#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bz2 s PRO 36 N 0.00 3.78 0.20 0.00 0.04 -1.26 -5.06 135.00 132.70 2bz2 s PRO 36 Ca 0.00 1.79 0.11 0.00 0.04 0.00 0.00 61.00 62.94 2bz2 s PRO 36 Cb 0.00 -2.43 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 2bz2 s PRO 36 CO 0.00 -0.54 -0.19 1.03 0.04 0.00 0.00 177.00 177.34 2bz2 s ARG 37 N -2.66 1.72 -0.09 4.56 0.52 -1.26 -5.11 118.95 116.63 2bz2 s ARG 37 Ca 0.63 -1.47 -0.21 0.00 -0.52 0.00 0.00 55.73 54.16 2bz2 s ARG 37 Cb -0.29 -1.94 -0.04 0.00 0.52 0.00 0.00 34.95 33.20 2bz2 s ARG 37 CO 0.35 0.40 0.60 0.15 0.02 0.00 0.00 175.30 176.82 2bz2 s LYS 38 N -2.82 4.39 0.95 3.54 1.02 -1.26 -4.89 119.74 120.67 2bz2 s LYS 38 Ca 0.23 0.68 0.00 0.00 0.02 0.00 0.00 55.97 56.90 2bz2 s LYS 38 Cb -0.08 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 2bz2 s LYS 38 CO 0.12 0.12 0.00 0.41 -0.92 0.00 0.00 175.35 175.08 2bz2 n GLY 39 N 3.16 -1.90 3.08 -3.33 0.00 -1.26 -4.93 105.19 100.00 2bz2 n GLY 39 Ca -0.04 -1.56 0.03 0.00 0.00 0.00 0.00 46.02 44.45 2bz2 n GLY 39 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bz2 s ASN 40 N -4.00 -0.94 -0.01 1.61 3.84 -1.23 -4.85 114.94 109.36 2bz2 s ASN 40 Ca 0.00 -0.14 -0.25 0.00 0.21 0.00 0.00 52.86 52.68 2bz2 s ASN 40 Cb 0.00 1.41 -0.04 0.00 -0.55 0.00 0.00 41.25 42.07 2bz2 s ASN 40 CO 0.00 -0.14 0.77 -0.89 -2.79 0.00 0.00 177.10 174.04 2bz2 s THR 41 N 2.46 4.89 0.19 -5.21 2.01 -1.25 -2.27 115.64 116.46 2bz2 s THR 41 Ca 0.18 1.61 0.06 0.00 0.31 0.00 0.00 61.69 63.85 2bz2 s THR 41 Cb -0.03 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 2bz2 s THR 41 CO -0.19 0.29 0.13 -0.76 -0.69 0.00 0.00 174.62 173.40 2bz2 s LEU 42 N 0.47 3.72 -0.37 4.42 1.02 0.41 -4.15 118.68 124.19 2bz2 s LEU 42 Ca 0.40 -0.21 -0.07 0.00 0.02 0.00 0.00 54.13 54.26 2bz2 s LEU 42 Cb -0.19 -2.31 0.06 0.00 0.02 0.00 0.00 46.19 43.76 2bz2 s LEU 42 CO 0.22 0.04 0.17 -0.47 0.02 0.00 0.00 176.35 176.33 2bz2 s TYR 43 N -1.86 3.31 -0.01 0.29 5.04 -0.67 -1.37 117.35 122.09 2bz2 s TYR 43 Ca 0.31 -1.54 -0.02 0.00 -2.44 0.00 0.00 57.07 53.39 2bz2 s TYR 43 Cb -0.09 -2.59 -0.04 0.00 0.35 0.00 0.00 41.96 39.59 2bz2 s TYR 43 CO 0.23 -0.79 0.13 0.08 -1.34 0.00 0.00 175.55 173.86 2bz2 s VAL 44 N 1.39 5.08 0.00 3.14 1.01 0.29 0.18 120.40 131.50 2bz2 s VAL 44 Ca 0.01 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.72 2bz2 s VAL 44 Cb -0.21 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.81 2bz2 s VAL 44 CO 0.02 0.34 -0.05 -0.47 0.00 0.00 0.00 175.10 174.94 2bz2 s TYR 45 N -1.26 0.43 -0.51 5.22 5.04 0.47 0.17 117.35 126.92 2bz2 s TYR 45 Ca 0.25 -0.16 0.00 0.00 -2.44 0.00 0.00 57.07 54.72 2bz2 s TYR 