#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgz n ASP -4 N 0.00 0.06 0.02 1.67 8.00 -1.26 -3.24 116.55 121.81 2pgz n ASP -4 Ca 0.00 0.24 0.02 0.00 0.71 0.00 0.00 54.79 55.75 2pgz n ASP -4 Cb 0.00 -0.37 0.36 0.00 -0.02 0.00 0.00 41.12 41.08 2pgz n ASP -4 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2pgz h ASP -3 N 0.03 0.43 -0.11 -2.24 3.45 -2.05 0.17 116.42 116.09 2pgz h ASP -3 Ca 0.00 -0.06 0.01 0.00 0.43 0.00 0.00 57.03 57.41 2pgz h ASP -3 Cb 0.44 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.09 2pgz h ASP -3 CO 0.00 0.46 0.03 0.44 -1.57 0.00 0.00 179.24 178.60 2pgz h ASP -2 N 0.46 0.03 -0.26 6.45 3.32 -1.98 0.32 116.42 124.76 2pgz h ASP -2 Ca 0.11 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.06 2pgz h ASP -2 Cb 0.22 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2pgz h ASP -2 CO -0.00 0.04 -0.23 0.11 -1.72 0.00 0.00 179.24 177.43 2pgz h LYS -1 N 0.09 0.73 -0.34 3.56 1.57 -1.66 -1.43 116.57 119.10 2pgz h LYS -1 Ca 0.05 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 2pgz h LYS -1 Cb 0.03 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2pgz h LYS -1 CO -0.06 0.90 0.06 1.25 -0.57 0.00 0.00 179.45 181.03 2pgz h LEU 0 N 0.64 0.46 -0.15 2.94 7.12 -0.80 -2.23 115.31 123.30 2pgz h LEU 0 Ca 0.09 -0.07 -0.11 0.00 0.13 0.00 0.00 57.88 57.92 2pgz h LEU 0 Cb 0.73 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 40.75 2pgz h LEU 0 CO 0.06 0.49 -0.35 0.45 -0.13 0.00 0.00 178.44 178.96 2pgz h HIS 1 N 0.49 0.63 -0.74 1.25 3.86 -0.45 -2.68 115.15 117.50 2pgz h HIS 1 Ca 0.11 -0.24 -0.05 0.00 -1.16 0.00 0.00 60.37 59.04 2pgz h HIS 1 Cb 0.23 -0.11 -0.03 0.00 1.06 0.00 0.00 27.41 28.56 2pgz h HIS 1 CO 0.01 0.97 0.29 0.66 0.86 0.00 0.00 177.93 180.71 2pgz h SER 2 N 0.11 1.04 -0.21 2.45 4.64 -1.12 0.19 113.55 120.65 2pgz h SER 2 Ca -0.00 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2pgz h SER 2 Cb 0.95 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 2pgz h SER 2 CO 0.08 0.94 0.13 1.56 -0.87 0.00 0.00 176.83 178.66 2pgz h GLN 3 N 1.08 0.28 -0.87 4.77 4.20 -1.49 -0.87 115.11 122.20 2pgz h GLN 3 Ca 0.25 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 2pgz h GLN 3 Cb 0.23 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 2pgz h GLN 3 CO -0.02 0.22 0.54 0.00 -0.67 0.00 0.00 178.83 178.90 2pgz h ALA 4 N 1.05 1.11 -0.64 3.87 0.00 -1.09 0.10 119.26 123.66 2pgz h ALA 4 Ca 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2pgz h ALA 4 Cb 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 2pgz h ALA 4 CO -0.02 0.56 0.37 -0.91 0.00 0.00 0.00 179.25 179.26 2pgz h ASN 5 N 1.20 0.78 -0.19 0.00 2.35 -0.44 -0.51 115.58 118.76 2pgz h ASN 5 Ca 0.31 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.92 2pgz h ASN 5 Cb -0.07 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.10 2pgz h ASN 5 CO -0.06 0.63 -0.16 0.25 -1.65 0.00 0.00 177.43 176.43 2pgz h LEU 6 N 0.87 0.48 -1.14 1.61 5.85 -0.67 -0.88 115.31 121.44 2pgz h LEU 6 Ca 0.23 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.54 2pgz h LEU 6 Cb 0.00 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 2pgz h LEU 6 CO -0.04 0.84 0.59 0.24 -0.34 0.00 0.00 178.44 179.73 2pgz h MET 7 N 0.13 1.03 -0.29 1.25 2.86 -0.76 -1.04 114.93 118.11 2pgz h MET 7 Ca 0.03 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.55 2pgz h MET 7 Cb 0.69 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 2pgz h MET 7 CO 0.04 0.68 -0.06 -0.09 1.06 0.00 0.00 176.91 178.54 2pgz h ARG 8 N 1.06 0.55 0.21 1.72 2.43 -0.93 -1.59 114.38 117.83 2pgz h ARG 8 Ca 0.38 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2pgz h ARG 8 Cb 0.15 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2pgz h ARG 8 CO -0.14 0.74 -0.10 1.25 -1.51 0.00 0.00 179.97 180.21 2pgz h LEU 9 N 0.31 -0.24 -1.43 3.80 5.85 -0.83 -0.76 115.31 122.02 2pgz h LEU 9 Ca 0.07 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.83 2pgz h LEU 9 Cb 0.53 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 2pgz h LEU 9 CO 0.03 -0.17 0.42 0.11 -0.34 0.00 0.00 178.44 178.48 2pgz h LYS 10 N -0.29 0.73 -0.49 1.25 1.57 -1.19 -0.51 116.57 117.64 2pgz h LYS 10 Ca -0.03 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.64 2pgz h LYS 10 Cb 0.22 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2pgz h LYS 10 CO 0.05 0.48 0.03 1.03 -0.57 0.00 0.00 179.45 180.47 2pgz h SER 11 N 0.75 0.83 0.32 0.86 0.87 -1.08 -2.23 113.55 113.88 2pgz h SER 11 Ca 0.25 -0.29 -0.17 0.00 -1.23 0.00 0.00 61.79 60.35 2pgz h SER 11 Cb 0.06 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 2pgz h SER 11 CO -0.07 0.92 -0.69 0.44 -0.53 0.00 0.00 176.83 176.90 2pgz h ASP 12 N 0.72 0.38 0.10 6.23 3.32 -0.19 -3.30 116.42 123.68 2pgz h ASP 12 Ca 0.14 -0.24 -0.28 0.00 0.02 0.00 0.00 57.03 56.67 2pgz h ASP 12 Cb 0.47 -0.11 0.03 0.00 0.22 0.00 0.00 39.33 39.94 2pgz h ASP 12 CO 0.02 0.96 -1.16 -0.07 -1.72 0.00 0.00 179.24 177.27 2pgz h LEU 13 N 0.23 0.84 -4.41 1.55 3.38 -1.16 -3.33 115.31 112.41 2pgz h LEU 13 Ca -0.02 -0.82 -0.60 0.00 0.09 0.00 0.00 57.88 56.54 2pgz h LEU 13 Cb 1.24 -0.26 -0.22 0.00 0.09 0.00 0.00 40.66 41.50 2pgz h LEU 13 CO 0.11 1.57 0.71 0.49 0.09 0.00 0.00 178.44 181.42 2pgz n PHE 14 N -3.85 2.37 -2.75 1.13 0.99 -0.84 -5.03 117.46 109.48 2pgz n PHE 14 Ca -0.13 -2.29 -0.10 0.00 -0.00 0.00 0.00 57.45 54.93 2pgz n PHE 14 Cb 0.94 -1.27 0.06 0.00 -1.00 0.00 0.00 39.48 38.21 2pgz n PHE 14 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2pgz n ASN 15 N -0.03 -0.17 -3.22 4.37 5.03 -1.24 -4.95 115.26 115.05 2pgz n ASN 15 Ca 0.50 -2.77 0.04 0.00 0.87 0.00 0.00 54.58 53.22 2pgz n ASN 15 Cb 0.47 0.24 -0.04 0.00 -1.02 0.00 0.00 39.78 39.44 2pgz n ASN 15 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 2pgz s TYR 20 N -1.55 -0.23 -1.10 3.10 5.04 -1.26 -5.02 117.35 116.33 2pgz s TYR 20 Ca 0.27 0.36 0.07 0.00 -2.44 0.00 0.00 57.07 55.33 2pgz s TYR 20 Cb 0.41 0.12 0.32 0.00 0.35 0.00 0.00 41.96 43.17 2pgz s TYR 20 CO -0.03 -0.11 1.09 -0.35 -1.34 0.00 0.00 175.55 174.81 2pgz n PRO 21 N 4.81 2.36 0.00 4.97 -0.04 -1.26 -4.86 135.00 140.97 2pgz n PRO 21 Ca -0.07 -1.27 0.00 0.00 -0.04 0.00 0.00 63.50 62.12 2pgz n PRO 21 Cb 0.55 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 2pgz n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2pgz n GLY 22 N 0.50 -0.92 3.79 0.55 0.00 -1.26 -4.99 105.19 102.85 2pgz n GLY 22 Ca 0.11 -1.65 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 2pgz n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pgz s PRO 23 N -2.04 2.67 0.26 1.61 0.04 -1.26 -5.04 135.00 131.25 2pgz s PRO 23 Ca 0.00 1.14 -0.02 0.00 0.04 0.00 0.00 61.00 62.15 2pgz s PRO 23 Cb 0.00 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 2pgz s PRO 23 CO 0.00 -1.32 0.30 0.95 0.04 0.00 0.00 177.00 176.97 2pgz s THR 24 N -2.82 0.00 0.44 1.26 -4.23 -0.76 -4.97 115.64 104.56 2pgz s THR 24 Ca 0.61 -1.80 0.10 0.00 -1.18 0.00 0.00 61.69 59.43 2pgz s THR 24 Cb -0.16 -2.47 0.25 0.00 1.34 0.00 0.00 72.50 71.46 2pgz s THR 24 CO 0.51 0.00 2.07 0.50 -0.54 0.00 0.00 174.62 177.16 2pgz h LYS 25 N 2.35 0.31 0.00 3.99 3.64 -1.91 -1.23 116.57 123.72 2pgz h LYS 25 Ca -0.30 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.03 2pgz h LYS 25 Cb 1.24 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2pgz h LYS 25 CO 0.43 0.24 -0.14 -0.44 -2.27 0.00 0.00 179.45 177.28 2pgz h ASP 26 N 0.32 0.00 -1.93 4.20 3.32 -1.96 -3.38 116.42 116.99 2pgz h ASP 26 Ca 0.08 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.60 2pgz h ASP 26 Cb 0.02 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 39.19 2pgz h ASP 26 CO -0.01 0.10 -1.11 -0.67 -1.72 0.00 0.00 179.24 175.83 2pgz n ASP 27 N -3.11 0.23 -4.89 6.45 2.03 -0.75 -5.13 116.55 111.38 2pgz n ASP 27 Ca 0.03 -2.79 -0.30 0.00 0.52 0.00 0.00 54.79 52.25 2pgz n ASP 27 Cb 0.57 -0.55 0.04 0.00 -0.72 0.00 0.00 41.12 40.46 2pgz n ASP 27 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2pgz s PRO 28 N -1.43 2.95 0.10 -0.67 0.04 -0.54 -1.83 135.00 133.62 2pgz s PRO 28 Ca 0.36 0.42 0.04 0.00 0.04 0.00 0.00 61.00 61.87 2pgz s PRO 28 Cb 0.22 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.66 2pgz s PRO 28 CO -0.11 -0.93 -0.11 -1.17 0.04 0.00 0.00 177.00 174.72 2pgz s LEU 29 N -5.29 2.38 -0.15 -3.56 0.20 -0.14 -4.93 118.68 107.21 2pgz s LEU 29 Ca 0.57 -0.78 -0.01 0.00 0.69 0.00 0.00 54.13 54.60 2pgz s LEU 29 Cb -0.11 -0.38 -0.01 0.00 -0.43 0.00 0.00 46.19 45.25 2pgz s LEU 29 CO 0.51 -0.21 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.36 2pgz s THR 30 N -2.19 3.15 -0.21 3.68 2.01 -1.26 -0.94 115.64 119.89 2pgz s THR 30 Ca 0.05 -0.62 -0.05 0.00 0.31 0.00 0.00 61.69 61.38 2pgz s THR 30 Cb -0.04 -2.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.10 2pgz s THR 30 CO 0.01 0.51 0.00 -0.69 -0.69 0.00 0.00 174.62 173.76 2pgz s VAL 31 N 0.53 3.94 -0.13 3.82 1.01 0.19 -4.31 120.40 125.45 2pgz s VAL 31 Ca -0.08 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 2pgz s VAL 31 Cb -0.15 -2.79 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 2pgz s VAL 31 CO 0.04 0.42 0.35 -0.89 0.00 0.00 0.00 175.10 175.01 2pgz s THR 32 N 1.07 5.25 0.08 3.92 2.01 0.29 -1.40 115.64 126.87 2pgz s THR 32 Ca 0.02 0.67 0.10 0.00 0.31 0.00 0.00 61.69 62.79 2pgz s THR 32 Cb -0.14 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2pgz s THR 32 CO 0.02 0.40 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.33 2pgz s LEU 33 N 0.29 2.29 -0.14 4.42 1.43 0.42 -1.42 118.68 125.97 2pgz s LEU 33 Ca 0.20 -0.63 -0.16 0.00 -1.03 0.00 0.00 54.13 52.51 2pgz s LEU 33 Cb -0.14 -1.30 0.04 0.00 0.03 0.00 0.00 46.19 44.83 2pgz s LEU 33 CO 0.06 0.22 0.43 -0.83 0.23 0.00 0.00 176.35 176.47 2pgz s GLY 34 N -1.62 -0.32 -0.08 -3.19 0.00 -0.78 -4.40 107.32 96.94 2pgz s GLY 34 Ca 0.13 1.13 0.00 0.00 0.00 0.00 0.00 44.72 45.99 2pgz s GLY 34 CO 0.04 0.95 -0.06 -1.36 0.00 0.00 0.00 173.10 172.67 2pgz s PHE 35 N 0.01 2.96 -0.36 1.90 0.08 -1.26 -0.20 117.98 121.11 2pgz s PHE 35 Ca -0.02 -0.01 -0.02 0.00 0.12 0.00 0.00 56.93 57.01 2pgz s PHE 35 Cb -0.03 -1.74 0.08 0.00 -0.57 0.00 0.00 43.02 40.76 2pgz s PHE 35 CO 0.01 0.30 0.10 0.99 -0.10 0.00 0.00 175.22 176.52 2pgz s THR 36 N -0.69 3.06 -0.24 0.64 2.01 -0.26 -1.20 115.64 118.96 2pgz s THR 36 Ca 0.10 -1.81 -0.24 0.00 0.31 0.00 0.00 61.69 60.05 2pgz s THR 36 Cb -0.11 -2.98 -0.01 0.00 0.01 0.00 0.00 72.50 69.41 2pgz s THR 36 CO 0.02 -0.44 0.82 -0.22 -0.69 0.00 0.00 174.62 174.10 2pgz s LEU 37 N 1.16 4.09 -0.20 4.42 2.96 -0.74 -1.14 118.68 129.24 2pgz s LEU 37 Ca 0.03 1.03 0.04 0.00 -0.22 0.00 0.00 54.13 55.01 2pgz s LEU 37 Cb -0.21 -3.18 -0.21 0.00 0.50 0.00 0.00 46.19 43.09 2pgz s LEU 37 CO -0.03 -0.50 0.04 1.67 -1.32 0.00 0.00 176.35 176.20 2pgz n GLN 38 N 5.92 0.68 -3.63 1.98 7.27 0.26 -3.47 117.38 126.39 2pgz n GLN 38 Ca 0.05 0.16 -0.11 0.00 0.07 0.00 0.00 57.00 57.17 2pgz n GLN 38 Cb 0.48 -1.59 -0.07 0.00 2.41 0.00 0.00 30.24 31.47 2pgz n GLN 38 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2pgz s ASP 39 N -6.42 -0.63 -0.48 1.69 2.15 -0.79 -0.07 116.67 112.12 2pgz s ASP 39 Ca -0.25 1.18 -0.18 0.00 0.43 0.00 0.00 52.55 53.73 2pgz s ASP 39 Cb 0.08 1.21 0.05 0.00 -0.30 0.00 0.00 42.92 43.96 2pgz s ASP 39 CO 0.70 -0.20 0.56 -0.63 -0.17 0.00 0.00 175.17 175.43 2pgz s ILE 40 N 0.43 4.96 -0.04 4.11 1.01 -1.26 -0.59 121.20 129.82 2pgz s ILE 40 Ca 0.00 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 59.94 2pgz s ILE 40 Cb -0.05 -4.22 -0.32 0.00 0.01 0.00 0.00 42.46 37.88 2pgz s ILE 40 CO -0.04 -0.69 0.88 0.58 0.00 0.00 0.00 174.94 175.67 2pgz h VAL 41 N 5.82 1.42 -2.98 2.92 2.07 -1.44 -3.41 116.25 120.65 2pgz h VAL 41 Ca -0.27 -2.56 -0.15 0.00 0.82 0.00 0.00 66.70 64.54 2pgz h VAL 41 Cb 1.10 3.13 -0.25 0.00 -1.52 0.00 0.00 31.29 33.74 2pgz h VAL 41 CO 0.92 0.74 -0.36 -0.75 0.02 0.00 0.00 177.57 178.13 2pgz s LYS 42 N -2.47 0.35 -0.12 1.57 2.20 -1.23 -4.91 119.74 115.13 2pgz s LYS 42 Ca -0.13 0.44 0.01 0.00 -0.36 0.00 0.00 55.97 55.93 2pgz s LYS 42 Cb 0.02 0.15 0.02 0.00 -1.51 0.00 0.00 37.83 36.51 2pgz s LYS 42 CO 0.85 -0.05 -0.14 0.00 -0.36 0.00 0.00 175.35 175.64 2pgz s ALA 43 N 0.27 1.70 -0.39 3.13 0.00 -1.26 -0.98 121.76 124.22 2pgz s ALA 43 Ca -0.01 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.15 2pgz s ALA 43 Cb -0.03 -0.91 0.09 0.00 0.00 0.00 0.00 23.12 22.28 2pgz s ALA 43 CO -0.01 -0.20 0.18 0.34 0.00 0.00 0.00 175.76 176.07 2pgz s ASP 44 N 1.21 5.28 0.00 0.00 -1.08 0.23 -4.95 116.67 117.36 2pgz s ASP 44 Ca -0.02 -1.76 0.25 0.00 -0.52 0.00 0.00 52.55 50.50 2pgz s ASP 44 Cb -0.14 -1.84 1.08 0.00 -1.46 0.00 0.00 42.92 40.55 2pgz s ASP 44 CO -0.05 -0.49 1.80 -1.54 0.52 0.00 0.00 175.17 175.41 2pgz n SER 45 N 4.68 0.00 0.17 -0.34 3.41 -1.26 -0.55 113.62 119.73 2pgz n SER 45 Ca -0.06 0.46 0.07 0.00 -0.26 0.00 0.00 58.87 59.08 2pgz n SER 45 Cb 0.42 -0.49 0.09 0.00 -0.26 0.00 0.00 64.21 63.98 2pgz n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2pgz h SER 46 N 0.00 0.00 0.00 4.04 4.64 -1.95 -3.37 113.55 116.91 2pgz h SER 46 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pgz h SER 46 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2pgz h SER 46 CO 0.00 0.25 0.00 0.35 -0.87 0.00 0.00 176.83 176.56 2pgz n THR 47 N -3.14 0.00 -3.60 2.95 -2.24 -1.16 -5.03 114.28 102.07 2pgz n THR 47 Ca 0.03 -0.36 -0.23 0.00 -2.27 0.00 0.00 64.05 61.22 2pgz n THR 47 Cb 0.63 1.13 0.04 0.00 -2.10 0.00 0.00 70.33 70.04 2pgz n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2pgz n ASN 48 N -0.39 -3.33 -4.20 3.42 3.02 0.29 -4.93 115.26 109.15 2pgz n ASN 48 Ca 0.00 -0.84 -0.27 0.00 -0.03 0.00 0.00 54.58 53.44 2pgz n ASN 48 Cb 0.03 -4.15 -0.16 0.00 -0.61 0.00 0.00 39.78 34.90 2pgz n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2pgz s GLU 49 N -5.64 1.76 0.05 3.52 2.02 -1.10 -1.54 118.70 117.75 2pgz s GLU 49 Ca 0.21 -0.71 0.07 0.00 0.02 0.00 0.00 54.97 54.57 2pgz s GLU 49 Cb -0.06 -1.63 -0.03 0.00 0.10 0.00 0.00 34.13 32.52 2pgz s GLU 49 CO 0.81 0.38 -0.21 0.08 0.02 0.00 0.00 175.26 176.34 2pgz s VAL 50 N -0.31 1.67 -0.21 2.63 1.01 -0.43 -0.60 120.40 124.15 2pgz s VAL 50 Ca 0.04 -1.22 -0.04 0.00 0.00 0.00 0.00 61.98 60.76 2pgz s VAL 50 Cb -0.09 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2pgz