#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgz h ASP -3 N 0.00 0.25 -0.51 -2.24 3.58 -2.05 -2.03 116.42 113.41 2pgz h ASP -3 Ca 0.00 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.32 2pgz h ASP -3 Cb 0.00 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 40.96 2pgz h ASP -3 CO 0.00 0.65 0.23 0.44 -2.88 0.00 0.00 179.24 177.68 2pgz h ASP -2 N 0.19 0.69 -0.23 2.28 3.32 -2.05 -1.60 116.42 119.02 2pgz h ASP -2 Ca 0.02 -0.14 -0.13 0.00 0.02 0.00 0.00 57.03 56.79 2pgz h ASP -2 Cb 0.84 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 2pgz h ASP -2 CO 0.07 0.64 -0.34 0.11 -1.72 0.00 0.00 179.24 178.00 2pgz h LYS -1 N 0.69 0.74 -1.01 3.56 1.57 -1.96 -1.21 116.57 118.94 2pgz h LYS -1 Ca 0.17 -0.35 0.01 0.00 -1.87 0.00 0.00 60.65 58.61 2pgz h LYS -1 Cb 0.15 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 2pgz h LYS -1 CO -0.02 0.97 0.67 1.25 -0.57 0.00 0.00 179.45 181.75 2pgz h LEU 0 N 0.62 1.15 -0.74 2.94 5.85 -1.24 0.17 115.31 124.06 2pgz h LEU 0 Ca 0.06 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 2pgz h LEU 0 Cb 0.87 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2pgz h LEU 0 CO 0.08 0.83 -0.12 0.45 -0.34 0.00 0.00 178.44 179.34 2pgz h HIS 1 N 1.36 0.92 -0.40 1.25 3.86 -0.93 0.76 115.15 121.98 2pgz h HIS 1 Ca 0.37 -0.18 -0.10 0.00 -1.16 0.00 0.00 60.37 59.31 2pgz h HIS 1 Cb -0.14 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.08 2pgz h HIS 1 CO -0.00 0.90 -0.13 0.66 0.86 0.00 0.00 177.93 180.22 2pgz h SER 2 N 0.75 0.80 -0.62 2.45 4.64 -0.77 0.59 113.55 121.40 2pgz h SER 2 Ca 0.12 -0.38 0.04 0.00 -0.47 0.00 0.00 61.79 61.10 2pgz h SER 2 Cb 0.62 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.45 2pgz h SER 2 CO 0.04 1.00 0.37 1.56 -0.87 0.00 0.00 176.83 178.93 2pgz h GLN 3 N 0.60 0.69 -0.45 4.77 4.20 -0.56 -1.85 115.11 122.51 2pgz h GLN 3 Ca 0.10 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2pgz h GLN 3 Cb 0.67 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 2pgz h GLN 3 CO 0.05 0.46 0.22 0.00 -0.67 0.00 0.00 178.83 178.88 2pgz h ALA 4 N 1.29 0.58 -0.89 3.87 0.00 -0.59 -1.82 119.26 121.70 2pgz h ALA 4 Ca 0.26 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2pgz h ALA 4 Cb 0.07 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2pgz h ALA 4 CO -0.12 0.14 0.54 -0.91 0.00 0.00 0.00 179.25 178.90 2pgz h ASN 5 N 0.59 1.07 -0.28 0.00 2.35 -0.64 -0.99 115.58 117.68 2pgz h ASN 5 Ca 0.16 -0.07 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2pgz h ASN 5 Cb 0.12 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 2pgz h ASN 5 CO -0.02 0.83 -0.04 0.25 -1.65 0.00 0.00 177.43 176.79 2pgz h LEU 6 N 1.23 0.52 -0.97 1.61 5.85 -1.19 -0.67 115.31 121.69 2pgz h LEU 6 Ca 0.32 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2pgz h LEU 6 Cb -0.05 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2pgz h LEU 6 CO -0.06 0.75 0.39 0.24 -0.34 0.00 0.00 178.44 179.42 2pgz h MET 7 N 0.29 1.12 -0.31 1.25 2.86 -1.14 -1.39 114.93 117.61 2pgz h MET 7 Ca 0.07 -0.15 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 2pgz h MET 7 Cb 0.51 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 2pgz h MET 7 CO 0.02 0.85 0.03 -0.09 1.06 0.00 0.00 176.91 178.78 2pgz h ARG 8 N 1.12 0.52 -0.12 1.72 2.43 -1.10 -1.21 114.38 117.74 2pgz h ARG 8 Ca 0.27 -0.15 0.03 0.00 -0.81 0.00 0.00 59.98 59.32 2pgz h ARG 8 Cb 0.09 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 2pgz h ARG 8 CO -0.04 0.64 -0.06 1.25 -1.51 0.00 0.00 179.97 180.25 2pgz h LEU 9 N 0.33 -0.21 -0.58 3.80 5.85 -0.80 0.57 115.31 124.27 2pgz h LEU 9 Ca 0.09 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2pgz h LEU 9 Cb 0.39 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2pgz h LEU 9 CO 0.01 -0.09 0.19 0.11 -0.34 0.00 0.00 178.44 178.32 2pgz h LYS 10 N -0.05 0.90 -0.47 1.25 1.57 -1.20 -1.30 116.57 117.27 2pgz h LYS 10 Ca 0.07 -0.19 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 2pgz h LYS 10 Cb 0.16 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2pgz h LYS 10 CO -0.16 0.80 -0.13 0.66 -0.57 0.00 0.00 179.45 180.05 2pgz h SER 11 N 0.82 0.87 -0.67 0.86 4.64 -0.96 0.40 113.55 119.51 2pgz h SER 11 Ca 0.19 -0.28 0.01 0.00 -0.47 0.00 0.00 61.79 61.24 2pgz h SER 11 Cb 0.27 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 62.09 2pgz h SER 11 CO -0.01 1.01 0.44 0.44 -0.87 0.00 0.00 176.83 177.85 2pgz h ASP 12 N 0.78 0.76 -0.11 4.97 3.32 -0.64 -1.61 116.42 123.89 2pgz h ASP 12 Ca 0.12 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.99 2pgz h ASP 12 Cb 0.65 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 40.02 2pgz h ASP 12 CO 0.05 0.54 -0.57 -0.07 -1.72 0.00 0.00 179.24 177.47 2pgz h LEU 13 N 0.90 0.70 0.00 1.55 3.38 -0.95 -3.32 115.31 117.56 2pgz h LEU 13 Ca 0.25 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2pgz h LEU 13 Cb -0.08 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.46 2pgz h LEU 13 CO -0.06 1.23 -0.49 0.49 0.09 0.00 0.00 178.44 179.70 2pgz n PHE 14 N -4.16 0.03 0.73 1.13 0.99 0.11 -4.57 117.46 111.73 2pgz n PHE 14 Ca -0.08 0.01 0.00 0.00 -0.00 0.00 0.00 57.45 57.38 2pgz n PHE 14 Cb 0.64 -0.27 0.00 0.00 -1.00 0.00 0.00 39.48 38.85 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 -3.48 3.20 -2.92 4.37 4.13 -0.61 -4.67 115.26 115.28 2pgz n ASN 15 Ca -0.07 -1.97 0.02 0.00 1.68 0.00 0.00 54.58 54.24 2pgz n ASN 15 Cb 0.25 -0.57 0.01 0.00 -1.54 0.00 0.00 39.78 37.93 2pgz n ASN 15 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 2pgz n ARG 16 N 0.68 0.13 0.00 3.52 0.63 -1.19 -4.91 116.66 115.52 2pgz n ARG 16 Ca 0.00 -0.54 0.00 0.00 -0.92 0.00 0.00 57.85 56.39 2pgz n ARG 16 Cb 0.48 0.88 0.00 0.00 0.45 0.00 0.00 32.46 34.27 2pgz n ARG 16 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2pgz n SER 17 N -0.79 0.00 0.00 6.15 7.64 -1.25 -4.72 113.62 120.65 2pgz n SER 17 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2pgz n SER 17 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 2pgz n SER 17 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2pgz n MET 19 N 0.00 0.00 -2.04 1.43 0.00 -1.26 -4.98 117.12 110.27 2pgz n MET 19 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.27 2pgz n MET 19 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.19 2pgz n MET 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 175.97 175.50 2pgz s TYR 20 N -0.64 2.00 -0.48 3.17 6.14 -1.26 -4.91 117.35 121.37 2pgz s TYR 20 Ca 0.00 0.41 0.08 0.00 0.64 0.00 0.00 57.07 58.20 2pgz s TYR 20 Cb 0.00 -3.95 0.53 0.00 0.42 0.00 0.00 41.96 38.96 2pgz s TYR 20 CO 0.00 -3.36 1.35 -0.35 0.64 0.00 0.00 175.55 173.83 2pgz n PRO 21 N 7.50 3.40 0.00 4.97 -0.04 -1.26 -4.92 135.00 144.65 2pgz n PRO 21 Ca 0.19 -2.06 0.00 0.00 -0.04 0.00 0.00 63.50 61.58 2pgz n PRO 21 Cb 0.44 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.92 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 0.31 -1.34 3.80 0.55 0.00 -1.26 -5.00 105.19 102.26 2pgz n GLY 22 Ca 0.20 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.31 