#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bz2 h PRO 36 N 0.00 0.00 -0.84 0.00 0.13 -2.05 -3.06 132.00 126.18 2bz2 h PRO 36 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.26 2bz2 h PRO 36 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2bz2 h PRO 36 CO 0.00 0.06 0.55 0.00 -0.23 0.00 0.00 178.00 178.38 2bz2 h ARG 37 N 0.00 0.64 -7.01 0.86 3.08 -2.00 -3.40 114.38 106.55 2bz2 h ARG 37 Ca -0.00 -0.04 -0.45 0.00 0.07 0.00 0.00 59.98 59.56 2bz2 h ARG 37 Cb 0.53 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2bz2 h ARG 37 CO 0.01 0.42 0.30 0.15 -1.07 0.00 0.00 179.97 179.78 2bz2 s LYS 38 N -5.64 4.15 0.00 0.04 1.02 -1.16 -4.81 119.74 113.34 2bz2 s LYS 38 Ca -0.10 1.01 0.00 0.00 0.02 0.00 0.00 55.97 56.90 2bz2 s LYS 38 Cb 0.21 -2.22 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 2bz2 s LYS 38 CO 0.78 -0.03 0.00 0.41 -0.92 0.00 0.00 175.35 175.60 2bz2 n GLY 39 N -0.72 1.55 3.03 -3.33 0.00 -1.26 -4.88 105.19 99.57 2bz2 n GLY 39 Ca 0.06 -0.67 0.05 0.00 0.00 0.00 0.00 46.02 45.46 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 1.80 -0.00 0.24 1.61 3.84 -1.11 -4.66 114.94 116.67 2bz2 s ASN 40 Ca 0.00 -0.00 -0.30 0.00 0.21 0.00 0.00 52.86 52.77 2bz2 s ASN 40 Cb 0.00 0.76 -0.09 0.00 -0.55 0.00 0.00 41.25 41.37 2bz2 s ASN 40 CO 0.00 -0.00 0.93 -0.89 -2.79 0.00 0.00 177.10 174.35 2bz2 s THR 41 N 2.75 4.09 0.06 -5.21 2.01 -1.26 -1.95 115.64 116.13 2bz2 s THR 41 Ca 0.29 2.06 0.08 0.00 0.31 0.00 0.00 61.69 64.43 2bz2 s THR 41 Cb 0.02 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.20 2bz2 s THR 41 CO -0.21 0.48 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.23 2bz2 s LEU 42 N -1.24 2.49 -0.27 4.42 1.43 0.32 -3.72 118.68 122.10 2bz2 s LEU 42 Ca 0.41 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 2bz2 s LEU 42 Cb -0.25 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2bz2 s LEU 42 CO 0.31 0.24 0.37 -0.47 0.23 0.00 0.00 176.35 177.03 2bz2 s TYR 43 N -0.94 3.24 -0.12 0.29 5.04 0.05 -1.80 117.35 123.11 2bz2 s TYR 43 Ca 0.14 0.38 -0.03 0.00 -2.44 0.00 0.00 57.07 55.13 2bz2 s TYR 43 Cb -0.10 -2.58 -0.03 0.00 0.35 0.00 0.00 41.96 39.59 2bz2 s TYR 43 CO 0.05 -0.24 0.00 0.08 -1.34 0.00 0.00 175.55 174.10 2bz2 s VAL 44 N 2.07 4.29 0.04 3.14 1.01 0.11 0.14 120.40 131.20 2bz2 s VAL 44 Ca 0.15 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2bz2 s VAL 44 Cb -0.16 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2bz2 s VAL 44 CO 0.10 0.55 -0.10 -0.47 0.00 0.00 0.00 175.10 175.19 2bz2 s TYR 45 N -0.35 0.85 -3.30 