#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 4.04 0.86 0.00 0.04 -1.26 -4.82 135.00 133.86 2bz2 s PRO 36 Ca 0.00 1.87 0.00 0.00 0.04 0.00 0.00 61.00 62.91 2bz2 s PRO 36 Cb 0.00 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2bz2 s PRO 36 CO 0.00 -0.34 0.00 0.54 0.04 0.00 0.00 177.00 177.24 2bz2 n ARG 37 N 0.07 0.00 -2.65 4.56 1.74 -1.26 -4.51 116.66 114.61 2bz2 n ARG 37 Ca 0.04 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.81 2bz2 n ARG 37 Cb 0.46 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.86 2bz2 n ARG 37 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2bz2 s LYS 38 N 0.00 3.92 0.00 5.56 1.02 -1.26 -5.04 119.74 123.94 2bz2 s LYS 38 Ca 0.00 0.78 0.00 0.00 0.02 0.00 0.00 55.97 56.77 2bz2 s LYS 38 Cb 0.00 -2.25 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 2bz2 s LYS 38 CO 0.00 -0.13 0.00 0.41 -0.92 0.00 0.00 175.35 174.71 2bz2 n GLY 39 N -1.29 1.17 3.13 -3.33 0.00 -1.26 -4.98 105.19 98.63 2bz2 n GLY 39 Ca 0.05 -0.78 0.02 0.00 0.00 0.00 0.00 46.02 45.30 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 0.20 -1.33 0.08 1.61 3.84 -1.18 -4.86 114.94 113.29 2bz2 s ASN 40 Ca 0.00 -0.51 -0.25 0.00 0.21 0.00 0.00 52.86 52.31 2bz2 s ASN 40 Cb 0.00 1.72 -0.06 0.00 -0.55 0.00 0.00 41.25 42.36 2bz2 s ASN 40 CO 0.00 -0.17 0.77 -0.89 -2.79 0.00 0.00 177.10 174.02 2bz2 s THR 41 N 2.06 4.62 0.01 -5.21 2.01 -1.26 -2.04 115.64 115.83 2bz2 s THR 41 Ca 0.15 1.65 0.04 0.00 0.31 0.00 0.00 61.69 63.84 2bz2 s THR 41 Cb -0.04 -4.12 -0.03 0.00 0.01 0.00 0.00 72.50 68.32 2bz2 s THR 41 CO -0.12 0.41 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.38 2bz2 s LEU 42 N -0.39 3.08 -0.18 4.42 1.43 0.39 -4.12 118.68 123.32 2bz2 s LEU 42 Ca 0.38 -0.20 -0.21 0.00 -1.03 0.00 0.00 54.13 53.07 2bz2 s LEU 42 Cb -0.21 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2bz2 s LEU 42 CO 0.24 0.27 0.61 -0.47 0.23 0.00 0.00 176.35 177.24 2bz2 s TYR 43 N -0.99 3.40 -0.09 0.29 5.04 -0.81 -1.69 117.35 122.49 2bz2 s TYR 43 Ca 0.17 0.94 0.04 0.00 -2.44 0.00 0.00 57.07 55.78 2bz2 s TYR 43 Cb -0.11 -2.77 -0.00 0.00 0.35 0.00 0.00 41.96 39.43 2bz2 s TYR 43 CO 0.07 -0.12 -0.23 0.08 -1.34 0.00 0.00 175.55 174.01 2bz2 s VAL 44 N 1.70 1.96 0.07 3.14 1.01 -0.29 0.94 120.40 128.93 2bz2 s VAL 44 Ca 0.29 -0.97 0.09 0.00 0.00 0.00 0.00 61.98 61.38 2bz2 s VAL 44 Cb -0.16 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 2bz2 s VAL 44 CO 0.11 0.54 -0.24 -0.47 0.00 0.00 0.00 175.10 175.04 2bz2 s TYR 45 N 0.30 2.08 0.00 5.22 5.04 0.36 -0.80 117.35 129.54 