#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 3.63 0.12 0.00 0.04 -1.26 -5.06 135.00 132.48 2bz2 s PRO 36 Ca 0.00 1.72 0.10 0.00 0.04 0.00 0.00 61.00 62.87 2bz2 s PRO 36 Cb 0.00 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 2bz2 s PRO 36 CO 0.00 -0.64 -0.25 1.03 0.04 0.00 0.00 177.00 177.18 2bz2 s ARG 37 N -2.88 1.52 0.06 4.56 0.52 -1.26 -5.12 118.95 116.34 2bz2 s ARG 37 Ca 0.66 -1.29 -0.17 0.00 -0.52 0.00 0.00 55.73 54.41 2bz2 s ARG 37 Cb -0.27 -1.96 -0.06 0.00 0.52 0.00 0.00 34.95 33.18 2bz2 s ARG 37 CO 0.32 0.46 0.51 0.15 0.02 0.00 0.00 175.30 176.77 2bz2 s LYS 38 N -2.00 4.09 0.00 3.54 1.02 -1.26 -5.08 119.74 120.04 2bz2 s LYS 38 Ca 0.15 0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.75 2bz2 s LYS 38 Cb -0.10 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.00 2bz2 s LYS 38 CO 0.07 0.64 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 2bz2 n GLY 39 N 1.67 -1.07 0.00 -3.33 0.00 -1.26 -4.47 105.19 96.72 2bz2 n GLY 39 Ca -0.11 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2bz2 n GLY 39 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bz2 n ASN 40 N -1.98 0.00 -4.80 1.61 2.85 -1.24 -4.68 115.26 107.03 2bz2 n ASN 40 Ca 0.00 0.00 -0.39 0.00 -0.11 0.00 0.00 54.58 54.08 2bz2 n ASN 40 Cb 0.00 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 40.96 2bz2 n ASN 40 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2bz2 s THR 41 N 0.00 4.60 0.16 -0.44 2.01 -1.26 -2.20 115.64 118.52 2bz2 s THR 41 Ca 0.00 1.40 0.07 0.00 0.31 0.00 0.00 61.69 63.47 2bz2 s THR 41 Cb 0.00 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.48 2bz2 s THR 41 CO 0.00 0.54 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.69 2bz2 s LEU 42 N -1.11 3.25 -0.33 4.42 1.02 0.46 -4.26 118.68 122.14 2bz2 s LEU 42 Ca 0.32 -0.40 -0.09 0.00 0.02 0.00 0.00 54.13 53.98 2bz2 s LEU 42 Cb -0.21 -1.93 0.01 0.00 0.02 0.00 0.00 46.19 44.07 2bz2 s LEU 42 CO 0.22 0.11 0.15 -0.47 0.02 0.00 0.00 176.35 176.38 2bz2 s TYR 43 N -1.62 3.19 -0.09 0.29 5.04 0.62 -1.37 117.35 123.42 2bz2 s TYR 43 Ca 0.26 -0.78 -0.01 0.00 -2.44 0.00 0.00 57.07 54.10 2bz2 s TYR 43 Cb -0.10 -2.36 -0.03 0.00 0.35 0.00 0.00 41.96 39.83 2bz2 s TYR 43 CO 0.17 -0.54 -0.04 0.08 -1.34 0.00 0.00 175.55 173.89 2bz2 s VAL 44 N 1.57 3.93 0.06 3.14 1.01 0.27 0.73 120.40 131.11 2bz2 s VAL 44 Ca 0.03 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.68 2bz2 s VAL 44 Cb -0.18 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 2bz2 s VAL 44 CO 0.06 0.58 -0.13 -0.47 0.00 0.00 0.00 175.10 175.13 2bz2 s TYR 45 N -0.56 1.15 -2.37 