#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2z3r s MET -3 N 0.00 4.33 -0.35 0.00 -2.45 -1.26 -4.98 119.30 114.60 2z3r s MET -3 Ca 0.00 2.20 -0.21 0.00 -1.25 0.00 0.00 55.69 56.43 2z3r s MET -3 Cb 0.00 -3.12 0.00 0.00 1.25 0.00 0.00 34.83 32.96 2z3r s MET -3 CO 0.00 -0.30 0.69 0.00 1.05 0.00 0.00 175.02 176.46 2z3r s ALA -2 N -0.33 3.47 -0.18 4.11 0.00 -1.26 -5.05 121.76 122.52 2z3r s ALA -2 Ca 0.55 -0.73 -0.04 0.00 0.00 0.00 0.00 51.96 51.75 2z3r s ALA -2 Cb -0.40 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 2z3r s ALA -2 CO 0.45 -1.32 -0.03 0.42 0.00 0.00 0.00 175.76 175.27 2z3r s ILE -1 N 2.82 3.79 0.26 0.00 1.01 -1.26 -5.08 121.20 122.73 2z3r s ILE -1 Ca 0.27 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.24 2z3r s ILE -1 Cb -0.14 -2.68 -0.14 0.00 0.01 0.00 0.00 42.46 39.51 2z3r s ILE -1 CO 0.15 0.46 1.24 -0.24 0.00 0.00 0.00 174.94 176.54 2z3r n SER 0 N 3.96 2.10 -0.07 3.58 2.88 -1.26 -4.87 113.62 119.95 2z3r n SER 0 Ca -0.17 1.16 0.25 0.00 -1.33 0.00 0.00 58.87 58.78 2z3r n SER 0 Cb 0.52 -1.36 0.72 0.00 -0.75 0.00 0.00 64.21 63.34 2z3r n SER 0 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2z3r h ASN 1 N 3.18 0.00 0.64 -3.46 2.35 -1.98 -2.26 115.58 114.05 2z3r h ASN 1 Ca -0.43 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.18 2z3r h ASN 1 Cb 1.31 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.66 2z3r h ASN 1 CO 0.68 0.00 -0.63 -0.50 -1.65 0.00 0.00 177.43 175.33 2z3r h TRP 2 N 0.00 0.00 -0.74 1.19 4.06 -1.89 -0.47 115.95 118.10 2z3r h TRP 2 Ca 0.33 0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.34 2z3r h TRP 2 Cb 1.46 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.56 2z3r h TRP 2 CO 0.00 0.63 0.44 0.28 -3.56 0.00 0.00 178.44 176.23 2z3r h VAL 3 N 0.00 1.00 -0.06 1.49 2.07 -1.77 0.25 116.25 119.23 2z3r h VAL 3 Ca -0.01 -0.28 -0.18 0.00 0.82 0.00 0.00 66.70 67.05 2z3r h VAL 3 Cb 1.12 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2z3r h VAL 3 CO 0.08 0.15 -0.75 0.78 0.02 0.00 0.00 177.57 177.85 2z3r h ASN 4 N 0.80 0.45 0.10 0.57 2.35 -1.54 -1.97 115.58 116.34 2z3r h ASN 4 Ca 0.33 -0.30 0.01 0.00 -0.55 0.00 0.00 56.30 55.79 2z3r h ASN 4 Cb 0.17 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 2z3r h ASN 4 CO -0.17 1.04 -0.19 0.58 -1.65 0.00 0.00 177.43 177.04 2z3r h VAL 5 N 0.25 0.57 -0.78 2.81 2.07 -0.76 -1.42 116.25 118.98 2z3r h VAL 5 Ca -0.03 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.60 2z3r h VAL 5 Cb 1.33 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 31.58 2z3r h VAL 5 CO 0.13 0.00 0.40 0.40 0.02 0.00 0.00 177.57 178.52 2z3r h ILE 6 N -0.36 0.82 0.00 4.57 2.04 -0.39 -0.07 117.51 124.12 2z3r h ILE 6 Ca 0.03 -0.22 -0.09 0.00 1.00 0.00 0.00 64.86 65.58 2z3r h ILE 6 Cb 0.38 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2z3r h ILE 6 CO -0.11 0.12 -0.42 0.77 0.00 0.00 0.00 178.15 178.51 2z3r h SER 7 N 0.65 0.00 -0.53 1.72 4.64 -1.12 -1.88 113.55 117.03 2z3r h SER 7 Ca 0.40 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.69 2z3r h SER 7 Cb 0.46 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.53 2z3r h SER 7 CO -0.30 0.42 0.22 0.44 -0.87 0.00 0.00 176.83 176.75 2z3r h ASP 8 N 0.00 0.72 -0.97 4.97 3.32 -0.92 -1.57 116.42 121.97 2z3r h ASP 8 Ca -0.00 -0.16 0.04 0.00 0.02 0.00 0.00 57.03 56.93 2z3r h ASP 8 Cb 1.13 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 40.44 2z3r h ASP 8 CO 0.05 0.68 0.63 -0.07 -1.72 0.00 0.00 179.24 178.82 2z3r h LEU 9 N 0.71 1.04 -1.04 1.55 3.38 -0.49 0.21 115.31 120.67 2z3r h LEU 9 Ca 0.18 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 2z3r h LEU 9 Cb 0.18 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2z3r h LEU 9 CO -0.02 0.70 -0.20 0.50 0.09 0.00 0.00 178.44 179.52 2z3r h LYS 10 N 1.21 0.45 -0.08 1.13 3.11 -1.24 -0.99 116.57 120.15 2z3r h LYS 10 Ca 0.39 -0.15 -0.05 0.00 -2.81 0.00 0.00 60.65 58.04 2z3r h LYS 10 Cb 0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 32.23 31.23 2z3r h LYS 10 CO -0.13 0.63 -0.13 -0.22 -2.81 0.00 0.00 179.45 176.78 2z3r h LYS 11 N 0.41 0.23 -0.51 1.90 3.64 -0.27 -2.27 116.57 119.69 2z3r h LYS 11 Ca 0.07 -0.14 0.10 0.00 -1.27 0.00 0.00 60.65 59.41 2z3r h LYS 11 Cb 0.58 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.33 2z3r h LYS 11 CO 0.04 0.71 -0.01 0.82 -2.27 0.00 0.00 179.45 178.74 2z3r h ILE 12 N -0.23 0.59 -0.37 2.00 2.04 -0.88 -0.27 117.51 120.39 2z3r h ILE 12 Ca 0.01 -0.04 0.08 0.00 1.00 0.00 0.00 64.86 65.91 2z3r h ILE 12 Cb 0.69 0.47 -0.08 0.00 -0.74 0.00 0.00 36.82 37.16 2z3r h ILE 12 CO 0.03 0.02 -0.17 -0.33 0.00 0.00 0.00 178.15 177.69 2z3r h GLU 13 N 0.11 -0.10 -0.35 2.37 5.08 -0.90 -1.18 114.58 119.60 2z3r h GLU 13 Ca 0.26 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2z3r h GLU 13 Cb 0.39 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2z3r h GLU 13 CO -0.44 -0.07 0.15 -0.44 -1.00 0.00 0.00 179.01 177.21 2z3r h ASP 14 N -0.11 0.48 -0.52 1.42 3.45 -1.22 -3.17 116.42 116.75 2z3r h ASP 14 Ca 0.19 -0.16 -0.05 0.00 0.43 0.00 0.00 57.03 57.43 2z3r h ASP 14 Cb 0.39 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 39.01 2z3r h ASP 14 CO -0.44 0.51 0.14 -0.07 -1.57 0.00 0.00 179.24 177.80 2z3r h LEU 15 N 0.42 0.82 0.00 1.55 3.38 -0.46 -3.00 115.31 118.03 2z3r h LEU 15 Ca 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2z3r h LEU 15 Cb 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2z3r h LEU 15 CO -0.01 0.80 0.00 2.30 0.09 0.00 0.00 178.44 181.62 2z3r n ILE 16 N -4.27 0.37 -0.10 1.22 -5.35 -0.50 -3.73 119.36 107.00 2z3r n ILE 16 Ca 0.04 0.09 -0.01 0.00 -0.27 0.00 0.00 62.75 62.60 2z3r n ILE 16 Cb 0.23 -0.69 0.25 0.00 -1.74 0.00 0.00 39.64 37.69 2z3r n ILE 16 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2z3r h GLN 17 N 0.00 0.75 0.00 6.28 4.20 -1.50 -1.58 115.11 123.26 2z3r h GLN 17 Ca 0.00 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2z3r h GLN 17 Cb 0.37 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2z3r h GLN 17 CO 0.00 0.64 0.00 -1.13 -0.67 0.00 0.00 178.83 177.67 2z3r n SER 18 N -4.32 0.77 -4.93 1.46 3.41 -1.24 -4.89 113.62 103.87 2z3r n SER 18 Ca 0.04 0.61 -0.26 0.00 -0.26 0.00 0.00 58.87 59.01 2z3r n SER 18 Cb 0.18 -0.81 0.01 0.00 -0.26 0.00 0.00 64.21 63.34 2z3r n SER 18 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2z3r s MET 19 N -3.19 2.23 -0.56 4.33 -1.94 -0.59 -5.07 119.30 114.51 2z3r s MET 19 Ca 0.08 -2.02 0.06 0.00 -1.71 0.00 0.00 55.69 52.10 2z3r s MET 19 Cb 0.11 -2.16 0.23 0.00 2.01 0.00 0.00 34.83 35.01 2z3r s MET 19 CO 0.52 -0.72 0.59 -2.39 -0.01 0.00 0.00 175.02 173.00 2z3r n HIS 20 N -1.89 1.91 -3.14 -0.03 1.44 -1.26 -5.01 115.22 107.24 2z3r n HIS 20 Ca 0.01 -3.92 -0.40 0.00 -2.01 0.00 0.00 57.72 51.40 2z3r n HIS 20 Cb 0.64 -0.41 -0.06 0.00 0.12 0.00 0.00 29.99 30.28 2z3r n HIS 20 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2z3r s ILE 21 N -1.63 5.06 -0.07 0.61 -1.09 -1.26 -4.92 121.20 117.89 2z3r s ILE 21 Ca 0.35 1.19 0.11 0.00 -2.23 0.00 0.00 60.65 60.07 2z3r s ILE 21 Cb 0.11 -3.94 0.17 0.00 -1.58 0.00 0.00 42.46 37.22 2z3r s ILE 21 CO -0.09 0.18 1.06 -0.90 -1.23 0.00 0.00 174.94 173.96 2z3r n ASP 22 N 4.50 1.67 -4.76 3.58 5.68 -1.26 -4.86 116.55 121.09 2z3r n ASP 22 Ca -0.03 -2.56 -0.36 0.00 -0.50 0.00 0.00 54.79 51.34 2z3r n ASP 22 Cb 0.50 -0.29 0.01 0.00 -1.14 0.00 0.00 41.12 40.21 2z3r n ASP 22 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2z3r s ALA 23 N -1.81 2.70 -0.05 2.12 0.00 -1.26 -5.00 121.76 118.46 2z3r s ALA 23 Ca 0.18 0.94 -0.01 0.00 0.00 0.00 0.00 51.96 53.07 2z3r s ALA 23 Cb 0.16 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 