#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn9 h ASP -4 N 0.00 0.07 0.22 1.67 5.19 -2.05 0.15 116.42 121.67 2wn9 h ASP -4 Ca 0.00 -0.01 -0.27 0.00 -0.62 0.00 0.00 57.03 56.13 2wn9 h ASP -4 Cb 0.00 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 39.51 2wn9 h ASP -4 CO 0.00 0.13 -1.12 0.44 -3.12 0.00 0.00 179.24 175.57 2wn9 h ASP -3 N 0.08 0.73 -0.38 6.45 3.32 -2.05 -1.75 116.42 122.82 2wn9 h ASP -3 Ca 0.02 -0.64 -0.00 0.00 0.02 0.00 0.00 57.03 56.42 2wn9 h ASP -3 Cb 0.13 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2wn9 h ASP -3 CO 0.01 1.46 0.23 0.44 -1.72 0.00 0.00 179.24 179.65 2wn9 h ASP -2 N 0.26 0.47 -0.21 6.45 3.32 -1.88 0.35 116.42 125.18 2wn9 h ASP -2 Ca -0.14 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.80 2wn9 h ASP -2 Cb 1.78 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 41.21 2wn9 h ASP -2 CO 0.21 0.37 -0.20 0.11 -1.72 0.00 0.00 179.24 178.01 2wn9 h LYS -1 N 0.55 0.51 -0.89 3.56 1.57 -0.67 -1.21 116.57 119.98 2wn9 h LYS -1 Ca 0.14 -0.27 0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2wn9 h LYS -1 Cb -0.00 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 2wn9 h LYS -1 CO -0.03 0.84 0.58 1.25 -0.57 0.00 0.00 179.45 181.53 2wn9 h LEU 0 N 0.20 0.98 -0.79 2.94 6.46 -0.85 -1.96 115.31 122.29 2wn9 h LEU 0 Ca 0.04 -0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.71 2wn9 h LEU 0 Cb 0.74 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 40.42 2wn9 h LEU 0 CO 0.05 0.69 0.07 0.45 -0.62 0.00 0.00 178.44 179.08 2wn9 h HIS 1 N 1.15 1.05 -0.59 1.25 3.86 -0.21 -1.83 115.15 119.83 2wn9 h HIS 1 Ca 0.35 -0.14 -0.06 0.00 -1.16 0.00 0.00 60.37 59.35 2wn9 h HIS 1 Cb -0.04 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.11 2wn9 h HIS 1 CO -0.01 0.90 0.14 0.66 0.86 0.00 0.00 177.93 180.47 2wn9 h SER 2 N 0.93 0.91 -0.46 2.45 4.64 -0.76 -0.83 113.55 120.43 2wn9 h SER 2 Ca 0.18 -0.24 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 2wn9 h SER 2 Cb 0.44 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 2wn9 h SER 2 CO 0.01 0.91 0.14 1.56 -0.87 0.00 0.00 176.83 178.59 2wn9 h GLN 3 N 0.86 0.71 -0.51 4.77 4.20 -1.25 -1.94 115.11 121.96 2wn9 h GLN 3 Ca 0.19 -0.15 0.04 0.00 0.06 0.00 0.00 58.65 58.79 2wn9 h GLN 3 Cb 0.36 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 2wn9 h GLN 3 CO 0.00 0.68 0.25 0.00 -0.67 0.00 0.00 178.83 179.09 2wn9 h ALA 4 N 1.00 0.64 -0.74 3.87 0.00 -1.14 0.58 119.26 123.47 2wn9 h ALA 4 Ca 0.15 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2wn9 h ALA 4 Cb 0.26 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2wn9 h ALA 4 CO -0.01 -0.09 0.40 -0.91 0.00 0.00 0.00 179.25 178.64 2wn9 h ASN 5 N 0.50 0.93 -0.27 0.00 2.35 -0.99 -0.03 115.58 118.07 2wn9 h ASN 5 Ca 0.22 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.76 2wn9 h ASN 5 Cb 0.13 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 2wn9 h ASN 5 