2.59 0.27 1.61 0.04 -1.26 -5.04 135.00 130.90 2pgz s PRO 23 Ca 0.00 0.92 -0.04 0.00 0.04 0.00 0.00 61.00 61.92 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 -1.34 0.36 0.95 0.04 0.00 0.00 177.00 177.01 2pgz s THR 24 N -3.04 0.00 0.45 1.26 -4.23 -0.89 -4.98 115.64 104.21 2pgz s THR 24 Ca 0.59 -1.71 0.12 0.00 -1.18 0.00 0.00 61.69 59.51 2pgz s THR 24 Cb -0.15 -2.47 0.28 0.00 1.34 0.00 0.00 72.50 71.51 2pgz s THR 24 CO 0.55 0.00 2.07 0.11 -0.54 0.00 0.00 174.62 176.81 2pgz h LYS 25 N 2.30 0.33 0.00 3.99 1.57 -1.92 -1.37 116.57 121.47 2pgz h LYS 25 Ca -0.29 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2pgz h LYS 25 Cb 1.24 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2pgz h LYS 25 CO 0.42 0.22 -0.50 -0.44 -0.57 0.00 0.00 179.45 178.57 2pgz h ASP 26 N 0.34 0.00 -2.01 0.86 3.45 -1.96 -3.38 116.42 113.71 2pgz h ASP 26 Ca 0.13 -0.07 -0.52 0.00 0.43 0.00 0.00 57.03 56.99 2pgz h ASP 26 Cb 0.10 0.00 -0.40 0.00 -0.56 0.00 0.00 39.33 38.47 2pgz h ASP 26 CO -0.03 0.04 -1.13 -0.67 -1.57 0.00 0.00 179.24 175.88 2pgz n ASP 27 N -2.51 0.60 -4.85 6.45 2.03 -0.65 -5.13 116.55 112.49 2pgz n ASP 27 Ca 0.03 -2.87 -0.31 0.00 0.52 0.00 0.00 54.79 52.16 2pgz n ASP 27 Cb 0.49 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 40.26 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 -1.81 3.60 -0.02 -0.67 0.04 -0.61 -2.10 135.00 133.44 2pgz s PRO 28 Ca 0.38 0.85 0.05 0.00 0.04 0.00 0.00 61.00 62.31 2pgz s PRO 28 Cb 0.25 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.70 2pgz s PRO 28 CO -0.10 -0.56 -0.16 -1.17 0.04 0.00 0.00 177.00 175.05 2pgz s LEU 29 N -4.91 2.01 -0.24 -3.56 2.96 -0.03 -4.94 118.68 109.97 2pgz s LEU 29 Ca 0.57 -0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.10 2pgz s LEU 29 Cb -0.11 -0.86 -0.03 0.00 0.50 0.00 0.00 46.19 45.69 2pgz s LEU 29 CO 0.48 0.19 0.09 -0.89 -1.32 0.00 0.00 176.35 174.90 2pgz s THR 30 N -0.33 4.58 -0.20 3.68 2.01 -1.26 -0.57 115.64 123.55 2pgz s THR 30 Ca 0.05 -0.09 -0.07 0.00 0.31 0.00 0.00 61.69 61.89 2pgz s THR 30 Cb -0.07 -3.13 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2pgz s THR 30 CO -0.00 0.35 0.07 -0.69 -0.69 0.00 0.00 174.62 173.66 2pgz s VAL 31 N 1.35 4.73 -0.14 3.82 1.01 0.49 -4.55 120.40 127.10 2pgz s VAL 31 Ca 0.05 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 2pgz s VAL 31 Cb -0.15 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2pgz s VAL 31 CO 0.04 0.43 0.37 -0.89 0.00 0.00 0.00 175.10 175.05 2pgz s THR 32 N 0.62 5.26 0.06 3.92 2.01 0.39 -1.39 115.64 126.51 2pgz s THR 32 Ca 0.03 0.71 0.09 0.00 0.31 0.00 0.00 61.69 62.83 2pgz s THR 32 Cb -0.13 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 2pgz s THR 32 CO 0.01 0.36 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.31 2pgz s LEU 33 N 0.55 2.37 -0.13 4.42 1.43 0.47 -1.49 118.68 126.31 2pgz s LEU 33 Ca 0.20 -0.55 -0.17 0.00 -1.03 0.00 0.00 54.13 52.58 2pgz s LEU 33 Cb -0.14 -1.38 0.04 0.00 0.03 0.00 0.00 46.19 44.75 2pgz s LEU 33 CO 0.06 0.24 0.45 -0.83 0.23 0.00 0.00 176.35 176.51 2pgz s GLY 34 N -1.45 -0.33 -0.03 -3.19 0.00 -0.61 -4.37 107.32 97.34 2pgz s GLY 34 Ca 0.13 1.12 0.03 0.00 0.00 0.00 0.00 44.72 46.00 2pgz s GLY 34 CO 0.04 0.92 -0.11 -1.36 0.00 0.00 0.00 173.10 172.58 2pgz s PHE 35 N -0.18 2.78 -0.30 1.90 0.08 -1.26 -0.59 117.98 120.40 2pgz s PHE 35 Ca -0.04 -0.10 0.01 0.00 0.12 0.00 0.00 56.93 56.92 2pgz s PHE 35 Cb -0.03 -1.62 0.07 0.00 -0.57 0.00 0.00 43.02 40.86 2pgz s PHE 35 CO 0.02 0.27 -0.01 0.99 -0.10 0.00 0.00 175.22 176.40 2pgz s THR 36 N -0.84 2.65 -0.24 0.64 2.01 -0.43 -1.50 115.64 117.92 2pgz s THR 36 Ca 0.13 -1.69 -0.23 0.00 0.31 0.00 0.00 61.69 60.22 2pgz s THR 36 Cb -0.11 -2.63 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 2pgz s THR 36 CO 0.03 -0.22 0.75 -0.22 -0.69 0.00 0.00 174.62 174.27 2pgz s LEU 37 N 1.14 4.08 -0.20 4.42 2.96 -0.74 -0.95 118.68 129.40 2pgz s LEU 37 Ca -0.03 0.92 0.08 0.00 -0.22 0.00 0.00 54.13 54.88 2pgz s LEU 37 Cb -0.20 -3.06 -0.22 0.00 0.50 0.00 0.00 46.19 43.21 2pgz s LEU 37 CO -0.04 -0.45 0.05 1.67 -1.32 0.00 0.00 176.35 176.27 2pgz n GLN 38 N 5.83 0.68 -3.62 1.98 7.27 0.03 -3.41 117.38 126.13 2pgz n GLN 38 Ca 0.03 0.12 -0.12 0.00 0.07 0.00 0.00 57.00 57.11 2pgz n GLN 38 Cb 0.48 -1.58 -0.07 0.00 2.41 0.00 0.00 30.24 31.49 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 -6.17 -0.60 -0.43 1.69 2.15 -0.84 -0.50 116.67 111.97 2pgz s ASP 39 Ca -0.21 1.10 -0.18 0.00 0.43 0.00 0.00 52.55 53.69 2pgz s ASP 39 Cb 0.08 1.10 0.03 0.00 -0.30 0.00 0.00 42.92 43.82 2pgz s ASP 39 CO 0.73 -0.23 0.51 -0.63 -0.17 0.00 0.00 175.17 175.37 2pgz s ILE 40 N 0.14 5.00 -0.06 4.11 1.01 -1.26 -0.68 121.20 129.46 2pgz s ILE 40 Ca 0.01 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 2pgz s ILE 40 Cb -0.04 -4.11 -0.30 0.00 0.01 0.00 0.00 42.46 38.01 2pgz s ILE 40 CO -0.01 -0.51 0.74 0.58 0.00 0.00 0.00 174.94 175.74 2pgz h VAL 41 N 5.78 1.20 -3.02 2.92 2.07 -1.17 -3.41 116.25 120.63 2pgz h VAL 41 Ca -0.26 -2.50 -0.16 0.00 0.82 0.00 0.00 66.70 64.60 2pgz h VAL 41 Cb 1.10 2.92 -0.26 0.00 -1.52 0.00 0.00 31.29 33.53 2pgz h VAL 41 CO 0.84 0.74 -0.39 -0.75 0.02 0.00 0.00 177.57 178.03 2pgz s LYS 42 N -2.49 0.32 -0.14 1.57 2.20 -1.22 -4.88 119.74 115.09 2pgz s LYS 42 Ca -0.16 0.44 0.01 0.00 -0.36 0.00 0.00 55.97 55.90 2pgz s LYS 42 Cb 0.03 0.11 0.02 0.00 -1.51 0.00 0.00 37.83 36.48 2pgz s LYS 42 CO 0.82 -0.06 -0.14 0.00 -0.36 0.00 0.00 175.35 175.61 2pgz s ALA 43 N 0.39 1.85 -0.38 3.13 0.00 -1.26 -0.89 121.76 124.60 2pgz s ALA 43 Ca -0.02 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 2pgz s ALA 43 Cb -0.04 -1.03 0.07 0.00 0.00 0.00 0.00 23.12 22.13 2pgz s ALA 43 CO -0.02 -0.34 0.18 0.34 0.00 0.00 0.00 175.76 175.92 2pgz s ASP 44 N 1.42 5.37 0.00 0.00 -1.08 0.16 -4.94 116.67 117.60 2pgz s ASP 44 Ca 0.04 -1.52 0.29 0.00 -0.52 0.00 0.00 52.55 50.84 2pgz s ASP 44 Cb -0.13 -1.89 1.31 0.00 -1.46 0.00 0.00 42.92 40.76 2pgz s ASP 44 CO -0.10 -0.46 1.96 -1.54 0.52 0.00 0.00 175.17 175.55 2pgz n SER 45 N 4.78 0.00 0.13 -0.34 3.41 -1.26 -0.86 113.62 119.47 2pgz n SER 45 Ca -0.09 0.30 0.02 0.00 -0.26 0.00 0.00 58.87 58.84 2pgz n SER 45 Cb 0.43 -0.43 0.01 0.00 -0.26 0.00 0.00 64.21 63.95 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 -1.96 -3.37 113.55 116.90 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 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2pgz h SER 46 CO 0.00 0.53 0.00 0.35 -0.87 0.00 0.00 176.83 176.84 2pgz n THR 47 N -3.20 0.00 -3.69 2.95 -2.24 -1.18 -5.03 114.28 101.89 2pgz n THR 47 Ca 0.01 -0.45 -0.28 0.00 -2.27 0.00 0.00 64.05 61.07 2pgz n THR 47 Cb 0.75 1.05 0.03 0.00 -2.10 0.00 0.00 70.33 70.06 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 -0.49 -3.98 -4.17 3.42 3.02 -0.04 -4.93 115.26 108.10 2pgz n ASN 48 Ca 0.00 -0.96 -0.25 0.00 -0.03 0.00 0.00 54.58 53.34 2pgz n ASN 48 Cb 0.01 -3.58 -0.15 0.00 -0.61 0.00 0.00 39.78 35.45 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 -5.94 1.47 0.01 3.52 