#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 0.63 -0.29 0.00 1.85 -2.04 -2.16 114.93 112.91 2z3r h MET -3 Ca 0.00 -0.08 -0.04 0.00 -0.61 0.00 0.00 59.70 58.97 2z3r h MET -3 Cb 0.00 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 31.90 2z3r h MET -3 CO 0.00 0.51 0.04 0.00 -0.40 0.00 0.00 176.91 177.06 2z3r h ALA -2 N 1.58 0.39 -0.32 0.39 0.00 -1.95 -1.44 119.26 117.91 2z3r h ALA -2 Ca 0.16 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2z3r h ALA -2 Cb 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2z3r h ALA -2 CO -0.02 0.09 0.19 0.82 0.00 0.00 0.00 179.25 180.34 2z3r h ILE -1 N 0.31 1.04 -0.06 0.00 1.08 -1.85 -2.22 117.51 115.81 2z3r h ILE -1 Ca 0.09 -0.13 -0.09 0.00 -0.39 0.00 0.00 64.86 64.33 2z3r h ILE -1 Cb 0.36 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 34.71 2z3r h ILE -1 CO 0.01 0.07 -0.38 0.77 -0.69 0.00 0.00 178.15 177.93 2z3r h SER 0 N 0.39 0.12 -0.54 1.72 4.64 -1.16 -0.93 113.55 117.79 2z3r h SER 0 Ca 0.12 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2z3r h SER 0 Cb -0.01 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2z3r h SER 0 CO -0.05 0.49 0.34 0.78 -0.87 0.00 0.00 176.83 177.52 2z3r h ASN 1 N 0.10 0.63 -0.16 4.97 2.35 -1.00 -0.93 115.58 121.55 2z3r h ASN 1 Ca 0.01 -0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.61 2z3r h ASN 1 Cb 0.72 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2z3r h ASN 1 CO 0.05 0.48 -0.30 -0.50 -1.65 0.00 0.00 177.43 175.51 2z3r h TRP 2 N 0.73 0.74 -0.91 1.19 -0.00 -0.76 0.19 115.95 117.14 2z3r h TRP 2 Ca 0.20 -0.18 -0.01 0.00 -0.00 0.00 0.00 58.89 58.89 2z3r h TRP 2 Cb -0.05 -0.17 -0.04 0.00 -0.00 0.00 0.00 29.16 28.89 2z3r h TRP 2 CO -0.03 0.87 0.53 0.28 -0.00 0.00 0.00 178.44 180.08 2z3r h VAL 3 N 0.55 1.25 -0.08 1.49 2.07 -0.61 -1.66 116.25 119.27 2z3r h VAL 3 Ca 0.07 -0.58 -0.15 0.00 0.82 0.00 0.00 66.70 66.86 2z3r h VAL 3 Cb 0.79 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 2z3r h VAL 3 CO 0.06 0.27 -0.59 0.78 0.02 0.00 0.00 177.57 178.12 2z3r h ASN 4 N 1.25 0.30 -0.58 0.57 2.35 -0.71 -2.14 115.58 116.63 2z3r h ASN 4 Ca 0.32 -0.17 0.04 0.00 -0.55 0.00 0.00 56.30 55.95 2z3r h ASN 4 Cb -0.03 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.21 2z3r h ASN 4 CO -0.06 0.82 0.32 0.58 -1.65 0.00 0.00 177.43 177.45 2z3r h VAL 5 N 0.20 0.99 -0.72 2.81 2.07 -0.26 -1.39 116.25 119.95 2z3r h VAL 5 Ca -0.00 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 2z3r h VAL 5 Cb 1.09 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 2z3r h VAL 5 CO 0.09 0.11 0.36 0.40 0.02 0.00 0.00 177.57 178.56 2z3r h ILE 6 N 0.62 1.22 -0.56 4.57 2.04 -0.97 -0.83 117.51 123.60 2z3r h ILE 6 Ca 0.25 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2z3r h ILE 6 Cb 0.12 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 2z3r h ILE 6 CO -0.15 0.26 0.30 -1.28 0.00 0.00 0.00 178.15 177.28 2z3r h SER 7 N 1.01 0.68 -0.25 1.72 0.87 -0.90 -0.64 113.55 116.04 2z3r h SER 7 Ca 0.25 -0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.68 2z3r h SER 7 Cb 0.07 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2z3r h SER 7 CO -0.04 0.56 -0.15 0.44 -0.53 0.00 0.00 176.83 177.11 2z3r h ASP 8 N 0.77 0.56 -0.42 6.23 3.32 -0.57 -1.75 116.42 124.56 2z3r h ASP 8 Ca 0.20 -0.43 0.04 0.00 0.02 0.00 0.00 57.03 56.86 2z3r h ASP 8 Cb 0.03 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 2z3r h ASP 8 CO -0.03 0.87 0.19 -0.07 -1.72 0.00 0.00 179.24 178.48 2z3r h LEU 9 N 0.26 0.26 -0.73 1.55 3.38 -0.48 0.17 115.31 119.72 2z3r h LEU 9 Ca 0.05 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.13 2z3r h LEU 9 Cb 0.67 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 2z3r h LEU 9 CO 0.04 0.19 0.41 0.50 0.09 0.00 0.00 178.44 179.67 2z3r h LYS 10 N 0.39 0.70 -0.25 1.13 3.64 -1.10 -0.28 116.57 120.81 2z3r h LYS 10 Ca 0.19 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2z3r