CO -0.16 0.77 -0.24 0.25 -1.65 0.00 0.00 177.43 176.40 2wn9 h LEU 6 N 1.02 0.68 -0.46 1.61 5.85 -0.97 -0.81 115.31 122.24 2wn9 h LEU 6 Ca 0.26 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.56 2wn9 h LEU 6 Cb 0.05 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 2wn9 h LEU 6 CO -0.04 1.00 0.22 0.24 -0.34 0.00 0.00 178.44 179.52 2wn9 h MET 7 N 0.37 0.43 -0.66 1.25 2.86 -0.71 -0.96 114.93 117.52 2wn9 h MET 7 Ca 0.05 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2wn9 h MET 7 Cb 0.80 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 2wn9 h MET 7 CO 0.06 0.28 0.32 -0.09 1.06 0.00 0.00 176.91 178.55 2wn9 h ARG 8 N 0.44 0.94 -0.05 1.72 2.43 -0.96 -1.22 114.38 117.68 2wn9 h ARG 8 Ca 0.20 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2wn9 h ARG 8 Cb 0.12 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2wn9 h ARG 8 CO -0.15 0.74 0.03 1.25 -1.51 0.00 0.00 179.97 180.34 2wn9 h LEU 9 N 0.91 0.06 -0.86 3.80 5.85 -0.72 -0.17 115.31 124.17 2wn9 h LEU 9 Ca 0.23 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 2wn9 h LEU 9 Cb 0.11 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 2wn9 h LEU 9 CO -0.03 0.05 0.42 0.11 -0.34 0.00 0.00 178.44 178.66 2wn9 h LYS 10 N 0.06 1.24 -0.56 1.25 1.57 -1.07 -0.06 116.57 118.99 2wn9 h LYS 10 Ca 0.02 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 2wn9 h LYS 10 Cb 0.00 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 2wn9 h LYS 10 CO -0.00 0.94 0.29 1.03 -0.57 0.00 0.00 179.45 181.14 2wn9 h SER 11 N 1.23 0.71 -0.40 0.86 0.87 -1.02 0.16 113.55 115.95 2wn9 h SER 11 Ca 0.30 -0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 2wn9 h SER 11 Cb 0.10 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 2wn9 h SER 11 CO -0.04 0.61 0.09 0.44 -0.53 0.00 0.00 176.83 177.40 2wn9 h ASP 12 N 0.75 0.62 0.58 6.23 3.32 -0.58 0.31 116.42 127.65 2wn9 h ASP 12 Ca 0.20 -0.24 -0.18 0.00 0.02 0.00 0.00 57.03 56.83 2wn9 h ASP 12 Cb 0.07 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2wn9 h ASP 12 CO -0.03 0.70 -0.79 -0.07 -1.72 0.00 0.00 179.24 177.34 2wn9 h LEU 13 N 0.51 0.19 0.00 1.55 3.38 -0.81 -3.15 115.31 116.98 2wn9 h LEU 13 Ca 0.12 -0.14 -0.25 0.00 0.09 0.00 0.00 57.88 57.70 2wn9 h LEU 13 Cb 0.33 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 2wn9 h LEU 13 CO 0.00 0.90 -1.95 0.49 0.09 0.00 0.00 178.44 177.97 2wn9 n PHE 14 N -3.70 0.00 -0.11 1.13 0.99 0.53 -4.37 117.46 111.92 2wn9 n PHE 14 Ca -0.03 0.00 -0.14 0.00 -0.00 0.00 0.00 57.45 57.29 2wn9 n PHE 14 Cb 0.75 -0.65 -0.13 0.00 -1.00 0.00 0.00 39.48 38.45 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 -2.92 1.25 -1.24 4.37 5.03 0.91 -4.29 115.26 118.37 2wn9 n ASN 15 Ca -0.29 -0.08 0.10 0.00 0.87 0.00 0.00 54.58 55.19 2wn9 n ASN 15 Cb 0.83 0.20 0.29 0.00 -1.02 0.00 0.00 39.78 40.09 2wn9 n ASN 15 CO 0.00 0.00 0.00 -2.11 -1.83 0.00 0.00 177.26 173.32 2wn9 n ARG 16 N -3.01 2.63 -4.29 3.52 1.85 -0.21 -4.83 116.66 112.33 2wn9 n ARG 16 Ca -0.39 -2.38 -0.18 0.00 -1.00 0.00 0.00 57.85 53.91 2wn9 n ARG 16 Cb 1.04 -1.55 -0.14 0.00 -1.05 0.00 0.00 32.46 30.76 2wn9 n ARG 16 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2wn9 s SER 17 N -0.98 1.10 0.28 2.89 0.01 -1.19 -4.96 113.70 110.85 2wn9 s SER 17 Ca 0.44 -0.28 -0.22 0.00 1.31 0.00 0.00 55.95 57.19 2wn9 s SER 17 Cb 0.24 -0.08 -0.09 0.00 0.21 0.00 0.00 66.02 66.29 2wn9 s SER 17 CO 0.29 0.04 0.83 -2.16 0.41 0.00 0.00 173.24 172.64 2wn9 s PRO 18 N -0.63 4.38 0.21 12.44 0.05 -1.26 -4.57 135.00 145.63 2wn9 s PRO 18 Ca 0.01 1.07 -0.32 0.00 0.05 0.00 0.00 61.00 61.80 2wn9 s PRO 18 Cb -0.05 -2.81 -0.13 0.00 0.05 0.00 0.00 34.50 31.57 2wn9 s PRO 18 CO 0.00 0.32 1.64 0.00 0.05 0.00 0.00 177.00 179.02 2wn9 n MET 19 N 0.57 2.55 -1.69 4.56 0.00 -1.26 -4.88 117.12 116.97 2wn9 n MET 19 Ca 0.00 0.92 -0.44 0.00 0.00 0.00 0.00 57.70 58.17 2wn9 n MET 19 Cb 0.51 -2.72 -0.04 0.00 0.00 0.00 0.00 33.22 30.97 2wn9 n MET 19 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 2wn9 n TYR 20 N 3.37 2.50 1.98 3.17 9.36 -1.26 -4.84 117.16 131.44 2wn9 n TYR 20 Ca 0.15 0.08 0.05 0.00 3.32 0.00 0.00 57.90 61.50 2wn9 n TYR 20 Cb 0.33 -2.64 0.30 0.00 -0.63 0.00 0.00 39.34 36.71 2wn9 n TYR 20 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2wn9 n PRO 21 N 4.40 1.02 0.00 2.98 -0.04 -1.26 -4.85 135.00 137.25 2wn9 n PRO 21 Ca 0.17 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 2wn9 n PRO 21 Cb 0.33 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 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 0.67 0.05 3.81 0.55 0.00 -1.26 -5.02 105.19 104.00 2wn9 n GLY 22 Ca 0.08 -1.81 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.95 2.46 0.30 1.61 0.04 -1.26 -5.06 135.00 131.14 2wn9 s PRO 23 Ca 0.00 0.75 0.02 0.00 0.04 0.00 0.00 61.00 61.81 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 -1.39 0.31 0.95 0.04 0.00 0.00 177.00 176.91 2wn9 s THR 24 N -3.12 0.00 0.41 1.26 -4.23 -1.02 -4.99 115.64 103.94 2wn9 s THR 24 Ca 0.60 -1.87 0.16 0.00 -1.18 0.00 0.00 61.69 59.39 2wn9 s THR 24 Cb -0.14 -2.52 0.17 0.00 1.34 0.00 0.00 72.50 71.34 2wn9 s THR 24 CO 0.54 0.00 1.94 0.11 -0.54 0.00 0.00 174.62 176.67 2wn9 h LYS 25 N 2.23 0.00 0.00 3.99 1.57 -1.91 -1.08 116.57 121.37 2wn9 h LYS 25 Ca -0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2wn9 h LYS 25 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2wn9 h LYS 25 CO 0.40 0.25 0.00 -0.44 -0.57 0.00 0.00 179.45 179.09 2wn9 h ASP 26 N 0.00 0.00 -1.55 0.86 3.32 -1.96 -3.38 116.42 113.71 2wn9 h ASP 26 Ca -0.00 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.60 2wn9 h ASP 26 Cb 0.47 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 39.68 2wn9 h ASP 26 CO 0.03 0.00 -1.00 -0.67 -1.72 0.00 0.00 179.24 175.88 2wn9 n ASP 27 N -2.82 -0.15 -4.78 6.45 2.03 -0.71 -5.14 116.55 111.42 2wn9 n ASP 