5.22 5.04 0.11 0.14 117.35 126.08 2bz2 s TYR 45 Ca 0.09 -0.44 0.00 0.00 -2.44 0.00 0.00 57.07 54.28 2bz2 s TYR 45 Cb -0.12 -0.66 0.00 0.00 0.35 0.00 0.00 41.96 41.54 2bz2 s TYR 45 CO 0.02 0.04 0.00 0.41 -1.34 0.00 0.00 175.55 174.68 2bz2 n GLY 46 N 1.45 -1.56 3.40 8.97 0.00 -1.12 -0.43 105.19 115.90 2bz2 n GLY 46 Ca -0.21 -1.06 -0.25 0.00 0.00 0.00 0.00 46.02 44.50 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 -1.35 1.46 -1.32 1.61 2.02 -1.26 -4.67 118.70 115.19 2bz2 s GLU 47 Ca 0.00 -1.51 -0.16 0.00 0.02 0.00 0.00 54.97 53.32 2bz2 s GLU 47 Cb 0.00 -1.70 0.01 0.00 0.10 0.00 0.00 34.13 32.54 2bz2 s GLU 47 CO 0.00 0.36 0.48 -0.25 0.02 0.00 0.00 175.26 175.87 2bz2 n ASP 48 N 0.21 -2.29 -4.79 -0.19 8.00 -1.26 -4.93 116.55 111.31 2bz2 n ASP 48 Ca -0.12 -1.17 -0.34 0.00 0.71 0.00 0.00 54.79 53.87 2bz2 n ASP 48 Cb 0.57 -2.32 -0.07 0.00 -0.02 0.00 0.00 41.12 39.27 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 -6.93 3.14 0.32 -1.24 -1.94 -1.26 -5.11 119.30 106.28 2bz2 s MET 49 Ca 0.26 -0.40 0.10 0.00 -1.71 0.00 0.00 55.69 53.94 2bz2 s MET 49 Cb -0.12 -2.92 -0.06 0.00 2.01 0.00 0.00 34.83 33.74 2bz2 s MET 49 CO 0.94 0.68 -0.12 0.95 -0.01 0.00 0.00 175.02 177.46 2bz2 s THR 50 N -1.12 2.25 -0.01 2.05 -4.23 -1.26 -5.06 115.64 108.26 2bz2 s THR 50 Ca 0.20 -2.24 -0.25 0.00 -1.18 0.00 0.00 61.69 58.22 2bz2 s THR 50 Cb -0.12 -2.55 -0.18 0.00 1.34 0.00 0.00 72.50 70.98 2bz2 s THR 50 CO 0.11 -0.25 1.25 1.55 -0.54 0.00 0.00 174.62 176.73 2bz2 h PRO 51 N 2.10 -0.14 -0.94 3.99 0.13 -1.99 -2.12 132.00 133.02 2bz2 h PRO 51 Ca -0.41 0.01 0.06 0.00 -0.87 0.00 0.00 66.00 64.79 2bz2 h PRO 51 Cb 1.25 0.03 -0.06 0.00 0.13 0.00 0.00 31.00 32.35 2bz2 h PRO 51 CO 0.68 0.25 0.61 1.15 -0.23 0.00 0.00 178.00 180.46 2bz2 h THR 52 N -0.57 1.08 -0.43 1.56 2.02 -1.99 0.71 112.91 115.30 2bz2 h THR 52 Ca -0.01 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 2bz2 h THR 52 Cb 0.46 -0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2bz2 h THR 52 CO 0.02 0.20 0.15 0.25 0.37 0.00 0.00 175.52 176.52 2bz2 h LEU 53 N 1.09 0.61 -0.26 2.58 5.85 -1.97 -2.48 115.31 120.73 2bz2 h LEU 53 Ca 0.40 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 2bz2 h LEU 53 Cb 0.17 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2bz2 h LEU 53 CO -0.15 0.63 0.09 -0.07 -0.34 0.00 0.00 178.44 178.61 2bz2 h LEU 54 N 0.55 0.38 -1.25 2.25 3.38 -0.58 -1.63 115.31 118.41 2bz2 h LEU 54 Ca 0.14 -0.19 0.22 0.00 0.09 0.00 0.00 57.88 58.15 2bz2 h LEU 54 Cb 0.23 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.79 2bz2 h LEU 54 CO -0.01 