#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2z3r h MET -3 N 0.00 0.46 -0.93 0.00 1.85 -2.05 -0.69 114.93 113.57 2z3r h MET -3 Ca 0.00 -0.14 0.07 0.00 -0.61 0.00 0.00 59.70 59.02 2z3r h MET -3 Cb 0.00 -0.04 -0.06 0.00 0.43 0.00 0.00 31.60 31.92 2z3r h MET -3 CO 0.00 0.61 0.60 0.00 -0.40 0.00 0.00 176.91 177.73 2z3r h ALA -2 N 0.83 1.50 -0.18 0.39 0.00 -1.95 0.78 119.26 120.62 2z3r h ALA -2 Ca 0.08 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 2z3r h ALA -2 Cb 0.40 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2z3r h ALA -2 CO 0.01 0.36 -0.45 0.82 0.00 0.00 0.00 179.25 179.99 2z3r h ILE -1 N 1.05 1.33 -0.97 0.00 2.04 -1.92 -2.37 117.51 116.67 2z3r h ILE -1 Ca 0.41 -1.69 0.08 0.00 1.00 0.00 0.00 64.86 64.65 2z3r h ILE -1 Cb 0.22 1.93 -0.07 0.00 -0.74 0.00 0.00 36.82 38.15 2z3r h ILE -1 CO -0.16 0.52 0.63 0.28 0.00 0.00 0.00 178.15 179.42 2z3r h SER 0 N 0.30 0.96 -0.27 1.72 0.02 -0.36 -0.80 113.55 115.12 2z3r h SER 0 Ca -0.00 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2z3r h SER 0 Cb 1.06 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 2z3r h SER 0 CO 0.10 0.59 0.10 0.78 -1.14 0.00 0.00 176.83 177.26 2z3r h ASN 1 N 1.07 0.38 -0.15 3.07 2.35 -0.82 0.12 115.58 121.60 2z3r h ASN 1 Ca 0.43 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.91 2z3r h ASN 1 Cb 0.27 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2z3r h ASN 1 CO -0.19 0.45 -0.23 -0.50 -1.65 0.00 0.00 177.43 175.31 2z3r h TRP 2 N 0.28 0.67 -0.58 1.19 -0.00 -0.88 0.61 115.95 117.24 2z3r h TRP 2 Ca 0.09 -0.14 -0.01 0.00 -0.00 0.00 0.00 58.89 58.83 2z3r h TRP 2 Cb 0.19 -0.16 -0.03 0.00 -0.00 0.00 0.00 29.16 29.16 2z3r h TRP 2 CO -0.00 0.78 0.33 0.28 -0.00 0.00 0.00 178.44 179.82 2z3r h VAL 3 N 0.52 1.18 -0.53 1.49 2.07 -0.76 -1.58 116.25 118.64 2z3r h VAL 3 Ca 0.08 -0.45 -0.09 0.00 0.82 0.00 0.00 66.70 67.05 2z3r h VAL 3 Cb 0.68 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2z3r h VAL 3 CO 0.05 0.20 -0.04 0.78 0.02 0.00 0.00 177.57 178.58 2z3r h ASN 4 N 0.78 0.91 -0.47 0.57 2.35 -0.13 -2.51 115.58 117.07 2z3r h ASN 4 Ca 0.20 -0.26 0.09 0.00 -0.55 0.00 0.00 56.30 55.79 2z3r h ASN 4 Cb 0.03 -0.24 -0.08 0.00 0.05 0.00 0.00 38.32 38.07 2z3r h ASN 4 CO -0.03 0.99 -0.00 0.58 -1.65 0.00 0.00 177.43 177.31 2z3r h VAL 5 N 0.85 0.63 -0.56 2.81 2.07 0.53 0.21 116.25 122.79 2z3r h VAL 5 Ca 0.15 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.69 2z3r h VAL 5 Cb 0.55 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 2z3r h VAL 5 CO 0.03 0.02 0.26 0.40 0.02 0.00 0.00 177.57 178.31 2z3r h ILE 6 N 0.11 0.91 -0.59 4.57 2.04 -1.09 0.43 117.51 123.90 2z3r h ILE 6 Ca 0.24 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 2z3r h ILE 6 Cb 0.35 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 2z3r h ILE 6 CO -0.40 0.09 0.34 -1.28 0.00 0.00 0.00 178.15 176.90 2z3r h SER 7 N 0.50 0.71 -0.17 1.72 0.87 -0.87 0.21 113.55 116.52 2z3r h SER 7 Ca 0.26 -0.04 -0.14 0.00 -1.23 0.00 0.00 61.79 60.63 2z3r h SER 7 Cb 0.20 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 2z3r h SER 7 CO -0.20 0.56 -0.40 0.44 -0.53 0.00 0.00 176.83 176.69 2z3r h ASP 8 N 0.81 0.75 -0.70 6.23 3.32 -0.33 -2.02 116.42 124.48 2z3r h ASP 8 Ca 0.21 -0.34 0.03 0.00 0.02 0.00 0.00 57.03 56.95 2z3r h ASP 8 Cb -0.01 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.29 2z3r h ASP 8 CO -0.04 1.06 0.43 -0.07 -1.72 0.00 0.00 179.24 178.91 2z3r h LEU 9 N 0.58 0.71 -0.84 1.55 3.38 0.16 -0.40 115.31 120.44 2z3r h LEU 9 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2z3r h LEU 9 Cb 0.94 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2z3r h LEU 9 CO 0.09 0.49 0.15 0.50 0.09 0.00 0.00 178.44 179.75 2z3r h LYS 10 N 0.84 1.01 0.14 1.13 3.64 -1.04 -0.39 116.57 121.91 2z3r h LYS 10 Ca 0.29 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2z3r h LYS 10 Cb 0.04 