#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bz2 n PRO 36 N 0.00 0.18 0.01 0.00 -0.04 -1.26 -2.91 135.00 130.98 2bz2 n PRO 36 Ca 0.00 0.43 0.07 0.00 -0.04 0.00 0.00 63.50 63.96 2bz2 n PRO 36 Cb 0.00 -1.85 0.48 0.00 -0.04 0.00 0.00 33.50 32.09 2bz2 n PRO 36 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2bz2 h ARG 37 N 0.00 0.41 -0.96 0.54 2.43 -2.04 -1.30 114.38 113.46 2bz2 h ARG 37 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2bz2 h ARG 37 Cb 0.34 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 2bz2 h ARG 37 CO 0.00 0.27 0.61 0.87 -1.51 0.00 0.00 179.97 180.21 2bz2 h LYS 38 N 0.42 1.28 0.00 0.20 1.57 -2.01 -3.43 116.57 114.61 2bz2 h LYS 38 Ca 0.17 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2bz2 h LYS 38 Cb 0.16 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.19 2bz2 h LYS 38 CO -0.04 0.87 0.00 0.41 -0.57 0.00 0.00 179.45 180.12 2bz2 n GLY 39 N -1.31 0.96 3.18 3.86 0.00 -0.49 -5.04 105.19 106.35 2bz2 n GLY 39 Ca 0.11 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.00 -1.41 0.11 1.61 2.47 -1.25 -5.00 114.94 110.46 2bz2 s ASN 40 Ca 0.00 -0.70 -0.22 0.00 0.42 0.00 0.00 52.86 52.36 2bz2 s ASN 40 Cb 0.00 1.91 -0.07 0.00 -1.45 0.00 0.00 41.25 41.64 2bz2 s ASN 40 CO 0.00 -0.19 0.67 -0.89 -3.72 0.00 0.00 177.10 172.97 2bz2 s THR 41 N 1.95 4.59 -0.12 -5.21 2.01 -1.26 -2.02 115.64 115.59 2bz2 s THR 41 Ca 0.15 1.44 -0.01 0.00 0.31 0.00 0.00 61.69 63.59 2bz2 s THR 41 Cb -0.05 -4.01 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 2bz2 s THR 41 CO -0.09 0.53 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.53 2bz2 s LEU 42 N -1.03 3.08 -0.45 4.42 1.02 0.48 -3.68 118.68 122.51 2bz2 s LEU 42 Ca 0.32 -0.14 -0.23 0.00 0.02 0.00 0.00 54.13 54.10 2bz2 s LEU 42 Cb -0.21 -1.70 0.03 0.00 0.02 0.00 0.00 46.19 44.32 2bz2 s LEU 42 CO 0.22 0.24 0.79 -0.47 0.02 0.00 0.00 176.35 177.15 2bz2 s TYR 43 N -0.06 2.99 -0.16 0.29 5.04 -0.87 -0.70 117.35 123.87 2bz2 s TYR 43 Ca 0.00 0.15 -0.06 0.00 -2.44 0.00 0.00 57.07 54.71 2bz2 s TYR 43 Cb -0.13 -3.67 -0.04 0.00 0.35 0.00 0.00 41.96 38.46 2bz2 s TYR 43 CO 0.03 -1.00 0.05 0.08 -1.34 0.00 0.00 175.55 173.37 2bz2 s VAL 44 N 3.30 4.69 0.04 3.14 1.01 0.28 -0.25 120.40 132.61 2bz2 s VAL 44 Ca 0.30 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.28 2bz2 s VAL 44 Cb -0.12 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2bz2 s VAL 44 CO 0.22 0.49 -0.21 -0.47 0.00 0.00 0.00 175.10 175.13 2bz2 s TYR 45 N 0.13 2.46 0.00 5.22 5.04 0.89 0.15 117.35 131.24 2bz2 s TYR 45 Ca 0.04 -0.32 0.00 0.00 -2.44 0.00 0.00 