s VAL 50 CO 0.00 0.19 -0.04 -1.81 0.00 0.00 0.00 175.10 173.44 2pgz s ASP 51 N -1.22 4.35 0.05 3.32 1.11 -0.16 -1.16 116.67 122.96 2pgz s ASP 51 Ca 0.07 -0.36 0.04 0.00 0.18 0.00 0.00 52.55 52.49 2pgz s ASP 51 Cb -0.09 -1.74 -0.04 0.00 1.07 0.00 0.00 42.92 42.12 2pgz s ASP 51 CO 0.02 0.00 -0.04 -0.76 1.18 0.00 0.00 175.17 175.57 2pgz s LEU 52 N 1.33 3.28 -0.12 1.23 1.43 0.13 -1.02 118.68 124.94 2pgz s LEU 52 Ca 0.04 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.98 2pgz s LEU 52 Cb -0.14 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2pgz s LEU 52 CO -0.02 0.23 -0.23 -0.69 0.23 0.00 0.00 176.35 175.87 2pgz s VAL 53 N -1.15 2.11 0.19 -1.59 1.01 0.25 -0.87 120.40 120.34 2pgz s VAL 53 Ca 0.21 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 61.07 2pgz s VAL 53 Cb -0.11 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.45 2pgz s VAL 53 CO 0.13 0.55 0.42 -0.72 0.00 0.00 0.00 175.10 175.48 2pgz s TYR 54 N 0.55 0.15 -0.21 5.22 -0.85 -0.71 -0.58 117.35 120.93 2pgz s TYR 54 Ca -0.13 -0.51 -0.09 0.00 -0.52 0.00 0.00 57.07 55.82 2pgz s TYR 54 Cb -0.17 0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 2pgz s TYR 54 CO 0.04 -0.85 0.10 0.71 -1.52 0.00 0.00 175.55 174.04 2pgz s TYR 55 N -3.93 3.27 -0.42 -3.49 4.12 -0.29 -0.55 117.35 116.06 2pgz s TYR 55 Ca 0.14 0.10 -0.11 0.00 0.02 0.00 0.00 57.07 57.22 2pgz s TYR 55 Cb 0.01 -2.17 0.06 0.00 -1.52 0.00 0.00 41.96 38.35 2pgz s TYR 55 CO -0.00 0.09 0.27 -2.00 0.02 0.00 0.00 175.55 173.92 2pgz s GLU 56 N 0.72 2.72 -0.04 -0.62 2.12 -0.41 -1.10 118.70 122.09 2pgz s GLU 56 Ca 0.05 -1.35 -0.30 0.00 0.36 0.00 0.00 54.97 53.74 2pgz s GLU 56 Cb -0.13 -3.83 -0.02 0.00 0.26 0.00 0.00 34.13 30.41 2pgz s GLU 56 CO 0.02 -0.90 0.99 -1.14 -0.54 0.00 0.00 175.26 173.69 2pgz s GLN 57 N 1.49 4.51 -0.07 4.30 0.74 0.72 -3.06 119.66 128.29 2pgz s GLN 57 Ca 0.03 1.41 0.04 0.00 0.05 0.00 0.00 55.36 56.88 2pgz s GLN 57 Cb -0.22 -3.49 0.00 0.00 1.10 0.00 0.00 33.01 30.40 2pgz s GLN 57 CO 0.04 -0.16 -0.18 -0.65 -0.55 0.00 0.00 175.29 173.79 2pgz s GLN 58 N 1.41 2.19 -0.01 1.67 -0.21 0.26 -1.87 119.66 123.10 2pgz s GLN 58 Ca 0.51 -0.64 0.00 0.00 0.02 0.00 0.00 55.36 55.25 2pgz s GLN 58 Cb -0.20 -1.77 0.01 0.00 1.00 0.00 0.00 33.01 32.05 2pgz s GLN 58 CO 0.24 0.16 -0.01 0.50 -2.12 0.00 0.00 175.29 174.06 2pgz s ARG 59 N 0.33 0.16 0.27 2.91 3.00 -0.51 -0.93 118.95 124.19 2pgz s ARG 59 Ca -0.12 0.01 -0.09 0.00 -1.00 0.00 0.00 55.73 54.54 2pgz s ARG 59 Cb -0.15 -0.25 -0.00 0.00 0.00 0.00 0.00 34.95 34.54 2pgz s ARG 59 CO 0.05 -0.04 0.45 1.67 0.00 0.00 0.00 175.30 177.43 2pgz s TRP 60 N 0.43 0.64 -0.02 5.12 -2.14 -0.99 -0.55 118.94 121.44 2pgz s TRP 60 Ca -0.04 -0.96 0.01 0.00 2.66 0.00 0.00 56.10 57.76 2pgz s TRP 60 Cb -0.06 0.05 0.02 0.00 -3.10 0.00 0.00 33.47 30.38 2pgz s TRP 60 CO -0.01 -1.02 -0.01 0.21 -2.66 0.00 0.00 176.95 173.47 2pgz s LYS 61 N -3.69 0.22 -0.10 3.25 2.20 -1.26 -0.37 119.74 119.99 2pgz s LYS 61 Ca 0.26 0.02 0.04 0.00 -0.36 0.00 0.00 55.97 55.93 2pgz s LYS 61 Cb 0.00 -0.34 0.00 0.00 -1.51 0.00 0.00 37.83 35.98 2pgz s LYS 61 CO 0.13 -0.06 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.31 2pgz s LEU 62 N 0.59 2.05 0.41 5.43 1.43 0.00 -4.87 118.68 123.71 2pgz s LEU 62 Ca -0.06 -0.54 0.15 0.00 -1.03 0.00 0.00 54.13 52.66 2pgz s LEU 62 Cb -0.09 -1.35 1.02 0.00 0.03 0.00 0.00 46.19 45.80 2pgz s LEU 62 CO -0.01 0.15 1.87 0.78 0.23 0.00 0.00 176.35 179.36 2pgz h ASN 63 N 6.75 0.46 0.59 2.29 2.35 -1.90 -1.81 115.58 124.31 2pgz h ASN 63 Ca -0.20 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2pgz h ASN 63 Cb 1.23 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2pgz h ASN 63 CO 0.47 0.20 0.00 -1.54 -1.65 0.00 0.00 177.43 174.92 2pgz n SER 64 N -4.52 0.31 -0.90 5.81 3.41 -1.26 -2.54 113.62 113.93 2pgz n SER 64 Ca 0.18 0.58 0.08 0.00 -0.26 0.00 0.00 58.87 59.45 2pgz n SER 64 Cb 0.62 -0.64 0.21 0.00 -0.26 0.00 0.00 64.21 64.14 2pgz n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2pgz n LEU 65 N -1.84 3.26 -4.77 1.04 4.77 -0.68 -4.98 117.00 113.80 2pgz n LEU 65 Ca 0.03 -1.93 -0.38 0.00 -0.03 0.00 0.00 56.01 53.70 2pgz n LEU 65 Cb 0.19 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 40.91 2pgz n LEU 65 CO 0.16 0.80 0.66 -0.04 -1.33 0.00 0.00 177.39 177.65 2pgz s MET 66 N -1.02 4.61 0.07 3.23 -1.94 -1.05 -3.73 119.30 119.47 2pgz s MET 66 Ca 0.32 1.40 -0.12 0.00 -1.71 0.00 0.00 55.69 55.58 2pgz s MET 66 Cb 0.17 -2.89 0.01 0.00 2.01 0.00 0.00 34.83 34.13 2pgz s MET 66 CO 0.22 0.29 0.27 1.67 -0.01 0.00 0.00 175.02 177.47 2pgz s TRP 67 N -1.51 -0.03 -0.32 -0.03 -2.14 -0.21 -4.94 118.94 109.77 2pgz s TRP 67 Ca 0.49 -0.24 -0.23 0.00 2.66 0.00 0.00 56.10 58.77 2pgz s TRP 67 Cb -0.21 0.06 0.00 0.00 -3.10 0.00 0.00 33.47 30.22 2pgz s TRP 67 CO 0.27 -0.54 0.78 0.34 -2.66 0.00 0.00 176.95 175.13 2pgz s ASP 68 N -2.44 6.63 0.36 -2.66 -1.08 -1.26 -4.66 116.67 111.56 2pgz s ASP 68 Ca -0.01 0.57 0.10 0.00 -0.52 0.00 0.00 52.55 52.70 2pgz s ASP 68 Cb 0.01 -2.40 0.86 0.00 -1.46 0.00 0.00 42.92 39.93 2pgz s ASP 68 CO -0.07 -0.64 1.85 -0.65 0.52 0.00 0.00 175.17 176.18 2pgz h PRO 69 N 8.21 0.63 0.00 4.34 0.11 -1.94 -1.79 132.00 141.56 2pgz h PRO 69 Ca -0.25 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 2pgz h PRO 69 Cb 1.10 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2pgz h PRO 69 CO 0.89 0.42 -0.00 -0.91 -0.21 0.00 0.00 178.00 178.18 2pgz h ASN 70 N 0.65 0.00 1.80 -2.05 2.35 -1.93 0.41 115.58 116.81 2pgz h ASN 70 Ca 0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 2pgz h ASN 70 Cb 0.84 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.21 2pgz h ASN 70 CO -0.23 0.00 -0.00 -0.33 -1.65 0.00 0.00 177.43 175.22 2pgz h GLU 71 N 0.00 0.00 -1.24 0.81 5.08 -1.73 -3.37 114.58 114.13 2pgz h GLU 71 Ca -0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2pgz h GLU 71 Cb 0.01 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.85 2pgz h GLU 71 CO 0.00 0.00 -0.97 0.66 -1.00 0.00 0.00 179.01 177.70 2pgz n TYR 72 N -2.78 2.26 -3.58 4.33 4.01 -0.08 -4.96 117.16 116.34 2pgz n TYR 72 Ca 0.05 -2.93 -0.27 0.00 -0.16 0.00 0.00 57.90 54.59 2pgz n TYR 72 Cb 0.49 -0.23 0.02 0.00 -0.31 0.00 0.00 39.34 39.31 2pgz n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pgz n GLY 73 N -0.28 -0.50 2.40 2.72 0.00 -1.13 -2.39 105.19 106.00 2pgz n GLY 73 Ca 0.24 0.16 -0.17 0.00 0.00 0.00 0.00 46.02 46.25 2pgz n GLY 73 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2pgz n ASN 74 N -2.64 -5.04 -4.69 1.61 3.02 0.12 -4.98 115.26 102.67 2pgz n ASN 74 Ca -0.00 0.18 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 2pgz n ASN 74 Cb 0.55 -4.09 -0.03 0.00 -0.61 0.00 0.00 39.78 35.60 2pgz n ASN 74 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pgz s ILE 75 N -2.75 3.45 -0.16 2.41 1.01 -1.01 -4.89 121.20 119.26 2pgz s ILE 75 Ca 0.00 0.85 0.09 0.00 0.00 0.00 0.00 60.65 61.59 2pgz s ILE 75 Cb 0.00 -3.55 -0.12 0.00 0.01 0.00 0.00 42.46 38.80 2pgz s ILE 75 CO 0.00 -0.01 0.26 0.35 0.00 0.00 0.00 174.94 175.55 2pgz n THR 76 N 4.72 0.00 -3.53 2.92 -2.24 -1.26 -4.28 114.28 