h LYS 10 Cb 0.12 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2z3r h LYS 10 CO -0.15 0.47 0.06 -0.22 -2.27 0.00 0.00 179.45 177.34 2z3r h LYS 11 N 0.72 0.40 -0.45 1.90 3.64 -0.44 -1.81 116.57 120.53 2z3r h LYS 11 Ca 0.34 -0.10 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2z3r h LYS 11 Cb 0.26 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 2z3r h LYS 11 CO -0.21 0.50 0.14 0.82 -2.27 0.00 0.00 179.45 178.43 2z3r h ILE 12 N 0.23 0.82 -0.53 2.00 2.04 -0.33 -1.61 117.51 120.13 2z3r h ILE 12 Ca 0.08 -0.10 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 2z3r h ILE 12 Cb 0.28 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2z3r h ILE 12 CO 0.00 0.05 0.14 -0.08 0.00 0.00 0.00 178.15 178.27 2z3r h GLU 13 N 0.30 0.80 0.19 2.37 4.81 -0.90 -0.94 114.58 121.22 2z3r h GLU 13 Ca 0.22 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2z3r h GLU 13 Cb 0.24 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2z3r h GLU 13 CO -0.24 0.72 -0.13 0.22 -0.73 0.00 0.00 179.01 178.85 2z3r h ASP 14 N 0.78 -0.32 0.14 1.04 1.82 -1.04 -3.05 116.42 115.79 2z3r h ASP 14 Ca 0.17 0.02 -0.15 0.00 -0.39 0.00 0.00 57.03 56.69 2z3r h ASP 14 Cb 0.27 0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 2z3r h ASP 14 CO -0.00 -0.20 -0.55 -0.07 -1.61 0.00 0.00 179.24 176.80 2z3r h LEU 15 N -0.32 0.48 0.00 2.28 3.38 -0.81 -2.59 115.31 117.74 2z3r h LEU 15 Ca -0.02 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2z3r h LEU 15 Cb 0.27 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2z3r h LEU 15 CO 0.01 0.94 0.00 2.30 0.09 0.00 0.00 178.44 181.78 2z3r n ILE 16 N -3.94 0.03 -0.19 1.22 -5.35 -0.40 -4.11 119.36 106.62 2z3r n ILE 16 Ca -0.03 0.01 -0.06 0.00 -0.27 0.00 0.00 62.75 62.40 2z3r n ILE 16 Cb 0.60 -0.52 -0.05 0.00 -1.74 0.00 0.00 39.64 37.92 2z3r n ILE 16 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 2z3r h GLN 17 N 0.00 -0.03 0.00 6.28 5.75 -1.35 -2.73 115.11 123.03 2z3r h GLN 17 Ca 0.00 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.39 2z3r h GLN 17 Cb 0.19 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 2z3r h GLN 17 CO 0.00 -0.02 -0.53 0.66 -2.65 0.00 0.00 178.83 176.28 2z3r h SER 18 N -0.04 0.00 -3.64 -0.69 4.64 -1.80 -3.45 113.55 108.58 2z3r h SER 18 Ca 0.08 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.97 2z3r h SER 18 Cb 0.23 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 62.50 2z3r h SER 18 CO -0.46 0.53 0.20 -0.04 -0.87 0.00 0.00 176.83 176.19 2z3r s MET 19 N -3.57 -0.76 -0.55 4.77 -1.94 -1.03 -5.02 119.30 111.20 2z3r s MET 19 Ca -0.01 -0.12 0.04 0.00 -1.71 0.00 0.00 55.69 53.89 2z3r s MET 19 Cb 0.12 -1.66 0.15 0.00 2.01 0.00 0.00 34.83 35.45 2z3r s MET 19 CO 0.74 -3.39 0.35 -1.01 -0.01 0.00 0.00 175.02 171.69 2z3r s HIS 20 N -3.20 2.73 -0.54 -0.03 0.09 -1.26 -5.03 115.29 108.04 2z3r s HIS 20 Ca 0.71 -2.92 -0.20 0.00 -0.00 0.00 0.00 55.06 52.65 2z3r s HIS 20 Cb -0.09 -2.28 0.07 0.00 -0.00 0.00 0.00 32.58 30.28 2z3r s HIS 20 CO 0.55 -0.69 0.72 0.42 -0.00 0.00 0.00 174.74 175.74 2z3r s ILE 21 N -0.51 4.74 -1.37 0.60 -1.09 -1.26 -4.84 121.20 117.46 2z3r s ILE 21 Ca 0.22 -0.47 0.19 0.00 -2.23 0.00 0.00 60.65 58.36 2z3r s ILE 21 Cb -0.14 -4.41 0.65 0.00 -1.58 0.00 0.00 42.46 36.98 2z3r s ILE 21 CO -0.09 -0.98 1.56 -0.90 -1.23 0.00 0.00 174.94 173.30 2z3r n ASP 22 N 6.54 4.27 -4.68 3.58 3.85 -1.26 -4.72 116.55 124.13 2z3r n ASP 22 Ca -0.06 -2.26 -0.41 0.00 -0.71 0.00 0.00 54.79 51.35 2z3r n ASP 22 Cb 0.45 -0.51 0.01 0.00 -1.35 0.00 0.00 41.12 39.72 2z3r n ASP 22 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2z3r n ALA 23 N 1.19 0.98 -2.72 2.12 0.00 -1.26 -4.97 120.51 115.85 2z3r n ALA 23 Ca 0.24 0.24 -0.35 0.00 0.00 0.00 0.00 53.44 53.57 2z3r n ALA 23 Cb 0.75 -2.22 -0.10 0.00 0.00 0.00 0.00 19.45 17.88 2z3r n ALA 23 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2z3r s THR 24 N -1.23 4.20 0.03 0.00 -4.23 -1.26 -4.03 115.64 109.13 2z3r s THR 24 Ca 0.63 -0.28 0.06 0.00 -1.18 0.00 0.00 61.69 60.92 2z3r s THR 24 Cb -0.51 -2.