#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgz h ASP -4 N 0.00 0.00 -0.33 -2.24 3.32 -2.05 -1.81 116.42 113.30 2pgz h ASP -4 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pgz h ASP -4 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2pgz h ASP -4 CO 0.00 0.56 0.20 -0.78 -1.72 0.00 0.00 179.24 177.50 2pgz h ASP -3 N 0.00 0.40 -0.76 6.45 3.58 -2.05 -1.35 116.42 122.68 2pgz h ASP -3 Ca -0.01 -0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.41 2pgz h ASP -3 Cb 1.03 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.94 2pgz h ASP -3 CO 0.07 0.32 0.50 0.44 -2.88 0.00 0.00 179.24 177.69 2pgz h ASP -2 N 0.43 0.85 -0.39 2.28 3.32 -1.94 -1.30 116.42 119.69 2pgz h ASP -2 Ca 0.12 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 2pgz h ASP -2 Cb -0.00 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 2pgz h ASP -2 CO -0.02 0.61 -0.06 0.11 -1.72 0.00 0.00 179.24 178.16 2pgz h LYS -1 N 1.01 0.81 -0.61 3.56 1.57 -1.14 -0.95 116.57 120.83 2pgz h LYS -1 Ca 0.28 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 2pgz h LYS -1 Cb -0.09 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2pgz h LYS -1 CO -0.07 0.85 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.58 2pgz h LEU 0 N 0.75 1.06 -0.80 2.94 3.38 -0.95 -2.42 115.31 119.26 2pgz h LEU 0 Ca 0.13 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 2pgz h LEU 0 Cb 0.53 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2pgz h LEU 0 CO 0.03 1.12 0.31 0.45 0.09 0.00 0.00 178.44 180.44 2pgz h HIS 1 N 0.98 1.22 -0.67 1.13 3.86 -0.98 -1.65 115.15 119.04 2pgz h HIS 1 Ca 0.17 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 2pgz h HIS 1 Cb 0.58 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 2pgz h HIS 1 CO 0.04 0.92 0.30 0.66 0.86 0.00 0.00 177.93 180.72 2pgz h SER 2 N 1.17 0.90 -0.23 2.45 4.64 -1.02 0.11 113.55 121.56 2pgz h SER 2 Ca 0.27 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.42 2pgz h SER 2 Cb 0.22 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 2pgz h SER 2 CO -0.02 0.80 0.08 1.56 -0.87 0.00 0.00 176.83 178.37 2pgz h GLN 3 N 0.94 0.36 -0.57 4.77 4.20 -1.29 -1.42 115.11 122.10 2pgz h GLN 3 Ca 0.23 -0.07 0.05 0.00 0.06 0.00 0.00 58.65 58.92 2pgz h GLN 3 Cb 0.15 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 2pgz h GLN 3 CO -0.02 0.43 0.29 0.00 -0.67 0.00 0.00 178.83 178.86 2pgz h ALA 4 N 0.91 0.74 -0.78 3.87 0.00 -1.08 -0.16 119.26 122.76 2pgz h ALA 4 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2pgz h ALA 4 Cb 0.22 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2pgz h ALA 4 CO -0.00 -0.05 0.30 -0.91 0.00 0.00 0.00 179.25 178.59 2pgz h ASN 5 N 0.56 1.08 -0.18 0.00 2.35 -0.61 -0.95 115.58 117.84 2pgz h ASN 5 Ca 0.25 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 2pgz h ASN 5 Cb 0.16 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 2pgz h ASN 5 CO -0.17 0.96 -0.25 0.25 -1.65 0.00 0.00 177.43 176.56 2pgz h LEU 6 N 1.14 0.53 -1.13 1.61 5.85 -0.79 -0.46 115.31 122.06 2pgz h LEU 6 Ca 0.26 -0.52 0.03 0.00 0.84 0.00 0.00 57.88 58.49 2pgz h LEU 6 Cb 0.23 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 2pgz h LEU 6 CO -0.02 0.94 0.59 0.24 -0.34 0.00 0.00 178.44 179.85 2pgz h MET 7 N 0.13 1.10 -0.25 1.25 2.86 -0.93 -0.84 114.93 118.24 2pgz h MET 7 Ca 0.02 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 2pgz h MET 7 Cb 0.83 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 2pgz h MET 7 CO 0.06 0.73 -0.27 -0.09 1.06 0.00 0.00 176.91 178.39 2pgz h ARG 8 N 1.13 0.63 -0.28 1.72 2.43 -1.04 -1.56 114.38 117.42 2pgz h ARG 8 Ca 0.36 -0.34 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2pgz h ARG 8 Cb 0.01 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 2pgz h ARG 8 CO -0.11 0.95 0.10 1.25 -1.51 0.00 0.00 179.97 180.65 2pgz h LEU 9 N 0.35 0.11 -0.73 3.80 5.85 -0.73 -0.24 115.31 123.71 2pgz h LEU 9 Ca 0.04 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 2pgz h LEU 9 Cb 0.84 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 2pgz h LEU 9 CO 0.07 0.10 0.11 0.11 -0.34 0.00 0.00 178.44 178.49 2pgz h LYS 10 N 0.22 1.08 -0.63 1.25 1.57 -1.14 -0.79 116.57 118.13 2pgz h LYS 10 Ca 0.12 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2pgz h LYS 10 Cb 0.09 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2pgz h LYS 10 CO -0.13 0.98 0.30 1.03 -0.57 0.00 0.00 179.45 181.07 2pgz h SER 11 N 1.01 0.83 -0.50 0.86 0.87 -1.08 0.11 113.55 115.65 2pgz h SER 11 Ca 0.20 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 2pgz h SER 11 Cb 0.42 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2pgz h SER 11 CO 0.01 0.73 0.19 0.44 -0.53 0.00 0.00 176.83 177.67 2pgz h ASP 12 N 0.87 0.70 -0.05 6.23 3.45 -0.71 0.25 116.42 127.15 2pgz h ASP 12 Ca 0.22 -0.18 -0.21 0.00 0.43 0.00 0.00 57.03 57.28 2pgz h ASP 12 Cb 0.12 -0.18 0.01 0.00 -0.56 0.00 0.00 39.33 38.72 2pgz h ASP 12 CO -0.03 0.69 -0.77 -0.07 -1.57 0.00 0.00 179.24 177.49 2pgz h LEU 13 N 0.66 0.83 0.00 1.55 3.38 -1.05 -3.13 115.31 117.56 2pgz h LEU 13 Ca 0.16 -0.55 -0.37 0.00 0.09 0.00 0.00 57.88 57.22 2pgz h LEU 13 Cb 0.22 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 2pgz h LEU 13 CO -0.01 1.33 -2.40 0.49 0.09 0.00 0.00 178.44 177.95 2pgz n PHE 14 N -3.91 0.00 -0.08 1.13 0.99 0.02 -4.33 117.46 111.27 2pgz n PHE 14 Ca -0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.31 2pgz n PHE 14 Cb 0.74 -0.95 -0.16 0.00 -1.00 0.00 0.00 39.48 38.11 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 -3.18 0.08 -0.35 4.37 3.02 0.79 -4.47 115.26 115.51 2pgz n ASN 15 Ca -0.43 0.03 0.04 0.00 -0.03 0.00 0.00 54.58 54.20 2pgz n ASN 15 Cb 0.98 1.03 0.06 0.00 -0.61 0.00 0.00 39.78 41.24 2pgz n ASN 15 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2pgz n ARG 16 N -2.71 1.06 0.00 3.52 1.85 -0.68 -5.02 116.66 114.67 2pgz n ARG 16 Ca -0.28 -1.27 0.00 0.00 -1.00 0.00 0.00 57.85 55.30 2pgz n ARG 16 Cb 1.07 -1.16 0.00 0.00 -1.05 0.00 0.00 32.46 31.33 2pgz n ARG 16 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2pgz n SER 17 N 0.34 0.00 0.00 2.89 7.64 -1.18 -5.02 113.62 118.28 2pgz n SER 17 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 2pgz n SER 17 Cb 0.25 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 2pgz n SER 17 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2pgz n TYR 20 N 0.00 0.00 -0.58 1.43 4.19 -1.26 -5.08 117.16 115.86 2pgz n TYR 20 Ca 0.00 0.00 0.06 0.00 3.31 0.00 0.00 57.90 61.27 2pgz n TYR 20 Cb 0.00 0.00 0.34 0.00 0.49 0.00 0.00 39.34 40.17 2pgz n TYR 20 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2pgz n PRO 21 N 0.00 4.26 0.00 2.98 -0.04 -1.26 -4.94 135.00 136.00 2pgz n PRO 21 Ca 0.00 -2.63 0.00 0.00 -0.04 0.00 0.00 63.50 60.83 2pgz n PRO 21 Cb 0.00 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 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 0.52 -0.62 3.79 0.55 0.00 -1.26 -4.99 105.19 103.18 2pgz n GLY 22 Ca 0.23 -1.70 -0.32 