#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn9 h HIS 1 N 0.00 0.48 -0.49 -1.77 3.86 -2.05 0.67 115.15 115.85 2wn9 h HIS 1 Ca 0.00 -0.07 -0.07 0.00 -1.16 0.00 0.00 60.37 59.07 2wn9 h HIS 1 Cb 0.00 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 2wn9 h HIS 1 CO 0.00 0.57 0.04 0.66 0.86 0.00 0.00 177.93 180.06 2wn9 h SER 2 N 0.42 0.81 -0.42 2.45 4.64 -1.99 -0.05 113.55 119.41 2wn9 h SER 2 Ca 0.08 -0.29 -0.02 0.00 -0.47 0.00 0.00 61.79 61.09 2wn9 h SER 2 Cb 0.49 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 2wn9 h SER 2 CO 0.03 0.89 0.18 1.56 -0.87 0.00 0.00 176.83 178.62 2wn9 h GLN 3 N 0.70 0.62 -0.56 4.77 4.20 -1.96 -2.03 115.11 120.86 2wn9 h GLN 3 Ca 0.14 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2wn9 h GLN 3 Cb 0.45 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 2wn9 h GLN 3 CO 0.02 0.57 0.34 0.00 -0.67 0.00 0.00 178.83 179.08 2wn9 h ALA 4 N 1.02 0.71 -0.79 3.87 0.00 -0.78 -0.76 119.26 122.54 2wn9 h ALA 4 Ca 0.14 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2wn9 h ALA 4 Cb 0.17 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2wn9 h ALA 4 CO -0.01 0.19 0.50 -0.91 0.00 0.00 0.00 179.25 179.02 2wn9 h ASN 5 N 0.75 0.83 -0.26 0.00 2.35 -0.81 0.10 115.58 118.54 2wn9 h ASN 5 Ca 0.20 -0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.81 2wn9 h ASN 5 Cb -0.02 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 2wn9 h ASN 5 CO -0.04 0.57 -0.39 0.25 -1.65 0.00 0.00 177.43 176.17 2wn9 h LEU 6 N 0.97 0.80 -1.07 1.61 5.85 -1.11 -0.92 115.31 121.44 2wn9 h LEU 6 Ca 0.32 -0.51 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2wn9 h LEU 6 Cb 0.02 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 2wn9 h LEU 6 CO -0.11 1.15 0.26 0.24 -0.34 0.00 0.00 178.44 179.64 2wn9 h MET 7 N 0.47 0.92 -0.23 1.25 2.86 -0.91 -1.03 114.93 118.26 2wn9 h MET 7 Ca 0.03 -0.14 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 2wn9 h MET 7 Cb 0.98 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 2wn9 h MET 7 CO 0.09 0.75 -0.04 -0.09 1.06 0.00 0.00 176.91 178.68 2wn9 h ARG 8 N 0.91 0.43 -0.16 1.72 2.43 -0.86 -0.57 114.38 118.27 2wn9 h ARG 8 Ca 0.22 -0.16 0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2wn9 h ARG 8 Cb 0.16 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 2wn9 h ARG 8 CO -0.02 0.65 -0.09 1.25 -1.51 0.00 0.00 179.97 180.25 2wn9 h LEU 9 N 0.17 -0.30 -0.65 3.80 5.85 -0.91 0.16 115.31 123.43 2wn9 h LEU 9 Ca 0.06 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2wn9 h LEU 9 Cb 0.48 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2wn9 h LEU 9 CO 0.02 -0.12 0.34 0.11 -0.34 0.00 0.00 178.44 178.45 2wn9 h LYS 10 N -0.08 0.93 -0.53 1.25 1.57 -1.05 -0.56 116.57 118.10 2wn9 h LYS 10 Ca 0.09 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2wn9 h LYS 10 Cb 0.22 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2wn9 h LYS 10 CO -0.22 0.72 0.24 1.03 -0.57 0.00 0.00 179.45 180.65 2wn9 h SER 11 N 0.90 0.70 -0.62 0.86 0.87 -0.88 0.13 113.55 115.51 2wn9 h SER 11 Ca 0.23 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2wn9 h SER 11 Cb 0.08 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 2wn9 h SER 11 CO -0.03 0.65 0.38 0.44 -0.53 0.00 0.00 176.83 177.74 2wn9 h ASP 12 N 0.71 0.74 -0.18 6.23 3.32 -0.31 0.45 116.42 127.38 2wn9 h ASP 12 Ca 0.18 -0.05 -0.22 0.00 0.02 0.00 0.00 57.03 56.96 2wn9 h ASP 12 Cb 0.15 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.52 2wn9 h ASP 12 CO -0.02 0.58 -0.74 -0.07 -1.72 0.00 0.00 179.24 177.27 2wn9 h LEU 13 N 0.84 0.96 0.00 1.55 3.38 -0.87 -2.95 115.31 118.23 2wn9 h LEU 13 Ca 0.22 -0.61 -0.14 0.00 0.09 0.00 0.00 57.88 57.44 2wn9 h LEU 13 Cb -0.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2wn9 h LEU 13 CO -0.04 1.41 -2.02 0.49 0.09 0.00 0.00 178.44 178.37 2wn9 n PHE 14 N -3.95 0.16 -0.06 1.13 0.99 0.43 -4.39 117.46 111.77 2wn9 n PHE 14 Ca -0.07 0.05 -0.09 0.00 -0.00 0.00 0.00 57.45 57.34 2wn9 n PHE 14 Cb 0.73 -0.76 -0.06 0.00 -1.00 0.00 0.00 39.48 38.39 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 -2.52 2.71 0.02 4.37 5.03 0.15 -4.79 115.26 120.24 2wn9 n ASN 15 Ca -0.14 -0.03 0.12 0.00 0.87 0.00 0.00 54.58 55.40 2wn9 n ASN 15 Cb 0.80 -0.23 0.30 0.00 -1.02 0.00 0.00 39.78 39.63 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 -2.98 0.08 -4.46 3.52 1.74 -0.91 -4.82 116.66 108.82 2wn9 n ARG 16 Ca -0.23 0.03 -0.22 0.00 -0.77 0.00 0.00 57.85 56.66 2wn9 n ARG 16 Cb 0.73 -1.55 -0.14 0.00 -1.02 0.00 0.00 32.46 30.48 2wn9 n ARG 16 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2wn9 s SER 17 N -3.33 2.05 1.04 0.55 0.01 -1.13 -5.04 113.70 107.85 2wn9 s SER 17 Ca 0.10 -0.50 -0.18 0.00 1.31 0.00 0.00 55.95 56.68 2wn9 s SER 17 Cb 0.17 -0.15 0.02 0.00 0.21 0.00 0.00 66.02 66.27 2wn9 s SER 17 CO 0.67 0.09 -0.17 -2.65 0.41 0.00 0.00 173.24 171.59 2wn9 n PRO 18 N 1.82 -0.85 -2.43 12.44 -0.02 -1.26 -4.67 135.00 140.03 2wn9 n PRO 18 Ca -0.18 -0.23 -0.38 0.00 -2.02 0.00 0.00 63.50 60.70 2wn9 n PRO 18 Cb 0.54 -1.58 -0.03 0.00 -0.02 0.00 0.00 33.50 32.40 2wn9 n PRO 18 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2wn9 s MET 19 N -3.17 4.21 -0.34 -0.52 -1.94 -1.26 -5.01 119.30 111.27 2wn9 s MET 19 Ca 0.52 1.70 -0.25 0.00 -1.71 0.00 0.00 55.69 55.94 2wn9 s MET 19 Cb -0.12 -2.72 0.01 0.00 2.01 0.00 0.00 34.83 34.01 2wn9 s MET 19 CO 0.68 -0.15 0.89 -0.47 -0.01 0.00 0.00 175.02 175.96 2wn9 s TYR 20 N -1.47 3.13 -1.63 -0.03 5.04 -1.26 -4.96 117.35 116.17 2wn9 s TYR 20 Ca 0.55 0.81 0.02 0.00 -2.44 0.00 0.00 57.07 56.01 2wn9 s TYR 20 Cb -0.27 -3.51 0.07 0.00 0.35 0.00 0.00 41.96 38.60 2wn9 s TYR 20 CO 0.34 -0.74 0.90 -0.35 -1.34 0.00 0.00 175.55 174.37 2wn9 n PRO 21 N 6.59 1.23 0.00 4.97 -0.04 -1.26 -4.87 135.00 141.61 2wn9 n PRO 21 Ca 0.06 -0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2wn9 n PRO 21 Cb 0.48 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 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 0.42 -0.66 3.81 0.55 0.00 -1.26 -5.01 105.19 103.04 2wn9 n GLY 22 Ca 0.02 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 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 -2.25 2.95 0.27 1.61 0.04 -1.26 -5.03 135.00 131.32 2wn9 s PRO 23 Ca 0.00 1.05 -0.02 0.00 0.04 0.00 0.00 61.00 62.07 2wn9 s PRO 23 Cb 0.00 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2wn9 s PRO 23 CO 0.00 -1.09 0.31 0.95 0.04 0.00 0.00 177.00 177.20 2wn9 s THR 24 N -2.87 0.00 0.44 1.26 -4.23 -0.93 -4.98 115.64 104.34 2wn9 s THR 24 Ca 0.60 -1.80 0.15 0.00 -1.18 0.00 0.00 61.69 59.46 2wn9 s THR 24 Cb -0.15 -2.48 0.34 0.00 1.34 0.00 0.00 72.50 71.55 2wn9 s THR 24 CO 0.50 0.00 1.97 0.07 -0.54 0.00 0.00 174.62 176.62 2wn9 h LYS 25 N 2.33 0.38 0.00 3.99 2.10 -1.91 -1.44 116.57 122.02 2wn9 h LYS 25 Ca -0.30 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 2wn9 h LYS 25 Cb 1.24 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 2wn9 h LYS 25 CO 0.43 0.25 -0.71 -0.25 -2.00 0.00 0.00 179.45 177.17 2wn9 n ASP 26 