0.46 0.63 0.03 0.09 0.00 0.00 178.44 179.64 2bz2 h ARG 55 N 0.27 0.53 -0.00 1.13 3.08 -0.70 0.57 114.38 119.26 2bz2 h ARG 55 Ca 0.09 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 2bz2 h ARG 55 Cb 0.21 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2bz2 h ARG 55 CO -0.00 0.35 -0.77 0.78 -1.07 0.00 0.00 179.97 179.25 2bz2 h GLY 56 N 0.54 0.06 1.99 0.04 0.00 -0.96 2.07 103.07 106.82 2bz2 h GLY 56 Ca 0.56 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.80 2bz2 h GLY 56 CO -0.31 0.09 -0.00 0.00 0.00 0.00 0.00 176.54 176.31 2bz2 n ALA 57 N -2.41 2.33 -0.45 3.60 0.00 0.17 -3.55 120.51 120.20 2bz2 n ALA 57 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2bz2 n ALA 57 Cb 0.74 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 -1.53 0.00 0.12 0.00 3.01 0.52 -4.72 117.46 114.86 2bz2 n PHE 58 Ca 0.07 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.40 2bz2 n PHE 58 Cb 0.34 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.73 2bz2 n PHE 58 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2bz2 h SER 59 N 0.00 -0.29 0.61 4.37 0.02 0.33 -3.15 113.55 115.44 2bz2 h SER 59 Ca 0.00 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.67 2bz2 h SER 59 Cb 0.23 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2bz2 h SER 59 CO 0.00 0.13 -0.22 1.55 -1.14 0.00 0.00 176.83 177.15 2bz2 h PRO 60 N -0.77 0.00 0.00 3.45 0.13 -1.80 -2.43 132.00 130.58 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 0.50 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.63 2bz2 h PRO 60 CO 0.06 0.22 0.00 1.19 -0.23 0.00 0.00 178.00 179.23 2bz2 n PHE 61 N -3.59 0.85 0.00 1.56 3.72 -1.22 -4.95 117.46 113.83 2bz2 n PHE 61 Ca -0.01 0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.70 2bz2 n PHE 61 Cb 0.35 -1.00 0.00 0.00 -0.94 0.00 0.00 39.48 37.90 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 0.34 2.15 3.78 1.37 0.00 -0.91 -4.66 105.19 107.27 2bz2 n GLY 62 Ca 0.03 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.21 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 7.35 -0.22 1.61 0.02 -1.26 -4.31 114.94 118.12 2bz2 s ASN 63 Ca 0.00 1.76 -0.08 0.00 -1.02 0.00 0.00 52.86 53.53 2bz2 s ASN 63 Cb 0.00 -2.55 -0.04 0.00 0.02 0.00 0.00 41.25 38.69 2bz2 s ASN 63 CO 0.00 0.02 0.08 -0.63 0.02 0.00 0.00 177.10 176.58 2bz2 s ILE 64 N -1.47 4.58 -0.02 0.60 1.01 -1.26 -3.27 121.20 121.36 2bz2 s ILE 64 Ca 0.46 -0.09 0.12 0.00 0.00 0.00 0.00 60.65 61.13 2bz2 s ILE 64 Cb -0.20 -3.11 -0.11 0.00 0.01 0.00 0.00 42.46 39.04 2bz2 s ILE 64 CO 0.25 0.38 1.19 0.16 0.00 0.00 0.00 174.94 