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.96 2.91 0.26 1.61 0.04 -1.26 -5.04 135.00 131.56 2pgz s PRO 23 Ca 0.00 1.17 0.03 0.00 0.04 0.00 0.00 61.00 62.23 2pgz s PRO 23 Cb 0.00 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 2pgz s PRO 23 CO 0.00 -1.13 0.21 0.95 0.04 0.00 0.00 177.00 177.07 2pgz s THR 24 N -2.68 0.00 0.39 1.26 -4.23 -0.92 -4.97 115.64 104.49 2pgz s THR 24 Ca 0.62 -1.98 0.06 0.00 -1.18 0.00 0.00 61.69 59.21 2pgz s THR 24 Cb -0.17 -2.50 0.23 0.00 1.34 0.00 0.00 72.50 71.40 2pgz s THR 24 CO 0.46 0.00 1.99 0.11 -0.54 0.00 0.00 174.62 176.65 2pgz h LYS 25 N 2.38 0.51 0.00 3.99 1.57 -1.92 -0.65 116.57 122.46 2pgz h LYS 25 Ca -0.31 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.32 2pgz h LYS 25 Cb 1.24 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2pgz h LYS 25 CO 0.45 0.42 -0.44 -0.44 -0.57 0.00 0.00 179.45 178.86 2pgz h ASP 26 N 0.52 0.00 -2.03 0.86 3.32 -1.97 -3.38 116.42 113.74 2pgz h ASP 26 Ca 0.13 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.64 2pgz h ASP 26 Cb 0.08 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.24 2pgz h ASP 26 CO -0.02 0.44 -1.06 -0.67 -1.72 0.00 0.00 179.24 176.22 2pgz n ASP 27 N -3.33 0.93 -4.82 6.45 2.03 -0.85 -5.12 116.55 111.84 2pgz n ASP 27 Ca 0.01 -2.90 -0.31 0.00 0.52 0.00 0.00 54.79 52.11 2pgz n ASP 27 Cb 0.64 -0.63 0.05 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 -1.77 2.87 -0.01 -0.67 0.04 -0.31 -2.17 135.00 132.97 2pgz s PRO 28 Ca 0.38 0.94 0.06 0.00 0.04 0.00 0.00 61.00 62.41 2pgz s PRO 28 Cb 0.22 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 2pgz s PRO 28 CO -0.09 -1.14 -0.19 -1.17 0.04 0.00 0.00 177.00 174.45 2pgz s LEU 29 N -5.57 2.04 -0.25 -3.56 2.96 0.15 -4.92 118.68 109.53 2pgz s LEU 29 Ca 0.58 -0.34 -0.08 0.00 -0.22 0.00 0.00 54.13 54.07 2pgz s LEU 29 Cb -0.14 -0.96 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 2pgz s LEU 29 CO 0.55 0.23 0.10 -0.89 -1.32 0.00 0.00 176.35 175.01 2pgz s THR 30 N -0.44 4.61 -0.21 3.68 2.01 -1.26 -0.97 115.64 123.06 2pgz s THR 30 Ca 0.07 -0.07 -0.07 0.00 0.31 0.00 0.00 61.69 61.93 2pgz s THR 30 Cb -0.07 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2pgz s THR 30 CO -0.01 0.34 0.06 -0.69 -0.69 0.00 0.00 174.62 173.63 2pgz s VAL 31 N 1.45 4.53 -0.11 3.82 1.01 0.05 -4.58 120.40 126.56 2pgz s VAL 31 Ca 0.06 -0.12 -0.19 0.00 0.00 0.00 0.00 61.98 61.74 2pgz s VAL 31 Cb -0.15 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2pgz s VAL 31 CO 0.05 0.41 0.49 -0.89 0.00 0.00 0.00 175.10 175.17 2pgz s THR 32 N 0.86 5.17 0.07 3.92 2.01 0.00 -1.43 115.64 126.25 2pgz s THR 32 Ca 0.03 0.99 0.09 0.00 0.31 0.00 0.00 61.69 63.12 2pgz s THR 32 Cb -0.14 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 2pgz s THR 32 CO 0.02 0.32 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.27 2pgz s LEU 33 N 0.61 2.22 -0.17 4.42 1.43 0.31 -1.63 118.68 125.88 2pgz s LEU 33 Ca 0.27 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 2pgz s LEU 33 Cb -0.15 -1.15 0.05 0.00 0.03 0.00 0.00 46.19 44.96 2pgz s LEU 33 CO 0.11 0.19 0.43 -0.83 0.23 0.00 0.00 176.35 176.48 2pgz s GLY 34 N -1.52 -0.33 -0.08 -3.19 0.00 -0.71 -4.39 107.32 97.10 2pgz s GLY 34 Ca 0.11 1.32 -0.02 0.00 0.00 0.00 0.00 44.72 46.13 2pgz s GLY 34 CO 0.03 1.25 0.02 -1.36 0.00 0.00 0.00 173.10 173.04 2pgz s PHE 35 N 0.59 3.20 -0.30 1.90 0.08 -1.26 -0.39 117.98 121.79 2pgz s PHE 35 Ca -0.03 0.22 0.01 0.00 0.12 0.00 0.00 56.93 57.25 2pgz s PHE 35 Cb -0.05 -1.80 0.07 0.00 -0.57 0.00 0.00 43.02 40.67 2pgz s PHE 35 CO -0.04 0.49 -0.02 0.99 -0.10 0.00 0.00 175.22 176.55 2pgz s THR 36 N -0.91 2.57 -0.24 0.64 2.01 -0.42 -1.41 115.64 117.88 2pgz s THR 36 Ca 0.14 -1.68 -0.23 0.00 0.31 0.00 0.00 61.69 60.23 2pgz s THR 36 Cb -0.11 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.81 2pgz s THR 36 CO 0.03 -0.19 0.75 -0.22 -0.69 0.00 0.00 174.62 174.30 2pgz s LEU 37 N 1.13 4.08 -0.17 4.42 2.96 -0.46 -1.13 118.68 129.52 2pgz s LEU 37 Ca -0.03 0.92 0.03 0.00 -0.22 0.00 0.00 54.13 54.82 2pgz s LEU 37 Cb -0.20 -3.05 -0.22 0.00 0.50 0.00 0.00 46.19 43.21 2pgz s LEU 37 CO -0.04 -0.44 0.16 0.00 -1.32 0.00 0.00 176.35 174.71 2pgz n GLN 38 N 5.79 0.69 -3.63 1.98 6.02 0.20 -3.56 117.38 124.88 2pgz n GLN 38 Ca 0.03 0.19 -0.12 0.00 -0.01 0.00 0.00 57.00 57.09 2pgz n GLN 38 Cb 0.48 -1.63 -0.07 0.00 1.02 0.00 0.00 30.24 30.04 2pgz n GLN 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2pgz s ASP 39 N -6.51 -0.59 -0.44 1.08 2.15 -0.84 0.02 116.67 111.54 2pgz s ASP 39 Ca -0.22 1.11 -0.18 0.00 0.43 0.00 0.00 52.55 53.69 2pgz s ASP 39 Cb 0.08 1.12 0.03 0.00 -0.30 0.00 0.00 42.92 43.84 2pgz s ASP 39 CO 0.73 -0.21 0.51 -0.63 -0.17 0.00 0.00 175.17 175.39 2pgz s ILE 40 N 0.22 5.01 -0.07 4.11 1.01 -1.26 -0.91 121.20 129.30 2pgz s ILE 40 Ca 0.01 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.13 2pgz s ILE 40 Cb -0.05 -4.12 -0.30 0.00 0.01 0.00 0.00 42.46 38.00 2pgz s ILE 40 CO -0.02 -0.53 0.79 0.58 0.00 0.00 0.00 174.94 175.76 2pgz h VAL 41 N 5.78 1.42 -2.94 2.92 2.07 -1.36 -3.41 116.25 120.73 2pgz h VAL 41 Ca -0.26 -2.48 -0.15 0.00 0.82 0.00 0.00 66.70 64.63 2pgz h VAL 41 Cb 1.10 3.09 -0.25 0.00 -1.52 0.00 0.00 31.29 33.71 2pgz h VAL 41 CO 0.85 0.69 -0.34 -0.75 0.02 0.00 0.00 177.57 178.04 2pgz s LYS 42 N -2.42 0.37 -0.18 1.57 2.20 -1.22 -4.89 119.74 115.18 2pgz s LYS 42 Ca -0.16 0.47 0.00 0.00 -0.36 0.00 0.00 55.97 55.92 2pgz s LYS 42 Cb 0.01 0.16 0.04 0.00 -1.51 0.00 0.00 37.83 36.53 2pgz s LYS 42 CO 0.80 -0.06 -0.08 0.00 -0.36 0.00 0.00 175.35 175.65 2pgz s ALA 43 N 0.28 1.74 -0.47 3.13 0.00 -1.26 -0.73 121.76 124.45 2pgz s ALA 43 Ca -0.01 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 2pgz s ALA 43 Cb -0.03 -1.18 0.11 0.00 0.00 0.00 0.00 23.12 22.02 2pgz s ALA 43 CO -0.01 -0.75 0.36 0.34 0.00 0.00 0.00 175.76 175.70 2pgz s ASP 44 N 1.52 5.81 0.00 0.00 3.68 0.31 -4.94 116.67 123.05 2pgz s ASP 44 Ca 0.00 -1.74 0.26 0.00 2.13 0.00 0.00 52.55 53.20 2pgz s ASP 44 Cb -0.15 -2.06 1.26 0.00 -1.45 0.00 0.00 42.92 40.52 2pgz s ASP 44 CO -0.08 -0.68 1.88 -1.54 0.13 0.00 0.00 175.17 174.87 2pgz n SER 45 N 5.00 0.00 0.12 -0.34 3.41 -1.26 -0.56 113.62 119.99 2pgz n SER 45 Ca -0.10 0.12 -0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2pgz n SER 45 Cb 0.41 -0.36 0.01 0.00 -0.26 0.00 0.00 64.21 64.01 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 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2pgz h SER 46 CO 0.00 0.64 0.00 0.35 -0.87 0.00 0.00 176.83 176.95 2pgz n THR 47 N -3.29 0.00 -3.64 2.95 -2.24 -1.15 -5.03 114.28 101.88 2pgz n THR 47 Ca 0.01 -0.38 -0.26 0.00 -2.27 0.00 0.00 64.05 61.15 2pgz n THR 47 Cb 0.78 1.12 0.04 0.00 -2.10 0.00 0.00 70.33 70.17 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 -0.36 -4.24 -4.16 3.42 3.02 0.28 -4.93 115.26 108.28 2pgz n ASN 48 Ca 0.00 -0.93 -0.26 0.00 -0.03 0.00 0.00 54.58 53.36 2pgz n ASN 48 Cb 0.03 -3.77 -0.16 0.00 -0.61 0.00 0.00 39.78 35.28 