2z3r s ALA 23 CO 0.02 -0.93 0.02 0.95 0.00 0.00 0.00 175.76 175.82 2z3r s THR 24 N -1.64 4.36 0.02 0.00 -4.23 -1.26 -3.99 115.64 108.89 2z3r s THR 24 Ca 0.73 -0.35 0.03 0.00 -1.18 0.00 0.00 61.69 60.92 2z3r s THR 24 Cb -0.28 -2.89 -0.01 0.00 1.34 0.00 0.00 72.50 70.66 2z3r s THR 24 CO 0.32 0.51 -0.09 -0.76 -0.54 0.00 0.00 174.62 174.05 2z3r s LEU 25 N -1.18 2.10 0.17 4.79 1.43 0.08 -4.83 118.68 121.23 2z3r s LEU 25 Ca 0.16 -0.30 -0.32 0.00 -1.03 0.00 0.00 54.13 52.65 2z3r s LEU 25 Cb -0.11 -0.39 -0.11 0.00 0.03 0.00 0.00 46.19 45.60 2z3r s LEU 25 CO 0.06 0.01 1.78 -0.31 0.23 0.00 0.00 176.35 178.13 2z3r s TYR 26 N -0.60 2.53 -0.16 0.29 2.02 -1.26 -1.29 117.35 118.88 2z3r s TYR 26 Ca -0.00 0.15 -0.04 0.00 -0.37 0.00 0.00 57.07 56.81 2z3r s TYR 26 Cb -0.06 -4.17 0.06 0.00 -0.40 0.00 0.00 41.96 37.40 2z3r s TYR 26 CO 0.00 -4.63 0.12 0.99 -1.57 0.00 0.00 175.55 170.46 2z3r s THR 27 N 1.94 -0.15 -0.62 -0.71 2.01 -0.10 -4.79 115.64 113.22 2z3r s THR 27 Ca 0.78 -0.06 -0.23 0.00 0.31 0.00 0.00 61.69 62.49 2z3r s THR 27 Cb -0.48 -0.53 0.06 0.00 0.01 0.00 0.00 72.50 71.55 2z3r s THR 27 CO 0.34 -0.19 0.96 -0.70 -0.69 0.00 0.00 174.62 174.35 2z3r s GLU 28 N 2.19 3.19 0.31 4.92 2.56 -1.26 -4.14 118.70 126.47 2z3r s GLU 28 Ca 0.03 -0.61 0.25 0.00 0.00 0.00 0.00 54.97 54.65 2z3r s GLU 28 Cb -0.15 -4.16 0.67 0.00 2.00 0.00 0.00 34.13 32.48 2z3r s GLU 28 CO -0.09 -1.71 1.72 0.77 -0.56 0.00 0.00 175.26 175.40 2z3r h SER 29 N 9.49 0.00 -2.60 -1.70 0.02 -1.96 -3.40 113.55 113.40 2z3r h SER 29 Ca -0.28 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.16 2z3r h SER 29 Cb 1.07 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.23 2z3r h SER 29 CO 1.15 0.00 -0.78 -0.62 -1.14 0.00 0.00 176.83 175.44 2z3r s ASP 30 N -5.19 3.01 -0.11 3.07 2.15 -1.26 -5.04 116.67 113.30 2z3r s ASP 30 Ca 0.09 -1.51 -0.25 0.00 0.43 0.00 0.00 52.55 51.31 2z3r s ASP 30 Cb 0.09 -0.21 -0.03 0.00 -0.30 0.00 0.00 42.92 42.48 2z3r s ASP 30 CO 0.61 -0.38 0.77 -0.69 -0.17 0.00 0.00 175.17 175.31 2z3r s VAL 31 N 1.79 4.96 0.28 1.11 1.01 -1.26 -5.04 120.40 123.24 2z3r s VAL 31 Ca 0.12 1.56 -0.27 0.00 0.00 0.00 0.00 61.98 63.38 2z3r s VAL 31 Cb -0.18 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 32.01 2z3r s VAL 31 CO -0.23 0.14 0.93 -1.00 0.00 0.00 0.00 175.10 174.93 2z3r s HIS 32 N 1.46 3.83 0.43 5.22 3.76 -1.26 -4.94 115.29 123.79 2z3r s HIS 32 Ca 0.38 1.82 0.09 0.00 -0.15 0.00 0.00 55.06 57.20 2z3r s HIS 32 Cb -0.17 -2.93 0.93 0.00 1.11 0.00 0.00 32.58 31.52 2z3r s HIS 32 CO 0.16 0.34 2.07 -1.35 -0.85 0.00 0.00 174.74 175.11 2z3r h PRO 33 N 3.66 0.45 0.00 8.40 0.11 -2.00 -0.53 132.00 142.09 2z3r h PRO 33 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2z3r h PRO 33 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2z3r h PRO 33 CO 0.66 0.30 0.00 0.66 -0.21 0.00 0.00 178.00 179.41 2z3r h SER 34 N 0.47 0.00 0.00 -2.05 4.64 -2.03 -3.03 113.55 111.54 2z3r h SER 34 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2z3r h SER 34 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2z3r h SER 34 CO -0.03 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.88 2z3r h LYS 36 N 0.00 0.33 -0.09 0.00 2.10 -1.37 -1.41 116.57 116.13 2z3r h LYS 36 Ca 0.00 -0.08 -0.24 0.00 -2.00 0.00 0.00 60.65 58.33 2z3r h LYS 36 Cb 0.88 -0.04 0.01 0.00 -0.90 0.00 0.00 32.23 32.18 2z3r h LYS 36 CO 0.00 0.47 -0.89 0.28 -2.00 0.00 0.00 179.45 177.31 2z3r h VAL 37 N 0.31 1.28 -0.38 0.07 2.07 -1.90 0.42 116.25 118.12 2z3r h VAL 37 Ca 0.06 -2.09 0.05 0.00 0.82 0.00 0.00 66.70 65.54 2z3r h VAL 37 Cb 0.42 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.29 2z3r h VAL 37 CO 0.02 0.66 0.12 0.74 0.02 0.00 0.00 177.57 179.13 2z3r h THR 38 N 0.48 0.87 -0.42 2.57 2.02 -1.82 -0.38 112.91 116.23 2z3r h