#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn9 h LYS -1 N 0.00 0.91 -0.85 -1.24 1.57 -2.05 0.34 116.57 115.26 2wn9 h LYS -1 Ca 0.00 -0.19 0.07 0.00 -1.87 0.00 0.00 60.65 58.67 2wn9 h LYS -1 Cb 0.00 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.11 2wn9 h LYS -1 CO 0.00 0.81 0.51 -0.07 -0.57 0.00 0.00 179.45 180.13 2wn9 h LEU 0 N 0.84 0.78 -0.33 2.94 3.38 -2.05 0.18 115.31 121.04 2wn9 h LEU 0 Ca 0.19 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 2wn9 h LEU 0 Cb 0.27 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2wn9 h LEU 0 CO -0.01 0.48 -0.23 0.45 0.09 0.00 0.00 178.44 179.22 2wn9 h HIS 1 N 0.90 0.87 -0.72 1.13 3.86 -1.75 -1.11 115.15 118.33 2wn9 h HIS 1 Ca 0.38 -0.24 -0.05 0.00 -1.16 0.00 0.00 60.37 59.30 2wn9 h HIS 1 Cb 0.25 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.49 2wn9 h HIS 1 CO -0.04 0.98 0.24 0.66 0.86 0.00 0.00 177.93 180.63 2wn9 h SER 2 N 0.51 1.02 -0.22 2.45 4.64 -0.07 0.12 113.55 122.01 2wn9 h SER 2 Ca 0.06 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 2wn9 h SER 2 Cb 0.79 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 2wn9 h SER 2 CO 0.06 0.94 0.09 1.56 -0.87 0.00 0.00 176.83 178.61 2wn9 h GLN 3 N 1.06 0.33 -0.74 4.77 4.20 -0.95 -2.34 115.11 121.44 2wn9 h GLN 3 Ca 0.24 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.92 2wn9 h GLN 3 Cb 0.27 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.95 2wn9 h GLN 3 CO -0.01 0.39 0.46 0.00 -0.67 0.00 0.00 178.83 179.00 2wn9 h ALA 4 N 0.93 0.98 -0.67 3.87 0.00 -0.81 -0.66 119.26 122.90 2wn9 h ALA 4 Ca 0.07 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2wn9 h ALA 4 Cb 0.18 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2wn9 h ALA 4 CO -0.01 0.23 0.42 -0.91 0.00 0.00 0.00 179.25 178.98 2wn9 h ASN 5 N 0.88 0.69 -0.31 0.00 2.35 -0.72 -0.40 115.58 118.07 2wn9 h ASN 5 Ca 0.31 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.96 2wn9 h ASN 5 Cb 0.06 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2wn9 h ASN 5 CO -0.13 0.48 -0.16 0.25 -1.65 0.00 0.00 177.43 176.22 2wn9 h LEU 6 N 0.82 0.69 -0.86 1.61 5.85 -0.90 -0.34 115.31 122.18 2wn9 h LEU 6 Ca 0.27 -0.41 0.04 0.00 0.84 0.00 0.00 57.88 58.61 2wn9 h LEU 6 Cb 0.01 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 2wn9 h LEU 6 CO -0.10 0.95 0.55 0.24 -0.34 0.00 0.00 178.44 179.73 2wn9 h MET 7 N 0.43 1.02 -0.43 1.25 2.86 -1.02 -1.17 114.93 117.87 2wn9 h MET 7 Ca 0.07 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 2wn9 h MET 7 Cb 0.69 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 2wn9 h MET 7 CO 0.05 0.68 -0.00 -0.09 1.06 0.00 0.00 176.91 178.60 2wn9 h ARG 8 N 1.05 0.76 0.15 1.72 2.43 -0.80 -1.50 114.38 118.19 2wn9 h ARG 8 Ca 0.35 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2wn9 h ARG 8 Cb 0.04 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2wn9 h ARG 8 CO -0.13 0.83 -0.13 1.25 -1.51 0.00 0.00 179.97 180.29 2wn9 h LEU 9 N 0.60 -0.34 -1.17 3.80 5.85 -0.79 -1.45 115.31 121.81 2wn9 h LEU 9 Ca 0.12 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2wn9 h LEU 9 Cb 0.49 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 2wn9 h LEU 9 CO 0.02 -0.20 0.57 0.11 -0.34 0.00 0.00 178.44 178.60 2wn9 h LYS 10 N -0.29 1.06 -0.25 1.25 1.57 -1.12 -2.02 116.57 116.78 2wn9 h LYS 10 Ca -0.00 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 2wn9 h LYS 10 Cb 0.27 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2wn9 h LYS 10 CO -0.02 0.70 -0.10 1.03 -0.57 0.00 0.00 179.45 180.49 2wn9 h SER 11 N 1.10 0.52 -0.36 0.86 0.87 -1.05 -1.78 113.55 113.70 2wn9 h SER 11 Ca 0.34 -0.39 -0.05 0.00 -1.23 0.00 0.00 61.79 60.45 2wn9 h SER 11 Cb -0.01 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 2wn9 h SER 11 CO -0.09 0.80 0.07 0.44 -0.53 0.00 0.00 176.83 177.51 2wn9 h ASP 12 N 0.24 0.63 0.52 6.23 3.32 -0.89 0.23 116.42 126.71 2wn9 h ASP 12 Ca 0.06 -0.11 -0.27 0.00 0.02 0.00 0.00 57.03 56.73 2wn9 h ASP 12 Cb 0.59 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.98 2wn9 h ASP 12 CO 0.03 0.66 -1.20 -0.07 -1.72 0.00 0.00 179.24 176.94 2wn9 h LEU 13 N 0.66 0.50 0.01 1.55 3.38 -1.35 -3.31 115.31 116.74 2wn9 h LEU 13 Ca 0.14 -0.50 -0.39 0.00 0.09 0.00 0.00 57.88 57.23 2wn9 h LEU 13 Cb 0.30 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 2wn9 h LEU 13 CO 0.00 1.36 -2.15 0.49 0.09 0.00 0.00 178.44 178.23 2wn9 n PHE 14 N -3.60 0.38 -0.04 1.13 0.99 -0.67 -4.72 117.46 110.91 2wn9 n PHE 14 Ca -0.09 0.14 -0.17 0.00 -0.00 0.00 0.00 57.45 57.34 2wn9 n PHE 14 Cb 0.99 -1.04 -0.14 0.00 -1.00 0.00 0.00 39.48 38.29 2wn9 n PHE 14 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2wn9 n ASN 15 N -4.10 1.59 -1.94 4.37 5.03 0.73 -4.19 115.26 116.74 2wn9 n ASN 15 Ca -0.46 0.15 -0.14 0.00 0.87 0.00 0.00 54.58 55.00 2wn9 n ASN 15 Cb 0.86 -0.38 -0.03 0.00 -1.02 0.00 0.00 39.78 39.21 2wn9 n ASN 15 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2wn9 n ARG 16 N -3.26 1.76 0.00 3.52 1.74 -0.81 -5.03 116.66 114.59 2wn9 n ARG 16 Ca -0.32 -1.24 0.00 0.00 -0.77 0.00 0.00 57.85 55.51 2wn9 n ARG 16 Cb 1.05 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.85 2wn9 n ARG 16 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2wn9 n SER 17 N 1.11 0.00 -3.99 0.55 3.41 -1.26 -4.91 113.62 108.53 2wn9 n SER 17 Ca 0.29 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.68 2wn9 n SER 17 Cb 0.61 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.40 2wn9 n SER 17 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2wn9 s TYR 20 N -2.22 1.10 -1.87 7.33 5.04 -1.26 -4.85 117.35 120.63 2wn9 s TYR 20 Ca 0.00 -0.33 0.08 0.00 -2.44 0.00 0.00 57.07 54.38 2wn9 s TYR 20 Cb 0.00 -0.82 0.24 0.00 0.35 0.00 0.00 41.96 41.73 2wn9 s TYR 20 CO 0.00 -0.18 1.17 -0.35 -1.34 0.00 0.00 175.55 174.86 2wn9 n PRO 21 N 3.60 1.70 0.00 4.97 -0.04 -1.26 -4.88 135.00 139.09 2wn9 n PRO 21 Ca -0.21 -0.98 0.00 0.00 -0.04 0.00 0.00 63.50 62.26 2wn9 n PRO 21 Cb 0.53 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2wn9 n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wn9 n GLY 22 N 0.85 0.13 3.80 0.55 0.00 -1.26 -5.01 105.19 104.26 2wn9 n GLY 22 Ca 0.09 -1.