45 Cb -0.12 -0.27 0.00 0.00 0.35 0.00 0.00 41.96 41.91 2bz2 s TYR 45 CO 0.16 -0.03 0.00 0.41 -1.34 0.00 0.00 175.55 174.76 2bz2 n GLY 46 N 2.68 -1.27 3.35 8.97 0.00 -1.18 -0.55 105.19 117.20 2bz2 n GLY 46 Ca -0.15 -0.99 -0.27 0.00 0.00 0.00 0.00 46.02 44.61 2bz2 n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bz2 s GLU 47 N -1.57 1.29 -1.24 1.61 2.02 -1.26 -4.62 118.70 114.93 2bz2 s GLU 47 Ca 0.00 -1.28 -0.17 0.00 0.02 0.00 0.00 54.97 53.54 2bz2 s GLU 47 Cb 0.00 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.55 2bz2 s GLU 47 CO 0.00 0.39 0.65 -0.25 0.02 0.00 0.00 175.26 176.07 2bz2 n ASP 48 N 0.95 -3.56 -4.77 -0.19 8.00 -1.26 -4.86 116.55 110.86 2bz2 n ASP 48 Ca -0.18 -1.07 -0.35 0.00 0.71 0.00 0.00 54.79 53.89 2bz2 n ASP 48 Cb 0.53 -2.93 -0.08 0.00 -0.02 0.00 0.00 41.12 38.62 2bz2 n ASP 48 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2bz2 s MET 49 N -6.44 3.17 0.28 -1.24 -1.94 -1.26 -5.07 119.30 106.81 2bz2 s MET 49 Ca 0.34 -0.31 0.10 0.00 -1.71 0.00 0.00 55.69 54.11 2bz2 s MET 49 Cb -0.14 -2.96 -0.05 0.00 2.01 0.00 0.00 34.83 33.70 2bz2 s MET 49 CO 0.89 0.73 -0.01 0.95 -0.01 0.00 0.00 175.02 177.57 2bz2 s THR 50 N -0.98 3.20 -0.01 2.05 -4.23 -1.26 -5.04 115.64 109.36 2bz2 s THR 50 Ca 0.15 -1.96 -0.24 0.00 -1.18 0.00 0.00 61.69 58.47 2bz2 s THR 50 Cb -0.12 -2.79 -0.17 0.00 1.34 0.00 0.00 72.50 70.77 2bz2 s THR 50 CO 0.04 -0.34 1.12 1.55 -0.54 0.00 0.00 174.62 176.45 2bz2 h PRO 51 N 1.89 -0.29 -0.77 3.99 0.13 -1.99 -1.64 132.00 133.32 2bz2 h PRO 51 Ca -0.43 0.02 0.11 0.00 -0.87 0.00 0.00 66.00 64.83 2bz2 h PRO 51 Cb 1.25 0.07 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 2bz2 h PRO 51 CO 0.61 0.08 0.51 1.15 -0.23 0.00 0.00 178.00 180.12 2bz2 h THR 52 N -0.76 0.90 0.04 1.56 2.02 -1.98 0.40 112.91 115.08 2bz2 h THR 52 Ca -0.03 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 2bz2 h THR 52 Cb 0.50 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2bz2 h THR 52 CO 0.05 0.11 -0.02 0.25 0.37 0.00 0.00 175.52 176.29 2bz2 h LEU 53 N 0.62 -0.05 -0.42 2.58 5.85 -1.97 -2.57 115.31 119.36 2bz2 h LEU 53 Ca 0.37 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2bz2 h LEU 53 Cb 0.57 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2bz2 h LEU 53 CO -0.14 0.39 0.21 -0.07 -0.34 0.00 0.00 178.44 178.49 2bz2 h LEU 54 N -0.49 0.54 -0.89 2.25 3.38 -0.47 -1.63 115.31 118.00 2bz2 h LEU 54 Ca -0.01 -0.12 0.17 0.00 0.09 0.00 0.00 57.88 58.01 2bz2 h LEU 54 Cb 0.45 -0.14 -0.10 0.00 0.09 0.00 0.00 40.66 40.96 2bz2 h LEU 54 CO 0.01 0.51 0.47 -0.09 0.09 0.00 0.00 178.44 179.43 2bz2 h ARG 55 N 0.54 0.61 0.00 1.13 2.43 -0.24 0.58 114.38 