57.07 54.35 2bz2 s TYR 45 Cb -0.12 -1.43 0.00 0.00 0.35 0.00 0.00 41.96 40.75 2bz2 s TYR 45 CO 0.01 0.20 0.00 0.41 -1.34 0.00 0.00 175.55 174.83 2bz2 n GLY 46 N 1.64 -0.12 3.52 8.97 0.00 -1.10 -0.48 105.19 117.63 2bz2 n GLY 46 Ca -0.16 -1.04 -0.24 0.00 0.00 0.00 0.00 46.02 44.58 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 -2.00 1.86 -1.28 1.61 2.02 -1.26 -4.49 118.70 115.15 2bz2 s GLU 47 Ca 0.00 -1.67 -0.17 0.00 0.02 0.00 0.00 54.97 53.16 2bz2 s GLU 47 Cb 0.00 -1.89 0.01 0.00 0.10 0.00 0.00 34.13 32.36 2bz2 s GLU 47 CO 0.00 0.34 0.56 -0.25 0.02 0.00 0.00 175.26 175.93 2bz2 n ASP 48 N -0.70 -2.83 -4.51 -0.19 8.00 -1.26 -4.94 116.55 110.12 2bz2 n ASP 48 Ca -0.05 -1.13 -0.32 0.00 0.71 0.00 0.00 54.79 54.00 2bz2 n ASP 48 Cb 0.60 -2.58 -0.12 0.00 -0.02 0.00 0.00 41.12 39.00 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 -6.73 2.36 0.34 -1.24 -1.94 -1.26 -5.11 119.30 105.72 2bz2 s MET 49 Ca 0.29 -0.81 0.09 0.00 -1.71 0.00 0.00 55.69 53.56 2bz2 s MET 49 Cb -0.13 -2.35 -0.06 0.00 2.01 0.00 0.00 34.83 34.30 2bz2 s MET 49 CO 0.92 0.59 -0.08 0.95 -0.01 0.00 0.00 175.02 177.39 2bz2 s THR 50 N -0.88 2.32 -0.01 2.05 -4.23 -1.26 -5.05 115.64 108.58 2bz2 s THR 50 Ca 0.14 -2.17 -0.24 0.00 -1.18 0.00 0.00 61.69 58.25 2bz2 s THR 50 Cb -0.11 -2.67 -0.17 0.00 1.34 0.00 0.00 72.50 70.90 2bz2 s THR 50 CO 0.04 -0.21 1.15 1.55 -0.54 0.00 0.00 174.62 176.61 2bz2 h PRO 51 N 1.99 -0.27 -0.94 3.99 0.13 -1.99 -1.68 132.00 133.22 2bz2 h PRO 51 Ca -0.42 0.02 0.10 0.00 -0.87 0.00 0.00 66.00 64.83 2bz2 h PRO 51 Cb 1.25 0.06 -0.07 0.00 0.13 0.00 0.00 31.00 32.37 2bz2 h PRO 51 CO 0.69 0.09 0.61 1.15 -0.23 0.00 0.00 178.00 180.31 2bz2 h THR 52 N -0.73 0.98 -0.16 1.56 2.02 -1.98 0.27 112.91 114.86 2bz2 h THR 52 Ca -0.03 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 2bz2 h THR 52 Cb 0.50 -0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2bz2 h THR 52 CO 0.05 0.18 0.01 0.25 0.37 0.00 0.00 175.52 176.38 2bz2 h LEU 53 N 0.97 0.27 -0.57 2.58 5.85 -1.97 -2.40 115.31 120.03 2bz2 h LEU 53 Ca 0.44 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 2bz2 h LEU 53 Cb 0.39 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 2bz2 h LEU 53 CO -0.20 0.49 0.26 -0.07 -0.34 0.00 0.00 178.44 178.58 2bz2 h LEU 54 N 0.04 0.76 -1.30 2.25 3.38 -0.32 -1.48 115.31 118.64 2bz2 h LEU 54 Ca 0.05 -0.15 0.14 0.00 0.09 0.00 0.00 57.88 58.01 2bz2 h LEU 54 Cb 0.34 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.83 2bz2 h LEU 54 CO 0.01 0.69 0.57 -0.09 0.09 0.00 0.00 178.44 179.71 2bz2 h ARG 55 N 0.78 0.66 0.00 