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 -5.79 1.60 0.05 3.52 2.02 -1.09 -1.57 118.70 117.44 2pgz s GLU 49 Ca 0.34 -0.63 0.08 0.00 0.02 0.00 0.00 54.97 54.77 2pgz s GLU 49 Cb -0.10 -1.48 -0.03 0.00 0.10 0.00 0.00 34.13 32.62 2pgz s GLU 49 CO 0.84 0.33 -0.21 0.08 0.02 0.00 0.00 175.26 176.32 2pgz s VAL 50 N -0.25 1.72 -0.17 2.63 1.01 -0.68 -0.53 120.40 124.12 2pgz s VAL 50 Ca 0.03 -1.28 -0.02 0.00 0.00 0.00 0.00 61.98 60.71 2pgz s VAL 50 Cb -0.09 -1.51 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 2pgz s VAL 50 CO 0.00 0.17 -0.10 -1.81 0.00 0.00 0.00 175.10 173.37 2pgz s ASP 51 N -1.31 4.05 0.14 3.32 1.11 0.09 -1.50 116.67 122.57 2pgz s ASP 51 Ca 0.08 -0.39 0.08 0.00 0.18 0.00 0.00 52.55 52.50 2pgz s ASP 51 Cb -0.09 -1.65 -0.04 0.00 1.07 0.00 0.00 42.92 42.20 2pgz s ASP 51 CO 0.02 0.07 -0.10 -0.76 1.18 0.00 0.00 175.17 175.58 2pgz s LEU 52 N 0.94 2.99 -0.10 1.23 1.43 0.09 -0.86 118.68 124.40 2pgz s LEU 52 Ca -0.02 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 2pgz s LEU 52 Cb -0.15 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.35 2pgz s LEU 52 CO -0.00 0.14 -0.17 -0.69 0.23 0.00 0.00 176.35 175.86 2pgz s VAL 53 N -1.43 1.58 0.16 -1.59 1.01 -0.09 -0.84 120.40 119.19 2pgz s VAL 53 Ca 0.23 -0.71 -0.14 0.00 0.00 0.00 0.00 61.98 61.35 2pgz s VAL 53 Cb -0.10 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.88 2pgz s VAL 53 CO 0.14 0.46 0.40 -0.72 0.00 0.00 0.00 175.10 175.38 2pgz s TYR 54 N 0.79 -0.01 -0.17 5.22 -0.85 -0.83 -0.63 117.35 120.87 2pgz s TYR 54 Ca -0.10 -0.34 -0.06 0.00 -0.52 0.00 0.00 57.07 56.05 2pgz s TYR 54 Cb -0.16 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.36 2pgz s TYR 54 CO 0.01 -0.77 0.03 0.71 -1.52 0.00 0.00 175.55 174.01 2pgz s TYR 55 N -3.87 3.19 -0.40 -3.49 4.12 -0.28 -1.02 117.35 115.61 2pgz s TYR 55 Ca 0.09 -0.01 -0.07 0.00 0.02 0.00 0.00 57.07 57.09 2pgz s TYR 55 Cb 0.01 -2.03 0.08 0.00 -1.52 0.00 0.00 41.96 38.50 2pgz s TYR 55 CO -0.06 0.14 0.21 -2.00 0.02 0.00 0.00 175.55 173.86 2pgz s GLU 56 N 0.26 2.50 -0.11 -0.62 2.12 -0.34 -1.30 118.70 121.22 2pgz s GLU 56 Ca 0.02 -1.47 -0.30 0.00 0.36 0.00 0.00 54.97 53.59 2pgz s GLU 56 Cb -0.13 -3.67 -0.01 0.00 0.26 0.00 0.00 34.13 30.58 2pgz s GLU 56 CO 0.01 -0.91 1.03 -1.14 -0.54 0.00 0.00 175.26 173.71 2pgz s GLN 57 N 1.37 4.40 -0.07 4.30 0.74 0.47 -3.15 119.66 127.72 2pgz s GLN 57 Ca 0.03 1.42 0.05 0.00 0.05 0.00 0.00 55.36 56.91 2pgz s GLN 57 Cb -0.22 -3.55 -0.01 0.00 1.10 0.00 0.00 33.01 30.33 2pgz s GLN 57 CO 0.01 -0.36 -0.24 -0.65 -0.55 0.00 0.00 175.29 173.51 2pgz s GLN 58 N 2.14 2.62 -0.03 1.67 -0.21 0.32 -1.74 119.66 124.43 2pgz s GLN 58 Ca 0.49 -0.86 0.01 0.00 0.02 0.00 0.00 55.36 55.02 2pgz s GLN 58 Cb -0.19 -2.13 0.01 0.00 1.00 0.00 0.00 33.01 31.70 2pgz s GLN 58 CO 0.17 0.30 -0.04 0.50 -2.12 0.00 0.00 175.29 174.10 2pgz s ARG 59 N 0.03 0.62 0.34 2.91 6.06 -0.65 -0.91 118.95 127.36 2pgz s ARG 59 Ca -0.09 -0.12 -0.07 0.00 -2.50 0.00 0.00 55.73 52.95 2pgz s ARG 59 Cb -0.15 -0.65 0.01 0.00 0.06 0.00 0.00 34.95 34.23 2pgz s ARG 59 CO 0.05 -0.01 0.55 1.67 -2.50 0.00 0.00 175.30 175.06 2pgz s TRP 60 N 0.53 0.73 -0.07 5.12 -2.14 -0.98 -0.82 118.94 121.31 2pgz s TRP 60 Ca -0.07 -1.08 -0.04 0.00 2.66 0.00 0.00 56.10 57.57 2pgz s TRP 60 Cb -0.10 0.17 0.03 0.00 -3.10 0.00 0.00 33.47 30.48 2pgz s TRP 60 CO -0.00 -1.21 0.17 0.21 -2.66 0.00 0.00 176.95 173.45 2pgz s LYS 61 N -3.06 0.13 -0.04 3.25 2.20 -1.26 -0.45 119.74 120.52 2pgz s LYS 61 Ca 0.26 0.36 0.06 0.00 -0.36 0.00 0.00 55.97 56.28 2pgz s LYS 61 Cb -0.02 -0.10 -0.01 0.00 -1.51 0.00 0.00 37.83 36.19 2pgz s LYS 61 CO 0.16 -0.13 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.30 2pgz s LEU 62 N 0.91 2.01 0.39 5.43 1.43 -0.16 -4.95 118.68 123.74 2pgz s LEU 62 Ca -0.07 -0.42 0.06 0.00 -1.03 0.00 0.00 54.13 52.67 2pgz s LEU 62 Cb -0.09 -1.15 0.80 0.00 0.03 0.00 0.00 46.19 45.79 2pgz s LEU 62 CO -0.05 0.22 2.04 0.78 0.23 0.00 0.00 176.35 179.58 2pgz h ASN 63 N 5.98 0.54 0.50 2.29 -0.26 -1.89 -2.52 115.58 120.22 2pgz h ASN 63 Ca -0.35 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.38 2pgz h ASN 63 Cb 1.16 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 2pgz h ASN 63 CO 0.47 0.39 0.00 -1.54 -1.06 0.00 0.00 177.43 175.69 2pgz n SER 64 N -4.47 0.65 -1.33 5.81 3.41 -1.26 -2.15 113.62 114.28 2pgz n SER 64 Ca 0.04 0.70 0.09 0.00 -0.26 0.00 0.00 58.87 59.45 2pgz n SER 64 Cb 0.06 -0.83 0.31 0.00 -0.26 0.00 0.00 64.21 63.50 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 -2.27 4.27 -4.81 1.04 4.77 -0.95 -4.98 117.00 114.07 2pgz n LEU 65 Ca 0.01 -2.36 -0.37 0.00 -0.03 0.00 0.00 56.01 53.26 2pgz n LEU 65 Cb 0.17 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.69 2pgz n LEU 65 CO 0.17 0.82 0.40 -0.04 -1.33 0.00 0.00 177.39 177.40 2pgz s MET 66 N -1.68 4.26 0.09 3.23 -1.94 -0.92 -3.84 119.30 118.50 2pgz s MET 66 Ca 0.45 0.86 -0.05 0.00 -1.71 0.00 0.00 55.69 55.25 2pgz s MET 66 Cb 0.29 -2.95 -0.02 0.00 2.01 0.00 0.00 34.83 34.16 2pgz s MET 66 CO 0.23 0.44 0.10 1.67 -0.01 0.00 0.00 175.02 177.44 2pgz s TRP 67 N -1.45 0.42 -0.37 -0.03 -2.14 -0.57 -4.96 118.94 109.84 2pgz s TRP 67 Ca 0.41 -0.88 -0.21 0.00 2.66 0.00 0.00 56.10 58.07 2pgz s TRP 67 Cb -0.17 -0.24 0.01 0.00 -3.10 0.00 0.00 33.47 29.96 2pgz s TRP 67 CO 0.21 -0.50 0.69 0.34 -2.66 0.00 0.00 176.95 175.03 2pgz s ASP 68 N -2.92 6.45 0.55 -2.66 -1.08 -1.26 -4.67 116.67 111.08 2pgz s ASP 68 Ca 0.10 0.14 0.27 0.00 -0.52 0.00 0.00 52.55 52.55 2pgz s ASP 68 Cb 0.06 -2.35 1.45 0.00 -1.46 0.00 0.00 42.92 40.62 2pgz s ASP 68 CO -0.08 -0.67 1.97 -0.65 0.52 0.00 0.00 175.17 176.26 2pgz h PRO 69 N 8.54 0.00 0.00 4.34 0.11 -1.94 -1.03 132.00 142.02 2pgz h PRO 69 Ca -0.26 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 2pgz h PRO 69 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2pgz h PRO 69 CO 0.87 0.00 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.71 2pgz h ASN 70 N 0.00 0.00 0.36 -2.05 2.35 -1.92 0.22 115.58 114.53 2pgz h ASN 70 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2pgz h ASN 70 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.50 2pgz h ASN 70 CO -0.00 0.04 -0.21 -0.62 -1.65 0.00 0.00 177.43 174.99 2pgz n GLU 71 N -3.97 0.63 -2.64 0.81 1.02 -0.39 -4.26 120.64 111.84 2pgz n GLU 71 Ca -0.03 -0.30 -0.10 0.00 -0.02 0.00 0.00 57.16 56.71 2pgz n GLU 71 Cb 0.13 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.09 2pgz n GLU 71 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2pgz n TYR 72 N -0.92 1.62 -2.67 -0.32 4.01 -0.67 -4.99 117.16 113.22 2pgz n TYR 72 Ca 0.12 -2.64 -0.19 0.00 -0.16 0.00 0.00 57.90 55.03 2pgz n TYR 72 Cb 0.32 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 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 -0.30 -0.50 2.30 2.72 0.00 -1.18 -1.96 105.19 106.27 2pgz n GLY 73 Ca 0.15 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -2.10 -4.16 -4.69 1.61 3.02 0.68 -4.99 115.26 104.62 2pgz n ASN 74 Ca -0.16 