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2z3r h LYS 10 CO -0.12 0.90 -0.07 -0.22 -2.27 0.00 0.00 179.45 177.68 2z3r h LYS 11 N 0.97 -0.18 -0.61 1.90 3.64 -0.81 -1.85 116.57 119.62 2z3r h LYS 11 Ca 0.20 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.69 2z3r h LYS 11 Cb 0.35 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.14 2z3r h LYS 11 CO 0.00 -0.04 0.23 0.82 -2.27 0.00 0.00 179.45 178.20 2z3r h ILE 12 N -0.29 0.78 -0.53 2.00 2.04 -0.99 -0.42 117.51 120.10 2z3r h ILE 12 Ca -0.02 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.72 2z3r h ILE 12 Cb 0.23 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 2z3r h ILE 12 CO 0.03 0.08 0.31 -0.08 0.00 0.00 0.00 178.15 178.49 2z3r h GLU 13 N 0.42 0.60 0.22 2.37 4.81 -1.01 -1.65 114.58 120.34 2z3r h GLU 13 Ca 0.30 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 2z3r h GLU 13 Cb 0.36 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.61 2z3r h GLU 13 CO -0.30 0.40 -0.11 0.22 -0.73 0.00 0.00 179.01 178.50 2z3r h ASP 14 N 0.62 -0.25 -0.69 1.04 1.82 -0.78 -3.07 116.42 115.10 2z3r h ASP 14 Ca 0.22 -0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.74 2z3r h ASP 14 Cb 0.04 0.07 -0.03 0.00 0.68 0.00 0.00 39.33 40.08 2z3r h ASP 14 CO -0.11 -0.06 0.34 -0.07 -1.61 0.00 0.00 179.24 177.73 2z3r h LEU 15 N -0.44 0.92 0.00 2.28 3.38 -0.96 -2.53 115.31 117.97 2z3r h LEU 15 Ca -0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2z3r h LEU 15 Cb 0.33 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2z3r h LEU 15 CO 0.05 0.78 0.00 2.30 0.09 0.00 0.00 178.44 181.66 2z3r n ILE 16 N -4.33 0.05 0.00 1.22 -5.35 -0.63 -4.28 119.36 106.04 2z3r n ILE 16 Ca 0.07 0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.56 2z3r n ILE 16 Cb 0.14 -0.55 0.00 0.00 -1.74 0.00 0.00 39.64 37.49 2z3r n ILE 16 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46 2z3r n GLN 17 N -1.19 0.00 0.33 6.28 -0.06 -0.95 -2.38 117.38 119.41 2z3r n GLN 17 Ca 0.16 0.59 0.22 0.00 -2.00 0.00 0.00 57.00 55.97 2z3r n GLN 17 Cb 0.18 -0.98 1.15 0.00 -4.06 0.00 0.00 30.24 26.54 2z3r n GLN 17 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2z3r h SER 18 N 0.00 0.00 -3.97 1.69 4.64 -1.81 -3.45 113.55 110.65 2z3r h SER 18 Ca 0.00 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.86 2z3r h SER 18 Cb 0.00 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.22 2z3r h SER 18 CO 0.00 0.00 0.36 -0.04 -0.87 0.00 0.00 176.83 176.28 2z3r s MET 19 N -4.14 1.33 -0.55 4.77 -1.94 -1.00 -5.01 119.30 112.75 2z3r s MET 19 Ca -0.04 -0.31 0.04 0.00 -1.71 0.00 0.00 55.69 53.66 2z3r s MET 19 Cb 0.13 -1.97 0.39 0.00 2.01 0.00 0.00 34.83 35.39 2z3r s MET 19 CO 0.43 -1.93 1.24 0.72 -0.01 0.00 0.00 175.02 175.47 2z3r n HIS 20 N -3.43 3.46 -2.79 -0.03 -0.00 -1.26 -5.01 115.22 106.16 2z3r n HIS 20 Ca 0.12 -3.16 -0.43 0.00 -0.00 0.00 0.00 57.72 54.26 2z3r n HIS 20 Cb 0.60 -0.37 -0.04 0.00 -0.00 0.00 0.00 29.99 30.19 2z3r n HIS 20 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2z3r s ILE 21 N -5.21 4.55 -0.17 1.59 -1.09 -1.26 -4.85 121.20 114.77 2z3r s ILE 21 Ca 0.48 1.20 0.15 0.00 -2.23 0.00 0.00 60.65 60.26 2z3r s ILE 21 Cb 0.37 -4.36 0.35 0.00 -1.58 0.00 0.00 42.46 37.24 2z3r s ILE 21 CO -0.21 -0.58 1.18 -0.90 -1.23 0.00 0.00 174.94 173.21 2z3r n ASP 22 N 6.86 2.06 -4.77 3.58 5.75 -1.26 -4.83 116.55 123.93 2z3r n ASP 22 Ca 0.08 -3.45 -0.41 0.00 -0.01 0.00 0.00 54.79 51.00 2z3r n ASP 22 Cb 0.48 -0.47 -0.00 0.00 -1.03 0.00 0.00 41.12 40.09 2z3r n ASP 22 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2z3r s ALA 23 N -3.03 3.49 -0.11 2.12 0.00 -1.26 -5.00 121.76 117.97 2z3r s ALA 23 Ca 0.35 1.47 -0.05 0.00 0.00 0.00 0.00 51.96 53.73 2z3r s ALA 23 Cb 0.32 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 2z3r s ALA 23 CO -0.01 -0.96 0.07 0.95 0.00 0.00 0.00 175.76 175.80 2z3r s THR 24 N -1.15 4.88 0.08 0.00 -4.23 -1.26 -4.04 115.64 109.92 