119.43 2bz2 h ARG 55 Ca 0.14 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2bz2 h ARG 55 Cb 0.10 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 2bz2 h ARG 55 CO -0.02 0.40 -0.42 0.78 -1.51 0.00 0.00 179.97 179.20 2bz2 h GLY 56 N 0.62 0.00 1.99 2.80 0.00 -0.99 2.12 103.07 109.61 2bz2 h GLY 56 Ca 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.78 2bz2 h GLY 56 CO -0.39 0.00 -0.26 0.00 0.00 0.00 0.00 176.54 175.89 2bz2 h ALA 57 N 1.58 0.84 -0.00 3.60 0.00 0.90 -3.29 119.26 122.88 2bz2 h ALA 57 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bz2 h ALA 57 Cb 0.91 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2bz2 h ALA 57 CO 0.05 0.31 -0.01 1.19 0.00 0.00 0.00 179.25 180.80 2bz2 n PHE 58 N -3.16 0.00 0.13 0.00 3.01 0.95 -4.61 117.46 113.79 2bz2 n PHE 58 Ca 0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.36 2bz2 n PHE 58 Cb 0.63 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 40.02 2bz2 n PHE 58 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2bz2 h SER 59 N 0.47 -0.31 0.67 4.37 0.87 0.34 -3.18 113.55 116.79 2bz2 h SER 59 Ca 0.00 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.31 2bz2 h SER 59 Cb 0.10 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2bz2 h SER 59 CO 0.00 0.11 -0.12 1.55 -0.53 0.00 0.00 176.83 177.83 2bz2 h PRO 60 N -0.79 0.00 0.00 2.24 0.13 -1.80 -2.38 132.00 129.41 2bz2 h PRO 60 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2bz2 h PRO 60 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.64 2bz2 h PRO 60 CO 0.06 0.12 0.00 1.19 -0.23 0.00 0.00 178.00 179.14 2bz2 n PHE 61 N -3.39 0.36 0.00 1.56 3.72 -1.21 -4.96 117.46 113.54 2bz2 n PHE 61 Ca -0.01 0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.52 2bz2 n PHE 61 Cb 0.31 -0.70 0.00 0.00 -0.94 0.00 0.00 39.48 38.15 2bz2 n PHE 61 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bz2 n GLY 62 N 0.72 1.23 3.72 1.37 0.00 -0.89 -4.39 105.19 106.95 2bz2 n GLY 62 Ca 0.05 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 2bz2 n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bz2 s ASN 63 N 0.00 6.74 -0.20 1.61 0.02 -1.26 -4.36 114.94 117.49 2bz2 s ASN 63 Ca 0.00 0.88 -0.16 0.00 -1.02 0.00 0.00 52.86 52.56 2bz2 s ASN 63 Cb 0.00 -2.31 -0.04 0.00 0.02 0.00 0.00 41.25 38.92 2bz2 s ASN 63 CO 0.00 -0.02 0.39 -0.63 0.02 0.00 0.00 177.10 176.87 2bz2 s ILE 64 N 0.63 5.20 -0.07 0.60 1.01 -1.26 -2.87 121.20 124.45 2bz2 s ILE 64 Ca 0.28 0.69 0.13 0.00 0.00 0.00 0.00 60.65 61.76 2bz2 s ILE 64 Cb -0.16 -3.72 -0.10 0.00 0.01 0.00 0.00 42.46 38.49 2bz2 s ILE 64 CO 0.12 0.26 1.11 0.16 0.00 0.00 0.00 174.94 176.58 2bz2 h ILE 65 N 5.02 0.94 -2.30 2.92 3.07 -1.88 -3.45 117.51 121.84 2bz2 h ILE 65 Ca -0.36 -2.49 -0.19 0.00 1.55 0.00 0.00 64.86 63.36 2bz2 h ILE 65 Cb 1.16 2.40 -0.31 0.00 -0.27 0.00 0.00 36.82 39.80 2bz2 h ILE 65 CO 0.72 0.54 -0.51 -0.62 -1.05 0.00 0.00 178.15 177.23 2bz2 s ASP 66 N -6.26 0.45 -0.15 2.16 2.15 -1.26 -5.08 116.67 108.68 2bz2 s ASP 66 Ca -0.00 0.30 -0.04 0.00 0.43 0.00 0.00 52.55 53.23 2bz2 s ASP 66 Cb 0.08 0.91 -0.03 0.00 -0.30 0.00 0.00 42.92 43.58 2bz2 s ASP 66 CO 0.79 -0.29 -0.01 -0.22 -0.17 0.00 0.00 175.17 175.27 2bz2 s LEU 67 N 2.48 3.40 0.16 -1.34 0.20 -1.26 -2.81 118.68 119.50 2bz2 s LEU 67 Ca 0.07 -0.06 0.09 0.00 0.69 0.00 0.00 54.13 54.93 2bz2 s LEU 67 Cb -0.14 -1.82 -0.04 0.00 -0.43 0.00 0.00 46.19 43.75 2bz2 s LEU 67 CO -0.13 0.19 -0.21 -0.55 -0.29 0.00 0.00 176.35 175.36 2bz2 s SER 68 N 0.24 2.92 -0.03 3.68 0.15 -1.00 -5.03 113.70 114.63 2bz2 s SER 68 Ca -0.01 -0.81 0.03 0.00 0.70 0.00 0.00 55.95 55.85 2bz2 s SER 68 Cb -0.13 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 63.99 2bz2 s SER 68 CO 0.02 0.05 -0.11 -0.04 1.20 0.00 0.00 173.24 174.37 2bz2 s MET 69 N -2.49 1.14 -0.49 5.44 -1.94 -1.26 -1.59 119.30 118.10 2bz2 s MET 69 Ca 0.15 -0.37 -0.00 0.00 -1.71 0.00 0.00 55.69 53.75 2bz2 s MET 69 Cb -0.08 -1.04 0.13 0.00 2.01 0.00 0.00 34.83 35.85 2bz2 s MET 69 CO 0.07 0.14 0.27 -0.51 -0.01 0.00 0.00 175.02 174.98 2bz2 s ASP 70 N 0.16 4.99 0.28 3.03 1.11 0.31 -4.94 116.67 121.61 2bz2 s ASP 70 Ca -0.03 -2.52 0.13 0.00 0.18 0.00 0.00 52.55 50.31 2bz2 s ASP 70 Cb -0.09 -1.77 0.33 0.00 1.07 0.00 0.00 42.92 42.46 2bz2 s ASP 70 CO 0.01 -0.40 1.57 1.55 1.18 0.00 0.00 175.17 179.08 2bz2 h PRO 71 N 7.33 0.00 0.00 8.23 0.13 -1.96 0.22 132.00 145.95 2bz2 h PRO 71 Ca -0.07 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.99 2bz2 h PRO 71 Cb 0.98 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 2bz2 h PRO 71 CO 0.67 0.59 -0.33 -1.00 -0.23 0.00 0.00 178.00 177.70 2bz2 h PRO 72 N 0.00 0.00 -0.02 1.56 0.13 -1.93 -3.20 132.00 128.54 2bz2 h PRO 72 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2bz2 h PRO 72 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2bz2 h PRO 72 CO 0.08 0.33 0.00 0.54 -0.23 0.00 0.00 178.00 178.72 2bz2 n ARG 73 N -3.32 0.53 -3.41 0.86 1.74 -1.23 -4.98 116.66 106.85 2bz2 n ARG 73 Ca 0.01 -1.16 -0.20 0.00 -0.77 0.00 0.00 57.85 55.74 2bz2 n ARG 73 Cb 0.57 -1.21 0.07 0.00 -1.02 0.00 0.00 32.46 30.87 2bz2 n ARG 73 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2bz2 n ASN 74 N 0.61 -5.29 -3.98 0.55 3.02 -0.68 -5.00 115.26 104.48 2bz2 n ASN 74 Ca 0.06 -0.47 -0.08 0.00 -0.03 0.00 0.00 54.58 54.06 2bz2 n ASN 74 Cb 0.27 -4.40 -0.09 0.00 -0.61 0.00 0.00 39.78 34.95 2bz2 n ASN 74 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bz2 s ALA 76 N -3.90 0.44 0.01 0.00 0.00 0.13 0.11 121.76 118.55 2bz2 s ALA 76 Ca 0.08 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.12 2bz2 s ALA 76 Cb 0.06 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.35 2bz2 s ALA 76 CO -0.09 -0.25 -0.17 -0.06 0.00 0.00 0.00 175.76 175.19 2bz2 s PHE 77 N -2.81 2.60 -0.08 0.00 0.40 -0.62 0.10 117.98 117.56 2bz2 s PHE 77 Ca -0.02 -0.23 0.04 0.00 -0.60 0.00 0.00 56.93 56.12 2bz2 s PHE 77 Cb -0.00 -1.51 -0.00 0.00 0.51 0.00 0.00 43.02 42.02 2bz2 s PHE 77 CO -0.05 0.23 -0.21 0.08 0.70 0.00 0.00 175.22 175.96 2bz2 s VAL 78 N -0.87 1.81 -0.16 -0.44 1.01 -0.47 -2.39 120.40 118.90 2bz2 s VAL 78 Ca 0.14 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 2bz2 s VAL 78 Cb -0.11 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2bz2 s VAL 78 CO 0.04 0.51 -0.05 -0.89 0.00 0.00 0.00 175.10 174.70 2bz2 s THR 79 N 0.26 3.71 -0.08 3.92 2.01 -1.12 0.15 115.64 124.49 2bz2 s THR 79 Ca -0.13 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 61.48 2bz2 s THR 79 Cb -0.16 -2.62 -0.01 0.00 0.01 0.00 0.00 72.50 69.72 2bz2 s THR 79 CO 0.06 0.49 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.98 2bz2 s TYR 80 N 0.45 2.60 0.45 4.92 2.02 -0.96 -3.02 117.35 123.82 2bz2 s TYR 80 Ca -0.05 -0.62 0.24 0.00 -0.37 0.00 0.00 57.07 56.27 2bz2 s TYR 80 Cb -0.15 -1.68 1.37 0.00 -0.40 0.00 0.00 41.96 41.11 2bz2 s TYR 80 CO 0.03 -0.15 2.08 1.49 -1.57 0.00 0.00 175.55 177.43 2bz2 h GLU 81 N 6.15 0.00 -6.52 -0.62 4.81 -1.88 -3.26 114.58 113.26 2bz2 h GLU 81 Ca -0.32 0.00 -0.70 0.00 -0.13 0.00 0.00 59.36 58.21 2bz2 h GLU 81 Cb 1.19 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 30.29 2bz2 h GLU 81 CO 0.50 0.12 -0.85 0.15 -0.73 0.00 0.00 179.01 178.19 2bz2 s LYS 82 N -4.41 2.23 0.55 1.92 1.02 -1.26 -4.78 119.74 115.01 2bz2 s LYS 82 Ca -0.04 -0.86 0.33 0.00 0.02 0.00 0.00 55.97 55.42 2bz2 s LYS 82 Cb 0.14 -2.14 1.47 0.00 -0.52 0.00 0.00 37.83 36.78 2bz2 s LYS 82 CO 0.61 0.58 2.03 0.52 -0.92 0.00 0.00 175.35 178.17 2bz2 h MET 83 N 5.45 0.00 0.00 1.68 2.86 -1.89 -2.24 114.93 120.79 2bz2 h MET 83 Ca -0.44 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.11 2bz2 h MET 83 Cb 1.13 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.78 2bz2 h MET 83 CO 0.48 0.06 -0.46 1.49 1.06 0.00 0.00 176.91 179.54 2bz2 h GLU 84 N 0.00 0.00 -0.02 1.72 4.81 -1.95 -2.61 114.58 116.52 2bz2 h GLU 84 Ca -0.00 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.09 2bz2 h GLU 84 Cb 0.