0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 2pgz n ASN 74 Cb 0.63 -2.82 -0.03 0.00 -0.61 0.00 0.00 39.78 36.95 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 -2.45 3.07 -0.03 2.41 1.01 -0.83 -4.89 121.20 119.49 2pgz s ILE 75 Ca 0.00 0.56 0.12 0.00 0.00 0.00 0.00 60.65 61.33 2pgz s ILE 75 Cb 0.00 -3.36 -0.18 0.00 0.01 0.00 0.00 42.46 38.93 2pgz s ILE 75 CO 0.00 0.00 0.27 0.35 0.00 0.00 0.00 174.94 175.57 2pgz n THR 76 N 4.62 0.00 -3.59 2.92 -2.24 -1.26 -4.36 114.28 110.37 2pgz n THR 76 Ca 0.15 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 2pgz n THR 76 Cb 0.41 0.25 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 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 -3.34 -0.44 0.10 3.42 3.84 -1.26 -1.11 116.67 117.88 2pgz s ASP 77 Ca -0.04 -0.24 -0.14 0.00 -0.00 0.00 0.00 52.55 52.13 2pgz s ASP 77 Cb 0.08 0.64 0.02 0.00 -1.38 0.00 0.00 42.92 42.28 2pgz s ASP 77 CO 0.50 -1.10 0.34 0.72 -0.00 0.00 0.00 175.17 175.63 2pgz s PHE 78 N -3.82 -0.11 -0.04 2.11 -0.12 -0.17 -4.99 117.98 110.84 2pgz s PHE 78 Ca 0.05 -0.20 -0.04 0.00 -0.05 0.00 0.00 56.93 56.69 2pgz s PHE 78 Cb -0.03 0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.48 2pgz s PHE 78 CO -0.06 -0.63 0.16 1.03 -0.05 0.00 0.00 175.22 175.68 2pgz s ARG 79 N -3.58 3.42 -0.03 1.99 3.00 -1.26 -0.91 118.95 121.57 2pgz s ARG 79 Ca 0.02 -0.27 -0.23 0.00 0.00 0.00 0.00 55.73 55.25 2pgz s ARG 79 Cb 0.02 -3.11 0.05 0.00 0.00 0.00 0.00 34.95 31.91 2pgz s ARG 79 CO -0.10 0.71 0.49 -0.08 0.00 0.00 0.00 175.30 176.32 2pgz s THR 80 N -1.22 0.03 0.22 0.02 -1.32 -0.35 -4.99 115.64 108.03 2pgz s THR 80 Ca 0.23 -0.24 -0.31 0.00 -1.21 0.00 0.00 61.69 60.16 2pgz s THR 80 Cb -0.12 -0.81 -0.15 0.00 -1.51 0.00 0.00 72.50 69.91 2pgz s THR 80 CO 0.14 -0.13 1.19 -0.24 -2.21 0.00 0.00 174.62 173.36 2pgz n SER 81 N 1.09 1.71 0.32 8.08 2.88 -1.26 -0.81 113.62 125.63 2pgz n SER 81 Ca -0.20 1.15 0.21 0.00 -1.33 0.00 0.00 58.87 58.70 2pgz n SER 81 Cb 0.56 -1.29 1.10 0.00 -0.75 0.00 0.00 64.21 63.83 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 3.20 1.00 0.00 -1.46 0.00 -0.84 -1.26 119.26 119.89 2pgz h ALA 82 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2pgz h ALA 82 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2pgz h ALA 82 CO 0.69 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.94 2pgz h ALA 83 N 2.00 1.00 0.00 0.00 0.00 -1.89 -3.12 119.26 117.26 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 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2pgz h ALA 83 CO 0.00 0.00 -0.18 -0.44 0.00 0.00 0.00 179.25 178.63 2pgz h ASP 84 N 0.00 0.00 -4.00 0.00 3.32 -1.58 -3.47 116.42 110.70 2pgz h ASP 84 Ca 0.00 -0.05 -0.33 0.00 0.02 0.00 0.00 57.03 56.67 2pgz h ASP 84 Cb 0.39 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.80 2pgz h ASP 84 CO 0.00 0.02 -0.70 0.27 -1.72 0.00 0.00 179.24 177.12 2pgz s ILE 85 N -3.14 1.09 0.29 0.35 -4.36 -1.18 -4.98 121.20 109.27 2pgz s ILE 85 Ca 0.09 -2.05 -0.29 0.00 -0.26 0.00 0.00 60.65 58.14 2pgz s ILE 85 Cb 0.11 -1.99 -0.10 0.00 1.25 0.00 0.00 42.46 41.74 2pgz s ILE 85 CO 0.64 -0.63 1.35 0.86 0.24 0.00 0.00 174.94 177.41 2pgz s TRP 86 N -3.38 3.07 0.05 1.37 -0.00 -1.26 -4.96 118.94 113.83 2pgz s TRP 86 Ca 0.20 1.26 0.04 0.00 -0.00 0.00 0.00 56.10 57.60 2pgz s TRP 86 Cb 0.04 -3.71 -0.03 0.00 -0.00 0.00 0.00 33.47 29.77 2pgz s TRP 86 CO 0.03 -2.12 -0.12 0.95 -0.00 0.00 0.00 176.95 175.68 2pgz s THR 87 N -0.59 0.96 0.41 5.86 -4.23 -1.26 -5.11 115.64 111.68 2pgz s THR 87 Ca 0.53 -1.14 -0.25 0.00 -1.18 0.00 0.00 61.69 59.66 2pgz s THR 87 Cb -0.40 -0.93 -0.08 0.00 1.34 0.00 0.00 72.50 72.43 2pgz s THR 87 CO 0.48 -0.19 1.16 -2.16 -0.54 0.00 0.00 174.62 173.37 2pgz s PRO 88 N -1.49 4.01 -0.16 3.99 0.04 -1.26 -4.93 135.00 135.21 2pgz s PRO 88 Ca -0.03 1.79 -0.05 0.00 0.04 0.00 0.00 61.00 62.75 2pgz s PRO 88 Cb -0.09 -2.61 -0.16 0.00 0.04 0.00 0.00 34.50 31.67 2pgz s PRO 88 CO 0.02 -0.34 3.36 -0.40 0.04 0.00 0.00 177.00 179.67 2pgz n ASP 89 N -0.05 5.66 -4.70 6.66 5.75 -1.26 -4.95 116.55 123.65 2pgz n ASP 89 Ca 0.05 -2.71 -0.42 0.00 -0.01 0.00 0.00 54.79 51.70 2pgz n ASP 89 Cb 0.47 -1.36 -0.03 0.00 -1.03 0.00 0.00 41.12 39.17 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 -0.00 3.54 -0.00 2.12 -1.09 -1.26 -2.81 121.20 121.69 2pgz s ILE 90 Ca 0.64 1.05 0.00 0.00 -2.23 0.00 0.00 60.65 60.12 2pgz s ILE 90 Cb 0.34 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.55 2pgz s ILE 90 CO -0.07 0.05 -0.00 -0.89 -1.23 0.00 0.00 174.94 172.80 2pgz s THR 91 N 1.60 0.05 0.16 2.92 2.01 0.50 -4.89 115.64 118.00 2pgz s THR 91 Ca 0.64 0.01 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 2pgz s THR 91 Cb -0.34 -0.08 -0.08 0.00 0.01 0.00 0.00 72.50 72.01 2pgz s THR 91 CO 0.29 0.03 1.33 0.00 -0.69 0.00 0.00 174.62 175.58 2pgz s ALA 92 N 0.18 3.54 -0.92 7.40 0.00 -1.26 -1.36 121.76 129.34 2pgz s ALA 92 Ca -0.02 1.09 0.28 0.00 0.00 0.00 0.00 51.96 53.31 2pgz s ALA 92 Cb -0.03 -3.50 1.00 0.00 0.00 0.00 0.00 23.12 20.59 2pgz s ALA 92 CO -0.01 -0.56 1.79 0.66 0.00 0.00 0.00 175.76 177.65 2pgz n TYR 93 N 3.22 0.23 -2.47 0.00 4.01 0.80 -4.01 117.16 118.93 2pgz n TYR 93 Ca 0.08 0.07 0.01 0.00 -0.16 0.00 0.00 57.90 57.90 2pgz n TYR 93 Cb 0.43 -0.57 0.05 0.00 -0.31 0.00 0.00 39.34 38.94 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 -1.70 1.54 -4.76 7.72 3.41 -1.26 -5.02 113.62 113.55 2pgz n SER 94 Ca 0.06 -2.35 -0.33 0.00 -0.26 0.00 0.00 58.87 56.00 2pgz n SER 94 Cb 0.36 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 64.00 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 -2.82 4.73 0.00 4.04 1.04 -1.26 -1.79 113.70 117.64 2pgz s SER 95 Ca 0.33 2.02 0.03 0.00 0.48 0.00 0.00 55.95 58.81 2pgz s SER 95 Cb 0.37 -2.55 0.01 0.00 0.10 0.00 0.00 66.02 63.94 2pgz s SER 95 CO -0.10 -1.89 0.43 0.35 0.98 0.00 0.00 173.24 173.01 2pgz n THR 96 N -2.81 0.00 -3.82 2.02 -2.24 -0.06 -4.81 114.28 102.56 2pgz n THR 96 Ca 0.11 -0.48 -0.11 0.00 -2.27 0.00 0.00 64.05 61.29 2pgz n THR 96 Cb 0.52 1.04 -0.09 0.00 -2.10 0.00 0.00 70.33 69.70 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 -0.57 0.65 0.31 -0.78 1.81 -1.25 -5.05 118.95 114.06 2pgz s ARG 97 Ca 0.03 -0.45 -0.29 0.00 -1.72 0.00 0.00 55.73 53.29 2pgz s ARG 97 Cb 0.02 0.27 -0.12 0.00 -0.45 0.00 0.00 34.95 34.68 2pgz s ARG 97 CO 0.06 -0.18 1.46 -2.30 -0.68 0.00 0.00 175.30 173.66 2pgz n PRO 98 N 1.02 2.43 -1.68 3.54 -0.02 -1.26 -4.66 135.00 134.36 2pgz n PRO 98 Ca -0.21 0.86 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 2pgz n PRO 98 Cb 0.57 -2.56 -0.00 0.00 -0.02 0.00 0.00 33.50 31.50 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 1.29 2.16 -4.28 -1.45 0.31 -1.26 -4.87 118.33 110.22 2pgz n VAL 99 Ca 0.07 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.56 2pgz n VAL 99 Cb 0.36 -1.49 -0.12 0.00 -0.91 0.00 0.00 33.84 31.68 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 -1.94 3.67 -0.06 5.55 -0.21 -0.73 -4.98 119.66 120.96 2pgz s GLN 