2bz2 s TYR 45 Ca -0.16 -0.39 0.00 0.00 -2.44 0.00 0.00 57.07 54.07 2bz2 s TYR 45 Cb -0.17 -1.21 0.00 0.00 0.35 0.00 0.00 41.96 40.93 2bz2 s TYR 45 CO 0.08 0.16 0.00 0.41 -1.34 0.00 0.00 175.55 174.86 2bz2 n GLY 46 N 1.57 0.76 3.68 8.97 0.00 -1.17 -0.46 105.19 118.54 2bz2 n GLY 46 Ca -0.17 -0.96 -0.23 0.00 0.00 0.00 0.00 46.02 44.65 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 2.43 -1.23 1.61 2.02 -1.26 -4.54 118.70 115.73 2bz2 s GLU 47 Ca 0.00 -1.29 -0.22 0.00 0.02 0.00 0.00 54.97 53.48 2bz2 s GLU 47 Cb 0.00 -2.27 0.01 0.00 0.10 0.00 0.00 34.13 31.97 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 -0.80 -3.80 -4.57 -0.19 8.00 -1.26 -4.94 116.55 109.00 2bz2 n ASP 48 Ca -0.07 -1.14 -0.34 0.00 0.71 0.00 0.00 54.79 53.94 2bz2 n ASP 48 Cb 0.58 -2.57 -0.11 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 -6.71 3.15 0.37 -1.24 -1.94 -1.26 -5.11 119.30 106.56 2bz2 s MET 49 Ca 0.39 -0.51 0.08 0.00 -1.71 0.00 0.00 55.69 53.95 2bz2 s MET 49 Cb -0.18 -2.76 -0.07 0.00 2.01 0.00 0.00 34.83 33.84 2bz2 s MET 49 CO 0.92 0.51 -0.05 0.95 -0.01 0.00 0.00 175.02 177.33 2bz2 s THR 50 N -0.37 2.13 -0.02 2.05 -4.23 -1.26 -5.03 115.64 108.90 2bz2 s THR 50 Ca 0.06 -2.12 -0.22 0.00 -1.18 0.00 0.00 61.69 58.22 2bz2 s THR 50 Cb -0.12 -2.78 -0.15 0.00 1.34 0.00 0.00 72.50 70.78 2bz2 s THR 50 CO 0.02 -0.12 1.01 1.55 -0.54 0.00 0.00 174.62 176.54 2bz2 h PRO 51 N 1.93 -0.38 -0.81 3.99 0.13 -1.99 -0.85 132.00 134.01 2bz2 h PRO 51 Ca -0.43 0.03 0.16 0.00 -0.87 0.00 0.00 66.00 64.89 2bz2 h PRO 51 Cb 1.25 0.09 -0.06 0.00 0.13 0.00 0.00 31.00 32.41 2bz2 h PRO 51 CO 0.75 -0.04 0.54 1.15 -0.23 0.00 0.00 178.00 180.16 2bz2 h THR 52 N -0.88 0.78 0.01 1.56 2.02 -1.97 1.07 112.91 115.50 2bz2 h THR 52 Ca -0.04 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 2bz2 h THR 52 Cb 0.52 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2bz2 h THR 52 CO 0.07 0.09 -0.01 0.25 0.37 0.00 0.00 175.52 176.29 2bz2 h LEU 53 N 0.48 -0.01 -0.10 2.58 5.85 -1.97 -2.48 115.31 119.65 2bz2 h LEU 53 Ca 0.41 -0.61 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 2bz2 h LEU 53 Cb 0.88 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 2bz2 h LEU 53 CO -0.15 0.61 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.49 2bz2 h LEU 54 N -0.65 0.17 -1.05 2.25 3.38 -0.19 -1.74 115.31 117.49 2bz2 h LEU 54 Ca -0.00 -0.31 0.18 0.00 0.09 0.00 0.00 57.88 57.84 2bz2 h LEU 54 Cb 0.63 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 2bz2 h LEU 54 CO 0.00 0.45 0.62 -0.09 0.09 0.00 0.00 178.44 