110.61 2pgz n THR 76 Ca 0.14 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 2pgz n THR 76 Cb 0.42 0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 2pgz n THR 76 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2pgz s ASP 77 N -2.61 -0.42 0.13 3.42 1.47 -1.26 -0.45 116.67 116.95 2pgz s ASP 77 Ca -0.01 -0.16 -0.12 0.00 1.18 0.00 0.00 52.55 53.44 2pgz s ASP 77 Cb 0.06 0.56 0.01 0.00 -0.34 0.00 0.00 42.92 43.21 2pgz s ASP 77 CO 0.37 -0.94 0.32 0.72 0.68 0.00 0.00 175.17 176.32 2pgz s PHE 78 N -3.78 0.06 -0.10 2.11 -0.12 0.05 -4.99 117.98 111.20 2pgz s PHE 78 Ca 0.02 -0.43 -0.05 0.00 -0.05 0.00 0.00 56.93 56.42 2pgz s PHE 78 Cb -0.00 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.45 2pgz s PHE 78 CO -0.12 -0.68 0.11 1.03 -0.05 0.00 0.00 175.22 175.51 2pgz s ARG 79 N -3.87 3.32 -0.06 1.99 3.00 -1.26 -0.45 118.95 121.61 2pgz s ARG 79 Ca 0.08 -0.22 -0.14 0.00 0.00 0.00 0.00 55.73 55.45 2pgz s ARG 79 Cb 0.03 -3.08 0.03 0.00 0.00 0.00 0.00 34.95 31.93 2pgz s ARG 79 CO -0.08 0.75 0.33 -0.08 0.00 0.00 0.00 175.30 176.22 2pgz s THR 80 N -1.02 0.03 0.20 0.02 -1.32 -0.27 -4.99 115.64 108.30 2pgz s THR 80 Ca 0.15 -0.27 -0.32 0.00 -1.21 0.00 0.00 61.69 60.04 2pgz s THR 80 Cb -0.12 -0.56 -0.14 0.00 -1.51 0.00 0.00 72.50 70.16 2pgz s THR 80 CO 0.05 -0.15 1.32 -0.24 -2.21 0.00 0.00 174.62 173.39 2pgz n SER 81 N 1.95 2.18 0.32 8.08 2.88 -1.26 -0.34 113.62 127.43 2pgz n SER 81 Ca -0.18 1.14 0.20 0.00 -1.33 0.00 0.00 58.87 58.70 2pgz n SER 81 Cb 0.57 -1.34 1.08 0.00 -0.75 0.00 0.00 64.21 63.77 2pgz n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pgz h ALA 82 N 4.03 1.13 0.00 -1.46 0.00 -1.20 0.23 119.26 121.99 2pgz h ALA 82 Ca -0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2pgz h ALA 82 Cb 1.30 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2pgz h ALA 82 CO 0.75 0.01 -0.07 0.00 0.00 0.00 0.00 179.25 179.94 2pgz h ALA 83 N 1.99 1.08 0.00 0.00 0.00 -1.89 -3.04 119.26 117.40 2pgz h ALA 83 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2pgz h ALA 83 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2pgz h ALA 83 CO 0.00 0.09 0.00 -0.25 0.00 0.00 0.00 179.25 179.09 2pgz n ASP 84 N -3.29 0.79 -4.27 0.00 8.00 0.81 -4.88 116.55 113.71 2pgz n ASP 84 Ca -0.01 0.62 -0.15 0.00 0.71 0.00 0.00 54.79 55.96 2pgz n ASP 84 Cb 0.27 -0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 40.45 2pgz n ASP 84 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2pgz s ILE 85 N -3.20 0.79 0.28 0.53 -4.36 -1.15 -5.04 121.20 109.05 2pgz s ILE 85 Ca 0.08 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.18 2pgz s ILE 85 Cb 0.11 -2.20 -0.10 0.00 1.25 0.00 0.00 42.46 41.53 2pgz s ILE 85 CO 0.52 -0.42 1.24 0.86 0.24 0.00 0.00 174.94 177.38 2pgz s TRP 86 N -3.58 3.28 0.08 1.37 -0.00 -1.26 -4.94 118.94 113.89 2pgz s TRP 86 Ca 0.26 1.46 0.05 0.00 -0.00 0.00 0.00 56.10 57.87 2pgz s TRP 86 Cb 0.06 -3.52 -0.03 0.00 -0.00 0.00 0.00 33.47 29.97 2pgz s TRP 86 CO 0.06 -1.42 -0.15 0.95 -0.00 0.00 0.00 176.95 176.39 2pgz s THR 87 N -0.79 1.20 0.46 5.86 -4.23 -1.26 -5.10 115.64 111.78 2pgz s THR 87 Ca 0.50 -1.40 -0.22 0.00 -1.18 0.00 0.00 61.69 59.38 2pgz s THR 87 Cb -0.36 -1.20 -0.08 0.00 1.34 0.00 0.00 72.50 72.20 2pgz s THR 87 CO 0.45 -0.25 1.10 -2.16 -0.54 0.00 0.00 174.62 173.22 2pgz s PRO 88 N -1.93 3.81 -0.23 3.99 0.04 -1.26 -4.94 135.00 134.49 2pgz s PRO 88 Ca 0.01 1.59 -0.05 0.00 0.04 0.00 0.00 61.00 62.59 2pgz s PRO 88 Cb -0.09 -2.31 -0.09 0.00 0.04 0.00 0.00 34.50 32.05 2pgz s PRO 88 CO 0.02 -0.47 3.14 -0.40 0.04 0.00 0.00 177.00 179.34 2pgz n ASP 89 N -0.61 5.86 -4.69 6.66 5.75 -1.26 -4.95 116.55 123.31 2pgz n ASP 89 Ca 0.08 -2.84 -0.42 0.00 -0.01 0.00 0.00 54.79 51.59 2pgz n ASP 89 Cb 0.50 -1.31 -0.03 0.00 -1.03 0.00 0.00 41.12 39.25 2pgz n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2pgz s ILE 90 N -0.66 3.78 0.01 2.12 -1.09 -1.26 -2.82 121.20 121.28 2pgz s ILE 90 Ca 0.61 1.14 0.03 0.00 -2.23 0.00 0.00 60.65 60.20 2pgz s ILE 90 Cb 0.34 -3.73 -0.01 0.00 -1.58 0.00 0.00 42.46 37.48 2pgz s ILE 90 CO -0.11 -0.01 -0.08 -0.89 -1.23 0.00 0.00 174.94 172.62 2pgz s THR 91 N 2.52 0.66 0.24 2.92 2.01 -0.05 -4.90 115.64 119.04 2pgz s THR 91 Ca 0.63 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.84 2pgz s THR 91 Cb -0.30 -0.58 -0.09 0.00 0.01 0.00 0.00 72.50 71.54 2pgz s THR 91 CO 0.26 0.08 1.13 0.00 -0.69 0.00 0.00 174.62 175.40 2pgz s ALA 92 N -0.41 3.41 -0.89 7.40 0.00 -1.26 -1.64 121.76 128.37 2pgz s ALA 92 Ca 0.01 0.91 0.25 0.00 0.00 0.00 0.00 51.96 53.13 2pgz s ALA 92 Cb -0.04 -3.36 0.47 0.00 0.00 0.00 0.00 23.12 20.19 2pgz s ALA 92 CO -0.00 -0.24 1.39 0.66 0.00 0.00 0.00 175.76 177.57 2pgz n TYR 93 N 1.71 0.16 -2.42 0.00 4.01 0.16 -4.13 117.16 116.65 2pgz n TYR 93 Ca 0.01 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2pgz n TYR 93 Cb 0.45 -0.38 0.06 0.00 -0.31 0.00 0.00 39.34 39.16 2pgz n TYR 93 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2pgz n SER 94 N -1.68 1.70 -4.75 7.72 3.41 -1.26 -5.02 113.62 113.74 2pgz n SER 94 Ca 0.05 -2.47 -0.31 0.00 -0.26 0.00 0.00 58.87 55.87 2pgz n SER 94 Cb 0.37 -0.39 0.11 0.00 -0.26 0.00 0.00 64.21 64.03 2pgz n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2pgz s SER 95 N -2.91 4.19 0.00 4.04 1.04 -1.26 -1.83 113.70 116.97 2pgz s SER 95 Ca 0.34 1.92 0.00 0.00 0.48 0.00 0.00 55.95 58.69 2pgz s SER 95 Cb 0.37 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.95 2pgz s SER 95 CO -0.09 -2.25 0.19 0.35 0.98 0.00 0.00 173.24 172.42 2pgz n THR 96 N -3.61 0.00 -3.92 2.02 -2.24 -0.29 -4.81 114.28 101.44 2pgz n THR 96 Ca 0.10 -0.46 -0.10 0.00 -2.27 0.00 0.00 64.05 61.32 2pgz n THR 96 Cb 0.53 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.69 2pgz n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2pgz s ARG 97 N -0.55 0.53 0.41 -0.78 0.52 -1.25 -5.06 118.95 112.77 2pgz s ARG 97 Ca 0.00 -0.65 -0.26 0.00 -0.52 0.00 0.00 55.73 54.30 2pgz s ARG 97 Cb 0.00 0.21 -0.10 0.00 0.52 0.00 0.00 34.95 35.58 2pgz s ARG 97 CO 0.00 -0.13 1.41 -2.30 0.02 0.00 0.00 175.30 174.30 2pgz n PRO 98 N 1.03 2.33 -1.80 3.54 -0.02 -1.26 -4.67 135.00 134.16 2pgz n PRO 98 Ca -0.20 0.82 -0.39 0.00 -2.02 0.00 0.00 63.50 61.71 2pgz n PRO 98 Cb 0.57 -2.57 0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2pgz n PRO 98 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2pgz s VAL 99 N -1.16 2.08 -0.18 -1.45 1.01 -1.26 -4.87 120.40 114.58 2pgz s VAL 99 Ca 0.58 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.58 2pgz s VAL 99 Cb -0.48 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2pgz s VAL 99 CO 0.60 0.01 0.00 -1.10 0.00 0.00 0.00 175.10 174.61 2pgz s GLN 100 N -2.59 3.74 -0.12 2.72 -0.21 -0.73 -4.98 119.66 117.49 2pgz s GLN 100 Ca 0.64 -0.47 -0.19 0.00 0.02 0.00 0.00 55.36 55.37 2pgz s GLN 100 Cb -0.43 -3.05 -0.04 0.00 1.00 0.00 0.00 33.01 30.50 2pgz s GLN 100 CO 0.53 0.18 0.50 0.08 -2.12 0.00 0.00 175.29 174.46 2pgz s VAL 101 N 0.55 5.17 -1.05 1.09 1.01 -1.26 -1.04 120.40 124.88 2pgz s VAL 101 Ca -0.01 0.99 0.11 0.00 0.00 0.00 0.00 61.98 63.07 2pgz s VAL 101 Cb -0.14 -3.83 -0.00 