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.00 2wn9 n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wn9 s PRO 23 N -2.09 2.62 0.26 1.61 0.04 -1.26 -5.04 135.00 131.15 2wn9 s PRO 23 Ca 0.00 0.98 -0.03 0.00 0.04 0.00 0.00 61.00 61.99 2wn9 s PRO 23 Cb 0.00 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 2wn9 s PRO 23 CO 0.00 -1.33 0.32 0.95 0.04 0.00 0.00 177.00 176.98 2wn9 s THR 24 N -3.01 0.00 0.42 1.26 -4.23 -0.88 -4.98 115.64 104.22 2wn9 s THR 24 Ca 0.59 -1.75 0.11 0.00 -1.18 0.00 0.00 61.69 59.46 2wn9 s THR 24 Cb -0.15 -2.45 0.19 0.00 1.34 0.00 0.00 72.50 71.43 2wn9 s THR 24 CO 0.55 0.00 1.98 0.50 -0.54 0.00 0.00 174.62 177.11 2wn9 h LYS 25 N 2.34 0.20 0.00 3.99 3.64 -1.91 -1.02 116.57 123.81 2wn9 h LYS 25 Ca -0.30 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 2wn9 h LYS 25 Cb 1.25 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2wn9 h LYS 25 CO 0.43 0.29 -0.10 -0.44 -2.27 0.00 0.00 179.45 177.35 2wn9 h ASP 26 N 0.19 0.00 -1.36 4.20 3.32 -1.96 -3.39 116.42 117.42 2wn9 h ASP 26 Ca 0.04 -0.02 -0.44 0.00 0.02 0.00 0.00 57.03 56.64 2wn9 h ASP 26 Cb 0.26 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 39.50 2wn9 h ASP 26 CO 0.01 0.01 -0.93 -0.67 -1.72 0.00 0.00 179.24 175.95 2wn9 n ASP 27 N -2.52 -0.61 -4.84 6.45 2.03 -0.65 -5.14 116.55 111.27 2wn9 n ASP 27 Ca 0.05 -3.00 -0.31 0.00 0.52 0.00 0.00 54.79 52.05 2wn9 n ASP 27 Cb 0.47 0.16 0.03 0.00 -0.72 0.00 0.00 41.12 41.06 2wn9 n ASP 27 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2wn9 s PRO 28 N -0.89 3.31 0.13 -0.67 0.04 -0.48 -2.07 135.00 134.36 2wn9 s PRO 28 Ca 0.34 0.87 0.09 0.00 0.04 0.00 0.00 61.00 62.33 2wn9 s PRO 28 Cb 0.23 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 2wn9 s PRO 28 CO -0.13 -0.80 -0.20 -1.17 0.04 0.00 0.00 177.00 174.74 2wn9 s LEU 29 N -5.27 2.35 -0.16 -3.56 2.96 -0.26 -4.93 118.68 109.81 2wn9 s LEU 29 Ca 0.57 -0.75 -0.02 0.00 -0.22 0.00 0.00 54.13 53.71 2wn9 s LEU 29 Cb -0.12 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.66 2wn9 s LEU 29 CO 0.53 0.04 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.61 2wn9 s THR 30 N -1.46 3.24 -0.20 3.68 2.01 -1.26 -1.05 115.64 120.61 2wn9 s THR 30 Ca 0.10 -0.58 -0.05 0.00 0.31 0.00 0.00 61.69 61.47 2wn9 s THR 30 Cb -0.09 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 70.00 2wn9 s THR 30 CO 0.05 0.50 0.01 -0.69 -0.69 0.00 0.00 174.62 173.80 2wn9 s VAL 31 N 0.65 4.08 -0.21 3.82 1.01 0.74 -4.41 120.40 126.09 2wn9 s VAL 31 Ca -0.05 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 2wn9 s VAL 31 Cb -0.15 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2wn9 s VAL 31 CO 0.02 0.43 0.30 -0.89 0.00 0.00 0.00 175.10 174.97 2wn9 s THR 32 N 0.94 5.27 -0.00 3.92 2.01 0.31 -1.50 115.64 126.59 2wn9 s THR 32 Ca 0.02 0.51 0.06 0.00 0.31 0.00 0.00 61.69 62.59 2wn9 s THR 32 Cb -0.14 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 2wn9 s THR 32 CO 0.02 0.31 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.32 2wn9 s LEU 33 N 1.07 2.56 -0.13 4.42 1.43 0.45 -1.33 118.68 127.15 2wn9 s LEU 33 Ca 0.15 -0.35 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 2wn9 s LEU 33 Cb -0.14 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.61 2wn9 s LEU 33 CO 0.06 0.30 0.34 -0.83 0.23 0.00 0.00 176.35 176.45 2wn9 s GLY 34 N -1.04 -0.25 -0.04 -3.19 0.00 -0.46 -4.37 107.32 97.97 2wn9 s GLY 34 Ca 0.13 0.95 0.02 0.00 0.00 0.00 0.00 44.72 45.81 2wn9 s GLY 34 CO 0.02 0.82 -0.07 -1.36 0.00 0.00 0.00 173.10 172.51 2wn9 s PHE 35 N 0.16 2.92 -0.35 1.90 0.08 -1.26 -0.36 117.98 121.06 2wn9 s PHE 35 Ca -0.00 0.00 0.01 0.00 0.12 0.00 0.00 56.93 57.06 2wn9 s PHE 35 Cb -0.02 -1.68 0.10 0.00 -0.57 0.00 0.00 43.02 40.85 2wn9 s PHE 35 CO 0.01 0.34 0.08 0.99 -0.10 0.00 0.00 175.22 176.54 2wn9 s THR 36 N -0.87 2.66 -0.12 0.64 2.01 -0.37 -1.59 115.64 118.00 2wn9 s THR 36 Ca 0.14 -2.12 -0.28 0.00 0.31 0.00 0.00 61.69 59.75 2wn9 s THR 36 Cb -0.11 -2.84 -0.02 0.00 0.01 0.00 0.00 72.50 69.54 2wn9 s THR 36 CO 0.03 -0.54 0.92 -0.22 -0.69 0.00 0.00 174.62 174.12 2wn9 s LEU 37 N 1.02 4.24 -0.25 4.42 2.96 -0.83 -1.09 118.68 129.15 2wn9 s LEU 37 Ca 0.07 1.39 0.02 0.00 -0.22 0.00 0.00 54.13 55.38 2wn9 s LEU 37 Cb -0.20 -3.40 -0.16 0.00 0.50 0.00 0.00 46.19 42.92 2wn9 s LEU 37 CO -0.06 -0.39 -0.22 1.67 -1.32 0.00 0.00 176.35 176.03 2wn9 n GLN 38 N 4.91 0.61 -3.63 1.98 7.27 0.01 -3.34 117.38 125.18 2wn9 n GLN 38 Ca 0.06 0.14 -0.12 0.00 0.07 0.00 0.00 57.00 57.15 2wn9 n GLN 38 Cb 0.49 -1.49 -0.07 0.00 2.41 0.00 0.00 30.24 31.58 2wn9 n GLN 38 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2wn9 s ASP 39 N -6.39 -0.63 -0.47 1.69 2.15 -0.83 -0.45 116.67 111.74 2wn9 s ASP 39 Ca -0.33 1.22 -0.18 0.00 0.43 0.00 0.00 52.55 53.69 2wn9 s ASP 39 Cb 0.09 1.24 0.04 0.00 -0.30 0.00 0.00 42.92 43.99 2wn9 s ASP 39 CO 0.56 -0.21 0.54 -0.63 -0.17 0.00 0.00 175.17 175.26 2wn9 s ILE 40 N 0.33 4.98 -0.02 4.11 1.01 -1.26 -0.64 121.20 129.71 2wn9 s ILE 40 Ca 0.01 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.09 2wn9 s ILE 40 Cb -0.05 -4.18 -0.33 0.00 0.01 0.00 0.00 42.46 37.91 2wn9 s ILE 40 CO -0.02 -0.63 0.80 0.58 0.00 0.00 0.00 174.94 175.67 2wn9 h VAL 41 N 5.81 1.09 -3.06 2.92 2.07 -1.55 -3.41 116.25 120.12 2wn9 h VAL 41 Ca -0.27 -2.58 -0.16 0.00 0.82 0.00 0.00 66.70 64.51 2wn9 h VAL 41 Cb 1.10 2.89 -0.25 0.00 -1.52 0.00 0.00 31.29 33.50 2wn9 h VAL 41 CO 0.89 0.83 -0.40 -0.75 0.02 0.00 0.00 177.57 178.16 2wn9 s LYS 42 N -2.58 0.32 -0.20 1.57 2.20 -1.23 -4.92 119.74 114.91 2wn9 s LYS 42 Ca -0.13 0.39 -0.01 0.00 -0.36 0.00 0.00 55.97 55.85 2wn9 s LYS 42 Cb 0.05 0.15 0.05 0.00 -1.51 0.00 0.00 37.83 36.57 2wn9 s LYS 42 CO 0.89 -0.04 -0.01 0.00 -0.36 0.00 0.00 175.35 175.82 2wn9 s ALA 43 N 0.19 1.41 -0.47 3.13 0.00 -1.26 -1.00 121.76 123.76 2wn9 s ALA 43 Ca -0.00 -0.91 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 2wn9 s ALA 43 Cb -0.02 -1.23 0.10 0.00 0.00 0.00 0.00 23.12 21.97 2wn9 s ALA 43 CO -0.00 -1.06 0.36 0.34 0.00 0.00 0.00 175.76 175.40 2wn9 s ASP 44 N 1.66 5.88 0.21 0.00 -1.08 0.35 -4.93 116.67 118.76 2wn9 s ASP 44 Ca -0.02 -1.62 0.24 0.00 -0.52 0.00 0.00 52.55 50.64 2wn9 s ASP 44 Cb -0.17 -2.08 0.91 0.00 -1.46 0.00 0.00 42.92 40.11 2wn9 s ASP 44 CO -0.07 -0.66 1.73 -1.54 0.52 0.00 0.00 175.17 175.15 2wn9 n SER 45 N 5.05 0.64 0.17 -0.34 3.41 -1.26 -0.15 113.62 121.13 2wn9 n SER 45 Ca -0.11 0.61 0.05 0.00 -0.26 0.00 0.00 58.87 59.16 2wn9 n SER 45 Cb 0.42 -0.76 0.17 0.00 -0.26 0.00 0.00 64.21 63.77 2wn9 n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2wn9 h SER 46 N 0.00 0.00 0.00 4.04 4.64 -1.96 -3.36 113.55 116.92 2wn9 h SER 46 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wn9 h SER 46 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2wn9 h SER 46 CO 0.00 0.42 0.00 0.35 -0.87 0.00 0.00 176.83 176.73 2wn9 n THR 47 N -3.32 0.00 -3.52 2.95 -2.24 -1.15 -5.04 114.28 101.97 2wn9 n THR 47 Ca 0.01 -0.39 -0.22 0.00 -2.27 0.00 0.00 64.05 61.19 2wn9 n THR 47 Cb 0.63 1.11 0.05 0.00 -2.10 0.00 0.00 70.33 70.02 2wn9 n THR 47 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wn9 n ASN 48 N -0.41 -4.51 -4.04 3.42 3.02 0.78 -4.93 115.26 108.60 2wn9 n ASN 48 Ca 0.00 -0.83 -0.22 0.00 -0.03 0.00 0.00 54.58 53.50 2wn9 n ASN 48 Cb 0.03 -4.32 -0.16 0.00 -0.61 0.00 0.00 39.78 34.72 2wn9 n ASN 48 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2wn9 s GLU 49 N -5.38 1.25 0.04 3.52 2.02 -1.09 -1.42 118.70 117.65 2wn9 s GLU 49 Ca 0.32 -0.39 0.08 0.00 0.02 0.00 0.00 54.97 55.00 2wn9 s GLU 49 Cb -0.08 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 33.00 2wn9 s GLU 49 CO 0.80 0.14 -0.24 0.08 0.02 0.00 0.00 175.26 176.05 2wn9 s VAL 50 N 0.21 1.94 -0.19 2.63 1.01 -0.47 -0.50 120.40 125.03 2wn9 s VAL 50 Ca -0.05 -1.31 -0.03 0.00 0.00 0.00 0.00 61.98 60.60 2wn9 s VAL 50 Cb -0.10 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 2wn9 s VAL 50 CO 0.01 0.30 -0.06 -1.81 0.00 0.00 0.00 175.10 173.54 2wn9 s ASP 51 N -1.21 