179.50 2bz2 h ARG 55 N -0.10 0.74 -0.03 1.13 2.43 0.11 0.46 114.38 119.11 2bz2 h ARG 55 Ca 0.03 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.02 2bz2 h ARG 55 Cb 0.36 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2bz2 h ARG 55 CO 0.01 0.49 -0.58 0.78 -1.51 0.00 0.00 179.97 179.15 2bz2 h GLY 56 N 0.76 0.10 1.98 2.80 0.00 -1.17 2.12 103.07 109.66 2bz2 h GLY 56 Ca 0.56 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2bz2 h GLY 56 CO -0.35 0.11 -0.02 0.00 0.00 0.00 0.00 176.54 176.28 2bz2 h ALA 57 N 1.34 0.99 -0.00 3.60 0.00 0.61 -3.28 119.26 122.52 2bz2 h ALA 57 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bz2 h ALA 57 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2bz2 h ALA 57 CO 0.08 0.00 -0.01 1.19 0.00 0.00 0.00 179.25 180.51 2bz2 n PHE 58 N -2.87 0.00 0.06 0.00 3.01 0.11 -4.64 117.46 113.13 2bz2 n PHE 58 Ca 0.04 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.38 2bz2 n PHE 58 Cb 0.50 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.89 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 0.22 -0.16 0.72 4.37 0.02 0.34 -3.22 113.55 115.83 2bz2 h SER 59 Ca 0.00 -0.35 -0.02 0.00 -0.84 0.00 0.00 61.79 60.58 2bz2 h SER 59 Cb 0.05 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 2bz2 h SER 59 CO 0.00 0.30 -0.10 1.55 -1.14 0.00 0.00 176.83 177.44 2bz2 h PRO 60 N -0.68 0.00 0.00 3.45 0.13 -1.80 -2.57 132.00 130.54 2bz2 h PRO 60 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 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 0.03 0.10 0.00 0.74 -0.23 0.00 0.00 178.00 178.64 2bz2 h PHE 61 N 0.00 0.00 0.00 1.56 0.04 -1.82 -3.48 116.94 113.24 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 0.48 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.63 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 0.42 0.49 3.79 -1.45 0.00 -0.97 -4.54 105.19 102.94 2bz2 n GLY 62 Ca 0.02 -1.32 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.21 1.61 0.01 -1.26 -4.43 114.94 117.76 2bz2 s ASN 63 Ca 0.00 1.31 -0.09 0.00 -0.71 0.00 0.00 52.86 53.37 2bz2 s ASN 63 Cb 0.00 -2.39 -0.04 0.00 0.41 0.00 0.00 41.25 39.23 2bz2 s ASN 63 CO 0.00 0.22 0.10 -0.63 -1.51 0.00 0.00 177.10 175.29 2bz2 s ILE 64 N -0.91 4.97 -0.47 0.60 1.01 -1.26 -2.72 121.20 122.43 2bz2 s ILE 64 Ca 0.31 0.04 0.22 0.00 0.00 0.00 0.00 60.65 61.22 2bz2 s ILE 64 Cb -0.20 -3.28 -0.17 0.00 0.01 0.00 0.00 42.46 38.82 2bz2 s ILE 64 CO 0.20 0.40 0.89 2.30 0.00 0.00 0.00 174.94 178.73 2bz2 n ILE 65 N 3.99 0.16 -3.39 2.92 -5.35 -1.21 -4.77 119.36 