176.92 2bz2 h ILE 65 N 5.25 1.16 -2.69 2.92 3.07 -1.83 -3.45 117.51 121.94 2bz2 h ILE 65 Ca -0.37 -2.74 -0.19 0.00 1.55 0.00 0.00 64.86 63.10 2bz2 h ILE 65 Cb 1.18 2.54 -0.31 0.00 -0.27 0.00 0.00 36.82 39.95 2bz2 h ILE 65 CO 0.62 0.66 -0.50 -0.62 -1.05 0.00 0.00 178.15 177.26 2bz2 s ASP 66 N -6.42 0.29 -0.19 2.16 2.15 -1.26 -5.06 116.67 108.34 2bz2 s ASP 66 Ca 0.01 0.59 -0.03 0.00 0.43 0.00 0.00 52.55 53.55 2bz2 s ASP 66 Cb 0.09 0.84 -0.01 0.00 -0.30 0.00 0.00 42.92 43.54 2bz2 s ASP 66 CO 0.80 -0.25 -0.05 -0.22 -0.17 0.00 0.00 175.17 175.28 2bz2 s LEU 67 N 2.46 2.96 0.12 -1.34 1.98 -1.26 -2.27 118.68 121.33 2bz2 s LEU 67 Ca 0.02 -0.32 0.08 0.00 -2.89 0.00 0.00 54.13 51.02 2bz2 s LEU 67 Cb -0.13 -1.73 -0.04 0.00 0.66 0.00 0.00 46.19 44.95 2bz2 s LEU 67 CO -0.10 0.05 -0.19 -0.55 -1.89 0.00 0.00 176.35 173.67 2bz2 s SER 68 N 1.05 2.44 0.05 3.68 0.15 -0.93 -5.02 113.70 115.13 2bz2 s SER 68 Ca 0.01 -0.76 0.05 0.00 0.70 0.00 0.00 55.95 55.95 2bz2 s SER 68 Cb -0.15 -0.13 -0.02 0.00 -1.71 0.00 0.00 66.02 64.01 2bz2 s SER 68 CO -0.00 -0.01 -0.15 -0.04 1.20 0.00 0.00 173.24 174.23 2bz2 s MET 69 N -2.30 0.97 -0.38 5.44 -1.94 -1.26 -0.21 119.30 119.62 2bz2 s MET 69 Ca 0.09 -0.86 0.04 0.00 -1.71 0.00 0.00 55.69 53.25 2bz2 s MET 69 Cb -0.08 -1.01 0.11 0.00 2.01 0.00 0.00 34.83 35.86 2bz2 s MET 69 CO 0.05 0.24 0.11 -0.51 -0.01 0.00 0.00 175.02 174.90 2bz2 s ASP 70 N -1.35 4.57 0.28 3.03 1.11 0.58 -4.90 116.67 119.99 2bz2 s ASP 70 Ca 0.02 -2.34 0.13 0.00 0.18 0.00 0.00 52.55 50.54 2bz2 s ASP 70 Cb -0.09 -1.55 0.33 0.00 1.07 0.00 0.00 42.92 42.68 2bz2 s ASP 70 CO 0.02 -0.34 1.57 1.55 1.18 0.00 0.00 175.17 179.15 2bz2 h PRO 71 N 7.36 0.00 0.00 8.23 0.13 -1.96 0.70 132.00 146.45 2bz2 h PRO 71 Ca -0.06 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.01 2bz2 h PRO 71 Cb 0.99 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 2bz2 h PRO 71 CO 0.55 0.59 -0.33 -1.00 -0.23 0.00 0.00 178.00 177.58 2bz2 h PRO 72 N 0.00 0.00 -0.04 1.56 0.13 -1.93 -3.20 132.00 128.52 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 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2bz2 h PRO 72 CO 0.08 0.33 0.00 0.54 -0.23 0.00 0.00 178.00 178.71 2bz2 n ARG 73 N -3.32 0.64 -3.45 0.86 1.74 -1.22 -4.98 116.66 106.92 2bz2 n ARG 73 Ca 0.01 -1.19 -0.21 0.00 -0.77 0.00 0.00 57.85 55.70 2bz2 n ARG 73 Cb 0.56 -1.20 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 0.56 -5.59 -3.95 0.55 3.02 -0.65 -4.97 115.26 104.23 2bz2 n ASN 74 Ca 0.06 -0.48 -0.08 0.00 -0.03 0.00 0.00 54.58 54.05 2bz2 n ASN 74 Cb 0.27 -4.49 -0.08 0.00 -0.61 