1.13 2.43 -0.37 0.33 114.38 119.34 2bz2 h ARG 55 Ca 0.19 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.19 2bz2 h ARG 55 Cb 0.15 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2bz2 h ARG 55 CO -0.02 0.44 -0.63 0.78 -1.51 0.00 0.00 179.97 179.02 2bz2 h GLY 56 N 0.68 0.00 2.00 2.80 0.00 -0.84 2.09 103.07 109.80 2bz2 h GLY 56 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2bz2 h GLY 56 CO -0.20 0.00 -0.00 0.00 0.00 0.00 0.00 176.54 176.34 2bz2 n ALA 57 N -2.35 2.30 -0.30 3.60 0.00 0.91 -3.58 120.51 121.09 2bz2 n ALA 57 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2bz2 n ALA 57 Cb 0.68 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.66 2bz2 n ALA 57 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2bz2 n PHE 58 N -2.06 0.00 0.11 0.00 3.01 0.21 -4.70 117.46 114.03 2bz2 n PHE 58 Ca 0.06 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.40 2bz2 n PHE 58 Cb 0.41 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.80 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 0.00 -0.28 0.61 4.37 0.87 0.34 -3.21 113.55 116.25 2bz2 h SER 59 Ca 0.00 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.29 2bz2 h SER 59 Cb 0.15 0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2bz2 h SER 59 CO 0.00 0.18 -0.10 1.55 -0.53 0.00 0.00 176.83 177.93 2bz2 h PRO 60 N -0.83 0.00 0.00 2.24 0.13 -1.79 -2.28 132.00 129.47 2bz2 h PRO 60 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 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 0.10 0.00 0.74 -0.23 0.00 0.00 178.00 178.67 2bz2 h PHE 61 N 0.00 0.00 0.00 1.56 0.04 -1.83 -3.48 116.94 113.23 2bz2 h PHE 61 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2bz2 h PHE 61 Cb 0.43 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.58 2bz2 h PHE 61 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12 2bz2 n GLY 62 N 0.51 0.17 3.79 -1.45 0.00 -0.86 -4.56 105.19 102.79 2bz2 n GLY 62 Ca 0.03 -1.41 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 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 7.10 -0.19 1.61 0.02 -1.26 -4.39 114.94 117.83 2bz2 s ASN 63 Ca 0.00 1.31 -0.08 0.00 -1.02 0.00 0.00 52.86 53.06 2bz2 s ASN 63 Cb 0.00 -2.39 -0.04 0.00 0.02 0.00 0.00 41.25 38.83 2bz2 s ASN 63 CO 0.00 0.20 0.09 -0.63 0.02 0.00 0.00 177.10 176.77 2bz2 s ILE 64 N -0.77 5.03 -0.28 0.60 1.01 -1.26 -2.94 121.20 122.59 2bz2 s ILE 64 Ca 0.31 0.05 0.23 0.00 0.00 0.00 0.00 60.65 61.24 2bz2 s ILE 64 Cb -0.20 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2bz2 s ILE 64 CO 0.20 0.45 1.00 2.30 0.00 0.00 0.00 174.94 