4.30 0.03 3.32 1.11 -0.17 -1.14 116.67 122.91 2wn9 s ASP 51 Ca 0.10 -0.34 0.06 0.00 0.18 0.00 0.00 52.55 52.55 2wn9 s ASP 51 Cb -0.09 -1.72 -0.03 0.00 1.07 0.00 0.00 42.92 42.15 2wn9 s ASP 51 CO 0.02 0.04 -0.16 -0.76 1.18 0.00 0.00 175.17 175.50 2wn9 s LEU 52 N 1.10 2.71 -0.10 1.23 1.43 0.27 -1.26 118.68 124.05 2wn9 s LEU 52 Ca 0.01 -0.36 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 2wn9 s LEU 52 Cb -0.15 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 2wn9 s LEU 52 CO -0.01 0.27 -0.20 -0.69 0.23 0.00 0.00 176.35 175.95 2wn9 s VAL 53 N -0.92 2.43 0.19 -1.59 1.01 0.19 -0.84 120.40 120.87 2wn9 s VAL 53 Ca 0.15 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 2wn9 s VAL 53 Cb -0.11 -1.96 0.03 0.00 0.00 0.00 0.00 36.38 34.34 2wn9 s VAL 53 CO 0.05 0.55 0.50 -0.72 0.00 0.00 0.00 175.10 175.48 2wn9 s TYR 54 N 0.26 -0.10 -0.17 5.22 -0.85 -0.63 -0.81 117.35 120.27 2wn9 s TYR 54 Ca -0.14 -0.24 -0.07 0.00 -0.52 0.00 0.00 57.07 56.10 2wn9 s TYR 54 Cb -0.17 0.35 -0.04 0.00 0.38 0.00 0.00 41.96 42.49 2wn9 s TYR 54 CO 0.07 -0.88 0.06 0.71 -1.52 0.00 0.00 175.55 173.99 2wn9 s TYR 55 N -3.87 3.27 -0.38 -3.49 4.12 -0.25 -0.65 117.35 116.10 2wn9 s TYR 55 Ca 0.09 0.11 -0.05 0.00 0.02 0.00 0.00 57.07 57.24 2wn9 s TYR 55 Cb -0.00 -2.05 0.07 0.00 -1.52 0.00 0.00 41.96 38.46 2wn9 s TYR 55 CO -0.04 0.22 0.16 -2.00 0.02 0.00 0.00 175.55 173.91 2wn9 s GLU 56 N 0.18 2.40 -0.16 -0.62 2.12 -0.50 -1.24 118.70 120.88 2wn9 s GLU 56 Ca 0.04 -1.47 -0.21 0.00 0.36 0.00 0.00 54.97 53.69 2wn9 s GLU 56 Cb -0.12 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.69 2wn9 s GLU 56 CO 0.00 -0.87 0.63 -1.14 -0.54 0.00 0.00 175.26 173.35 2wn9 s GLN 57 N 1.31 4.27 -0.07 4.30 0.74 0.51 -3.35 119.66 127.36 2wn9 s GLN 57 Ca 0.02 0.65 0.04 0.00 0.05 0.00 0.00 55.36 56.12 2wn9 s GLN 57 Cb -0.22 -3.54 0.00 0.00 1.10 0.00 0.00 33.01 30.36 2wn9 s GLN 57 CO -0.00 -0.14 -0.19 -0.65 -0.55 0.00 0.00 175.29 173.76 2wn9 s GLN 58 N 1.57 2.28 -0.01 1.67 -0.21 -0.18 -1.35 119.66 123.42 2wn9 s GLN 58 Ca 0.30 -0.67 0.00 0.00 0.02 0.00 0.00 55.36 55.01 2wn9 s GLN 58 Cb -0.16 -1.83 0.01 0.00 1.00 0.00 0.00 33.01 32.03 2wn9 s GLN 58 CO 0.12 0.17 -0.01 0.50 -2.12 0.00 0.00 175.29 173.95 2wn9 s ARG 59 N 0.31 0.16 0.28 2.91 3.00 -0.44 -1.35 118.95 123.82 2wn9 s ARG 59 Ca -0.12 -0.02 -0.10 0.00 -1.00 0.00 0.00 55.73 54.49 2wn9 s ARG 59 Cb -0.15 -0.21 0.00 0.00 0.00 0.00 0.00 34.95 34.58 2wn9 s ARG 59 CO 0.05 -0.01 0.49 1.67 0.00 0.00 0.00 175.30 177.50 2wn9 s TRP 60 N 0.25 0.53 -0.02 5.12 -2.14 -0.96 -0.53 118.94 121.20 2wn9 s TRP 60 Ca -0.02 -0.88 0.00 0.00 2.66 0.00 0.00 56.10 57.86 2wn9 s TRP 60 Cb -0.04 0.15 0.02 0.00 -3.10 0.00 0.00 33.47 30.50 2wn9 s TRP 60 CO -0.01 -1.06 -0.00 0.21 -2.66 0.00 0.00 176.95 173.43 2wn9 s LYS 61 N -3.66 0.23 -0.09 3.25 2.20 -1.26 0.04 119.74 120.45 2wn9 s LYS 61 Ca 0.24 0.03 0.04 0.00 -0.36 0.00 0.00 55.97 55.93 2wn9 s LYS 61 Cb -0.01 -0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 35.96 2wn9 s LYS 61 CO 0.12 -0.07 -0.24 -0.51 -0.36 0.00 0.00 175.35 174.29 2wn9 s LEU 62 N 0.65 2.06 0.36 5.43 1.43 -0.34 -4.87 118.68 123.40 2wn9 s LEU 62 Ca -0.06 -0.53 0.10 0.00 -1.03 0.00 0.00 54.13 52.60 2wn9 s LEU 62 Cb -0.09 -1.37 0.84 0.00 0.03 0.00 0.00 46.19 45.60 2wn9 s LEU 62 CO -0.01 0.18 1.87 0.78 0.23 0.00 0.00 176.35 179.40 2wn9 h ASN 63 N 6.54 0.63 0.43 2.29 2.35 -1.90 -1.72 115.58 124.19 2wn9 h ASN 63 Ca -0.23 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 2wn9 h ASN 63 Cb 1.22 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.51 2wn9 h ASN 63 CO 0.47 0.31 0.00 -1.54 -1.65 0.00 0.00 177.43 175.03 2wn9 n SER 64 N -4.56 0.00 -0.94 5.81 3.41 -1.26 -2.21 113.62 113.87 2wn9 n SER 64 Ca 0.17 0.39 0.08 0.00 -0.26 0.00 0.00 58.87 59.25 2wn9 n SER 64 Cb 0.48 -0.44 0.23 0.00 -0.26 0.00 0.00 64.21 64.22 2wn9 n SER 64 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wn9 n LEU 65 N -1.44 3.52 -4.78 1.04 4.77 -0.65 -4.97 117.00 114.49 2wn9 n LEU 65 Ca 0.04 -2.21 -0.39 0.00 -0.03 0.00 0.00 56.01 53.42 2wn9 n LEU 65 Cb 0.15 -0.37 -0.06 0.00 -2.33 0.00 0.00 43.42 40.81 2wn9 n LEU 65 CO 0.13 0.78 0.53 -0.04 -1.33 0.00 0.00 177.39 177.46 2wn9 s MET 66 N -1.39 4.59 0.10 3.23 -1.94 -0.94 -3.69 119.30 119.26 2wn9 s MET 66 Ca 0.35 1.21 -0.10 0.00 -1.71 0.00 0.00 55.69 55.44 2wn9 s MET 66 Cb 0.21 -3.16 0.00 0.00 2.01 0.00 0.00 34.83 33.89 2wn9 s MET 66 CO 0.19 0.50 0.22 1.67 -0.01 0.00 0.00 175.02 177.60 2wn9 s TRP 67 N -1.26 0.12 -0.34 -0.03 -2.14 -0.45 -4.95 118.94 109.88 2wn9 s TRP 67 Ca 0.40 -0.53 -0.21 0.00 2.66 0.00 0.00 56.10 58.42 2wn9 s TRP 67 Cb -0.22 -0.02 0.00 0.00 -3.10 0.00 0.00 33.47 30.13 2wn9 s TRP 67 CO 0.26 -0.57 0.65 0.34 -2.66 0.00 0.00 176.95 174.97 2wn9 s ASP 68 N -2.86 6.45 0.49 -2.66 -1.08 -1.26 -4.66 116.67 111.10 2wn9 s ASP 68 Ca 0.05 0.23 0.18 0.00 -0.52 0.00 0.00 52.55 52.49 2wn9 s ASP 68 Cb 0.04 -2.33 1.22 0.00 -1.46 0.00 0.00 42.92 40.39 2wn9 s ASP 68 CO -0.11 -0.58 2.05 -0.65 0.52 0.00 0.00 175.17 176.41 2wn9 h PRO 69 N 8.40 0.14 -0.03 4.34 0.11 -1.94 -0.41 132.00 142.61 2wn9 h PRO 69 Ca -0.26 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.85 2wn9 h PRO 69 Cb 1.11 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2wn9 h PRO 69 CO 0.83 0.09 0.03 -0.91 -0.21 0.00 0.00 178.00 177.83 2wn9 h ASN 70 N 0.14 0.00 1.56 -2.05 -0.26 -1.92 0.27 115.58 113.32 2wn9 h ASN 70 Ca 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 2wn9 h ASN 70 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 2wn9 h ASN 70 CO -0.02 0.00 0.00 -0.33 -1.06 0.00 0.00 177.43 176.02 2wn9 h GLU 71 N 0.00 0.00 -1.21 0.81 5.08 -1.48 -3.37 114.58 114.41 2wn9 h GLU 71 Ca 0.01 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.92 2wn9 h GLU 71 Cb 0.07 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.91 2wn9 h GLU 71 CO -0.00 0.00 -1.00 0.66 -1.00 0.00 0.00 179.01 177.67 2wn9 n TYR 72 N -2.56 2.11 -3.65 4.33 4.02 -0.27 -4.98 117.16 116.16 2wn9 n TYR 72 Ca 0.05 -2.91 -0.27 0.00 -0.01 0.00 0.00 57.90 54.75 2wn9 n TYR 72 Cb 0.44 -0.25 0.04 0.00 -0.02 0.00 0.00 39.34 39.55 2wn9 n TYR 72 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wn9 n GLY 73 N -0.25 -0.52 2.52 2.72 0.00 -1.11 -2.09 105.19 106.46 2wn9 n GLY 73 Ca 0.22 0.19 -0.10 0.00 0.00 0.00 0.00 46.02 46.33 2wn9 n GLY 73 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wn9 n ASN 74 N -2.79 -4.89 -4.69 1.61 3.02 0.79 -4.98 115.26 103.33 2wn9 n ASN 74 Ca 0.01 0.26 -0.42 0.00 -0.03 0.00 0.00 54.58 54.39 2wn9 n ASN 74 Cb 0.55 -3.30 -0.03 0.00 -0.61 0.00 0.00 39.78 36.39 2wn9 n ASN 74 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wn9 s ILE 75 N -2.17 3.31 -0.37 2.41 1.01 -0.89 -4.89 121.20 119.61 2wn9 s ILE 75 Ca 0.00 0.76 0.09 0.00 0.00 0.00 0.00 60.65 61.50 2wn9 s ILE 75 Cb 0.00 -3.49 -0.11 0.00 0.01 0.00 0.00 42.46 38.87 2wn9 s ILE 75 CO 0.00 0.00 0.36 0.35 0.00 0.00 0.00 174.94 175.66 2wn9 n THR 76 N 4.63 0.00 -3.60 2.92 -2.24 -1.26 -4.34 114.28 110.39 2wn9 n THR 76 Ca 0.14 -0.27 -0.08 0.00 -2.27 0.00 0.00 64.05 61.57 2wn9 n