0.00 0.00 0.00 0.00 36.38 32.40 2pgz s VAL 101 CO 0.02 0.31 0.68 0.18 0.00 0.00 0.00 175.10 176.29 2pgz n LEU 102 N 3.80 1.31 -4.30 3.92 4.77 0.18 -4.99 117.00 121.69 2pgz n LEU 102 Ca -0.06 -0.77 -0.17 0.00 -0.03 0.00 0.00 56.01 54.98 2pgz n LEU 102 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2pgz n LEU 102 CO 0.43 0.26 -0.43 -0.94 -1.33 0.00 0.00 177.39 175.38 2pgz s SER 103 N -1.48 2.20 0.45 -1.43 1.04 -1.25 -4.91 113.70 108.32 2pgz s SER 103 Ca 0.09 -1.01 -0.25 0.00 0.48 0.00 0.00 55.95 55.26 2pgz s SER 103 Cb 0.09 -0.08 -0.08 0.00 0.10 0.00 0.00 66.02 66.05 2pgz s SER 103 CO 0.29 -0.24 1.43 -2.84 0.98 0.00 0.00 173.24 172.86 2pgz s PRO 104 N -3.64 3.70 -1.34 4.02 0.02 -1.26 -4.84 135.00 131.66 2pgz s PRO 104 Ca 0.19 2.43 -0.14 0.00 0.02 0.00 0.00 61.00 63.51 2pgz s PRO 104 Cb 0.01 -2.67 0.10 0.00 0.02 0.00 0.00 34.50 31.96 2pgz s PRO 104 CO 0.04 -0.81 1.91 1.04 -0.33 0.00 0.00 177.00 178.84 2pgz n GLN 105 N -0.17 3.21 -4.10 5.54 6.02 -1.26 -4.89 117.38 121.73 2pgz n GLN 105 Ca 0.05 -3.18 -0.16 0.00 -0.01 0.00 0.00 57.00 53.69 2pgz n GLN 105 Cb 0.42 -3.21 -0.15 0.00 1.02 0.00 0.00 30.24 28.32 2pgz n GLN 105 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2pgz s ILE 106 N 2.48 0.35 0.34 5.09 1.01 -1.26 -0.64 121.20 128.56 2pgz s ILE 106 Ca 0.46 -0.15 0.09 0.00 0.00 0.00 0.00 60.65 61.06 2pgz s ILE 106 Cb 0.08 -0.33 -0.06 0.00 0.01 0.00 0.00 42.46 42.16 2pgz s ILE 106 CO -0.01 0.12 -0.06 0.00 0.00 0.00 0.00 174.94 174.99 2pgz s ALA 107 N 0.16 3.04 -0.15 9.38 0.00 0.54 -4.64 121.76 130.10 2pgz s ALA 107 Ca -0.01 -2.02 -0.00 0.00 0.00 0.00 0.00 51.96 49.92 2pgz s ALA 107 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 2pgz s ALA 107 CO -0.00 0.09 -0.13 0.08 0.00 0.00 0.00 175.76 175.80 2pgz s VAL 108 N -2.56 2.96 -0.14 0.00 1.01 -0.52 -1.12 120.40 120.03 2pgz s VAL 108 Ca 0.33 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 2pgz s VAL 108 Cb 0.01 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 2pgz s VAL 108 CO 0.18 0.51 -0.08 -0.69 0.00 0.00 0.00 175.10 175.02 2pgz s VAL 109 N 0.64 3.53 0.18 2.92 1.01 0.40 -1.07 120.40 128.00 2pgz s VAL 109 Ca -0.07 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2pgz s VAL 109 Cb -0.15 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2pgz s VAL 109 CO 0.03 0.52 0.02 -0.89 0.00 0.00 0.00 175.10 174.77 2pgz s THR 110 N 0.25 3.84 0.64 3.92 2.01 0.15 -0.77 115.64 125.68 2pgz s THR 110 Ca -0.05 -1.38 0.37 0.00 0.31 0.00 0.00 61.69 60.93 2pgz s THR 110 Cb -0.15 -2.94 0.39 0.00 0.01 0.00 0.00 72.50 69.82 2pgz s THR 110 CO 0.04 -0.12 2.22 1.12 -0.69 0.00 0.00 174.62 177.20 2pgz h HIS 111 N 2.63 0.00 0.00 4.92 2.07 -1.05 0.14 115.15 123.86 2pgz h HIS 111 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2pgz h HIS 111 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 2pgz h HIS 111 CO 0.62 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.08 2pgz n ASP 112 N -3.29 0.00 0.00 3.10 5.75 -1.26 -1.04 116.55 119.81 2pgz n ASP 112 Ca -0.02 -1.10 0.00 0.00 -0.01 0.00 0.00 54.79 53.66 2pgz n ASP 112 Cb 0.18 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 2pgz n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pgz n GLY 113 N 0.73 0.75 3.82 6.12 0.00 0.03 -4.70 105.19 111.94 2pgz n GLY 113 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2pgz n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pgz s SER 114 N -2.41 7.03 -0.05 1.61 1.04 -1.20 -0.82 113.70 118.90 2pgz s SER 114 Ca 0.00 1.41 0.05 0.00 0.48 0.00 0.00 55.95 57.89 2pgz s SER 114 Cb 0.00 -2.42 -0.01 0.00 0.10 0.00 0.00 66.02 63.70 2pgz s SER 114 CO 0.00 0.01 -0.20 -0.69 0.98 0.00 0.00 173.24 173.33 2pgz s VAL 115 N -1.57 1.68 -0.15 5.02 1.01 0.50 -0.67 120.40 126.22 2pgz s VAL 115 Ca 0.44 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2pgz s VAL 115 Cb -0.16 -1.43 0.01 0.00 0.00 0.00 0.00 36.38 34.80 2pgz s VAL 115 CO 0.21 0.47 -0.19 -0.32 0.00 0.00 0.00 175.10 175.27 2pgz s MET 116 N -0.04 3.09 -0.05 2.72 0.00 -0.23 -2.35 119.30 122.44 2pgz s MET 116 Ca -0.04 -0.81 0.00 0.00 0.00 0.00 0.00 55.69 54.84 2pgz s MET 116 Cb -0.12 -2.51 0.02 0.00 0.00 0.00 0.00 34.83 32.22 2pgz s MET 116 CO 0.03 -0.01 -0.02 0.12 0.00 0.00 0.00 175.02 175.13 2pgz s PHE 117 N 0.84 0.67 -0.56 4.11 5.36 -0.11 -1.44 117.98 126.86 2pgz s PHE 117 Ca -0.06 -0.17 0.06 0.00 -0.96 0.00 0.00 56.93 55.80 2pgz s PHE 117 Cb -0.15 -0.68 0.21 0.00 -0.34 0.00 0.00 43.02 42.06 2pgz s PHE 117 CO -0.02 -0.23 0.54 -0.89 -1.46 0.00 0.00 175.22 173.16 2pgz n ILE 118 N 4.44 0.72 -2.20 3.12 5.41 -1.26 -0.57 119.36 129.01 2pgz n ILE 118 Ca -0.19 -4.47 -0.42 0.00 1.00 0.00 0.00 62.75 58.67 2pgz n ILE 118 Cb 0.50 -2.00 -0.03 0.00 -0.71 0.00 0.00 39.64 37.41 2pgz n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2pgz s PRO 119 N -1.35 4.31 0.08 0.38 0.04 -1.17 -4.73 135.00 132.56 2pgz s PRO 119 Ca 0.33 2.01 -0.27 0.00 0.04 0.00 0.00 61.00 63.12 2pgz s PRO 119 Cb 0.07 -3.41 -0.06 0.00 0.04 0.00 0.00 34.50 31.15 2pgz s PRO 119 CO -0.12 -0.49 0.83 0.00 0.04 0.00 0.00 177.00 177.26 2pgz s ALA 120 N 1.71 3.34 0.03 8.56 0.00 -1.26 -1.29 121.76 132.85 2pgz s ALA 120 Ca 0.64 0.39 0.02 0.00 0.00 0.00 0.00 51.96 53.01 2pgz s ALA 120 Cb -0.34 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 2pgz s ALA 120 CO 0.29 0.07 -0.06 -0.65 0.00 0.00 0.00 175.76 175.40 2pgz s GLN 121 N -0.20 0.45 -0.21 0.00 -0.21 0.28 -0.65 119.66 119.13 2pgz s GLN 121 Ca 0.41 -0.62 -0.06 0.00 0.02 0.00 0.00 55.36 55.11 2pgz s GLN 121 Cb -0.22 -0.22 -0.03 0.00 1.00 0.00 0.00 33.01 33.55 2pgz s GLN 121 CO 0.26 0.04 0.02 0.50 -2.12 0.00 0.00 175.29 173.98 2pgz s ARG 122 N -1.30 3.66 -0.10 2.91 3.52 -0.20 -1.74 118.95 125.70 2pgz s ARG 122 Ca -0.09 -0.50 0.04 0.00 -0.13 0.00 0.00 55.73 55.05 2pgz s ARG 122 Cb -0.09 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.17 2pgz s ARG 122 CO 0.00 -0.00 -0.22 -1.17 -0.81 0.00 0.00 175.30 173.10 2pgz s LEU 123 N 1.06 2.03 -0.20 -0.88 2.96 -0.05 -1.78 118.68 121.82 2pgz s LEU 123 Ca 0.03 -0.53 -0.11 0.00 -0.22 0.00 0.00 54.13 53.30 2pgz s LEU 123 Cb -0.14 -1.33 -0.05 0.00 0.50 0.00 0.00 46.19 45.17 2pgz s LEU 123 CO 0.02 0.13 0.18 -0.44 -1.32 0.00 0.00 176.35 174.92 2pgz s SER 124 N 0.44 6.24 0.14 3.68 0.01 -1.26 -0.70 113.70 122.26 2pgz s SER 124 Ca -0.17 0.26 -0.02 0.00 1.31 0.00 0.00 55.95 57.33 2pgz s SER 124 Cb -0.17 -2.12 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 2pgz s SER 124 CO 0.07 0.12 0.10 0.72 0.41 0.00 0.00 173.24 174.66 2pgz s PHE 125 N 0.60 0.84 -0.18 2.43 -0.12 -0.31 -1.13 117.98 120.10 2pgz s PHE 125 Ca 0.10 -1.19 -0.29 0.00 -0.05 0.00 0.00 56.93 55.49 2pgz s PHE 125 Cb -0.12 -0.43 -0.03 0.00 -0.63 0.00 0.00 43.02 41.80 2pgz s PHE 125 CO 0.01 -0.56 1.60 -1.64 -0.05 0.00 0.00 175.22 174.58 2pgz s MET 126 N -4.05 3.89 -0.28 1.99 -1.94 -0.76 -1.32 119.30 116.84 2pgz s MET 126 Ca 0.25 1.76 -0.16 0.00 -1.71 0.00 0.00 55.69 55.83 2pgz s MET 126 Cb 0.07 -4.01 0.08 0.00 2.01 0.00 0.00 34.83 32.98 2pgz s MET 126 CO 0.03 -1.17 0.68 0.00 -0.01 0.00 0.00 175.02 174.55 2pgz s ASP 128 N 1.59 6.12 0.00 0.00 -1.08 -1.26 -3.19 116.67 118.85 2pgz s ASP 128 Ca -0.10 -0.91 0.11 0.00 -0.52 0.00 0.00 52.55 51.13 2pgz s ASP 128 Cb -0.05 -2.17 0.67 0.00 -1.46 0.00 0.00 42.92 39.91 2pgz s ASP 128 CO -0.19 -0.48 1.42 -0.81 0.52 0.00 0.00 175.17 175.63 2pgz n PRO 129 N 5.21 0.98 -1.64 4.34 -0.04 -1.26 -4.69 135.00 137.91 2pgz n PRO 129 Ca -0.11 0.00 -0.49 0.00 -0.04 0.00 0.00 63.50 62.86 2pgz n PRO 129 Cb 0.47 -1.18 -0.05 0.00 -0.04 0.00 0.00 33.50 32.70 2pgz n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2pgz n THR 130 N -0.68 0.06 -0.02 0.52 -1.04 -1.26 -1.26 114.28 110.60 2pgz n THR 130 Ca 0.08 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2pgz n THR 130 Cb 0.04 -1.27 0.00 0.00 -1.82 0.00 0.00 70.33 67.28 2pgz n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2pgz n GLY 131 N 3.19 0.34 0.31 3.41 0.00 -1.26 -4.52 105.19 106.66 2pgz n GLY 131 Ca 0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.36 2pgz n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2pgz h VAL 132 N 0.00 0.53 -0.93 1.61 3.04 -1.37 -1.93 116.25 117.21 2pgz h VAL 132 Ca 0.00 0.00 -0.48 0.00 -1.01 0.00 0.00 66.70 65.21 2pgz h VAL 132 Cb 0.00 0.93 -0.29 0.00 -2.01 0.00 0.00 31.29 29.92 2pgz h VAL 132 CO 0.00 0.00 0.61 -0.90 -1.01 0.00 0.00 177.57 176.27 2pgz n ASP 133 N -3.88 3.76 -4.30 3.17 5.75 -1.26 -0.38 116.55 119.41 2pgz n ASP 133 Ca -0.01 -3.49 -0.16 0.00 -0.01 0.00 0.00 54.79 51.11 2pgz n ASP 133 Cb 0.19 -0.82 -0.10 0.00 -1.03 0.00 0.00 41.12 39.36 2pgz n ASP 133 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2pgz s SER 134 N -1.14 2.11 0.32 -1.12 1.04 -0.73 -5.01 113.70 109.17 2pgz s SER 134 Ca 0.53 -1.06 0.06 0.00 0.48 0.00 0.00 55.95 55.96 2pgz s SER 134 Cb 0.44 -0.06 0.71 0.00 0.10 0.00 0.00 66.02 67.21 2pgz s SER 134 CO 0.10 -0.31 1.83 -0.08 0.98 0.00 0.00 173.24 175.76 2pgz h GLU 135 N 2.63 0.79 0.00 4.02 4.81 -1.91 -1.53 114.58 123.39 2pgz h GLU 135 Ca -0.38 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.80 2pgz h GLU 135 Cb 1.21 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 2pgz h GLU 135 CO 0.63 0.53 -0.03 0.93 -0.73 0.00 0.00 179.01 180.33 2pgz h GLU 136 N 0.82 0.00 0.00 1.92 3.07 -1.96 -3.50 114.58 114.93 2pgz h GLU 136 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 2pgz h GLU 136 Cb 0.71 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 2pgz h GLU 136 CO -0.28 0.03 0.00 0.41 -1.40 0.00 0.00 179.01 177.78 2pgz n GLY 137 N 0.68 -1.43 3.65 -3.84 0.00 -0.58 -4.83 105.19 98.84 2pgz n GLY 137 Ca 0.02 -1.20 -0.25 0.00 0.00 0.00 0.00 46.02 44.59 2pgz n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pgz s ALA 138 N -1.50 3.17 -0.08 4.61 0.00 0.40 -4.31 121.76 124.05 2pgz s ALA 138 Ca 0.00 -1.45 0.02 0.00 0.00 0.00 0.00 51.96 50.53 2pgz s ALA 138 Cb 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 23.12 22.22 2pgz s ALA 138 CO 0.00 0.42 -0.14 0.99 0.00 0.00 0.00 175.76 177.03 2pgz s THR 139 N -1.89 1.29 0.21 0.00 2.01 -1.26 -1.16 115.64 114.84 2pgz s THR 139 Ca 0.28 -0.56 0.01 0.00 0.31 0.00 0.00 61.69 61.73 2pgz s THR 139 Cb -0.08 -1.17 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 2pgz s THR 139 CO 0.19 0.39 0.05 0.00 -0.69 0.00 0.00 174.62 174.56 2pgz s ALA 141 N -3.76 -0.91 -0.11 0.00 0.00 -1.26 -1.04 121.76 114.68 2pgz s ALA 141 Ca 0.31 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.71 2pgz s ALA 141 Cb 0.07 0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.23 2pgz s ALA 141 CO 0.09 -0.27 0.27 0.54 0.00 0.00 0.00 175.76 176.39 2pgz s VAL 142 N -1.17 -0.02 0.04 0.00 0.11 -0.34 -4.91 120.40 114.10 2pgz s VAL 142 Ca -0.12 0.09 -0.13 0.00 -2.93 0.00 0.00 61.98 58.89 2pgz s VAL 142 Cb -0.04 -0.40 -0.06 0.00 -1.53 0.00 0.00 36.38 34.35 2pgz s VAL 142 CO 0.05 0.04 0.42 -0.54 -3.33 0.00 0.00 175.10 171.74 2pgz s LYS 143 N 0.88 3.88 -0.01 1.54 1.02 -1.26 -0.72 119.74 125.06 2pgz s LYS 143 Ca -0.06 0.35 0.08 0.00 0.02 0.00 0.00 55.97 56.36 2pgz s LYS 143 Cb -0.07 -3.12 -0.02 0.00 -0.52 0.00 0.00 37.83 34.10 2pgz s LYS 143 CO -0.06 0.63 -0.25 -0.06 -0.92 0.00 0.00 175.35 174.69 2pgz s PHE 144 N -1.22 2.23 -0.01 3.18 0.08 0.17 -0.67 117.98 121.74 2pgz s PHE 144 Ca 0.28 -0.42 -0.29 0.00 0.12 0.00 0.00 56.93 56.62 2pgz s PHE 144 Cb -0.16 -1.43 0.11 0.00 -0.57 0.00 0.00 43.02 40.97 2pgz s PHE 144 CO 0.16 -0.03 1.29 0.20 -0.10 0.00 0.00 175.22 176.74 2pgz s GLY 145 N -0.63 -0.24 0.46 4.36 0.00 -0.65 -0.64 107.32 109.97 2pgz s GLY 145 Ca 0.10 0.30 -0.25 0.00 0.00 0.00 0.00 44.72 44.87 2pgz s GLY 145 CO -0.01 3.35 1.38 -0.45 0.00 0.00 0.00 173.10 177.37 2pgz s SER 146 N -3.47 5.86 0.08 1.64 0.15 -1.26 -0.87 113.70 115.83 2pgz s SER 146 Ca 0.23 2.81 -0.10 0.00 0.70 0.00 0.00 55.95 59.59 2pgz s SER 146 Cb 0.02 -2.64 -0.25 0.00 -1.71 0.00 0.00 66.02 61.43 2pgz s SER 146 CO -0.02 -1.17 1.15 -0.25 1.20 0.00 0.00 173.24 174.15 2pgz h TRP 147 N 2.22 0.78 0.00 3.44 2.91 -1.88 -3.41 115.95 120.01 2pgz h TRP 147 Ca -0.51 -0.50 0.00 0.00 1.13 0.00 0.00 58.89 59.01 2pgz h TRP 147 Cb 1.27 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 29.86 2pgz h TRP 147 CO 0.50 1.36 -0.15 1.33 -1.03 0.00 0.00 178.44 180.44 2pgz n VAL 148 N -3.70 0.00 -4.16 2.65 0.24 -1.26 -5.00 118.33 107.09 2pgz n VAL 148 Ca -0.11 -0.40 -0.34 0.00 -2.04 0.00 0.00 64.34 61.44 2pgz n VAL 148 Cb 0.97 0.92 -0.10 0.00 -1.47 0.00 0.00 33.84 34.16 2pgz n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2pgz s TYR 149 N -1.12 3.18 0.99 6.34 2.02 -1.26 -5.11 117.35 122.39 2pgz s TYR 149 Ca 0.00 -0.02 -0.17 0.00 -0.37 0.00 0.00 57.07 56.52 2pgz s TYR 149 Cb 0.00 -2.01 0.22 0.00 -0.40 0.00 0.00 41.96 39.77 2pgz s TYR 149 CO 0.00 0.15 1.34 -1.54 -1.57 0.00 0.00 175.55 173.93 2pgz s SER 150 N 0.20 2.87 0.12 2.29 1.04 -1.26 -4.68 113.70 114.27 2pgz s SER 150 Ca 0.02 0.20 0.15 0.00 0.48 0.00 0.00 55.95 56.80 2pgz s SER 150 Cb -0.13 -0.18 0.67 0.00 0.10 0.00 0.00 66.02 66.48 2pgz s SER 150 CO 0.01 -2.88 1.47 0.61 0.98 0.00 0.00 173.24 173.42 2pgz n GLY 151 N -3.77 -0.95 0.24 7.32 0.00 0.05 -1.37 105.19 106.71 2pgz n GLY 151 Ca 0.16 0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.36 2pgz n GLY 151 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2pgz h PHE 152 N 0.00 0.00 0.00 1.61 0.04 -1.93 -3.38 116.94 113.28 2pgz h PHE 152 Ca 0.00 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.53 2pgz h PHE 152 Cb 0.19 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.30 2pgz h PHE 152 CO 0.00 0.00 -1.85 0.39 -0.60 0.00 0.00 178.31 176.25 2pgz n GLU 153 N -3.08 0.36 -3.91 1.51 4.71 -0.54 -4.16 120.64 115.52 2pgz n GLU 153 Ca 0.03 0.11 -0.28 0.00 -0.01 0.00 0.00 57.16 57.00 2pgz n GLU 153 Cb 0.45 -1.22 -0.16 0.00 -1.01 0.00 0.00 31.44 29.49 2pgz n GLU 153 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2pgz s ILE 154 N -2.29 1.18 0.23 -3.67 1.01 -0.47 -0.97 121.20 116.22 2pgz s ILE 154 Ca -0.21 -0.60 -0.13 0.00 0.00 0.00 0.00 60.65 59.72 2pgz s ILE 154 Cb 0.06 -1.30 -0.08 0.00 0.01 0.00 0.00 42.46 41.16 2pgz s ILE 154 CO 0.32 0.21 0.60 -0.62 0.00 0.00 0.00 174.94 175.45 2pgz s ASP 155 N 1.61 6.74 0.12 3.58 2.15 -0.12 -3.99 116.67 