2.02 -1.11 -1.58 118.70 117.08 2pgz s GLU 49 Ca 0.33 -0.63 0.06 0.00 0.02 0.00 0.00 54.97 54.75 2pgz s GLU 49 Cb -0.11 -1.40 -0.02 0.00 0.10 0.00 0.00 34.13 32.70 2pgz s GLU 49 CO 0.85 0.37 -0.19 0.08 0.02 0.00 0.00 175.26 176.39 2pgz s VAL 50 N -0.37 1.50 -0.21 2.63 1.01 -0.61 -0.67 120.40 123.67 2pgz s VAL 50 Ca 0.06 -0.94 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 2pgz s VAL 50 Cb -0.07 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 2pgz s VAL 50 CO -0.00 0.31 0.00 -1.81 0.00 0.00 0.00 175.10 173.60 2pgz s ASP 51 N -0.73 4.75 0.11 3.32 1.11 -0.06 -1.32 116.67 123.84 2pgz s ASP 51 Ca 0.07 -0.25 0.07 0.00 0.18 0.00 0.00 52.55 52.62 2pgz s ASP 51 Cb -0.08 -1.82 -0.04 0.00 1.07 0.00 0.00 42.92 42.05 2pgz s ASP 51 CO 0.00 0.03 -0.08 -0.76 1.18 0.00 0.00 175.17 175.54 2pgz s LEU 52 N 1.21 3.10 -0.13 1.23 1.43 0.07 -0.53 118.68 125.07 2pgz s LEU 52 Ca 0.03 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2pgz s LEU 52 Cb -0.15 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.20 2pgz s LEU 52 CO 0.01 0.17 -0.20 -0.69 0.23 0.00 0.00 176.35 175.87 2pgz s VAL 53 N -1.27 1.90 0.14 -1.59 1.01 0.15 -0.82 120.40 119.92 2pgz s VAL 53 Ca 0.22 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.20 2pgz s VAL 53 Cb -0.11 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.59 2pgz s VAL 53 CO 0.15 0.52 0.31 -0.72 0.00 0.00 0.00 175.10 175.36 2pgz s TYR 54 N 0.84 0.11 -0.18 5.22 -0.85 -0.68 -0.79 117.35 121.02 2pgz s TYR 54 Ca -0.07 -0.48 -0.08 0.00 -0.52 0.00 0.00 57.07 55.92 2pgz s TYR 54 Cb -0.15 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.22 2pgz s TYR 54 CO -0.01 -0.69 0.07 0.71 -1.52 0.00 0.00 175.55 174.11 2pgz s TYR 55 N -3.88 3.27 -0.45 -3.49 4.12 -0.12 -0.83 117.35 115.97 2pgz s TYR 55 Ca 0.09 0.11 -0.10 0.00 0.02 0.00 0.00 57.07 57.19 2pgz s TYR 55 Cb 0.03 -2.09 0.10 0.00 -1.52 0.00 0.00 41.96 38.48 2pgz s TYR 55 CO -0.07 0.18 0.32 -2.00 0.02 0.00 0.00 175.55 174.00 2pgz s GLU 56 N 0.35 2.59 -0.08 -0.62 2.12 -0.40 -1.32 118.70 121.33 2pgz s GLU 56 Ca 0.04 -1.61 -0.29 0.00 0.36 0.00 0.00 54.97 53.48 2pgz s GLU 56 Cb -0.12 -3.89 -0.02 0.00 0.26 0.00 0.00 34.13 30.36 2pgz s GLU 56 CO -0.00 -1.09 0.95 -1.14 -0.54 0.00 0.00 175.26 173.44 2pgz s GLN 57 N 1.42 4.44 -0.04 4.30 0.74 0.24 -3.30 119.66 127.45 2pgz s GLN 57 Ca 0.04 1.30 0.06 0.00 0.05 0.00 0.00 55.36 56.82 2pgz s GLN 57 Cb -0.25 -3.52 -0.01 0.00 1.10 0.00 0.00 33.01 30.33 2pgz s GLN 57 CO 0.01 -0.21 -0.23 -0.65 -0.55 0.00 0.00 175.29 173.65 2pgz s GLN 58 N 1.66 2.25 -0.01 1.67 -0.21 0.62 -1.58 119.66 124.06 2pgz s GLN 58 Ca 0.47 -0.84 -0.01 0.00 0.02 0.00 0.00 55.36 55.00 2pgz s GLN 58 Cb -0.19 -1.98 0.01 0.00 1.00 0.00 0.00 33.01 31.85 2pgz s GLN 58 CO 0.20 0.39 0.02 1.03 -2.12 0.00 0.00 175.29 174.81 2pgz s ARG 59 N -0.23 0.01 0.29 2.91 0.52 -0.56 -1.17 118.95 120.72 2pgz s ARG 59 Ca -0.00 0.06 -0.14 0.00 -0.52 0.00 0.00 55.73 55.12 2pgz s ARG 59 Cb -0.12 -0.03 0.01 0.00 0.52 0.00 0.00 34.95 35.33 2pgz s ARG 59 CO 0.02 -0.03 0.59 1.67 0.02 0.00 0.00 175.30 177.57 2pgz s TRP 60 N 0.20 0.25 -0.02 -0.53 -2.14 -0.97 -0.46 118.94 115.26 2pgz s TRP 60 Ca -0.02 -0.67 -0.00 0.00 2.66 0.00 0.00 56.10 58.07 2pgz s TRP 60 Cb -0.02 0.40 0.03 0.00 -3.10 0.00 0.00 33.47 30.77 2pgz s TRP 60 CO -0.01 -1.16 0.04 0.21 -2.66 0.00 0.00 176.95 173.38 2pgz s LYS 61 N -3.65 -0.01 -0.09 3.25 2.20 -1.26 -0.12 119.74 120.06 2pgz s LYS 61 Ca 0.19 0.19 0.03 0.00 -0.36 0.00 0.00 55.97 56.02 2pgz s LYS 61 Cb -0.03 -0.20 0.01 0.00 -1.51 0.00 0.00 37.83 36.10 2pgz s LYS 61 CO 0.10 -0.15 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.25 2pgz s LEU 62 N 0.94 1.87 0.40 5.43 1.43 -0.33 -4.94 118.68 123.47 2pgz s LEU 62 Ca -0.08 -0.43 0.14 0.00 -1.03 0.00 0.00 54.13 52.73 2pgz s LEU 62 Cb -0.11 -1.13 0.98 0.00 0.03 0.00 0.00 46.19 45.97 2pgz s LEU 62 CO -0.03 0.09 1.89 0.78 0.23 0.00 0.00 176.35 179.31 2pgz h ASN 63 N 6.87 0.48 0.61 2.29 2.35 -1.89 -1.68 115.58 124.62 2pgz h ASN 63 Ca -0.25 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 2pgz h ASN 63 Cb 1.21 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.52 2pgz h ASN 63 CO 0.47 0.23 0.00 -1.54 -1.65 0.00 0.00 177.43 174.95 2pgz n SER 64 N -4.52 0.65 -1.22 5.81 3.41 -1.26 -2.12 113.62 114.38 2pgz n SER 64 Ca 0.17 0.68 0.11 0.00 -0.26 0.00 0.00 58.87 59.57 2pgz n SER 64 Cb 0.55 -0.81 0.28 0.00 -0.26 0.00 0.00 64.21 63.98 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 -2.24 3.73 -4.80 1.04 4.77 -0.63 -4.97 117.00 113.90 2pgz n LEU 65 Ca 0.02 -1.94 -0.36 0.00 -0.03 0.00 0.00 56.01 53.70 2pgz n LEU 65 Cb 0.20 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 40.80 2pgz n LEU 65 CO 0.18 0.92 0.53 -0.04 -1.33 0.00 0.00 177.39 177.65 2pgz s MET 66 N -1.05 4.36 0.12 3.23 -1.94 -0.90 -3.95 119.30 119.17 2pgz s MET 66 Ca 0.44 1.06 -0.10 0.00 -1.71 0.00 0.00 55.69 55.38 2pgz s MET 66 Cb 0.23 -2.76 -0.00 0.00 2.01 0.00 0.00 34.83 34.31 2pgz s MET 66 CO 0.30 0.30 0.25 1.67 -0.01 0.00 0.00 175.02 177.53 2pgz s TRP 67 N -1.64 0.20 -0.38 -0.03 -2.14 -0.62 -4.95 118.94 109.38 2pgz s TRP 67 Ca 0.48 -0.60 -0.21 0.00 2.66 0.00 0.00 56.10 58.44 2pgz s TRP 67 Cb -0.16 -0.02 0.01 0.00 -3.10 0.00 0.00 33.47 30.20 2pgz s TRP 67 CO 0.21 -0.63 0.64 0.34 -2.66 0.00 0.00 176.95 174.86 2pgz s ASP 68 N -2.90 6.40 0.54 -2.66 3.68 -1.26 -4.68 116.67 115.79 2pgz s ASP 68 Ca 0.09 0.02 0.28 0.00 2.13 0.00 0.00 52.55 55.07 2pgz s ASP 68 Cb 0.04 -2.33 1.43 0.00 -1.45 0.00 0.00 42.92 40.61 2pgz s ASP 68 CO -0.07 -0.65 1.96 -0.65 0.13 0.00 0.00 175.17 175.89 2pgz h PRO 69 N 8.58 0.00 0.00 4.34 0.11 -1.94 -1.29 132.00 141.80 2pgz h PRO 69 Ca -0.26 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 2pgz h PRO 69 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2pgz h PRO 69 CO 0.85 0.00 -0.10 -0.91 -0.21 0.00 0.00 178.00 177.64 2pgz h ASN 70 N 0.00 0.00 0.83 -2.05 2.35 -1.92 0.37 115.58 115.16 2pgz h ASN 70 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 2pgz h ASN 70 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 2pgz h ASN 70 CO -0.00 0.10 -0.21 -0.62 -1.65 0.00 0.00 177.43 175.04 2pgz n GLU 71 N -3.71 0.02 -2.52 0.81 -0.58 -0.49 -4.26 120.64 109.91 2pgz n GLU 71 Ca -0.02 0.01 -0.13 0.00 -0.42 0.00 0.00 57.16 56.60 2pgz n GLU 71 Cb 0.20 -1.52 0.03 0.00 -0.57 0.00 0.00 31.44 29.58 2pgz n GLU 71 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2pgz n TYR 72 N -1.56 2.00 -2.70 -0.32 4.01 -0.60 -4.98 117.16 113.02 2pgz n TYR 72 Ca 0.06 -2.49 -0.21 0.00 -0.16 0.00 0.00 57.90 55.10 2pgz n TYR 72 Cb 0.35 -0.27 0.01 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.48 -0.48 2.48 2.72 0.00 -1.18 -2.48 105.19 105.77 2pgz n GLY 73 Ca 0.23 0.04 -0.20 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.15 -5.54 -4.70 1.61 3.02 0.12 -4.97 115.26 102.66 2pgz n ASN 74 Ca -0.18 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.19 2pgz n ASN 74 Cb 0.65 -4.67 -0.03 0.00 -0.61 0.00 0.00 39.78 35.12 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 -2.86 3.03 -0.15 2.41 1.01 -1.03 -4.89 121.20 118.71 2pgz s ILE 75 Ca 0.00 0.55 0.10 0.00 0.00 0.00 0.00 60.65 61.30 2pgz s ILE 75 Cb 0.00 -3.36 -0.14 0.00 0.01 0.00 0.00 42.46 38.97 2pgz s ILE 75 CO 0.00 0.01 0.28 0.35 0.00 0.00 0.00 174.94 175.58 2pgz n THR 76 N 4.54 0.00 -3.58 2.92 -2.24 -1.26 -4.36 114.28 110.29 2pgz n THR 76 Ca 0.15 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 2pgz n THR 76 Cb 0.40 0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 69.11 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 -2.77 -0.42 0.10 3.42 1.47 -1.26 -0.85 116.67 116.36 2pgz s ASP 77 Ca -0.01 -0.21 -0.13 0.00 1.18 0.00 0.00 52.55 53.37 2pgz s ASP 77 Cb 0.07 0.60 0.02 0.00 -0.34 0.00 0.00 42.92 43.27 2pgz s ASP 77 CO 0.41 -1.03 0.32 0.72 0.68 0.00 0.00 175.17 176.26 2pgz s PHE 78 N -3.69 -0.07 -0.09 2.11 -0.12 0.21 -4.99 117.98 111.34 2pgz s PHE 78 Ca 0.05 -0.26 -0.05 0.00 -0.05 0.00 0.00 56.93 56.62 2pgz s PHE 78 Cb -0.02 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.46 2pgz s PHE 78 CO -0.06 -0.62 0.10 1.03 -0.05 0.00 0.00 175.22 175.63 2pgz s ARG 79 N -3.67 3.29 0.06 1.99 3.00 -1.26 -0.35 118.95 122.00 2pgz s ARG 79 Ca 0.03 -0.25 -0.16 0.00 0.00 0.00 0.00 55.73 55.34 2pgz s ARG 79 Cb 0.03 -3.05 0.03 0.00 0.00 0.00 0.00 34.95 31.96 2pgz s ARG 79 CO -0.11 0.74 0.37 -0.08 0.00 0.00 0.00 175.30 176.22 2pgz s THR 80 N -1.04 0.07 0.23 0.02 -1.32 -0.36 -4.98 115.64 108.26 2pgz s THR 80 Ca 0.17 -0.56 -0.31 0.00 -1.21 0.00 0.00 61.69 59.77 2pgz s THR 80 Cb -0.12 -0.99 -0.14 0.00 -1.51 0.00 0.00 72.50 69.75 2pgz s THR 80 CO 0.06 -0.31 1.37 -0.24 -2.21 0.00 0.00 174.62 173.29 2pgz n SER 81 N 0.41 2.54 0.32 8.08 2.88 -1.26 -0.65 113.62 125.94 2pgz n SER 81 Ca -0.18 1.14 0.20 0.00 -1.33 0.00 0.00 58.87 58.71 2pgz n SER 81 Cb 0.60 -1.40 1.12 0.00 -0.75 0.00 0.00 64.21 63.78 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 4.06 1.18 0.00 -1.46 0.00 -1.27 -1.05 119.26 120.71 2pgz h ALA 82 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2pgz h ALA 82 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2pgz h ALA 82 CO 0.75 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.96 2pgz h ALA 83 N 1.95 1.00 0.00 0.00 0.00 -1.89 -2.97 119.26 117.35 2pgz h ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2pgz h ALA 83 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2pgz h ALA 83 CO -0.00 0.00 -0.12 -0.25 0.00 0.00 0.00 179.25 178.88 2pgz n ASP 84 N -2.89 0.38 -4.20 0.00 8.00 -0.40 -4.89 116.55 112.55 2pgz n ASP 84 Ca -0.00 0.39 -0.12 0.00 0.71 0.00 0.00 54.79 55.77 2pgz n ASP 84 Cb 0.21 -0.43 -0.10 0.00 -0.02 0.00 0.00 41.12 40.78 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 -3.05 0.71 0.29 0.53 -4.36 -1.12 -5.00 121.20 109.20 2pgz s ILE 85 Ca 0.12 -1.96 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 2pgz s ILE 85 Cb 0.16 -1.88 -0.10 0.00 1.25 0.00 0.00 42.46 41.89 2pgz s ILE 85 CO 0.59 -0.69 1.35 0.86 0.24 0.00 0.00 174.94 177.29 2pgz s TRP 86 N -3.62 3.05 0.06 1.37 -0.00 -1.26 -4.96 118.94 113.57 2pgz s TRP 86 Ca 0.17 1.26 0.05 0.00 -0.00 0.00 0.00 56.10 57.58 2pgz s TRP 86 Cb 0.05 -3.72 -0.03 0.00 -0.00 0.00 0.00 33.47 29.77 2pgz s TRP 86 CO -0.01 -2.15 -0.13 0.95 -0.00 0.00 0.00 176.95 175.62 2pgz s THR 87 N -0.64 1.01 0.51 5.86 -4.23 -1.26 -5.11 115.64 111.79 2pgz s THR 87 Ca 0.53 -1.21 -0.20 0.00 -1.18 0.00 0.00 61.69 59.64 2pgz s THR 87 Cb -0.40 -0.98 -0.07 0.00 1.34 0.00 0.00 72.50 72.39 2pgz s THR 87 CO 0.48 -0.21 1.06 -2.16 -0.54 0.00 0.00 174.62 173.25 2pgz s PRO 88 N -1.60 3.66 -0.33 3.99 0.04 -1.26 -4.94 135.00 134.56 2pgz s PRO 88 Ca -0.03 1.39 -0.03 0.00 0.04 0.00 0.00 61.00 62.37 2pgz s PRO 88 Cb -0.10 -2.07 0.04 0.00 0.04 0.00 0.00 34.50 32.41 2pgz s PRO 88 CO 0.02 -0.55 2.72 -0.40 0.04 0.00 0.00 177.00 178.83 2pgz n ASP 89 N -1.15 6.23 -4.69 6.66 5.75 -1.26 -4.95 116.55 123.15 2pgz n ASP 89 Ca 0.10 -3.03 -0.42 0.00 -0.01 0.00 0.00 54.79 51.42 2pgz n ASP 89 Cb 0.52 -1.22 -0.03 0.00 -1.03 0.00 0.00 41.12 39.36 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 -1.65 3.26 -0.01 2.12 -1.09 -1.26 -2.84 121.20 119.73 2pgz s ILE 90 Ca 0.52 0.67 0.02 0.00 -2.23 0.00 0.00 60.65 59.63 2pgz s ILE 90 Cb 0.33 -3.43 -0.00 0.00 -1.58 0.00 0.00 42.46 37.77 2pgz s ILE 90 CO -0.13 -0.01 -0.07 -0.89 -1.23 0.00 0.00 174.94 172.61 2pgz s THR 91 N 2.67 0.56 0.12 2.92 2.01 0.08 -4.92 115.64 119.08 2pgz s THR 91 Ca 0.71 -0.30 -0.31 0.00 0.31 0.00 0.00 61.69 62.10 2pgz s THR 91 Cb -0.37 -0.48 -0.07 0.00 0.01 0.00 0.00 72.50 71.59 2pgz s THR 91 CO 0.30 0.16 1.31 0.00 -0.69 0.00 0.00 174.62 175.71 2pgz s ALA 92 N -0.14 3.52 -0.76 7.40 0.00 -1.26 -1.71 121.76 128.81 2pgz s ALA 92 Ca 0.02 1.03 0.26 0.00 0.00 0.00 0.00 51.96 53.27 2pgz s ALA 92 Cb -0.03 -3.49 0.67 0.00 0.00 0.00 0.00 23.12 20.26 2pgz s ALA 92 CO -0.00 -0.53 1.60 0.66 0.00 0.00 0.00 175.76 177.48 2pgz n TYR 93 N 3.63 0.60 -2.35 0.00 4.01 0.82 -4.06 117.16 119.81 2pgz n TYR 93 Ca 0.09 0.17 0.02 0.00 -0.16 0.00 0.00 57.90 58.02 2pgz n TYR 93 Cb 0.44 -0.72 0.06 0.00 -0.31 0.00 0.00 39.34 38.81 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 -2.04 1.52 -4.74 7.72 3.41 -1.26 -5.02 113.62 113.22 2pgz n SER 94 Ca 0.05 -2.50 -0.31 0.00 -0.26 0.00 0.00 58.87 55.84 2pgz n SER 94 Cb 0.41 -0.38 0.11 0.00 -0.26 0.00 0.00 64.21 64.09 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 -2.70 4.04 0.00 4.04 1.04 -1.26 -1.83 113.70 117.03 2pgz s SER 95 Ca 0.35 2.00 0.00 0.00 0.48 0.00 0.00 55.95 58.78 2pgz s SER 95 Cb 0.37 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.95 2pgz s SER 95 CO -0.11 -2.35 0.28 0.35 0.98 0.00 0.00 173.24 172.39 2pgz n THR 96 N -3.57 0.00 -3.85 2.02 -2.24 -0.13 -4.81 114.28 101.70 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 0.52 1.04 -0.08 0.00 -2.10 0.00 0.00 70.33 69.71 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 -0.37 0.71 0.32 -0.78 1.81 -1.25 -5.05 118.95 114.33 2pgz s ARG 97 Ca 0.00 -0.69 -0.29 0.00 -1.72 0.00 0.00 55.73 53.03 2pgz s ARG 97 Cb 0.00 0.29 -0.12 0.00 -0.45 0.00 0.00 34.95 34.68 2pgz s ARG 97 CO 0.00 -0.21 1.49 -2.30 -0.68 0.00 0.00 175.30 173.60 2pgz n PRO 98 N 0.57 2.51 -1.75 3.54 -0.02 -1.26 -4.68 135.00 133.92 2pgz n PRO 98 Ca -0.18 0.89 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 2pgz n PRO 98 Cb 0.59 -2.61 0.01 0.00 -0.02 0.00 0.00 33.50 31.47 2pgz n PRO 98 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2pgz n VAL 99 N 1.33 2.31 -3.95 -1.45 0.31 -1.26 -4.86 118.33 110.76 2pgz n VAL 99 Ca 0.06 -0.50 -0.35 0.00 -0.01 0.00 0.00 64.34 63.54 2pgz n VAL 99 Cb 0.36 -1.81 -0.11 0.00 -0.91 0.00 0.00 33.84 31.38 2pgz n VAL 99 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2pgz s GLN 100 N -2.18 3.82 -0.09 5.55 -0.21 -0.68 -4.98 119.66 120.89 2pgz s GLN 100 Ca 0.57 -0.41 -0.20 0.00 0.02 0.00 0.00 55.36 55.34 2pgz s GLN 100 Cb -0.49 -3.24 -0.04 0.00 1.00 0.00 0.00 33.01 30.24 2pgz s GLN 100 CO 0.61 0.08 0.56 0.08 -2.12 0.00 0.00 175.29 174.50 2pgz s VAL 101 N 