100 Ca 0.57 -0.51 -0.19 0.00 0.02 0.00 0.00 55.36 55.26 2pgz s GLN 100 Cb -0.56 -2.98 -0.05 0.00 1.00 0.00 0.00 33.01 30.42 2pgz s GLN 100 CO 0.61 0.18 0.52 0.08 -2.12 0.00 0.00 175.29 174.56 2pgz s VAL 101 N 0.55 5.06 -0.83 1.09 1.01 -1.26 -0.92 120.40 125.09 2pgz s VAL 101 Ca -0.02 1.07 0.11 0.00 0.00 0.00 0.00 61.98 63.14 2pgz s VAL 101 Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2pgz s VAL 101 CO 0.02 0.39 0.59 0.18 0.00 0.00 0.00 175.10 176.29 2pgz n LEU 102 N 3.09 1.00 -4.36 3.92 4.77 0.95 -4.96 117.00 121.40 2pgz n LEU 102 Ca -0.08 -0.67 -0.19 0.00 -0.03 0.00 0.00 56.01 55.05 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 0.21 -0.41 -0.94 -1.33 0.00 0.00 177.39 175.34 2pgz s SER 103 N -1.67 2.54 0.41 -1.43 1.04 -1.24 -4.91 113.70 108.44 2pgz s SER 103 Ca 0.07 -1.08 -0.27 0.00 0.48 0.00 0.00 55.95 55.16 2pgz s SER 103 Cb 0.09 -0.13 -0.09 0.00 0.10 0.00 0.00 66.02 65.98 2pgz s SER 103 CO 0.34 -0.25 1.41 -2.84 0.98 0.00 0.00 173.24 172.89 2pgz s PRO 104 N -3.69 3.92 -1.35 4.02 0.02 -1.26 -4.83 135.00 131.84 2pgz s PRO 104 Ca 0.24 2.41 -0.13 0.00 0.02 0.00 0.00 61.00 63.54 2pgz s PRO 104 Cb 0.01 -2.81 0.11 0.00 0.02 0.00 0.00 34.50 31.83 2pgz s PRO 104 CO 0.08 -0.62 1.95 1.04 -0.33 0.00 0.00 177.00 179.12 2pgz n GLN 105 N 0.15 3.24 -4.32 5.54 6.02 -1.26 -4.89 117.38 121.86 2pgz n GLN 105 Ca 0.03 -3.17 -0.19 0.00 -0.01 0.00 0.00 57.00 53.66 2pgz n GLN 105 Cb 0.41 -3.15 -0.15 0.00 1.02 0.00 0.00 30.24 28.37 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 2.09 0.67 0.31 5.09 1.01 -1.26 -0.12 121.20 128.99 2pgz s ILE 106 Ca 0.45 -0.31 0.10 0.00 0.00 0.00 0.00 60.65 60.88 2pgz s ILE 106 Cb 0.09 -0.59 -0.06 0.00 0.01 0.00 0.00 42.46 41.91 2pgz s ILE 106 CO -0.02 0.21 -0.13 0.00 0.00 0.00 0.00 174.94 175.00 2pgz s ALA 107 N 0.11 2.81 -0.17 9.38 0.00 0.01 -4.64 121.76 129.26 2pgz s ALA 107 Ca -0.01 -2.00 -0.02 0.00 0.00 0.00 0.00 51.96 49.93 2pgz s ALA 107 Cb -0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 2pgz s ALA 107 CO 0.00 0.13 -0.09 0.08 0.00 0.00 0.00 175.76 175.88 2pgz s VAL 108 N -2.62 3.21 -0.14 0.00 1.01 -0.43 -1.22 120.40 120.22 2pgz s VAL 108 Ca 0.31 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 2pgz s VAL 108 Cb 0.00 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2pgz s VAL 108 CO 0.15 0.49 -0.09 -0.69 0.00 0.00 0.00 175.10 174.96 2pgz s VAL 109 N 0.81 3.43 0.17 2.92 1.01 -0.09 -1.10 120.40 127.55 2pgz s VAL 109 Ca -0.03 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.48 2pgz s VAL 109 Cb -0.15 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 2pgz s VAL 109 CO 0.01 0.52 0.08 -0.89 0.00 0.00 0.00 175.10 174.81 2pgz s THR 110 N 0.28 4.12 0.63 3.92 2.01 0.30 -1.00 115.64 125.90 2pgz s THR 110 Ca -0.07 -1.26 0.43 0.00 0.31 0.00 0.00 61.69 61.10 2pgz s THR 110 Cb -0.15 -3.10 0.44 0.00 0.01 0.00 0.00 72.50 69.70 2pgz s THR 110 CO 0.04 -0.13 2.35 1.12 -0.69 0.00 0.00 174.62 177.32 2pgz h HIS 111 N 2.49 0.00 -0.06 4.92 2.07 -1.42 0.12 115.15 123.27 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 0.60 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.06 2pgz n ASP 112 N -3.12 0.57 0.00 3.10 5.75 -1.26 -1.51 116.55 120.08 2pgz n ASP 112 Ca -0.03 -1.54 0.00 0.00 -0.01 0.00 0.00 54.79 53.21 2pgz n ASP 112 Cb 0.09 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 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 0.89 0.75 3.79 6.12 0.00 0.41 -4.75 105.19 112.40 2pgz n GLY 113 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.76 7.18 -0.02 1.61 1.04 -1.21 -0.98 113.70 118.55 2pgz s SER 114 Ca 0.00 1.81 0.05 0.00 0.48 0.00 0.00 55.95 58.29 2pgz s SER 114 Cb 0.00 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.54 2pgz s SER 114 CO 0.00 -0.18 -0.17 -0.69 0.98 0.00 0.00 173.24 173.18 2pgz s VAL 115 N -1.78 1.38 -0.07 5.02 1.01 0.40 -0.54 120.40 125.81 2pgz s VAL 115 Ca 0.54 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.82 2pgz s VAL 115 Cb -0.16 -1.16 0.01 0.00 0.00 0.00 0.00 36.38 35.07 2pgz s VAL 115 CO 0.21 0.39 -0.15 -0.32 0.00 0.00 0.00 175.10 175.23 2pgz s MET 116 N -0.28 1.98 -0.03 2.72 0.00 -0.26 -2.32 119.30 121.11 2pgz s MET 116 Ca 0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 55.69 55.20 2pgz s MET 116 Cb -0.08 -1.59 0.03 0.00 0.00 0.00 0.00 34.83 33.19 2pgz s MET 116 CO 0.00 0.07 0.03 0.12 0.00 0.00 0.00 175.02 175.25 2pgz s PHE 117 N 0.55 0.11 -0.55 4.11 5.36 -0.08 -1.31 117.98 126.17 2pgz s PHE 117 Ca -0.15 0.14 0.06 0.00 -0.96 0.00 0.00 56.93 56.01 2pgz s PHE 117 Cb -0.16 -0.36 0.20 0.00 -0.34 0.00 0.00 43.02 42.36 2pgz s PHE 117 CO 0.05 -0.14 0.52 -0.89 -1.46 0.00 0.00 175.22 173.30 2pgz n ILE 118 N 4.55 0.58 -2.15 3.12 5.41 -1.26 -0.52 119.36 129.08 2pgz n ILE 118 Ca -0.19 -4.39 -0.42 0.00 1.00 0.00 0.00 62.75 58.74 2pgz n ILE 118 Cb 0.50 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.42 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 -1.24 4.30 0.03 0.38 0.04 -1.19 -4.73 135.00 132.59 2pgz s PRO 119 Ca 0.33 2.08 -0.22 0.00 0.04 0.00 0.00 61.00 63.23 2pgz s PRO 119 Cb 0.07 -3.34 -0.06 0.00 0.04 0.00 0.00 34.50 31.21 2pgz s PRO 119 CO -0.13 -0.50 0.65 0.00 0.04 0.00 0.00 177.00 177.07 2pgz s ALA 120 N 1.50 3.47 0.02 8.56 0.00 -1.26 -1.19 121.76 132.85 2pgz s ALA 120 Ca 0.65 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.75 2pgz s ALA 120 Cb -0.36 -2.81 -0.02 0.00 0.00 0.00 0.00 23.12 19.93 2pgz s ALA 120 CO 0.30 0.18 -0.04 -0.65 0.00 0.00 0.00 175.76 175.55 2pgz s GLN 121 N -0.37 0.34 -0.19 0.00 -0.21 -0.18 -0.03 119.66 119.02 2pgz s GLN 121 Ca 0.33 -0.48 -0.06 0.00 0.02 0.00 0.00 55.36 55.17 2pgz s GLN 121 Cb -0.19 -0.12 -0.03 0.00 1.00 0.00 0.00 33.01 33.67 2pgz s GLN 121 CO 0.20 0.02 0.02 0.50 -2.12 0.00 0.00 175.29 173.90 2pgz s ARG 122 N -1.02 3.75 -0.07 2.91 3.52 -0.10 -1.97 118.95 125.96 2pgz s ARG 122 Ca -0.08 -0.46 0.02 0.00 -0.13 0.00 0.00 55.73 55.08 2pgz s ARG 122 Cb -0.07 -3.12 0.01 0.00 -1.56 0.00 0.00 34.95 30.22 2pgz s ARG 122 CO -0.00 0.12 -0.13 -1.17 -0.81 0.00 0.00 175.30 173.31 2pgz s LEU 123 N 0.73 1.68 -0.21 -0.88 2.96 -0.02 -1.78 118.68 121.16 2pgz s LEU 123 Ca 0.01 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 2pgz s LEU 123 Cb -0.14 -0.90 -0.05 0.00 0.50 0.00 0.00 46.19 45.60 2pgz s LEU 123 CO 0.02 0.04 0.14 -0.44 -1.32 0.00 0.00 176.35 174.80 2pgz s SER 124 N 0.68 6.18 0.15 3.68 0.01 -1.26 -0.73 113.70 122.41 2pgz s SER 124 Ca -0.14 0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.30 2pgz s SER 124 Cb -0.16 -2.10 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 2pgz s SER 124 CO 0.04 0.13 0.08 0.72 0.41 0.00 0.00 173.24 174.62 2pgz s PHE 125 N 0.63 0.97 -0.18 2.43 -0.12 -0.56 -0.88 117.98 120.28 2pgz s PHE 125 Ca 0.08 -1.28 -0.29 0.00 -0.05 0.00 0.00 56.93 55.39 2pgz s PHE 125 Cb -0.12 -0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 41.72 2pgz s PHE 125 CO 0.01 -0.55 1.57 -1.64 -0.05 0.00 0.00 175.22 174.55 2pgz s MET 126 N -4.08 3.95 -0.30 1.99 -1.94 -0.74 -1.69 119.30 116.49 2pgz s MET 126 Ca 0.29 1.77 -0.12 0.00 -1.71 0.00 0.00 55.69 55.92 2pgz s MET 126 Cb 0.07 -3.98 0.13 0.00 2.01 0.00 0.00 34.83 33.06 2pgz s MET 126 CO 0.05 -1.10 0.71 0.00 -0.01 0.00 0.00 175.02 174.67 2pgz s ASP 128 N 2.60 6.37 -0.02 0.00 2.15 -1.26 -3.17 116.67 123.33 2pgz s ASP 128 Ca -0.06 -0.15 0.04 0.00 0.43 0.00 0.00 52.55 52.80 2pgz s ASP 128 Cb -0.10 -2.33 0.14 0.00 -0.30 0.00 0.00 42.92 40.34 2pgz s ASP 128 CO -0.19 -0.73 0.92 -0.81 -0.17 0.00 0.00 175.17 174.20 2pgz n PRO 129 N 6.24 1.55 -1.63 4.34 -0.04 -1.26 -4.68 135.00 139.51 2pgz n PRO 129 Ca -0.01 -0.57 -0.48 0.00 -0.04 0.00 0.00 63.50 62.40 2pgz n PRO 129 Cb 0.48 -1.38 -0.04 0.00 -0.04 0.00 0.00 33.50 32.51 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 0.02 0.36 -0.28 0.52 -1.04 -1.26 -1.03 114.28 111.57 2pgz n THR 130 Ca 0.05 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2pgz n THR 130 Cb 0.28 -1.