2z3r s THR 24 Ca 0.53 -0.03 0.05 0.00 -1.18 0.00 0.00 61.69 61.07 2z3r s THR 24 Cb -0.44 -3.11 -0.03 0.00 1.34 0.00 0.00 72.50 70.26 2z3r s THR 24 CO 0.59 0.60 -0.14 -0.76 -0.54 0.00 0.00 174.62 174.37 2z3r s LEU 25 N -0.80 2.30 -0.12 4.79 1.43 -0.33 -4.83 118.68 121.11 2z3r s LEU 25 Ca 0.13 -0.64 -0.29 0.00 -1.03 0.00 0.00 54.13 52.29 2z3r s LEU 25 Cb -0.12 -0.49 -0.05 0.00 0.03 0.00 0.00 46.19 45.55 2z3r s LEU 25 CO 0.03 -0.10 1.89 -0.31 0.23 0.00 0.00 176.35 178.09 2z3r s TYR 26 N -1.42 1.58 -0.13 0.29 2.02 -1.26 -1.33 117.35 117.09 2z3r s TYR 26 Ca -0.01 0.19 0.00 0.00 -0.37 0.00 0.00 57.07 56.88 2z3r s TYR 26 Cb -0.09 -4.05 0.02 0.00 -0.40 0.00 0.00 41.96 37.44 2z3r s TYR 26 CO 0.02 -4.17 -0.12 0.99 -1.57 0.00 0.00 175.55 170.70 2z3r s THR 27 N 5.70 1.37 -0.49 -0.71 2.01 -0.34 -4.71 115.64 118.48 2z3r s THR 27 Ca 0.85 -0.51 -0.20 0.00 0.31 0.00 0.00 61.69 62.14 2z3r s THR 27 Cb -0.33 -1.31 0.05 0.00 0.01 0.00 0.00 72.50 70.91 2z3r s THR 27 CO 0.35 0.42 0.65 -0.70 -0.69 0.00 0.00 174.62 174.65 2z3r s GLU 28 N 1.50 3.18 0.00 4.92 2.56 -1.26 -4.14 118.70 125.46 2z3r s GLU 28 Ca 0.03 -0.70 0.25 0.00 0.00 0.00 0.00 54.97 54.56 2z3r s GLU 28 Cb -0.13 -4.05 0.55 0.00 2.00 0.00 0.00 34.13 32.50 2z3r s GLU 28 CO -0.09 -1.18 1.45 0.43 -0.56 0.00 0.00 175.26 175.31 2z3r n SER 29 N 6.30 0.47 -3.54 -1.70 7.64 -1.26 -4.47 113.62 117.05 2z3r n SER 29 Ca -0.05 -0.20 -0.28 0.00 1.01 0.00 0.00 58.87 59.35 2z3r n SER 29 Cb 0.46 0.20 -0.11 0.00 -1.01 0.00 0.00 64.21 63.75 2z3r n SER 29 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2z3r s ASP 30 N -3.00 2.74 0.05 6.43 2.15 -1.26 -5.01 116.67 118.76 2z3r s ASP 30 Ca 0.11 -2.81 -0.30 0.00 0.43 0.00 0.00 52.55 49.98 2z3r s ASP 30 Cb 0.18 -0.70 -0.05 0.00 -0.30 0.00 0.00 42.92 42.05 2z3r s ASP 30 CO 0.69 -0.22 1.16 -0.69 -0.17 0.00 0.00 175.17 175.93 2z3r s VAL 31 N 0.24 4.21 -0.24 1.11 1.01 -1.26 -5.00 120.40 120.46 2z3r s VAL 31 Ca 0.24 1.58 -0.23 0.00 0.00 0.00 0.00 61.98 63.58 2z3r s VAL 31 Cb -0.11 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 2z3r s VAL 31 CO -0.09 0.12 0.76 -1.00 0.00 0.00 0.00 175.10 174.88 2z3r s HIS 32 N 1.09 3.31 0.53 5.22 0.09 -1.26 -4.93 115.29 119.34 2z3r s HIS 32 Ca 0.57 1.03 0.45 0.00 -0.00 0.00 0.00 55.06 57.11 2z3r s HIS 32 Cb -0.28 -2.97 1.67 0.00 -0.00 0.00 0.00 32.58 31.01 2z3r s HIS 32 CO 0.29 -0.36 1.60 -1.35 -0.00 0.00 0.00 174.74 174.91 2z3r h PRO 33 N 7.73 0.01 0.00 8.40 0.11 -1.99 0.94 132.00 147.20 2z3r h PRO 33 Ca -0.25 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2z3r h PRO 33 Cb 1.11 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2z3r h PRO 33 CO 0.83 0.01 0.00 0.66 -0.21 0.00 0.00 178.00 179.29 2z3r h SER 34 N 0.01 0.00 0.00 -2.05 4.64 -2.03 -3.01 113.55 111.12 2z3r h SER 34 Ca 0.89 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 62.19 2z3r h SER 34 Cb 3.44 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 65.47 2z3r h SER 34 CO -0.11 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.46 2z3r h LYS 36 N 0.49 0.23 -0.03 0.00 2.10 -1.41 -1.11 116.57 116.84 2z3r h LYS 36 Ca -0.03 -0.13 -0.25 0.00 -2.00 0.00 0.00 60.65 58.24 2z3r h LYS 36 Cb 1.19 0.01 0.01 0.00 -0.90 0.00 0.00 32.23 32.55 2z3r h LYS 36 CO 0.01 0.68 -0.97 0.28 -2.00 0.00 0.00 179.45 177.46 2z3r h VAL 37 N 0.19 1.31 -0.23 0.07 2.07 -1.89 0.62 116.25 118.38 2z3r h VAL 37 Ca 0.01 -2.23 -0.01 0.00 0.82 0.00 0.00 66.70 65.29 2z3r h VAL 37 Cb 0.94 2.30 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 2z3r h VAL 37 CO 0.08 0.69 0.12 0.74 0.02 0.00 0.00 177.57 179.21 2z3r h THR 38 N 0.39 1.13 -0.72 2.57 2.02 -1.90 -0.69 112.91 115.71 2z3r h THR 38 Ca -0.10 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 2z3r h THR 38 Cb 1.61 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.92 2z3r h THR 38 CO 0.19 0.12 0.30 0.00 0.37 0.00 0.00 175.52 176.50 2z3r h ALA 39 N 