THR 76 Cb 0.42 0.89 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 2wn9 n THR 76 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2wn9 s ASP 77 N -2.06 -0.38 0.20 3.42 1.47 -1.26 -1.15 116.67 116.91 2wn9 s ASP 77 Ca 0.02 -0.21 -0.14 0.00 1.18 0.00 0.00 52.55 53.41 2wn9 s ASP 77 Cb 0.07 0.55 0.01 0.00 -0.34 0.00 0.00 42.92 43.21 2wn9 s ASP 77 CO 0.38 -0.95 0.45 0.72 0.68 0.00 0.00 175.17 176.44 2wn9 s PHE 78 N -3.54 0.17 -0.06 2.11 -0.12 0.26 -4.99 117.98 111.81 2wn9 s PHE 78 Ca 0.06 -0.53 -0.00 0.00 -0.05 0.00 0.00 56.93 56.41 2wn9 s PHE 78 Cb -0.02 0.21 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 2wn9 s PHE 78 CO -0.05 -0.89 -0.02 1.03 -0.05 0.00 0.00 175.22 175.24 2wn9 s ARG 79 N -3.94 2.86 -0.05 1.99 3.00 -1.26 -0.72 118.95 120.83 2wn9 s ARG 79 Ca 0.15 -0.50 -0.12 0.00 0.00 0.00 0.00 55.73 55.27 2wn9 s ARG 79 Cb 0.00 -2.70 0.02 0.00 0.00 0.00 0.00 34.95 32.27 2wn9 s ARG 79 CO 0.02 0.67 0.28 -0.08 0.00 0.00 0.00 175.30 176.19 2wn9 s THR 80 N -0.92 0.04 0.18 0.02 -1.32 -0.35 -4.99 115.64 108.30 2wn9 s THR 80 Ca 0.15 -0.31 -0.33 0.00 -1.21 0.00 0.00 61.69 59.99 2wn9 s THR 80 Cb -0.11 -0.50 -0.15 0.00 -1.51 0.00 0.00 72.50 70.22 2wn9 s THR 80 CO 0.04 -0.17 1.22 -0.24 -2.21 0.00 0.00 174.62 173.26 2wn9 n SER 81 N 1.98 1.61 0.26 8.08 2.88 -1.26 -0.67 113.62 126.50 2wn9 n SER 81 Ca -0.18 1.14 0.10 0.00 -1.33 0.00 0.00 58.87 58.60 2wn9 n SER 81 Cb 0.57 -1.25 0.71 0.00 -0.75 0.00 0.00 64.21 63.48 2wn9 n SER 81 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wn9 h ALA 82 N 3.61 1.59 0.00 -1.46 0.00 -1.55 0.96 119.26 122.41 2wn9 h ALA 82 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2wn9 h ALA 82 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2wn9 h ALA 82 CO 0.72 0.10 0.00 0.00 0.00 0.00 0.00 179.25 180.07 2wn9 h ALA 83 N 1.92 1.00 -0.00 0.00 0.00 -1.89 -2.87 119.26 117.42 2wn9 h ALA 83 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wn9 h ALA 83 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2wn9 h ALA 83 CO 0.01 0.00 -0.23 -0.25 0.00 0.00 0.00 179.25 178.78 2wn9 n ASP 84 N -2.97 0.29 -4.26 0.00 8.00 0.33 -4.91 116.55 113.04 2wn9 n ASP 84 Ca -0.03 0.01 -0.14 0.00 0.71 0.00 0.00 54.79 55.35 2wn9 n ASP 84 Cb 0.08 -0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 40.96 2wn9 n ASP 84 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2wn9 s ILE 85 N -2.92 0.78 0.30 0.53 -4.36 -1.08 -5.06 121.20 109.39 2wn9 s ILE 85 Ca 0.15 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 2wn9 s ILE 85 Cb 0.19 -2.13 -0.10 0.00 1.25 0.00 0.00 42.46 41.66 2wn9 s ILE 85 CO 0.59 -0.47 1.30 0.86 0.24 0.00 0.00 174.94 177.46 2wn9 s TRP 86 N -3.59 3.13 0.06 1.37 -0.00 -1.26 -4.95 118.94 113.71 2wn9 s TRP 86 Ca 0.24 1.39 0.04 0.00 -0.00 0.00 0.00 56.10 57.76 2wn9 s TRP 86 Cb 0.06 -3.64 -0.03 0.00 -0.00 0.00 0.00 33.47 29.86 2wn9 s TRP 86 CO 0.04 -1.78 -0.11 0.95 -0.00 0.00 0.00 176.95 176.05 2wn9 s THR 87 N -0.87 0.85 0.51 5.86 -4.23 -1.26 -5.10 115.64 111.39 2wn9 s THR 87 Ca 0.50 -1.29 -0.20 0.00 -1.18 0.00 0.00 61.69 59.53 2wn9 s THR 87 Cb -0.39 -0.95 -0.07 0.00 1.34 0.00 0.00 72.50 72.43 2wn9 s THR 87 CO 0.49 -0.36 1.09 -2.16 -0.54 0.00 0.00 174.62 173.14 2wn9 s PRO 88 N -1.90 3.58 -0.37 3.99 0.04 -1.26 -4.94 135.00 134.14 2wn9 s PRO 88 Ca -0.04 1.52 -0.04 0.00 0.04 0.00 0.00 61.00 62.48 2wn9 s PRO 88 Cb -0.08 -2.08 0.02 0.00 0.04 0.00 0.00 34.50 32.40 2wn9 s PRO 88 CO 0.01 -0.65 2.84 -0.40 0.04 0.00 0.00 177.00 178.84 2wn9 n ASP 89 N -1.08 6.28 -4.70 6.66 5.75 -1.26 -4.95 116.55 123.24 2wn9 n ASP 89 Ca 0.10 -3.08 -0.42 0.00 -0.01 0.00 0.00 54.79 51.38 2wn9 n ASP 89 Cb 0.51 -1.25 -0.03 0.00 -1.03 0.00 0.00 41.12 39.33 2wn9 n ASP 89 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2wn9 s ILE 90 N -1.75 4.04 0.01 2.12 -1.09 -1.26 -2.37 121.20 120.90 2wn9 s ILE 90 Ca 0.58 1.43 0.01 0.00 -2.23 0.00 0.00 60.65 60.43 2wn9 s ILE 90 Cb 0.36 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 37.31 2wn9 s ILE 90 CO -0.17 0.05 -0.03 -0.89 -1.23 0.00 0.00 174.94 172.67 2wn9 s THR 91 N 1.68 0.21 0.28 2.92 2.01 -0.23 -4.91 115.64 117.60 2wn9 s THR 91 Ca 0.59 -0.43 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 2wn9 s THR 91 Cb -0.28 -0.25 -0.10 0.00 0.01 0.00 0.00 72.50 71.89 2wn9 s THR 91 CO 0.26 -0.14 1.17 0.00 -0.69 0.00 0.00 174.62 175.22 2wn9 s ALA 92 N -0.58 3.44 -0.64 7.40 0.00 -1.26 -1.76 121.76 128.37 2wn9 s ALA 92 Ca -0.05 1.01 0.24 0.00 0.00 0.00 0.00 51.96 53.16 2wn9 s ALA 92 Cb -0.04 -3.38 0.27 0.00 0.00 0.00 0.00 23.12 19.96 2wn9 s ALA 92 CO -0.00 -0.32 1.24 0.66 0.00 0.00 0.00 175.76 177.34 2wn9 n TYR 93 N 1.29 0.47 -2.38 0.00 4.01 0.15 -4.26 117.16 116.44 2wn9 n TYR 93 Ca 0.00 0.14 -0.01 0.00 -0.16 0.00 0.00 57.90 57.86 2wn9 n TYR 93 Cb 0.44 -0.59 0.06 0.00 -0.31 0.00 0.00 39.34 38.94 2wn9 n TYR 93 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2wn9 n SER 94 N -2.06 1.94 -4.77 7.72 3.41 -1.26 -5.03 113.62 113.56 2wn9 n SER 94 Ca 0.03 -2.61 -0.32 0.00 -0.26 0.00 0.00 58.87 55.71 2wn9 n SER 94 Cb 0.44 -0.40 0.07 0.00 -0.26 0.00 0.00 64.21 64.05 2wn9 n SER 94 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2wn9 s SER 95 N -3.06 4.80 0.00 4.04 1.04 -1.26 -1.90 113.70 117.37 2wn9 s SER 95 Ca 0.35 1.92 0.02 0.00 0.48 0.00 0.00 55.95 58.73 2wn9 s SER 95 Cb 0.37 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.94 2wn9 s SER 95 CO -0.08 -1.83 0.23 0.35 0.98 0.00 0.00 173.24 172.89 2wn9 n THR 96 N -2.94 0.00 -3.94 2.02 -2.24 0.08 -4.83 114.28 102.44 2wn9 n THR 96 Ca 0.10 -0.47 -0.09 0.00 -2.27 0.00 0.00 64.05 61.32 2wn9 n THR 96 Cb 0.52 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.67 2wn9 n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2wn9 s ARG 97 N -0.90 0.58 0.34 -0.78 0.52 -1.25 -5.05 118.95 112.41 2wn9 s ARG 97 Ca 0.01 -0.76 -0.29 0.00 -0.52 0.00 0.00 55.73 54.17 2wn9 s ARG 97 Cb 0.02 0.22 -0.12 0.00 0.52 0.00 0.00 34.95 35.60 2wn9 s ARG 97 CO 0.07 -0.14 1.47 -2.30 0.02 0.00 0.00 175.30 174.42 2wn9 n PRO 98 N 0.78 2.55 -1.79 3.54 -0.02 -1.26 -4.66 135.00 134.15 2wn9 n PRO 98 Ca -0.19 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 2wn9 n PRO 98 Cb 0.58 -2.61 -0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2wn9 n PRO 98 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wn9 s VAL 99 N -0.79 2.02 -0.18 -1.45 1.01 -1.26 -4.87 120.40 114.87 2wn9 s VAL 99 Ca 0.57 0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.50 2wn9 s VAL 99 Cb -0.51 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2wn9 s VAL 99 CO 0.59 0.00 0.03 -1.10 0.00 0.00 0.00 175.10 174.62 2wn9 s GLN 100 N -2.04 3.82 -0.15 2.72 -0.21 -0.62 -4.98 119.66 118.20 2wn9 s GLN 100 Ca 0.53 -0.43 -0.18 0.00 0.02 0.00 0.00 55.36 55.30 2wn9 s GLN 100 Cb -0.47 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.38 2wn9 s GLN 100 CO 0.63 0.19 0.49 0.08 -2.12 0.00 0.00 175.29 174.57 2wn9 s VAL 101 N 0.55 5.16 -0.52 1.09 1.01 -1.26 -0.91 120.40 125.52 2wn9 s VAL 101 Ca 0.01 0.96 0.17 0.00 0.00 0.00 0.00 61.98 63.11 2wn9 s VAL 101 Cb -0.13 -3.83 -0.21 0.00 0.00 0.00 0.00 36.38 32.21 2wn9 s VAL 101 CO 0.02 0.27 0.59 0.18 0.00 0.00 0.00 175.10 176.15 2wn9 n LEU 102 N 4.11 0.51 -4.48 3.92 4.77 0.68 -4.99 117.00 121.52 2wn9 n LEU 102 Ca -0.06 -0.33 -0.23 0.00 -0.03 0.00 0.00 56.01 55.36 2wn9 n LEU 102 Cb 0.51 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.50 2wn9 n LEU 102 CO 0.43 0.13 -0.31 -0.94 -1.33 0.00 0.00 177.39 175.36 2wn9 s SER 103 N -3.04 2.89 0.87 -1.43 1.04 -1.24 -4.95 113.70 107.84 2wn9 s SER 103 Ca 0.02 -1.30 -0.13 0.00 0.48 0.00 0.00 55.95 55.02 2wn9 s SER 103 Cb 0.12 -0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.12 2wn9 s SER 103 CO 0.69 -0.46 0.86 -2.65 0.98 0.00 0.00 173.24 172.66 2wn9 n PRO 104 N -0.71 -0.12 -3.92 4.02 -0.02 -1.26 -4.83 135.00 128.15 2wn9 n PRO 104 Ca -0.04 0.03 -0.30 0.00 -2.02 0.00 0.00 63.50 61.16 2wn9 n PRO 104 Cb 0.65 -2.17 -0.13 0.00 -0.02 0.00 0.00 33.50 31.84 2wn9 n PRO 104 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wn9 s GLN 105 N -3.94 2.14 -0.02 -0.52 -0.21 -1.26 -4.78 119.66 111.07 2wn9 s GLN 105 Ca 0.66 -2.77 0.02 0.00 0.02 0.00 0.00 55.36 53.29 2wn9 s GLN 105 Cb -0.26 -3.39 0.00 0.00 1.00 0.00 0.00 33.01 30.37 2wn9 s GLN 105 CO 0.59 -1.15 -0.08 0.42 -2.12 0.00 0.00 175.29 172.94 2wn9 s ILE 106 N -0.51 0.72 0.21 1.08 1.01 -1.26 -1.39 121.20 121.06 2wn9 s ILE 106 Ca 0.19 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.57 2wn9 s ILE 106 Cb -0.21 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 2wn9 s ILE 106 CO -0.03 0.23 0.15 0.00 0.00 0.00 0.00 174.94 175.28 2wn9 s ALA 107 N 0.18 3.54 -0.18 9.38 0.00 0.15 -4.57 121.76 130.27 2wn9 s ALA 107 Ca -0.03 -1.34 -0.02 0.00 0.00 0.00 0.00 51.96 50.57 2wn9 s ALA 107 Cb -0.08 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 2wn9 s ALA 107 CO 0.00 0.37 -0.08 0.08 0.00 0.00 0.00 175.76 176.14 2wn9 s VAL 108 N -1.96 3.32 -0.13 0.00 1.01 -0.33 -1.21 120.40 121.10 2wn9 s VAL 108 Ca 0.32 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 2wn9 s VAL 108 Cb -0.09 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 2wn9 s VAL 108 CO 0.24 0.47 -0.10 -0.69 0.00 0.00 0.00 175.10 175.03 2wn9 s VAL 109 N 0.87 3.38 0.16 2.92 1.01 0.11 -1.12 120.40 127.72 2wn9 s VAL 109 Ca -0.02 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2wn9 s VAL 109 Cb -0.15 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2wn9 s VAL 109 CO 0.01 0.52 -0.04 -0.89 0.00 0.00 0.00 175.10 174.70 2wn9 s THR 110 N 0.21 3.56 0.24 3.92 2.01 -0.17 -0.57 115.64 124.84 2wn9 s THR 110 Ca -0.06 -1.42 0.35 0.00 0.31 0.00 0.00 61.69 60.87 2wn9 s THR 110 Cb -0.15 -2.76 0.36 0.00 0.01 0.00 0.00 72.50 69.96 2wn9 s THR 110 CO 0.04 -0.06 2.06 1.12 -0.69 0.00 0.00 174.62 177.10 2wn9 h HIS 111 N 2.95 0.00 0.00 4.92 2.07 -1.42 0.53 115.15 124.20 2wn9 h HIS 111 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2wn9 h HIS 111 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 2wn9 h HIS 111 CO 0.62 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.08 2wn9 n ASP 112 N -2.77 0.00 0.00 3.10 5.75 -1.26 -1.34 116.55 120.02 2wn9 n ASP 112 Ca -0.02 -1.12 0.00 0.00 -0.01 0.00 0.00 54.79 53.65 2wn9 n ASP 112 Cb 0.11 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2wn9 n ASP 112 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wn9 n GLY 113 N 0.86 0.66 3.80 6.12 0.00 0.18 -4.74 105.19 112.06 2wn9 n GLY 113 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 2wn9 n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wn9 s SER 114 N -2.95 7.17 -0.06 1.61 1.04 -1.22 -1.20 113.70 118.09 2wn9 s SER 114 Ca 0.00 1.68 0.04 0.00 0.48 0.00 0.00 55.95 58.15 2wn9 s SER 114 Cb 0.00 -2.52 -0.00 0.00 0.10 0.00 0.00 66.02 63.59 2wn9 s SER 114 CO 0.00 -0.11 -0.19 -0.69 0.98 0.00 0.00 173.24 173.23 2wn9 s VAL 115 N -1.72 1.62 -0.13 5.02 1.01 0.11 -1.00 120.40 125.31 2wn9 s VAL 115 Ca 0.51 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.71 2wn9 s VAL 115 Cb -0.16 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.83 2wn9 s VAL 115 CO 0.21 0.46 -0.22 -0.32 0.00 0.00 0.00 175.10 175.23 2wn9 s MET 116 N 0.14 2.98 -0.05 2.72 0.00 -0.28 -2.26 119.30 122.56 2wn9 s MET 116 Ca -0.08 -0.84 -0.01 0.00 0.00 0.00 0.00 55.69 54.75 2wn9 s MET 116 Cb -0.14 -2.37 0.03 0.00 0.00 0.00 0.00 34.83 32.35 2wn9 s MET 116 CO 0.04 0.03 0.03 0.12 0.00 0.00 0.00 175.02 175.24 2wn9 s PHE 117 N 0.72 0.28 -0.51 4.11 5.36 -0.45 -1.19 117.98 126.29 2wn9 s PHE 117 Ca -0.10 0.09 0.06 0.00 -0.96 0.00 0.00 56.93 56.02 2wn9 s PHE 117 Cb -0.16 -0.56 0.20 0.00 -0.34 0.00 0.00 43.02 42.16 2wn9 s PHE 117 CO 0.00 -0.22 0.49 -0.89 -1.46 0.00 0.00 175.22 173.14 2wn9 n ILE 118 N 5.09 0.15 -2.38 3.12 5.41 -1.26 -1.02 119.36 128.47 2wn9 n ILE 118 Ca -0.08 -4.20 -0.40 0.00 1.00 0.00 0.00 62.75 59.07 2wn9 n ILE 118 Cb 0.50 -1.92 -0.04 0.00 -0.71 0.00 0.00 39.64 37.47 2wn9 n ILE 118 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2wn9 s PRO 119 N -1.02 4.56 0.10 0.38 0.04 -1.21 -4.74 135.00 133.11 2wn9 s PRO 119 Ca 0.33 1.90 -0.22 0.00 0.04 0.00 0.00 61.00 63.05 2wn9 s PRO 119 Cb 0.07 -3.17 -0.07 0.00 0.04 0.00 0.00 34.50 31.37 2wn9 s PRO 119 CO -0.14 0.09 0.66 0.00 0.04 0.00 0.00 177.00 177.66 2wn9 s ALA 120 N -1.03 3.52 0.03 8.56 0.00 -1.26 -1.41 121.76 130.16 2wn9 s ALA 120 Ca 0.46 0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.58 2wn9 s ALA 120 Cb -0.34 -2.79 -0.02 0.00 0.00 0.00 0.00 23.12 19.97 2wn9 s ALA 120 CO 0.43 0.33 0.02 -0.65 0.00 0.00 0.00 175.76 175.89 2wn9 s GLN 121 N -1.01 0.44 -0.16 0.00 -0.21 0.18 -0.23 119.66 118.67 2wn9 s GLN 121 Ca 0.32 -0.71 -0.01 0.00 0.02 0.00 0.00 55.36 54.98 2wn9 s GLN 121 Cb -0.21 0.17 -0.01 0.00 1.00 0.00 0.00 33.01 33.96 2wn9 s GLN 121 CO 0.22 -0.09 -0.11 0.50 -2.12 0.00 0.00 175.29 173.69 2wn9 s ARG 122 N -2.10 3.36 -0.09 2.91 3.52 -0.08 -1.60 118.95 124.86 2wn9 s ARG 122 Ca -0.10 -0.68 0.03 0.00 -0.13 0.00 0.00 55.73 54.86 2wn9 s ARG 122 Cb -0.05 -2.73 0.01 0.00 -1.56 0.00 0.00 34.95 30.62 2wn9 s ARG 122 CO -0.03 0.07 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.18 2wn9 s LEU 123 N 0.72 1.87 -0.18 -0.88 2.96 -0.02 -1.59 118.68 121.55 2wn9 s LEU 123 Ca -0.05 -0.44 -0.12 0.00 -0.22 0.00 0.00 54.13 53.30 2wn9 s LEU 123 Cb -0.15 -1.14 -0.05 0.00 0.50 0.00 0.00 46.19 45.35 2wn9 s LEU 123 CO 0.02 0.09 0.21 -0.44 -1.32 0.00 0.00 176.35 174.90 2wn9 s SER 124 N 0.59 6.31 0.13 3.68 0.01 -1.26 -0.57 113.70 122.59 2wn9 s SER 124 Ca -0.15 0.35 -0.05 0.00 1.31 0.00 0.00 55.95 57.41 2wn9 s SER 124 Cb -0.17 -2.13 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 2wn9 s SER 124 CO 0.05 0.13 0.15 0.72 0.41 0.00 0.00 173.24 174.70 2wn9 s PHE 125 N 0.45 0.53 -0.12 2.43 -0.12 -0.29 -0.74 117.98 120.14 2wn9 s PHE 125 Ca 0.12 -0.94 -0.29 0.00 -0.05 0.00 0.00 56.93 55.77 2wn9 s PHE 125 Cb -0.12 -0.25 -0.05 0.00 -0.63 0.00 0.00 43.02 41.98 2wn9 s PHE 125 CO 0.01 -0.58 1.70 -1.64 -0.05 0.00 0.00 175.22 174.66 2wn9 s MET 126 N -3.97 3.98 -0.29 1.99 -1.94 -0.80 -1.36 119.30 116.91 2wn9 s MET 126 Ca 0.16 2.02 -0.15 0.00 -1.71 0.00 0.00 55.69 56.02 2wn9 s MET 