178.89 2bz2 n ILE 65 N 3.55 0.49 -3.60 2.92 -5.35 -1.17 -4.85 119.36 111.36 2bz2 n ILE 65 Ca -0.16 -0.49 -0.05 0.00 -0.27 0.00 0.00 62.75 61.78 2bz2 n ILE 65 Cb 0.52 -0.23 -0.07 0.00 -1.74 0.00 0.00 39.64 38.12 2bz2 n ILE 65 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2bz2 s ASP 66 N -5.04 -0.67 -0.13 7.28 2.15 -1.26 -5.07 116.67 113.93 2bz2 s ASP 66 Ca -0.00 1.18 0.02 0.00 0.43 0.00 0.00 52.55 54.17 2bz2 s ASP 66 Cb 0.11 1.79 -0.00 0.00 -0.30 0.00 0.00 42.92 44.52 2bz2 s ASP 66 CO 0.80 -0.23 -0.19 -0.22 -0.17 0.00 0.00 175.17 175.15 2bz2 s LEU 67 N 2.75 2.32 0.16 -1.34 0.20 -1.26 -1.89 118.68 119.62 2bz2 s LEU 67 Ca -0.01 -0.50 0.10 0.00 0.69 0.00 0.00 54.13 54.42 2bz2 s LEU 67 Cb -0.12 -1.50 -0.04 0.00 -0.43 0.00 0.00 46.19 44.10 2bz2 s LEU 67 CO -0.16 0.12 -0.23 -0.44 -0.29 0.00 0.00 176.35 175.35 2bz2 s SER 68 N 0.57 3.17 0.01 3.68 0.01 -0.97 -5.03 113.70 115.13 2bz2 s SER 68 Ca -0.11 -0.82 0.07 0.00 1.31 0.00 0.00 55.95 56.40 2bz2 s SER 68 Cb -0.16 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 2bz2 s SER 68 CO 0.04 0.10 -0.21 -0.04 0.41 0.00 0.00 173.24 173.54 2bz2 s MET 69 N -2.46 1.60 -0.47 12.44 -1.94 -1.26 -1.72 119.30 125.49 2bz2 s MET 69 Ca 0.17 -0.84 0.03 0.00 -1.71 0.00 0.00 55.69 53.33 2bz2 s MET 69 Cb -0.08 -1.61 0.14 0.00 2.01 0.00 0.00 34.83 35.28 2bz2 s MET 69 CO 0.08 0.43 0.27 -0.51 -0.01 0.00 0.00 175.02 175.28 2bz2 s ASP 70 N -0.78 3.69 0.29 3.03 1.11 0.16 -4.94 116.67 119.23 2bz2 s ASP 70 Ca 0.08 -2.80 0.14 0.00 0.18 0.00 0.00 52.55 50.15 2bz2 s ASP 70 Cb -0.08 -1.12 0.35 0.00 1.07 0.00 0.00 42.92 43.14 2bz2 s ASP 70 CO 0.00 -0.24 1.58 1.55 1.18 0.00 0.00 175.17 179.24 2bz2 h PRO 71 N 6.53 0.00 0.00 8.23 0.13 -1.97 -0.50 132.00 144.42 2bz2 h PRO 71 Ca 0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.08 2bz2 h PRO 71 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2bz2 h PRO 71 CO 0.52 0.57 -0.30 -1.00 -0.23 0.00 0.00 178.00 177.55 2bz2 h PRO 72 N 0.00 0.00 -0.01 1.56 0.13 -1.92 -3.18 132.00 128.57 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 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2bz2 h PRO 72 CO 0.07 0.30 -0.09 0.54 -0.23 0.00 0.00 178.00 178.60 2bz2 n ARG 73 N -3.30 1.23 -3.33 0.86 1.74 -1.22 -4.98 116.66 107.66 2bz2 n ARG 73 Ca 0.01 -1.14 -0.18 0.00 -0.77 0.00 0.00 57.85 55.77 2bz2 n ARG 73 Cb 0.55 -1.24 0.07 0.00 -1.02 0.00 0.00 32.46 30.82 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 0.48 -4.82 -3.86 0.55 5.03 -0.85 -4.98 115.26 106.80 2bz2 n ASN 74 Ca 0.07 -0.44 -0.09 0.00 0.87 0.00 0.00 54.58 