0.00 0.00 39.78 34.86 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 -3.89 1.38 0.00 0.00 0.00 0.38 0.22 121.76 119.85 2bz2 s ALA 76 Ca 0.06 -1.55 0.08 0.00 0.00 0.00 0.00 51.96 50.56 2bz2 s ALA 76 Cb 0.06 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.50 2bz2 s ALA 76 CO -0.10 -0.24 -0.26 -0.06 0.00 0.00 0.00 175.76 175.10 2bz2 s PHE 77 N -3.53 2.30 -0.06 0.00 0.08 0.71 0.93 117.98 118.41 2bz2 s PHE 77 Ca 0.21 -0.43 0.04 0.00 0.12 0.00 0.00 56.93 56.87 2bz2 s PHE 77 Cb 0.05 -1.45 -0.00 0.00 -0.57 0.00 0.00 43.02 41.05 2bz2 s PHE 77 CO 0.02 0.02 -0.20 0.08 -0.10 0.00 0.00 175.22 175.04 2bz2 s VAL 78 N -0.68 1.71 -0.17 -0.44 1.01 -0.47 -2.18 120.40 119.18 2bz2 s VAL 78 Ca 0.11 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 2bz2 s VAL 78 Cb -0.10 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 2bz2 s VAL 78 CO 0.00 0.48 -0.06 -0.89 0.00 0.00 0.00 175.10 174.63 2bz2 s THR 79 N 0.14 3.48 0.08 3.92 2.01 -0.96 0.18 115.64 124.48 2bz2 s THR 79 Ca -0.09 -0.49 0.06 0.00 0.31 0.00 0.00 61.69 61.49 2bz2 s THR 79 Cb -0.14 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2bz2 s THR 79 CO 0.04 0.47 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.05 2bz2 s TYR 80 N 0.79 2.79 0.31 4.92 2.02 -0.93 -2.59 117.35 124.65 2bz2 s TYR 80 Ca -0.02 -0.12 0.10 0.00 -0.37 0.00 0.00 57.07 56.65 2bz2 s TYR 80 Cb -0.15 -1.48 0.51 0.00 -0.40 0.00 0.00 41.96 40.45 2bz2 s TYR 80 CO 0.02 0.42 1.71 0.93 -1.57 0.00 0.00 175.55 177.05 2bz2 h GLU 81 N 3.77 0.06 -6.24 -0.62 5.08 -1.88 -3.30 114.58 111.45 2bz2 h GLU 81 Ca -0.49 -0.03 -0.69 0.00 -1.00 0.00 0.00 59.36 57.15 2bz2 h GLU 81 Cb 1.17 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 30.13 2bz2 h GLU 81 CO 0.53 0.53 -0.85 0.15 -1.00 0.00 0.00 179.01 178.37 2bz2 s LYS 82 N -3.95 2.45 0.57 2.33 1.02 -1.26 -4.56 119.74 116.34 2bz2 s LYS 82 Ca -0.03 -0.85 0.30 0.00 0.02 0.00 0.00 55.97 55.41 2bz2 s LYS 82 Cb 0.13 -2.21 1.70 0.00 -0.52 0.00 0.00 37.83 36.94 2bz2 s LYS 82 CO 0.75 0.49 2.19 0.52 -0.92 0.00 0.00 175.35 178.38 2bz2 h MET 83 N 5.74 0.00 -0.00 1.68 2.86 -1.83 -1.02 114.93 122.36 2bz2 h MET 83 Ca -0.39 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.16 2bz2 h MET 83 Cb 1.