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.53 2z3r s THR 24 CO 0.57 0.58 -0.17 -0.76 -0.54 0.00 0.00 174.62 174.30 2z3r s LEU 25 N -0.60 2.15 -0.23 4.79 1.43 0.10 -4.79 118.68 121.53 2z3r s LEU 25 Ca 0.10 -0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 2z3r s LEU 25 Cb -0.12 -0.78 -0.08 0.00 0.03 0.00 0.00 46.19 45.24 2z3r s LEU 25 CO 0.02 0.11 2.16 -1.22 0.23 0.00 0.00 176.35 177.64 2z3r n TYR 26 N 1.99 1.94 -4.02 0.29 4.01 -1.26 -1.28 117.16 118.82 2z3r n TYR 26 Ca -0.17 -0.01 -0.30 0.00 -0.16 0.00 0.00 57.90 57.26 2z3r n TYR 26 Cb 0.54 -2.67 -0.16 0.00 -0.31 0.00 0.00 39.34 36.74 2z3r n TYR 26 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2z3r s THR 27 N 7.24 1.63 -0.47 -0.72 2.01 0.20 -4.77 115.64 120.77 2z3r s THR 27 Ca 1.02 -0.75 -0.22 0.00 0.31 0.00 0.00 61.69 62.05 2z3r s THR 27 Cb -0.55 -1.57 0.03 0.00 0.01 0.00 0.00 72.50 70.43 2z3r s THR 27 CO 0.42 0.40 0.76 -0.70 -0.69 0.00 0.00 174.62 174.81 2z3r s GLU 28 N 1.45 3.33 0.28 4.92 2.56 -1.26 -3.85 118.70 126.12 2z3r s GLU 28 Ca 0.04 -0.28 0.23 0.00 0.00 0.00 0.00 54.97 54.95 2z3r s GLU 28 Cb -0.14 -3.98 0.26 0.00 2.00 0.00 0.00 34.13 32.28 2z3r s GLU 28 CO -0.10 -1.17 1.37 0.77 -0.56 0.00 0.00 175.26 175.57 2z3r h SER 29 N 9.02 0.00 -2.83 -1.70 0.02 -1.96 -3.41 113.55 112.68 2z3r h SER 29 Ca -0.25 -0.03 -0.59 0.00 -0.84 0.00 0.00 61.79 60.07 2z3r h SER 29 Cb 1.09 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 63.23 2z3r h SER 29 CO 0.97 0.02 -0.83 -0.62 -1.14 0.00 0.00 176.83 175.23 2z3r s ASP 30 N -5.41 2.95 0.10 3.07 -1.08 -1.26 -4.99 116.67 110.05 2z3r s ASP 30 Ca 0.04 -2.56 -0.26 0.00 -0.52 0.00 0.00 52.55 49.25 2z3r s ASP 30 Cb 0.09 -0.65 -0.06 0.00 -1.46 0.00 0.00 42.92 40.84 2z3r s ASP 30 CO 0.71 -0.26 0.80 -0.69 0.52 0.00 0.00 175.17 176.25 2z3r s VAL 31 N 0.55 4.57 -0.05 1.11 1.01 -1.26 -5.06 120.40 121.27 2z3r s VAL 31 Ca 0.21 1.72 -0.11 0.00 0.00 0.00 0.00 61.98 63.80 2z3r s VAL 31 Cb -0.17 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 2z3r s VAL 31 CO -0.04 0.41 0.30 -2.28 0.00 0.00 0.00 175.10 173.49 2z3r s HIS 32 N -0.44 3.68 0.65 5.22 2.46 -1.26 -4.99 115.29 120.61 2z3r s HIS 32 Ca 0.39 0.80 0.36 0.00 0.47 0.00 0.00 55.06 57.08 2z3r s HIS 32 Cb -0.22 -2.14 1.98 0.00 -0.13 0.00 0.00 32.58 32.07 2z3r s HIS 32 CO 0.25 0.68 2.16 -1.35 -2.47 0.00 0.00 174.74 174.01 2z3r h PRO 33 N 4.80 0.00 -0.01 2.88 0.11 -2.00 0.99 132.00 138.77 2z3r h PRO 33 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2z3r h PRO 33 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2z3r h PRO 33 CO 0.60 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.26 2z3r n SER 34 N -3.19 0.50 -0.22 -2.05 3.41 -1.26 -2.60 113.62 108.20 2z3r n SER 34 Ca -0.02 -1.21 0.06 0.00 -0.26 0.00 0.00 58.87 57.45 2z3r n SER 34 Cb 0.23 -0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.27 2z3r n SER 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2z3r h LYS 36 N 0.00 1.11 -0.20 0.00 2.10 -1.39 0.15 116.57 118.33 2z3r h LYS 36 Ca 0.00 -0.07 -0.20 0.00 -2.00 0.00 0.00 60.65 58.38 2z3r h LYS 36 Cb 1.14 -0.25 0.00 0.00 -0.90 0.00 0.00 32.23 32.22 2z3r h LYS 36 CO 0.00 0.73 -0.67 0.28 -2.00 0.00 0.00 179.45 177.79 2z3r h VAL 37 N 1.14 1.28 -0.85 0.07 2.07 -1.91 -1.02 116.25 117.04 2z3r h VAL 37 Ca 0.32 -1.88 -0.03 0.00 0.82 0.00 0.00 66.70 65.93 2z3r h VAL 37 Cb -0.11 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2z3r h VAL 37 CO -0.07 0.60 0.42 0.74 0.02 0.00 0.00 177.57 179.28 2z3r h THR 38 N 0.57 1.26 -0.07 2.57 2.02 -1.86 -1.41 112.91 115.99 2z3r h THR 38 Ca -0.02 -0.72 -0.23 0.00 0.77 0.00 0.00 66.41 66.22 2z3r h THR 38 Cb 1.29 0.16 0.01 0.00 -1.74 0.00 0.00 68.15 67.87 2z3r h THR 38 CO 0.14 0.31 -0.87 0.00 0.37 0.00 0.00 175.52 175.47 2z3r h