0.99 0.93 -0.86 6.16 0.00 -1.22 -2.53 119.26 122.74 2z3r h ALA 39 Ca 0.08 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2z3r h ALA 39 Cb 0.09 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 2z3r h ALA 39 CO -0.01 0.54 0.56 1.98 0.00 0.00 0.00 179.25 182.31 2z3r h MET 40 N 1.02 1.06 -0.38 0.00 -1.53 -0.63 -1.78 114.93 112.69 2z3r h MET 40 Ca 0.24 -0.06 -0.03 0.00 -3.44 0.00 0.00 59.70 56.40 2z3r h MET 40 Cb 0.19 -0.24 -0.02 0.00 -0.55 0.00 0.00 31.60 30.98 2z3r h MET 40 CO -0.02 0.70 0.10 0.87 0.14 0.00 0.00 176.91 178.70 2z3r h LYS 41 N 1.09 0.56 -0.27 0.39 1.57 -0.85 -0.31 116.57 118.76 2z3r h LYS 41 Ca 0.34 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.94 2z3r h LYS 41 Cb -0.02 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2z3r h LYS 41 CO -0.11 0.52 -0.19 0.00 -0.57 0.00 0.00 179.45 179.10 2z3r h PHE 43 N 0.33 -0.02 -0.65 0.00 0.04 -1.12 -0.60 116.94 114.92 2z3r h PHE 43 Ca 0.05 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.83 2z3r h PHE 43 Cb 0.72 0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.93 2z3r h PHE 43 CO 0.07 -0.10 0.30 -0.07 -0.60 0.00 0.00 178.31 177.91 2z3r h LEU 44 N 0.11 0.86 -0.35 1.54 3.38 -0.96 -0.95 115.31 118.96 2z3r h LEU 44 Ca 0.23 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2z3r h LEU 44 Cb 0.33 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2z3r h LEU 44 CO -0.38 0.77 0.07 -0.07 0.09 0.00 0.00 178.44 178.92 2z3r h LEU 45 N 0.90 0.54 -1.16 1.67 3.38 -0.96 -2.83 115.31 116.85 2z3r h LEU 45 Ca 0.22 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2z3r h LEU 45 Cb 0.14 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2z3r h LEU 45 CO -0.03 0.65 -0.15 -0.33 0.09 0.00 0.00 178.44 178.67 2z3r h GLU 46 N 0.41 0.00 -0.12 1.13 4.39 -0.86 -0.95 114.58 118.58 2z3r h GLU 46 Ca 0.11 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.75 2z3r h GLU 46 Cb 0.33 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2z3r h GLU 46 CO 0.00 0.15 -0.18 1.25 -1.16 0.00 0.00 179.01 179.08 2z3r h LEU 47 N 0.00 0.19 -1.48 1.33 5.85 -0.92 -1.39 115.31 118.88 2z3r h LEU 47 Ca -0.00 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 2z3r h LEU 47 Cb 0.69 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 2z3r h LEU 47 CO 0.02 0.39 -0.11 1.56 -0.34 0.00 0.00 178.44 179.95 2z3r h GLN 48 N 0.18 0.00 -0.39 1.25 4.20 -1.13 -2.17 115.11 117.05 2z3r h GLN 48 Ca 0.03 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 2z3r h GLN 48 Cb 0.43 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 2z3r h GLN 48 CO 0.03 0.11 0.04 0.28 -0.67 0.00 0.00 178.83 178.62 2z3r h VAL 49 N 0.00 1.25 -0.39 -0.54 2.07 -1.33 -0.79 116.25 116.51 2z3r h VAL 49 Ca -0.00 -0.91 0.06 0.00 0.82 0.00 0.00 66.70 66.66 2z3r h VAL 49 Cb 0.55 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2z3r h VAL 49 CO 0.01 0.31 0.08 0.40 0.02 0.00 0.00 177.57 178.40 2z3r h ILE 50 N 0.51 0.80 0.41 4.57 2.04 -1.30 0.92 117.51 125.46 2z3r h ILE 50 Ca 0.12 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 2z3r h ILE 50 Cb 0.41 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2z3r h ILE 50 CO 0.01 0.04 -0.20 -1.28 0.00 0.00 0.00 178.15 176.72 2z3r h SER 51 N 0.21 -0.47 -0.43 1.72 0.87 -1.39 -1.93 113.55 112.13 2z3r h SER 51 Ca 0.19 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.85 2z3r h SER 51 Cb 0.22 0.12 -0.07 0.00 -0.44 0.00 0.00 62.40 62.23 2z3r h SER 51 CO -0.25 -0.33 0.00 -0.07 -0.53 0.00 0.00 176.83 175.65 2z3r h LEU 52 N -0.55 -0.17 -1.07 2.23 3.38 -0.87 -2.12 115.31 116.14 2z3r h LEU 52 Ca -0.06 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2z3r h LEU 52 Cb 0.42 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2z3r h LEU 52 CO 0.09 -0.05 0.00 -0.33 0.09 0.00 0.00 178.44 178.24 2z3r h GLU 53 N 0.11 0.00 0.06 1.13 5.08 -0.75 -3.13 114.58 117.08 2z3r h GLU 53 Ca 0.21 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.29 2z3r h GLU 53 Cb 0.