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 2bz2 h MET 83 CO 0.48 0.05 -0.45 1.49 1.06 0.00 0.00 176.91 179.54 2bz2 h GLU 84 N 0.00 0.01 0.00 1.72 4.81 -1.97 -2.45 114.58 116.70 2bz2 h GLU 84 Ca -0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 2bz2 h GLU 84 Cb 0.14 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2bz2 h GLU 84 CO 0.01 0.46 -0.36 0.77 -0.73 0.00 0.00 179.01 179.16 2bz2 h SER 85 N 0.01 0.00 0.33 1.04 0.02 -1.45 -1.13 113.55 112.36 2bz2 h SER 85 Ca -0.00 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.64 2bz2 h SER 85 Cb 0.80 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.36 2bz2 h SER 85 CO 0.06 0.36 -1.33 0.00 -1.14 0.00 0.00 176.83 174.77 2bz2 h ALA 86 N 1.64 -0.03 -0.14 3.77 0.00 -1.47 -2.23 119.26 120.81 2bz2 h ALA 86 Ca -0.00 -0.84 -0.16 0.00 0.00 0.00 0.00 54.91 53.92 2bz2 h ALA 86 Cb 0.71 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2bz2 h ALA 86 CO 0.05 0.77 -0.57 0.22 0.00 0.00 0.00 179.25 179.72 2bz2 h ASP 87 N 0.17 0.49 0.30 0.00 3.58 -1.30 0.94 116.42 120.59 2bz2 h ASP 87 Ca -0.20 -0.27 -0.19 0.00 0.42 0.00 0.00 57.03 56.79 2bz2 h ASP 87 Cb 2.03 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 42.93 2bz2 h ASP 87 CO 0.24 0.96 -0.78 -0.61 -2.88 0.00 0.00 179.24 176.17 2bz2 h GLN 88 N 0.33 0.39 0.00 0.28 4.15 -1.27 -2.43 115.11 116.56 2bz2 h GLN 88 Ca 0.00 -0.34 -0.15 0.00 0.77 0.00 0.00 58.65 58.93 2bz2 h GLN 88 Cb 1.10 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.84 2bz2 h GLN 88 CO 0.10 0.99 -0.72 0.00 -1.93 0.00 0.00 178.83 177.27 2bz2 h ALA 89 N 0.90 0.55 -0.15 3.38 0.00 -1.30 -2.25 119.26 120.40 2bz2 h ALA 89 Ca -0.04 -0.65 -0.22 0.00 0.00 0.00 0.00 54.91 54.00 2bz2 h ALA 89 Cb 1.37 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.07 2bz2 h ALA 89 CO 0.13 0.88 -0.79 0.28 0.00 0.00 0.00 179.25 179.75 2bz2 h VAL 90 N 0.00 1.28 0.07 0.00 2.07 -0.76 0.21 116.25 119.12 2bz2 h VAL 90 Ca -0.01 -1.98 -0.25 0.00 0.82 0.00 0.00 66.70 65.27 2bz2 h VAL 90 Cb 1.54 1.99 0.01 0.00 -1.52 0.00 0.00 31.29 33.31 2bz2 h VAL 90 CO 0.09 0.63 -1.09 0.00 0.02 0.00 0.00 177.57 177.21 2bz2 h ALA 91 N 0.56 0.22 0.04 1.67 0.00 -1.50 -0.04 119.26 120.21 2bz2 h ALA 91 Ca -0.05 -0.78 -0.18 0.00 0.00 0.00 0.00 54.91 53.89 2bz2 h ALA 91 Cb 1.42 0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.23 2bz2 h ALA 91 CO 0.16 0.85 -0.73 0.93 0.00 0.00 0.00 179.25 180.46 2bz2 h GLU 92 N 0.18 0.43 -0.19 0.00 4.39 -1.44 -3.31 114.58 114.64 2bz2 h GLU 92 Ca -0.12 -0.51 -0.19 0.00 0.34 0.00 0.00 59.36 58.88 2bz2 h GLU 92 Cb 1.77 0.16 0.01 0.00 -0.10 0.00 0.00 28.75 30.58 2bz2 h GLU 92 CO 0.19 1.17 -0.61 -0.07 -1.16 0.00 0.00 179.01 178.53 2bz2 h LEU 93 N -0.08 0.87 -9.57 1.33 3.38 -0.67 -3.43 115.31 107.14 2bz2 h LEU 93 Ca -0.10 -0.59 -0.52 0.00 0.09 0.00 0.00 57.88 56.75 2bz2 h LEU 93 Cb 1.46 -0.25 0.05 0.00 0.09 0.00 0.00 40.66 42.00 2bz2 h LEU 93 CO 0.14 1.31 1.08 0.21 0.09 0.00 0.00 