5.22 5.04 0.95 -0.69 117.35 125.07 2bz2 s TYR 45 Ca 0.07 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.33 2bz2 s TYR 45 Cb -0.12 -0.51 0.00 0.00 0.35 0.00 0.00 41.96 41.68 2bz2 s TYR 45 CO 0.02 -0.02 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 2bz2 n GLY 46 N 1.86 -1.64 3.47 8.97 0.00 -1.24 -0.07 105.19 116.53 2bz2 n GLY 46 Ca -0.19 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.53 1.68 -1.28 1.61 0.41 -1.26 -4.73 118.70 113.59 2bz2 s GLU 47 Ca 0.00 -1.52 -0.16 0.00 -0.41 0.00 0.00 54.97 52.88 2bz2 s GLU 47 Cb 0.00 -1.90 0.01 0.00 -1.78 0.00 0.00 34.13 30.46 2bz2 s GLU 47 CO 0.00 0.39 0.57 -0.25 -0.49 0.00 0.00 175.26 175.48 2bz2 n ASP 48 N 0.02 -2.89 -4.87 -0.19 8.00 -1.26 -4.93 116.55 110.43 2bz2 n ASP 48 Ca -0.11 -1.11 -0.37 0.00 0.71 0.00 0.00 54.79 53.91 2bz2 n ASP 48 Cb 0.57 -2.67 -0.06 0.00 -0.02 0.00 0.00 41.12 38.94 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 -6.66 3.52 0.35 -1.24 -1.94 -1.26 -5.10 119.30 106.96 2bz2 s MET 49 Ca 0.29 -0.10 0.09 0.00 -1.71 0.00 0.00 55.69 54.26 2bz2 s MET 49 Cb -0.13 -3.21 -0.06 0.00 2.01 0.00 0.00 34.83 33.44 2bz2 s MET 49 CO 0.91 0.74 -0.04 0.95 -0.01 0.00 0.00 175.02 177.58 2bz2 s THR 50 N -0.93 2.39 -0.03 2.05 -4.23 -1.26 -5.05 115.64 108.58 2bz2 s THR 50 Ca 0.15 -2.08 -0.20 0.00 -1.18 0.00 0.00 61.69 58.38 2bz2 s THR 50 Cb -0.12 -2.74 -0.13 0.00 1.34 0.00 0.00 72.50 70.85 2bz2 s THR 50 CO 0.04 -0.18 0.87 1.55 -0.54 0.00 0.00 174.62 176.36 2bz2 h PRO 51 N 1.90 -0.45 -0.37 3.99 0.13 -1.99 -2.27 132.00 132.93 2bz2 h PRO 51 Ca -0.42 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.75 2bz2 h PRO 51 Cb 1.25 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.46 2bz2 h PRO 51 CO 0.70 -0.16 0.25 1.15 -0.23 0.00 0.00 178.00 179.70 2bz2 h THR 52 N -1.00 1.06 -0.26 1.56 2.02 -1.99 -0.04 112.91 114.26 2bz2 h THR 52 Ca -0.05 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 2bz2 h THR 52 Cb 0.50 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2bz2 h THR 52 CO 0.08 0.08 0.05 0.25 0.37 0.00 0.00 175.52 176.35 2bz2 h LEU 53 N 0.45 0.41 -0.38 2.58 6.46 -1.98 -2.29 115.31 120.57 2bz2 h LEU 53 Ca 0.14 -0.25 -0.06 0.00 -0.12 0.00 0.00 57.88 57.60 2bz2 h LEU 53 Cb 0.02 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 2bz2 h LEU 53 CO -0.03 0.55 0.02 -0.07 -0.62 0.00 0.00 178.44 178.29 2bz2 h LEU 54 N 0.24 0.64 -1.46 2.25 3.38 -0.73 -1.82 115.31 117.81 2bz2 h LEU 54 Ca 0.08 -0.30 0.18 0.00 0.09 0.00 0.00 57.88 57.93 2bz2 h LEU 54 Cb 0.31 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.83 