126 Cb 0.06 -4.04 0.10 0.00 2.01 0.00 0.00 34.83 32.96 2wn9 s MET 126 CO -0.03 -1.09 0.72 0.00 -0.01 0.00 0.00 175.02 174.62 2wn9 s ASP 128 N 1.86 6.24 -0.01 0.00 -1.08 -1.26 -2.98 116.67 119.45 2wn9 s ASP 128 Ca -0.09 -0.62 0.05 0.00 -0.52 0.00 0.00 52.55 51.38 2wn9 s ASP 128 Cb -0.06 -2.27 0.16 0.00 -1.46 0.00 0.00 42.92 39.29 2wn9 s ASP 128 CO -0.19 -0.71 1.09 -0.81 0.52 0.00 0.00 175.17 175.06 2wn9 n PRO 129 N 5.94 1.48 -1.65 4.34 -0.04 -1.26 -4.68 135.00 139.14 2wn9 n PRO 129 Ca -0.05 -0.66 -0.48 0.00 -0.04 0.00 0.00 63.50 62.27 2wn9 n PRO 129 Cb 0.47 -1.21 -0.05 0.00 -0.04 0.00 0.00 33.50 32.67 2wn9 n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2wn9 n THR 130 N 0.04 0.02 -0.04 0.52 -1.04 -1.26 -1.37 114.28 111.15 2wn9 n THR 130 Ca 0.06 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2wn9 n THR 130 Cb 0.19 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 2wn9 n THR 130 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wn9 n GLY 131 N 3.12 0.38 0.27 3.41 0.00 -1.26 -4.45 105.19 106.65 2wn9 n GLY 131 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2wn9 n GLY 131 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wn9 h VAL 132 N 0.00 0.73 -0.81 1.61 2.07 -1.41 -1.73 116.25 116.72 2wn9 h VAL 132 Ca 0.00 -0.30 -0.44 0.00 0.82 0.00 0.00 66.70 66.78 2wn9 h VAL 132 Cb 0.00 1.18 -0.25 0.00 -1.52 0.00 0.00 31.29 30.70 2wn9 h VAL 132 CO 0.00 0.08 0.56 -0.90 0.02 0.00 0.00 177.57 177.32 2wn9 n ASP 133 N -3.97 4.11 -4.33 0.57 5.75 -1.26 -0.92 116.55 116.50 2wn9 n ASP 133 Ca -0.03 -3.33 -0.17 0.00 -0.01 0.00 0.00 54.79 51.26 2wn9 n ASP 133 Cb 0.17 -0.81 -0.10 0.00 -1.03 0.00 0.00 41.12 39.35 2wn9 n ASP 133 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2wn9 s SER 134 N -0.89 1.97 0.32 -1.12 1.04 -0.66 -5.01 113.70 109.36 2wn9 s SER 134 Ca 0.47 -1.16 0.03 0.00 0.48 0.00 0.00 55.95 55.77 2wn9 s SER 134 Cb 0.39 -0.02 0.63 0.00 0.10 0.00 0.00 66.02 67.12 2wn9 s SER 134 CO 0.08 -0.44 1.91 -0.08 0.98 0.00 0.00 173.24 175.68 2wn9 h GLU 135 N 2.51 0.88 0.00 4.02 4.81 -1.91 -1.77 114.58 123.12 2wn9 h GLU 135 Ca -0.38 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2wn9 h GLU 135 Cb 1.22 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.40 2wn9 h GLU 135 CO 0.65 0.58 0.00 0.93 -0.73 0.00 0.00 179.01 180.43 2wn9 h GLU 136 N 0.90 0.00 0.00 1.92 5.08 -1.96 -3.50 114.58 117.03 2wn9 h GLU 136 Ca 0.39 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.78 2wn9 h GLU 136 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2wn9 h GLU 136 CO -0.16 0.00 -0.03 0.41 -1.00 0.00 0.00 179.01 178.23 2wn9 n GLY 137 N 0.80 -1.58 3.72 -3.84 0.00 -0.67 -4.84 105.19 98.78 2wn9 n GLY 137 Ca 0.04 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.59 2wn9 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wn9 s ALA 138 N -1.52 3.36 -0.05 4.61 0.00 -0.13 -4.29 121.76 123.73 2wn9 s ALA 138 Ca 0.00 -1.43 0.02 0.00 0.00 0.00 0.00 51.96 50.55 2wn9 s ALA 138 Cb 0.00 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 22.05 2wn9 s ALA 138 CO 0.00 0.36 -0.12 0.99 0.00 0.00 0.00 175.76 177.00 2wn9 s THR 139 N -2.00 1.06 0.18 0.00 2.01 -1.26 -1.29 115.64 114.34 2wn9 s THR 139 Ca 0.31 -0.46 0.01 0.00 0.31 0.00 0.00 61.69 61.85 2wn9 s THR 139 Cb -0.08 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.42 2wn9 s THR 139 CO 0.21 0.33 0.04 0.00 -0.69 0.00 0.00 174.62 174.51 2wn9 s ALA 141 N -3.78 -0.87 -0.15 0.00 0.00 -1.26 -1.02 121.76 114.69 2wn9 s ALA 141 Ca 0.27 0.33 -0.09 0.00 0.00 0.00 0.00 51.96 52.47 2wn9 s ALA 141 Cb 0.07 0.17 0.05 0.00 0.00 0.00 0.00 23.12 23.41 2wn9 s ALA 141 CO 0.06 -0.33 0.36 0.54 0.00 0.00 0.00 175.76 176.39 2wn9 s VAL 142 N -1.78 -0.02 0.05 0.00 0.11 -0.41 -4.91 120.40 113.44 2wn9 s VAL 142 Ca -0.10 0.08 -0.13 0.00 -2.93 0.00 0.00 61.98 58.90 2wn9 s VAL 142 Cb -0.03 -0.54 -0.06 0.00 -1.53 0.00 0.00 36.38 34.22 2wn9 s VAL 142 CO 0.02 0.03 0.43 -0.54 -3.33 0.00 0.00 175.10 171.71 2wn9 s LYS 143 N 1.06 3.89 -0.05 1.54 1.02 -1.26 -0.80 119.74 125.14 2wn9 s LYS 143 Ca -0.07 0.37 0.06 0.00 0.02 0.00 0.00 55.97 56.35 2wn9 s LYS 143 Cb -0.07 -3.12 -0.01 0.00 -0.52 0.00 0.00 37.83 34.11 2wn9 s LYS 143 CO -0.08 0.62 -0.24 -0.06 -0.92 0.00 0.00 175.35 174.67 2wn9 s PHE 144 N -1.23 2.31 0.13 3.18 0.08 0.21 -0.67 117.98 121.99 2wn9 s PHE 144 Ca 0.29 -0.66 -0.24 0.00 0.12 0.00 0.00 56.93 56.44 2wn9 s PHE 144 Cb -0.16 -1.51 0.08 0.00 -0.57 0.00 0.00 43.02 40.86 2wn9 s PHE 144 CO 0.16 -0.19 1.10 0.20 -0.10 0.00 0.00 175.22 176.39 2wn9 s GLY 145 N -0.19 0.03 0.47 4.36 0.00 -0.72 -0.53 107.32 110.74 2wn9 s GLY 145 Ca -0.02 -0.20 -0.24 0.00 0.00 0.00 0.00 44.72 44.26 2wn9 s GLY 145 CO 0.03 3.07 1.30 -0.45 0.00 0.00 0.00 173.10 177.05 2wn9 s SER 146 N -3.48 5.86 0.08 1.64 0.15 -1.26 -1.07 113.70 115.63 2wn9 s SER 146 Ca 0.23 2.64 -0.13 0.00 0.70 0.00 0.00 55.95 59.39 2wn9 s SER 146 Cb -0.02 -2.63 -0.21 0.00 -1.71 0.00 0.00 66.02 61.46 2wn9 s SER 146 CO 0.03 -1.16 1.22 -0.25 1.20 0.00 0.00 173.24 174.29 2wn9 h TRP 147 N 2.05 1.02 0.00 3.44 2.91 -1.82 -3.41 115.95 120.14 2wn9 h TRP 147 Ca -0.50 -0.54 0.00 0.00 1.13 0.00 0.00 58.89 58.98 2wn9 h TRP 147 Cb 1.27 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 29.79 2wn9 h TRP 147 CO 0.50 1.37 0.00 1.33 -1.03 0.00 0.00 178.44 180.61 2wn9 n VAL 148 N -3.86 0.00 -4.06 2.65 0.24 -1.26 -5.02 118.33 107.03 2wn9 n VAL 148 Ca -0.10 -0.42 -0.34 0.00 -2.04 0.00 0.00 64.34 61.43 2wn9 n VAL 148 Cb 0.86 1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 34.16 2wn9 n VAL 148 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 2wn9 s TYR 149 N -0.68 3.24 0.97 6.34 2.02 -1.26 -5.10 117.35 122.87 2wn9 s TYR 149 Ca 0.00 0.06 -0.16 0.00 -0.37 0.00 0.00 57.07 56.60 2wn9 s TYR 149 Cb 0.00 -2.05 0.19 0.00 -0.40 0.00 0.00 41.96 39.71 2wn9 s TYR 149 CO 0.00 0.17 1.26 -1.54 -1.57 0.00 0.00 175.55 173.88 2wn9 s SER 150 N 0.25 2.99 0.29 2.29 1.04 -1.26 -4.69 113.70 114.62 2wn9 s SER 150 Ca 0.03 0.43 0.22 0.00 0.48 0.00 0.00 55.95 57.11 2wn9 s SER 150 Cb -0.12 -0.59 1.08 0.00 0.10 0.00 0.00 66.02 66.49 2wn9 s SER 150 CO 0.01 -2.82 1.68 0.61 0.98 0.00 0.00 173.24 173.69 2wn9 n GLY 151 N -3.21 -1.03 0.23 7.32 0.00 0.26 -1.08 105.19 107.68 2wn9 n GLY 151 Ca 0.13 0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.45 2wn9 n GLY 151 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2wn9 h PHE 152 N 0.00 0.00 0.00 1.61 0.05 -1.93 -3.39 116.94 113.28 2wn9 h PHE 152 Ca 0.00 0.00 -0.20 0.00 3.82 0.00 0.00 57.97 61.59 2wn9 h PHE 152 Cb 0.15 0.00 -0.03 0.00 2.00 0.00 0.00 35.95 38.06 2wn9 h PHE 152 CO 0.00 0.00 -1.73 0.39 -0.18 0.00 0.00 178.31 176.79 2wn9 n GLU 153 N -3.01 0.31 -3.99 1.51 4.71 -0.41 -4.20 120.64 115.56 2wn9 n GLU 153 Ca 0.03 0.09 -0.30 0.00 -0.01 0.00 0.00 57.16 56.97 2wn9 n GLU 153 Cb 0.42 -1.17 -0.16 0.00 -1.01 0.00 0.00 31.44 29.52 2wn9 n GLU 153 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2wn9 s ILE 154 N -2.25 1.47 0.03 -3.67 1.01 -0.24 -1.10 121.20 116.45 2wn9 s ILE 154 Ca -0.18 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 