 0.80 0.00 0.00 2.43 -0.67 0.37 114.38 117.37 2vy5 h ARG 79 Ca 0.02 -0.52 -0.03 0.00 -0.81 0.00 0.00 59.98 58.64 2vy5 h ARG 79 Cb 0.00 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2vy5 h ARG 79 CO -0.00 1.15 -0.15 1.25 -1.51 0.00 0.00 179.97 180.70 2vy5 h LEU 80 N 0.61 0.00 0.00 3.80 5.85 -1.04 0.39 115.31 124.91 2vy5 h LEU 80 Ca 0.01 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 2vy5 h LEU 80 Cb 1.17 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2vy5 h LEU 80 CO 0.12 0.15 -1.12 0.54 -0.34 0.00 0.00 178.44 177.80 2vy5 n ARG 81 N -4.24 0.52 0.09 1.25 1.74 -0.12 -4.64 116.66 111.26 2vy5 n ARG 81 Ca -0.02 0.43 -0.13 0.00 -0.77 0.00 0.00 57.85 57.36 2vy5 n ARG 81 Cb 0.22 -1.62 -0.08 0.00 -1.02 0.00 0.00 32.46 29.96 2vy5 n ARG 81 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2vy5 h LYS 82 N -1.00 -0.25 -6.77 5.56 3.11 -0.31 -3.45 116.57 113.47 2vy5 h LYS 82 Ca -0.19 0.02 -0.50 0.00 -2.81 0.00 0.00 60.65 57.16 2vy5 h LYS 82 Cb 0.98 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 32.27 2vy5 h LYS 82 CO -0.12 0.11 0.06 1.41 -2.81 0.00 0.00 179.45 178.10 2vy5 s MET 83 N -4.48 3.72 0.00 1.90 1.75 0.14 -4.68 119.30 117.65 2vy5 s MET 83 Ca -0.14 0.34 0.00 0.00 -1.25 0.00 0.00 55.69 54.63 2vy5 s MET 83 Cb 0.02 -2.45 0.00 0.00 2.84 0.00 0.00 34.83 35.24 2vy5 s MET 83 CO 0.58 0.01 0.00 0.41 -0.65 0.00 0.00 175.02 175.36 2vy5 n GLY 84 N -1.30 2.76 3.18 2.11 0.00 -1.26 -4.24 105.19 106.44 2vy5 n GLY 84 Ca 0.01 -0.39 0.04 0.00 0.00 0.00 0.00 46.02 45.68 2vy5 n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vy5 s TYR 85 N 0.00 -0.15 0.00 1.61 2.02 -1.26 -5.07 117.35 114.50 2vy5 s TYR 85 Ca 0.00 0.21 0.00 0.00 -0.37 0.00 0.00 57.07 56.91 2vy5 s TYR 85 Cb 0.00 0.07 0.00 0.00 -0.40 0.00 0.00 41.96 41.63 2vy5 s TYR 85 CO 0.00 -0.08 0.00 2.41 -1.57 0.00 0.00 175.55 176.31 2vy5 n THR 86 N 4.95 0.00 -0.50 -0.71 -1.04 -1.26 -5.15 114.28 110.57 2vy5 n THR 86 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2vy5 n THR 86 Cb 0.55 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 2vy5 n THR 86 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72