N -4.47 0.68 -3.15 7.07 8.00 -1.26 -4.40 116.55 119.02 2wn9 n ASP 26 Ca 0.11 0.06 -0.21 0.00 0.71 0.00 0.00 54.79 55.45 2wn9 n ASP 26 Cb 0.41 0.29 -0.05 0.00 -0.02 0.00 0.00 41.12 41.75 2wn9 n ASP 26 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2wn9 n ASP 27 N -2.08 0.10 -4.87 -2.24 2.03 -0.76 -5.14 116.55 103.59 2wn9 n ASP 27 Ca 0.03 -2.84 -0.30 0.00 0.52 0.00 0.00 54.79 52.20 2wn9 n ASP 27 Cb 0.44 -0.42 0.06 0.00 -0.72 0.00 0.00 41.12 40.48 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 -1.38 2.55 -0.01 -0.67 0.04 -0.61 -2.18 135.00 132.73 2wn9 s PRO 28 Ca 0.36 0.42 0.03 0.00 0.04 0.00 0.00 61.00 61.86 2wn9 s PRO 28 Cb 0.23 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 2wn9 s PRO 28 CO -0.11 -1.25 -0.11 -1.17 0.04 0.00 0.00 177.00 174.40 2wn9 s LEU 29 N -5.48 2.00 -0.21 -3.56 2.96 -0.20 -4.92 118.68 109.26 2wn9 s LEU 29 Ca 0.59 -0.21 -0.09 0.00 -0.22 0.00 0.00 54.13 54.20 2wn9 s LEU 29 Cb -0.12 -0.60 -0.04 0.00 0.50 0.00 0.00 46.19 45.93 2wn9 s LEU 29 CO 0.52 0.13 0.11 -0.89 -1.32 0.00 0.00 176.35 174.90 2wn9 s THR 30 N -0.22 5.06 -0.17 3.68 2.01 -1.26 -0.85 115.64 123.88 2wn9 s THR 30 Ca 0.03 0.07 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 2wn9 s THR 30 Cb -0.05 -3.32 -0.01 0.00 0.01 0.00 0.00 72.50 69.12 2wn9 s THR 30 CO -0.00 0.40 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.56 2wn9 s VAL 31 N 0.75 3.34 -0.14 3.82 1.01 0.96 -4.54 120.40 125.61 2wn9 s VAL 31 Ca 0.06 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.35 2wn9 s VAL 31 Cb -0.13 -2.47 -0.05 0.00 0.00 0.00 0.00 36.38 33.74 2wn9 s VAL 31 CO 0.02 0.48 0.36 -0.89 0.00 0.00 0.00 175.10 175.06 2wn9 s THR 32 N 0.84 5.25 0.00 3.92 2.01 -0.09 -1.63 115.64 125.95 2wn9 s THR 32 Ca -0.02 0.70 0.08 0.00 0.31 0.00 0.00 61.69 62.76 2wn9 s THR 32 Cb -0.15 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 2wn9 s THR 32 CO 0.01 0.38 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.85 2wn9 s LEU 33 N 0.43 2.08 -0.04 4.42 2.96 0.11 -1.32 118.68 127.33 2wn9 s LEU 33 Ca 0.20 -0.48 -0.15 0.00 -0.22 0.00 0.00 54.13 53.48 2wn9 s LEU 33 Cb -0.14 -1.24 0.03 0.00 0.50 0.00 0.00 46.19 45.34 2wn9 s LEU 33 CO 0.07 0.28 0.33 -0.83 -1.32 0.00 0.00 176.35 174.88 2wn9 s GLY 34 N -0.77 -0.19 -0.02 7.98 0.00 -0.42 -4.37 107.32 109.52 2wn9 s GLY 34 Ca 0.10 0.49 0.04 0.00 0.00 0.00 0.00 44.72 45.35 2wn9 s GLY 34 CO -0.00 0.29 -0.12 -1.36 0.00 0.00 0.00 173.10 171.91 2wn9 s PHE 35 N -1.05 2.75 -0.29 1.90 0.08 -1.26 -0.45 117.98 119.66 2wn9 s PHE 35 Ca -0.11 -0.12 0.02 0.00 0.12 0.00 0.00 56.93 56.83 2wn9 s PHE 35 Cb -0.05 -1.60 0.07 0.00 -0.57 0.00 0.00 43.02 40.87 2wn9 s PHE 35 CO 0.04 0.27 -0.04 0.99 -0.10 0.00 0.00 175.22 176.37 2wn9 s THR 36 N -0.85 2.44 -0.20 0.64 2.01 -0.06 -1.85 115.64 117.78 2wn9 s THR 36 Ca 0.14 -1.73 -0.25 0.00 0.31 0.00 0.00 61.69 60.16 2wn9 s THR 36 Cb -0.11 -2.51 -0.01 0.00 0.01 0.00 0.00 72.50 69.88 2wn9 s THR 36 CO 0.03 -0.19 0.82 -0.22 -0.69 0.00 0.00 174.62 174.37 2wn9 s LEU 37 N 1.10 4.14 -0.20 4.42 2.96 -0.83 -0.81 118.68 129.47 2wn9 s LEU 37 Ca -0.04 1.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.97 2wn9 s LEU 37 Cb -0.20 -3.19 -0.21 0.00 0.50 0.00 0.00 46.19 43.08 2wn9 s LEU 37 CO -0.05 -0.43 0.04 0.00 -1.32 0.00 0.00 176.35 174.60 2wn9 n GLN 38 N 5.48 0.70 -3.64 1.98 6.02 0.14 -3.29 117.38 124.76 2wn9 n GLN 38 Ca 0.04 0.19 -0.10 0.00 -0.01 0.00 0.00 57.00 57.13 2wn9 n GLN 38 Cb 0.48 -1.60 -0.07 0.00 1.02 0.00 0.00 30.24 30.07 2wn9 n GLN 38 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2wn9 s ASP 39 N -6.70 -0.52 -0.46 1.08 2.15 -0.84 -0.51 116.67 110.87 2wn9 s ASP 39 Ca -0.28 0.98 -0.19 0.00 0.43 0.00 0.00 52.55 53.48 2wn9 s ASP 39 Cb 0.08 1.01 0.04 0.00 -0.30 0.00 0.00 42.92 43.75 2wn9 s ASP 39 CO 0.68 -0.17 0.59 -0.63 -0.17 0.00 0.00 175.17 175.47 2wn9 s ILE 40 N 0.36 4.90 0.00 4.11 1.01 -1.26 -0.67 121.20 129.65 2wn9 s ILE 40 Ca 0.02 -0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.31 2wn9 s ILE 40 Cb -0.05 -4.20 -0.34 0.00 0.01 0.00 0.00 42.46 37.88 2wn9 s ILE 40 CO -0.06 -0.64 0.89 0.58 0.00 0.00 0.00 174.94 175.72 2wn9 h VAL 41 N 5.84 1.17 -2.70 2.92 2.07 -1.37 -3.41 116.25 120.77 2wn9 h VAL 41 Ca -0.26 -2.64 -0.12 0.00 0.82 0.00 0.00 66.70 64.50 2wn9 h VAL 41 Cb 1.10 2.96 -0.24 0.00 -1.52 0.00 0.00 31.29 33.59 2wn9 h VAL 41 CO 0.90 0.82 -0.24 -0.75 0.02 0.00 0.00 177.57 178.32 2wn9 s LYS 42 N -2.59 0.47 -0.24 1.57 2.20 -1.23 -4.90 119.74 115.03 2wn9 s LYS 42 Ca -0.11 0.63 -0.00 0.00 -0.36 0.00 0.00 55.97 56.12 2wn9 s LYS 42 Cb 0.04 0.19 0.07 0.00 -1.51 0.00 0.00 37.83 36.62 2wn9 s LYS 42 CO 0.92 -0.08 -0.00 0.00 -0.36 0.00 0.00 175.35 175.83 2wn9 s ALA 43 N 0.45 1.63 -0.43 3.13 0.00 -1.26 -0.76 121.76 124.51 2wn9 s ALA 43 Ca -0.02 -1.23 -0.15 0.00 0.00 0.00 0.00 51.96 50.56 2wn9 s ALA 43 Cb -0.04 -1.40 0.04 0.00 0.00 0.00 0.00 23.12 21.73 2wn9 s ALA 43 CO -0.02 -1.27 0.34 0.34 0.00 0.00 0.00 175.76 175.15 2wn9 s ASP 44 N 1.56 6.11 0.00 0.00 -1.08 0.24 -4.94 116.67 118.55 2wn9 s ASP 44 Ca -0.02 -1.08 0.29 0.00 -0.52 0.00 0.00 52.55 51.23 2wn9 s ASP 44 Cb -0.18 -2.16 1.27 0.00 -1.46 0.00 0.00 42.92 40.39 2wn9 s ASP 44 CO -0.09 -0.53 1.94 -1.54 0.52 0.00 0.00 175.17 175.47 2wn9 n SER 45 N 5.17 0.00 0.12 -0.34 3.41 -1.26 -1.15 113.62 119.58 2wn9 n SER 45 Ca -0.12 0.41 -0.01 0.00 -0.26 0.00 0.00 58.87 58.90 2wn9 n SER 45 Cb 0.46 -0.47 0.06 0.00 -0.26 0.00 0.00 64.21 64.00 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 -1.95 -3.36 113.55 116.91 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 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2wn9 h SER 46 CO 0.00 0.68 0.00 0.35 -0.87 0.00 0.00 176.83 176.99 2wn9 n THR 47 N -3.44 0.00 -3.57 2.95 -2.24 -1.20 -5.03 114.28 101.75 2wn9 n THR 47 Ca 0.00 -0.47 -0.24 0.00 -2.27 0.00 0.00 64.05 61.08 2wn9 n THR 47 Cb 0.74 1.03 0.05 0.00 -2.10 0.00 0.00 70.33 70.05 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 -0.50 -4.39 -4.13 3.42 3.02 -0.30 -4.93 115.26 107.45 2wn9 n ASN 48 Ca 0.00 -0.87 -0.24 0.00 -0.03 0.00 0.00 54.58 53.44 2wn9 n ASN 48 Cb 0.01 -4.11 -0.15 0.00 -0.61 0.00 0.00 39.78 34.92 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 -5.54 1.33 0.00 3.52 2.02 -1.13 -1.59 118.70 117.32 2wn9 s GLU 49 Ca 0.32 -0.56 0.07 0.00 0.02 0.00 0.00 54.97 54.82 2wn9 s GLU 49 Cb -0.09 -1.27 -0.02 0.00 0.10 0.00 0.00 34.13 32.85 2wn9 s GLU 49 CO 0.81 0.32 -0.22 0.08 0.02 0.00 0.00 175.26 176.28 2wn9 s VAL 50 N -0.31 1.75 -0.21 2.63 1.01 -0.60 -0.60 120.40 124.07 2wn9 s VAL 50 Ca 0.05 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 60.94 2wn9 s VAL 50 Cb -0.07 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 2wn9 s VAL 50 CO -0.00 0.42 0.01 -1.81 0.00 0.00 0.00 175.10 173.71 2wn9 s ASP 51 N -0.73 4.81 0.07 3.32 1.11 0.07 -1.31 116.67 124.01 2wn9 s ASP 51 Ca 0.09 -0.23 0.08 0.00 0.18 0.00 0.00 52.55 52.66 2wn9 s ASP 51 Cb -0.09 -1.83 -0.03 0.00 1.07 0.00 0.00 42.92 42.04 2wn9 s ASP 51 CO 0.00 0.03 -0.18 -0.76 1.18 0.00 0.00 175.17 175.45 2wn9 s LEU 52 N 1.20 2.66 -0.13 1.23 1.02 0.17 -0.87 118.68 123.95 2wn9 s LEU 52 Ca 0.03 -0.46 0.01 0.00 0.02 0.00 0.00 54.13 53.74 2wn9 s LEU 52 Cb -0.14 -1.54 -0.00 0.00 0.02 0.00 0.00 46.19 44.52 2wn9 s LEU 52 CO 0.01 0.23 -0.18 -0.69 0.02 0.00 0.00 176.35 175.74 2wn9 s VAL 53 N -1.00 2.48 0.10 -1.59 1.01 0.15 -1.12 120.40 120.43 2wn9 s VAL 53 Ca 0.16 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2wn9 s VAL 53 Cb -0.11 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2wn9 s VAL 53 CO 0.07 0.53 0.29 -0.72 0.00 0.00 0.00 175.10 175.28 2wn9 s TYR 54 N 0.62 -0.03 -0.15 5.22 -0.85 -0.59 -0.69 117.35 120.88 2wn9 s TYR 54 Ca -0.10 -0.34 -0.11 0.00 -0.52 0.00 0.00 57.07 56.00 2wn9 s TYR 54 Cb -0.16 0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.23 2wn9 s TYR 54 CO 0.03 -0.62 0.21 0.71 -1.52 0.00 0.00 175.55 174.36 2wn9 s TYR 55 N -3.80 3.49 -0.42 -3.49 4.12 0.01 -0.74 117.35 116.52 2wn9 s TYR 55 Ca 0.04 0.51 -0.06 0.00 0.02 0.00 0.00 57.07 57.58 2wn9 s TYR 55 Cb 0.03 -2.19 0.10 0.00 -1.52 0.00 0.00 41.96 38.38 2wn9 s TYR 55 CO -0.11 0.39 0.25 -2.00 0.02 0.00 0.00 175.55 174.09 2wn9 s GLU 56 N 0.01 2.33 -0.13 -0.62 2.12 -0.59 -0.88 118.70 120.94 2wn9 s GLU 56 Ca 0.14 -1.67 -0.25 0.00 0.36 0.00 0.00 54.97 53.54 2wn9 s GLU 56 Cb -0.12 -3.71 -0.02 0.00 0.26 0.00 0.00 34.13 30.54 2wn9 s GLU 56 CO 0.02 -1.04 0.81 -1.14 -0.54 0.00 0.00 175.26 173.37 2wn9 s GLN 57 N 1.29 4.35 -0.05 4.30 0.74 0.41 -3.58 119.66 127.12 2wn9 s GLN 57 Ca 0.05 1.02 0.05 0.00 0.05 0.00 0.00 55.36 56.53 2wn9 s GLN 57 Cb -0.24 -3.53 -0.01 0.00 1.10 0.00 0.00 33.01 30.33 2wn9 s GLN 57 CO -0.01 -0.21 -0.20 -0.65 -0.55 0.00 0.00 175.29 173.67 2wn9 s GLN 58 N 1.72 2.09 0.02 1.67 -0.21 0.10 -1.30 119.66 123.75 2wn9 s GLN 58 Ca 0.39 -0.72 -0.01 0.00 0.02 0.00 0.00 55.36 55.04 2wn9 s GLN 58 Cb -0.17 -1.78 -0.02 0.00 1.00 0.00 0.00 33.01 32.04 2wn9 s GLN 58 CO 0.15 0.29 0.00 -0.98 -2.12 0.00 0.00 175.29 172.63 2wn9 s ARG 59 N -0.01 0.34 0.25 2.91 1.70 -0.43 -0.86 118.95 122.84 2wn9 s ARG 59 Ca -0.04 -0.56 -0.17 0.00 -0.47 0.00 0.00 55.73 54.49 2wn9 s ARG 59 Cb -0.13 0.12 0.01 0.00 -0.57 0.00 0.00 34.95 34.39 2wn9 s ARG 59 CO 0.03 -0.06 0.59 1.67 -1.08 0.00 0.00 175.30 176.45 2wn9 s TRP 60 N -1.42 0.05 -0.03 5.89 -2.14 -0.93 -0.91 118.94 119.45 2wn9 s TRP 60 Ca -0.15 -0.45 0.01 0.00 2.66 0.00 0.00 56.10 58.17 2wn9 s TRP 60 Cb -0.09 0.45 0.02 0.00 -3.10 0.00 0.00 33.47 30.75 2wn9 s TRP 60 CO -0.01 -1.09 -0.01 0.21 -2.66 0.00 0.00 176.95 173.39 2wn9 s LYS 61 N -3.95 0.40 -0.10 3.25 2.20 -1.26 0.08 119.74 120.35 2wn9 s LYS 61 Ca 0.15 0.01 0.03 0.00 -0.36 0.00 0.00 55.97 55.81 2wn9 s LYS 61 Cb -0.03 -0.52 0.00 0.00 -1.51 0.00 0.00 37.83 35.78 2wn9 s LYS 61 CO 0.06 -0.09 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.24 2wn9 s LEU 62 N 0.84 1.98 0.47 5.43 1.43 -0.45 -4.94 118.68 123.45 2wn9 s LEU 62 Ca -0.09 -0.51 0.23 0.00 -1.03 0.00 0.00 54.13 52.73 2wn9 s LEU 62 Cb -0.12 -1.28 1.25 0.00 0.03 0.00 0.00 46.19 46.06 2wn9 s LEU 62 CO -0.01 0.12 1.90 0.78 0.23 0.00 0.00 176.35 179.36 2wn9 h ASN 63 N 6.88 0.22 0.76 2.29 2.35 -1.89 -2.00 115.58 124.19 2wn9 h ASN 63 Ca -0.24 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 2wn9 h ASN 63 Cb 1.22 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.57 2wn9 h ASN 63 CO 0.48 0.09 0.00 -1.54 -1.65 0.00 0.00 177.43 174.82 2wn9 n SER 64 N -4.42 0.28 -1.17 5.81 3.41 -1.26 -2.39 113.62 113.88 2wn9 n SER 64 Ca 0.17 0.56 0.10 0.00 -0.26 0.00 0.00 58.87 59.44 2wn9 n SER 64 Cb 0.74 -0.62 0.28 0.00 -0.26 0.00 0.00 64.21 64.35 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 -1.79 3.71 -4.83 1.04 4.77 -0.75 -4.97 117.00 114.18 2wn9 n LEU 65 Ca 0.04 -2.01 -0.34 0.00 -0.03 0.00 0.00 56.01 53.67 2wn9 n LEU 65 Cb 0.24 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 2wn9 n LEU 65 CO 0.19 0.92 0.50 -0.04 -1.33 0.00 0.00 177.39 177.64 2wn9 s MET 66 N -1.01 4.19 0.19 3.23 -1.94 -1.01 -3.88 119.30 119.07 2wn9 s MET 66 Ca 0.43 0.90 -0.14 0.00 -1.71 0.00 0.00 55.69 55.17 2wn9 s MET 66 Cb 0.22 -2.53 0.01 0.00 2.01 0.00 0.00 34.83 34.54 2wn9 s MET 66 CO 0.29 0.19 0.44 1.67 -0.01 0.00 0.00 175.02 177.60 2wn9 s TRP 67 N -1.87 0.10 -0.38 -0.03 -2.14 -0.55 -4.95 118.94 109.13 2wn9 s TRP 67 Ca 0.53 -0.45 -0.18 0.00 2.66 0.00 0.00 56.10 58.66 2wn9 s TRP 67 Cb -0.13 0.23 0.01 0.00 -3.10 0.00 0.00 33.47 30.48 2wn9 s TRP 67 CO 0.18 -0.86 0.48 0.34 -2.66 0.00 0.00 176.95 174.43 2wn9 s ASP 68 N -2.92 6.26 0.53 -2.66 -1.08 -1.26 -4.69 116.67 110.86 2wn9 s ASP 68 Ca 0.13 -0.27 0.25 0.00 -0.52 0.00 0.00 52.55 52.13 2wn9 s ASP 68 Cb 0.00 -2.25 1.39 0.00 -1.46 0.00 0.00 42.92 40.61 2wn9 s ASP 68 CO -0.01 -0.52 2.01 -0.65 0.52 0.00 0.00 175.17 176.52 2wn9 h PRO 69 N 8.59 0.00 -0.07 4.34 0.11 -1.94 -0.76 132.00 142.26 2wn9 h PRO 69 Ca -0.27 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.85 2wn9 h PRO 69 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2wn9 h PRO 69 CO 0.78 0.00 0.06 -0.91 -0.21 0.00 0.00 178.00 177.72 2wn9 h ASN 70 N 0.00 0.00 0.81 -2.05 2.35 -1.92 0.21 115.58 114.98 2wn9 h ASN 70 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2wn9 h ASN 70 Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.27 2wn9 h ASN 70 CO -0.00 0.00 -0.19 -0.62 -1.65 0.00 0.00 177.43 174.96 2wn9 n GLU 71 N -4.12 0.00 -2.55 0.81 -0.58 -0.29 -4.21 120.64 109.70 2wn9 n GLU 71 Ca -0.01 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.58 2wn9 n GLU 71 Cb 0.16 -1.50 0.02 0.00 -0.57 0.00 0.00 31.44 29.55 2wn9 n GLU 71 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2wn9 n TYR 72 N -1.51 2.07 -3.77 -0.32 4.01 -0.41 -4.97 117.16 112.26 2wn9 n TYR 72 Ca 0.06 -2.68 -0.29 0.00 -0.16 0.00 0.00 57.90 54.83 2wn9 n TYR 72 Cb 0.34 -0.26 0.01 0.00 -0.31 0.00 0.00 39.34 39.12 2wn9 n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wn9 n GLY 73 N -0.38 -0.49 2.42 2.72 0.00 -1.19 -2.18 105.19 106.10 2wn9 n GLY 73 Ca 0.23 0.15 -0.18 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.62 -5.24 -4.71 1.61 3.02 0.61 -4.98 115.26 102.95 2wn9 n ASN 74 Ca 0.03 0.17 -0.42 0.00 -0.03 0.00 0.00 54.58 54.33 2wn9 n ASN 74 Cb 0.53 -4.32 -0.03 0.00 -0.61 0.00 0.00 39.78 35.35 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 -2.81 2.63 -0.22 2.41 1.01 -0.93 -4.89 121.20 118.40 2wn9 s ILE 75 Ca 0.00 0.33 0.09 0.00 0.00 0.00 0.00 60.65 61.07 2wn9 s ILE 75 Cb 0.00 -3.21 -0.12 0.00 0.01 0.00 0.00 42.46 39.14 2wn9 s ILE 75 CO 0.00 0.01 0.29 0.35 0.00 0.00 0.00 174.94 175.59 2wn9 n THR 76 N 4.30 0.00 -3.50 2.92 -2.24 -1.26 -4.38 114.28 110.11 2wn9 n THR 76 Ca 0.15 -0.25 -0.11 0.00 -2.27 0.00 0.00 64.05 61.58 2wn9 n THR 76 Cb 0.38 0.66 -0.02 0.00 -2.10 0.00 0.00 70.33 69.25 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 -2.42 -0.49 0.14 3.42 1.47 -1.26 -0.98 116.67 116.55 2wn9 s ASP 77 Ca 0.00 -0.10 -0.14 0.00 1.18 0.00 0.00 52.55 53.50 2wn9 s ASP 77 Cb 0.06 0.59 0.02 0.00 -0.34 0.00 0.00 42.92 43.25 