27 Ca 0.04 -3.03 -0.31 0.00 0.52 0.00 0.00 54.79 52.01 2wn9 n ASP 27 Cb 0.48 -0.06 0.08 0.00 -0.72 0.00 0.00 41.12 40.91 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 2.37 -0.03 -0.67 0.04 -0.49 -2.44 135.00 132.39 2wn9 s PRO 28 Ca 0.35 1.02 0.05 0.00 0.04 0.00 0.00 61.00 62.47 2wn9 s PRO 28 Cb 0.27 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.88 2wn9 s PRO 28 CO -0.10 -1.52 -0.19 -1.17 0.04 0.00 0.00 177.00 174.06 2wn9 s LEU 29 N -5.82 1.99 -0.24 -3.56 2.96 -0.30 -4.93 118.68 108.78 2wn9 s LEU 29 Ca 0.60 -0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 54.06 2wn9 s LEU 29 Cb -0.16 -1.03 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 2wn9 s LEU 29 CO 0.56 0.20 0.10 -0.89 -1.32 0.00 0.00 176.35 174.99 2wn9 s THR 30 N -0.20 4.69 -0.19 3.68 2.01 -1.26 -1.08 115.64 123.28 2wn9 s THR 30 Ca 0.01 -0.05 -0.07 0.00 0.31 0.00 0.00 61.69 61.90 2wn9 s THR 30 Cb -0.10 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 2wn9 s THR 30 CO 0.01 0.35 0.04 -0.69 -0.69 0.00 0.00 174.62 173.65 2wn9 s VAL 31 N 1.29 4.49 -0.13 3.82 1.01 0.12 -4.58 120.40 126.42 2wn9 s VAL 31 Ca 0.05 -0.13 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 2wn9 s VAL 31 Cb -0.15 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 2wn9 s VAL 31 CO 0.05 0.44 0.46 -0.89 0.00 0.00 0.00 175.10 175.15 2wn9 s THR 32 N 0.68 5.20 0.04 3.92 2.01 0.24 -1.72 115.64 126.01 2wn9 s THR 32 Ca 0.02 0.90 0.09 0.00 0.31 0.00 0.00 61.69 63.01 2wn9 s THR 32 Cb -0.13 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 2wn9 s THR 32 CO 0.02 0.32 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.26 2wn9 s LEU 33 N 0.70 2.25 -0.17 4.42 1.43 -0.16 -1.48 118.68 125.67 2wn9 s LEU 33 Ca 0.25 -0.56 -0.16 0.00 -1.03 0.00 0.00 54.13 52.63 2wn9 s LEU 33 Cb -0.15 -1.33 0.04 0.00 0.03 0.00 0.00 46.19 44.79 2wn9 s LEU 33 CO 0.09 0.26 0.46 -0.83 0.23 0.00 0.00 176.35 176.56 2wn9 s GLY 34 N -1.26 -0.34 -0.06 -3.19 0.00 -0.60 -4.42 107.32 97.45 2wn9 s GLY 34 Ca 0.12 1.29 0.01 0.00 0.00 0.00 0.00 44.72 46.14 2wn9 s GLY 34 CO 0.03 1.11 -0.05 -1.36 0.00 0.00 0.00 173.10 172.82 2wn9 s PHE 35 N 0.22 2.97 -0.28 1.90 0.08 -1.26 -0.54 117.98 121.08 2wn9 s PHE 35 Ca -0.00 0.04 0.01 0.00 0.12 0.00 0.00 56.93 57.10 2wn9 s PHE 35 Cb -0.03 -1.70 0.06 0.00 -0.57 0.00 0.00 43.02 40.77 2wn9 s PHE 35 CO 0.01 0.37 -0.06 0.99 -0.10 0.00 0.00 175.22 176.43 2wn9 s THR 36 N -0.86 2.52 -0.21 0.64 2.01 -0.14 -1.78 115.64 117.81 2wn9 s THR 36 Ca 0.14 -1.57 -0.23 0.00 0.31 0.00 0.00 61.69 60.34 2wn9 s THR 36 Cb -0.11 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 2wn9 s THR 36 CO 0.03 -0.09 0.73 -0.22 -0.69 0.00 0.00 174.62 174.38 2wn9 s LEU 37 N 1.16 4.12 -0.18 4.42 2.96 -0.84 -0.93 118.68 129.40 2wn9 s LEU 37 Ca -0.07 0.95 0.02 0.00 -0.22 0.00 0.00 54.13 54.81 2wn9 s LEU 37 Cb -0.20 -3.05 -0.22 0.00 0.50 0.00 0.00 46.19 43.22 2wn9 s LEU 37 CO -0.04 -0.38 