2bz2 h LEU 54 CO 0.00 0.78 0.57 0.03 0.09 0.00 0.00 178.44 179.91 2bz2 h ARG 55 N 0.48 0.47 0.00 1.13 3.08 -0.90 0.40 114.38 119.03 2bz2 h ARG 55 Ca 0.11 -0.03 -0.18 0.00 0.07 0.00 0.00 59.98 59.96 2bz2 h ARG 55 Cb 0.44 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2bz2 h ARG 55 CO 0.02 0.31 -0.83 0.78 -1.07 0.00 0.00 179.97 179.17 2bz2 h GLY 56 N 0.48 0.00 1.98 0.04 0.00 -0.94 1.65 103.07 106.28 2bz2 h GLY 56 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2bz2 h GLY 56 CO -0.18 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.35 2bz2 n ALA 57 N -2.37 2.33 -0.27 3.60 0.00 0.11 -3.54 120.51 120.37 2bz2 n ALA 57 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2bz2 n ALA 57 Cb 0.80 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 -1.84 0.00 0.16 0.00 3.01 0.49 -4.68 117.46 114.61 2bz2 n PHE 58 Ca 0.06 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.40 2bz2 n PHE 58 Cb 0.38 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.78 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 -0.38 0.64 4.37 0.87 0.24 -3.19 113.55 116.10 2bz2 h SER 59 Ca 0.00 -0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.35 2bz2 h SER 59 Cb 0.13 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 2bz2 h SER 59 CO 0.00 0.03 -0.18 1.55 -0.53 0.00 0.00 176.83 177.70 2bz2 h PRO 60 N -0.85 0.00 0.00 2.24 0.13 -1.80 -2.47 132.00 129.25 2bz2 h PRO 60 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2bz2 h PRO 60 Cb 0.52 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2bz2 h PRO 60 CO 0.07 0.18 0.00 1.19 -0.23 0.00 0.00 178.00 179.22 2bz2 n PHE 61 N -3.52 0.80 0.00 1.56 3.72 -1.22 -4.95 117.46 113.86 2bz2 n PHE 61 Ca -0.01 0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.69 2bz2 n PHE 61 Cb 0.34 -0.98 0.00 0.00 -0.94 0.00 0.00 39.48 37.89 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 0.25 -0.03 3.80 1.37 0.00 -0.93 -4.51 105.19 105.15 2bz2 n GLY 62 Ca 0.03 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 44.09 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 6.93 -0.21 1.61 0.01 -1.26 -4.36 114.94 117.65 2bz2 s ASN 63 Ca 0.00 1.10 -0.08 0.00 -0.71 0.00 0.00 52.86 53.17 2bz2 s ASN 63 Cb 0.00 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.30 2bz2 s ASN 63 CO 0.00 0.23 0.09 -0.63 -1.51 0.00 0.00 177.10 175.29 2bz2 s ILE 64 N -0.77 4.87 -0.69 0.60 1.01 -1.26 -3.14 121.20 121.83 2bz2 s ILE 64 Ca 0.27 0.00 0.23 0.00 0.00 0.00 0.00 60.65 61.15 2bz2 s ILE 64 Cb -0.18 -3.24 -0.13 0.00 0.01 0.00 0.00 