111.72 2bz2 n ILE 65 Ca -0.16 -0.31 -0.16 0.00 -0.27 0.00 0.00 62.75 61.84 2bz2 n ILE 65 Cb 0.52 0.18 -0.09 0.00 -1.74 0.00 0.00 39.64 38.51 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 -4.13 1.50 -0.19 7.28 2.15 -1.26 -5.07 116.67 116.95 2bz2 s ASP 66 Ca 0.01 -0.83 -0.05 0.00 0.43 0.00 0.00 52.55 52.11 2bz2 s ASP 66 Cb 0.14 0.56 -0.02 0.00 -0.30 0.00 0.00 42.92 43.30 2bz2 s ASP 66 CO 0.83 -0.37 -0.01 -0.22 -0.17 0.00 0.00 175.17 175.23 2bz2 s LEU 67 N 2.26 3.23 0.12 -1.34 0.20 -1.26 -2.46 118.68 119.43 2bz2 s LEU 67 Ca 0.10 -0.20 0.08 0.00 0.69 0.00 0.00 54.13 54.81 2bz2 s LEU 67 Cb -0.14 -1.81 -0.04 0.00 -0.43 0.00 0.00 46.19 43.78 2bz2 s LEU 67 CO -0.29 0.08 -0.20 -0.44 -0.29 0.00 0.00 176.35 175.21 2bz2 s SER 68 N 0.87 2.61 0.09 3.68 0.01 -0.89 -5.01 113.70 115.06 2bz2 s SER 68 Ca 0.00 -0.74 0.08 0.00 1.31 0.00 0.00 55.95 56.61 2bz2 s SER 68 Cb -0.14 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 2bz2 s SER 68 CO 0.02 0.04 -0.21 -0.04 0.41 0.00 0.00 173.24 173.46 2bz2 s MET 69 N -2.16 1.16 -0.44 12.44 -1.94 -1.26 -0.67 119.30 126.44 2bz2 s MET 69 Ca 0.09 -1.13 0.02 0.00 -1.71 0.00 0.00 55.69 52.97 2bz2 s MET 69 Cb -0.09 -1.41 0.13 0.00 2.01 0.00 0.00 34.83 35.47 2bz2 s MET 69 CO 0.05 0.33 0.21 -0.51 -0.01 0.00 0.00 175.02 175.10 2bz2 s ASP 70 N -1.79 3.93 0.29 3.03 1.01 0.53 -4.93 116.67 118.73 2bz2 s ASP 70 Ca 0.07 -2.58 0.14 0.00 0.71 0.00 0.00 52.55 50.88 2bz2 s ASP 70 Cb -0.10 -1.20 0.35 0.00 1.01 0.00 0.00 42.92 42.98 2bz2 s ASP 70 CO 0.04 -0.28 1.58 1.55 0.21 0.00 0.00 175.17 178.27 2bz2 h PRO 71 N 6.88 0.00 0.00 8.23 0.13 -1.96 0.19 132.00 145.47 2bz2 h PRO 71 Ca -0.04 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.02 2bz2 h PRO 71 Cb 0.93 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2bz2 h PRO 71 CO 0.53 0.57 -0.32 -1.00 -0.23 0.00 0.00 178.00 177.56 2bz2 h PRO 72 N 0.00 0.00 -0.01 1.56 0.13 -1.93 -3.25 132.00 128.50 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 0.32 0.00 0.54 -0.23 0.00 0.00 178.00 178.70 2bz2 n ARG 73 N -3.30 -0.25 -3.35 0.86 1.74 -1.22 -4.99 116.66 106.14 2bz2 n ARG 73 Ca 0.01 -0.80 -0.18 0.00 -0.77 0.00 0.00 57.85 56.11 2bz2 n ARG 73 Cb 0.56 -1.08 0.07 0.00 -1.02 0.00 0.00 32.46 30.98 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 0.23 -4.89 -4.18 0.55 5.03 -0.12 -4.97 115.26 106.91 2bz2 n ASN 74 Ca 0.03 -0.45 -0.12 0.00 0.87 0.00 0.00 54.58 54.91 2bz2 n ASN 74 Cb 0.12 -4.20 -0.10 0.00 -1.02 0.00 0.00 39.78 34.57 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 -3.26 