THR 38 Ca -0.08 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 66.94 2z3r h THR 38 Cb 1.53 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 2z3r h THR 38 CO 0.18 0.05 0.02 0.00 0.37 0.00 0.00 175.52 176.14 2z3r h ALA 39 N 1.25 0.57 -0.71 6.16 0.00 -1.14 -2.61 119.26 122.79 2z3r h ALA 39 Ca 0.17 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2z3r h ALA 39 Cb 0.16 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2z3r h ALA 39 CO -0.19 0.33 0.42 1.98 0.00 0.00 0.00 179.25 181.79 2z3r h MET 40 N 0.57 0.75 -0.37 0.00 -1.53 -0.65 -1.14 114.93 112.56 2z3r h MET 40 Ca 0.12 -0.05 -0.01 0.00 -3.44 0.00 0.00 59.70 56.33 2z3r h MET 40 Cb 0.45 -0.17 -0.02 0.00 -0.55 0.00 0.00 31.60 31.31 2z3r h MET 40 CO 0.02 0.50 0.20 0.87 0.14 0.00 0.00 176.91 178.64 2z3r h LYS 41 N 0.78 0.49 -0.25 0.39 1.57 -0.75 -1.59 116.57 117.21 2z3r h LYS 41 Ca 0.31 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.96 2z3r h LYS 41 Cb 0.14 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2z3r h LYS 41 CO -0.16 0.36 -0.16 0.00 -0.57 0.00 0.00 179.45 178.92 2z3r h PHE 43 N 0.26 0.73 -0.41 0.00 0.04 -0.98 -1.23 116.94 115.36 2z3r h PHE 43 Ca 0.05 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.78 2z3r h PHE 43 Cb 0.69 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 2z3r h PHE 43 CO 0.07 0.32 -0.03 -0.07 -0.60 0.00 0.00 178.31 178.00 2z3r h LEU 44 N 0.70 0.73 -0.85 1.54 3.38 -1.17 0.11 115.31 119.75 2z3r h LEU 44 Ca 0.34 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2z3r h LEU 44 Cb 0.27 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 2z3r h LEU 44 CO -0.22 0.88 0.50 -0.07 0.09 0.00 0.00 178.44 179.62 2z3r h LEU 45 N 0.56 1.03 -0.15 1.67 3.38 -0.81 -3.06 115.31 117.94 2z3r h LEU 45 Ca 0.11 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 2z3r h LEU 45 Cb 0.52 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2z3r h LEU 45 CO 0.03 0.81 -0.55 -0.33 0.09 0.00 0.00 178.44 178.49 2z3r h GLU 46 N 1.17 0.00 -0.13 1.13 4.39 -1.03 -2.45 114.58 117.66 2z3r h GLU 46 Ca 0.30 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.00 2z3r h GLU 46 Cb -0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2z3r h GLU 46 CO -0.05 0.55 0.07 1.25 -1.16 0.00 0.00 179.01 179.66 2z3r h LEU 47 N 0.00 0.15 -1.42 1.33 5.85 -0.87 -2.33 115.31 118.02 2z3r h LEU 47 Ca -0.01 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.65 2z3r h LEU 47 Cb 1.36 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 2z3r h LEU 47 CO 0.07 0.13 -0.28 1.56 -0.34 0.00 0.00 178.44 179.58 2z3r h GLN 48 N 0.18 0.00 -0.38 1.25 4.20 -1.41 -1.67 115.11 117.28 2z3r h GLN 48 Ca 0.05 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 2z3r h GLN 48 Cb 0.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2z3r h GLN 48 CO -0.01 0.28 -0.06 0.28 -0.67 0.00 0.00 178.83 178.65 2z3r h VAL 49 N 0.00 1.27 -0.04 -0.54 2.07 -1.48 0.17 116.25 117.70 2z3r h VAL 49 Ca -0.00 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.41 2z3r h VAL 49 Cb 0.57 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 2z3r h VAL 49 CO 0.04 0.37 0.01 0.40 0.02 0.00 0.00 177.57 178.41 2z3r h ILE 50 N 0.51 0.99 0.01 4.57 2.04 -1.34 0.03 117.51 124.32 2z3r h ILE 50 Ca 0.10 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 65.98 2z3r h ILE 50 Cb 0.56 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 2z3r h ILE 50 CO 0.03 0.01 -0.28 -1.28 0.00 0.00 0.00 178.15 176.62 2z3r h SER 51 N 0.04 -0.84 0.12 1.72 0.87 -1.31 -1.10 113.55 113.04 2z3r h SER 51 Ca 0.02 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.69 2z3r h SER 51 Cb 0.01 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2z3r h SER 51 CO -0.02 -0.35 -0.13 0.25 -0.53 0.00 0.00 176.83 176.05 2z3r h LEU 52 N -0.44 -0.34 -2.28 2.23 6.46 -0.75 -2.46 115.31 