59.76 2wn9 s ILE 154 Cb 0.05 -1.42 -0.05 0.00 0.01 0.00 0.00 42.46 41.05 2wn9 s ILE 154 CO 0.27 0.40 0.35 -0.62 0.00 0.00 0.00 174.94 175.34 2wn9 s ASP 155 N 1.52 6.61 0.07 3.58 2.15 -0.21 -3.90 116.67 126.48 2wn9 s ASP 155 Ca 0.04 0.73 0.07 0.00 0.43 0.00 0.00 52.55 53.82 2wn9 s ASP 155 Cb -0.13 -2.16 -0.04 0.00 -0.30 0.00 0.00 42.92 40.29 2wn9 s ASP 155 CO -0.10 0.24 -0.13 -0.76 -0.17 0.00 0.00 175.17 174.25 2wn9 s LEU 156 N -1.65 2.86 0.24 -1.34 1.43 -1.26 -0.18 118.68 118.77 2wn9 s LEU 156 Ca 0.28 -0.38 -0.17 0.00 -1.03 0.00 0.00 54.13 52.83 2wn9 s LEU 156 Cb -0.14 -1.68 0.01 0.00 0.03 0.00 0.00 46.19 44.42 2wn9 s LEU 156 CO 0.16 0.22 0.57 -1.59 0.23 0.00 0.00 176.35 175.94 2wn9 s LYS 157 N -1.79 1.57 0.17 1.70 -2.85 -0.56 -4.93 119.74 113.05 2wn9 s LYS 157 Ca 0.18 -1.05 0.11 0.00 -1.00 0.00 0.00 55.97 54.21 2wn9 s LYS 157 Cb -0.11 0.53 -0.04 0.00 -2.06 0.00 0.00 37.83 36.15 2wn9 s LYS 157 CO 0.09 -0.68 -0.25 0.95 0.10 0.00 0.00 175.35 175.56 2wn9 s THR 158 N -3.94 2.30 0.04 3.79 -4.23 -1.26 -0.41 115.64 111.93 2wn9 s THR 158 Ca 0.15 -1.94 0.09 0.00 -1.18 0.00 0.00 61.69 58.81 2wn9 s THR 158 Cb -0.02 -2.07 -0.14 0.00 1.34 0.00 0.00 72.50 71.61 2wn9 s THR 158 CO 0.05 -0.05 1.30 0.44 -0.54 0.00 0.00 174.62 175.81 2wn9 h ASP 159 N 3.43 0.00 -5.02 3.99 3.32 -1.97 -3.47 116.42 116.71 2wn9 h ASP 159 Ca -0.48 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.46 2wn9 h ASP 159 Cb 1.20 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.56 2wn9 h ASP 159 CO 0.45 0.86 -0.27 0.28 -1.72 0.00 0.00 179.24 178.84 2wn9 s THR 160 N -2.78 0.07 -2.27 0.35 -1.32 -1.26 -5.04 115.64 103.40 2wn9 s THR 160 Ca 0.02 -0.58 0.29 0.00 -1.21 0.00 0.00 61.69 60.21 2wn9 s THR 160 Cb 0.09 -0.75 0.60 0.00 -1.51 0.00 0.00 72.50 70.94 2wn9 s THR 160 CO 0.80 -0.32 1.85 -0.90 -2.21 0.00 0.00 174.62 173.84 2wn9 n ASP 161 N 0.98 1.05 -4.59 8.08 5.75 -1.26 -4.78 116.55 121.78 2wn9 n ASP 161 Ca -0.20 -1.27 -0.42 0.00 -0.01 0.00 0.00 54.79 52.89 2wn9 n ASP 161 Cb 0.57 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.61 2wn9 n ASP 161 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2wn9 s GLN 162 N -2.07 3.80 0.42 0.11 -1.52 -1.26 -0.67 119.66 118.46 2wn9 s GLN 162 Ca 0.39 0.24 -0.26 0.00 -1.95 0.00 0.00 55.36 53.77 2wn9 s GLN 162 Cb 0.21 -3.77 -0.10 0.00 -0.22 0.00 0.00 33.01 29.13 2wn9 s GLN 162 CO 0.37 -0.69 1.46 0.28 -0.25 0.00 0.00 175.29 176.46 2wn9 n VAL 163 N 5.54 2.45 -2.28 1.09 0.31 -0.90 -4.89 118.33 119.65 2wn9 n VAL 163 Ca 0.00 -0.50 -0.43 0.00 -0.01 0.00 0.00 64.34 63.40 2wn9 n VAL 163 Cb 0.49 -1.90 -0.02 0.00 -0.91 0.00 0.00 33.84 31.49 2wn9 n VAL 163 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2wn9 s ASP 164 N -0.32 6.36 -0.01 4.52 3.68 -0.62 -4.86 116.67 125.43 2wn9 s ASP 164 Ca 0.58 1.09 0.14 0.00 2.13 0.00 0.00 52.55 56.49 2wn9 s ASP 164 Cb -0.46 -2.54 0.39 0.00 -1.45 0.00 0.00 42.92 38.87 2wn9 s ASP 164 CO 0.60 -1.36 1.33 0.18 0.13 0.00 0.00 175.17 176.05 2wn9 n LEU 165 N 8.68 3.21 0.17 -1.34 4.77 -1.26 -1.97 117.00 129.26 2wn9 n LEU 165 Ca 0.17 -2.03 0.13 0.00 -0.03 0.00 0.00 56.01 54.25 2wn9 n LEU 165 Cb 0.47 -0.30 0.59 0.00 -2.33 0.00 0.00 43.42 41.85 2wn9 n LEU 165 CO 0.68 0.79 0.88 0.77 -1.33 0.00 0.00 177.39 179.17 2wn9 h SER 166 N 2.56 0.00 -0.08 -1.43 4.64 -1.89 -2.07 113.55 115.28 2wn9 h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wn9 h SER 166 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2wn9 h SER 166 CO 0.01 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.77 2wn9 n SER 167 N -2.37 2.44 -4.72 4.97 7.64 -1.26 -5.03 113.62 115.29 2wn9 n SER 167 Ca 0.00 -2.41 -0.42 0.00 1.01 0.00 0.00 58.87 57.05 2wn9 n SER 167 Cb 0.15 -0.21 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 2wn9 n SER 167 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2wn9 s TYR 168 N -1.72 3.16 -0.03 1.43 5.04 -0.78 -4.59 117.35 119.86 2wn9 s TYR 168 Ca 0.17 0.87 -0.30 0.00 -2.44 0.00 0.00 57.07 55.38 2wn9 s TYR 168 Cb 0.13 -3.78 -0.07 0.00 0.35 0.00 0.00 41.96 38.59 2wn9 s TYR 168 CO 0.04 -2.73 1.95 -0.47 -1.34 0.00 0.00 175.55 173.00 2wn9 s TYR 169 N 0.90 1.40 0.47 4.97 5.04 0.40 -4.87 117.35 125.66 2wn9 s TYR 169 Ca 0.65 -0.15 0.21 0.00 -2.44 0.00 0.00 57.07 55.35 2wn9 s TYR 169 Cb -0.40 -4.13 1.32 0.00 0.35 0.00 0.00 41.96 39.10 2wn9 s TYR 169 CO 0.33 -4.94 2.08 0.00 -1.34 0.00 0.00 175.55 171.67 2wn9 h ALA 170 N 11.22 1.56 -0.34 3.97 0.00 -1.90 -2.35 119.26 131.42 2wn9 h ALA 170 Ca -0.46 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.27 2wn9 h ALA 170 Cb 1.22 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 2wn9 h ALA 170 CO 0.95 0.14 0.02 0.43 0.00 0.00 0.00 179.25 180.79 2wn9 n SER 171 N -4.03 3.61 -4.60 0.00 7.64 -1.26 -5.03 113.62 109.95 2wn9 n SER 171 Ca -0.02 -3.25 -0.36 0.00 1.01 0.00 0.00 58.87 56.25 2wn9 n SER 171 Cb 0.20 -0.59 0.08 0.00 -1.01 0.00 0.00 64.21 62.88 2wn9 n SER 171 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2wn9 n SER 172 N -0.65 0.33 0.27 6.43 2.88 -0.89 -4.88 113.62 117.12 2wn9 n SER 172 Ca 0.27 0.68 0.18 0.00 -1.33 0.00 0.00 58.87 58.68 2wn9 n SER 172 Cb 0.99 -1.38 0.87 0.00 -0.75 0.00 0.00 64.21 63.94 2wn9 n SER 172 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2wn9 h LYS 173 N -0.13 0.00 -5.47 -1.46 1.79 -1.91 -3.43 116.57 105.96 2wn9 h LYS 173 Ca -0.47 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.43 2wn9 h LYS 173 Cb 1.34 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.69 2wn9 h LYS 173 CO 0.47 0.00 -0.84 0.71 -1.08 0.00 0.00 179.45 178.71 2wn9 s TYR 174 N -3.81 1.70 0.06 -1.35 1.51 -1.26 -1.58 117.35 112.62 2wn9 s TYR 174 Ca -0.01 -0.43 -0.15 0.00 -1.01 0.00 0.00 57.07 55.47 2wn9 s TYR 174 Cb 0.10 -1.13 -0.06 0.00 -0.11 0.00 0.00 41.96 40.77 2wn9 s TYR 174 CO 0.44 -0.12 0.47 -2.00 -1.11 0.00 0.00 175.55 173.22 2wn9 s GLU 175 N -0.13 3.96 -0.23 -0.62 2.12 0.40 -4.80 118.70 119.40 2wn9 s GLU 175 Ca -0.00 0.45 -0.16 0.00 0.36 0.00 0.00 54.97 55.62 2wn9 s GLU 175 Cb -0.10 -3.