0.30 -0.05 0.00 0.00 0.02 0.20 121.76 118.96 2bz2 s ALA 76 Ca 0.10 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 51.22 2bz2 s ALA 76 Cb 0.03 0.23 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2bz2 s ALA 76 CO -0.03 -0.29 -0.25 -0.06 0.00 0.00 0.00 175.76 175.13 2bz2 s PHE 77 N -2.91 2.35 -0.13 0.00 0.08 0.16 -1.14 117.98 116.39 2bz2 s PHE 77 Ca -0.02 -0.64 0.02 0.00 0.12 0.00 0.00 56.93 56.41 2bz2 s PHE 77 Cb 0.01 -1.54 0.01 0.00 -0.57 0.00 0.00 43.02 40.93 2bz2 s PHE 77 CO -0.06 -0.17 -0.20 0.08 -0.10 0.00 0.00 175.22 174.77 2bz2 s VAL 78 N -0.25 1.89 -0.08 -0.44 1.01 -0.68 -2.10 120.40 119.74 2bz2 s VAL 78 Ca -0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 2bz2 s VAL 78 Cb -0.13 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2bz2 s VAL 78 CO 0.02 0.52 -0.05 -0.89 0.00 0.00 0.00 175.10 174.70 2bz2 s THR 79 N 0.86 3.85 -0.03 3.92 2.01 -1.03 0.15 115.64 125.36 2bz2 s THR 79 Ca -0.07 -0.42 0.08 0.00 0.31 0.00 0.00 61.69 61.59 2bz2 s THR 79 Cb -0.15 -2.60 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 2bz2 s THR 79 CO -0.02 0.59 -0.26 -0.31 -0.69 0.00 0.00 174.62 173.93 2bz2 s TYR 80 N -0.65 2.35 0.35 4.92 2.02 -0.87 -3.31 117.35 122.17 2bz2 s TYR 80 Ca 0.10 -0.51 0.28 0.00 -0.37 0.00 0.00 57.07 56.57 2bz2 s TYR 80 Cb -0.12 -1.52 1.40 0.00 -0.40 0.00 0.00 41.96 41.32 2bz2 s TYR 80 CO 0.02 -0.08 2.04 1.49 -1.57 0.00 0.00 175.55 177.44 2bz2 h GLU 81 N 5.64 0.00 -6.24 -0.62 4.81 -1.86 -3.13 114.58 113.17 2bz2 h GLU 81 Ca -0.40 0.00 -0.69 0.00 -0.13 0.00 0.00 59.36 58.14 2bz2 h GLU 81 Cb 1.13 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.21 2bz2 h GLU 81 CO 0.47 0.13 -0.89 0.15 -0.73 0.00 0.00 179.01 178.14 2bz2 s LYS 82 N -4.05 2.37 0.49 1.92 1.02 -1.26 -4.80 119.74 115.42 2bz2 s LYS 82 Ca -0.02 -0.91 0.23 0.00 0.02 0.00 0.00 55.97 55.29 2bz2 s LYS 82 Cb 0.12 -2.11 1.27 0.00 -0.52 0.00 0.00 37.83 36.59 2bz2 s LYS 82 CO 0.58 0.45 2.02 0.52 -0.92 0.00 0.00 175.35 178.00 2bz2 h MET 83 N 5.84 0.00 0.00 1.68 2.86 -1.89 -1.66 114.93 121.76 2bz2 h MET 83 Ca -0.36 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.23 2bz2 h MET 83 Cb 1.15 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 2bz2 h MET 83 CO 0.47 0.16 -0.23 0.93 1.06 0.00 0.00 176.91 179.30 2bz2 h GLU 84 N 0.00 0.00 0.00 1.72 4.39 -1.96 -2.31 114.58 116.42 2bz2 h GLU 84 Ca -0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 2bz2 h GLU 84 Cb 0.38 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 2bz2 h GLU 84 CO 0.02 0.23 -0.57 0.77 -1.16 