2wn9 s ASP 77 CO 0.37 -0.97 0.37 0.72 0.68 0.00 0.00 175.17 176.34 2wn9 s PHE 78 N -3.68 -0.01 -0.09 2.11 -0.12 0.22 -4.99 117.98 111.42 2wn9 s PHE 78 Ca 0.03 -0.34 -0.01 0.00 -0.05 0.00 0.00 56.93 56.57 2wn9 s PHE 78 Cb -0.02 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.52 2wn9 s PHE 78 CO -0.09 -0.73 -0.05 1.03 -0.05 0.00 0.00 175.22 175.33 2wn9 s ARG 79 N -3.86 3.02 0.03 1.99 3.00 -1.26 -0.42 118.95 121.45 2wn9 s ARG 79 Ca 0.07 -0.51 -0.12 0.00 0.00 0.00 0.00 55.73 55.17 2wn9 s ARG 79 Cb 0.02 -2.71 0.01 0.00 0.00 0.00 0.00 34.95 32.27 2wn9 s ARG 79 CO -0.08 0.57 0.25 -0.08 0.00 0.00 0.00 175.30 175.97 2wn9 s THR 80 N -0.55 0.09 0.21 0.02 -1.32 -0.42 -4.99 115.64 108.68 2wn9 s THR 80 Ca 0.09 -0.72 -0.32 0.00 -1.21 0.00 0.00 61.69 59.53 2wn9 s THR 80 Cb -0.12 -0.82 -0.14 0.00 -1.51 0.00 0.00 72.50 69.92 2wn9 s THR 80 CO 0.02 -0.40 1.38 -0.24 -2.21 0.00 0.00 174.62 173.18 2wn9 n SER 81 N 0.84 2.49 0.23 8.08 2.88 -1.26 -0.50 113.62 126.38 2wn9 n SER 81 Ca -0.20 1.13 0.17 0.00 -1.33 0.00 0.00 58.87 58.65 2wn9 n SER 81 Cb 0.58 -1.38 0.86 0.00 -0.75 0.00 0.00 64.21 63.52 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 4.29 1.72 0.00 -1.46 0.00 -1.57 0.21 119.26 122.45 2wn9 h ALA 82 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2wn9 h ALA 82 Cb 1.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2wn9 h ALA 82 CO 0.76 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.76 2wn9 h ALA 83 N 1.78 1.00 0.00 0.00 0.00 -1.88 -2.85 119.26 117.30 2wn9 h ALA 83 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2wn9 h ALA 83 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2wn9 h ALA 83 CO -0.00 0.00 -0.11 -0.25 0.00 0.00 0.00 179.25 178.88 2wn9 n ASP 84 N -2.31 0.28 -4.22 0.00 8.00 0.06 -4.88 116.55 113.48 2wn9 n ASP 84 Ca 0.01 0.38 -0.13 0.00 0.71 0.00 0.00 54.79 55.76 2wn9 n ASP 84 Cb 0.19 -0.40 -0.10 0.00 -0.02 0.00 0.00 41.12 40.79 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 -3.03 0.75 0.31 0.53 -4.36 -1.08 -5.06 121.20 109.26 2wn9 s ILE 85 Ca 0.12 -1.97 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 2wn9 s ILE 85 Cb 0.17 -1.92 -0.10 0.00 1.25 0.00 0.00 42.46 41.86 2wn9 s ILE 85 CO 0.58 -0.66 1.33 0.86 0.24 0.00 0.00 174.94 177.30 2wn9 s TRP 86 N -3.60 3.04 0.06 1.37 -0.00 -1.26 -4.96 118.94 113.58 2wn9 s TRP 86 Ca 0.19 1.33 0.04 0.00 -0.00 0.00 0.00 56.10 57.65 2wn9 s TRP 86 Cb 0.05 -3.71 -0.03 0.00 -0.00 0.00 0.00 33.47 29.79 2wn9 s TRP 86 CO 0.00 -2.03 -0.11 0.95 -0.00 0.00 0.00 176.95 175.77 2wn9 s THR 87 N -0.86 0.80 0.49 5.86 -4.23 -1.26 -5.10 115.64 111.35 2wn9 s THR 87 Ca 0.51 -1.20 -0.21 0.00 -1.18 0.00 0.00 61.69 59.61 2wn9 s THR 87 Cb -0.40 -0.84 -0.07 0.00 1.34 0.00 0.00 72.50 72.53 2wn9 s THR 87 CO 0.51 -0.32 1.11 -2.16 -0.54 0.00 0.00 174.62 173.22 2wn9 s PRO 88 N -1.69 3.64 -0.46 3.99 0.04 -1.26 -4.94 135.00 134.31 2wn9 s PRO 88 Ca -0.06 1.60 -0.04 0.00 0.04 0.00 0.00 61.00 62.54 2wn9 s PRO 88 Cb -0.10 -2.19 0.05 0.00 0.04 0.00 0.00 34.50 32.31 2wn9 s PRO 88 CO 0.01 -0.61 2.79 -0.40 0.04 0.00 0.00 177.00 178.83 2wn9 n ASP 89 N -0.89 6.48 -4.71 6.66 5.75 -1.26 -4.95 116.55 123.63 2wn9 n ASP 89 Ca 0.09 -3.19 -0.42 0.00 -0.01 0.00 0.00 54.79 51.27 2wn9 n ASP 89 Cb 0.50 -1.24 -0.03 0.00 -1.03 0.00 0.00 41.12 39.32 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 -2.14 4.06 0.00 2.12 -1.09 -1.26 -2.41 121.20 120.49 2wn9 s ILE 90 Ca 0.59 1.47 -0.01 0.00 -2.23 0.00 0.00 60.65 60.47 2wn9 s ILE 90 Cb 0.38 -3.94 -0.01 0.00 -1.58 0.00 0.00 42.46 37.31 2wn9 s ILE 90 CO -0.22 0.10 0.01 -0.89 -1.23 0.00 0.00 174.94 172.72 2wn9 s THR 91 N 1.17 0.05 0.27 2.92 2.01 0.06 -4.92 115.64 117.21 2wn9 s THR 91 Ca 0.58 -0.44 -0.29 0.00 0.31 0.00 0.00 61.69 61.85 2wn9 s THR 91 Cb -0.29 -0.16 -0.10 0.00 0.01 0.00 0.00 72.50 71.96 2wn9 s THR 91 CO 0.29 -0.24 1.31 0.00 -0.69 0.00 0.00 174.62 175.29 2wn9 s ALA 92 N -0.71 3.52 -0.79 7.40 0.00 -1.26 -1.56 121.76 128.36 2wn9 s ALA 92 Ca -0.08 1.19 0.25 0.00 0.00 0.00 0.00 51.96 53.32 2wn9 s ALA 92 Cb -0.05 -3.48 0.47 0.00 0.00 0.00 0.00 23.12 20.07 2wn9 s ALA 92 CO -0.00 -0.59 1.41 0.66 0.00 0.00 0.00 175.76 177.24 2wn9 n TYR 93 N 1.67 0.34 -2.45 0.00 4.01 0.73 -4.20 117.16 117.26 2wn9 n TYR 93 Ca 0.03 0.10 0.01 0.00 -0.16 0.00 0.00 57.90 57.88 2wn9 n TYR 93 Cb 0.42 -0.52 0.05 0.00 -0.31 0.00 0.00 39.34 38.99 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 -1.87 1.57 -4.74 7.72 3.41 -1.26 -5.03 113.62 113.42 2wn9 n SER 94 Ca 0.04 -2.38 -0.32 0.00 -0.26 0.00 0.00 58.87 55.95 2wn9 n SER 94 Cb 0.40 -0.39 0.10 0.00 -0.26 0.00 0.00 64.21 64.06 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 -2.83 4.25 0.00 4.04 1.04 -1.26 -2.02 113.70 116.93 2wn9 s SER 95 Ca 0.34 2.01 0.01 0.00 0.48 0.00 0.00 55.95 58.79 2wn9 s SER 95 Cb 0.37 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.93 2wn9 s SER 95 CO -0.10 -2.21 0.13 0.35 0.98 0.00 0.00 173.24 172.39 2wn9 n THR 96 N -3.32 0.00 -3.91 2.02 -2.24 -0.20 -4.83 114.28 101.80 2wn9 n THR 96 Ca 0.11 -0.48 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 2wn9 n THR 96 Cb 0.52 1.00 -0.09 0.00 -2.10 0.00 0.00 70.33 69.66 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 -0.92 0.61 0.31 -0.78 1.81 -1.25 -5.04 118.95 113.68 2wn9 s ARG 97 Ca 0.01 -0.71 -0.30 0.00 -1.72 0.00 0.00 55.73 53.01 2wn9 s ARG 97 Cb 0.01 0.24 -0.11 0.00 -0.45 0.00 0.00 34.95 34.64 2wn9 s ARG 97 CO 0.04 -0.16 1.57 -2.14 -0.68 0.00 0.00 175.30 173.93 2wn9 s PRO 98 N -2.55 4.13 0.52 3.54 0.02 -1.26 -4.66 135.00 134.73 2wn9 s PRO 98 Ca -0.05 2.56 -0.23 0.00 0.02 0.00 0.00 61.00 63.30 2wn9 s PRO 98 Cb -0.01 -3.02 -0.06 0.00 0.02 0.00 0.00 34.50 31.43 2wn9 s PRO 98 CO -0.04 -0.60 1.36 1.55 -0.33 0.00 0.00 177.00 178.94 2wn9 n VAL 99 N 1.84 3.52 -4.30 3.83 3.14 -1.26 -4.88 118.33 120.23 2wn9 n VAL 99 Ca 0.07 -0.50 -0.34 0.00 -2.96 0.00 0.00 64.34 60.61 2wn9 n VAL 99 Cb 0.38 -1.69 -0.13 0.00 -1.06 0.00 0.00 33.84 31.34 2wn9 n VAL 99 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2wn9 s GLN 100 N -2.74 3.48 -0.07 1.45 -0.21 -0.61 -4.99 119.66 115.97 2wn9 s GLN 100 Ca 0.69 -0.61 -0.22 0.00 0.02 0.00 0.00 55.36 55.24 2wn9 s GLN 100 Cb -0.43 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 30.66 2wn9 s GLN 100 CO 0.52 0.05 0.63 0.08 -2.12 0.00 0.00 175.29 174.44 2wn9 s VAL 101 N 0.83 5.07 -0.86 1.09 1.01 -1.26 -1.08 120.40 125.19 2wn9 s VAL 101 Ca -0.02 1.29 0.15 0.00 0.00 0.00 0.00 61.98 63.40 2wn9 s VAL 101 Cb -0.15 -3.97 -0.13 0.00 0.00 0.00 0.00 36.38 32.14 2wn9 s VAL 101 CO 0.01 0.29 0.68 0.18 0.00 0.00 0.00 175.10 176.26 2wn9 n LEU 102 N 3.63 0.90 -4.41 3.92 4.77 0.79 -4.98 117.00 121.62 2wn9 n LEU 102 Ca -0.03 -0.56 -0.20 0.00 -0.03 0.00 0.00 56.01 55.19 2wn9 n LEU 102 Cb 0.51 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 2wn9 n LEU 102 CO 0.46 0.20 -0.27 -0.94 -1.33 0.00 0.00 177.39 175.51 2wn9 s SER 103 N -2.28 1.99 0.74 -1.43 1.04 -1.24 -4.93 113.70 107.58 2wn9 s SER 103 Ca 0.07 -1.38 -0.15 0.00 0.48 0.00 