42.46 38.92 2bz2 s ILE 64 CO 0.16 0.40 1.02 2.30 0.00 0.00 0.00 174.94 178.82 2bz2 n ILE 65 N 4.03 0.11 -3.38 2.92 -5.35 -1.19 -4.80 119.36 111.71 2bz2 n ILE 65 Ca -0.16 -0.19 -0.12 0.00 -0.27 0.00 0.00 62.75 62.01 2bz2 n ILE 65 Cb 0.52 0.34 -0.09 0.00 -1.74 0.00 0.00 39.64 38.67 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 -3.70 0.71 -0.13 7.28 2.15 -1.26 -5.05 116.67 116.68 2bz2 s ASP 66 Ca 0.05 -0.10 0.03 0.00 0.43 0.00 0.00 52.55 52.96 2bz2 s ASP 66 Cb 0.15 0.87 0.01 0.00 -0.30 0.00 0.00 42.92 43.65 2bz2 s ASP 66 CO 0.81 -0.33 -0.22 -0.22 -0.17 0.00 0.00 175.17 175.05 2bz2 s LEU 67 N 2.47 2.06 0.13 -1.34 0.20 -1.26 -1.01 118.68 119.94 2bz2 s LEU 67 Ca 0.11 -0.58 0.09 0.00 0.69 0.00 0.00 54.13 54.44 2bz2 s LEU 67 Cb -0.15 -1.40 -0.04 0.00 -0.43 0.00 0.00 46.19 44.18 2bz2 s LEU 67 CO -0.20 0.09 -0.21 -0.44 -0.29 0.00 0.00 176.35 175.30 2bz2 s SER 68 N 0.73 2.76 -0.03 3.68 0.01 -0.73 -5.01 113.70 115.12 2bz2 s SER 68 Ca -0.09 -0.75 0.07 0.00 1.31 0.00 0.00 55.95 56.49 2bz2 s SER 68 Cb -0.16 -0.16 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 2bz2 s SER 68 CO 0.00 0.06 -0.25 -0.04 0.41 0.00 0.00 173.24 173.43 2bz2 s MET 69 N -2.19 2.23 -0.53 12.44 -1.94 -1.26 -0.79 119.30 127.25 2bz2 s MET 69 Ca 0.11 -0.91 0.04 0.00 -1.71 0.00 0.00 55.69 53.22 2bz2 s MET 69 Cb -0.09 -2.09 0.14 0.00 2.01 0.00 0.00 34.83 34.80 2bz2 s MET 69 CO 0.05 0.53 0.29 -0.51 -0.01 0.00 0.00 175.02 175.38 2bz2 s ASP 70 N -0.53 4.25 0.29 3.03 1.11 0.14 -4.94 116.67 120.02 2bz2 s ASP 70 Ca 0.07 -3.09 0.14 0.00 0.18 0.00 0.00 52.55 49.85 2bz2 s ASP 70 Cb -0.11 -1.53 0.35 0.00 1.07 0.00 0.00 42.92 42.70 2bz2 s ASP 70 CO 0.00 -0.21 1.58 1.55 1.18 0.00 0.00 175.17 179.27 2bz2 h PRO 71 N 6.35 0.00 0.00 8.23 0.13 -1.96 0.95 132.00 145.70 2bz2 h PRO 71 Ca -0.03 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.03 2bz2 h PRO 71 Cb 0.87 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 2bz2 h PRO 71 CO 0.66 0.57 -0.33 -1.00 -0.23 0.00 0.00 178.00 177.67 2bz2 h PRO 72 N 0.00 0.00 -0.05 1.56 0.13 -1.93 -3.22 132.00 128.49 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 0.33 0.00 0.54 -0.23 0.00 0.00 178.00 178.71 2bz2 n ARG 73 N -3.31 0.59 -3.42 0.86 1.74 -1.22 -4.98 116.66 106.91 2bz2 n ARG 73 Ca 0.01 -1.15 -0.20 0.00 -0.77 0.00 0.00 57.85 55.75 2bz2 n ARG 73 Cb 0.57 -1.17 0.07 0.00 -1.02 0.00 0.00 32.46 30.91 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 0.46 -5.06 -4.17 0.55 3.02 -0.60 -5.00 115.26 104.46 2bz2 n ASN 74 Ca 0.06 -0.49 -0.10 0.00 -0.03 0.00 