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 2bz2 h GLU 84 CO 0.01 0.46 -0.64 0.77 -0.73 0.00 0.00 179.01 178.87 2bz2 h SER 85 N 0.00 0.08 0.10 1.04 0.02 -1.60 -2.33 113.55 110.85 2bz2 h SER 85 Ca -0.00 -0.05 -0.27 0.00 -0.84 0.00 0.00 61.79 60.63 2bz2 h SER 85 Cb 0.96 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 63.50 2bz2 h SER 85 CO 0.06 0.70 -1.09 0.00 -1.14 0.00 0.00 176.83 175.36 2bz2 h ALA 86 N 1.30 0.13 -0.30 3.77 0.00 -1.54 -2.54 119.26 120.09 2bz2 h ALA 86 Ca -0.01 -0.72 -0.09 0.00 0.00 0.00 0.00 54.91 54.09 2bz2 h ALA 86 Cb 1.14 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2bz2 h ALA 86 CO 0.09 0.71 -0.20 0.22 0.00 0.00 0.00 179.25 180.07 2bz2 h ASP 87 N 0.34 0.55 -0.21 0.00 3.58 -1.43 -1.53 116.42 117.72 2bz2 h ASP 87 Ca -0.14 -0.18 -0.10 0.00 0.42 0.00 0.00 57.03 57.04 2bz2 h ASP 87 Cb 1.74 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 42.64 2bz2 h ASP 87 CO 0.21 0.76 -0.25 -0.61 -2.88 0.00 0.00 179.24 176.47 2bz2 h GLN 88 N 0.49 0.53 -0.64 0.28 4.15 -1.43 -1.22 115.11 117.27 2bz2 h GLN 88 Ca 0.08 -0.30 -0.03 0.00 0.77 0.00 0.00 58.65 59.17 2bz2 h GLN 88 Cb 0.63 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.31 2bz2 h GLN 88 CO 0.04 0.89 0.28 0.00 -1.93 0.00 0.00 178.83 178.12 2bz2 h ALA 89 N 0.64 0.83 0.00 3.38 0.00 -1.31 -1.26 119.26 121.54 2bz2 h ALA 89 Ca 0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2bz2 h ALA 89 Cb 0.81 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2bz2 h ALA 89 CO 0.06 0.42 -0.25 0.28 0.00 0.00 0.00 179.25 179.76 2bz2 h VAL 90 N 0.89 0.71 0.00 0.00 2.07 -1.24 1.88 116.25 120.56 2bz2 h VAL 90 Ca 0.22 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 2bz2 h VAL 90 Cb 0.16 1.69 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2bz2 h VAL 90 CO -0.02 0.25 -0.07 0.00 0.02 0.00 0.00 177.57 177.74 2bz2 h ALA 91 N 1.75 0.96 0.00 1.67 0.00 -0.35 -3.19 119.26 120.10 2bz2 h ALA 91 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2bz2 h ALA 91 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2bz2 h ALA 91 CO 0.03 0.05 -0.42 0.39 0.00 0.00 0.00 179.25 179.30 2bz2 n GLU 92 N -3.09 0.00 0.17 0.00 1.02 -0.56 -4.68 120.64 113.50 2bz2 n GLU 92 Ca 0.04 0.00 0.17 0.00 -0.02 0.00 0.00 57.16 57.35 2bz2 n GLU 92 Cb 0.55 -0.50 0.79 0.00 -0.02 0.00 0.00 31.44 32.25 2bz2 n GLU 92 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2bz2 h LEU 93 N 0.00 0.00 -9.19 -4.62 3.38 0.27 -3.40 115.31 101.76 2bz2 h LEU 93 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2bz2 h LEU 93 Cb 0.42 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2bz2 h LEU 93 CO 0.00 0.00 0.77 0.21 0.09 0.00 0.00 178.44 179.51 2bz2 s ASN 94 N -5.94 7.06 