ALA 39 N 1.23 0.34 -0.85 6.16 0.00 -0.92 -2.72 119.26 122.51 2z3r h ALA 39 Ca 0.29 -0.65 0.04 0.00 0.00 0.00 0.00 54.91 54.60 2z3r h ALA 39 Cb 0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2z3r h ALA 39 CO -0.04 0.73 0.54 1.98 0.00 0.00 0.00 179.25 182.46 2z3r h MET 40 N 0.38 1.00 -0.55 0.00 -1.53 -1.08 -1.49 114.93 111.66 2z3r h MET 40 Ca -0.07 -0.06 -0.06 0.00 -3.44 0.00 0.00 59.70 56.07 2z3r h MET 40 Cb 1.49 -0.23 -0.02 0.00 -0.55 0.00 0.00 31.60 32.29 2z3r h MET 40 CO 0.16 0.66 0.10 0.87 0.14 0.00 0.00 176.91 178.84 2z3r h LYS 41 N 1.03 0.87 -0.71 0.39 1.57 -1.07 0.73 116.57 119.38 2z3r h LYS 41 Ca 0.35 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 58.88 2z3r h LYS 41 Cb 0.06 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 2z3r h LYS 41 CO -0.13 0.81 0.25 0.00 -0.57 0.00 0.00 179.45 179.80 2z3r h PHE 43 N 1.03 0.68 -0.29 0.00 0.04 -0.50 -0.07 116.94 117.82 2z3r h PHE 43 Ca 0.23 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.01 2z3r h PHE 43 Cb 0.27 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 2z3r h PHE 43 CO 0.02 0.41 0.16 -0.07 -0.60 0.00 0.00 178.31 178.23 2z3r h LEU 44 N 0.73 0.37 -0.67 1.54 3.38 -0.76 -0.88 115.31 119.02 2z3r h LEU 44 Ca 0.21 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2z3r h LEU 44 Cb -0.05 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2z3r h LEU 44 CO -0.06 0.36 0.30 -0.07 0.09 0.00 0.00 178.44 179.06 2z3r h LEU 45 N 0.35 0.89 -0.85 1.67 3.38 -1.26 -2.78 115.31 116.71 2z3r h LEU 45 Ca 0.10 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2z3r h LEU 45 Cb 0.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2z3r h LEU 45 CO -0.02 0.79 0.00 -0.33 0.09 0.00 0.00 178.44 178.97 2z3r h GLU 46 N 0.93 0.00 -0.66 1.13 4.39 -0.53 -2.11 114.58 117.72 2z3r h GLU 46 Ca 0.23 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.87 2z3r h GLU 46 Cb 0.15 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 2z3r h GLU 46 CO -0.02 0.00 0.17 1.25 -1.16 0.00 0.00 179.01 179.25 2z3r h LEU 47 N 0.00 0.97 -2.14 1.33 5.85 -0.89 -2.24 115.31 118.20 2z3r h LEU 47 Ca 0.00 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 2z3r h LEU 47 Cb 0.66 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 2z3r h LEU 47 CO 0.00 0.93 -0.02 1.56 -0.34 0.00 0.00 178.44 180.58 2z3r h GLN 48 N 0.99 0.00 -0.39 1.25 4.20 -1.33 -1.42 115.11 118.40 2z3r h GLN 48 Ca 0.21 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.81 2z3r h GLN 48 Cb 0.33 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2z3r h GLN 48 CO -0.00 0.02 -0.20 0.28 -0.67 0.00 0.00 178.83 178.25 2z3r h VAL 49 N 0.00 1.28 -0.62 -0.54 2.07 -1.44 -2.37 116.25 114.63 2z3r h VAL 49 Ca -0.00 -1.34 0.04 0.00 0.82 0.00 0.00 66.70 66.22 2z3r h VAL 49 Cb 0.28 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 2z3r h VAL 49 CO 0.00 0.45 0.35 0.40 0.02 0.00 0.00 177.57 178.79 2z3r h ILE 50 N 0.63 1.01 0.32 4.57 2.04 -1.25 0.01 117.51 124.84 2z3r h ILE 50 Ca 0.09 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2z3r h ILE 50 Cb 0.76 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2z3r h ILE 50 CO 0.06 0.12 -0.15 -1.28 0.00 0.00 0.00 178.15 176.90 2z3r h SER 51 N 0.68 -0.36 -0.32 1.72 0.87 -1.40 -0.52 113.55 114.22 2z3r h SER 51 Ca 0.27 -0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2z3r h SER 51 Cb 0.11 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 2z3r h SER 51 CO -0.15 -0.20 0.19 -0.07 -0.53 0.00 0.00 176.83 176.07 2z3r h LEU 52 N -0.49 0.32 -0.99 2.23 3.38 -1.26 0.12 115.31 118.62 2z3r h LEU 52 Ca -0.04 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 2z3r h LEU 52 Cb 0.37 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2z3r h LEU 52 CO 0.07 0.23 -0.39 -0.33 0.09 0.00 0.00 178.44 178.11 2z3r h GLU 53 N 0.39 0.00 -0.03 1.13 5.08 -0.96 -3.09 114.58 117.10 2z3r h GLU 53 Ca 0.12 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.24 