0.00 54.58 54.01 2bz2 n ASN 74 Cb 0.24 -4.50 -0.10 0.00 -0.61 0.00 0.00 39.78 34.81 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 -3.73 0.40 -0.08 0.00 0.00 0.13 0.26 121.76 118.74 2bz2 s ALA 76 Ca 0.15 -0.78 0.04 0.00 0.00 0.00 0.00 51.96 51.37 2bz2 s ALA 76 Cb 0.06 0.12 -0.01 0.00 0.00 0.00 0.00 23.12 23.29 2bz2 s ALA 76 CO -0.03 -0.13 -0.20 -0.06 0.00 0.00 0.00 175.76 175.34 2bz2 s PHE 77 N -1.86 2.60 -0.11 0.00 0.08 0.03 0.07 117.98 118.79 2bz2 s PHE 77 Ca -0.09 -0.62 0.02 0.00 0.12 0.00 0.00 56.93 56.35 2bz2 s PHE 77 Cb -0.07 -1.68 0.02 0.00 -0.57 0.00 0.00 43.02 40.72 2bz2 s PHE 77 CO -0.02 -0.16 -0.15 0.08 -0.10 0.00 0.00 175.22 174.88 2bz2 s VAL 78 N -0.09 1.45 -0.12 -0.44 1.01 -0.74 -1.78 120.40 119.69 2bz2 s VAL 78 Ca -0.04 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 2bz2 s VAL 78 Cb -0.14 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2bz2 s VAL 78 CO 0.04 0.43 0.00 -0.89 0.00 0.00 0.00 175.10 174.69 2bz2 s THR 79 N 1.01 4.31 -0.04 3.92 2.01 -0.18 0.12 115.64 126.79 2bz2 s THR 79 Ca -0.06 -0.23 0.07 0.00 0.31 0.00 0.00 61.69 61.77 2bz2 s THR 79 Cb -0.15 -2.85 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 2bz2 s THR 79 CO -0.02 0.56 -0.25 -0.31 -0.69 0.00 0.00 174.62 173.91 2bz2 s TYR 80 N -0.42 2.36 0.38 4.92 2.02 -0.82 -3.16 117.35 122.63 2bz2 s TYR 80 Ca 0.08 -0.61 0.22 0.00 -0.37 0.00 0.00 57.07 56.39 2bz2 s TYR 80 Cb -0.12 -1.54 1.17 0.00 -0.40 0.00 0.00 41.96 41.07 2bz2 s TYR 80 CO 0.02 -0.15 1.98 1.49 -1.57 0.00 0.00 175.55 177.32 2bz2 h GLU 81 N 5.86 0.00 -6.44 -0.62 4.81 -1.88 -2.93 114.58 113.37 2bz2 h GLU 81 Ca -0.36 0.00 -0.69 0.00 -0.13 0.00 0.00 59.36 58.18 2bz2 h GLU 81 Cb 1.16 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.29 2bz2 h GLU 81 CO 0.47 0.20 -0.81 0.15 -0.73 0.00 0.00 179.01 178.29 2bz2 s LYS 82 N -4.21 2.32 0.54 1.92 1.02 -1.26 -4.46 119.74 115.61 2bz2 s LYS 82 Ca -0.03 -0.81 0.34 0.00 0.02 0.00 0.00 55.97 55.50 2bz2 s LYS 82 Cb 0.14 -2.26 1.48 0.00 -0.52 0.00 0.00 37.83 36.67 2bz2 s LYS 82 CO 0.64 0.59 2.01 0.52 -0.92 0.00 0.00 175.35 178.19 2bz2 h MET 83 N 5.23 0.00 0.00 1.68 2.86 -1.83 -2.24 114.93 120.64 2bz2 h MET 83 Ca -0.46 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.07 2bz2 h MET 83 Cb 1.14 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.79 2bz2 h MET 83 CO 0.49 0.00 -0.54 0.93 1.06 0.00 0.00 176.91 178.85 2bz2 h GLU 84 N 0.00 0.00 -0.04 1.72 5.08 -1.96 -2.73 114.58 116.65 2bz2 h GLU 84 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 2bz2 h GLU 84 Cb 0.