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.13 2wn9 s GLU 175 CO 0.01 0.62 0.42 0.42 -0.54 0.00 0.00 175.26 176.19 2wn9 s ILE 176 N -1.22 5.17 -0.07 -3.70 -1.09 -1.26 -1.43 121.20 117.60 2wn9 s ILE 176 Ca 0.29 0.72 -0.04 0.00 -2.23 0.00 0.00 60.65 59.39 2wn9 s ILE 176 Cb -0.16 -3.74 -0.27 0.00 -1.58 0.00 0.00 42.46 36.70 2wn9 s ILE 176 CO 0.16 0.20 0.56 -0.07 -1.23 0.00 0.00 174.94 174.57 2wn9 h LEU 177 N 8.05 0.40 -7.00 2.97 3.38 -1.14 -3.49 115.31 118.48 2wn9 h LEU 177 Ca -0.34 -0.74 0.02 0.00 0.09 0.00 0.00 57.88 56.91 2wn9 h LEU 177 Cb 1.16 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 41.62 2wn9 h LEU 177 CO 0.70 1.65 0.33 -0.94 0.09 0.00 0.00 178.44 180.27 2wn9 s SER 178 N -6.95 -0.51 -0.20 -0.43 1.04 -1.11 -4.99 113.70 100.54 2wn9 s SER 178 Ca -0.16 0.23 -0.07 0.00 0.48 0.00 0.00 55.95 56.44 2wn9 s SER 178 Cb 0.07 0.48 0.09 0.00 0.10 0.00 0.00 66.02 66.76 2wn9 s SER 178 CO 0.81 -0.69 0.42 0.00 0.98 0.00 0.00 173.24 174.76 2wn9 s ALA 179 N -2.57 -1.17 0.16 5.32 0.00 -1.26 -0.97 121.76 121.27 2wn9 s ALA 179 Ca -0.01 1.48 0.07 0.00 0.00 0.00 0.00 51.96 53.50 2wn9 s ALA 179 Cb -0.01 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2wn9 s ALA 179 CO -0.04 -0.79 -0.16 0.95 0.00 0.00 0.00 175.76 175.72 2wn9 s THR 180 N 2.62 1.62 -0.17 0.00 -4.23 -0.47 -2.12 115.64 112.87 2wn9 s THR 180 Ca -0.01 -1.93 -0.03 0.00 -1.18 0.00 0.00 61.69 58.54 2wn9 s THR 180 Cb -0.12 -1.79 0.06 0.00 1.34 0.00 0.00 72.50 71.98 2wn9 s THR 180 CO -0.13 -0.43 0.05 0.00 -0.54 0.00 0.00 174.62 173.57 2wn9 s GLN 181 N -3.00 0.45 -0.07 3.99 -2.07 0.15 -1.24 119.66 117.87 2wn9 s GLN 181 Ca 0.15 -0.25 0.01 0.00 -1.82 0.00 0.00 55.36 53.45 2wn9 s GLN 181 Cb -0.04 -1.88 0.02 0.00 -1.09 0.00 0.00 33.01 30.02 2wn9 s GLN 181 CO 0.05 -0.61 -0.09 0.99 -1.32 0.00 0.00 175.29 174.31 2wn9 s THR 182 N 1.96 0.98 0.25 3.63 2.01 -0.65 -4.24 115.64 119.58 2wn9 s THR 182 Ca 0.01 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 2wn9 s THR 182 Cb -0.16 -0.94 -0.09 0.00 0.01 0.00 0.00 72.50 71.31 2wn9 s THR 182 CO -0.08 0.33 1.32 -0.60 -0.69 0.00 0.00 174.62 174.90 2wn9 s ARG 183 N 1.00 4.38 -0.03 4.92 3.52 -1.26 -0.78 118.95 130.69 2wn9 s ARG 183 Ca -0.09 2.12 0.04 0.00 -0.13 0.00 0.00 55.73 57.68 2wn9 s ARG 183 Cb -0.15 -3.15 -0.00 0.00 -1.56 0.00 0.00 34.95 30.09 2wn9 s ARG 183 CO -0.00 -0.23 -0.15 -0.65 -0.81 0.00 0.00 175.30 173.45 2wn9 s GLN 184 N -0.69 1.54 -0.15 5.12 -0.21 0.42 -4.94 119.66 120.75 2wn9 s GLN 184 Ca 0.54 -0.54 -0.02 0.00 0.02 0.00 0.00 55.36 55.36 2wn9 s GLN 184 Cb -0.38 -1.37 -0.02 0.00 1.00 0.00 0.00 33.01 32.24 2wn9 s GLN 184 CO 0.43 0.24 -0.09 0.08 -2.12 0.00 0.00 175.29 173.82 2wn9 s VAL 185 N 0.00 3.33 -0.06 1.09 1.01 -1.26 -1.68 120.40 122.83 2wn9 s VAL 185 Ca -0.02 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.44 2wn9 s VAL 185 Cb -0.10 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2wn9 s VAL 185 CO 0.01 0.50 -0.16 -1.10 0.00 0.00 0.00 175.10 174.35 2wn9 s GLN 186 N 0.51 2.63 0.10 2.72 -0.21 0.87 -4.96 119.66 121.31 2wn9 s GLN 186 Ca -0.07 -0.74 0.06 0.00 0.02 0.00 0.00 55.36 54.63 2wn9 s GLN 186 Cb -0.15 -2.37 -0.04 0.00 1.00 0.00 0.00 33.01 31.45 2wn9 s GLN 186 CO 0.04 0.52 -0.06 -1.01 -2.12 0.00 0.00 175.29 172.66 2wn9 s HIS 187 N -0.46 2.85 -1.00 0.91 3.76 -1.26 -0.73 115.29 119.36 2wn9 s HIS 187 Ca 0.06 -0.10 0.26 0.00 -0.15 0.00 0.00 55.06 55.12 2wn9 s HIS 187 Cb -0.12 -1.48 1.09 0.00 1.11 0.00 0.00 32.58 33.18 2wn9 s HIS 187 CO 0.02 0.45 1.82 -0.35 -0.85 0.00 0.00 174.74 175.83 2wn9 n PRO 192 N 0.67 0.00 -3.28 8.40 -0.04 -1.26 -5.05 135.00 134.45 2wn9 n PRO 192 Ca -0.12 0.06 -0.33 0.00 -0.04 0.00 0.00 63.50 63.07 2wn9 n PRO 192 Cb 0.52 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 2wn9 n PRO 192 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2wn9 s GLU 193 N -3.00 3.94 0.40 0.54 1.03 -1.26 -5.06 118.70 115.28 2wn9 s GLU 193 Ca 0.12 0.50 -0.24 0.00 0.03 0.00 0.00 54.97 55.38 2wn9 s GLU 193 Cb 0.17 -2.61 -0.09 0.00 -0.80 0.00 0.00 34.13 30.79 2wn9 s GLU 193 CO 0.47 0.28 1.04 -1.25 -1.33 0.00 0.00 175.26 174.47 2wn9 s PRO 194 N -2.72 4.17 -0.07 -4.83 0.04 -1.26 -4.93 135.00 125.41 2wn9 s PRO 194 Ca 0.49 1.49 0.05 0.00 0.04 0.00 0.00 61.00 63.07 2wn9 s PRO 194 Cb -0.12 -2.53 -0.01 0.00 0.04 0.00 0.00 34.50 31.88 2wn9 s PRO 194 CO 0.19 -0.13 -0.23 0.71 0.04 0.00 0.00 177.00 177.59 2wn9 s TYR 195 N -1.68 2.51 -0.03 0.56 2.02 0.09 -0.58 117.35 120.24 2wn9 s TYR 195 Ca 0.58 -0.67 0.06 0.00 -0.37 0.00 0.00 57.07 56.67 2wn9 s TYR 195 Cb -0.21 -1.63 -0.01 0.00 -0.40 0.00 0.00 41.96 39.70 2wn9 s TYR 195 CO 0.27 -0.18 -0.22 0.42 -1.57 0.00 0.00 175.55 174.27 2wn9 s ILE 196 N -0.15 1.72 0.18 2.71 -1.09 -1.26 -0.09 121.20 123.23 2wn9 s ILE 196 Ca -0.04 -0.92 -0.03 0.00 -2.23 0.00 0.00 60.65 57.44 2wn9 s ILE 196 Cb -0.14 -1.44 -0.03 0.00 -1.58 0.00 0.00 42.46 39.27 2wn9 s ILE 196 CO 0.04 0.49 0.16 1.51 -1.23 0.00 0.00 174.94 175.90 2wn9 s ASP 197 N -0.38 0.16 -0.19 3.58 -4.77 -0.67 -4.52 116.67 109.88 2wn9 s ASP 197 Ca 0.05 -1.24 -0.01 0.00 -3.30 0.00 0.00 52.55 48.05 2wn9 s ASP 197 Cb -0.10 0.38 0.00 0.00 -1.09 0.00 0.00 42.92 42.12 2wn9 s ASP 197 CO 0.00 -0.84 -0.12 -0.69 0.70 0.00 0.00 175.17 174.22 2wn9 s VAL 198 N -4.09 2.80 -0.37 2.11 1.01 0.31 -0.44 120.40 121.73 2wn9 s VAL 198 Ca 0.31 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 2wn9 s VAL 198 Cb 0.06 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.22 2wn9 s VAL 198 CO 0.07 0.49 0.48 0.21 0.00 0.00 0.00 175.10 176.35 2wn9 s ASN 199 N 1.17 6.27 -0.31 3.32 2.47 0.04 -0.62 114.94 127.27 2wn9 s ASN 199 Ca 0.01 -0.21 -0.21 0.00 0.42 0.00 0.00 52.86 52.88 2wn9 s ASN 199 Cb -0.14 -2.25 -0.01 0.00 -1.45 0.00 0.00 41.25 37.40 2wn9 s ASN 199 CO -0.04 -0.49 0.67 -0.22 -3.72 0.00 0.00 177.10 173.29 2wn9 s LEU 200 N 2.31 4.14 -0.18 3.21 2.96 0.02 -1.63 118.68 129.51 2wn9 s LEU 200 Ca 0.16 0.45 0.01 0.00 -0.22 0.00 0.00 54.13 54.53 2wn9 s LEU 200 Cb -0.16 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.68 2wn9 s LEU 200 CO 0.13 -0.52 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.77 2wn9 s VAL 201 N 2.70 1.97 -0.12 1.68 1.01 -0.37 -1.29 120.40 125.98 2wn9 s VAL 201 Ca 0.27 -0.91 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2wn9 s VAL 201 Cb -0.15 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2wn9 s VAL 201 CO 0.12 0.50 -0.17 -0.69 0.00 0.00 0.00 175.10 174.86 2wn9 s VAL 202 N 1.32 1.67 -0.18 2.92 1.01 -0.19 -1.37 120.40 125.58 2wn9 s VAL 202 Ca 0.04 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 2wn9 s VAL 202 Cb -0.13 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2wn9 s VAL 202 CO -0.12 0.48 0.04 -0.54 0.00 0.00 0.00 175.10 174.96 2wn9 s LYS 203 N 0.93 3.89 0.11 2.72 1.02 -0.14 -1.55 119.74 126.71 2wn9 s LYS 203 Ca -0.07 -0.39 -0.11 0.00 0.02 0.00 0.00 55.97 55.42 2wn9 s LYS 203 Cb -0.15 -3.16 0.01 0.00 -0.52 0.00 0.00 37.83 34.00 2wn9 s LYS 203 CO -0.02 0.23 0.26 -0.59 -0.92 0.00 0.00 175.35 174.32 2wn9 s PHE 204 N 0.47 0.07 0.11 3.18 -0.12 -0.41 -0.49 117.98 120.79 2wn9 s PHE 204 Ca 0.02 -0.46 -0.18 0.00 -0.05 0.00 0.00 56.93 56.26 2wn9 s PHE 204 Cb -0.13 0.04 0.04 0.00 -0.63 0.00 0.00 43.02 42.34 2wn9 s PHE 204 CO 0.01 -0.61 0.43 -0.98 -0.05 0.00 0.00 175.22 174.02 2wn9 s ARG 205 N -3.85 1.06 0.16 1.99 1.70 -0.51 -0.95 118.95 118.54 2wn9 s ARG 205 Ca 0.06 -0.58 -0.33 0.00 -0.47 0.00 0.00 55.73 54.40 2wn9 s ARG 205 Cb 0.04 0.47 -0.13 0.00 -0.57 0.00 0.00 34.95 34.76 2wn9 s ARG 205 CO -0.10 -0.41 1.63 0.39 -1.08 0.00 0.00 175.30 175.73 2wn9 n GLU 206 N -0.06 2.32 -1.91 3.89 1.02 -0.10 -0.45 120.64 125.35 2wn9 n GLU 206 Ca -0.17 0.84 -0.43 0.00 -0.02 0.00 0.00 57.16 57.38 2wn9 n GLU 206 Cb 0.63 -2.63 -0.03 0.00 -0.02 0.00 0.00 31.44 29.39 2wn9 n GLU 206 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2wn9 s ARG 207 N 1.14 3.35 0.00 3.49 3.52 -0.61 -4.70 118.95 125.14 2wn9 s ARG 207 Ca 0.78 1.62 0.20 0.00 -0.13 0.00 0.00 55.73 58.21 2wn9 s ARG 207 Cb -0.63 -4.22 1.22 0.00 -1.56 0.00 0.00 34.95 29.75 2wn9 s ARG 207 CO 0.37 -1.84 1.60 0.54 -0.81 0.00 0.00 175.30 175.17