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.59 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 2.65 0.84 0.25 3.41 0.00 -1.26 -4.40 105.19 106.67 2pgz n GLY 131 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.26 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 0.94 -0.61 1.61 3.04 -1.27 -1.85 116.25 118.11 2pgz h VAL 132 Ca 0.00 -0.30 -0.27 0.00 -1.01 0.00 0.00 66.70 65.12 2pgz h VAL 132 Cb 0.00 1.17 -0.16 0.00 -2.01 0.00 0.00 31.29 30.28 2pgz h VAL 132 CO 0.00 0.08 0.35 -0.90 -1.01 0.00 0.00 177.57 176.09 2pgz n ASP 133 N -4.27 3.66 -4.39 3.17 5.75 -1.26 -0.76 116.55 118.45 2pgz n ASP 133 Ca -0.03 -2.98 -0.19 0.00 -0.01 0.00 0.00 54.79 51.58 2pgz n ASP 133 Cb 0.16 -0.71 -0.10 0.00 -1.03 0.00 0.00 41.12 39.44 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 -0.54 2.21 0.34 -1.12 1.04 -0.70 -5.00 113.70 109.92 2pgz s SER 134 Ca 0.38 -1.25 0.02 0.00 0.48 0.00 0.00 55.95 55.57 2pgz s SER 134 Cb 0.31 -0.06 0.59 0.00 0.10 0.00 0.00 66.02 66.96 2pgz s SER 134 CO 0.08 -0.49 1.97 -0.08 0.98 0.00 0.00 173.24 175.70 2pgz h GLU 135 N 2.33 0.82 0.00 4.02 4.81 -1.90 -2.42 114.58 122.23 2pgz h GLU 135 Ca -0.39 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 2pgz h GLU 135 Cb 1.23 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.44 2pgz h GLU 135 CO 0.66 0.59 -0.06 0.93 -0.73 0.00 0.00 179.01 180.40 2pgz h GLU 136 N 0.84 0.00 0.00 1.92 3.07 -1.96 -3.49 114.58 114.95 2pgz h GLU 136 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 2pgz h GLU 136 Cb -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2pgz h GLU 136 CO -0.04 0.06 0.00 0.41 -1.40 0.00 0.00 179.01 178.04 2pgz n GLY 137 N 0.75 -1.60 3.74 -3.84 0.00 -0.91 -4.82 105.19 98.50 2pgz n GLY 137 Ca 0.03 -1.26 -0.25 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.38 3.40 -0.06 4.61 0.00 0.93 -4.33 121.76 124.95 2pgz s ALA 138 Ca 0.00 -1.36 0.03 0.00 0.00 0.00 0.00 51.96 50.64 2pgz s ALA 138 Cb 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.97 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 -1.88 1.27 0.09 0.00 2.01 -1.26 -1.21 115.64 114.66 2pgz s THR 139 Ca 0.30 -0.59 -0.00 0.00 0.31 0.00 0.00 61.69 61.71 2pgz s THR 139 Cb -0.09 -1.12 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 2pgz s THR 139 CO 0.22 0.38 -0.00 0.00 -0.69 0.00 0.00 174.62 174.52 2pgz s ALA 141 N -3.90 -0.42 -0.11 0.00 0.00 -1.26 -1.21 121.76 114.86 2pgz s ALA 141 Ca 0.15 -0.09 -0.08 0.00 0.00 0.00 0.00 51.96 51.95 2pgz s ALA 141 Cb 0.07 0.15 0.04 0.00 0.00 0.00 0.00 23.12 23.38 2pgz s ALA 141 CO -0.04 -0.26 0.28 0.54 0.00 0.00 0.00 175.76 176.28 2pgz s VAL 142 N -1.67 -0.02 0.02 0.00 0.11 -0.40 -4.91 120.40 113.53 2pgz s VAL 142 Ca -0.12 0.07 -0.14 0.00 -2.93 0.00 0.00 61.98 58.86 2pgz s VAL 142 Cb -0.06 -0.41 -0.06 0.00 -1.53 0.00 0.00 36.38 34.33 2pgz s VAL 142 CO 0.01 0.03 0.41 -0.54 -3.33 0.00 0.00 175.10 171.68 2pgz s LYS 143 N 0.77 3.89 -0.08 1.54 1.02 -1.26 -0.53 119.74 125.08 2pgz s LYS 143 Ca -0.05 0.37 0.04 0.00 0.02 0.00 0.00 55.97 56.35 2pgz s LYS 143 Cb -0.06 -3.18 -0.00 0.00 -0.52 0.00 0.00 37.83 34.07 2pgz s LYS 143 CO -0.05 0.67 -0.22 -0.06 -0.92 0.00 0.00 175.35 174.77 2pgz s PHE 144 N -1.14 2.33 0.12 3.18 0.08 -0.31 -0.14 117.98 122.10 2pgz s PHE 144 Ca 0.25 -0.88 -0.24 0.00 0.12 0.00 0.00 56.93 56.18 2pgz s PHE 144 Cb -0.16 -1.56 0.08 0.00 -0.57 0.00 0.00 43.02 40.81 2pgz s PHE 144 CO 0.14 -0.34 1.11 0.20 -0.10 0.00 0.00 175.22 176.23 2pgz s GLY 145 N 0.26 0.02 0.38 4.36 0.00 -0.47 -0.74 107.32 111.13 2pgz s GLY 145 Ca -0.14 -0.18 -0.27 0.00 0.00 0.00 0.00 44.72 44.13 2pgz s GLY 145 CO 0.07 3.14 1.31 -1.26 0.00 0.00 0.00 173.10 176.36 2pgz n SER 146 N -1.13 2.81 -0.00 1.64 2.88 -1.26 -0.37 113.62 118.19 2pgz n SER 146 Ca -0.01 1.17 -0.18 0.00 -1.33 0.00 0.00 58.87 58.52 2pgz n SER 146 Cb 0.59 -1.51 -0.10 0.00 -0.75 0.00 0.00 64.21 62.45 2pgz n SER 146 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 2pgz h TRP 147 N 2.41 0.81 0.00 0.66 2.91 -1.86 -3.41 115.95 117.47 2pgz h TRP 147 Ca -0.47 -0.40 0.00 0.00 1.13 0.00 0.00 58.89 59.14 2pgz h TRP 147 Cb 1.28 -0.11 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2pgz h TRP 147 CO 0.50 1.22 -0.24 1.33 -1.03 0.00 0.00 178.44 180.22 2pgz n VAL 148 N -4.10 0.00 -3.79 2.65 0.24 -1.26 -4.98 118.33 107.09 2pgz n VAL 148 Ca -0.09 -0.39 -0.35 0.00 -2.04 0.00 0.00 64.34 61.46 2pgz n VAL 148 Cb 0.71 0.97 -0.09 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 -1.41 3.31 0.98 6.34 2.02 -1.26 -5.09 117.35 122.23 2pgz s TYR 149 Ca 0.01 0.17 -0.16 0.00 -0.37 0.00 0.00 57.07 56.73 2pgz s TYR 149 Cb 0.03 -2.18 0.19 0.00 -0.40 0.00 0.00 41.96 39.60 2pgz s TYR 149 CO 0.16 0.13 1.25 -1.54 -1.57 0.00 0.00 175.55 173.98 2pgz s SER 150 N 0.69 2.94 0.19 2.29 1.04 -1.26 -4.63 113.70 114.95 2pgz s SER 150 Ca 0.06 0.45 0.16 0.00 0.48 0.00 0.00 55.95 57.10 2pgz s SER 150 Cb -0.13 -0.63 0.76 0.00 0.10 0.00 0.00 66.02 66.13 2pgz s SER 150 CO 0.01 -2.85 1.48 0.61 0.98 0.00 0.00 173.24 173.47 2pgz n GLY 151 N -3.10 -0.87 0.15 7.32 0.00 0.21 -1.06 105.19 107.84 2pgz n GLY 151 Ca 0.13 0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.91 -3.39 116.94 113.29 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 0.11 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.23 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 -2.57 0.24 -4.16 1.51 4.71 -0.23 -4.20 120.64 115.94 2pgz n GLU 153 Ca 0.05 0.07 -0.30 0.00 -0.01 0.00 0.00 57.16 56.97 2pgz n GLU 153 Cb 0.45 -1.10 -0.16 0.00 -1.01 0.00 0.00 31.44 29.61 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 1.63 0.18 -3.67 1.01 -0.25 -0.67 121.20 117.23 2pgz s ILE 154 Ca -0.14 -0.68 0.05 0.00 0.00 0.00 0.00 60.65 59.88 2pgz s ILE 154 Cb 0.04 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2pgz s ILE 154 CO 0.22 0.47 0.21 -0.62 0.00 0.00 0.00 174.94 175.21 2pgz s ASP 155 N 1.33 5.83 0.18 3.58 2.15 -0.14 -3.89 116.67 125.70 2pgz s ASP 155 Ca 0.02 -0.04 0.11 0.00 0.43 0.00 0.00 52.55 