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2z3r h GLU 53 CO -0.36 0.00 -1.48 0.66 -1.00 0.00 0.00 179.01 176.84 2z3r h SER 54 N 0.00 0.20 -6.36 1.42 4.64 -0.77 -3.48 113.55 109.20 2z3r h SER 54 Ca 0.00 -0.29 -0.48 0.00 -0.47 0.00 0.00 61.79 60.54 2z3r h SER 54 Cb 0.62 -0.06 -0.06 0.00 -0.31 0.00 0.00 62.40 62.59 2z3r h SER 54 CO 0.00 1.25 -0.78 0.61 -0.87 0.00 0.00 176.83 177.03 2z3r n GLY 55 N 1.58 -0.46 3.25 -0.77 0.00 -0.85 -4.96 105.19 102.98 2z3r n GLY 55 Ca -0.13 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.46 2.89 0.14 1.61 2.15 -1.26 -5.04 116.67 113.70 2z3r s ASP 56 Ca 0.58 -0.48 -0.09 0.00 0.43 0.00 0.00 52.55 53.00 2z3r s ASP 56 Cb -0.30 -0.76 -0.05 0.00 -0.30 0.00 0.00 42.92 41.51 2z3r s ASP 56 CO 0.85 0.23 1.40 0.00 -0.17 0.00 0.00 175.17 177.48 2z3r h ALA 57 N 6.06 0.48 -0.33 3.66 0.00 -1.97 -1.58 119.26 125.58 2z3r h ALA 57 Ca -0.33 -0.55 -0.06 0.00 0.00 0.00 0.00 54.91 53.97 2z3r h ALA 57 Cb 1.17 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2z3r h ALA 57 CO 0.47 0.69 -0.04 1.03 0.00 0.00 0.00 179.25 181.41 2z3r h SER 58 N 0.54 0.61 0.10 0.00 0.87 -1.99 0.34 113.55 114.02 2z3r h SER 58 Ca -0.01 -0.34 0.01 0.00 -1.23 0.00 0.00 61.79 60.22 2z3r h SER 58 Cb 1.24 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 2z3r h SER 58 CO 0.13 0.80 -0.13 0.40 -0.53 0.00 0.00 176.83 177.50 2z3r h ILE 59 N 0.40 0.70 -0.45 2.23 2.04 -1.97 -1.46 117.51 119.00 2z3r h ILE 59 Ca 0.09 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.00 2z3r h ILE 59 Cb 0.51 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 2z3r h ILE 59 CO 0.02 0.00 0.17 -0.74 0.00 0.00 0.00 178.15 177.60 2z3r h HIS 60 N -0.27 0.30 -0.49 1.37 2.76 -1.20 -0.04 115.15 117.58 2z3r h HIS 60 Ca 0.01 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.18 2z3r h HIS 60 Cb 0.28 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 2z3r h HIS 60 CO -0.14 0.12 0.19 -0.44 -1.30 0.00 0.00 177.93 176.36 2z3r h ASP 61 N 0.35 0.63 -0.14 3.26 3.32 -0.80 -1.07 116.42 121.97 2z3r h ASP 61 Ca 0.21 -0.07 -0.21 0.00 0.02 0.00 0.00 57.03 56.97 2z3r h ASP 61 Cb 0.19 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.59 2z3r h ASP 61 CO -0.20 0.58 -0.75 0.74 -1.72 0.00 0.00 179.24 177.89 2z3r h THR 62 N 0.69 1.29 -0.47 0.35 2.02 -0.59 -1.99 112.91 114.22 2z3r h THR 62 Ca 0.17 -1.96 -0.04 0.00 0.77 0.00 0.00 66.41 65.35 2z3r h THR 62 Cb 0.15 2.04 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2z3r h THR 62 CO -0.02 0.62 0.15 0.58 0.37 0.00 0.00 175.52 177.22 2z3r h VAL 63 N 0.46 1.22 -0.37 3.16 2.07 -0.84 -1.67 116.25 120.28 2z3r h VAL 63 Ca -0.05 -0.73 0.03 0.00 0.82 0.00 0.00 66.70 66.77 2z3r h VAL 63 Cb 1.38 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 2z3r h VAL 63 CO 0.15 0.27 0.17 -0.08 0.02 0.00 0.00 177.57 178.10 2z3r h GLU 64 N 0.62 0.34 -0.18 1.57 4.81 -1.15 -0.73 114.58 119.86 2z3r h GLU 64 Ca 0.15 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.38 2z3r h GLU 64 Cb 0.26 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2z3r h GLU 64 CO -0.01 0.23 0.06 -0.97 -0.73 0.00 0.00 179.01 177.59 2z3r h ASN 65 N 0.35 0.07 -0.40 1.04 -1.24 -1.17 -1.56 115.58 112.68 2z3r h ASN 65 Ca 0.16 0.02 0.06 0.00 0.71 0.00 0.00 56.30 57.24 2z3r h ASN 65 Cb 0.08 0.01 -0.05 0.00 0.73 0.00 0.00 38.32 39.09 2z3r h ASN 65 CO -0.12 0.07 0.10 0.25 -1.29 0.00 0.00 177.43 176.44 2z3r h LEU 66 N 0.15 0.07 -0.62 0.34 6.46 -0.97 -0.91 115.31 119.82 2z3r h LEU 66 Ca 0.08 0.06 -0.09 0.00 -0.12 0.00 0.00 57.88 57.81 2z3r h LEU 66 Cb 0.05 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 2z3r h LEU 66 CO -0.08 0.07 0.04 0.40 -0.62 0.00 0.00 178.44 178.26 2z3r h ILE 67 N 0.24 1.26 -0.39 4.05 2.04 -0.93 -0.99 117.51 122.80 2z3r h ILE 67 Ca 0.19 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 2z3r h ILE 67 Cb 0.20 