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2bz2 h GLU 84 CO 0.00 0.54 -0.62 0.77 -1.00 0.00 0.00 179.01 178.70 2bz2 h SER 85 N 0.00 0.18 0.05 1.42 0.02 -1.63 -1.32 113.55 112.27 2bz2 h SER 85 Ca -0.01 -0.10 -0.18 0.00 -0.84 0.00 0.00 61.79 60.66 2bz2 h SER 85 Cb 1.27 -0.05 0.02 0.00 0.14 0.00 0.00 62.40 63.77 2bz2 h SER 85 CO 0.07 0.75 -0.72 0.00 -1.14 0.00 0.00 176.83 175.80 2bz2 h ALA 86 N 1.25 0.02 -0.32 3.77 0.00 -1.56 -2.28 119.26 120.14 2bz2 h ALA 86 Ca -0.01 -0.62 -0.08 0.00 0.00 0.00 0.00 54.91 54.20 2bz2 h ALA 86 Cb 1.12 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2bz2 h ALA 86 CO 0.09 0.39 -0.12 0.22 0.00 0.00 0.00 179.25 179.83 2bz2 h ASP 87 N -0.15 0.53 0.06 0.00 3.58 -1.49 0.34 116.42 119.29 2bz2 h ASP 87 Ca -0.10 -0.14 -0.16 0.00 0.42 0.00 0.00 57.03 57.05 2bz2 h ASP 87 Cb 1.46 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.36 2bz2 h ASP 87 CO 0.14 0.69 -0.55 -0.61 -2.88 0.00 0.00 179.24 176.03 2bz2 h GLN 88 N 0.50 0.52 0.20 0.28 5.75 -1.28 -1.19 115.11 119.90 2bz2 h GLN 88 Ca 0.09 -0.33 -0.32 0.00 -0.15 0.00 0.00 58.65 57.94 2bz2 h GLN 88 Cb 0.51 0.04 0.03 0.00 1.07 0.00 0.00 27.48 29.13 2bz2 h GLN 88 CO 0.03 0.93 -1.38 0.00 -2.65 0.00 0.00 178.83 175.76 2bz2 h ALA 89 N 1.00 -0.09 -0.05 3.38 0.00 -1.02 -2.20 119.26 120.27 2bz2 h ALA 89 Ca 0.01 -0.82 -0.09 0.00 0.00 0.00 0.00 54.91 54.00 2bz2 h ALA 89 Cb 1.08 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2bz2 h ALA 89 CO 0.10 0.70 -0.38 0.28 0.00 0.00 0.00 179.25 179.95 2bz2 h VAL 90 N 0.20 1.28 0.12 0.00 2.07 -0.34 1.30 116.25 120.89 2bz2 h VAL 90 Ca -0.23 -1.36 -0.27 0.00 0.82 0.00 0.00 66.70 65.66 2bz2 h VAL 90 Cb 2.07 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 2bz2 h VAL 90 CO 0.26 0.40 -1.22 0.00 0.02 0.00 0.00 177.57 177.03 2bz2 h ALA 91 N 1.53 0.11 0.10 1.67 0.00 -1.25 -2.00 119.26 119.42 2bz2 h ALA 91 Ca 0.01 -0.87 -0.31 0.00 0.00 0.00 0.00 54.91 53.74 2bz2 h ALA 91 Cb 0.71 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2bz2 h ALA 91 CO 0.05 0.96 -1.62 0.93 0.00 0.00 0.00 179.25 179.57 2bz2 h GLU 92 N 0.08 0.21 -0.41 0.00 5.08 -1.19 -3.37 114.58 114.98 2bz2 h GLU 92 Ca -0.13 -0.36 -0.12 0.00 -1.00 0.00 0.00 59.36 57.75 2bz2 h GLU 92 Cb 1.95 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 31.32 2bz2 h GLU 92 CO 0.20 1.17 -0.22 -0.07 -1.00 0.00 0.00 179.01 179.09 2bz2 h LEU 93 N -0.29 0.90 -9.55 1.33 3.38 0.15 -3.43 115.31 107.82 2bz2 h LEU 93 Ca -0.36 -0.41 -0.53 0.00 0.09 0.00 0.00 57.88 56.67 2bz2 h LEU 93 Cb 1.79 -0.25 