0.00 -0.43 3.84 -1.07 -3.62 114.94 114.79 2bz2 s ASN 94 Ca -0.05 1.61 0.00 0.00 0.21 0.00 0.00 52.86 54.63 2bz2 s ASN 94 Cb 0.16 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.31 2bz2 s ASN 94 CO 0.59 -0.65 0.00 0.61 -2.79 0.00 0.00 177.10 174.86 2bz2 n GLY 95 N 3.39 0.52 3.35 1.21 0.00 -1.22 -4.88 105.19 107.57 2bz2 n GLY 95 Ca 0.12 -0.38 -0.19 0.00 0.00 0.00 0.00 46.02 45.57 2bz2 n GLY 95 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bz2 s THR 96 N -2.54 1.67 0.22 2.61 -4.23 -1.24 -5.04 115.64 107.10 2bz2 s THR 96 Ca 0.00 -2.19 0.06 0.00 -1.18 0.00 0.00 61.69 58.38 2bz2 s THR 96 Cb 0.00 -2.10 -0.05 0.00 1.34 0.00 0.00 72.50 71.69 2bz2 s THR 96 CO 0.00 -0.56 -0.07 -1.58 -0.54 0.00 0.00 174.62 171.88 2bz2 s GLN 97 N -3.67 1.35 0.00 3.99 0.74 -1.26 -2.31 119.66 118.50 2bz2 s GLN 97 Ca 0.23 -1.65 0.00 0.00 0.05 0.00 0.00 55.36 53.99 2bz2 s GLN 97 Cb 0.00 -0.89 0.00 0.00 1.10 0.00 0.00 33.01 33.22 2bz2 s GLN 97 CO 0.07 0.04 0.00 0.28 -0.55 0.00 0.00 175.29 175.13 2bz2 n VAL 98 N -0.42 0.00 0.24 1.34 0.31 -0.02 -4.92 118.33 114.86 2bz2 n VAL 98 Ca -0.07 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.42 2bz2 n VAL 98 Cb 0.62 0.00 0.73 0.00 -0.91 0.00 0.00 33.84 34.28 2bz2 n VAL 98 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2bz2 h GLU 99 N 0.00 0.00 0.00 5.55 5.08 -2.03 -3.32 114.58 119.86 2bz2 h GLU 99 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bz2 h GLU 99 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2bz2 h GLU 99 CO 0.00 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.88 2bz2 n SER 100 N -3.12 0.00 -4.11 1.42 3.41 -1.26 -5.16 113.62 104.80 2bz2 n SER 100 Ca 0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.55 2bz2 n SER 100 Cb 0.53 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.38 2bz2 n SER 100 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2bz2 s VAL 101 N 0.00 0.17 -0.14 -3.33 1.01 -1.25 -5.04 120.40 111.81 2bz2 s VAL 101 Ca 0.00 -1.83 0.01 0.00 0.00 0.00 0.00 61.98 60.16 2bz2 s VAL 101 Cb 0.00 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.66 2bz2 s VAL 101 CO 0.00 -0.75 -0.15 -1.10 0.00 0.00 0.00 175.10 173.10 2bz2 s GLN 102 N -3.97 2.30 -0.22 2.72 -0.21 -1.26 -0.84 119.66 118.17 2bz2 s GLN 102 Ca 0.14 -0.57 -0.19 0.00 0.02 0.00 0.00 55.36 54.76 2bz2 s GLN 102 Cb 0.08 -2.07 -0.03 0.00 1.00 0.00 0.00 33.01 31.99 2bz2 s GLN 102 CO -0.05 -0.19 0.57 -0.51 -2.12 0.00 0.00 175.29 172.99 2bz2 s LEU 103 N 1.37 4.11 -0.15 2.90 1.43 -0.98 -4.31 118.68 123.04 2bz2 s LEU 103 Ca 0.02 0.69 0.02 0.00 -1.03 0.00 0.00 54.13 53.83 2bz2 s LEU 103 Cb -0.13 -2.78 0.02 0.00 0.03 0.00 0.00 46.19 