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2z3r h ILE 67 CO -0.22 0.40 0.17 0.40 0.00 0.00 0.00 178.15 178.90 2z3r h ILE 68 N 0.97 1.18 -0.48 -0.67 2.04 -0.86 -0.18 117.51 119.52 2z3r h ILE 68 Ca 0.18 -0.54 0.05 0.00 1.00 0.00 0.00 64.86 65.55 2z3r h ILE 68 Cb 0.51 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 2z3r h ILE 68 CO 0.02 0.20 0.21 -0.07 0.00 0.00 0.00 178.15 178.51 2z3r h LEU 69 N 0.49 0.26 -0.05 1.44 4.07 -0.92 -2.30 115.31 118.31 2z3r h LEU 69 Ca 0.13 0.04 -0.25 0.00 0.08 0.00 0.00 57.88 57.88 2z3r h LEU 69 Cb 0.15 0.00 0.02 0.00 1.08 0.00 0.00 40.66 41.91 2z3r h LEU 69 CO -0.01 0.19 -0.99 0.00 -1.08 0.00 0.00 178.44 176.55 2z3r h ALA 70 N 1.29 0.19 -0.52 1.53 0.00 -0.97 -2.35 119.26 118.43 2z3r h ALA 70 Ca 0.22 -0.68 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2z3r h ALA 70 Cb 0.18 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2z3r h ALA 70 CO -0.19 0.70 0.30 -0.91 0.00 0.00 0.00 179.25 179.15 2z3r h ASN 71 N 0.40 0.63 -0.38 0.00 2.35 -1.02 0.04 115.58 117.60 2z3r h ASN 71 Ca -0.11 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.52 2z3r h ASN 71 Cb 1.63 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.83 2z3r h ASN 71 CO 0.19 0.50 -0.07 -1.13 -1.65 0.00 0.00 177.43 175.28 2z3r h ASN 72 N 0.72 0.71 -0.24 5.81 -0.00 -0.96 -3.08 115.58 118.55 2z3r h ASN 72 Ca 0.19 -0.35 -0.17 0.00 -0.00 0.00 0.00 56.30 55.97 2z3r h ASN 72 Cb 0.00 -0.19 -0.00 0.00 -0.00 0.00 0.00 38.32 38.13 2z3r h ASN 72 CO -0.03 0.90 -0.50 0.28 -0.00 0.00 0.00 177.43 178.07 2z3r h SER 73 N 0.52 0.90 -0.78 1.15 0.02 -0.99 -3.22 113.55 111.15 2z3r h SER 73 Ca 0.10 -0.46 0.15 0.00 -0.84 0.00 0.00 61.79 60.74 2z3r h SER 73 Cb 0.57 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.80 2z3r h SER 73 CO 0.03 1.24 0.52 -0.07 -1.14 0.00 0.00 176.83 177.41 2z3r h LEU 74 N 0.64 0.44 0.00 5.07 3.38 -0.91 -1.11 115.31 122.82 2z3r h LEU 74 Ca 0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2z3r h LEU 74 Cb 1.09 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2z3r h LEU 74 CO 0.11 0.23 0.00 -1.20 0.09 0.00 0.00 178.44 177.67 2z3r n SER 75 N -4.49 0.00 -3.73 -0.43 7.64 -1.19 -5.09 113.62 106.33 2z3r n SER 75 Ca 0.15 0.40 -0.41 0.00 1.01 0.00 0.00 58.87 60.01 2z3r n SER 75 Cb 0.52 -0.42 0.02 0.00 -1.01 0.00 0.00 64.21 63.32 2z3r n SER 75 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2z3r n SER 76 N -1.42 7.13 -0.09 6.43 3.41 -0.42 -5.16 113.62 123.50 2z3r n SER 76 Ca 0.01 -3.57 0.00 0.00 -0.26 0.00 0.00 58.87 55.04 2z3r n SER 76 Cb 0.03 -1.21 0.00 0.00 -0.26 0.00 0.00 64.21 62.77 2z3r n SER 76 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2z3r n VAL 80 N 0.47 -0.44 -3.56 -3.33 0.24 -1.26 -5.16 118.33 105.28 2z3r n VAL 80 Ca 0.42 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.46 2z3r n VAL 80 Cb 0.28 -0.44 -0.02 0.00 -1.47 0.00 0.00 33.84 32.19 2z3r n VAL 80 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2z3r s THR 81 N -0.09 5.15 -0.13 3.34 -4.23 -1.26 -5.06 115.64 113.36 2z3r s THR 81 Ca 0.00 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 2z3r s THR 81 Cb 0.00 -3.78 0.02 0.00 1.34 0.00 0.00 72.50 70.08 2z3r s THR 81 CO 0.00 -0.33 -0.12 -1.61 -0.54 0.00 0.00 174.62 172.02 2z3r s GLU 82 N -3.72 2.06 0.15 3.99 2.02 -1.26 -5.12 118.70 116.82 2z3r s GLU 82 Ca 0.39 -0.47 0.08 0.00 0.02 0.00 0.00 54.97 54.99 2z3r s GLU 82 Cb -0.10 -1.91 -0.04 0.00 0.10 0.00 0.00 34.13 32.18 2z3r s GLU 82 CO 0.31 -0.21 -0.07 -1.54 0.02 0.00 0.00 175.26 173.78 2z3r s SER 83 N 1.44 4.46 -1.07 -0.19 1.04 -1.26 -4.66 113.70 113.46 2z3r s SER 83 Ca 0.02 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.00 2z3r s SER 83 Cb -0.13 -0.85 0.00 0.00 0.10 0.00 0.00 66.02 65.14 2z3r s SER 83 CO -0.08 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.87 2z3r n GLY 84 N 0.21 0.79 3.84 7.32 0.00 -1.26 -5.01 105.19 111.07 2z3r n GLY 84 