54.99 2bz2 n ASN 74 Cb 0.33 -4.13 -0.07 0.00 -1.02 0.00 0.00 39.78 34.88 2bz2 n ASN 74 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2bz2 s ALA 76 N -3.87 0.95 -0.04 0.00 0.00 0.39 -0.66 121.76 118.51 2bz2 s ALA 76 Ca 0.07 -1.34 0.07 0.00 0.00 0.00 0.00 51.96 50.76 2bz2 s ALA 76 Cb 0.05 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 2bz2 s ALA 76 CO -0.10 -0.24 -0.25 -0.06 0.00 0.00 0.00 175.76 175.12 2bz2 s PHE 77 N -3.61 2.33 -0.10 0.00 0.40 -0.70 1.00 117.98 117.30 2bz2 s PHE 77 Ca 0.11 -0.61 0.03 0.00 -0.60 0.00 0.00 56.93 55.87 2bz2 s PHE 77 Cb 0.05 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 42.06 2bz2 s PHE 77 CO -0.05 -0.15 -0.22 0.08 0.70 0.00 0.00 175.22 175.58 2bz2 s VAL 78 N -0.30 1.93 -0.17 -0.44 1.01 0.12 -2.30 120.40 120.26 2bz2 s VAL 78 Ca 0.01 -0.94 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 2bz2 s VAL 78 Cb -0.12 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2bz2 s VAL 78 CO 0.02 0.53 0.01 -0.89 0.00 0.00 0.00 175.10 174.77 2bz2 s THR 79 N 0.48 4.35 -0.08 3.92 2.01 -0.79 0.18 115.64 125.71 2bz2 s THR 79 Ca -0.16 -0.19 0.04 0.00 0.31 0.00 0.00 61.69 61.69 2bz2 s THR 79 Cb -0.17 -2.93 -0.01 0.00 0.01 0.00 0.00 72.50 69.39 2bz2 s THR 79 CO 0.06 0.48 -0.21 -0.31 -0.69 0.00 0.00 174.62 173.95 2bz2 s TYR 80 N 0.35 2.58 0.38 4.92 2.02 -0.86 -3.03 117.35 123.72 2bz2 s TYR 80 Ca -0.01 -0.68 0.06 0.00 -0.37 0.00 0.00 57.07 56.07 2bz2 s TYR 80 Cb -0.13 -1.68 0.75 0.00 -0.40 0.00 0.00 41.96 40.50 2bz2 s TYR 80 CO 0.01 -0.19 1.99 1.49 -1.57 0.00 0.00 175.55 177.28 2bz2 h GLU 81 N 6.22 0.56 -6.52 -0.62 4.81 -1.88 -3.34 114.58 113.80 2bz2 h GLU 81 Ca -0.30 -0.06 -0.68 0.00 -0.13 0.00 0.00 59.36 58.19 2bz2 h GLU 81 Cb 1.19 -0.11 -0.19 0.00 0.63 0.00 0.00 28.75 30.27 2bz2 h GLU 81 CO 0.49 0.44 -0.77 0.15 -0.73 0.00 0.00 179.01 178.60 2bz2 s LYS 82 N -5.33 2.16 0.54 1.92 1.02 -1.26 -4.93 119.74 113.85 2bz2 s LYS 82 Ca -0.08 -0.95 0.32 0.00 0.02 0.00 0.00 55.97 55.28 2bz2 s LYS 82 Cb 0.17 -2.27 1.24 0.00 -0.52 0.00 0.00 37.83 36.45 2bz2 s LYS 82 CO 0.75 0.54 1.94 0.52 -0.92 0.00 0.00 175.35 178.17 2bz2 h MET 83 N 4.26 0.00 0.00 1.68 2.86 -1.95 -2.52 114.93 119.26 2bz2 h MET 83 Ca -0.48 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.11 2bz2 h MET 83 Cb 1.