0.89 5.11 -0.94 1.09 1.01 -1.26 -1.00 120.40 125.30 2pgz s VAL 101 Ca 0.03 1.14 0.13 0.00 0.00 0.00 0.00 61.98 63.28 2pgz s VAL 101 Cb -0.14 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.28 2pgz s VAL 101 CO 0.02 0.32 0.65 0.18 0.00 0.00 0.00 175.10 176.28 2pgz n LEU 102 N 3.55 1.06 -4.33 3.92 4.77 0.22 -4.98 117.00 121.22 2pgz n LEU 102 Ca -0.05 -0.65 -0.17 0.00 -0.03 0.00 0.00 56.01 55.10 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 0.44 0.22 -0.41 -0.94 -1.33 0.00 0.00 177.39 175.37 2pgz s SER 103 N -1.86 2.31 0.41 -1.43 1.04 -1.25 -4.92 113.70 108.00 2pgz s SER 103 Ca 0.08 -1.05 -0.27 0.00 0.48 0.00 0.00 55.95 55.19 2pgz s SER 103 Cb 0.10 -0.09 -0.10 0.00 0.10 0.00 0.00 66.02 66.03 2pgz s SER 103 CO 0.40 -0.26 1.46 -2.84 0.98 0.00 0.00 173.24 172.98 2pgz s PRO 104 N -3.70 3.92 -1.38 4.02 0.02 -1.26 -4.83 135.00 131.79 2pgz s PRO 104 Ca 0.22 2.51 -0.15 0.00 0.02 0.00 0.00 61.00 63.60 2pgz s PRO 104 Cb 0.01 -2.83 0.06 0.00 0.02 0.00 0.00 34.50 31.77 2pgz s PRO 104 CO 0.06 -0.66 1.98 1.04 -0.33 0.00 0.00 177.00 179.09 2pgz n GLN 105 N 0.17 3.05 -3.95 5.54 1.13 -1.26 -4.90 117.38 117.16 2pgz n GLN 105 Ca 0.03 -2.97 -0.14 0.00 -1.94 0.00 0.00 57.00 51.97 2pgz n GLN 105 Cb 0.40 -3.34 -0.15 0.00 0.11 0.00 0.00 30.24 27.26 2pgz n GLN 105 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2pgz s ILE 106 N 3.39 0.13 0.31 5.09 1.01 -1.26 -0.79 121.20 129.08 2pgz s ILE 106 Ca 0.49 -0.04 0.10 0.00 0.00 0.00 0.00 60.65 61.21 2pgz s ILE 106 Cb 0.09 -0.14 -0.06 0.00 0.01 0.00 0.00 42.46 42.36 2pgz s ILE 106 CO -0.01 0.06 -0.11 0.00 0.00 0.00 0.00 174.94 174.87 2pgz s ALA 107 N 0.17 2.93 -0.18 9.38 0.00 0.17 -4.60 121.76 129.63 2pgz s ALA 107 Ca -0.01 -1.95 -0.03 0.00 0.00 0.00 0.00 51.96 49.97 2pgz s ALA 107 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 2pgz s ALA 107 CO -0.00 0.17 -0.07 0.08 0.00 0.00 0.00 175.76 175.94 2pgz s VAL 108 N -2.53 3.38 -0.12 0.00 1.01 -0.13 -1.22 120.40 120.78 2pgz s VAL 108 Ca 0.32 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 2pgz s VAL 108 Cb -0.02 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2pgz s VAL 108 CO 0.17 0.46 -0.04 -0.69 0.00 0.00 0.00 175.10 175.00 2pgz s VAL 109 N 0.97 3.94 0.15 2.92 1.01 0.52 -1.04 120.40 128.87 2pgz s VAL 109 Ca -0.01 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.70 2pgz s VAL 109 Cb -0.15 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2pgz s VAL 109 CO 0.00 0.54 -0.11 -0.89 0.00 0.00 0.00 175.10 174.64 2pgz s THR 110 N -0.17 3.18 0.65 3.92 2.01 0.06 -0.62 115.64 124.66 2pgz s THR 110 Ca 0.03 -1.53 0.36 0.00 0.31 0.00 0.00 61.69 60.86 2pgz s THR 110 Cb -0.13 -2.53 0.38 0.00 0.01 0.00 0.00 72.50 70.23 2pgz s THR 110 CO 0.02 -0.02 2.16 1.12 -0.69 0.00 0.00 174.62 177.22 2pgz h HIS 111 N 3.23 0.00 -0.00 4.92 2.07 -1.30 0.23 115.15 124.30 2pgz h HIS 111 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2pgz h HIS 111 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 2pgz h HIS 111 CO 0.63 0.00 -0.00 -0.40 -3.07 0.00 0.00 177.93 175.09 2pgz n ASP 112 N -3.19 0.10 0.00 3.10 5.75 -1.26 -1.59 116.55 119.46 2pgz n ASP 112 Ca -0.02 -1.00 0.00 0.00 -0.01 0.00 0.00 54.79 53.77 2pgz n ASP 112 Cb 0.23 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 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 1.02 0.63 3.79 6.12 0.00 0.81 -4.70 105.19 112.87 2pgz n GLY 113 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.99 6.92 -0.02 1.61 1.04 -1.21 -1.19 113.70 117.86 2pgz s SER 114 Ca 0.00 1.94 0.05 0.00 0.48 0.00 0.00 55.95 58.43 2pgz s SER 114 Cb 0.00 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.53 2pgz s SER 114 CO 0.00 -0.37 -0.18 -0.69 0.98 0.00 0.00 173.24 172.98 2pgz s VAL 115 N -1.72 1.44 -0.13 5.02 1.01 0.83 -0.76 120.40 126.09 2pgz s VAL 115 Ca 0.57 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.81 2pgz s VAL 115 Cb -0.19 -1.21 0.01 0.00 0.00 0.00 0.00 36.38 34.99 2pgz s VAL 115 CO 0.25 0.41 -0.19 -0.32 0.00 0.00 0.00 175.10 175.25 2pgz s MET 116 N -0.27 2.65 -0.05 2.72 0.00 -0.21 -2.29 119.30 121.85 2pgz s MET 116 Ca 0.03 -0.72 -0.00 0.00 0.00 0.00 0.00 55.69 55.00 2pgz s MET 116 Cb -0.09 -2.19 0.03 0.00 0.00 0.00 0.00 34.83 32.58 2pgz s MET 116 CO 0.00 -0.04 -0.02 0.12 0.00 0.00 0.00 175.02 175.09 2pgz s PHE 117 N 0.90 0.64 -0.55 4.11 5.36 -0.32 -0.96 117.98 127.17 2pgz s PHE 117 Ca -0.07 -0.16 0.05 0.00 -0.96 0.00 0.00 56.93 55.80 2pgz s PHE 117 Cb -0.15 -0.68 0.20 0.00 -0.34 0.00 0.00 43.02 42.05 2pgz s PHE 117 CO -0.02 -0.24 0.51 -0.89 -1.46 0.00 0.00 175.22 173.12 2pgz n ILE 118 N 4.52 0.50 -2.18 3.12 5.41 -1.26 -0.28 119.36 129.18 2pgz n ILE 118 Ca -0.18 -4.35 -0.42 0.00 1.00 0.00 0.00 62.75 58.80 2pgz n ILE 118 Cb 0.50 -1.97 -0.03 0.00 -0.71 0.00 0.00 39.64 37.44 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 -1.17 4.30 0.12 0.38 0.04 -1.21 -4.74 135.00 132.73 2pgz s PRO 119 Ca 0.32 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 63.14 2pgz s PRO 119 Cb 0.06 -3.40 -0.07 0.00 0.04 0.00 0.00 34.50 31.13 2pgz s PRO 119 CO -0.14 -0.50 0.81 0.00 0.04 0.00 0.00 177.00 177.21 2pgz s ALA 120 N 1.70 3.39 0.03 8.56 0.00 -1.26 -1.27 121.76 132.90 2pgz s ALA 120 Ca 0.65 0.38 0.02 0.00 0.00 0.00 0.00 51.96 53.00 2pgz s ALA 120 Cb -0.35 -3.02 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 2pgz s ALA 120 CO 0.29 0.17 -0.06 -0.65 0.00 0.00 0.00 175.76 175.51 2pgz s GLN 121 N -0.65 0.44 -0.21 0.00 -0.21 -0.01 -0.61 119.66 118.41 2pgz s GLN 121 Ca 0.38 -0.58 -0.08 0.00 0.02 0.00 0.00 55.36 55.11 2pgz s GLN 121 Cb -0.22 -0.23 -0.04 0.00 1.00 0.00 0.00 33.01 33.51 2pgz s GLN 121 CO 0.26 0.04 0.08 0.50 -2.12 0.00 0.00 175.29 174.05 2pgz s ARG 122 N -1.18 3.88 -0.08 2.91 3.52 -0.17 -1.68 118.95 126.15 2pgz s ARG 122 Ca -0.08 -0.38 0.03 0.00 -0.13 0.00 0.00 55.73 55.17 2pgz s ARG 122 Cb -0.08 -3.29 0.01 0.00 -1.56 0.00 0.00 34.95 30.03 2pgz s ARG 122 CO 0.00 0.09 -0.17 -1.17 -0.81 0.00 0.00 175.30 173.24 2pgz s LEU 123 N 0.88 1.83 -0.18 -0.88 2.96 -0.00 -1.69 118.68 121.59 2pgz s LEU 123 Ca 0.04 -0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 53.43 2pgz s LEU 123 Cb -0.14 -1.08 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 2pgz s LEU 123 CO 0.03 0.08 0.18 -0.44 -1.32 0.00 0.00 176.35 174.88 2pgz s SER 124 N 0.55 6.29 0.15 3.68 0.01 -1.26 -0.75 113.70 122.38 2pgz s SER 124 Ca -0.16 0.33 -0.02 0.00 1.31 0.00 0.00 55.95 57.41 2pgz s SER 124 Cb -0.17 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 2pgz s SER 124 CO 0.06 0.18 0.11 0.72 0.41 0.00 0.00 173.24 174.72 2pgz s PHE 125 N 0.24 0.86 -0.24 2.43 -0.12 -0.44 -0.96 117.98 119.76 2pgz s PHE 125 Ca 0.11 -1.20 -0.29 0.00 -0.05 0.00 0.00 56.93 55.50 2pgz s PHE 125 Cb -0.12 -0.43 -0.02 0.00 -0.63 0.00 0.00 43.02 41.82 2pgz s PHE 125 CO 0.00 -0.58 1.52 -1.64 -0.05 0.00 0.00 175.22 174.47 2pgz s MET 126 N -4.06 3.85 -0.28 1.99 -1.94 -0.76 -1.57 119.30 116.52 2pgz s MET 126 Ca 0.27 1.56 -0.13 0.00 -1.71 0.00 0.00 55.69 55.68 2pgz s MET 126 Cb 