2z3r h GLU 53 Cb -0.01 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.25 2z3r h GLU 53 CO -0.05 0.39 -0.94 0.66 -1.00 0.00 0.00 179.01 178.07 2z3r h SER 54 N 0.00 0.77 -3.37 1.42 4.64 0.35 -3.47 113.55 113.89 2z3r h SER 54 Ca -0.00 -0.58 -0.36 0.00 -0.47 0.00 0.00 61.79 60.37 2z3r h SER 54 Cb 0.87 -0.23 0.02 0.00 -0.31 0.00 0.00 62.40 62.75 2z3r h SER 54 CO 0.05 1.38 -0.51 0.61 -0.87 0.00 0.00 176.83 177.49 2z3r n GLY 55 N 0.93 -0.39 3.09 -0.77 0.00 0.26 -4.97 105.19 103.35 2z3r n GLY 55 Ca -0.08 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.48 2.38 0.12 1.61 2.15 -1.26 -5.04 116.67 114.15 2z3r s ASP 56 Ca 0.15 -0.42 -0.23 0.00 0.43 0.00 0.00 52.55 52.48 2z3r s ASP 56 Cb -0.06 -1.08 -0.06 0.00 -0.30 0.00 0.00 42.92 41.41 2z3r s ASP 56 CO 0.18 0.06 1.69 0.00 -0.17 0.00 0.00 175.17 176.93 2z3r h ALA 57 N 7.05 -0.07 -0.81 3.66 0.00 -1.96 0.01 119.26 127.15 2z3r h ALA 57 Ca -0.28 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2z3r h ALA 57 Cb 1.20 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 2z3r h ALA 57 CO 0.48 -0.58 0.44 0.77 0.00 0.00 0.00 179.25 180.36 2z3r h SER 58 N -0.16 1.00 0.22 0.00 0.02 -1.98 0.82 113.55 113.46 2z3r h SER 58 Ca 0.06 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2z3r h SER 58 Cb 0.25 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2z3r h SER 58 CO -0.16 0.80 -0.11 0.40 -1.14 0.00 0.00 176.83 176.62 2z3r h ILE 59 N 1.12 0.85 -0.66 3.27 2.04 -1.86 -1.23 117.51 121.03 2z3r h ILE 59 Ca 0.28 -0.72 0.14 0.00 1.00 0.00 0.00 64.86 65.57 2z3r h ILE 59 Cb 0.02 1.24 -0.11 0.00 -0.74 0.00 0.00 36.82 37.24 2z3r h ILE 59 CO -0.05 0.15 0.01 -0.74 0.00 0.00 0.00 178.15 177.52 2z3r h HIS 60 N -0.68 -0.03 -0.49 1.37 2.76 -0.85 0.19 115.15 117.42 2z3r h HIS 60 Ca -0.03 0.05 -0.08 0.00 -2.20 0.00 0.00 60.37 58.10 2z3r h HIS 60 Cb 0.48 0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.53 2z3r h HIS 60 CO 0.04 -0.18 -0.03 -0.44 -1.30 0.00 0.00 177.93 176.02 2z3r h ASP 61 N 0.12 0.82 -0.26 3.26 3.32 -0.70 -0.25 116.42 122.73 2z3r h ASP 61 Ca 0.35 -0.22 -0.18 0.00 0.02 0.00 0.00 57.03 57.00 2z3r h ASP 61 Cb 0.58 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2z3r h ASP 61 CO -0.56 0.90 -0.56 0.74 -1.72 0.00 0.00 179.24 178.04 2z3r h THR 62 N 0.78 1.28 -0.48 0.35 2.02 -0.38 -1.71 112.91 114.77 2z3r h THR 62 Ca 0.14 -1.75 -0.03 0.00 0.77 0.00 0.00 66.41 65.55 2z3r h THR 62 Cb 0.51 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 2z3r h THR 62 CO 0.03 0.57 0.18 0.58 0.37 0.00 0.00 175.52 177.24 2z3r h VAL 63 N 0.61 1.21 -0.32 3.16 2.07 -0.34 -1.30 116.25 121.35 2z3r h VAL 63 Ca 0.00 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.85 2z3r h VAL 63 Cb 1.17 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 2z3r h VAL 63 CO 0.12 0.25 0.21 -0.08 0.02 0.00 0.00 177.57 178.09 2z3r h GLU 64 N 0.63 0.42 -0.29 1.57 4.81 -0.86 -1.69 114.58 119.17 2z3r h GLU 64 Ca 0.16 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 2z3r h GLU 64 Cb 0.22 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2z3r h GLU 64 CO -0.01 0.29 -0.05 -0.97 -0.73 0.00 0.00 179.01 177.55 2z3r h ASN 65 N 0.43 -0.22 -0.23 1.04 -1.24 -1.21 -1.96 115.58 112.19 2z3r h ASN 65 Ca 0.12 0.08 0.05 0.00 0.71 0.00 0.00 56.30 57.26 2z3r h ASN 65 Cb -0.03 0.16 -0.05 0.00 0.73 0.00 0.00 38.32 39.12 2z3r h ASN 65 CO -0.02 -0.07 -0.09 0.25 -1.29 0.00 0.00 177.43 176.20 2z3r h LEU 66 N 0.03 -0.32 -0.81 0.34 6.46 -0.89 -1.31 115.31 118.81 2z3r h LEU 66 Ca 0.14 0.08 -0.08 0.00 -0.12 0.00 0.00 57.88 57.91 2z3r h LEU 66 Cb 0.21 0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 2z3r h LEU 66 CO -0.28 -0.12 0.03 0.40 -0.62 0.00 0.00 178.44 177.85 2z3r h ILE 67 N -0.06 1.25 -0.31 4.05 2.04 -1.16 0.34 117.51 123.67 2z3r h ILE 67 Ca 0.12 -1.04 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 2z3r h ILE 67 Cb 0.24 