0.03 0.00 0.09 0.00 0.00 40.66 42.32 2bz2 h LEU 93 CO 0.02 1.12 0.83 0.21 0.09 0.00 0.00 178.44 180.71 2bz2 s ASN 94 N -6.61 6.70 0.00 -0.43 2.47 -0.75 -3.05 114.94 113.27 2bz2 s ASN 94 Ca -0.12 2.45 0.00 0.00 0.42 0.00 0.00 52.86 55.61 2bz2 s ASN 94 Cb 0.11 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 37.32 2bz2 s ASN 94 CO 0.85 -0.76 0.00 0.61 -3.72 0.00 0.00 177.10 174.08 2bz2 n GLY 95 N 3.67 0.97 3.40 1.21 0.00 -1.26 -4.84 105.19 108.35 2bz2 n GLY 95 Ca 0.13 -0.45 -0.20 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.61 1.57 0.18 2.61 -4.23 -1.17 -5.10 115.64 106.89 2bz2 s THR 96 Ca 0.00 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 58.42 2bz2 s THR 96 Cb 0.00 -2.38 -0.05 0.00 1.34 0.00 0.00 72.50 71.41 2bz2 s THR 96 CO 0.00 -0.34 -0.02 -1.58 -0.54 0.00 0.00 174.62 172.13 2bz2 s GLN 97 N -3.74 1.15 0.00 3.99 0.74 -1.26 -3.45 119.66 117.09 2bz2 s GLN 97 Ca 0.28 -1.55 0.00 0.00 0.05 0.00 0.00 55.36 54.15 2bz2 s GLN 97 Cb 0.03 -0.44 0.00 0.00 1.10 0.00 0.00 33.01 33.70 2bz2 s GLN 97 CO 0.11 -0.07 0.00 0.28 -0.55 0.00 0.00 175.29 175.06 2bz2 n VAL 98 N -0.27 0.00 0.16 1.34 0.31 0.70 -4.92 118.33 115.65 2bz2 n VAL 98 Ca -0.07 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.44 2bz2 n VAL 98 Cb 0.63 -0.06 0.66 0.00 -0.91 0.00 0.00 33.84 34.16 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 -2.05 -3.30 114.58 119.85 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 -3.26 0.00 -4.14 1.42 3.41 -1.26 -5.16 113.62 104.63 2bz2 n SER 100 Ca 0.05 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.56 2bz2 n SER 100 Cb 0.69 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.54 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 0.08 -0.08 -3.33 1.01 -1.25 -5.16 120.40 111.68 2bz2 s VAL 101 Ca 0.00 -1.89 0.02 0.00 0.00 0.00 0.00 61.98 60.11 2bz2 s VAL 101 Cb 0.00 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2bz2 s VAL 101 CO 0.00 -0.36 -0.11 -1.10 0.00 0.00 0.00 175.10 173.52 2bz2 s GLN 102 N -4.06 1.70 0.25 2.72 -0.21 -1.26 -0.22 119.66 118.58 2bz2 s GLN 102 Ca 0.26 -0.39 0.06 0.00 0.02 0.00 0.00 55.36 55.31 2bz2 s GLN 102 Cb 0.07 -1.48 -0.03 0.00 1.00 0.00 0.00 33.01 32.57 2bz2 s GLN 102 CO 0.04 -0.05 0.34 -1.17 -2.12 0.00 0.00 175.29 172.33 2bz2 s LEU 103 N 0.92 4.19 -0.05 2.90 0.20 -1.22 -4.46 118.68 121.15 2bz2 s LEU 103 Ca -0.10 -0.02 -0.02 0.00 0.69 0.00 0.00 54.13 54.68 2bz2 s LEU 103 Cb -0.15 -2.75 0.03 0.00 -0.43 0.00 0.00 46.19 42.89 2bz2 s LEU 103 CO 0.01 -0.10 0.09 -0.75 -0.29 0.00 0.00 176.35 175.30 