0.00 0.00 179.01 178.31 2bz2 h SER 85 N 0.00 0.00 0.48 1.42 0.02 -1.53 -2.39 113.55 111.55 2bz2 h SER 85 Ca -0.00 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.67 2bz2 h SER 85 Cb 0.59 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.15 2bz2 h SER 85 CO 0.03 0.57 -1.23 0.00 -1.14 0.00 0.00 176.83 175.05 2bz2 h ALA 86 N 1.43 0.09 -0.26 3.77 0.00 -1.45 -2.58 119.26 120.26 2bz2 h ALA 86 Ca -0.01 -0.84 -0.14 0.00 0.00 0.00 0.00 54.91 53.92 2bz2 h ALA 86 Cb 1.12 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2bz2 h ALA 86 CO 0.07 0.87 -0.42 -0.44 0.00 0.00 0.00 179.25 179.34 2bz2 h ASP 87 N 0.13 0.66 -0.27 0.00 3.32 -1.42 -1.24 116.42 117.61 2bz2 h ASP 87 Ca -0.15 -0.30 -0.15 0.00 0.02 0.00 0.00 57.03 56.45 2bz2 h ASP 87 Cb 1.93 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 41.30 2bz2 h ASP 87 CO 0.21 0.99 -0.42 -0.61 -1.72 0.00 0.00 179.24 177.69 2bz2 h GLN 88 N 0.51 0.76 -0.30 3.56 4.15 -1.48 -1.26 115.11 121.04 2bz2 h GLN 88 Ca 0.04 -0.46 -0.05 0.00 0.77 0.00 0.00 58.65 58.96 2bz2 h GLN 88 Cb 0.93 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.66 2bz2 h GLN 88 CO 0.08 1.09 0.01 0.00 -1.93 0.00 0.00 178.83 178.08 2bz2 h ALA 89 N 0.67 0.40 0.00 3.38 0.00 -1.38 -1.59 119.26 120.74 2bz2 h ALA 89 Ca 0.02 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2bz2 h ALA 89 Cb 1.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 2bz2 h ALA 89 CO 0.10 0.14 -0.19 0.28 0.00 0.00 0.00 179.25 179.58 2bz2 h VAL 90 N 0.32 0.66 0.00 0.00 2.07 -1.22 1.77 116.25 119.85 2bz2 h VAL 90 Ca 0.09 -0.82 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 2bz2 h VAL 90 Cb 0.41 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2bz2 h VAL 90 CO 0.01 0.19 -0.30 0.00 0.02 0.00 0.00 177.57 177.49 2bz2 h ALA 91 N 1.81 0.82 0.00 1.67 0.00 -0.78 -3.15 119.26 119.63 2bz2 h ALA 91 Ca -0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2bz2 h ALA 91 Cb 0.51 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2bz2 h ALA 91 CO 0.02 0.34 -0.80 0.39 0.00 0.00 0.00 179.25 179.21 2bz2 n GLU 92 N -3.16 0.13 0.18 0.00 1.02 -0.64 -4.64 120.64 113.54 2bz2 n GLU 92 Ca 0.03 0.05 0.15 0.00 -0.02 0.00 0.00 57.16 57.37 2bz2 n GLU 92 Cb 0.64 -0.72 0.74 0.00 -0.02 0.00 0.00 31.44 32.08 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 -0.23 0.00 -9.19 -4.62 3.38 0.25 -3.40 115.31 101.50 2bz2 h LEU 93 Ca -0.08 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.32 2bz2 h LEU 93 Cb 0.69 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 2bz2 h LEU 93 CO -0.05 0.00 0.70 0.21 0.09 0.00 0.00 178.44 179.39 2bz2 s ASN 94 N -6.38 7.14 0.00 -0.43 3.84 -1.13 -3.38 114.94 114.60 2bz2 s ASN 94 Ca -0.05 1.52 0.00 0.00 0.21 0.00 0.00 52.86 54.54 2bz2 s ASN 94 Cb 0.17 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 2bz2 s ASN 94 CO 0.64 -0.57 0.00 0.61 -2.79 0.00 0.00 177.10 174.98 2bz2 n GLY 95 N 3.25 1.29 3.63 1.21 0.00 -1.25 -4.85 105.19 108.47 2bz2 n GLY 95 Ca 0.11 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.06 2.73 0.11 2.61 -4.23 -1.22 -5.05 115.64 108.53 2bz2 s THR 96 Ca 0.00 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.61 2bz2 s THR 96 Cb 0.00 -2.78 -0.04 0.00 1.34 0.00 0.00 72.50 71.03 2bz2 s THR 96 CO 0.00 -0.23 -0.19 -1.58 -0.54 0.00 0.00 174.62 172.08 2bz2 s GLN 97 N -3.70 1.09 0.00 3.99 0.74 -1.26 -2.91 119.66 117.61 2bz2 s GLN 97 Ca 0.34 -1.18 0.00 0.00 0.05 0.00 0.00 55.36 54.57 2bz2 s GLN 97 Cb -0.01 -1.24 0.00 0.00 1.10 0.00 0.00 33.01 32.85 2bz2 s GLN 97 CO 0.19 0.28 0.00 0.28 -0.55 0.00 0.00 175.29 175.49 2bz2 n VAL 98 N 0.92 0.00 -0.01 1.34 0.31 0.99 -4.90 118.33 116.98 2bz2 n VAL 98 Ca -0.18 0.00 0.23 0.00 -0.01 0.00 0.00 64.34 64.38 2bz2 n VAL 98 Cb 0.55 -0.73 0.61 0.00 -0.91 0.00 0.00 33.84 33.36 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 4.39 -2.01 -3.28 114.58 119.23 2bz2 h GLU 99 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2bz2 h GLU 99 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2bz2 h GLU 99 CO 0.00 0.00 -0.01 0.43 -1.16 0.00 0.00 179.01 178.27 2bz2 n SER 100 N -3.45 -0.05 -4.12 1.42 7.64 -1.26 -5.16 113.62 108.64 2bz2 n SER 100 Ca 0.13 -0.71 -0.10 0.00 1.01 0.00 0.00 58.87 59.20 2bz2 n SER 100 Cb 0.98 0.02 -0.09 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 0.08 -0.12 0.44 1.01 -1.24 -5.11 120.40 115.46 2bz2 s VAL 101 Ca 0.00 -1.83 0.03 0.00 0.00 0.00 0.00 61.98 60.18 2bz2 s VAL 101 Cb 0.01 -2.08 0.01 0.00 0.00 0.00 0.00 36.38 34.32 2bz2 s VAL 101 CO -0.00 -0.36 -0.22 -1.10 0.00 0.00 0.00 175.10 173.41 2bz2 s GLN 102 N -4.05 2.97 -0.22 2.72 -0.21 -1.26 -0.01 119.66 119.61 2bz2 s GLN 102 Ca 0.25 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 54.59 2bz2 s GLN 102 Cb 0.07 -2.34 -0.02 0.00 1.00 0.00 0.00 33.01 31.71 2bz2 s GLN 102 CO 0.03 0.06 0.60 -0.51 -2.12 0.00 0.00 175.29 173.36 2bz2 s LEU 103 N 0.63 4.12 -0.17 2.90 1.43 -1.15 -4.56 118.68 121.88 2bz2 s LEU 103 Ca -0.12 0.75 -0.04 0.00 -1.03 0.00 0.00 54.13 53.69 2bz2 s LEU 103 Cb -0.16 -2.83 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 2bz2 s LEU 103 CO 