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2z3r h ILE 67 CO -0.27 0.38 0.10 0.40 0.00 0.00 0.00 178.15 178.75 2z3r h ILE 68 N 0.86 1.20 0.20 -0.67 2.04 -0.87 0.41 117.51 120.67 2z3r h ILE 68 Ca 0.16 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2z3r h ILE 68 Cb 0.47 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2z3r h ILE 68 CO 0.02 0.22 -0.17 -0.07 0.00 0.00 0.00 178.15 178.15 2z3r h LEU 69 N 0.35 -0.46 -0.30 1.44 -0.00 -0.97 -1.79 115.31 113.58 2z3r h LEU 69 Ca 0.10 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 2z3r h LEU 69 Cb 0.25 0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.05 2z3r h LEU 69 CO -0.00 -0.27 0.20 0.00 -0.00 0.00 0.00 178.44 178.37 2z3r h ALA 70 N 0.37 0.38 -0.53 1.53 0.00 -0.86 -2.33 119.26 117.82 2z3r h ALA 70 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2z3r h ALA 70 Cb 0.36 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2z3r h ALA 70 CO -0.03 -0.14 0.17 -0.91 0.00 0.00 0.00 179.25 178.34 2z3r h ASN 71 N 0.40 0.72 -0.46 0.00 2.35 -0.87 0.24 115.58 117.97 2z3r h ASN 71 Ca 0.11 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.71 2z3r h ASN 71 Cb -0.03 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.13 2z3r h ASN 71 CO -0.02 0.68 0.12 -1.13 -1.65 0.00 0.00 177.43 175.43 2z3r h ASN 72 N 0.77 0.73 -0.15 5.81 -0.00 -0.98 -2.98 115.58 118.77 2z3r h ASN 72 Ca 0.18 -0.13 -0.21 0.00 -0.00 0.00 0.00 56.30 56.14 2z3r h ASN 72 Cb 0.21 -0.19 0.01 0.00 -0.00 0.00 0.00 38.32 38.35 2z3r h ASN 72 CO -0.01 0.72 -0.72 0.28 -0.00 0.00 0.00 177.43 177.70 2z3r h SER 73 N 0.76 0.90 -0.62 1.15 0.02 -0.72 -3.31 113.55 111.73 2z3r h SER 73 Ca 0.17 -0.62 0.14 0.00 -0.84 0.00 0.00 61.79 60.64 2z3r h SER 73 Cb 0.28 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 2z3r h SER 73 CO -0.00 1.38 0.43 -0.07 -1.14 0.00 0.00 176.83 177.43 2z3r h LEU 74 N 0.48 0.19 -8.57 5.07 3.38 -0.41 -3.39 115.31 112.05 2z3r h LEU 74 Ca -0.05 0.01 -0.47 0.00 0.09 0.00 0.00 57.88 57.46 2z3r h LEU 74 Cb 1.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2z3r h LEU 74 CO 0.15 0.10 1.64 -0.24 0.09 0.00 0.00 178.44 180.18 2z3r n SER 75 N -4.43 2.19 0.00 -0.43 2.88 -1.21 -5.01 113.62 107.60 2z3r n SER 75 Ca 0.11 -0.40 0.00 0.00 -1.33 0.00 0.00 58.87 57.25 2z3r n SER 75 Cb 0.55 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 2z3r n SER 75 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2z3r n SER 76 N 15.18 0.00 0.00 -3.46 7.64 -1.26 -5.11 113.62 126.61 2z3r n SER 76 Ca 0.39 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.27 2z3r n SER 76 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2z3r n SER 76 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2z3r n VAL 80 N 0.00 0.00 -3.65 0.44 3.14 -1.26 -5.10 118.33 111.90 2z3r n VAL 80 Ca 0.00 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 2z3r n VAL 80 Cb 0.00 0.00 -0.12 0.00 -1.06 0.00 0.00 33.84 32.66 2z3r n VAL 80 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 2z3r s THR 81 N -2.00 4.90 -0.16 1.55 2.01 -1.26 -5.07 115.64 115.60 2z3r s THR 81 Ca 0.00 -0.02 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 2z3r s THR 81 Cb 0.00 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 2z3r s THR 81 CO 0.00 0.26 -0.04 -1.61 -0.69 0.00 0.00 174.62 172.54 2z3r s GLU 82 N 1.70 3.66 0.06 4.92 2.02 -1.26 -5.11 118.70 124.69 2z3r s GLU 82 Ca 0.07 -0.53 0.08 0.00 0.02 0.00 0.00 54.97 54.61 2z3r s GLU 82 Cb -0.16 -2.92 -0.03 0.00 0.10 0.00 0.00 34.13 31.13 2z3r s GLU 82 CO 0.08 0.22 -0.22 -1.54 0.02 0.00 0.00 175.26 173.83 2z3r s SER 83 N 0.41 2.60 -1.34 -0.19 1.04 -1.26 -4.79 113.70 110.16 2z3r s SER 83 Ca -0.04 -0.58 -0.07 0.00 0.48 0.00 0.00 55.95 55.73 2z3r s SER 83 Cb -0.14 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.78 2z3r s SER 83 CO 0.03 0.14 0.48 0.61 0.98 0.00 0.00 173.24 175.49 2z3r n GLY 84 N 1.59 -0.43 3.97 7.32 0.00 -1.26 -5.01 105.19 