0.00 55.95 54.97 2wn9 s SER 103 Cb 0.12 -0.00 0.01 0.00 0.10 0.00 0.00 66.02 66.24 2wn9 s SER 103 CO 0.56 -0.64 0.90 -2.65 0.98 0.00 0.00 173.24 172.39 2wn9 n PRO 104 N -0.61 0.40 -3.81 4.02 -0.02 -1.26 -4.83 135.00 128.89 2wn9 n PRO 104 Ca -0.02 0.19 -0.34 0.00 -2.02 0.00 0.00 63.50 61.32 2wn9 n PRO 104 Cb 0.66 -2.17 -0.11 0.00 -0.02 0.00 0.00 33.50 31.86 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 -3.36 2.35 -0.03 -0.52 -0.21 -1.26 -4.78 119.66 111.85 2wn9 s GLN 105 Ca 0.71 -2.57 0.01 0.00 0.02 0.00 0.00 55.36 53.53 2wn9 s GLN 105 Cb -0.33 -3.58 0.02 0.00 1.00 0.00 0.00 33.01 30.12 2wn9 s GLN 105 CO 0.52 -1.15 -0.04 0.42 -2.12 0.00 0.00 175.29 172.92 2wn9 s ILE 106 N -0.16 0.46 0.13 1.08 1.01 -1.26 -1.45 121.20 121.00 2wn9 s ILE 106 Ca 0.17 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.73 2wn9 s ILE 106 Cb -0.22 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 2wn9 s ILE 106 CO -0.02 0.19 0.24 0.00 0.00 0.00 0.00 174.94 175.34 2wn9 s ALA 107 N 0.70 3.89 -0.20 9.38 0.00 0.35 -4.55 121.76 131.32 2wn9 s ALA 107 Ca -0.09 -1.03 -0.04 0.00 0.00 0.00 0.00 51.96 50.80 2wn9 s ALA 107 Cb -0.12 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.29 2wn9 s ALA 107 CO -0.00 0.59 -0.03 0.08 0.00 0.00 0.00 175.76 176.40 2wn9 s VAL 108 N -1.69 3.60 -0.15 0.00 1.01 -0.16 -1.30 120.40 121.71 2wn9 s VAL 108 Ca 0.34 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 2wn9 s VAL 108 Cb -0.11 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 2wn9 s VAL 108 CO 0.27 0.43 -0.05 -0.69 0.00 0.00 0.00 175.10 175.07 2wn9 s VAL 109 N 1.16 3.77 0.20 2.92 1.01 0.44 -1.27 120.40 128.64 2wn9 s VAL 109 Ca 0.02 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.66 2wn9 s VAL 109 Cb -0.15 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2wn9 s VAL 109 CO -0.00 0.50 0.15 -0.89 0.00 0.00 0.00 175.10 174.85 2wn9 s THR 110 N 0.37 4.39 0.42 3.92 2.01 -0.08 -0.61 115.64 126.06 2wn9 s THR 110 Ca -0.05 -1.25 0.40 0.00 0.31 0.00 0.00 61.69 61.10 2wn9 s THR 110 Cb -0.14 -3.29 0.41 0.00 0.01 0.00 0.00 72.50 69.48 2wn9 s THR 110 CO 0.03 -0.20 2.20 1.12 -0.69 0.00 0.00 174.62 177.08 2wn9 h HIS 111 N 2.08 0.00 0.00 4.92 2.07 -1.35 0.92 115.15 123.79 2wn9 h HIS 111 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2wn9 h HIS 111 Cb 1.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.20 2wn9 h HIS 111 CO 0.58 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.04 2wn9 n ASP 112 N -2.98 0.00 0.00 3.10 5.75 -1.26 -1.48 116.55 119.68 2wn9 n ASP 112 Ca -0.02 -1.20 0.00 0.00 -0.01 0.00 0.00 54.79 53.56 2wn9 n ASP 112 Cb 0.13 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 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 0.74 0.74 3.78 6.12 0.00 0.31 -4.72 105.19 112.15 2wn9 n GLY 113 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2wn9 n GLY 113 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wn9 s SER 114 N -2.74 7.39 -0.04 1.61 0.01 -1.21 -1.34 113.70 117.38 2wn9 s SER 114 Ca 0.00 1.85 0.05 0.00 1.31 0.00 0.00 55.95 59.17 2wn9 s SER 114 Cb 0.00 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.64 2wn9 s SER 114 CO 0.00 -0.03 -0.20 -0.69 0.41 0.00 0.00 173.24 172.73 2wn9 s VAL 115 N -1.54 1.62 -0.13 3.43 1.01 0.11 -0.90 120.40 124.00 2wn9 s VAL 115 Ca 0.49 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2wn9 s VAL 115 Cb -0.20 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.82 2wn9 s VAL 115 CO 0.25 0.46 -0.18 -0.32 0.00 0.00 0.00 175.10 175.32 2wn9 s MET 116 N -0.19 2.53 -0.06 2.72 0.00 -0.39 -2.19 119.30 121.71 2wn9 s MET 116 Ca 0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 55.69 55.02 2wn9 s MET 116 Cb -0.11 -2.13 0.03 0.00 0.00 0.00 0.00 34.83 32.62 2wn9 s MET 116 CO 0.01 -0.08 -0.01 0.12 0.00 0.00 0.00 175.02 175.06 2wn9 s PHE 117 N 1.02 0.66 -0.51 4.11 5.36 -0.04 -0.99 117.98 127.59 2wn9 s PHE 117 Ca -0.04 -0.16 0.05 0.00 -0.96 0.00 0.00 56.93 55.82 2wn9 s PHE 117 Cb -0.15 -0.74 0.20 0.00 -0.34 0.00 0.00 43.02 41.99 2wn9 s PHE 117 CO -0.04 -0.28 0.47 -0.89 -1.46 0.00 0.00 175.22 173.02 2wn9 n ILE 118 N 4.84 0.04 -2.40 3.12 5.41 -1.26 -0.72 119.36 128.39 2wn9 n ILE 118 Ca -0.12 -4.13 -0.40 0.00 1.00 0.00 0.00 62.75 59.09 2wn9 n ILE 118 Cb 0.50 -1.91 -0.04 0.00 -0.71 0.00 0.00 39.64 37.49 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 -0.91 4.57 0.06 0.38 0.04 -1.23 -4.76 135.00 133.14 2wn9 s PRO 119 Ca 0.32 1.89 -0.18 0.00 0.04 0.00 0.00 61.00 63.08 2wn9 s PRO 119 Cb 0.06 -3.15 -0.06 0.00 0.04 0.00 0.00 34.50 31.38 2wn9 s PRO 119 CO -0.15 0.12 0.53 0.00 0.04 0.00 0.00 177.00 177.54 2wn9 s ALA 120 N -1.16 3.62 0.06 8.56 0.00 -1.26 -1.55 121.76 130.02 2wn9 s ALA 120 Ca 0.46 -0.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.26 2wn9 s ALA 120 Cb -0.34 -2.57 0.01 0.00 0.00 0.00 0.00 23.12 20.23 2wn9 s ALA 120 CO 0.44 0.42 0.27 -0.65 0.00 0.00 0.00 175.76 176.23 2wn9 s GLN 121 N -1.12 0.81 -0.17 0.00 -0.21 0.08 -0.15 119.66 118.89 2wn9 s GLN 121 Ca 0.28 -0.63 -0.02 0.00 0.02 0.00 0.00 55.36 55.01 2wn9 s GLN 121 Cb -0.19 0.34 -0.01 0.00 1.00 0.00 0.00 33.01 34.15 2wn9 s GLN 121 CO 0.18 -0.26 -0.07 0.50 -2.12 0.00 0.00 175.29 173.51 2wn9 s ARG 122 N -2.88 3.45 -0.09 2.91 3.52 -0.24 -1.55 118.95 124.06 2wn9 s ARG 122 Ca -0.03 -0.62 0.02 0.00 -0.13 0.00 0.00 55.73 54.97 2wn9 s ARG 122 Cb 0.00 -2.85 0.01 0.00 -1.56 0.00 0.00 34.95 30.55 2wn9 s ARG 122 CO -0.05 0.05 -0.16 -1.17 -0.81 0.00 0.00 175.30 173.16 2wn9 s LEU 123 N 0.83 1.76 -0.16 -0.88 2.96 -0.28 -1.57 118.68 121.34 2wn9 s LEU 123 Ca -0.02 -0.41 -0.14 0.00 -0.22 0.00 0.00 54.13 53.34 2wn9 s LEU 123 Cb -0.15 -1.07 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 2wn9 s LEU 123 CO 0.01 0.04 0.29 -0.44 -1.32 0.00 0.00 176.35 174.94 2wn9 s SER 124 N 0.80 6.43 0.12 3.68 0.01 -1.26 -0.65 113.70 122.83 2wn9 s SER 124 Ca -0.11 0.51 -0.06 0.00 1.31 0.00 0.00 55.95 57.60 2wn9 s SER 124 Cb -0.16 -2.18 -0.02 0.00 0.21 0.00 0.00 66.02 63.87 2wn9 s SER 124 CO 0.02 0.10 0.16 0.72 0.41 0.00 0.00 173.24 174.65 2wn9 s PHE 125 N 0.47 0.48 -0.06 2.43 -0.12 -0.43 -1.03 117.98 119.72 2wn9 s PHE 125 Ca 0.16 -0.89 -0.30 0.00 -0.05 0.00 0.00 56.93 55.86 2wn9 s PHE 125 Cb -0.13 -0.21 -0.06 0.00 -0.63 0.00 0.00 43.02 41.99 2wn9 s PHE 125 CO 0.04 -0.59 1.74 -1.64 -0.05 0.00 0.00 175.22 174.72 2wn9 s MET 126 N -3.96 4.09 -0.29 1.99 -1.94 -0.86 -1.56 119.30 116.77 2wn9 s MET 126 Ca 0.15 2.21 -0.14 0.00 -1.71 0.00 0.00 55.69 56.20 2wn9 s MET 126 Cb 0.05 -4.04 0.12 0.00 2.01 0.00 0.00 34.83 32.97 2wn9 s MET 126 CO -0.03 -0.97 0.79 0.00 -0.01 0.00 0.00 175.02 174.80 2wn9 s ASP 128 N 2.07 6.27 -0.03 0.00 2.15 -1.26 -3.07 116.67 122.80 2wn9 s ASP 128 Ca -0.07 -0.36 0.04 0.00 0.43 0.00 0.00 52.55 52.59 2wn9 s ASP 128 Cb -0.07 -2.27 0.16 0.00 -0.30 0.00 0.00 42.92 40.45 2wn9 s ASP 128 CO -0.18 -0.61 0.95 -0.81 -0.17 0.00 0.00 175.17 174.35 2wn9 n PRO 129 N 5.86 1.63 -1.66 4.34 -0.04 -1.26 -4.64 135.00 139.23 2wn9 n PRO 129 Ca -0.05 -0.65 -0.47 0.00 -0.04 0.00 0.00 63.50 62.30 2wn9 n PRO 129 Cb 0.48 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.50 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 0.06 0.01 -0.03 0.52 -1.04 -1.26 -1.29 114.28 111.25 2wn9 n THR 130 Ca 0.06 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2wn9 n THR 130 Cb 0.30 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 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 3.30 0.43 0.29 3.41 0.00 -1.26 -4.38 105.19 106.97 2wn9 n GLY 131 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 2wn9 n GLY 131 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2wn9 h VAL 132 N 0.00 0.60 -0.78 1.61 3.04 -1.39 -2.11 116.25 117.21 2wn9 h VAL 132 Ca 0.00 -0.13 -0.41 0.00 -1.01 0.00 0.00 66.70 65.15 2wn9 h VAL 132 Cb 0.00 1.08 -0.24 0.00 -2.01 0.00 0.00 31.29 30.12 2wn9 h VAL 132 CO 0.00 0.03 0.53 -0.90 -1.01 0.00 0.00 177.57 176.22 2wn9 n ASP 133 N -3.89 3.83 -4.20 3.17 5.75 -1.26 -0.60 116.55 119.35 2wn9 n ASP 133 Ca -0.03 -3.27 -0.12 0.00 -0.01 0.00 0.00 54.79 51.36 2wn9 n ASP 133 Cb 0.12 -0.78 -0.10 0.00 -1.03 0.00 0.00 41.12 39.32 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 -0.81 1.44 0.34 -1.12 1.04 -0.81 -5.03 113.70 108.75 2wn9 s SER 134 Ca 0.45 -1.00 0.04 0.00 0.48 0.00 0.00 55.95 55.92 2wn9 s SER 134 Cb 0.38 0.04 0.66 0.00 0.10 0.00 0.00 66.02 67.20 2wn9 s SER 134 CO 0.08 -0.39 1.96 -0.08 0.98 0.00 0.00 173.24 175.78 2wn9 h GLU 135 N 2.93 0.83 0.00 4.02 4.81 -1.91 -1.74 114.58 123.53 2wn9 h GLU 135 Ca -0.36 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.76 2wn9 h GLU 135 Cb 1.18 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 2wn9 h GLU 135 CO 0.63 0.55 -0.28 1.49 -0.73 0.00 0.00 179.01 180.68 2wn9 h GLU 136 N 0.86 0.00 0.00 1.92 4.22 -1.96 -3.50 114.58 116.12 2wn9 h GLU 136 Ca 0.32 0.00 0.10 0.00 0.08 0.00 0.00 59.36 59.86 2wn9 h GLU 136 Cb 0.16 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 2wn9 h GLU 136 CO -0.10 0.28 -0.13 0.41 -2.18 0.00 0.00 179.01 177.28 2wn9 n GLY 137 N 0.40 -1.99 3.87 1.92 0.00 -0.66 -4.86 105.19 103.88 2wn9 n GLY 137 Ca 0.01 -1.35 -0.22 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.43 3.70 -0.04 4.61 0.00 0.79 -4.35 121.76 125.03 2wn9 s ALA 138 Ca 0.00 -1.34 0.02 0.00 0.00 0.00 0.00 51.96 50.64 2wn9 s ALA 138 Cb 0.00 -1.44 0.01 0.00 0.00 0.00 0.00 23.12 21.69 2wn9 s ALA 138 CO 0.00 0.28 -0.07 0.99 0.00 0.00 0.00 175.76 176.95 2wn9 s THR 139 N -2.05 0.68 0.12 0.00 2.01 -1.26 -1.31 115.64 113.83 2wn9 s THR 139 Ca 0.33 -0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2wn9 s THR 139 Cb -0.08 -0.65 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 2wn9 s THR 139 CO 0.26 0.24 -0.01 0.00 -0.69 0.00 0.00 174.62 174.42 2wn9 s ALA 141 N -3.79 -0.48 -0.08 0.00 0.00 -1.26 -0.97 121.76 115.18 2wn9 s ALA 141 Ca 0.18 0.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.16 2wn9 s ALA 141 Cb 0.07 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.27 2wn9 s ALA 141 CO -0.02 -0.21 0.20 0.54 0.00 0.00 0.00 175.76 176.28 2wn9 s VAL 142 N -1.21 -0.03 0.02 0.00 0.11 -0.28 -4.91 120.40 114.10 2wn9 s VAL 142 Ca -0.13 0.10 -0.15 0.00 -2.93 0.00 0.00 61.98 58.87 2wn9 s VAL 142 Cb -0.06 -0.31 -0.06 0.00 -1.53 0.00 0.00 36.38 34.42 2wn9 s VAL 142 CO 0.02 0.04 0.43 -0.54 -3.33 0.00 0.00 175.10 171.72 2wn9 s LYS 143 N 0.81 3.95 -0.03 1.54 1.02 -1.26 -0.70 119.74 125.06 2wn9 s LYS 143 Ca -0.06 0.44 0.06 0.00 0.02 0.00 0.00 55.97 56.44 2wn9 s LYS 143 Cb -0.07 -3.21 -0.01 0.00 -0.52 0.00 0.00 37.83 34.02 2wn9 s LYS 143 CO -0.05 0.68 -0.23 -0.06 -0.92 0.00 0.00 175.35 174.77 2wn9 s PHE 144 N -1.11 2.13 0.07 3.18 0.08 0.03 -0.19 117.98 122.17 2wn9 s PHE 144 Ca 0.25 -0.50 -0.22 0.00 0.12 0.00 0.00 56.93 56.58 2wn9 s PHE 144 Cb -0.17 -1.39 0.07 0.00 -0.57 0.00 0.00 43.02 40.97 2wn9 s PHE 144 CO 0.14 -0.11 1.03 0.41 -0.10 0.00 0.00 175.22 176.59 2wn9 n GLY 145 N 2.73 0.47 3.76 4.36 0.00 -0.60 -0.53 105.19 115.39 2wn9 n GLY 145 Ca -0.16 -1.08 -0.38 0.00 0.00 0.00 0.00 46.02 44.39 2wn9 n GLY 145 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wn9 s SER 146 N -3.34 5.97 0.02 1.61 0.15 -1.26 -0.76 113.70 116.09 2wn9 s SER 146 Ca 0.23 2.60 -0.19 0.00 0.70 0.00 0.00 55.95 59.30 2wn9 s SER 146 Cb -0.02 -2.63 -0.22 0.00 -1.71 0.00 0.00 66.02 61.45 2wn9 s SER 146 CO 0.02 -1.08 1.15 -0.25 1.20 0.00 0.00 173.24 174.28 2wn9 h TRP 147 N 2.16 0.68 0.00 3.44 2.91 -1.83 -3.41 115.95 119.90 2wn9 h TRP 147 Ca -0.50 -0.35 0.00 0.00 1.13 0.00 0.00 58.89 59.17 2wn9 h TRP 147 Cb 1.26 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2wn9 h TRP 147 CO 0.51 1.16 -0.14 1.33 -1.03 0.00 0.00 178.44 180.26 2wn9 n VAL 148 N -4.18 0.00 -3.77 2.65 0.24 -1.26 -5.01 118.33 107.00 2wn9 n VAL 148 Ca -0.10 -0.43 -0.35 0.00 -2.04 0.00 0.00 64.34 61.42 2wn9 n VAL 148 Cb 0.67 0.95 -0.09 0.00 -1.47 0.00 0.00 33.84 33.91 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 -1.20 3.37 0.96 6.34 2.02 -1.26 -5.10 117.35 122.47 2wn9 s TYR 149 Ca 0.00 0.26 -0.15 0.00 -0.37 0.00 0.00 57.07 56.82 2wn9 s TYR 149 Cb 0.01 -2.16 0.17 0.00 -0.40 0.00 0.00 41.96 39.58 2wn9 s TYR 149 CO 0.05 0.23 1.22 -1.54 -1.57 0.00 0.00 175.55 173.94 2wn9 s SER 150 N 0.47 3.14 0.27 2.29 1.04 -1.26 -4.67 113.70 114.97 2wn9 s SER 150 Ca 0.07 0.60 0.22 0.00 0.48 0.00 0.00 55.95 57.32 2wn9 s SER 150 Cb -0.12 -0.89 1.02 0.00 0.10 0.00 0.00 66.02 66.14 2wn9 s SER 150 CO -0.01 -2.74 1.67 0.61 0.98 0.00 0.00 173.24 173.74 2wn9 n GLY 151 N -2.85 -1.08 0.03 7.32 0.00 0.82 -0.96 105.19 108.46 2wn9 n GLY 151 Ca 0.11 0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.40 2wn9 n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2wn9 n PHE 152 N -2.21 0.00 -0.03 1.61 3.72 -1.26 -4.18 117.46 115.12 2wn9 n PHE 152 Ca 0.01 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.36 2wn9 n PHE 152 Cb 0.14 -0.33 -0.02 0.00 -0.94 0.00 0.00 39.48 38.33 2wn9 n PHE 152 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2wn9 n GLU 153 N -1.31 0.13 -3.97 -1.08 4.71 -0.13 -4.19 120.64 114.79 2wn9 n GLU 153 Ca 0.11 0.04 -0.29 0.00 -0.01 0.00 0.00 57.16 57.01 2wn9 n GLU 153 Cb 0.29 -0.88 -0.16 0.00 -1.01 0.00 0.00 31.44 29.68 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 -2.11 1.39 0.13 -3.67 1.01 -0.14 -1.03 121.20 116.78 2wn9 s ILE 154 Ca -0.08 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.92 2wn9 s ILE 154 Cb 0.03 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 2wn9 s ILE 154 CO 0.11 0.31 0.31 -0.62 0.00 0.00 0.00 174.94 175.05 2wn9 s ASP 155 N 1.54 6.40 0.14 3.58 2.15 -0.03 -3.97 116.67 126.48 2wn9 s ASP 155 Ca 0.03 0.38 0.10 0.00 0.43 0.00 0.00 52.55 53.48 2wn9 s ASP 155 Cb -0.14 -2.00 -0.04 0.00 -0.30 0.00 0.00 42.92 40.44 2wn9 s ASP 155 CO -0.09 0.07 -0.20 -0.76 -0.17 0.00 0.00 175.17 174.01 2wn9 s LEU 156 N -2.85 2.59 0.01 -1.34 1.43 -1.26 -0.02 118.68 117.24 2wn9 s LEU 156 Ca 0.37 -0.67 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2wn9 s LEU 156 Cb -0.12 