0.11 0.00 -1.32 0.00 0.00 176.35 174.73 2wn9 n GLN 38 N 5.43 0.69 -3.63 1.98 6.02 0.12 -3.47 117.38 124.54 2wn9 n GLN 38 Ca 0.02 0.19 -0.10 0.00 -0.01 0.00 0.00 57.00 57.10 2wn9 n GLN 38 Cb 0.49 -1.62 -0.07 0.00 1.02 0.00 0.00 30.24 30.06 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 -6.56 -0.49 -0.43 1.08 2.15 -0.94 -0.46 116.67 111.02 2wn9 s ASP 39 Ca -0.25 0.89 -0.18 0.00 0.43 0.00 0.00 52.55 53.44 2wn9 s ASP 39 Cb 0.08 0.88 0.03 0.00 -0.30 0.00 0.00 42.92 43.61 2wn9 s ASP 39 CO 0.71 -0.20 0.51 -0.63 -0.17 0.00 0.00 175.17 175.39 2wn9 s ILE 40 N 0.05 5.00 -0.09 4.11 1.01 -1.26 -0.88 121.20 129.15 2wn9 s ILE 40 Ca 0.02 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 2wn9 s ILE 40 Cb -0.04 -4.11 -0.29 0.00 0.01 0.00 0.00 42.46 38.03 2wn9 s ILE 40 CO -0.04 -0.50 0.73 0.58 0.00 0.00 0.00 174.94 175.71 2wn9 h VAL 41 N 5.78 1.36 -2.96 2.92 2.07 -1.31 -3.41 116.25 120.71 2wn9 h VAL 41 Ca -0.26 -2.45 -0.15 0.00 0.82 0.00 0.00 66.70 64.66 2wn9 h VAL 41 Cb 1.10 3.02 -0.25 0.00 -1.52 0.00 0.00 31.29 33.64 2wn9 h VAL 41 CO 0.84 0.67 -0.36 -0.75 0.02 0.00 0.00 177.57 177.99 2wn9 s LYS 42 N -2.41 0.35 -0.21 1.57 2.20 -1.22 -4.89 119.74 115.12 2wn9 s LYS 42 Ca -0.17 0.47 -0.01 0.00 -0.36 0.00 0.00 55.97 55.90 2wn9 s LYS 42 Cb 0.02 0.14 0.06 0.00 -1.51 0.00 0.00 37.83 36.54 2wn9 s LYS 42 CO 0.78 -0.06 -0.02 0.00 -0.36 0.00 0.00 175.35 175.69 2wn9 s ALA 43 N 0.34 1.55 -0.45 3.13 0.00 -1.26 -0.88 121.76 124.19 2wn9 s ALA 43 Ca -0.01 -1.06 -0.14 0.00 0.00 0.00 0.00 51.96 50.74 2wn9 s ALA 43 Cb -0.03 -1.31 0.06 0.00 0.00 0.00 0.00 23.12 21.84 2wn9 s ALA 43 CO -0.01 -1.16 0.35 0.34 0.00 0.00 0.00 175.76 175.28 2wn9 s ASP 44 N 1.60 6.06 0.00 0.00 -1.08 0.06 -4.94 116.67 118.37 2wn9 s ASP 44 Ca -0.03 -1.25 0.29 0.00 -0.52 0.00 0.00 52.55 51.03 2wn9 s ASP 44 Cb -0.18 -2.15 1.30 0.00 -1.46 0.00 0.00 42.92 40.43 2wn9 s ASP 44 CO -0.07 -0.59 1.94 -1.54 0.52 0.00 0.00 175.17 175.43 2wn9 n SER 45 N 5.15 0.06 0.07 -0.34 3.41 -1.26 -0.64 113.62 120.07 2wn9 n SER 45 Ca -0.12 0.15 -0.05 0.00 -0.26 0.00 0.00 58.87 58.59 2wn9 n SER 45 Cb 0.44 -0.35 -0.09 0.00 -0.26 0.00 0.00 64.21 63.95 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 0.04 0.00 0.00 4.04 4.64 -1.96 -3.37 113.55 116.95 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 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2wn9 h SER 46 CO 0.00 0.90 0.00 0.35 -0.87 0.00 0.00 176.83 177.21 2wn9 n THR 47 N -3.31 0.00 -3.56 2.95 -2.24 -1.20 -5.03 114.28 101.89 2wn9 n THR 47 Ca -0.00 -0.49 -0.23 0.00 -2.27 0.00 0.00 64.05 61.06 2wn9 n THR 47 Cb 0.90 1.01 0.05 0.00 -2.10 0.00 0.00 70.33 70.19 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 -0.66 -4.03 -4.15 3.42 4.13 0.18 -4.93 115.26 109.23 2wn9 n ASN 48 Ca 0.00 -0.84 -0.24 0.00 1.68 0.00 0.00 54.58 55.17 2wn9 n ASN 48 Cb 0.00 -4.21 -0.15 0.00 -1.54 0.00 0.00 39.78 33.88 2wn9 n ASN 48 