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 2bz2 h MET 83 CO 0.50 0.00 -0.21 0.93 1.06 0.00 0.00 176.91 179.18 2bz2 h GLU 84 N 0.00 0.00 -0.00 1.72 5.08 -1.96 -2.70 114.58 116.72 2bz2 h GLU 84 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 2bz2 h GLU 84 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2bz2 h GLU 84 CO 0.00 0.21 -0.86 0.77 -1.00 0.00 0.00 179.01 178.13 2bz2 h SER 85 N 0.00 0.30 -0.01 1.42 0.02 -1.69 -2.49 113.55 111.10 2bz2 h SER 85 Ca -0.00 -0.24 -0.18 0.00 -0.84 0.00 0.00 61.79 60.53 2bz2 h SER 85 Cb 0.89 -0.09 0.01 0.00 0.14 0.00 0.00 62.40 63.35 2bz2 h SER 85 CO 0.03 1.03 -0.72 0.00 -1.14 0.00 0.00 176.83 176.03 2bz2 h ALA 86 N 0.95 0.10 -0.53 3.77 0.00 -1.59 -2.30 119.26 119.66 2bz2 h ALA 86 Ca -0.05 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 2bz2 h ALA 86 Cb 1.48 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 2bz2 h ALA 86 CO 0.13 0.45 0.17 -0.44 0.00 0.00 0.00 179.25 179.56 2bz2 h ASP 87 N 0.06 0.72 0.07 0.00 3.32 -1.53 0.66 116.42 119.71 2bz2 h ASP 87 Ca -0.09 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.70 2bz2 h ASP 87 Cb 1.41 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 2bz2 h ASP 87 CO 0.14 0.69 -0.56 -0.61 -1.72 0.00 0.00 179.24 177.18 2bz2 h GLN 88 N 0.77 0.51 0.13 3.56 4.15 -1.46 -1.36 115.11 121.41 2bz2 h GLN 88 Ca 0.18 -0.33 -0.28 0.00 0.77 0.00 0.00 58.65 59.00 2bz2 h GLN 88 Cb 0.22 0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.96 2bz2 h GLN 88 CO -0.01 0.93 -1.24 0.00 -1.93 0.00 0.00 178.83 176.58 2bz2 h ALA 89 N 1.00 0.09 -0.04 3.38 0.00 -0.85 -2.33 119.26 120.52 2bz2 h ALA 89 Ca 0.01 -0.88 -0.12 0.00 0.00 0.00 0.00 54.91 53.92 2bz2 h ALA 89 Cb 1.09 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2bz2 h ALA 89 CO 0.10 0.96 -0.52 0.28 0.00 0.00 0.00 179.25 180.08 2bz2 h VAL 90 N 0.08 1.36 0.23 0.00 2.07 0.35 0.41 116.25 120.75 2bz2 h VAL 90 Ca -0.14 -1.77 -0.32 0.00 0.82 0.00 0.00 66.70 65.29 2bz2 h VAL 90 Cb 1.97 1.92 0.03 0.00 -1.52 0.00 0.00 31.29 33.69 2bz2 h VAL 90 CO 0.21 0.51 -1.43 0.00 0.02 0.00 0.00 177.57 176.89 2bz2 h ALA 91 N 1.40 -0.10 0.00 1.67 0.00 -1.28 -2.31 119.26 118.64 2bz2 h ALA 91 Ca -0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 54.91 54.02 2bz2 h ALA 91 Cb 0.94 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2bz2 h ALA 91 CO 0.07 0.76 -0.14 0.93 0.00 0.00 0.00 179.25 180.87 2bz2 h GLU 92 N 0.13 0.00 -0.21 0.00 4.39 -1.36 -3.32 114.58 114.21 2bz2 h GLU 92 Ca -0.23 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.44 2bz2 h GLU 92 Cb 2.