0.07 -3.98 0.10 0.00 2.01 0.00 0.00 34.83 33.03 2pgz s MET 126 CO 0.04 -1.22 0.65 0.00 -0.01 0.00 0.00 175.02 174.49 2pgz s ASP 128 N 2.26 6.30 0.00 0.00 2.15 -1.26 -3.04 116.67 123.08 2pgz s ASP 128 Ca -0.08 -0.20 0.04 0.00 0.43 0.00 0.00 52.55 52.74 2pgz s ASP 128 Cb -0.09 -2.28 0.13 0.00 -0.30 0.00 0.00 42.92 40.38 2pgz s ASP 128 CO -0.19 -0.57 1.10 -0.81 -0.17 0.00 0.00 175.17 174.52 2pgz n PRO 129 N 5.86 1.22 -1.63 4.34 -0.04 -1.26 -4.68 135.00 138.81 2pgz n PRO 129 Ca -0.04 -0.35 -0.49 0.00 -0.04 0.00 0.00 63.50 62.58 2pgz n PRO 129 Cb 0.48 -1.09 -0.05 0.00 -0.04 0.00 0.00 33.50 32.81 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 -0.23 0.01 -0.02 0.52 -1.04 -1.26 -0.96 114.28 111.31 2pgz n THR 130 Ca 0.04 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2pgz n THR 130 Cb 0.08 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 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 2.96 0.48 0.32 3.41 0.00 -1.26 -4.40 105.19 106.70 2pgz n GLY 131 Ca 0.18 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.35 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 0.55 -0.79 1.61 3.04 -1.23 -0.32 116.25 119.12 2pgz h VAL 132 Ca 0.00 0.00 -0.43 0.00 -1.01 0.00 0.00 66.70 65.26 2pgz h VAL 132 Cb 0.00 0.91 -0.24 0.00 -2.01 0.00 0.00 31.29 29.95 2pgz h VAL 132 CO 0.00 0.00 0.54 -0.90 -1.01 0.00 0.00 177.57 176.20 2pgz n ASP 133 N -3.91 4.03 -4.30 3.17 5.75 -1.26 -0.27 116.55 119.75 2pgz n ASP 133 Ca -0.00 -3.30 -0.16 0.00 -0.01 0.00 0.00 54.79 51.32 2pgz n ASP 133 Cb 0.22 -0.80 -0.10 0.00 -1.03 0.00 0.00 41.12 39.41 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 -0.84 1.96 0.34 -1.12 1.04 -0.14 -5.03 113.70 109.91 2pgz s SER 134 Ca 0.46 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.83 2pgz s SER 134 Cb 0.38 -0.03 0.65 0.00 0.10 0.00 0.00 66.02 67.13 2pgz s SER 134 CO 0.08 -0.37 1.94 -0.08 0.98 0.00 0.00 173.24 175.78 2pgz h GLU 135 N 2.62 0.84 0.00 4.02 4.81 -1.91 -1.90 114.58 123.06 2pgz h GLU 135 Ca -0.38 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.77 2pgz h GLU 135 Cb 1.21 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 2pgz h GLU 135 CO 0.64 0.56 -0.15 1.05 -0.73 0.00 0.00 179.01 180.38 2pgz h GLU 136 N 0.87 0.00 0.00 1.92 9.09 -1.97 -3.50 114.58 120.99 2pgz h GLU 136 Ca 0.35 0.00 0.05 0.00 0.05 0.00 0.00 59.36 59.81 2pgz h GLU 136 Cb 0.24 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.33 2pgz h GLU 136 CO -0.12 0.15 -0.07 0.41 0.05 0.00 0.00 179.01 179.42 2pgz n GLY 137 N 0.21 -1.72 3.77 1.06 0.00 -0.72 -4.86 105.19 102.93 2pgz n GLY 137 Ca 0.01 -1.27 -0.25 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.49 3.47 -0.08 4.61 0.00 0.10 -4.25 121.76 124.12 2pgz s ALA 138 Ca 0.00 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 50.65 2pgz s ALA 138 Cb 0.00 -1.23 0.01 0.00 0.00 0.00 0.00 23.12 21.90 2pgz s ALA 138 CO 0.00 0.42 -0.15 0.99 0.00 0.00 0.00 175.76 177.01 2pgz s THR 139 N -1.89 1.40 0.19 0.00 2.01 -1.26 -1.13 115.64 114.95 2pgz s THR 139 Ca 0.31 -0.62 0.03 0.00 0.31 0.00 0.00 61.69 61.71 2pgz s THR 139 Cb -0.09 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.12 2pgz s THR 139 CO 0.23 0.41 -0.02 0.00 -0.69 0.00 0.00 174.62 174.55 2pgz s ALA 141 N -3.51 -0.42 -0.07 0.00 0.00 -1.26 -1.04 121.76 115.46 2pgz s ALA 141 Ca 0.24 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 52.21 2pgz s ALA 141 Cb 0.05 0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.24 2pgz s ALA 141 CO 0.05 -0.20 0.16 0.54 0.00 0.00 0.00 175.76 176.32 2pgz s VAL 142 N -1.13 -0.03 0.08 0.00 0.11 -0.19 -4.90 120.40 114.34 2pgz s VAL 142 Ca -0.12 0.11 -0.13 0.00 -2.93 0.00 0.00 61.98 58.91 2pgz s VAL 142 Cb -0.06 -0.26 -0.06 0.00 -1.53 0.00 0.00 36.38 34.47 2pgz s VAL 142 CO 0.02 0.05 0.46 -0.54 -3.33 0.00 0.00 175.10 171.76 2pgz s LYS 143 N 0.80 3.90 -0.05 1.54 1.02 -1.26 -0.38 119.74 125.32 2pgz s LYS 143 Ca -0.06 0.38 0.05 0.00 0.02 0.00 0.00 55.97 56.36 2pgz s LYS 143 Cb -0.08 -3.05 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 2pgz s LYS 143 CO -0.04 0.57 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.70 2pgz s PHE 144 N -1.32 1.94 0.11 3.18 0.08 0.05 -0.13 117.98 121.88 2pgz s PHE 144 Ca 0.32 -0.55 -0.25 0.00 0.12 0.00 0.00 56.93 56.57 2pgz s PHE 144 Cb -0.15 -1.29 0.08 0.00 -0.57 0.00 0.00 43.02 41.09 2pgz s PHE 144 CO 0.17 -0.17 1.13 0.20 -0.10 0.00 0.00 175.22 176.45 2pgz s GLY 145 N -0.06 -0.01 0.43 4.36 0.00 -0.69 -0.20 107.32 111.16 2pgz s GLY 145 Ca -0.03 -0.14 -0.26 0.00 0.00 0.00 0.00 44.72 44.29 2pgz s GLY 145 CO 0.02 3.28 1.37 -0.45 0.00 0.00 0.00 173.10 177.33 2pgz s SER 146 N -3.50 6.05 0.06 1.64 0.15 -1.26 -0.74 113.70 116.10 2pgz s SER 146 Ca 0.24 2.80 -0.15 0.00 0.70 0.00 0.00 55.95 59.54 2pgz s SER 146 Cb -0.01 -2.65 -0.25 0.00 -1.71 0.00 0.00 66.02 61.40 2pgz s SER 146 CO 0.03 -1.04 1.15 -0.25 1.20 0.00 0.00 173.24 174.33 2pgz h TRP 147 N 2.46 0.98 0.00 3.44 2.91 -1.88 -3.41 115.95 120.45 2pgz h TRP 147 Ca -0.50 -0.55 0.00 0.00 1.13 0.00 0.00 58.89 58.97 2pgz h TRP 147 Cb 1.26 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 29.80 2pgz h TRP 147 CO 0.51 1.39 -0.53 1.33 -1.03 0.00 0.00 178.44 180.11 2pgz n VAL 148 N -3.90 0.00 -4.05 2.65 0.24 -1.26 -4.98 118.33 107.03 2pgz n VAL 148 Ca -0.12 -0.30 -0.34 0.00 -2.04 0.00 0.00 64.34 61.54 2pgz n VAL 148 Cb 0.87 0.81 -0.10 0.00 -1.47 0.00 0.00 33.84 33.96 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 -1.71 3.23 0.94 6.34 2.02 -1.26 -5.11 117.35 121.79 2pgz s TYR 149 Ca 0.01 0.03 -0.15 0.00 -0.37 0.00 0.00 57.07 56.59 2pgz s TYR 149 Cb 0.03 -2.06 0.18 0.00 -0.40 0.00 0.00 41.96 39.71 2pgz s TYR 149 CO 0.19 0.14 1.30 -1.54 -1.57 0.00 0.00 175.55 174.07 2pgz s SER 150 N 0.35 3.31 0.22 2.29 1.04 -1.26 -4.67 113.70 114.98 2pgz s SER 150 Ca 0.02 0.36 0.18 0.00 0.48 0.00 0.00 55.95 57.00 2pgz s SER 150 Cb -0.13 -0.48 0.87 0.00 0.10 0.00 0.00 66.02 66.38 2pgz s SER 150 CO 0.00 -2.62 1.56 0.61 0.98 0.00 0.00 173.24 173.78 2pgz n GLY 151 N -3.64 -0.97 0.25 7.32 0.00 0.57 -1.14 105.19 107.59 2pgz n GLY 151 Ca 0.14 0.10 0.15 0.00 0.00 0.00 0.00 46.02 46.41 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 -0.16 0.00 2.80 0.00 0.00 57.97 60.61 2pgz h PHE 152 Cb 0.15 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.28 2pgz h PHE 152 CO 0.00 0.00 -1.58 0.39 -0.60 0.00 0.00 178.31 176.52 2pgz n GLU 153 N -3.09 0.25 -4.02 1.51 4.71 -0.40 -4.15 120.64 115.44 2pgz n GLU 153 Ca 0.02 0.06 -0.27 0.00 -0.01 0.00 0.00 57.16 56.96 2pgz n GLU 153 Cb 0.40 -1.16 -0.17 0.00 -1.01 0.00 0.00 31.44 29.51 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 -2.20 1.18 0.18 -3.67 1.01 -0.29 -0.85 121.20 116.56 2pgz s ILE 154 Ca -0.14 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.15 2pgz s ILE 154 Cb 0.04 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 2pgz s ILE 154 CO 0.23 0.39 0.29 -0.62 0.00 0.00 0.00 174.94 175.23 2pgz s ASP 155 N 1.52 6.21 0.19 3.58 2.15 0.26 -3.86 116.67 126.73 2pgz s ASP 155 Ca 0.03 