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2wn9 s GLU 49 N -5.52 1.37 0.03 3.52 2.02 -1.08 -1.46 118.70 117.58 2wn9 s GLU 49 Ca 0.28 -0.60 0.07 0.00 0.02 0.00 0.00 54.97 54.74 2wn9 s GLU 49 Cb -0.07 -1.32 -0.02 0.00 0.10 0.00 0.00 34.13 32.82 2wn9 s GLU 49 CO 0.80 0.36 -0.20 0.08 0.02 0.00 0.00 175.26 176.32 2wn9 s VAL 50 N -0.38 1.60 -0.20 2.63 1.01 -0.59 -0.76 120.40 123.72 2wn9 s VAL 50 Ca 0.06 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 60.94 2wn9 s VAL 50 Cb -0.07 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 34.93 2wn9 s VAL 50 CO -0.01 0.26 -0.09 -1.81 0.00 0.00 0.00 175.10 173.46 2wn9 s ASP 51 N -0.97 4.03 0.03 3.32 1.11 -0.06 -1.42 116.67 122.72 2wn9 s ASP 51 Ca 0.07 -0.43 0.04 0.00 0.18 0.00 0.00 52.55 52.41 2wn9 s ASP 51 Cb -0.08 -1.67 -0.04 0.00 1.07 0.00 0.00 42.92 42.20 2wn9 s ASP 51 CO 0.01 0.01 -0.06 -0.76 1.18 0.00 0.00 175.17 175.55 2wn9 s LEU 52 N 1.28 3.22 -0.14 1.23 1.43 -0.16 -0.75 118.68 124.78 2wn9 s LEU 52 Ca 0.03 -0.17 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 2wn9 s LEU 52 Cb -0.14 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2wn9 s LEU 52 CO -0.04 0.25 -0.14 -0.69 0.23 0.00 0.00 176.35 175.96 2wn9 s VAL 53 N -1.08 2.88 0.17 -1.59 1.01 -0.05 -0.75 120.40 120.98 2wn9 s VAL 53 Ca 0.19 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 2wn9 s VAL 53 Cb -0.11 -2.22 0.03 0.00 0.00 0.00 0.00 36.38 34.08 2wn9 s VAL 53 CO 0.10 0.52 0.45 -0.72 0.00 0.00 0.00 175.10 175.45 2wn9 s TYR 54 N 0.60 -0.08 -0.16 5.22 -0.85 -0.60 -0.70 117.35 120.78 2wn9 s TYR 54 Ca -0.08 -0.26 -0.05 0.00 -0.52 0.00 0.00 57.07 56.17 2wn9 s TYR 54 Cb -0.16 0.29 -0.03 0.00 0.38 0.00 0.00 41.96 42.44 2wn9 s TYR 54 CO 0.03 -0.81 0.00 0.71 -1.52 0.00 0.00 175.55 173.96 2wn9 s TYR 55 N -3.86 3.13 -0.42 -3.49 4.12 -0.10 -0.78 117.35 115.95 2wn9 s TYR 55 Ca 0.08 -0.11 -0.08 0.00 0.02 0.00 0.00 57.07 56.98 2wn9 s TYR 55 Cb 0.01 -1.99 0.09 0.00 -1.52 0.00 0.00 41.96 38.54 2wn9 s TYR 55 CO -0.06 0.08 0.25 -2.00 0.02 0.00 0.00 175.55 173.85 2wn9 s GLU 56 N 0.26 2.50 -0.16 -0.62 2.12 -0.44 -0.96 118.70 121.39 2wn9 s GLU 56 Ca 0.00 -1.54 -0.26 0.00 0.36 0.00 0.00 54.97 53.53 2wn9 s GLU 56 Cb -0.13 -3.74 -0.01 0.00 0.26 0.00 0.00 34.13 30.50 2wn9 s GLU 56 CO 0.02 -0.98 0.88 -1.14 -0.54 0.00 0.00 175.26 173.50 2wn9 s GLN 57 N 1.37 4.32 -0.08 4.30 0.74 0.30 -3.36 119.66 127.26 2wn9 s GLN 57 Ca 0.04 1.12 0.04 0.00 0.05 0.00 0.00 55.36 56.60 2wn9 s GLN 57 Cb -0.23 -3.57 -0.01 0.00 1.10 0.00 0.00 33.01 30.30 2wn9 s GLN 57 CO 0.01 -0.35 -0.22 -0.65 -0.55 0.00 0.00 175.29 173.53 2wn9 s GLN 58 N 2.19 2.83 -0.01 1.67 -0.21 0.43 -1.56 119.66 124.99 2wn9 s GLN 58 Ca 0.41 -0.85 0.01 0.00 0.02 0.00 0.00 55.36 54.95 2wn9 s GLN 58 Cb -0.17 -2.30 0.01 0.00 1.00 0.00 0.00 33.01 31.56 2wn9 s GLN 58 CO 0.13 0.31 -0.02 0.50 -2.12 0.00 0.00 175.29 174.09 2wn9 s ARG 59 N 0.02 0.33 0.31 2.91 6.06 -0.55 -0.74 118.95 127.29 2wn9 s ARG 59 Ca -0.08 -0.05 -0.09 0.00 -2.50 0.00 0.00 55.73 53.01 2wn9 s ARG 59 Cb -0.15 -0.39 0.01 0.00 0.06 0.00 0.00 34.95 34.48 2wn9 s ARG 59 CO 0.05 -0.01 0.52 1.67 -2.50 0.00 0.00 175.30 175.04 2wn9 s TRP 60 N 0.37 0.62 -0.06 5.12 -2.14 -0.86 -0.59 118.94 121.40 2wn9 s TRP 60 Ca -0.04 -0.98 -0.03 0.00 2.66 0.00 0.00 56.10 57.72 2wn9 s TRP 60 Cb -0.07 0.17 0.04 0.00 -3.10 0.00 0.00 33.47 30.51 2wn9 s TRP 60 CO -0.01 -1.14 0.14 0.21 -2.66 0.00 0.00 176.95 173.49 2wn9 s LYS 61 N -3.36 0.08 -0.07 3.25 2.20 -1.26 -0.18 119.74 120.40 2wn9 s LYS 61 Ca 0.25 0.36 0.05 0.00 -0.36 0.00 0.00 55.97 56.26 2wn9 s LYS 61 Cb -0.01 -0.19 -0.00 0.00 -1.51 0.00 0.00 37.83 36.12 2wn9 s LYS 61 CO 0.14 -0.17 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.23 2wn9 s LEU 62 N 1.18 2.01 0.37 5.43 1.43 -0.30 -4.95 118.68 123.85 2wn9 s LEU 62 Ca -0.09 -0.48 0.11 0.00 -1.03 0.00 0.00 54.13 52.63 2wn9 s LEU 62 Cb -0.12 -1.27 0.87 0.00 0.03 0.00 0.00 46.19 45.71 2wn9 s LEU 62 CO -0.06 0.18 1.89 0.78 0.23 0.00 0.00 176.35 179.37 2wn9 h ASN 63 N 6.41 0.59 0.52 2.29 4.21 -1.88 -2.26 115.58 125.46 2wn9 h ASN 63 Ca -0.27 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.27 2wn9 h ASN 63 Cb 1.20 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.32 2wn9 h ASN 63 CO 0.47 0.30 0.00 -1.54 -1.29 0.00 0.00 177.43 175.37 2wn9 n SER 64 N -4.54 0.59 -1.42 5.81 3.41 -1.26 -2.23 113.62 113.99 2wn9 n SER 64 Ca 0.16 0.68 0.10 0.00 -0.26 0.00 0.00 58.87 59.55 2wn9 n SER 64 Cb 0.47 -0.79 0.33 0.00 -0.26 0.00 0.00 64.21 63.96 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 -2.19 4.29 -4.78 1.04 4.77 -0.85 -4.98 117.00 114.30 2wn9 n LEU 65 Ca 0.01 -2.23 -0.38 0.00 -0.03 0.00 0.00 56.01 53.38 2wn9 n LEU 65 Cb 0.17 -0.52 -0.06 0.00 -2.33 0.00 0.00 43.42 40.68 2wn9 n LEU 65 CO 0.17 0.89 0.51 -0.04 -1.33 0.00 0.00 177.39 177.59 2wn9 s MET 66 N -1.43 4.54 0.19 3.23 -1.94 -0.95 -3.95 119.30 119.00 2wn9 s MET 66 Ca 0.49 1.16 -0.02 0.00 -1.71 0.00 0.00 55.69 55.61 2wn9 s MET 66 Cb 0.28 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.97 2wn9 s MET 66 CO 0.28 0.49 0.15 1.67 -0.01 0.00 0.00 175.02 177.59 2wn9 s TRP 67 N -1.30 1.05 -0.35 -0.03 -2.14 -0.81 -4.97 118.94 110.39 2wn9 s TRP 67 Ca 0.40 -1.30 -0.16 0.00 2.66 0.00 0.00 56.10 57.70 2wn9 s TRP 67 Cb -0.21 -0.49 -0.01 0.00 -3.10 0.00 0.00 33.47 29.66 2wn9 s TRP 67 CO 0.25 -0.65 0.41 0.34 -2.66 0.00 0.00 176.95 174.65 2wn9 s ASP 68 N -3.13 6.22 0.51 -2.66 3.68 -1.26 -4.68 116.67 115.35 2wn9 s ASP 68 Ca 0.35 -0.18 0.24 0.00 2.13 0.00 0.00 52.55 55.09 2wn9 s ASP 68 Cb 0.06 -2.22 1.33 0.00 -1.45 0.00 0.00 42.92 40.64 2wn9 s ASP 68 CO 0.10 -0.39 1.96 -0.65 0.13 0.00 0.00 175.17 176.33 2wn9 h PRO 69 N 8.47 0.10 0.00 4.34 0.11 -1.94 -1.35 132.00 141.73 2wn9 h PRO 69 Ca -0.29 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 2wn9 h PRO 69 Cb 1.14 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wn9 h PRO 69 CO 0.72 0.06 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.62 2wn9 h ASN 70 N 0.10 0.00 0.89 -2.05 2.35 -1.92 0.47 115.58 115.41 2wn9 h ASN 70 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 2wn9 h ASN 70 Cb 1.