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.76 2bz2 h GLU 92 CO 0.26 0.84 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.88 2bz2 h LEU 93 N -1.00 0.28 -9.53 1.33 3.38 -0.34 -3.42 115.31 106.02 2bz2 h LEU 93 Ca -0.04 -0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.37 2bz2 h LEU 93 Cb 0.88 -0.07 0.03 0.00 0.09 0.00 0.00 40.66 41.59 2bz2 h LEU 93 CO -0.02 0.34 0.91 0.21 0.09 0.00 0.00 178.44 179.96 2bz2 s ASN 94 N -6.85 6.63 0.00 -0.43 3.84 -0.87 -2.35 114.94 114.92 2bz2 s ASN 94 Ca -0.06 2.51 0.00 0.00 0.21 0.00 0.00 52.86 55.52 2bz2 s ASN 94 Cb 0.16 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.28 2bz2 s ASN 94 CO 0.73 -0.83 0.00 0.61 -2.79 0.00 0.00 177.10 174.82 2bz2 n GLY 95 N 3.81 0.67 3.50 1.21 0.00 -1.26 -4.90 105.19 108.22 2bz2 n GLY 95 Ca 0.14 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.23 2.06 0.22 2.61 -4.23 -0.99 -5.09 115.64 107.99 2bz2 s THR 96 Ca 0.00 -2.19 0.05 0.00 -1.18 0.00 0.00 61.69 58.37 2bz2 s THR 96 Cb 0.00 -2.56 -0.05 0.00 1.34 0.00 0.00 72.50 71.23 2bz2 s THR 96 CO 0.00 -0.24 -0.07 -1.10 -0.54 0.00 0.00 174.62 172.66 2bz2 s GLN 97 N -3.64 1.32 0.00 3.99 -0.21 -1.26 -3.08 119.66 116.77 2bz2 s GLN 97 Ca 0.31 -1.63 0.00 0.00 0.02 0.00 0.00 55.36 54.06 2bz2 s GLN 97 Cb 0.02 -0.87 0.00 0.00 1.00 0.00 0.00 33.01 33.17 2bz2 s GLN 97 CO 0.15 0.04 0.00 0.28 -2.12 0.00 0.00 175.29 173.64 2bz2 n VAL 98 N -0.40 0.00 -0.06 1.09 0.31 0.13 -4.88 118.33 114.52 2bz2 n VAL 98 Ca -0.07 0.00 0.25 0.00 -0.01 0.00 0.00 64.34 64.51 2bz2 n VAL 98 Cb 0.62 -0.81 0.63 0.00 -0.91 0.00 0.00 33.84 33.38 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 -2.01 -3.30 114.58 119.89 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 0.43 -1.00 0.00 0.00 179.01 178.44 2bz2 n SER 100 N -3.55 0.00 -4.10 1.42 7.64 -1.26 -5.16 113.62 108.62 2bz2 n SER 100 Ca 0.15 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.94 2bz2 n SER 100 Cb 1.02 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 64.11 2bz2 n SER 100 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2bz2 s VAL 101 N 0.00 0.36 -0.20 0.44 1.01 -1.25 -5.14 120.40 115.63 2bz2 s VAL 101 Ca 0.00 -1.68 -0.08 0.00 0.00 0.00 0.00 61.98 60.22 2bz2 s VAL 101 Cb 0.00 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2bz2 s VAL 101 CO 0.00 -0.86 0.09 -1.10 0.00 0.00 0.00 175.10 173.23 2bz2 s GLN 102 N -3.41 3.98 0.20 2.72 -0.21 -1.26 0.20 119.66 121.87 2bz2 s GLN 102 Ca 0.04 -0.33 0.05 0.00 0.02 0.00 0.00 55.36 55.14 2bz2 s GLN 102 Cb 0.04 -3.31 -0.03 0.00 1.00 0.00 0.00 33.01 30.70 2bz2 s GLN 102 CO -0.07 0.18 0.25 -1.17 -2.12 0.00 0.00 175.29 172.36 2bz2 s LEU 103 N 0.64 4.08 -0.02 2.90 0.20 -1.18 -4.56 118.68 120.75 2bz2 s LEU 103 Ca 0.05 -0.02 0.01 0.00 0.69 0.00 0.00 54.13 54.86 2bz2 s LEU 103 Cb -0.13 -2.65 0.01 0.00 -0.43 0.00 0.00 46.19 42.99 2bz2 s LEU 103 CO 0.01 0.00 -0.04 -0.54 -0.29 0.00 0.00 176.35 175.50 2bz2 s LYS 104 N -3.53 0.53 -0.05 1.98 1.02 0.37 -4.52 119.74 115.54 2bz2 s LYS 104 Ca 0.33 -0.11 0.03 0.00 0.02 0.00 0.00 55.97 56.24 2bz2 s LYS 104 Cb -0.10 -0.56 -0.03 0.00 -0.52 0.00 0.00 37.83 36.63 2bz2 s LYS 104 CO 0.27 0.01 -0.14 0.54 -0.92 0.00 0.00 175.35 175.11 2bz2 s VAL 105 N 0.42 3.11 0.25 3.17 0.11 -1.26 -0.07 120.40 126.12 2bz2 s VAL 105 Ca -0.05 -0.70 0.01 0.00 -2.93 0.00 0.00 61.98 58.31 2bz2 s VAL 105 Cb -0.08 -2.23 -0.04 0.00 -1.53 0.00 0.00 36.38 32.50 2bz2 s VAL 105 CO -0.00 0.59 0.13 0.20 -3.33 0.00 0.00 175.10 172.69 2bz2 s ASN 106 N -0.70 0.85 -0.11 3.54 0.01 0.65 -4.99 114.94 114.18 2bz2 s ASN 106 Ca 0.11 -1.44 0.02 0.00 -0.71 0.00 0.00 52.86 50.84 2bz2 s ASN 106 Cb -0.11 0.31 -0.01 0.00 0.41 0.00 0.00 41.25 41.85 2bz2 s ASN 106 CO 0.01 -0.82 -0.17 -0.63 -1.51 0.00 0.00 177.10 173.97 2bz2 s ILE 107 N -3.88 2.68 0.37 0.60 1.01 -1.26 -2.05 121.20 118.67 2bz2 s ILE 107 Ca 0.38 -0.80 -0.26 0.00 0.00 0.00 0.00 60.65 59.97 2bz2 s ILE 107 Cb 0.07 -2.09 -0.09 0.00 0.01 0.00 0.00 42.46 40.36 2bz2 s ILE 107 CO 0.14 0.54 1.18 0.00 0.00 0.00 0.00 174.94 176.80 2bz2 s ALA 108 N 0.28 3.24 0.21 9.38 0.00 -1.24 -4.88 121.76 128.75 2bz2 s ALA 108 Ca -0.12 1.00 -0.07 0.00 0.00 0.00 0.00 51.96 52.76 2bz2 s ALA 108 Cb -0.16 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.55 2bz2 s ALA 108 CO 0.07 -0.48 0.29 -0.98 0.00 0.00 0.00 175.76 174.65 2bz2 s ARG 109 N -2.10 1.32 0.43 0.00 1.70 -1.26 -5.01 118.95 114.03 2bz2 s ARG 109 Ca 0.54 -1.41 0.14 0.00 -0.47 0.00 0.00 55.73 54.52 2bz2 s ARG 109 Cb -0.32 0.36 1.02 0.00 -0.57 0.00 0.00 34.95 35.44 2bz2 s ARG 109 CO 0.41 -0.49 1.97 0.87 -1.08 0.00 0.00 175.30 176.98 2bz2 h LYS 110 N 2.47 0.41 -3.10 3.89 1.57 -2.06 -3.19 116.57 116.56 2bz2 h LYS 110 Ca -0.31 -0.02 -0.62 0.00 -1.87 0.00 0.00 60.65 57.82 2bz2 h LYS 110 Cb 1.25 -0.09 -0.42 0.00 0.08 0.00 0.00 32.23 33.05 2bz2 h LYS 110 CO 0.46 0.27 -0.56 -0.65 -0.57 0.00 0.00 179.45 178.40 2bz2 s GLN 111 N -5.40 2.48 0.36 3.15 -1.52 -1.26 -4.90 119.66 112.57 2bz2 s GLN 111 Ca -0.08 -3.33 0.27 0.00 -1.95 0.00 0.00 55.36 50.27 2bz2 s GLN 111 Cb 0.20 -3.44 1.16 0.00 -0.22 0.00 0.00 33.01 30.71 2bz2 s GLN 111 CO 0.75 -1.28 1.81 -1.00 -0.25 0.00 0.00 175.29 175.32 2bz2 h PRO 112 N 5.44 0.00 0.00 2.91 0.13 -1.95 -3.53 132.00 135.01 2bz2 h PRO 112 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2bz2 h PRO 112 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2bz2 h PRO 112 CO 0.72 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 177.16