2bz2 s LYS 104 N -3.97 -0.04 -0.14 1.98 2.20 0.90 -4.31 119.74 116.35 2bz2 s LYS 104 Ca 0.35 0.41 -0.02 0.00 -0.36 0.00 0.00 55.97 56.35 2bz2 s LYS 104 Cb -0.09 -0.41 -0.03 0.00 -1.51 0.00 0.00 37.83 35.79 2bz2 s LYS 104 CO 0.28 -0.31 -0.06 0.08 -0.36 0.00 0.00 175.35 174.99 2bz2 s VAL 105 N 2.08 3.70 0.36 4.02 1.01 -1.26 -0.03 120.40 130.27 2bz2 s VAL 105 Ca 0.03 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2bz2 s VAL 105 Cb -0.12 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 2bz2 s VAL 105 CO -0.04 0.52 0.08 0.20 0.00 0.00 0.00 175.10 175.85 2bz2 s ASN 106 N 0.19 2.57 -0.09 3.32 0.01 0.12 -4.73 114.94 116.33 2bz2 s ASN 106 Ca -0.03 -1.48 0.03 0.00 -0.71 0.00 0.00 52.86 50.67 2bz2 s ASN 106 Cb -0.14 0.12 0.00 0.00 0.41 0.00 0.00 41.25 41.64 2bz2 s ASN 106 CO 0.03 -0.71 -0.20 -0.63 -1.51 0.00 0.00 177.10 174.08 2bz2 s ILE 107 N -3.26 1.71 -0.21 0.60 1.01 -1.26 -0.77 121.20 119.03 2bz2 s ILE 107 Ca 0.31 -0.82 -0.25 0.00 0.00 0.00 0.00 60.65 59.90 2bz2 s ILE 107 Cb 0.07 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 2bz2 s ILE 107 CO 0.15 0.48 0.83 0.00 0.00 0.00 0.00 174.94 176.40 2bz2 s ALA 108 N 0.45 3.58 0.45 9.38 0.00 -1.24 -4.92 121.76 129.47 2bz2 s ALA 108 Ca -0.17 -0.04 0.12 0.00 0.00 0.00 0.00 51.96 51.87 2bz2 s ALA 108 Cb -0.17 -3.26 1.03 0.00 0.00 0.00 0.00 23.12 20.72 2bz2 s ALA 108 CO 0.07 -0.79 2.05 0.00 0.00 0.00 0.00 175.76 177.10 2bz2 h ARG 109 N 7.50 0.34 -6.62 0.00 3.08 -1.99 -3.41 114.38 113.28 2bz2 h ARG 109 Ca -0.26 -0.02 -0.52 0.00 0.07 0.00 0.00 59.98 59.25 2bz2 h ARG 109 Cb 1.11 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 31.10 2bz2 h ARG 109 CO 0.86 0.23 0.54 0.21 -1.07 0.00 0.00 179.97 180.74 2bz2 s LYS 110 N -5.34 4.50 -0.51 0.04 2.20 -1.26 -5.00 119.74 114.37 2bz2 s LYS 110 Ca -0.07 1.82 0.04 0.00 -0.36 0.00 0.00 55.97 57.40 2bz2 s LYS 110 Cb 0.18 -3.27 0.13 0.00 -1.51 0.00 0.00 37.83 33.36 2bz2 s LYS 110 CO 0.72 -0.09 0.27 1.14 -0.36 0.00 0.00 175.35 177.03 2bz2 s GLN 111 N 0.01 1.85 0.41 4.03 -2.07 -1.26 -4.83 119.66 117.80 2bz2 s GLN 111 Ca 0.53 -2.53 -0.25 0.00 -1.82 0.00 0.00 55.36 51.29 2bz2 s GLN 111 Cb -0.31 -3.08 -0.08 0.00 -1.09 0.00 0.00 33.01 28.44 2bz2 s GLN 111 CO 0.35 -1.14 1.19 -1.25 -1.32 0.00 0.00 175.29 173.12 2bz2 s PRO 112 N -0.23 3.99 0.00 9.60 0.04 -1.26 -5.04 135.00 142.09 2bz2 s PRO 112 Ca 0.18 1.88 0.32 0.00 0.04 0.00 0.00 61.00 63.41 2bz2 s PRO 112 Cb -0.24 -2.64 1.86 0.00 0.04 0.00 0.00 34.50 33.52 2bz2 s PRO 112 CO -0.01 -0.39 2.20 -1.33 0.04 0.00 0.00 177.00 177.51