111.38 2z3r n GLY 84 Ca -0.18 0.23 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 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 -4.21 4.23 0.66 0.00 1.02 -1.26 -5.01 119.74 115.17 2z3r s LYS 86 Ca 0.42 2.39 -0.18 0.00 0.02 0.00 0.00 55.97 58.62 2z3r s LYS 86 Cb -0.09 -3.05 -0.01 0.00 -0.52 0.00 0.00 37.83 34.16 2z3r s LYS 86 CO 0.32 -0.41 1.22 0.39 -0.92 0.00 0.00 175.35 175.95 2z3r n GLU 87 N 1.35 0.98 -0.32 1.68 -0.58 -1.26 -4.93 120.64 117.56 2z3r n GLU 87 Ca 0.03 0.39 0.03 0.00 -0.42 0.00 0.00 57.16 57.20 2z3r n GLU 87 Cb 0.40 -2.45 0.18 0.00 -0.57 0.00 0.00 31.44 28.99 2z3r n GLU 87 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2z3r n GLU 89 N -4.65 0.58 0.00 0.00 4.71 -1.26 -1.60 120.64 118.41 2z3r n GLU 89 Ca 0.15 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.41 2z3r n GLU 89 Cb 0.25 -1.45 0.06 0.00 -1.01 0.00 0.00 31.44 29.29 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 -0.95 0.42 -2.16 3.49 1.02 -0.55 -4.96 120.64 116.95 2z3r n GLU 90 Ca 0.12 -0.32 -0.28 0.00 -0.02 0.00 0.00 57.16 56.67 2z3r n GLU 90 Cb 0.06 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.03 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 -2.80 2.98 0.44 -4.62 1.43 -0.63 -5.02 118.68 110.47 2z3r s LEU 91 Ca 0.14 0.79 -0.22 0.00 -1.03 0.00 0.00 54.13 53.80 2z3r s LEU 91 Cb 0.17 -3.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.77 2z3r s LEU 91 CO 0.71 -1.33 1.07 -0.70 0.23 0.00 0.00 176.35 176.33 2z3r s GLU 92 N -5.20 3.94 -0.21 1.70 2.12 -1.25 -4.75 118.70 115.05 2z3r s GLU 92 Ca 0.57 1.51 -0.17 0.00 0.36 0.00 0.00 54.97 57.24 2z3r s GLU 92 Cb -0.11 -2.35 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 2z3r s GLU 92 CO 0.47 -0.34 0.47 -1.21 -0.54 0.00 0.00 175.26 174.12 2z3r s GLU 93 N -2.80 4.16 0.24 4.30 2.02 -1.26 -0.63 118.70 124.73 2z3r s GLU 93 Ca 0.62 0.31 0.07 0.00 0.02 0.00 0.00 54.97 56.00 2z3r s GLU 93 Cb -0.21 -3.57 -0.05 0.00 0.10 0.00 0.00 34.13 30.39 2z3r s GLU 93 CO 0.26 -0.15 -0.09 0.15 0.02 0.00 0.00 175.26 175.46 2z3r s LYS 94 N 1.64 1.43 1.19 1.61 1.02 -0.40 -4.77 119.74 121.45 2z3r s LYS 94 Ca 0.22 -1.69 -0.17 0.00 0.02 0.00 0.00 55.97 54.35 2z3r s LYS 94 Cb -0.15 -1.07 0.28 0.00 -0.52 0.00 0.00 37.83 36.36 2z3r s LYS 94 CO 0.09 0.08 1.05 0.54 -0.92 0.00 0.00 175.35 176.20 2z3r s ASN 95 N -3.37 0.94 0.30 2.83 2.20 -1.26 -0.72 114.94 115.85 2z3r s ASN 95 Ca 0.26 0.97 0.07 0.00 -0.94 0.00 0.00 52.86 53.23 2z3r s ASN 95 Cb 0.02 -1.46 0.48 0.00 -2.00 0.00 0.00 41.25 38.29 2z3r s ASN 95 CO 0.09 -4.15 1.71 0.40 -2.94 0.00 0.00 177.10 172.21 2z3r h ILE 96 N -2.59 1.31 -0.15 0.54 1.08 -1.85 -0.97 117.51 114.87 2z3r h ILE 96 Ca -0.51 -1.50 -0.09 0.00 -0.39 0.00 0.00 64.86 62.37 2z3r h ILE 96 Cb 1.32 1.69 -0.00 0.00 -3.07 0.00 0.00 36.82 36.76 2z3r h ILE 96 CO 0.43 0.45 -0.25 0.50 -0.69 0.00 0.00 178.15 178.58 2z3r h LYS 97 N 0.18 0.43 -0.81 2.37 3.64 -1.95 -0.15 116.57 120.28 2z3r h LYS 97 Ca 0.02 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 2z3r h LYS 97 Cb 0.80 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.61 2z3r h LYS 97 CO 0.06 0.86 0.42 0.93 -2.27 0.00 0.00 179.45 179.45 2z3r h GLU 98 N 0.05 1.14 -0.13 1.90 5.08 -1.90 -1.59 114.58 119.12 2z3r h GLU 98 Ca 0.01 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2z3r h GLU 98 Cb 0.83 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2z3r h GLU 98 CO 0.06 0.86 0.07 0.35 -1.00 0.00 0.00 179.01 179.34 2z3r h PHE 99 N 1.13 0.19 -0.18 4.33 3.57 -1.07 -2.05 116.94 122.86 2z3r h PHE 99 Ca 0.28 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.65 2z3r h PHE 99 Cb 0.07 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2z3r h PHE 99 CO 0.01 0.22 -0.43 -0.07 -2.23 0.00 0.00 178.31 175.80 2z3r h LEU 100 N 0.10 0.47 -0.39 0.59 3.38 -0.98 0.16 115.31 118.64 2z3r h LEU 100 Ca 0.05 -0.21 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 2z3r h LEU 100 Cb 0.