Ca -0.11 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 2z3r n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2z3r s LYS 86 N -3.46 4.06 0.55 0.00 1.02 -1.26 -5.01 119.74 115.63 2z3r s LYS 86 Ca 0.58 2.26 -0.21 0.00 0.02 0.00 0.00 55.97 58.63 2z3r s LYS 86 Cb -0.10 -2.85 -0.05 0.00 -0.52 0.00 0.00 37.83 34.31 2z3r s LYS 86 CO 0.21 -0.46 1.25 -1.21 -0.92 0.00 0.00 175.35 174.22 2z3r s GLU 87 N -2.13 3.18 0.20 1.68 0.41 -1.26 -4.91 118.70 115.87 2z3r s GLU 87 Ca 0.55 1.95 -0.18 0.00 -0.41 0.00 0.00 54.97 56.88 2z3r s GLU 87 Cb -0.40 -2.13 0.17 0.00 -1.78 0.00 0.00 34.13 29.99 2z3r s GLU 87 CO 0.53 -1.07 1.60 0.00 -0.49 0.00 0.00 175.26 175.82 2z3r n GLU 89 N -5.44 0.35 0.00 0.00 4.71 -1.26 -0.90 120.64 118.09 2z3r n GLU 89 Ca 0.06 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.33 2z3r n GLU 89 Cb 0.36 -1.50 0.16 0.00 -1.01 0.00 0.00 31.44 29.44 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 -1.01 0.17 -3.17 3.49 1.02 -0.47 -4.93 120.64 115.74 2z3r n GLU 90 Ca 0.08 -0.11 -0.32 0.00 -0.02 0.00 0.00 57.16 56.79 2z3r n GLU 90 Cb 0.04 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.90 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 -2.91 4.06 0.49 -4.62 1.43 -0.08 -5.00 118.68 112.04 2z3r s LEU 91 Ca 0.12 1.20 -0.22 0.00 -1.03 0.00 0.00 54.13 54.20 2z3r s LEU 91 Cb 0.17 -4.00 -0.09 0.00 0.03 0.00 0.00 46.19 42.30 2z3r s LEU 91 CO 0.71 -0.20 0.93 1.21 0.23 0.00 0.00 176.35 179.24 2z3r n GLU 92 N -0.41 1.12 -3.62 1.70 2.13 -1.26 -4.65 120.64 115.66 2z3r n GLU 92 Ca 0.03 0.41 -0.37 0.00 0.66 0.00 0.00 57.16 57.89 2z3r n GLU 92 Cb 0.53 -2.03 -0.09 0.00 0.27 0.00 0.00 31.44 30.12 2z3r n GLU 92 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2z3r s GLU 93 N -2.21 4.07 0.31 5.31 2.02 -1.26 -1.19 118.70 125.74 2z3r s GLU 93 Ca 0.67 -0.21 0.07 0.00 0.02 0.00 0.00 54.97 55.52 2z3r s GLU 93 Cb -0.51 -3.55 -0.06 0.00 0.10 0.00 0.00 34.13 30.11 2z3r s GLU 93 CO 0.54 0.02 -0.05 0.15 0.02 0.00 0.00 175.26 175.93 2z3r s LYS 94 N 1.18 1.67 1.14 1.61 1.02 -0.44 -4.79 119.74 121.11 2z3r s LYS 94 Ca 0.09 -1.86 -0.18 0.00 0.02 0.00 0.00 55.97 54.04 2z3r s LYS 94 Cb -0.14 -1.32 0.26 0.00 -0.52 0.00 0.00 37.83 36.11 2z3r s LYS 94 CO 0.06 0.04 1.14 0.54 -0.92 0.00 0.00 175.35 176.20 2z3r s ASN 95 N -3.51 1.51 0.10 2.83 2.20 -1.26 -1.19 114.94 115.62 2z3r s ASN 95 Ca 0.31 0.66 -0.16 0.00 -0.94 0.00 0.00 52.86 52.73 2z3r s ASN 95 Cb 0.04 -0.94 -0.06 0.00 -2.00 0.00 0.00 41.25 38.29 2z3r s ASN 95 CO 0.14 -3.76 1.50 0.40 -2.94 0.00 0.00 177.10 172.44 2z3r h ILE 96 N -2.33 1.28 -0.32 0.54 1.08 -1.88 -0.31 117.51 115.57 2z3r h ILE 96 Ca -0.46 -1.12 0.04 0.00 -0.39 0.00 0.00 64.86 62.93 2z3r h ILE 96 Cb 1.29 1.37 -0.04 0.00 -3.07 0.00 0.00 36.82 36.37 2z3r h ILE 96 CO 0.39 0.36 0.08 0.50 -0.69 0.00 0.00 178.15 178.79 2z3r h LYS 97 N 0.38 0.19 -0.18 2.37 3.64 -1.95 -0.61 116.57 120.41 2z3r h LYS 97 Ca 0.08 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 2z3r h LYS 97 Cb 0.57 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 2z3r h LYS 97 CO 0.03 0.13 -0.30 0.93 -2.27 0.00 0.00 179.45 177.97 2z3r h GLU 98 N 0.20 0.35 -0.22 1.90 5.08 -1.90 -2.23 114.58 117.76 2z3r h GLU 98 Ca 0.15 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 2z3r h GLU 98 Cb 0.15 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2z3r h GLU 98 CO -0.18 0.62 -0.05 0.35 -1.00 0.00 0.00 179.01 178.75 2z3r h PHE 99 N 0.31 0.46 -0.22 4.33 3.57 -0.60 -2.60 116.94 122.19 2z3r h PHE 99 Ca 0.04 -0.10 -0.09 0.00 3.53 0.00 0.00 57.97 61.35 2z3r h PHE 99 Cb 0.69 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2z3r h PHE 99 CO 0.02 0.65 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.40 2z3r h LEU 100 N 0.14 0.42 -0.52 0.59 3.38 -1.10 -0.49 115.31 117.73 2z3r h LEU 100 Ca 0.06 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 2z3r h LEU 100 Cb 0.50 