0.09 0.11 0.00 0.43 0.00 0.00 52.55 53.21 2pgz s ASP 155 Cb -0.13 -1.82 -0.04 0.00 -0.30 0.00 0.00 42.92 40.62 2pgz s ASP 155 CO -0.07 0.01 -0.23 -0.76 -0.17 0.00 0.00 175.17 173.94 2pgz s LEU 156 N -3.48 2.43 0.18 -1.34 1.43 -1.26 -0.38 118.68 116.26 2pgz s LEU 156 Ca 0.34 -0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 52.45 2pgz s LEU 156 Cb -0.10 -1.13 0.01 0.00 0.03 0.00 0.00 46.19 45.00 2pgz s LEU 156 CO 0.28 0.10 0.40 -1.59 0.23 0.00 0.00 176.35 175.77 2pgz s LYS 157 N -2.67 1.27 0.21 1.70 -2.85 -0.49 -4.90 119.74 112.01 2pgz s LYS 157 Ca 0.20 -1.04 0.11 0.00 -1.00 0.00 0.00 55.97 54.24 2pgz s LYS 157 Cb -0.08 0.44 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 2pgz s LYS 157 CO 0.09 -0.50 -0.23 0.95 0.10 0.00 0.00 175.35 175.76 2pgz s THR 158 N -3.93 2.37 -0.23 3.79 -4.23 -1.26 -0.39 115.64 111.76 2pgz s THR 158 Ca 0.14 -2.09 0.22 0.00 -1.18 0.00 0.00 61.69 58.78 2pgz s THR 158 Cb 0.01 -2.15 -0.01 0.00 1.34 0.00 0.00 72.50 71.69 2pgz s THR 158 CO -0.01 -0.16 1.04 0.44 -0.54 0.00 0.00 174.62 175.39 2pgz h ASP 159 N 3.07 0.00 -5.02 3.99 3.32 -1.97 -3.47 116.42 116.33 2pgz h ASP 159 Ca -0.45 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.52 2pgz h ASP 159 Cb 1.22 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.59 2pgz h ASP 159 CO 0.50 0.03 -0.08 0.28 -1.72 0.00 0.00 179.24 178.25 2pgz s THR 160 N -3.34 0.05 -0.95 0.35 -1.32 -1.26 -5.04 115.64 104.12 2pgz s THR 160 Ca -0.01 -0.37 0.27 0.00 -1.21 0.00 0.00 61.69 60.37 2pgz s THR 160 Cb 0.09 -0.90 0.13 0.00 -1.51 0.00 0.00 72.50 70.32 2pgz s THR 160 CO 0.79 -0.21 1.65 0.47 -2.21 0.00 0.00 174.62 175.12 2pgz n ASP 161 N 0.69 0.32 -4.66 8.08 8.00 -1.26 -4.80 116.55 122.92 2pgz n ASP 161 Ca -0.19 0.16 -0.39 0.00 0.71 0.00 0.00 54.79 55.08 2pgz n ASP 161 Cb 0.59 -0.15 -0.07 0.00 -0.02 0.00 0.00 41.12 41.47 2pgz n ASP 161 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2pgz s GLN 162 N -3.02 4.18 0.25 -1.24 -1.52 -1.26 -0.71 119.66 116.34 2pgz s GLN 162 Ca 0.12 0.39 -0.30 0.00 -1.95 0.00 0.00 55.36 53.62 2pgz s GLN 162 Cb 0.17 -3.57 -0.10 0.00 -0.22 0.00 0.00 33.01 29.29 2pgz s GLN 162 CO 0.62 -0.16 1.47 0.08 -0.25 0.00 0.00 175.29 177.06 2pgz s VAL 163 N 1.67 2.55 -0.16 1.09 1.01 -0.69 -4.86 120.40 121.02 2pgz s VAL 163 Ca 0.23 0.46 -0.29 0.00 0.00 0.00 0.00 61.98 62.38 2pgz s VAL 163 Cb -0.15 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2pgz s VAL 163 CO 0.09 0.07 1.81 -0.62 0.00 0.00 0.00 175.10 176.46 2pgz s ASP 164 N 0.43 6.23 0.00 3.32 -1.08 -0.56 -4.86 116.67 120.14 2pgz s ASP 164 Ca 0.61 1.94 0.12 0.00 -0.52 0.00 0.00 52.55 54.69 2pgz s ASP 164 Cb -0.43 -2.53 0.32 0.00 -1.46 0.00 0.00 42.92 38.82 2pgz s ASP 164 CO 0.43 -1.34 1.25 0.18 0.52 0.00 0.00 175.17 176.22 2pgz n LEU 165 N 8.83 2.95 0.06 -1.34 4.77 -1.26 -1.79 117.00 129.22 2pgz n LEU 165 Ca 0.21 -1.93 0.10 0.00 -0.03 0.00 0.00 56.01 54.37 2pgz n LEU 165 Cb 0.44 -0.24 0.42 0.00 -2.33 0.00 0.00 43.42 41.71 2pgz n LEU 165 CO 0.65 0.73 0.82 -1.54 -1.33 0.00 0.00 177.39 176.72 2pgz n SER 166 N 0.63 0.33 -0.62 -1.43 3.41 -1.26 -1.86 113.62 112.82 2pgz n SER 166 Ca 0.12 0.57 0.06 0.00 -0.26 0.00 0.00 58.87 59.36 2pgz n SER 166 Cb 0.43 -0.65 0.16 0.00 -0.26 0.00 0.00 64.21 63.90 2pgz n SER 166 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2pgz n SER 167 N -1.85 3.04 -4.73 4.04 7.64 -1.26 -5.02 113.62 115.48 2pgz n SER 167 Ca 0.04 -2.26 -0.42 0.00 1.01 0.00 0.00 58.87 57.24 2pgz n SER 167 Cb 0.23 -0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 63.12 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 -1.46 3.09 -0.12 1.43 5.04 -0.77 -4.60 117.35 119.96 2pgz s TYR 168 Ca 0.25 0.85 -0.29 0.00 -2.44 0.00 0.00 57.07 55.45 2pgz s TYR 168 Cb 0.16 -3.83 -0.05 0.00 0.35 0.00 0.00 41.96 38.59 2pgz s TYR 168 CO 0.12 -2.89 1.80 -0.47 -1.34 0.00 0.00 175.55 172.77 2pgz s TYR 169 N 0.69 1.74 0.59 4.97 5.04 0.35 -4.86 117.35 125.87 2pgz s TYR 169 Ca 0.65 0.22 0.30 0.00 -2.44 0.00 0.00 57.07 55.80 2pgz s TYR 169 Cb -0.41 -4.02 1.83 0.00 0.35 0.00 0.00 41.96 39.70 2pgz s TYR 169 CO 0.35 -3.96 2.23 0.00 -1.34 0.00 0.00 175.55 172.84 2pgz h ALA 170 N 11.06 1.55 -0.17 3.97 0.00 -1.90 -2.51 119.26 131.26 2pgz h ALA 170 Ca -0.40 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 2pgz h ALA 170 Cb 1.19 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 2pgz h ALA 170 CO 0.97 -0.05 -0.15 0.43 0.00 0.00 0.00 179.25 180.45 2pgz n SER 171 N -3.80 2.52 -4.63 0.00 7.64 -1.26 -5.04 113.62 109.05 2pgz n SER 171 Ca -0.02 -3.51 -0.37 0.00 1.01 0.00 0.00 58.87 55.98 2pgz n SER 171 Cb 0.12 -0.55 0.07 0.00 -1.01 0.00 0.00 64.21 62.85 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 -1.08 0.80 0.31 6.43 2.88 -0.95 -4.89 113.62 117.12 2pgz n SER 172 Ca 0.24 0.74 0.17 0.00 -1.33 0.00 0.00 58.87 58.69 2pgz n SER 172 Cb 0.83 -1.42 1.00 0.00 -0.75 0.00 0.00 64.21 63.87 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 0.11 0.00 -5.25 -1.46 1.79 -1.90 -3.43 116.57 106.43 2pgz h LYS 173 Ca -0.48 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.35 2pgz h LYS 173 Cb 1.35 0.00 -0.33 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 0.00 179.45 178.72 2pgz s TYR 174 N -4.43 2.26 0.15 -1.35 2.02 -1.26 -1.04 117.35 113.70 2pgz s TYR 174 Ca -0.05 -0.87 -0.14 0.00 -0.37 0.00 0.00 57.07 55.64 2pgz s TYR 174 Cb 0.14 -1.53 -0.07 0.00 -0.40 0.00 0.00 41.96 40.10 2pgz s TYR 174 CO 0.51 -0.35 0.56 -1.83 -1.57 0.00 0.00 175.55 172.86 2pgz s GLU 175 N 0.33 3.99 -0.17 -0.62 -1.05 -0.02 -4.79 118.70 116.37 2pgz s GLU 175 Ca -0.15 0.50 -0.18 0.00 -0.15 0.00 0.00 54.97 54.99 2pgz s GLU 175 Cb -0.17 -2.92 -0.04 0.00 -0.44 0.00 0.00 34.13 30.57 2pgz s GLU 175 CO 0.07 0.47 0.48 0.42 0.95 0.00 0.00 175.26 177.65 2pgz s ILE 176 N -1.48 5.15 -0.08 1.83 -1.09 -1.26 -1.74 121.20 122.53 2pgz s ILE 176 Ca 0.38 0.91 0.11 0.00 -2.23 0.00 0.00 60.65 59.83 2pgz s ILE 176 Cb -0.15 -3.81 -0.24 0.00 -1.58 0.00 0.00 42.46 36.68 2pgz s ILE 176 CO 0.19 0.25 0.52 0.18 -1.23 0.00 0.00 174.94 174.85 2pgz n LEU 177 N 4.30 0.94 -3.58 2.97 4.77 0.12 -4.98 117.00 121.55 2pgz n LEU 177 Ca -0.06 0.32 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 2pgz n LEU 177 Cb 0.51 0.08 -0.04 0.00 -2.33 0.00 0.00 43.42 41.63 2pgz n LEU 177 CO 0.42 0.46 0.82 -0.94 -1.33 0.00 0.00 177.39 176.82 2pgz s SER 178 N -6.09 -0.32 -0.17 -1.43 1.04 -1.01 -4.98 113.70 100.75 2pgz s SER 178 Ca -0.08 0.29 -0.05 0.00 0.48 0.00 0.00 55.95 56.59 2pgz s SER 178 Cb 0.08 0.27 0.08 0.00 0.10 0.00 0.00 66.02 66.55 2pgz s SER 178 CO 0.82 -0.34 0.31 0.00 0.98 0.00 0.00 173.24 175.01 2pgz s ALA 179 N -1.44 -0.73 0.21 5.32 0.00 -1.26 -0.96 121.76 122.90 2pgz s ALA 179 Ca 0.01 0.99 0.11 0.00 0.00 0.00 0.00 51.96 53.07 2pgz s ALA 179 Cb -0.01 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 2pgz s ALA 179 CO -0.01 -0.81 -0.22 0.95 0.00 0.00 0.00 175.76 175.68 2pgz s THR 180 N 2.47 2.25 -0.15 0.00 -4.23 -0.40 -1.70 115.64 113.88 2pgz s THR 180 Ca 0.03 -2.10 -0.03 0.00 -1.18 0.00 