117.73 2z3r h LEU 52 Ca 0.06 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 2z3r h LEU 52 Cb 0.52 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.57 2z3r h LEU 52 CO -0.24 -0.20 -0.05 -0.33 -0.62 0.00 0.00 178.44 177.01 2z3r h GLU 53 N -0.28 0.00 0.00 1.25 5.08 -0.94 -2.69 114.58 117.00 2z3r h GLU 53 Ca 0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2z3r h GLU 53 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2z3r h GLU 53 CO -0.04 0.05 -0.39 0.66 -1.00 0.00 0.00 179.01 178.28 2z3r h SER 54 N 0.00 0.00 -1.90 1.42 4.64 -0.69 -3.47 113.55 113.55 2z3r h SER 54 Ca -0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 2z3r h SER 54 Cb 0.19 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.19 2z3r h SER 54 CO 0.01 0.39 -0.28 0.61 -0.87 0.00 0.00 176.83 176.69 2z3r n GLY 55 N -0.40 0.88 3.36 -0.77 0.00 -1.02 -4.97 105.19 102.28 2z3r n GLY 55 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 2z3r n GLY 55 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2z3r s ASP 56 N -2.14 4.09 0.12 1.61 2.15 -1.26 -5.05 116.67 116.20 2z3r s ASP 56 Ca 0.00 -0.33 -0.32 0.00 0.43 0.00 0.00 52.55 52.33 2z3r s ASP 56 Cb 0.00 -1.64 -0.10 0.00 -0.30 0.00 0.00 42.92 40.88 2z3r s ASP 56 CO 0.00 0.13 1.57 0.00 -0.17 0.00 0.00 175.17 176.70 2z3r h ALA 57 N 7.00 -0.77 -0.76 3.66 0.00 -1.97 -1.29 119.26 125.13 2z3r h ALA 57 Ca -0.30 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2z3r h ALA 57 Cb 1.20 0.82 -0.04 0.00 0.00 0.00 0.00 17.79 19.77 2z3r h ALA 57 CO 0.57 -1.01 0.48 0.77 0.00 0.00 0.00 179.25 180.07 2z3r h SER 58 N -0.61 0.89 -0.14 0.00 0.02 -1.98 0.03 113.55 111.76 2z3r h SER 58 Ca 0.04 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2z3r h SER 58 Cb 0.68 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.99 2z3r h SER 58 CO -0.34 0.67 -0.02 0.40 -1.14 0.00 0.00 176.83 176.40 2z3r h ILE 59 N 1.04 1.27 -0.68 3.27 2.04 -1.93 -0.28 117.51 122.24 2z3r h ILE 59 Ca 0.28 -0.90 0.04 0.00 1.00 0.00 0.00 64.86 65.27 2z3r h ILE 59 Cb -0.08 1.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 2z3r h ILE 59 CO -0.06 0.26 0.42 -0.74 0.00 0.00 0.00 178.15 178.03 2z3r h HIS 60 N -0.02 0.77 -0.65 1.37 2.76 -0.87 0.10 115.15 118.63 2z3r h HIS 60 Ca 0.04 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.16 2z3r h HIS 60 Cb 0.41 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 2z3r h HIS 60 CO 0.04 0.43 0.12 -0.44 -1.30 0.00 0.00 177.93 176.78 2z3r h ASP 61 N 0.80 0.99 -0.01 3.26 3.32 -0.75 0.11 116.42 124.14 2z3r h ASP 61 Ca 0.28 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2z3r h ASP 61 Cb 0.06 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 2z3r h ASP 61 CO -0.13 0.98 -0.00 0.74 -1.72 0.00 0.00 179.24 179.11 2z3r h THR 62 N 0.99 1.29 -0.65 0.35 2.02 -0.57 -2.47 112.91 113.87 2z3r h THR 62 Ca 0.20 -0.87 0.11 0.00 0.77 0.00 0.00 66.41 66.62 2z3r h THR 62 Cb 0.40 1.88 -0.08 0.00 -1.74 0.00 0.00 68.15 68.60 2z3r h THR 62 CO 0.01 0.23 0.24 0.58 0.37 0.00 0.00 175.52 176.94 2z3r h VAL 63 N -0.35 0.72 -0.86 3.16 2.07 -0.62 -0.25 116.25 120.11 2z3r h VAL 63 Ca 0.00 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2z3r h VAL 63 Cb 0.37 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 2z3r h VAL 63 CO 0.00 0.07 0.53 -0.08 0.02 0.00 0.00 177.57 178.11 2z3r h GLU 64 N 0.40 1.15 -0.15 1.57 4.81 -0.72 -1.01 114.58 120.63 2z3r h GLU 64 Ca 0.34 -0.10 -0.20 0.00 -0.13 0.00 0.00 59.36 59.28 2z3r h GLU 64 Cb 0.46 -0.25 0.01 0.00 0.63 0.00 0.00 28.75 29.60 2z3r h GLU 64 CO -0.35 0.80 -0.67 -0.97 -0.73 0.00 0.00 179.01 177.09 2z3r h ASN 65 N 1.18 0.86 0.28 1.04 -1.24 -0.96 -0.74 115.58 116.01 2z3r h ASN 65 Ca 0.31 -0.62 -0.00 0.00 0.71 0.00 0.00 56.30 56.70 2z3r h ASN 65 Cb -0.07 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 38.71 