126.76 2pgz s ASP 155 Ca 0.02 1.07 0.06 0.00 0.43 0.00 0.00 52.55 54.13 2pgz s ASP 155 Cb -0.15 -2.29 -0.04 0.00 -0.30 0.00 0.00 42.92 40.15 2pgz s ASP 155 CO -0.08 -0.05 -0.02 -0.76 -0.17 0.00 0.00 175.17 174.09 2pgz s LEU 156 N -2.57 3.34 0.24 -1.34 1.43 -1.26 -0.63 118.68 117.90 2pgz s LEU 156 Ca 0.46 -0.28 -0.16 0.00 -1.03 0.00 0.00 54.13 53.12 2pgz s LEU 156 Cb -0.12 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.04 2pgz s LEU 156 CO 0.20 0.15 0.56 -1.59 0.23 0.00 0.00 176.35 175.90 2pgz s LYS 157 N -2.47 1.57 0.08 1.70 -2.85 -0.49 -4.93 119.74 112.35 2pgz s LYS 157 Ca 0.25 -1.08 0.08 0.00 -1.00 0.00 0.00 55.97 54.22 2pgz s LYS 157 Cb -0.11 0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 36.15 2pgz s LYS 157 CO 0.18 -0.68 -0.20 0.95 0.10 0.00 0.00 175.35 175.69 2pgz s THR 158 N -3.95 1.66 0.17 3.79 -4.23 -1.26 -0.43 115.64 111.38 2pgz s THR 158 Ca 0.16 -1.41 0.08 0.00 -1.18 0.00 0.00 61.69 59.34 2pgz s THR 158 Cb -0.02 -1.49 -0.15 0.00 1.34 0.00 0.00 72.50 72.17 2pgz s THR 158 CO 0.05 0.02 1.39 0.44 -0.54 0.00 0.00 174.62 175.98 2pgz h ASP 159 N 4.36 0.01 -5.04 3.99 3.45 -1.97 -3.47 116.42 117.75 2pgz h ASP 159 Ca -0.45 -0.01 -0.13 0.00 0.43 0.00 0.00 57.03 56.88 2pgz h ASP 159 Cb 1.17 -0.00 -0.19 0.00 -0.56 0.00 0.00 39.33 39.75 2pgz h ASP 159 CO 0.41 0.88 -0.46 0.28 -1.57 0.00 0.00 179.24 178.78 2pgz s THR 160 N -3.00 0.10 -2.31 0.35 -1.32 -1.26 -5.03 115.64 103.17 2pgz s THR 160 Ca 0.00 -0.86 0.21 0.00 -1.21 0.00 0.00 61.69 59.84 2pgz s THR 160 Cb 0.11 -0.71 0.46 0.00 -1.51 0.00 0.00 72.50 70.85 2pgz s THR 160 CO 0.80 -0.47 1.55 -0.90 -2.21 0.00 0.00 174.62 173.39 2pgz n ASP 161 N 1.03 1.76 -4.56 8.08 3.85 -1.26 -4.78 116.55 120.67 2pgz n ASP 161 Ca -0.21 -1.71 -0.40 0.00 -0.71 0.00 0.00 54.79 51.76 2pgz n ASP 161 Cb 0.57 -0.10 -0.09 0.00 -1.35 0.00 0.00 41.12 40.15 2pgz n ASP 161 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 2pgz s GLN 162 N -1.79 3.65 0.43 0.11 -1.52 -1.26 -0.76 119.66 118.52 2pgz s GLN 162 Ca 0.33 -0.30 -0.26 0.00 -1.95 0.00 0.00 55.36 53.18 2pgz s GLN 162 Cb 0.18 -3.78 -0.09 0.00 -0.22 0.00 0.00 33.01 29.10 2pgz s GLN 162 CO 0.27 -0.50 1.42 0.08 -0.25 0.00 0.00 175.29 176.32 2pgz s VAL 163 N 2.08 2.14 -0.33 1.09 1.01 -0.81 -4.87 120.40 120.71 2pgz s VAL 163 Ca 0.13 0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 2pgz s VAL 163 Cb -0.16 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 33.15 2pgz s VAL 163 CO 0.12 0.02 1.20 -0.62 0.00 0.00 0.00 175.10 175.82 2pgz s ASP 164 N -0.47 6.75 0.00 3.32 -1.08 -0.34 -4.87 116.67 119.99 2pgz s ASP 164 Ca 0.59 1.06 0.14 0.00 -0.52 0.00 0.00 52.55 53.82 2pgz s ASP 164 Cb -0.44 -2.54 0.34 0.00 -1.46 0.00 0.00 42.92 38.82 2pgz s ASP 164 CO 0.57 -1.04 1.25 0.18 0.52 0.00 0.00 175.17 176.65 2pgz n LEU 165 N 7.40 2.99 0.16 -1.34 4.77 -1.26 -1.79 117.00 127.93 2pgz n LEU 165 Ca 0.13 -1.76 0.13 0.00 -0.03 0.00 0.00 56.01 54.48 2pgz n LEU 165 Cb 0.47 -0.23 0.54 0.00 -2.33 0.00 0.00 43.42 41.86 2pgz n LEU 165 CO 0.63 0.71 0.88 0.77 -1.33 0.00 0.00 177.39 179.05 2pgz h SER 166 N 2.74 0.00 -0.35 -1.43 4.64 -1.89 -1.32 113.55 115.93 2pgz h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pgz h SER 166 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2pgz h SER 166 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 2pgz n SER 167 N -2.39 3.21 -4.73 4.97 7.64 -1.26 -5.03 113.62 116.04 2pgz n SER 167 Ca 0.02 -2.22 -0.42 0.00 1.01 0.00 0.00 58.87 57.26 2pgz n SER 167 Cb 0.23 -0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.09 2pgz n SER 167 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2pgz s TYR 168 N -1.39 3.07 -0.10 1.43 5.04 -0.50 -4.61 117.35 120.29 2pgz s TYR 168 Ca 0.29 0.85 -0.29 0.00 -2.44 0.00 0.00 57.07 55.48 2pgz s TYR 168 Cb 0.18 -3.84 -0.07 0.00 0.35 0.00 0.00 41.96 38.58 2pgz s TYR 168 CO 0.15 -2.93 2.06 -0.47 -1.34 0.00 0.00 175.55 173.02 2pgz s TYR 169 N 0.63 1.28 0.44 4.97 5.04 0.89 -4.87 117.35 125.74 2pgz s TYR 169 Ca 0.64 0.08 0.35 0.00 -2.44 0.00 0.00 57.07 55.70 2pgz s TYR 169 Cb -0.42 -4.08 1.80 0.00 0.35 0.00 0.00 41.96 39.61 2pgz s TYR 169 CO 0.36 -4.69 2.17 0.00 -1.34 0.00 0.00 175.55 172.05 2pgz h ALA 170 N 12.69 1.14 -0.19 3.97 0.00 -1.90 -2.19 119.26 132.79 2pgz h ALA 170 Ca -0.44 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 2pgz h ALA 170 Cb 1.23 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2pgz h ALA 170 CO 0.95 0.05 -0.07 0.43 0.00 0.00 0.00 179.25 180.62 2pgz n SER 171 N -3.33 2.91 -4.62 0.00 7.64 -1.26 -5.03 113.62 109.93 2pgz n SER 171 Ca -0.02 -3.32 -0.37 0.00 1.01 0.00 0.00 58.87 56.18 2pgz n SER 171 Cb 0.18 -0.54 0.07 0.00 -1.01 0.00 0.00 64.21 62.92 2pgz n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2pgz n SER 172 N -0.98 0.66 0.31 6.43 2.88 -0.83 -4.89 113.62 117.21 2pgz n SER 172 Ca 0.23 0.73 0.18 0.00 -1.33 0.00 0.00 58.87 58.68 2pgz n SER 172 Cb 0.84 -1.41 1.02 0.00 -0.75 0.00 0.00 64.21 63.92 2pgz n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2pgz h LYS 173 N 0.08 0.00 -5.33 -1.46 1.79 -1.91 -3.43 116.57 106.30 2pgz h LYS 173 Ca -0.48 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.36 2pgz h LYS 173 Cb 1.35 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.67 2pgz h LYS 173 CO 0.49 0.01 -0.86 0.71 -1.08 0.00 0.00 179.45 178.71 2pgz s TYR 174 N -4.41 2.14 0.10 -1.35 2.02 -1.26 -1.84 117.35 112.75 2pgz s TYR 174 Ca -0.05 -0.76 -0.09 0.00 -0.37 0.00 0.00 57.07 55.80 2pgz s TYR 174 Cb 0.14 -1.45 -0.06 0.00 -0.40 0.00 0.00 41.96 40.20 2pgz s TYR 174 CO 0.50 -0.29 0.41 -1.83 -1.57 0.00 0.00 175.55 172.76 2pgz s GLU 175 N 0.22 3.74 -0.18 -0.62 -1.05 0.17 -4.79 118.70 116.18 2pgz s GLU 175 Ca -0.11 0.13 -0.17 0.00 -0.15 0.00 0.00 54.97 54.66 2pgz s GLU 175 Cb -0.15 -2.95 -0.04 0.00 -0.44 0.00 0.00 34.13 30.55 2pgz s GLU 175 CO 0.05 0.53 0.47 0.42 0.95 0.00 0.00 175.26 177.68 2pgz s ILE 176 N -1.47 5.15 -0.09 1.83 -1.09 -1.26 -1.37 121.20 122.90 2pgz s ILE 176 Ca 0.35 0.87 -0.09 0.00 -2.23 0.00 0.00 60.65 59.55 2pgz s ILE 176 Cb -0.13 -3.80 -0.28 0.00 -1.58 0.00 0.00 42.46 36.67 2pgz s ILE 176 CO 0.19 0.23 0.51 -0.07 -1.23 0.00 0.00 174.94 174.57 2pgz h LEU 177 N 7.60 0.51 -7.00 2.97 3.38 -0.86 -3.49 115.31 118.42 2pgz h LEU 177 Ca -0.36 -0.95 -0.03 0.00 0.09 0.00 0.00 57.88 56.64 2pgz h LEU 177 Cb 1.16 -0.17 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 2pgz h LEU 177 CO 0.74 1.83 0.22 -0.94 0.09 0.00 0.00 178.44 180.37 2pgz s SER 178 N -7.16 -0.59 -0.19 -0.43 1.04 -1.09 -4.99 113.70 100.29 2pgz s SER 178 Ca -0.19 0.25 -0.06 0.00 0.48 0.00 0.00 55.95 56.43 2pgz s SER 178 Cb 0.06 0.57 0.09 0.00 0.10 0.00 0.00 66.02 66.84 2pgz s SER 178 CO 0.81 -0.82 0.37 0.00 0.98 0.00 0.00 173.24 174.57 2pgz s ALA 179 N -2.82 -0.97 0.17 5.32 0.00 -1.26 -0.86 121.76 121.34 2pgz s ALA 179 Ca -0.03 1.23 0.10 0.00 0.00 0.00 0.00 51.96 53.26 2pgz s ALA 179 Cb -0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 2pgz s ALA 179 CO -0.05 -0.82 -0.21 0.95 0.00 0.00 0.00 175.76 175.63 2pgz s THR 180 N 2.55 2.03 -0.22 0.00 -4.23 -0.49 -1.92 115.64 113.36 2pgz s THR 