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.72 2wn9 s LEU 156 CO 0.27 0.16 0.27 -0.75 0.23 0.00 0.00 176.35 176.54 2wn9 s LYS 157 N -2.32 0.69 0.14 1.70 2.20 -0.65 -4.92 119.74 116.58 2wn9 s LYS 157 Ca 0.18 -0.35 0.07 0.00 -0.36 0.00 0.00 55.97 55.51 2wn9 s LYS 157 Cb -0.10 0.30 -0.04 0.00 -1.51 0.00 0.00 37.83 36.48 2wn9 s LYS 157 CO 0.10 -0.20 -0.03 0.95 -0.36 0.00 0.00 175.35 175.81 2wn9 s THR 158 N -1.81 3.70 -0.09 3.43 -4.23 -1.26 -0.71 115.64 114.66 2wn9 s THR 158 Ca -0.10 -1.28 0.14 0.00 -1.18 0.00 0.00 61.69 59.26 2wn9 s THR 158 Cb -0.04 -2.81 -0.03 0.00 1.34 0.00 0.00 72.50 70.97 2wn9 s THR 158 CO 0.01 0.00 1.29 0.44 -0.54 0.00 0.00 174.62 175.82 2wn9 h ASP 159 N 3.11 0.00 -5.13 3.99 3.45 -1.97 -3.47 116.42 116.39 2wn9 h ASP 159 Ca -0.48 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 56.91 2wn9 h ASP 159 Cb 1.18 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 39.82 2wn9 h ASP 159 CO 0.57 0.62 -0.29 0.28 -1.57 0.00 0.00 179.24 178.86 2wn9 s THR 160 N -2.90 0.12 -2.50 0.35 -1.32 -1.26 -5.04 115.64 103.10 2wn9 s THR 160 Ca 0.02 -1.01 0.23 0.00 -1.21 0.00 0.00 61.69 59.72 2wn9 s THR 160 Cb 0.08 -1.28 0.41 0.00 -1.51 0.00 0.00 72.50 70.19 2wn9 s THR 160 CO 0.77 -0.56 1.43 -0.90 -2.21 0.00 0.00 174.62 173.16 2wn9 n ASP 161 N -0.10 2.89 -4.64 8.08 5.68 -1.26 -4.78 116.55 122.43 2wn9 n ASP 161 Ca -0.15 -1.91 -0.39 0.00 -0.50 0.00 0.00 54.79 51.83 2wn9 n ASP 161 Cb 0.63 -0.17 -0.08 0.00 -1.14 0.00 0.00 41.12 40.36 2wn9 n ASP 161 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2wn9 s GLN 162 N -1.65 4.11 0.35 0.11 -1.52 -1.26 -1.16 119.66 118.63 2wn9 s GLN 162 Ca 0.36 0.27 -0.29 0.00 -1.95 0.00 0.00 55.36 53.75 2wn9 s GLN 162 Cb 0.21 -3.61 -0.11 0.00 -0.22 0.00 0.00 33.01 29.28 2wn9 s GLN 162 CO 0.30 -0.23 1.42 0.08 -0.25 0.00 0.00 175.29 176.61 2wn9 s VAL 163 N 1.91 2.34 -0.25 1.09 1.01 -0.72 -4.87 120.40 120.91 2wn9 s VAL 163 Ca 0.20 0.33 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 2wn9 s VAL 163 Cb -0.15 -3.21 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2wn9 s VAL 163 CO 0.09 0.08 1.56 -0.62 0.00 0.00 0.00 175.10 176.20 2wn9 s ASP 164 N -0.21 6.41 -0.00 3.32 2.15 -0.77 -4.86 116.67 122.71 2wn9 s ASP 164 Ca 0.52 1.50 0.12 0.00 0.43 0.00 0.00 52.55 55.13 2wn9 s ASP 164 Cb -0.44 -2.53 0.35 0.00 -0.30 0.00 0.00 42.92 40.00 2wn9 s ASP 164 CO 0.57 -1.25 1.29 0.18 -0.17 0.00 0.00 175.17 175.79 2wn9 n LEU 165 N 8.38 3.06 0.11 -1.34 4.77 -1.26 -1.97 117.00 128.75 2wn9 n LEU 165 Ca 0.18 -2.02 0.11 0.00 -0.03 0.00 0.00 56.01 54.25 2wn9 n LEU 165 Cb 0.46 -0.27 0.46 0.00 -2.33 0.00 0.00 43.42 41.74 2wn9 n LEU 165 CO 0.65 0.76 0.83 -1.54 -1.33 0.00 0.00 177.39 176.75 2wn9 n SER 166 N 0.62 0.55 -0.42 -1.43 3.41 -1.26 -2.20 113.62 112.89 2wn9 n SER 166 Ca 0.13 0.65 0.06 0.00 -0.26 0.00 0.00 58.87 59.45 2wn9 n SER 166 Cb 0.46 -0.76 0.14 0.00 -0.26 0.00 0.00 64.21 63.79 2wn9 n SER 166 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wn9 n SER 167 N -2.12 2.84 -4.73 4.04 7.64 -1.26 -5.03 113.62 115.00 2wn9 n SER 167 Ca 0.02 -2.56 -0.42 0.00 1.01 0.00 0.00 58.87 56.92 2wn9 n SER 167 Cb 0.20 -0.32 -0.03 0.00 -1.01 0.00 0.00 64.21 63.05 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 -1.99 3.28 -0.05 1.43 5.04 -0.93 -4.56 117.35 119.57 2wn9 s TYR 168 Ca 0.25 1.19 -0.30 0.00 -2.44 0.00 0.00 57.07 55.77 2wn9 s TYR 168 Cb 0.20 -3.60 -0.07 0.00 0.35 0.00 0.00 41.96 38.84 2wn9 s TYR 168 CO 0.07 -1.90 1.82 -0.47 -1.34 0.00 0.00 175.55 173.73 2wn9 s TYR 169 N 0.35 1.65 0.43 4.97 5.04 0.33 -4.87 117.35 125.25 2wn9 s TYR 169 Ca 0.58 -0.01 0.36 0.00 -2.44 0.00 0.00 57.07 55.55 2wn9 s TYR 169 Cb -0.36 -4.06 1.82 0.00 0.35 0.00 0.00 41.96 39.72 2wn9 s TYR 169 CO 0.36 -4.48 2.17 0.00 -1.34 0.00 0.00 175.55 172.26 2wn9 h ALA 170 N 10.48 1.11 -0.18 3.97 0.00 -1.90 -2.45 119.26 130.29 2wn9 h ALA 170 Ca -0.43 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 2wn9 h ALA 170 Cb 1.20 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 2wn9 h ALA 170 CO 0.95 0.05 -0.15 0.43 0.00 0.00 0.00 179.25 180.53 2wn9 n SER 171 N -3.29 2.52 -4.62 0.00 7.64 -1.26 -5.04 113.62 109.57 2wn9 n SER 171 Ca -0.02 -3.53 -0.36 0.00 1.01 0.00 0.00 58.87 55.97 2wn9 n SER 171 Cb 0.19 -0.55 0.08 0.00 -1.01 0.00 0.00 64.21 62.91 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 -1.07 0.62 0.29 6.43 2.88 -0.93 -4.89 113.62 116.95 2wn9 n SER 172 Ca 0.24 0.70 0.17 0.00 -1.33 0.00 0.00 58.87 58.64 2wn9 n SER 172 Cb 0.85 -1.41 0.88 0.00 -0.75 0.00 0.00 64.21 63.78 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 -0.09 0.00 -5.89 -1.46 1.79 -1.91 -3.43 116.57 105.59 2wn9 h LYS 173 Ca -0.48 0.00 -0.67 0.00 -2.18 0.00 0.00 60.65 57.32 2wn9 h LYS 173 Cb 1.34 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.68 2wn9 h LYS 173 CO 0.48 0.05 -0.88 0.71 -1.08 0.00 0.00 179.45 178.73 2wn9 s TYR 174 N -4.15 2.32 0.08 -1.35 2.02 -1.26 -1.13 117.35 113.87 2wn9 s TYR 174 Ca -0.03 -0.69 -0.07 0.00 -0.37 0.00 0.00 57.07 55.91 2wn9 s TYR 174 Cb 0.13 -1.52 -0.05 0.00 -0.40 0.00 0.00 41.96 40.11 2wn9 s TYR 174 CO 0.52 -0.21 0.36 -1.83 -1.57 0.00 0.00 175.55 172.82 2wn9 s GLU 175 N -0.12 3.67 -0.22 -0.62 -1.05 0.40 -4.81 118.70 115.95 2wn9 s GLU 175 Ca -0.04 0.03 -0.18 0.00 -0.15 0.00 0.00 54.97 54.63 2wn9 s GLU 175 Cb -0.13 -2.97 -0.03 0.00 -0.44 0.00 0.00 34.13 30.55 2wn9 s GLU 175 CO 0.03 0.55 0.51 0.42 0.95 0.00 0.00 175.26 177.73 2wn9 s ILE 176 N -1.45 5.10 -0.10 1.83 -1.09 -1.26 -1.53 121.20 122.70 2wn9 s ILE 176 Ca 0.34 0.91 -0.07 0.00 -2.23 0.00 0.00 60.65 59.61 2wn9 s ILE 176 Cb -0.13 -3.83 -0.27 0.00 -1.58 0.00 0.00 42.46 36.65 2wn9 s ILE 176 CO 0.20 0.16 0.45 -0.07 -1.23 0.00 0.00 174.94 174.44 2wn9 h LEU 177 N 8.14 0.44 -7.00 2.97 3.38 -0.86 -3.49 115.31 118.89 2wn9 h LEU 177 Ca -0.33 -0.91 0.02 0.00 0.09 0.00 0.00 57.88 56.75 2wn9 h LEU 177 Cb 1.15 -0.14 -0.15 0.00 0.09 0.00 0.00 40.66 41.61 2wn9 h LEU 177 CO 0.73 1.81 0.31 -0.94 0.09 0.00 0.00 178.44 180.44 2wn9 s SER 178 N -7.05 -0.51 -0.20 -0.43 1.04 -1.06 -4.98 113.70 100.51 2wn9 s SER 178 Ca -0.20 0.17 -0.06 0.00 0.48 0.00 0.00 55.95 56.35 2wn9 s SER 178 Cb 0.06 0.50 0.10 0.00 0.10 0.00 0.00 66.02 66.79 2wn9 s SER 178 CO 0.79 -0.75 0.39 0.00 0.98 0.00 0.00 173.24 174.65 2wn9 s ALA 179 N -2.86 -1.05 0.20 5.32 0.00 -1.26 -0.78 121.76 121.33 2wn9 s ALA 179 Ca -0.00 1.27 0.10 0.00 0.00 0.00 0.00 51.96 53.33 2wn9 s ALA 179 Cb -0.01 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 2wn9 s ALA 179 CO -0.06 -0.87 -0.20 0.95 0.00 0.00 0.00 175.76 175.58 2wn9 s THR 180 N 2.57 2.10 -0.13 0.00 -4.23 -0.64 -1.75 115.64 113.55 2wn9 s THR 180 Ca 0.02 -2.09 -0.02 0.00 -1.18 0.00 0.00 61.69 58.42 2wn9 s THR 180 Cb -0.13 -2.04 0.04 0.00 1.34 0.00 0.00 72.50 71.71 2wn9 s THR 180 CO -0.13 -0.31 0.03 0.00 -0.54 0.00 0.00 174.62 173.67 2wn9 s GLN 181 N -3.01 0.51 -0.08 3.99 -2.07 -0.31 -1.27 119.66 117.42 2wn9 s GLN 181 Ca 0.21 -0.10 0.01 0.00 -1.82 0.00 0.00 55.36 53.66 2wn9 s GLN 181 Cb -0.06 -1.49 0.02 