0.03 -0.28 -0.02 -0.54 0.23 0.00 0.00 176.35 175.76 2bz2 s LYS 104 N 2.04 3.67 0.00 1.70 1.02 0.39 -3.93 119.74 124.63 2bz2 s LYS 104 Ca 0.27 -0.51 0.06 0.00 0.02 0.00 0.00 55.97 55.81 2bz2 s LYS 104 Cb -0.16 -2.99 -0.03 0.00 -0.52 0.00 0.00 37.83 34.14 2bz2 s LYS 104 CO 0.10 0.16 -0.18 0.08 -0.92 0.00 0.00 175.35 174.58 2bz2 s VAL 105 N 0.60 2.73 0.16 3.17 1.01 -1.26 0.14 120.40 126.94 2bz2 s VAL 105 Ca -0.02 -1.02 0.03 0.00 0.00 0.00 0.00 61.98 60.97 2bz2 s VAL 105 Cb -0.14 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 2bz2 s VAL 105 CO 0.02 0.46 0.12 0.59 0.00 0.00 0.00 175.10 176.30 2bz2 n ASN 106 N 1.96 -0.13 -4.64 3.32 5.03 0.27 -4.97 115.26 116.10 2bz2 n ASN 106 Ca -0.16 -1.99 -0.34 0.00 0.87 0.00 0.00 54.58 52.95 2bz2 n ASN 106 Cb 0.52 0.72 -0.10 0.00 -1.02 0.00 0.00 39.78 39.90 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 -2.56 4.04 0.42 2.41 1.01 -1.26 -1.92 121.20 123.33 2bz2 s ILE 107 Ca 0.17 -0.39 0.10 0.00 0.00 0.00 0.00 60.65 60.53 2bz2 s ILE 107 Cb 0.01 -2.69 0.29 0.00 0.01 0.00 0.00 42.46 40.08 2bz2 s ILE 107 CO 0.12 0.57 2.03 0.00 0.00 0.00 0.00 174.94 177.66 2bz2 h ALA 108 N 5.09 1.83 -4.06 9.38 0.00 -1.93 -3.41 119.26 126.16 2bz2 h ALA 108 Ca -0.50 -0.02 -0.69 0.00 0.00 0.00 0.00 54.91 53.70 2bz2 h ALA 108 Cb 1.18 -0.13 -0.23 0.00 0.00 0.00 0.00 17.79 18.61 2bz2 h ALA 108 CO 0.54 0.10 -0.82 0.50 0.00 0.00 0.00 179.25 179.57 2bz2 s ARG 109 N -5.45 2.02 -0.07 0.00 3.52 -1.26 -5.09 118.95 112.61 2bz2 s ARG 109 Ca -0.08 -1.00 0.04 0.00 -0.13 0.00 0.00 55.73 54.55 2bz2 s ARG 109 Cb 0.18 -2.14 0.00 0.00 -1.56 0.00 0.00 34.95 31.44 2bz2 s ARG 109 CO 0.74 0.54 -0.19 0.21 -0.81 0.00 0.00 175.30 175.78 2bz2 s LYS 110 N -1.35 2.27 0.65 5.12 2.20 -1.26 -5.12 119.74 122.25 2bz2 s LYS 110 Ca 0.14 -0.68 -0.18 0.00 -0.36 0.00 0.00 55.97 54.89 2bz2 s LYS 110 Cb -0.10 -1.83 -0.01 0.00 -1.51 0.00 0.00 37.83 34.38 2bz2 s LYS 110 CO 0.04 0.18 1.27 1.14 -0.36 0.00 0.00 175.35 177.62 2bz2 s GLN 111 N 0.29 2.55 0.45 4.03 -2.07 -1.26 -4.88 119.66 118.76 2bz2 s GLN 111 Ca -0.12 1.98 0.30 0.00 -1.82 0.00 0.00 55.36 55.71 2bz2 s GLN 111 Cb -0.15 -1.86 1.25 0.00 -1.09 0.00 0.00 33.01 31.16 2bz2 s GLN 111 CO 0.05 -1.57 1.89 -1.00 -1.32 0.00 0.00 175.29 173.34 2bz2 h PRO 112 N 0.48 0.00 -0.02 9.60 0.13 -2.08 -3.56 132.00 136.54 2bz2 h PRO 112 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2bz2 h PRO 112 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2bz2 h PRO 112 CO 0.53 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 176.97