43.32 2bz2 s LEU 103 CO -0.09 -0.27 -0.20 -0.75 0.23 0.00 0.00 176.35 175.27 2bz2 s LYS 104 N 2.04 2.90 0.06 1.70 2.20 0.29 -3.38 119.74 125.55 2bz2 s LYS 104 Ca 0.25 -0.80 0.04 0.00 -0.36 0.00 0.00 55.97 55.10 2bz2 s LYS 104 Cb -0.16 -2.43 -0.04 0.00 -1.51 0.00 0.00 37.83 33.70 2bz2 s LYS 104 CO 0.09 -0.11 -0.02 0.08 -0.36 0.00 0.00 175.35 175.03 2bz2 s VAL 105 N 1.06 3.93 0.21 4.02 1.01 -1.26 0.18 120.40 129.56 2bz2 s VAL 105 Ca -0.01 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.09 2bz2 s VAL 105 Cb -0.14 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2bz2 s VAL 105 CO -0.07 0.21 0.21 0.59 0.00 0.00 0.00 175.10 176.03 2bz2 n ASN 106 N 0.88 -0.54 -4.40 3.32 5.03 0.48 -4.95 115.26 115.09 2bz2 n ASN 106 Ca -0.12 -2.36 -0.34 0.00 0.87 0.00 0.00 54.58 52.63 2bz2 n ASN 106 Cb 0.52 1.18 -0.14 0.00 -1.02 0.00 0.00 39.78 40.33 2bz2 n ASN 106 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2bz2 s ILE 107 N -2.83 3.39 0.18 2.41 -1.09 -1.26 -1.67 121.20 120.34 2bz2 s ILE 107 Ca 0.24 -0.53 0.11 0.00 -2.23 0.00 0.00 60.65 58.24 2bz2 s ILE 107 Cb 0.01 -2.47 -0.04 0.00 -1.58 0.00 0.00 42.46 38.38 2bz2 s ILE 107 CO 0.17 0.49 -0.23 0.00 -1.23 0.00 0.00 174.94 174.14 2bz2 s ALA 108 N 0.58 2.42 0.06 9.38 0.00 -1.26 -4.89 121.76 128.05 2bz2 s ALA 108 Ca -0.05 -1.60 0.09 0.00 0.00 0.00 0.00 51.96 50.41 2bz2 s ALA 108 Cb -0.15 -0.31 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2bz2 s ALA 108 CO 0.03 0.40 -0.26 1.03 0.00 0.00 0.00 175.76 176.96 2bz2 s ARG 109 N -2.63 1.69 0.24 0.00 0.52 -1.26 -4.80 118.95 112.72 2bz2 s ARG 109 Ca 0.19 -1.14 -0.06 0.00 -0.52 0.00 0.00 55.73 54.20 2bz2 s ARG 109 Cb -0.08 -1.92 0.27 0.00 0.52 0.00 0.00 34.95 33.75 2bz2 s ARG 109 CO 0.09 0.49 1.90 -0.22 0.02 0.00 0.00 175.30 177.58 2bz2 h LYS 110 N 4.63 1.20 -2.92 3.54 3.64 -2.01 -3.30 116.57 121.35 2bz2 h LYS 110 Ca -0.47 -0.07 -0.61 0.00 -1.27 0.00 0.00 60.65 58.23 2bz2 h LYS 110 Cb 1.15 -0.27 -0.41 0.00 -0.41 0.00 0.00 32.23 32.29 2bz2 h LYS 110 CO 0.43 0.79 -0.70 -0.65 -2.27 0.00 0.00 179.45 177.05 2bz2 s GLN 111 N -6.10 1.89 0.43 1.90 -1.52 -1.26 -5.10 119.66 109.90 2bz2 s GLN 111 Ca -0.13 -2.81 -0.24 0.00 -1.95 0.00 0.00 55.36 50.23 2bz2 s GLN 111 Cb 0.18 -2.78 -0.08 0.00 -0.22 0.00 0.00 33.01 30.11 2bz2 s GLN 111 CO 0.81 -1.28 1.18 -1.25 -0.25 0.00 0.00 175.29 174.50 2bz2 s PRO 112 N -0.76 3.88 0.00 2.91 0.04 -1.25 -5.27 135.00 134.55 2bz2 s PRO 112 Ca 0.25 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.13 2bz2 s PRO 112 Cb -0.07 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 31.94 2bz2 s PRO 112 CO -0.14 -0.47 0.00 -1.33 0.04 0.00 0.00 177.00 175.10