178.44 181.28 2bz2 s ASN 94 N -6.92 6.39 0.00 -0.43 2.47 -0.03 -2.58 114.94 113.85 2bz2 s ASN 94 Ca -0.11 2.82 0.00 0.00 0.42 0.00 0.00 52.86 55.99 2bz2 s ASN 94 Cb 0.08 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.30 2bz2 s ASN 94 CO 0.88 -1.00 0.00 0.61 -3.72 0.00 0.00 177.10 173.87 2bz2 n GLY 95 N 4.16 0.76 3.26 1.21 0.00 -1.26 -4.86 105.19 108.46 2bz2 n GLY 95 Ca 0.17 -0.52 -0.15 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.82 1.16 0.09 2.61 -4.23 -1.06 -5.10 115.64 106.30 2bz2 s THR 96 Ca 0.00 -2.06 0.08 0.00 -1.18 0.00 0.00 61.69 58.53 2bz2 s THR 96 Cb 0.00 -1.92 -0.03 0.00 1.34 0.00 0.00 72.50 71.89 2bz2 s THR 96 CO 0.00 -0.69 -0.21 -1.58 -0.54 0.00 0.00 174.62 171.60 2bz2 s GLN 97 N -3.76 1.18 0.00 3.99 0.74 -1.26 -3.32 119.66 117.23 2bz2 s GLN 97 Ca 0.18 -1.14 0.00 0.00 0.05 0.00 0.00 55.36 54.45 2bz2 s GLN 97 Cb 0.03 -1.44 0.00 0.00 1.10 0.00 0.00 33.01 32.70 2bz2 s GLN 97 CO 0.02 0.34 0.00 0.28 -0.55 0.00 0.00 175.29 175.38 2bz2 n VAL 98 N 1.19 0.00 -0.08 1.34 0.31 0.17 -4.88 118.33 116.37 2bz2 n VAL 98 Ca -0.19 0.00 0.26 0.00 -0.01 0.00 0.00 64.34 64.40 2bz2 n VAL 98 Cb 0.53 -1.09 0.63 0.00 -0.91 0.00 0.00 33.84 33.00 2bz2 n VAL 98 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2bz2 h GLU 99 N 0.00 0.00 0.00 5.55 4.57 -2.04 -3.29 114.58 119.38 2bz2 h GLU 99 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2bz2 h GLU 99 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2bz2 h GLU 99 CO 0.00 0.00 -0.00 0.45 -1.18 0.00 0.00 179.01 178.28 2bz2 n SER 100 N -3.56 -0.01 -4.08 1.04 2.88 -1.26 -5.16 113.62 103.47 2bz2 n SER 100 Ca 0.16 -0.69 -0.09 0.00 -1.33 0.00 0.00 58.87 56.92 2bz2 n SER 100 Cb 1.07 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.44 2bz2 n SER 100 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2bz2 s VAL 101 N 0.00 0.11 -0.08 2.46 1.01 -1.24 -5.15 120.40 117.50 2bz2 s VAL 101 Ca 0.00 -1.74 0.03 0.00 0.00 0.00 0.00 61.98 60.27 2bz2 s VAL 101 Cb 0.00 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2bz2 s VAL 101 CO -0.00 -0.49 -0.18 -1.10 0.00 0.00 0.00 175.10 173.34 2bz2 s GLN 102 N -4.01 2.88 0.22 2.72 -0.21 -1.26 0.41 119.66 120.41 2bz2 s GLN 102 Ca 0.20 -0.76 0.07 0.00 0.02 0.00 0.00 55.36 54.88 2bz2 s GLN 102 Cb 0.06 -2.40 -0.04 0.00 1.00 0.00 0.00 33.01 31.63 2bz2 s GLN 102 CO -0.01 0.37 0.13 -1.17 -2.12 0.00 0.00 175.29 172.50 2bz2 s LEU 103 N -0.10 3.67 -0.03 2.90 0.20 -1.21 -4.53 118.68 119.59 2bz2 s LEU 103 Ca -0.03 -0.29 0.02 0.00 0.69 0.00 0.00 54.13 54.52 2bz2 s LEU 103 Cb -0.14 -2.24 0.01 0.00 -0.43 0.00 