2z3r h ASN 65 CO -0.06 1.34 -0.26 0.25 -1.29 0.00 0.00 177.43 177.41 2z3r h LEU 66 N 0.43 -0.69 -0.63 0.34 6.46 -0.71 -1.70 115.31 118.81 2z3r h LEU 66 Ca -0.04 0.06 -0.14 0.00 -0.12 0.00 0.00 57.88 57.64 2z3r h LEU 66 Cb 1.30 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 41.46 2z3r h LEU 66 CO 0.14 -0.38 -0.39 0.40 -0.62 0.00 0.00 178.44 177.59 2z3r h ILE 67 N -0.57 1.29 -0.49 4.05 2.04 -1.15 -0.38 117.51 122.31 2z3r h ILE 67 Ca -0.01 -1.56 0.10 0.00 1.00 0.00 0.00 64.86 64.39 2z3r h ILE 67 Cb 0.51 1.51 -0.09 0.00 -0.74 0.00 0.00 36.82 38.02 2z3r h ILE 67 CO -0.04 0.50 -0.04 0.40 0.00 0.00 0.00 178.15 178.96 2z3r h ILE 68 N 0.52 0.58 -0.69 -0.67 2.04 -1.16 -1.16 117.51 116.96 2z3r h ILE 68 Ca 0.05 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 2z3r h ILE 68 Cb 0.91 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 2z3r h ILE 68 CO 0.08 0.01 0.32 -0.07 0.00 0.00 0.00 178.15 178.49 2z3r h LEU 69 N 0.07 0.92 0.40 1.44 4.07 -0.55 -2.61 115.31 119.05 2z3r h LEU 69 Ca 0.24 -0.14 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 2z3r h LEU 69 Cb 0.37 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.88 2z3r h LEU 69 CO -0.44 0.80 -0.19 0.00 -1.08 0.00 0.00 178.44 177.52 2z3r h ALA 70 N 1.15 -0.54 -0.94 1.53 0.00 -0.97 -2.77 119.26 116.72 2z3r h ALA 70 Ca 0.24 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.14 2z3r h ALA 70 Cb 0.14 0.21 -0.10 0.00 0.00 0.00 0.00 17.79 18.03 2z3r h ALA 70 CO -0.03 -0.67 0.53 -0.91 0.00 0.00 0.00 179.25 178.18 2z3r h ASN 71 N -0.81 0.66 -0.10 0.00 2.35 -1.26 0.37 115.58 116.79 2z3r h ASN 71 Ca -0.06 0.10 0.03 0.00 -0.55 0.00 0.00 56.30 55.82 2z3r h ASN 71 Cb 0.54 -0.01 -0.06 0.00 0.05 0.00 0.00 38.32 38.84 2z3r h ASN 71 CO 0.09 0.23 -0.50 0.78 -1.65 0.00 0.00 177.43 176.39 2z3r h ASN 72 N 0.68 -1.57 -0.88 5.81 2.35 -1.42 -1.47 115.58 119.09 2z3r h ASN 72 Ca 0.54 0.18 0.01 0.00 -0.55 0.00 0.00 56.30 56.48 2z3r h ASN 72 Cb 0.83 0.61 -0.04 0.00 0.05 0.00 0.00 38.32 39.77 2z3r h ASN 72 CO -0.39 -0.45 0.58 0.28 -1.65 0.00 0.00 177.43 175.80 2z3r h SER 73 N -0.55 1.01 0.73 5.81 0.02 -1.04 -2.25 113.55 117.28 2z3r h SER 73 Ca 0.02 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2z3r h SER 73 Cb 0.63 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2z3r h SER 73 CO -0.38 0.72 0.00 0.18 -1.14 0.00 0.00 176.83 176.21 2z3r n LEU 74 N -4.48 0.55 0.15 5.07 4.77 0.04 -3.09 117.00 120.01 2z3r n LEU 74 Ca 0.10 0.63 -0.09 0.00 -0.03 0.00 0.00 56.01 56.62 2z3r n LEU 74 Cb 0.02 -0.55 -0.05 0.00 -2.33 0.00 0.00 43.42 40.51 2z3r n LEU 74 CO 0.36 -0.48 0.26 0.28 -1.33 0.00 0.00 177.39 176.49 2z3r h SER 75 N 0.00 -0.38 0.00 -1.43 0.02 -0.64 -3.50 113.55 107.62 2z3r h SER 75 Ca 0.00 -0.08 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 2z3r h SER 75 Cb 0.37 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 2z3r h SER 75 CO 0.00 0.08 1.07 -1.54 -1.14 0.00 0.00 176.83 175.30 2z3r n SER 76 N -5.08 1.76 -4.55 3.07 3.41 -1.18 -5.14 113.62 105.91 2z3r n SER 76 Ca -0.07 -1.96 -0.42 0.00 -0.26 0.00 0.00 58.87 56.16 2z3r n SER 76 Cb 0.22 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 2z3r n SER 76 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2z3r s THR 81 N 3.50 4.18 -0.05 6.66 2.01 -1.26 -5.12 115.64 125.56 2z3r s THR 81 Ca 0.17 0.62 0.02 0.00 0.31 0.00 0.00 61.69 62.81 2z3r s THR 81 Cb 0.06 -4.64 -0.03 0.00 0.01 0.00 0.00 72.50 67.90 2z3r s THR 81 CO -0.01 -1.24 -0.10 -1.61 -0.69 0.00 0.00 174.62 170.97 2z3r s GLU 82 N 4.51 2.64 0.05 4.92 2.02 -1.26 -5.13 118.70 126.44 2z3r s GLU 82 Ca 0.37 -0.62 0.07 0.00 0.02 0.00 0.00 54.97 54.81 2z3r s GLU 82 Cb -0.10 -2.51 -0.03 0.00 0.10 0.00 0.00 34.13 31.60 2z3r s GLU 82 CO 0.23 0.64 -0.20 -1.12 0.02 0.00 0.00 175.26 174.83 2z3r s SER 83 N -0.84 2.34 -1.28 -0.19 0.01 -1.26 -4.78 113.70 107.70 2z3r s SER 83 Ca 0.12 -0.52 -0.01 0.00 1.31 0.00 0.00 55.95 56.85 2z3r s SER 83 Cb -0.11 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 65.94 2z3r s SER 83 CO 0.02 0.13 0.85 0.61 0.41 0.00 0.00 173.24 175.26 2z3r n GLY 84 N 1.80 -0.34 3.86 3.44 0.00 -1.26 -5.03 105.19 107.67 2z3r n GLY 84 Ca -0.17 0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2z3r n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z3r n LYS 86 N -0.02 2.15 -1.22 0.00 5.02 -1.26 -5.00 118.16 117.83 2z3r n LYS 86 Ca -0.07 0.77 -0.34 0.00 -2.02 0.00 0.00 58.31 56.65 2z3r n LYS 86 Cb 0.53 -2.61 0.12 0.00 -0.02 0.00 0.00 35.03 33.04 2z3r n LYS 86 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2z3r s GLU 87 N -2.50 1.80 0.28 1.97 0.41 -1.26 -4.94 118.70 114.46 2z3r s GLU 87 Ca 0.63 1.78 -0.00 0.00 -0.41 0.00 0.00 54.97 56.96 2z3r s GLU 87 Cb -0.45 -1.79 0.48 0.00 -1.78 0.00 0.00 34.13 30.60 2z3r s GLU 87 CO 0.56 -2.10 1.88 0.00 -0.49 0.00 0.00 175.26 175.11 2z3r n GLU 89 N -4.53 0.37 0.00 0.00 4.71 -1.26 -1.76 120.64 118.17 2z3r n GLU 89 Ca 0.16 0.08 0.13 0.00 -0.01 0.00 0.00 57.16 57.52 2z3r n GLU 89 Cb 0.24 -1.50 0.42 0.00 -1.01 0.00 0.00 31.44 29.59 2z3r n GLU 89 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2z3r n GLU 90 N -1.19 0.16 -2.15 3.49 1.02 -0.80 -4.93 120.64 116.23 2z3r n GLU 90 Ca 0.11 -0.07 -0.30 0.00 -0.02 0.00 0.00 57.16 56.88 2z3r n GLU 90 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2z3r n GLU 90 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2z3r s LEU 91 N -2.89 3.39 0.42 -4.62 1.43 -0.72 -5.03 118.68 110.65 2z3r s LEU 91 Ca 0.15 1.29 -0.25 0.00 -1.03 0.00 0.00 54.13 54.30 2z3r s LEU 91 Cb 0.18 -4.30 -0.08 0.00 0.03 0.00 0.00 46.19 42.02 2z3r s LEU 91 CO 0.60 -0.75 1.17 -0.70 0.23 0.00 0.00 176.35 176.90 2z3r s GLU 92 N -4.92 3.98 -0.16 1.70 2.12 -1.26 -4.74 118.70 115.41 2z3r s GLU 92 Ca 0.53 1.81 -0.10 0.00 0.36 0.00 0.00 54.97 57.58 2z3r s GLU 92 Cb -0.11 -2.60 -0.05 0.00 0.26 0.00 0.00 34.13 31.63 2z3r s GLU 92 CO 0.49 -0.38 0.17 -1.21 -0.54 0.00 0.00 175.26 173.79 2z3r s GLU 93 N -2.41 3.97 0.30 4.30 2.02 -1.26 -0.93 118.70 124.69 2z3r s GLU 93 Ca 0.59 -0.12 0.04 0.00 0.02 0.00 0.00 54.97 55.49 2z3r s GLU 93 Cb -0.30 -3.35 -0.06 0.00 0.10 0.00 0.00 34.13 30.53 2z3r s GLU 93 CO 0.37 0.45 0.04 0.15 0.02 0.00 0.00 175.26 176.29 2z3r s LYS 94 N -0.08 1.56 1.00 1.61 1.02 -0.41 -4.79 119.74 119.65 2z3r s LYS 94 Ca 0.12 -1.85 -0.13 0.00 0.02 0.00 0.00 55.97 54.13 2z3r s LYS 94 Cb -0.12 -0.80 0.19 0.00 -0.52 0.00 0.00 37.83 36.59 2z3r s LYS 94 CO 0.01 -0.16 1.11 0.54 -0.92 0.00 0.00 175.35 175.93 2z3r s ASN 95 N -3.43 2.62 0.30 2.83 2.20 -1.26 -0.75 114.94 117.44 2z3r s ASN 95 Ca 0.35 1.05 -0.01 0.00 -0.94 0.00 0.00 52.86 53.30 2z3r s ASN 95 Cb 0.08 -1.65 0.46 0.00 -2.00 0.00 0.00 41.25 38.14 2z3r s ASN 95 CO 0.14 -3.12 1.93 0.40 -2.94 0.00 0.00 177.10 173.51 2z3r h ILE 96 N -1.89 1.21 0.02 0.54 1.08 -1.90 -0.84 117.51 115.73 2z3r h ILE 96 Ca -0.53 -0.49 -0.00 0.00 -0.39 0.00 0.00 64.86 63.45 2z3r h ILE 96 Cb 1.33 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.30 2z3r h ILE 96 CO 0.57 0.23 -0.01 0.50 -0.69 0.00 0.00 178.15 178.74 2z3r h LYS 97 N 0.99 -0.03 -0.53 2.37 3.64 -1.95 -0.64 116.57 120.43 2z3r h LYS 97 Ca 0.26 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.54 2z3r h LYS 97 Cb -0.00 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 2z3r h LYS 97 CO -0.04 0.14 -0.05 0.93 -2.27 0.00 0.00 179.45 178.16 2z3r h GLU 98 N -0.19 0.94 0.20 1.90 5.08 -1.90 -2.21 114.58 118.40 2z3r h GLU 98 Ca -0.00 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.06 2z3r h GLU 98 Cb 0.18 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2z3r h GLU 98 CO 0.00 0.96 -0.52 0.35 -1.00 0.00 0.00 179.01 