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2z3r h LEU 100 CO 0.02 0.69 -0.08 -0.61 0.09 0.00 0.00 178.44 178.55 2z3r h GLN 101 N 0.37 0.98 -0.08 1.13 5.75 -1.36 0.35 115.11 122.25 2z3r h GLN 101 Ca 0.05 -0.35 -0.10 0.00 -0.15 0.00 0.00 58.65 58.10 2z3r h GLN 101 Cb 0.67 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 2z3r h GLN 101 CO 0.05 1.02 -0.40 0.77 -2.65 0.00 0.00 178.83 177.62 2z3r h SER 102 N 0.85 0.18 -0.04 -0.69 0.02 -1.28 -1.04 113.55 111.55 2z3r h SER 102 Ca 0.14 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2z3r h SER 102 Cb 0.63 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 2z3r h SER 102 CO 0.04 0.57 0.01 0.15 -1.14 0.00 0.00 176.83 176.46 2z3r h PHE 103 N 0.15 0.07 -0.35 3.45 -0.00 -0.72 0.00 116.94 119.54 2z3r h PHE 103 Ca 0.01 -0.01 0.08 0.00 -0.00 0.00 0.00 57.97 58.05 2z3r h PHE 103 Cb 0.78 -0.02 -0.08 0.00 -0.00 0.00 0.00 35.95 36.62 2z3r h PHE 103 CO 0.01 0.29 -0.23 0.28 -0.00 0.00 0.00 178.31 178.67 2z3r h VAL 104 N -0.18 0.38 -0.92 1.41 2.07 -0.81 -2.00 116.25 116.20 2z3r h VAL 104 Ca 0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.55 2z3r h VAL 104 Cb 0.26 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 2z3r h VAL 104 CO 0.00 0.00 0.61 0.45 0.02 0.00 0.00 177.57 178.65 2z3r h HIS 105 N -0.18 1.14 -0.23 1.57 3.86 -0.60 -1.33 115.15 119.38 2z3r h HIS 105 Ca 0.18 0.03 -0.11 0.00 -1.16 0.00 0.00 60.37 59.31 2z3r h HIS 105 Cb 0.45 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 2z3r h HIS 105 CO -0.44 0.69 -0.32 0.97 0.86 0.00 0.00 177.93 179.70 2z3r h ILE 106 N 1.21 1.28 -0.61 2.45 2.10 -0.81 -2.35 117.51 120.77 2z3r h ILE 106 Ca 0.35 -1.39 0.00 0.00 1.08 0.00 0.00 64.86 64.91 2z3r h ILE 106 Cb -0.07 1.45 -0.03 0.00 -1.09 0.00 0.00 36.82 37.08 2z3r h ILE 106 CO -0.09 0.44 0.40 0.58 -1.08 0.00 0.00 178.15 178.39 2z3r h VAL 107 N 0.41 1.16 -0.73 2.19 2.07 -0.54 -0.71 116.25 120.11 2z3r h VAL 107 Ca 0.05 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.31 2z3r h VAL 107 Cb 0.75 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 2z3r h VAL 107 CO 0.06 0.16 0.48 1.56 0.02 0.00 0.00 177.57 179.85 2z3r h GLN 108 N 0.83 0.77 -0.26 1.57 4.20 -1.10 0.24 115.11 121.35 2z3r h GLN 108 Ca 0.22 -0.05 -0.09 0.00 0.06 0.00 0.00 58.65 58.80 2z3r h GLN 108 Cb -0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.52 2z3r h GLN 108 CO -0.05 0.51 -0.17 1.98 -0.67 0.00 0.00 178.83 180.43 2z3r h MET 109 N 0.79 0.57 -0.52 1.46 4.05 -0.78 0.39 114.93 120.89 2z3r h MET 109 Ca 0.31 -0.27 0.09 0.00 -0.28 0.00 0.00 59.70 59.54 2z3r h MET 109 Cb 0.20 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 30.93 2z3r h MET 109 CO -0.10 0.85 0.12 0.74 0.23 0.00 0.00 176.91 178.75 2z3r h PHE 110 N 0.29 0.20 -0.55 1.39 0.04 -0.31 -1.80 116.94 116.19 2z3r h PHE 110 Ca 0.05 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.86 2z3r h PHE 110 Cb 0.70 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.82 2z3r h PHE 110 CO 0.07 0.01 0.36 0.82 -0.60 0.00 0.00 178.31 178.97 2z3r h ILE 111 N 0.26 1.14 -0.71 -0.55 2.04 -0.08 0.26 117.51 119.88 2z3r h ILE 111 Ca 0.26 -0.26 0.18 0.00 1.00 0.00 0.00 64.86 66.03 2z3r h ILE 111 Cb 0.34 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 2z3r h ILE 111 CO -0.32 0.14 0.49 -1.13 0.00 0.00 0.00 178.15 177.33 2z3r h ASN 112 N 0.75 0.19 -0.01 1.72 -1.24 -0.52 -3.10 115.58 113.38 2z3r h ASN 112 Ca 0.20 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.22 2z3r h ASN 112 Cb -0.08 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 38.94 2z3r h ASN 112 CO -0.04 0.09 -0.35 0.41 -1.29 0.00 0.00 177.43 176.25 2z3r n THR 113 N -4.41 0.00 1.18 -3.57 -1.04 -0.34 -5.10 114.28 101.00 2z3r n THR 113 Ca 0.14 -0.33 0.09 0.00 -2.04 0.00 0.00 64.05 61.92 2z3r n THR 113 Cb 0.65 1.10 0.56 0.00 -1.82 0.00 0.00 70.33 70.82 2z3r n THR 113 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23