0.00 46.19 43.39 2bz2 s LEU 103 CO 0.04 0.01 -0.07 -0.54 -0.29 0.00 0.00 176.35 175.50 2bz2 s LYS 104 N -3.51 0.90 -0.06 1.98 1.02 0.43 -4.39 119.74 116.11 2bz2 s LYS 104 Ca 0.31 -0.24 0.02 0.00 0.02 0.00 0.00 55.97 56.09 2bz2 s LYS 104 Cb -0.08 -0.85 -0.03 0.00 -0.52 0.00 0.00 37.83 36.35 2bz2 s LYS 104 CO 0.23 0.05 -0.11 0.08 -0.92 0.00 0.00 175.35 174.68 2bz2 s VAL 105 N 0.41 3.36 0.11 3.17 1.01 -1.26 0.08 120.40 127.27 2bz2 s VAL 105 Ca -0.06 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 2bz2 s VAL 105 Cb -0.10 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2bz2 s VAL 105 CO 0.01 0.59 0.09 0.20 0.00 0.00 0.00 175.10 175.98 2bz2 s ASN 106 N -0.73 0.29 -0.16 3.32 0.02 0.22 -4.97 114.94 112.94 2bz2 s ASN 106 Ca 0.11 -1.03 -0.07 0.00 -1.02 0.00 0.00 52.86 50.85 2bz2 s ASN 106 Cb -0.11 0.30 -0.04 0.00 0.02 0.00 0.00 41.25 41.42 2bz2 s ASN 106 CO 0.01 -0.72 0.07 -0.51 0.02 0.00 0.00 177.10 175.97 2bz2 s ILE 107 N -3.98 4.88 0.56 0.60 2.07 -1.26 -0.28 121.20 123.80 2bz2 s ILE 107 Ca 0.16 -0.01 -0.21 0.00 -1.41 0.00 0.00 60.65 59.19 2bz2 s ILE 107 Cb 0.07 -3.17 -0.04 0.00 0.13 0.00 0.00 42.46 39.44 2bz2 s ILE 107 CO -0.03 0.51 1.30 0.00 -1.91 0.00 0.00 174.94 174.81 2bz2 s ALA 108 N -0.04 2.71 0.05 1.50 0.00 -1.26 -4.88 121.76 119.84 2bz2 s ALA 108 Ca 0.07 1.22 0.04 0.00 0.00 0.00 0.00 51.96 53.29 2bz2 s ALA 108 Cb -0.12 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 2bz2 s ALA 108 CO 0.01 -1.31 -0.12 0.50 0.00 0.00 0.00 175.76 174.84 2bz2 s ARG 109 N -3.03 0.77 0.03 0.00 3.52 -1.26 -5.08 118.95 113.90 2bz2 s ARG 109 Ca 0.74 -0.80 0.04 0.00 -0.13 0.00 0.00 55.73 55.57 2bz2 s ARG 109 Cb -0.37 -0.73 -0.02 0.00 -1.56 0.00 0.00 34.95 32.27 2bz2 s ARG 109 CO 0.43 0.17 -0.11 -1.59 -0.81 0.00 0.00 175.30 173.38 2bz2 s LYS 110 N -1.41 0.77 -0.59 5.12 -2.85 -1.26 -5.09 119.74 114.42 2bz2 s LYS 110 Ca -0.02 -0.65 0.06 0.00 -1.00 0.00 0.00 55.97 54.36 2bz2 s LYS 110 Cb -0.09 -0.72 0.21 0.00 -2.06 0.00 0.00 37.83 35.18 2bz2 s LYS 110 CO 0.01 0.18 0.58 0.94 0.10 0.00 0.00 175.35 177.16 2bz2 n GLN 111 N 2.02 1.73 0.27 1.78 7.27 -1.26 -4.90 117.38 124.29 2bz2 n GLN 111 Ca -0.18 -4.20 0.16 0.00 0.07 0.00 0.00 57.00 52.85 2bz2 n GLN 111 Cb 0.55 -2.03 0.65 0.00 2.41 0.00 0.00 30.24 31.83 2bz2 n GLN 111 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 2bz2 h PRO 112 N 4.72 0.00 0.00 3.69 0.13 -2.08 -3.59 132.00 134.86 2bz2 h PRO 112 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 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 0.68 0.04 0.00 -1.33 -0.23 0.00 0.00 178.00 177.16