178.80 2z3r h PHE 99 N 0.85 -1.50 -0.02 4.33 3.57 -1.00 -1.06 116.94 122.11 2z3r h PHE 99 Ca 0.15 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.65 2z3r h PHE 99 Cb 0.57 0.63 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 2z3r h PHE 99 CO 0.04 -0.61 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.29 2z3r h LEU 100 N -0.80 0.02 -0.35 0.59 3.38 -1.01 -0.01 115.31 117.12 2z3r h LEU 100 Ca -0.02 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2z3r h LEU 100 Cb 0.78 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2z3r h LEU 100 CO -0.24 0.17 -0.21 1.56 0.09 0.00 0.00 178.44 179.80 2z3r h GLN 101 N 0.02 0.77 0.00 1.13 4.20 -1.24 -1.44 115.11 118.55 2z3r h GLN 101 Ca 0.00 -0.35 -0.09 0.00 0.06 0.00 0.00 58.65 58.27 2z3r h GLN 101 Cb 0.26 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2z3r h GLN 101 CO 0.02 0.97 -0.41 0.77 -0.67 0.00 0.00 178.83 179.51 2z3r h SER 102 N 0.55 0.00 -0.07 1.46 0.02 -0.16 -2.46 113.55 112.89 2z3r h SER 102 Ca 0.07 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 2z3r h SER 102 Cb 0.77 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 2z3r h SER 102 CO 0.06 0.41 0.01 0.15 -1.14 0.00 0.00 176.83 176.32 2z3r h PHE 103 N 0.00 0.14 -0.60 3.45 -0.00 -0.81 -1.86 116.94 117.25 2z3r h PHE 103 Ca -0.00 -0.02 0.11 0.00 -0.00 0.00 0.00 57.97 58.05 2z3r h PHE 103 Cb 0.92 -0.04 -0.08 0.00 -0.00 0.00 0.00 35.95 36.76 2z3r h PHE 103 CO 0.00 0.37 0.17 0.28 -0.00 0.00 0.00 178.31 179.14 2z3r h VAL 104 N -0.14 0.70 -0.77 1.41 2.07 -1.13 -1.76 116.25 116.63 2z3r h VAL 104 Ca 0.02 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.51 2z3r h VAL 104 Cb 0.32 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.36 2z3r h VAL 104 CO 0.00 0.06 0.43 0.45 0.02 0.00 0.00 177.57 178.53 2z3r h HIS 105 N 0.32 0.79 -0.26 1.57 3.86 -0.97 -1.35 115.15 119.10 2z3r h HIS 105 Ca 0.31 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.40 2z3r h HIS 105 Cb 0.43 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 2z3r h HIS 105 CO -0.21 0.34 -0.45 0.97 0.86 0.00 0.00 177.93 179.43 2z3r h ILE 106 N 0.75 1.30 -0.66 2.45 2.10 -1.05 -2.87 117.51 119.53 2z3r h ILE 106 Ca 0.36 -1.65 -0.03 0.00 1.08 0.00 0.00 64.86 64.62 2z3r h ILE 106 Cb 0.30 1.58 -0.03 0.00 -1.09 0.00 0.00 36.82 37.58 2z3r h ILE 106 CO -0.23 0.53 0.27 0.58 -1.08 0.00 0.00 178.15 178.22 2z3r h VAL 107 N 0.54 1.22 -0.16 2.19 2.07 -0.86 0.11 116.25 121.37 2z3r h VAL 107 Ca 0.03 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 66.91 2z3r h VAL 107 Cb 1.00 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2z3r h VAL 107 CO 0.09 0.28 0.13 1.56 0.02 0.00 0.00 177.57 179.66 2z3r h GLN 108 N 0.94 0.00 -0.04 1.57 4.20 -1.03 -1.75 115.11 119.00 2z3r h GLN 108 Ca 0.22 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.83 2z3r h GLN 108 Cb 0.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2z3r h GLN 108 CO -0.02 0.00 -0.46 0.52 -0.67 0.00 0.00 178.83 178.20 2z3r h MET 109 N 0.00 0.10 0.00 1.46 2.86 -0.75 -3.22 114.93 115.39 2z3r h MET 109 Ca 0.07 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2z3r h MET 109 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 2z3r h MET 109 CO -0.00 0.55 -0.44 0.74 1.06 0.00 0.00 176.91 178.82 2z3r h PHE 110 N 0.09 0.00 -3.97 -0.22 0.04 -1.18 -3.46 116.94 108.24 2z3r h PHE 110 Ca 0.00 0.00 -0.49 0.00 2.80 0.00 0.00 57.97 60.28 2z3r h PHE 110 Cb 0.85 0.00 0.04 0.00 2.20 0.00 0.00 35.95 39.04 2z3r h PHE 110 CO 0.01 0.00 0.45 0.42 -0.60 0.00 0.00 178.31 178.59 2z3r s ILE 111 N -3.18 3.43 -1.78 -0.55 -1.09 -1.10 -5.01 121.20 111.93 2z3r s ILE 111 Ca 0.07 1.12 0.14 0.00 -2.23 0.00 0.00 60.65 59.75 2z3r s ILE 111 Cb 0.12 -3.59 0.11 0.00 -1.58 0.00 0.00 42.46 37.52 2z3r s ILE 111 CO 0.69 0.03 0.95 0.59 -1.23 0.00 0.00 174.94 175.97