0.00 -1.09 0.00 0.00 33.01 30.40 2wn9 s GLN 181 CO 0.09 -0.48 -0.08 0.99 -1.32 0.00 0.00 175.29 174.49 2wn9 s THR 182 N 1.96 0.90 0.16 3.63 2.01 -0.64 -4.27 115.64 119.39 2wn9 s THR 182 Ca 0.02 -0.29 -0.31 0.00 0.31 0.00 0.00 61.69 61.43 2wn9 s THR 182 Cb -0.15 -0.89 -0.09 0.00 0.01 0.00 0.00 72.50 71.38 2wn9 s THR 182 CO -0.07 0.32 1.46 -0.60 -0.69 0.00 0.00 174.62 175.05 2wn9 s ARG 183 N 1.16 4.27 -0.01 4.92 3.52 -1.26 -0.50 118.95 131.06 2wn9 s ARG 183 Ca -0.06 2.22 0.06 0.00 -0.13 0.00 0.00 55.73 57.82 2wn9 s ARG 183 Cb -0.14 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.05 2wn9 s ARG 183 CO -0.02 -0.49 -0.18 -0.65 -0.81 0.00 0.00 175.30 173.15 2wn9 s GLN 184 N 0.85 1.41 -0.23 5.12 -0.21 0.11 -4.94 119.66 121.77 2wn9 s GLN 184 Ca 0.66 -0.67 0.00 0.00 0.02 0.00 0.00 55.36 55.37 2wn9 s GLN 184 Cb -0.40 -1.38 0.03 0.00 1.00 0.00 0.00 33.01 32.26 2wn9 s GLN 184 CO 0.33 0.38 -0.12 0.08 -2.12 0.00 0.00 175.29 173.84 2wn9 s VAL 185 N -0.48 2.45 0.11 1.09 1.01 -1.26 -1.33 120.40 121.99 2wn9 s VAL 185 Ca 0.07 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 60.95 2wn9 s VAL 185 Cb -0.07 -2.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 2wn9 s VAL 185 CO -0.00 0.24 -0.05 0.00 0.00 0.00 0.00 175.10 175.29 2wn9 s GLN 186 N 1.26 2.34 -0.19 2.72 -2.07 0.72 -4.93 119.66 119.51 2wn9 s GLN 186 Ca -0.01 -0.95 0.01 0.00 -1.82 0.00 0.00 55.36 52.59 2wn9 s GLN 186 Cb -0.16 -2.41 0.03 0.00 -1.09 0.00 0.00 33.01 29.38 2wn9 s GLN 186 CO -0.07 0.52 -0.13 -1.01 -1.32 0.00 0.00 175.29 173.27 2wn9 s HIS 187 N -1.31 2.49 0.59 9.60 3.76 -1.26 -0.68 115.29 128.47 2wn9 s HIS 187 Ca 0.24 -1.56 -0.08 0.00 -0.15 0.00 0.00 55.06 53.51 2wn9 s HIS 187 Cb -0.11 -1.70 -0.02 0.00 1.11 0.00 0.00 32.58 31.85 2wn9 s HIS 187 CO 0.16 -0.75 0.94 0.71 -0.85 0.00 0.00 174.74 174.96 2wn9 s TYR 188 N 1.38 3.49 0.20 1.40 1.51 -1.26 -5.00 117.35 119.06 2wn9 s TYR 188 Ca 0.01 0.98 0.10 0.00 -1.01 0.00 0.00 57.07 57.15 2wn9 s TYR 188 Cb -0.15 -2.65 0.16 0.00 -0.11 0.00 0.00 41.96 39.21 2wn9 s TYR 188 CO -0.10 -0.67 1.49 0.77 -1.11 0.00 0.00 175.55 175.94 2wn9 h SER 189 N -0.18 0.00 -0.82 2.29 0.02 -2.00 -3.25 113.55 109.61 2wn9 h SER 189 Ca -0.45 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 60.69 2wn9 h SER 189 Cb 1.22 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.64 2wn9 h SER 189 CO 0.62 0.74 0.29 0.00 -1.14 0.00 0.00 176.83 177.34 2wn9 h PRO 192 N 3.39 0.00 -6.98 0.00 0.13 -1.89 -3.39 132.00 123.26 2wn9 h PRO 192 Ca -0.33 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.32 2wn9 h PRO 192 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 2wn9 h PRO 192 CO 0.57 0.40 0.40 -1.83 -0.23 0.00 0.00 178.00 177.31 2wn9 s GLU 193 N -2.88 4.13 0.52 0.86 1.03 -1.26 -5.02 118.70 116.08 2wn9 s GLU 193 Ca -0.02 1.45 -0.18 0.00 0.03 0.00 0.00 54.97 56.26 2wn9 s GLU 193 Cb 0.08 -2.46 -0.07 0.00 -0.80 0.00 0.00 34.13 30.88 2wn9 s GLU 193 CO 0.80 -0.16 1.02 -1.25 -1.33 0.00 0.00 175.26 174.34 2wn9 s PRO 194 N -2.63 3.77 -0.06 -4.83 0.04 -1.26 -4.72 135.00 125.31 2wn9 s PRO 194 Ca 0.59 1.17 0.06 0.00 0.04 0.00 0.00 61.00 62.86 2wn9 s PRO 194 Cb -0.20 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 2wn9 s PRO 194 CO 0.25 -0.44 -0.25 0.71 0.04 0.00 0.00 177.00 177.32 2wn9 s TYR 195 N -2.33 2.45 -0.04 0.56 2.02 0.15 -0.13 117.35 120.02 2wn9 s TYR 195 Ca 0.63 -0.70 0.06 0.00 -0.37 0.00 0.00 57.07 56.69 2wn9 s TYR 195 Cb -0.13 -1.60 -0.02 0.00 -0.40 0.00 0.00 41.96 39.81 2wn9 s TYR 195 CO 0.27 -0.20 -0.24 0.42 -1.57 0.00 0.00 175.55 174.23 2wn9 s ILE 196 N -0.18 2.18 0.17 2.71 -1.09 -1.26 -0.20 121.20 123.53 2wn9 s ILE 196 Ca -0.03 -1.04 -0.06 0.00 -2.23 0.00 0.00 60.65 57.29 2wn9 s ILE 196 Cb -0.14 -1.78 -0.02 0.00 -1.58 0.00 0.00 42.46 38.94 2wn9 s ILE 196 CO 0.03 0.58 0.22 1.51 -1.23 0.00 0.00 174.94 176.05 2wn9 s ASP 197 N -0.39 0.12 -0.20 3.58 1.47 -0.44 -4.43 116.67 116.38 2wn9 s ASP 197 Ca 0.03 -1.04 -0.02 0.00 1.18 0.00 0.00 52.55 52.71 2wn9 s ASP 197 Cb -0.12 0.40 -0.00 0.00 -0.34 0.00 0.00 42.92 42.86 2wn9 s ASP 197 CO 0.01 -0.86 -0.10 -0.69 0.68 0.00 0.00 175.17 174.21 2wn9 s VAL 198 N -4.02 2.93 -0.29 2.11 1.01 0.31 0.06 120.40 122.51 2wn9 s VAL 198 Ca 0.22 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 2wn9 s VAL 198 Cb 0.05 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 2wn9 s VAL 198 CO 0.03 0.47 0.44 0.21 0.00 0.00 0.00 175.10 176.26 2wn9 s ASN 199 N 1.27 6.32 -0.30 3.32 2.47 0.34 -0.79 114.94 127.57 2wn9 s ASN 199 Ca 0.03 0.28 -0.15 0.00 0.42 0.00 0.00 52.86 53.44 2wn9 s ASN 199 Cb -0.14 -2.24 -0.03 0.00 -1.45 0.00 0.00 41.25 37.39 2wn9 s ASN 199 CO -0.05 -0.28 0.38 -0.22 -3.72 0.00 0.00 177.10 173.21 2wn9 s LEU 200 N 2.21 4.20 -0.16 3.21 2.96 0.12 -1.62 118.68 129.60 2wn9 s LEU 200 Ca 0.17 0.08 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 2wn9 s LEU 200 Cb -0.16 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.14 2wn9 s LEU 200 CO 0.10 -0.26 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.97 2wn9 s VAL 201 N 2.08 2.03 -0.11 1.68 1.01 -0.40 -1.12 120.40 125.57 2wn9 s VAL 201 Ca 0.14 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.20 2wn9 s VAL 201 Cb -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.41 2wn9 s VAL 201 CO 0.11 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.88 2wn9 s VAL 202 N 1.03 1.71 -0.18 2.92 1.01 -0.14 -1.62 120.40 125.13 2wn9 s VAL 202 Ca -0.02 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.11 2wn9 s VAL 202 Cb -0.14 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2wn9 s VAL 202 CO -0.07 0.48 0.05 -0.75 0.00 0.00 0.00 175.10 174.82 2wn9 s LYS 203 N 0.80 3.95 0.10 2.72 2.20 0.04 -1.58 119.74 127.97 2wn9 s LYS 203 Ca -0.10 -0.36 -0.13 0.00 -0.36 0.00 0.00 55.97 55.02 2wn9 s LYS 203 Cb -0.16 -3.19 0.02 0.00 -1.51 0.00 0.00 37.83 33.00 2wn9 s LYS 203 CO 0.01 0.27 0.32 -0.59 -0.36 0.00 0.00 175.35 175.00 2wn9 s PHE 204 N 0.37 -0.08 0.09 4.03 -0.12 -0.43 -0.10 117.98 121.74 2wn9 s PHE 204 Ca 0.02 -0.25 -0.13 0.00 -0.05 0.00 0.00 56.93 56.53 2wn9 s PHE 204 Cb -0.12 0.14 0.02 0.00 -0.63 0.00 0.00 43.02 42.42 2wn9 s PHE 204 CO 0.00 -0.62 0.29 -0.98 -0.05 0.00 0.00 175.22 173.86 2wn9 s ARG 205 N -3.65 0.91 0.26 1.99 1.70 -0.58 -0.15 118.95 119.42 2wn9 s ARG 205 Ca 0.02 -0.75 -0.31 0.00 -0.47 0.00 0.00 55.73 54.23 2wn9 s ARG 205 Cb 0.03 0.39 -0.12 0.00 -0.57 0.00 0.00 34.95 34.67 2wn9 s ARG 205 CO -0.10 -0.31 1.59 0.39 -1.08 0.00 0.00 175.30 175.78 2wn9 n GLU 206 N 0.07 2.56 -1.97 3.89 1.02 0.23 -0.46 120.64 125.99 2wn9 n GLU 206 Ca -0.16 0.92 -0.39 0.00 -0.02 0.00 0.00 57.16 57.50 2wn9 n GLU 206 Cb 0.62 -2.69 0.01 0.00 -0.02 0.00 0.00 31.44 29.36 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 -0.04 3.69 0.00 3.49 3.52 -0.28 -4.68 118.95 124.65 2wn9 s ARG 207 Ca 0.68 2.18 0.00 0.00 -0.13 0.00 0.00 55.73 58.46 2wn9 s ARG 207 Cb -0.54 -2.57 0.00 0.00 -1.56 0.00 0.00 34.95 30.28 2wn9 s ARG 207 CO 0.45 -0.73 0.35 2.89 -0.81 0.00 0.00 175.30 177.44