0.00 61.69 58.41 2pgz s THR 180 Cb -0.13 -2.10 0.05 0.00 1.34 0.00 0.00 72.50 71.66 2pgz s THR 180 CO -0.11 -0.23 0.04 0.00 -0.54 0.00 0.00 174.62 173.78 2pgz s GLN 181 N -2.90 0.53 -0.08 3.99 -2.07 0.11 -1.23 119.66 118.01 2pgz s GLN 181 Ca 0.22 -0.21 0.01 0.00 -1.82 0.00 0.00 55.36 53.55 2pgz s GLN 181 Cb -0.07 -1.73 0.02 0.00 -1.09 0.00 0.00 33.01 30.14 2pgz s GLN 181 CO 0.10 -0.55 -0.08 0.99 -1.32 0.00 0.00 175.29 174.43 2pgz s THR 182 N 1.94 0.91 0.23 3.63 2.01 -0.64 -4.31 115.64 119.41 2pgz s THR 182 Ca 0.01 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 2pgz s THR 182 Cb -0.16 -0.91 -0.10 0.00 0.01 0.00 0.00 72.50 71.35 2pgz s THR 182 CO -0.07 0.33 1.45 -0.60 -0.69 0.00 0.00 174.62 175.03 2pgz s ARG 183 N 1.22 4.27 -0.01 4.92 3.52 -1.26 -0.24 118.95 131.37 2pgz s ARG 183 Ca -0.05 2.29 0.05 0.00 -0.13 0.00 0.00 55.73 57.89 2pgz s ARG 183 Cb -0.14 -3.12 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 2pgz s ARG 183 CO -0.02 -0.44 -0.15 -0.65 -0.81 0.00 0.00 175.30 173.23 2pgz s GLN 184 N -0.12 1.24 -0.13 5.12 -0.21 0.56 -4.92 119.66 121.20 2pgz s GLN 184 Ca 0.61 -0.53 -0.01 0.00 0.02 0.00 0.00 55.36 55.45 2pgz s GLN 184 Cb -0.42 -1.19 -0.02 0.00 1.00 0.00 0.00 33.01 32.39 2pgz s GLN 184 CO 0.41 0.31 -0.12 0.08 -2.12 0.00 0.00 175.29 173.86 2pgz s VAL 185 N -0.32 3.19 -0.03 1.09 1.01 -1.26 -1.55 120.40 122.53 2pgz s VAL 185 Ca 0.05 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.46 2pgz s VAL 185 Cb -0.06 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 2pgz s VAL 185 CO -0.00 0.52 -0.16 -1.10 0.00 0.00 0.00 175.10 174.35 2pgz s GLN 186 N 0.33 1.55 -0.14 2.72 -0.21 0.93 -4.97 119.66 119.88 2pgz s GLN 186 Ca -0.10 -0.58 0.01 0.00 0.02 0.00 0.00 55.36 54.72 2pgz s GLN 186 Cb -0.16 -1.40 -0.00 0.00 1.00 0.00 0.00 33.01 32.45 2pgz s GLN 186 CO 0.05 0.27 -0.16 -1.01 -2.12 0.00 0.00 175.29 172.32 2pgz s HIS 187 N -0.10 2.75 0.13 0.91 3.76 -1.26 -0.61 115.29 120.86 2pgz s HIS 187 Ca -0.00 -0.94 0.04 0.00 -0.15 0.00 0.00 55.06 54.01 2pgz s HIS 187 Cb -0.09 -1.84 -0.04 0.00 1.11 0.00 0.00 32.58 31.71 2pgz s HIS 187 CO 0.01 -0.39 0.15 0.71 -0.85 0.00 0.00 174.74 174.36 2pgz s TYR 188 N 0.60 3.24 0.37 1.40 1.51 -1.26 -5.02 117.35 118.19 2pgz s TYR 188 Ca -0.09 0.06 0.06 0.00 -1.01 0.00 0.00 57.07 56.08 2pgz s TYR 188 Cb -0.16 -1.59 0.71 0.00 -0.11 0.00 0.00 41.96 40.81 2pgz s TYR 188 CO 0.03 0.53 1.96 0.66 -1.11 0.00 0.00 175.55 177.61 2pgz h SER 189 N 2.71 0.48 -0.98 2.29 4.64 -2.00 -2.61 113.55 118.08 2pgz h SER 189 Ca -0.47 -0.06 0.09 0.00 -0.47 0.00 0.00 61.79 60.88 2pgz h SER 189 Cb 1.18 -0.12 -0.07 0.00 -0.31 0.00 0.00 62.40 63.08 2pgz h SER 189 CO 0.66 0.46 0.63 0.00 -0.87 0.00 0.00 176.83 177.71 2pgz h PRO 192 N 6.43 0.00 -7.03 0.00 0.13 -1.89 -3.36 132.00 126.27 2pgz h PRO 192 Ca -0.33 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.34 2pgz h PRO 192 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2pgz h PRO 192 CO 0.49 0.11 0.37 -1.21 -0.23 0.00 0.00 178.00 177.53 2pgz s GLU 193 N -3.31 4.10 0.39 0.86 8.01 -1.26 -5.03 118.70 122.47 2pgz s GLU 193 Ca 0.05 1.30 -0.24 0.00 0.01 0.00 0.00 54.97 56.09 2pgz s GLU 193 Cb 0.07 -2.28 -0.10 0.00 -4.31 0.00 0.00 34.13 27.51 2pgz s GLU 193 CO 0.65 -0.16 0.99 -1.25 0.01 0.00 0.00 175.26 175.50 2pgz s PRO 194 N -2.96 4.29 -0.08 0.39 0.04 -1.26 -4.63 135.00 130.79 2pgz s PRO 194 Ca 0.62 1.33 0.04 0.00 0.04 0.00 0.00 61.00 63.03 2pgz s PRO 194 Cb -0.15 -2.49 -0.01 0.00 0.04 0.00 0.00 34.50 31.89 2pgz s PRO 194 CO 0.19 0.00 -0.21 0.71 0.04 0.00 0.00 177.00 177.73 2pgz s TYR 195 N -1.81 2.56 -0.03 0.56 2.02 0.22 -0.31 117.35 120.55 2pgz s TYR 195 Ca 0.57 -0.72 0.06 0.00 -0.37 0.00 0.00 57.07 56.60 2pgz s TYR 195 Cb -0.17 -1.67 -0.02 0.00 -0.40 0.00 0.00 41.96 39.70 2pgz s TYR 195 CO 0.22 -0.22 -0.20 0.42 -1.57 0.00 0.00 175.55 174.20 2pgz s ILE 196 N -0.01 2.61 0.20 2.71 -1.09 -1.26 -0.05 121.20 124.30 2pgz s ILE 196 Ca -0.07 -0.91 -0.06 0.00 -2.23 0.00 0.00 60.65 57.38 2pgz s ILE 196 Cb -0.15 -1.98 -0.02 0.00 -1.58 0.00 0.00 42.46 38.73 2pgz s ILE 196 CO 0.05 0.58 0.26 1.51 -1.23 0.00 0.00 174.94 176.11 2pgz s ASP 197 N -0.70 0.07 -0.20 3.58 -4.77 -0.59 -4.56 116.67 109.50 2pgz s ASP 197 Ca 0.11 -1.10 -0.02 0.00 -3.30 0.00 0.00 52.55 48.24 2pgz s ASP 197 Cb -0.10 0.44 -0.00 0.00 -1.09 0.00 0.00 42.92 42.17 2pgz s ASP 197 CO -0.00 -0.92 -0.09 -0.69 0.70 0.00 0.00 175.17 174.17 2pgz s VAL 198 N -4.06 3.02 -0.31 2.11 1.01 0.72 -0.32 120.40 122.58 2pgz s VAL 198 Ca 0.27 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 2pgz s VAL 198 Cb 0.04 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 2pgz s VAL 198 CO 0.07 0.46 0.52 0.21 0.00 0.00 0.00 175.10 176.35 2pgz s ASN 199 N 1.35 6.37 -0.31 3.32 2.47 0.67 -0.77 114.94 128.04 2pgz s ASN 199 Ca 0.04 0.25 -0.17 0.00 0.42 0.00 0.00 52.86 53.41 2pgz s ASN 199 Cb -0.14 -2.28 -0.02 0.00 -1.45 0.00 0.00 41.25 37.36 2pgz s ASN 199 CO -0.05 -0.39 0.45 -0.22 -3.72 0.00 0.00 177.10 173.17 2pgz s LEU 200 N 2.37 4.21 -0.18 3.21 2.96 0.49 -1.63 118.68 130.11 2pgz s LEU 200 Ca 0.20 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.25 2pgz s LEU 200 Cb -0.15 -2.51 0.01 0.00 0.50 0.00 0.00 46.19 44.03 2pgz s LEU 200 CO 0.11 -0.33 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.96 2pgz s VAL 201 N 2.22 2.42 -0.12 1.68 1.01 -0.36 -1.02 120.40 126.23 2pgz s VAL 201 Ca 0.17 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.34 2pgz s VAL 201 Cb -0.16 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.20 2pgz s VAL 201 CO 0.11 0.51 -0.19 -0.69 0.00 0.00 0.00 175.10 174.84 2pgz s VAL 202 N 1.17 1.83 -0.20 2.92 1.01 -0.21 -1.28 120.40 125.65 2pgz s VAL 202 Ca 0.02 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 2pgz s VAL 202 Cb -0.14 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2pgz s VAL 202 CO -0.07 0.51 0.04 -0.75 0.00 0.00 0.00 175.10 174.82 2pgz s LYS 203 N 0.83 3.75 0.13 2.72 2.20 -0.13 -1.28 119.74 127.95 2pgz s LYS 203 Ca -0.08 -0.45 -0.12 0.00 -0.36 0.00 0.00 55.97 54.96 2pgz s LYS 203 Cb -0.16 -3.18 0.01 0.00 -1.51 0.00 0.00 37.83 33.00 2pgz s LYS 203 CO -0.01 0.07 0.32 -0.59 -0.36 0.00 0.00 175.35 174.78 2pgz s PHE 204 N 0.90 0.07 0.13 4.03 -0.12 -0.29 0.13 117.98 122.83 2pgz s PHE 204 Ca 0.03 -0.44 -0.14 0.00 -0.05 0.00 0.00 56.93 56.33 2pgz s PHE 204 Cb -0.14 0.09 0.02 0.00 -0.63 0.00 0.00 43.02 42.37 2pgz s PHE 204 CO 0.02 -0.68 0.36 -0.98 -0.05 0.00 0.00 175.22 173.89 2pgz s ARG 205 N -3.87 1.05 0.33 1.99 1.70 -0.71 0.03 118.95 119.47 2pgz s ARG 205 Ca 0.08 -0.81 -0.29 0.00 -0.47 0.00 0.00 55.73 54.23 2pgz s ARG 205 Cb 0.03 0.44 -0.11 0.00 -0.57 0.00 0.00 34.95 34.74 2pgz s ARG 205 CO -0.08 -0.40 1.55 -1.21 -1.08 0.00 0.00 175.30 174.08 2pgz s GLU 206 N -3.83 4.12 0.00 3.89 2.02 0.62 -0.84 118.70 124.67 2pgz s GLU 206 Ca 0.05 2.58 0.28 0.00 0.02 0.00 0.00 54.97 57.89 2pgz s GLU 206 Cb 0.02 -3.00 0.99 0.00 0.10 0.00 0.00 34.13 32.24 2pgz s GLU 206 CO -0.10 -0.59 1.71 -2.13 0.02 0.00 0.00 175.26 174.17