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2z3r h LEU 100 CO -0.01 0.84 -0.29 -0.61 0.09 0.00 0.00 178.44 178.46 2z3r h GLN 101 N 0.36 0.89 -0.41 1.13 5.75 -1.21 -1.35 115.11 120.28 2z3r h GLN 101 Ca 0.03 -0.43 -0.10 0.00 -0.15 0.00 0.00 58.65 57.99 2z3r h GLN 101 Cb 0.90 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.43 2z3r h GLN 101 CO 0.08 1.08 -0.16 0.77 -2.65 0.00 0.00 178.83 177.95 2z3r h SER 102 N 0.71 0.75 -0.88 -0.69 0.02 -1.29 -2.25 113.55 109.92 2z3r h SER 102 Ca 0.08 -0.24 0.11 0.00 -0.84 0.00 0.00 61.79 60.90 2z3r h SER 102 Cb 0.87 -0.20 -0.08 0.00 0.14 0.00 0.00 62.40 63.12 2z3r h SER 102 CO 0.08 0.92 0.51 0.15 -1.14 0.00 0.00 176.83 177.35 2z3r h PHE 103 N 0.68 0.92 0.03 3.45 -0.00 -0.68 -1.40 116.94 119.93 2z3r h PHE 103 Ca 0.11 0.03 -0.00 0.00 -0.00 0.00 0.00 57.97 58.11 2z3r h PHE 103 Cb 0.64 -0.28 0.00 0.00 -0.00 0.00 0.00 35.95 36.32 2z3r h PHE 103 CO 0.03 0.34 -0.02 0.28 -0.00 0.00 0.00 178.31 178.94 2z3r h VAL 104 N 0.81 0.97 -0.59 1.41 2.07 -0.94 -2.29 116.25 117.68 2z3r h VAL 104 Ca 0.44 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 68.02 2z3r h VAL 104 Cb 0.47 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 2z3r h VAL 104 CO -0.28 0.00 0.28 0.45 0.02 0.00 0.00 177.57 178.04 2z3r h HIS 105 N -0.05 0.51 -0.14 1.57 3.86 -1.01 -0.02 115.15 119.88 2z3r h HIS 105 Ca -0.00 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.18 2z3r h HIS 105 Cb 0.04 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 2z3r h HIS 105 CO -0.08 0.21 -0.15 0.97 0.86 0.00 0.00 177.93 179.74 2z3r h ILE 106 N 0.52 1.19 -0.16 2.45 2.10 -1.22 -1.44 117.51 120.94 2z3r h ILE 106 Ca 0.28 -0.84 -0.11 0.00 1.08 0.00 0.00 64.86 65.27 2z3r h ILE 106 Cb 0.24 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.23 2z3r h ILE 106 CO -0.22 0.26 -0.34 0.58 -1.08 0.00 0.00 178.15 177.35 2z3r h VAL 107 N 0.21 1.35 -0.90 2.19 2.07 -0.64 -0.95 116.25 119.59 2z3r h VAL 107 Ca 0.04 -1.60 0.23 0.00 0.82 0.00 0.00 66.70 66.19 2z3r h VAL 107 Cb 0.41 1.96 -0.13 0.00 -1.52 0.00 0.00 31.29 32.01 2z3r h VAL 107 CO 0.03 0.48 0.37 1.56 0.02 0.00 0.00 177.57 180.03 2z3r h GLN 108 N 0.16 0.35 -0.53 1.57 4.20 -0.94 -0.93 115.11 118.99 2z3r h GLN 108 Ca 0.00 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 2z3r h GLN 108 Cb 0.94 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 2z3r h GLN 108 CO 0.08 0.23 0.00 1.98 -0.67 0.00 0.00 178.83 180.45 2z3r h MET 109 N 0.36 0.90 -0.48 1.46 1.85 -0.65 -0.92 114.93 117.45 2z3r h MET 109 Ca 0.57 -0.26 -0.02 0.00 -0.61 0.00 0.00 59.70 59.38 2z3r h MET 109 Cb 1.10 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 33.01 2z3r h MET 109 CO -0.56 0.90 0.23 0.74 -0.40 0.00 0.00 176.91 177.82 2z3r h PHE 110 N 0.84 0.68 -0.31 1.39 0.04 -0.04 -1.83 116.94 117.71 2z3r h PHE 110 Ca 0.16 -0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.94 2z3r h PHE 110 Cb 0.49 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.39 2z3r h PHE 110 CO 0.03 0.55 0.05 0.82 -0.60 0.00 0.00 178.31 179.15 2z3r h ILE 111 N 0.62 0.84 -0.92 -0.55 2.04 -1.01 -1.09 117.51 117.45 2z3r h ILE 111 Ca 0.16 -0.05 0.18 0.00 1.00 0.00 0.00 64.86 66.15 2z3r h ILE 111 Cb 0.12 0.67 -0.10 0.00 -0.74 0.00 0.00 36.82 36.76 2z3r h ILE 111 CO -0.02 0.03 0.49 -1.13 0.00 0.00 0.00 178.15 177.52 2z3r h ASN 112 N 0.15 0.59 -0.21 1.72 -0.73 -1.02 -3.21 115.58 112.87 2z3r h ASN 112 Ca 0.14 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.42 2z3r h ASN 112 Cb 0.16 0.01 0.00 0.00 0.27 0.00 0.00 38.32 38.77 2z3r h ASN 112 CO -0.20 0.20 0.00 0.35 -0.37 0.00 0.00 177.43 177.41 2z3r n THR 113 N -4.87 0.55 1.60 -3.57 -2.24 -0.70 -5.10 114.28 99.95 2z3r n THR 113 Ca 0.20 -0.78 0.14 0.00 -2.27 0.00 0.00 64.05 61.35 2z3r n THR 113 Cb 0.53 0.84 0.61 0.00 -2.10 0.00 0.00 70.33 70.21 2z3r n THR 113 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96