53.07 2pgz s ASP 155 Cb -0.13 -1.61 -0.04 0.00 -0.30 0.00 0.00 42.92 40.84 2pgz s ASP 155 CO -0.08 0.04 -0.25 -0.76 -0.17 0.00 0.00 175.17 173.95 2pgz s LEU 156 N -3.33 2.41 0.09 -1.34 1.43 -1.26 -0.77 118.68 115.91 2pgz s LEU 156 Ca 0.32 -0.84 -0.05 0.00 -1.03 0.00 0.00 54.13 52.53 2pgz s LEU 156 Cb -0.10 -1.17 -0.02 0.00 0.03 0.00 0.00 46.19 44.93 2pgz s LEU 156 CO 0.26 0.13 0.10 -1.59 0.23 0.00 0.00 176.35 175.48 2pgz s LYS 157 N -2.55 0.80 0.16 1.70 -2.85 -0.51 -4.90 119.74 111.60 2pgz s LYS 157 Ca 0.19 -1.13 0.11 0.00 -1.00 0.00 0.00 55.97 54.13 2pgz s LYS 157 Cb -0.08 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 35.93 2pgz s LYS 157 CO 0.09 -0.22 -0.24 0.95 0.10 0.00 0.00 175.35 176.03 2pgz s THR 158 N -3.92 2.18 -0.19 3.79 -4.23 -1.26 -0.53 115.64 111.48 2pgz s THR 158 Ca 0.09 -1.89 0.17 0.00 -1.18 0.00 0.00 61.69 58.88 2pgz s THR 158 Cb 0.06 -1.99 0.04 0.00 1.34 0.00 0.00 72.50 71.95 2pgz s THR 158 CO -0.08 -0.09 1.27 0.44 -0.54 0.00 0.00 174.62 175.62 2pgz h ASP 159 N 3.47 0.00 -5.04 3.99 3.32 -1.98 -3.47 116.42 116.71 2pgz h ASP 159 Ca -0.47 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.50 2pgz h ASP 159 Cb 1.20 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.58 2pgz h ASP 159 CO 0.45 0.42 -0.16 0.28 -1.72 0.00 0.00 179.24 178.51 2pgz s THR 160 N -3.02 0.07 -2.26 0.35 -1.32 -1.26 -5.03 115.64 103.17 2pgz s THR 160 Ca 0.02 -0.55 0.20 0.00 -1.21 0.00 0.00 61.69 60.15 2pgz s THR 160 Cb 0.08 -0.95 0.43 0.00 -1.51 0.00 0.00 72.50 70.55 2pgz s THR 160 CO 0.76 -0.30 1.45 0.47 -2.21 0.00 0.00 174.62 174.79 2pgz n ASP 161 N 0.52 2.31 -4.57 8.08 8.00 -1.26 -4.79 116.55 124.83 2pgz n ASP 161 Ca -0.18 -1.86 -0.40 0.00 0.71 0.00 0.00 54.79 53.06 2pgz n ASP 161 Cb 0.60 -0.19 -0.09 0.00 -0.02 0.00 0.00 41.12 41.41 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 -1.61 3.78 0.34 -1.24 -1.52 -1.26 -0.56 119.66 117.58 2pgz s GLN 162 Ca 0.33 -0.22 -0.29 0.00 -1.95 0.00 0.00 55.36 53.24 2pgz s GLN 162 Cb 0.18 -3.73 -0.11 0.00 -0.22 0.00 0.00 33.01 29.13 2pgz s GLN 162 CO 0.26 -0.40 1.48 0.08 -0.25 0.00 0.00 175.29 176.46 2pgz s VAL 163 N 2.04 2.19 -0.23 1.09 1.01 -0.76 -4.86 120.40 120.88 2pgz s VAL 163 Ca 0.13 0.18 -0.29 0.00 0.00 0.00 0.00 61.98 62.00 2pgz s VAL 163 Cb -0.16 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 2pgz s VAL 163 CO 0.11 0.04 1.40 -0.62 0.00 0.00 0.00 175.10 176.03 2pgz s ASP 164 N 0.00 6.66 0.00 3.32 -1.08 -0.50 -4.86 116.67 120.21 2pgz s ASP 164 Ca 0.55 1.50 0.12 0.00 -0.52 0.00 0.00 52.55 54.21 2pgz s ASP 164 Cb -0.46 -2.54 0.25 0.00 -1.46 0.00 0.00 42.92 38.72 2pgz s ASP 164 CO 0.57 -1.04 1.13 0.18 0.52 0.00 0.00 175.17 176.53 2pgz n LEU 165 N 7.57 2.65 0.12 -1.34 4.77 -1.26 -1.36 117.00 128.15 2pgz n LEU 165 Ca 0.16 -1.62 0.12 0.00 -0.03 0.00 0.00 56.01 54.63 2pgz n LEU 165 Cb 0.46 -0.16 0.48 0.00 -2.33 0.00 0.00 43.42 41.87 2pgz n LEU 165 CO 0.62 0.61 0.86 -1.54 -1.33 0.00 0.00 177.39 176.61 2pgz n SER 166 N 0.65 0.67 -0.74 -1.43 3.41 -1.26 -1.54 113.62 113.38 2pgz n SER 166 Ca 0.11 0.65 0.07 0.00 -0.26 0.00 0.00 58.87 59.44 2pgz n SER 166 Cb 0.39 -0.80 0.19 0.00 -0.26 0.00 0.00 64.21 63.73 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 -2.22 3.24 -4.72 4.04 7.64 -1.26 -5.03 113.62 115.31 2pgz n SER 167 Ca 0.02 -2.29 -0.42 0.00 1.01 0.00 0.00 58.87 57.19 2pgz n SER 167 Cb 0.25 -0.33 -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 -1.53 3.14 -0.12 1.43 5.04 -0.59 -4.63 117.35 120.09 2pgz s TYR 168 Ca 0.29 0.85 -0.31 0.00 -2.44 0.00 0.00 57.07 55.46 2pgz s TYR 168 Cb 0.19 -3.80 -0.09 0.00 0.35 0.00 0.00 41.96 38.61 2pgz s TYR 168 CO 0.14 -2.82 2.06 0.98 -1.34 0.00 0.00 175.55 174.58 2pgz n TYR 169 N 3.64 2.19 0.32 4.97 9.36 0.10 -4.87 117.16 132.88 2pgz n TYR 169 Ca 0.11 -0.14 0.16 0.00 3.32 0.00 0.00 57.90 61.35 2pgz n TYR 169 Cb 0.40 -2.72 0.65 0.00 -0.63 0.00 0.00 39.34 37.04 2pgz n TYR 169 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2pgz h ALA 170 N 12.03 1.00 -0.28 2.98 0.00 -1.90 -2.46 119.26 130.64 2pgz h ALA 170 Ca -0.44 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.36 2pgz h ALA 170 Cb 1.26 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2pgz h ALA 170 CO 0.96 0.00 -0.06 0.43 0.00 0.00 0.00 179.25 180.57 2pgz n SER 171 N -2.78 2.86 -4.70 0.00 7.64 -1.26 -5.04 113.62 110.34 2pgz n SER 171 Ca 0.01 -3.49 -0.36 0.00 1.01 0.00 0.00 58.87 56.04 2pgz n SER 171 Cb 0.26 -0.59 0.08 0.00 -1.01 0.00 0.00 64.21 62.96 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 -0.97 1.58 0.30 6.43 2.88 -0.93 -4.89 113.62 118.02 2pgz n SER 172 Ca 0.28 0.75 0.16 0.00 -1.33 0.00 0.00 58.87 58.72 2pgz n SER 172 Cb 0.95 -1.52 0.92 0.00 -0.75 0.00 0.00 64.21 63.81 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 0.09 0.00 -5.50 -1.46 1.79 -1.90 -3.42 116.57 106.17 2pgz h LYS 173 Ca -0.49 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.30 2pgz h LYS 173 Cb 1.33 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.66 2pgz h LYS 173 CO 0.50 0.02 -0.86 0.71 -1.08 0.00 0.00 179.45 178.74 2pgz s TYR 174 N -4.52 2.57 0.14 -1.35 2.02 -1.26 -1.51 117.35 113.44 2pgz s TYR 174 Ca -0.05 -0.91 -0.08 0.00 -0.37 0.00 0.00 57.07 55.67 2pgz s TYR 174 Cb 0.15 -1.70 -0.06 0.00 -0.40 0.00 0.00 41.96 39.94 2pgz s TYR 174 CO 0.54 -0.34 0.43 -1.83 -1.57 0.00 0.00 175.55 172.78 2pgz s GLU 175 N 0.21 3.72 -0.20 -0.62 -1.05 0.35 -4.80 118.70 116.31 2pgz s GLU 175 Ca -0.14 0.10 -0.18 0.00 -0.15 0.00 0.00 54.97 54.59 2pgz s GLU 175 Cb -0.17 -2.85 -0.03 0.00 -0.44 0.00 0.00 34.13 30.64 2pgz s GLU 175 CO 0.07 0.46 0.50 0.42 0.95 0.00 0.00 175.26 177.66 2pgz s ILE 176 N -1.61 5.12 -0.10 1.83 -1.09 -1.26 -1.71 121.20 122.38 2pgz s ILE 176 Ca 0.40 0.91 -0.10 0.00 -2.23 0.00 0.00 60.65 59.63 2pgz s ILE 176 Cb -0.13 -3.82 -0.28 0.00 -1.58 0.00 0.00 42.46 36.66 2pgz s ILE 176 CO 0.22 0.20 0.48 -0.07 -1.23 0.00 0.00 174.94 174.53 2pgz h LEU 177 N 7.84 0.47 -7.00 2.97 3.38 -0.71 -3.49 115.31 118.77 2pgz h LEU 177 Ca -0.34 -0.93 0.01 0.00 0.09 0.00 0.00 57.88 56.71 2pgz h LEU 177 Cb 1.16 -0.15 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 2pgz h LEU 177 CO 0.74 1.80 0.29 -0.94 0.09 0.00 0.00 178.44 180.42 2pgz s SER 178 N -7.13 -0.53 -0.19 -0.43 1.04 -1.02 -4.98 113.70 100.46 2pgz s SER 178 Ca -0.20 0.19 -0.06 0.00 0.48 0.00 0.00 55.95 56.36 2pgz s SER 178 Cb 0.06 0.52 0.09 0.00 0.10 0.00 0.00 66.02 66.79 2pgz s SER 178 CO 0.79 -0.77 0.37 0.00 0.98 0.00 0.00 173.24 174.61 2pgz s ALA 179 N -2.87 -1.00 0.19 5.32 0.00 -1.26 -0.56 121.76 121.59 2pgz s ALA 179 Ca -0.01 1.25 0.10 0.00 0.00 0.00 0.00 51.96 53.30 2pgz s ALA 179 Cb -0.01 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 2pgz s ALA 179 CO -0.06 -0.83 -0.20 0.95 0.00 0.00 0.00 175.76 175.62 2pgz s THR 180 N 2.55 2.05 -0.14 0.00 -4.23 -0.52 -1.82 115.64 113.52 2pgz s THR 180 Ca 0.02 -2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 58.46 2pgz s THR 180 Cb -0.13 -2.00 0.05 0.00 1.34 