180 Ca 0.02 -1.90 -0.02 0.00 -1.18 0.00 0.00 61.69 58.61 2pgz s THR 180 Cb -0.13 -1.92 0.06 0.00 1.34 0.00 0.00 72.50 71.86 2pgz s THR 180 CO -0.12 -0.19 0.01 0.00 -0.54 0.00 0.00 174.62 173.78 2pgz s GLN 181 N -2.59 0.96 -0.10 3.99 -2.07 0.06 -1.12 119.66 118.80 2pgz s GLN 181 Ca 0.16 -0.65 0.02 0.00 -1.82 0.00 0.00 55.36 53.07 2pgz s GLN 181 Cb -0.07 -2.26 0.01 0.00 -1.09 0.00 0.00 33.01 29.60 2pgz s GLN 181 CO 0.07 -0.66 -0.14 0.99 -1.32 0.00 0.00 175.29 174.24 2pgz s THR 182 N 1.69 1.40 0.21 3.63 2.01 -0.49 -4.22 115.64 119.87 2pgz s THR 182 Ca -0.02 -0.59 -0.31 0.00 0.31 0.00 0.00 61.69 61.08 2pgz s THR 182 Cb -0.18 -1.28 -0.10 0.00 0.01 0.00 0.00 72.50 70.95 2pgz s THR 182 CO -0.09 0.42 1.47 -0.60 -0.69 0.00 0.00 174.62 175.13 2pgz s ARG 183 N 0.92 4.26 -0.02 4.92 3.52 -1.26 -0.92 118.95 130.37 2pgz s ARG 183 Ca -0.08 2.29 0.06 0.00 -0.13 0.00 0.00 55.73 57.87 2pgz s ARG 183 Cb -0.15 -3.14 -0.02 0.00 -1.56 0.00 0.00 34.95 30.09 2pgz s ARG 183 CO -0.00 -0.47 -0.21 -0.65 -0.81 0.00 0.00 175.30 173.16 2pgz s GLN 184 N 0.17 1.74 -0.14 5.12 -0.21 0.21 -4.94 119.66 121.61 2pgz s GLN 184 Ca 0.63 -0.76 -0.01 0.00 0.02 0.00 0.00 55.36 55.23 2pgz s GLN 184 Cb -0.42 -1.67 -0.02 0.00 1.00 0.00 0.00 33.01 31.90 2pgz s GLN 184 CO 0.39 0.45 -0.10 0.08 -2.12 0.00 0.00 175.29 173.98 2pgz s VAL 185 N -0.48 3.24 -0.12 1.09 1.01 -1.26 -1.67 120.40 122.22 2pgz s VAL 185 Ca 0.08 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 2pgz s VAL 185 Cb -0.08 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 2pgz s VAL 185 CO -0.01 0.51 -0.11 -1.10 0.00 0.00 0.00 175.10 174.39 2pgz s GLN 186 N 0.46 3.23 -0.04 2.72 -1.52 0.10 -4.96 119.66 119.65 2pgz s GLN 186 Ca -0.08 -0.65 0.06 0.00 -1.95 0.00 0.00 55.36 52.74 2pgz s GLN 186 Cb -0.15 -2.63 -0.02 0.00 -0.22 0.00 0.00 33.01 29.98 2pgz s GLN 186 CO 0.04 0.33 -0.21 -1.01 -0.25 0.00 0.00 175.29 174.19 2pgz s HIS 187 N 0.07 2.50 0.06 0.91 3.76 -1.26 -1.06 115.29 120.27 2pgz s HIS 187 Ca -0.04 -0.41 0.09 0.00 -0.15 0.00 0.00 55.06 54.55 2pgz s HIS 187 Cb -0.14 -1.58 -0.03 0.00 1.11 0.00 0.00 32.58 31.94 2pgz s HIS 187 CO 0.04 -0.01 -0.24 0.71 -0.85 0.00 0.00 174.74 174.40 2pgz s TYR 188 N -0.52 2.06 0.36 1.40 2.02 -1.26 -5.06 117.35 116.35 2pgz s TYR 188 Ca 0.07 -0.39 0.07 0.00 -0.37 0.00 0.00 57.07 56.45 2pgz s TYR 188 Cb -0.11 -1.20 0.68 0.00 -0.40 0.00 0.00 41.96 40.92 2pgz s TYR 188 CO 0.01 0.15 1.88 0.77 -1.57 0.00 0.00 175.55 176.79 2pgz h SER 189 N 4.60 0.33 -0.48 2.29 0.02 -2.01 -2.71 113.55 115.60 2pgz h SER 189 Ca -0.46 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.38 2pgz h SER 189 Cb 1.16 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.58 2pgz h SER 189 CO 0.42 0.48 0.15 0.00 -1.14 0.00 0.00 176.83 176.75 2pgz h PRO 192 N 7.33 0.59 -6.51 0.00 0.13 -1.89 -3.38 132.00 128.26 2pgz h PRO 192 Ca -0.31 -0.14 -0.53 0.00 -0.87 0.00 0.00 66.00 64.14 2pgz h PRO 192 Cb 1.17 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2pgz h PRO 192 CO 0.45 0.63 0.55 -1.83 -0.23 0.00 0.00 178.00 177.57 2pgz s GLU 193 N -4.93 4.45 0.46 0.86 1.03 -1.26 -4.97 118.70 114.34 2pgz s GLU 193 Ca -0.08 1.77 -0.23 0.00 0.03 0.00 0.00 54.97 56.46 2pgz s GLU 193 Cb 0.15 -3.33 -0.08 0.00 -0.80 0.00 0.00 34.13 30.07 2pgz s GLU 193 CO 0.78 -0.21 1.14 -1.25 -1.33 0.00 0.00 175.26 174.39 2pgz s PRO 194 N 0.82 3.80 -0.07 -4.83 0.04 -1.26 -4.71 135.00 128.79 2pgz s PRO 194 Ca 0.57 1.71 0.03 0.00 0.04 0.00 0.00 61.00 63.35 2pgz s PRO 194 Cb -0.30 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 2pgz s PRO 194 CO 0.30 -0.50 -0.15 0.71 0.04 0.00 0.00 177.00 177.40 2pgz s TYR 195 N -1.59 2.70 -0.03 0.56 2.02 -0.22 -0.77 117.35 120.02 2pgz s TYR 195 Ca 0.63 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 57.08 2pgz s TYR 195 Cb -0.27 -1.68 -0.02 0.00 -0.40 0.00 0.00 41.96 39.60 2pgz s TYR 195 CO 0.33 0.05 -0.26 0.42 -1.57 0.00 0.00 175.55 174.52 2pgz s ILE 196 N -0.42 2.06 0.18 2.71 -1.09 -1.26 0.01 121.20 123.39 2pgz s ILE 196 Ca 0.05 -1.10 -0.03 0.00 -2.23 0.00 0.00 60.65 57.34 2pgz s ILE 196 Cb -0.12 -1.71 -0.03 0.00 -1.58 0.00 0.00 42.46 39.01 2pgz s ILE 196 CO 0.02 0.58 0.15 1.51 -1.23 0.00 0.00 174.94 175.97 2pgz s ASP 197 N -0.52 0.17 -0.20 3.58 1.47 -0.67 -4.57 116.67 115.93 2pgz s ASP 197 Ca 0.07 -1.25 -0.02 0.00 1.18 0.00 0.00 52.55 52.53 2pgz s ASP 197 Cb -0.11 0.38 0.00 0.00 -0.34 0.00 0.00 42.92 42.85 2pgz s ASP 197 CO -0.00 -0.84 -0.11 -0.69 0.68 0.00 0.00 175.17 174.22 2pgz s VAL 198 N -4.10 2.85 -0.35 2.11 1.01 0.19 -0.62 120.40 121.49 2pgz s VAL 198 Ca 0.31 -0.67 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 2pgz s VAL 198 Cb 0.06 -2.26 -0.00 0.00 0.00 0.00 0.00 36.38 34.18 2pgz s VAL 198 CO 0.08 0.47 0.52 0.21 0.00 0.00 0.00 175.10 176.38 2pgz s ASN 199 N 1.36 6.33 -0.28 3.32 2.47 -0.10 -0.65 114.94 127.39 2pgz s ASN 199 Ca 0.05 -0.01 -0.19 0.00 0.42 0.00 0.00 52.86 53.13 2pgz s ASN 199 Cb -0.14 -2.27 -0.02 0.00 -1.45 0.00 0.00 41.25 37.37 2pgz s ASN 199 CO -0.07 -0.49 0.55 -0.22 -3.72 0.00 0.00 177.10 173.16 2pgz s LEU 200 N 2.42 4.10 -0.16 3.21 2.96 0.10 -1.40 118.68 129.91 2pgz s LEU 200 Ca 0.19 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.59 2pgz s LEU 200 Cb -0.15 -2.71 0.01 0.00 0.50 0.00 0.00 46.19 43.84 2pgz s LEU 200 CO 0.13 -0.36 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.91 2pgz s VAL 201 N 2.41 2.10 -0.12 1.68 1.01 -0.27 -1.20 120.40 126.01 2pgz s VAL 201 Ca 0.22 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.28 2pgz s VAL 201 Cb -0.15 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.38 2pgz s VAL 201 CO 0.10 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.87 2pgz s VAL 202 N 1.05 1.73 -0.17 2.92 1.01 -0.21 -1.40 120.40 125.34 2pgz s VAL 202 Ca -0.01 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 2pgz s VAL 202 Cb -0.14 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 2pgz s VAL 202 CO -0.07 0.49 -0.04 -0.54 0.00 0.00 0.00 175.10 174.94 2pgz s LYS 203 N 0.88 3.62 0.08 2.72 1.02 -0.04 -1.45 119.74 126.57 2pgz s LYS 203 Ca -0.08 -0.54 -0.12 0.00 0.02 0.00 0.00 55.97 55.26 2pgz s LYS 203 Cb -0.15 -2.93 0.01 0.00 -0.52 0.00 0.00 37.83 34.24 2pgz s LYS 203 CO -0.01 0.17 0.27 -0.59 -0.92 0.00 0.00 175.35 174.27 2pgz s PHE 204 N 0.55 -0.01 0.14 3.18 -0.12 -0.31 -0.10 117.98 121.30 2pgz s PHE 204 Ca -0.03 -0.28 -0.12 0.00 -0.05 0.00 0.00 56.93 56.44 2pgz s PHE 204 Cb -0.14 0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.31 2pgz s PHE 204 CO 0.03 -0.55 0.33 -0.98 -0.05 0.00 0.00 175.22 173.99 2pgz s ARG 205 N -3.31 1.08 0.31 1.99 1.70 -0.47 -0.46 118.95 119.79 2pgz s ARG 205 Ca 0.00 -0.92 -0.29 0.00 -0.47 0.00 0.00 55.73 54.05 2pgz s ARG 205 Cb 0.02 0.42 -0.11 0.00 -0.57 0.00 0.00 34.95 34.71 2pgz s ARG 205 CO -0.08 -0.40 1.45 -1.21 -1.08 0.00 0.00 175.30 173.98 2pgz s GLU 206 N -3.87 4.22 0.00 3.89 2.02 0.49 -0.66 118.70 124.78 2pgz s GLU 206 Ca 0.08 2.41 0.30 0.00 0.02 0.00 0.00 54.97 57.78 2pgz s GLU 206 Cb 0.03 -3.05 1.40 0.00 0.10 0.00 0.00 34.13 32.61 2pgz s GLU 206 CO -0.07 -0.44 1.94 2.89 0.02 0.00 0.00 175.26 179.60