0.00 0.00 72.50 71.76 2pgz s THR 180 CO -0.12 -0.30 0.02 0.00 -0.54 0.00 0.00 174.62 173.68 2pgz s GLN 181 N -2.94 0.66 -0.10 3.99 -2.07 0.27 -1.37 119.66 118.10 2pgz s GLN 181 Ca 0.20 -0.20 0.01 0.00 -1.82 0.00 0.00 55.36 53.54 2pgz s GLN 181 Cb -0.06 -1.65 0.02 0.00 -1.09 0.00 0.00 33.01 30.24 2pgz s GLN 181 CO 0.09 -0.50 -0.11 0.99 -1.32 0.00 0.00 175.29 174.44 2pgz s THR 182 N 1.90 1.22 0.29 3.63 2.01 -0.56 -4.23 115.64 119.89 2pgz s THR 182 Ca 0.02 -0.45 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 2pgz s THR 182 Cb -0.15 -1.16 -0.11 0.00 0.01 0.00 0.00 72.50 71.09 2pgz s THR 182 CO -0.07 0.39 1.55 -0.60 -0.69 0.00 0.00 174.62 175.20 2pgz s ARG 183 N 1.28 4.16 0.04 4.92 3.52 -1.26 -0.44 118.95 131.17 2pgz s ARG 183 Ca -0.02 2.50 0.04 0.00 -0.13 0.00 0.00 55.73 58.12 2pgz s ARG 183 Cb -0.14 -3.04 -0.02 0.00 -1.56 0.00 0.00 34.95 30.19 2pgz s ARG 183 CO -0.04 -0.57 -0.11 -0.65 -0.81 0.00 0.00 175.30 173.12 2pgz s GLN 184 N -0.55 0.72 -0.39 5.12 -0.21 0.12 -4.92 119.66 119.56 2pgz s GLN 184 Ca 0.62 -0.73 -0.13 0.00 0.02 0.00 0.00 55.36 55.14 2pgz s GLN 184 Cb -0.46 -0.66 0.02 0.00 1.00 0.00 0.00 33.01 32.91 2pgz s GLN 184 CO 0.47 0.15 0.26 0.08 -2.12 0.00 0.00 175.29 174.13 2pgz s VAL 185 N -1.01 4.96 -0.23 1.09 1.01 -1.26 -1.26 120.40 123.70 2pgz s VAL 185 Ca -0.03 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2pgz s VAL 185 Cb -0.08 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2pgz s VAL 185 CO 0.01 -0.26 0.02 -1.58 0.00 0.00 0.00 175.10 173.29 2pgz s GLN 186 N 1.63 3.55 -0.24 2.72 2.00 0.45 -4.95 119.66 124.81 2pgz s GLN 186 Ca 0.04 -0.54 -0.09 0.00 -2.00 0.00 0.00 55.36 52.77 2pgz s GLN 186 Cb -0.19 -3.17 -0.04 0.00 0.80 0.00 0.00 33.01 30.41 2pgz s GLN 186 CO 0.09 -0.16 0.12 -1.01 -0.50 0.00 0.00 175.29 173.83 2pgz s HIS 187 N 1.47 3.21 -0.13 1.67 3.76 -1.26 -0.92 115.29 123.09 2pgz s HIS 187 Ca 0.05 -0.02 -0.03 0.00 -0.15 0.00 0.00 55.06 54.91 2pgz s HIS 187 Cb -0.15 -2.25 -0.03 0.00 1.11 0.00 0.00 32.58 31.26 2pgz s HIS 187 CO 0.01 -0.10 -0.00 0.71 -0.85 0.00 0.00 174.74 174.50 2pgz s TYR 188 N 1.28 3.13 0.12 1.40 1.51 -1.26 -5.01 117.35 118.52 2pgz s TYR 188 Ca 0.06 0.00 0.31 0.00 -1.01 0.00 0.00 57.07 56.44 2pgz s TYR 188 Cb -0.14 -1.90 1.65 0.00 -0.11 0.00 0.00 41.96 41.46 2pgz s TYR 188 CO 0.05 0.24 1.95 0.66 -1.11 0.00 0.00 175.55 177.34 2pgz h SER 189 N 5.97 0.00 1.01 2.29 4.64 -2.00 -1.72 113.55 123.74 2pgz h SER 189 Ca -0.41 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.86 2pgz h SER 189 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 2pgz h SER 189 CO 0.60 0.00 -0.21 0.00 -0.87 0.00 0.00 176.83 176.35 2pgz h PRO 192 N 7.68 0.00 -5.69 0.00 0.13 -1.89 -3.39 132.00 128.83 2pgz h PRO 192 Ca -0.31 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.23 2pgz h PRO 192 Cb 1.13 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.18 2pgz h PRO 192 CO 0.30 0.37 -0.27 -1.21 -0.23 0.00 0.00 178.00 176.96 2pgz s GLU 193 N -3.92 4.11 0.67 0.86 2.02 -1.26 -5.02 118.70 116.16 2pgz s GLU 193 Ca -0.02 0.23 -0.12 0.00 0.02 0.00 0.00 54.97 55.08 2pgz s GLU 193 Cb 0.13 -3.35 -0.00 0.00 0.10 0.00 0.00 34.13 31.00 2pgz s GLU 193 CO 0.70 0.39 1.06 -1.25 0.02 0.00 0.00 175.26 176.18 2pgz s PRO 194 N -0.05 3.00 0.06 0.39 0.04 -1.26 -4.78 135.00 132.40 2pgz s PRO 194 Ca 0.20 1.07 0.05 0.00 0.04 0.00 0.00 61.00 62.36 2pgz s PRO 194 Cb -0.14 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 2pgz s PRO 194 CO 0.08 -1.06 -0.06 0.71 0.04 0.00 0.00 177.00 176.71 2pgz s TYR 195 N -2.82 2.87 -0.08 0.56 2.02 -0.09 -0.62 117.35 119.19 2pgz s TYR 195 Ca 0.60 -0.07 -0.13 0.00 -0.37 0.00 0.00 57.07 57.11 2pgz s TYR 195 Cb -0.15 -1.53 -0.05 0.00 -0.40 0.00 0.00 41.96 39.83 2pgz s TYR 195 CO 0.49 0.42 0.32 0.42 -1.57 0.00 0.00 175.55 175.63 2pgz s ILE 196 N -1.16 5.23 0.17 2.71 -1.09 -1.26 -0.41 121.20 125.39 2pgz s ILE 196 Ca 0.21 0.62 0.02 0.00 -2.23 0.00 0.00 60.65 59.27 2pgz s ILE 196 Cb -0.11 -3.62 -0.05 0.00 -1.58 0.00 0.00 42.46 37.10 2pgz s ILE 196 CO 0.13 0.52 -0.01 1.51 -1.23 0.00 0.00 174.94 175.86 2pgz s ASP 197 N -0.53 1.32 -0.22 3.58 1.47 -0.39 -4.26 116.67 117.63 2pgz s ASP 197 Ca 0.20 -1.16 -0.04 0.00 1.18 0.00 0.00 52.55 52.73 2pgz s ASP 197 Cb -0.14 0.10 -0.00 0.00 -0.34 0.00 0.00 42.92 42.53 2pgz s ASP 197 CO 0.08 -0.54 -0.05 -0.69 0.68 0.00 0.00 175.17 174.65 2pgz s VAL 198 N -3.61 3.29 -0.34 2.11 1.01 0.08 0.16 120.40 123.10 2pgz s VAL 198 Ca 0.23 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 2pgz s VAL 198 Cb 0.06 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 2pgz s VAL 198 CO 0.04 0.40 0.56 0.21 0.00 0.00 0.00 175.10 176.31 2pgz s ASN 199 N 1.46 6.38 -0.34 3.32 2.47 0.41 -1.16 114.94 127.48 2pgz s ASN 199 Ca 0.05 0.14 -0.19 0.00 0.42 0.00 0.00 52.86 53.28 2pgz s ASN 199 Cb -0.14 -2.29 -0.00 0.00 -1.45 0.00 0.00 41.25 37.36 2pgz s ASN 199 CO -0.04 -0.49 0.54 -0.22 -3.72 0.00 0.00 177.10 173.17 2pgz s LEU 200 N 2.50 4.29 -0.20 3.21 2.96 0.31 -1.50 118.68 130.25 2pgz s LEU 200 Ca 0.21 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 54.17 2pgz s LEU 200 Cb -0.15 -2.64 -0.00 0.00 0.50 0.00 0.00 46.19 43.90 2pgz s LEU 200 CO 0.13 -0.48 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.90 2pgz s VAL 201 N 2.46 3.02 -0.11 1.68 1.01 -0.47 -1.27 120.40 126.71 2pgz s VAL 201 Ca 0.20 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2pgz s VAL 201 Cb -0.15 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 33.89 2pgz s VAL 201 CO 0.13 0.46 -0.23 -0.69 0.00 0.00 0.00 175.10 174.78 2pgz s VAL 202 N 1.30 2.02 -0.16 2.92 1.01 -0.35 -1.44 120.40 125.71 2pgz s VAL 202 Ca 0.04 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 2pgz s VAL 202 Cb -0.14 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2pgz s VAL 202 CO -0.05 0.55 -0.08 -0.54 0.00 0.00 0.00 175.10 174.98 2pgz s LYS 203 N 0.50 3.48 0.11 2.72 1.02 0.28 -1.60 119.74 126.25 2pgz s LYS 203 Ca -0.15 -0.62 -0.13 0.00 0.02 0.00 0.00 55.97 55.10 2pgz s LYS 203 Cb -0.17 -2.82 0.02 0.00 -0.52 0.00 0.00 37.83 34.34 2pgz s LYS 203 CO 0.05 0.12 0.31 -0.59 -0.92 0.00 0.00 175.35 174.32 2pgz s PHE 204 N 0.63 -0.04 0.10 3.18 -0.12 -0.35 0.08 117.98 121.46 2pgz s PHE 204 Ca -0.05 -0.33 -0.12 0.00 -0.05 0.00 0.00 56.93 56.38 2pgz s PHE 204 Cb -0.15 0.11 0.01 0.00 -0.63 0.00 0.00 43.02 42.37 2pgz s PHE 204 CO 0.03 -0.63 0.27 -0.98 -0.05 0.00 0.00 175.22 173.86 2pgz s ARG 205 N -3.83 0.92 0.33 1.99 1.70 -0.69 -0.05 118.95 119.32 2pgz s ARG 205 Ca 0.04 -0.83 -0.29 0.00 -0.47 0.00 0.00 55.73 54.18 2pgz s ARG 205 Cb 0.03 0.39 -0.11 0.00 -0.57 0.00 0.00 34.95 34.69 2pgz s ARG 205 CO -0.11 -0.32 1.53 -1.21 -1.08 0.00 0.00 175.30 174.10 2pgz s GLU 206 N -3.73 4.13 0.00 3.89 2.02 0.06 -0.49 118.70 124.58 2pgz s GLU 206 Ca 0.03 2.55 0.24 0.00 0.02 0.00 0.00 54.97 57.81 2pgz s GLU 206 Cb 0.03 -3.00 1.40 0.00 0.10 0.00 0.00 34.13 32.66 2pgz s GLU 206 CO -0.11 -0.56 1.77 -2.13 0.02 0.00 0.00 175.26 174.25