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2wn9 h ASN 70 CO -0.03 0.04 -0.14 -0.62 -1.65 0.00 0.00 177.43 175.03 2wn9 n GLU 71 N -3.35 0.01 -2.81 0.81 1.02 -0.51 -4.29 120.64 111.52 2wn9 n GLU 71 Ca -0.02 0.01 -0.14 0.00 -0.02 0.00 0.00 57.16 56.99 2wn9 n GLU 71 Cb 0.18 -1.51 0.01 0.00 -0.02 0.00 0.00 31.44 30.09 2wn9 n GLU 71 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2wn9 n TYR 72 N -1.53 1.17 -3.01 -0.32 4.01 -0.62 -4.98 117.16 111.89 2wn9 n TYR 72 Ca 0.07 -3.17 -0.20 0.00 -0.16 0.00 0.00 57.90 54.44 2wn9 n TYR 72 Cb 0.34 -0.37 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 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 -0.00 -0.50 2.35 2.72 0.00 -1.19 -1.91 105.19 106.65 2wn9 n GLY 73 Ca 0.17 0.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.19 -4.61 -4.71 1.61 3.02 0.16 -4.98 115.26 103.56 2wn9 n ASN 74 Ca -0.08 0.17 -0.42 0.00 -0.03 0.00 0.00 54.58 54.22 2wn9 n ASN 74 Cb 0.58 -3.58 -0.03 0.00 -0.61 0.00 0.00 39.78 36.14 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 -2.64 3.34 -0.20 2.41 1.01 -0.81 -4.90 121.20 119.42 2wn9 s ILE 75 Ca 0.00 0.92 0.11 0.00 0.00 0.00 0.00 60.65 61.68 2wn9 s ILE 75 Cb 0.00 -3.59 -0.15 0.00 0.01 0.00 0.00 42.46 38.73 2wn9 s ILE 75 CO 0.00 0.05 0.32 0.35 0.00 0.00 0.00 174.94 175.66 2wn9 n THR 76 N 4.15 0.00 -3.60 2.92 -2.24 -1.26 -4.32 114.28 109.92 2wn9 n THR 76 Ca 0.12 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.58 2wn9 n THR 76 Cb 0.42 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 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 -2.74 -0.32 0.14 3.42 1.47 -1.26 -1.31 116.67 116.06 2wn9 s ASP 77 Ca -0.01 -0.18 -0.17 0.00 1.18 0.00 0.00 52.55 53.36 2wn9 s ASP 77 Cb 0.07 0.48 0.04 0.00 -0.34 0.00 0.00 42.92 43.17 2wn9 s ASP 77 CO 0.44 -0.82 0.44 0.72 0.68 0.00 0.00 175.17 176.63 2wn9 s PHE 78 N -3.33 -0.25 -0.08 2.11 -0.12 0.02 -4.99 117.98 111.34 2wn9 s PHE 78 Ca 0.07 -0.05 -0.03 0.00 -0.05 0.00 0.00 56.93 56.87 2wn9 s PHE 78 Cb -0.01 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 2wn9 s PHE 78 CO -0.05 -0.74 0.07 1.03 -0.05 0.00 0.00 175.22 175.48 2wn9 s ARG 79 N -3.80 3.18 0.00 1.99 3.00 -1.26 -0.81 118.95 121.25 2wn9 s ARG 79 Ca 0.03 -0.32 -0.18 0.00 0.00 0.00 0.00 55.73 55.26 2wn9 s ARG 79 Cb 0.01 -2.96 0.03 0.00 0.00 0.00 0.00 34.95 32.04 2wn9 s ARG 79 CO -0.11 0.72 0.39 -0.08 0.00 0.00 0.00 175.30 176.22 2wn9 s THR 80 N -1.01 0.05 0.26 0.02 -1.32 -0.55 -4.99 115.64 108.09 2wn9 s THR 80 Ca 0.16 -0.42 -0.30 0.00 -1.21 0.00 0.00 61.69 59.93 2wn9 s THR 80 Cb -0.12 -0.79 -0.14 0.00 -1.51 0.00 0.00 72.50 69.95 2wn9 s THR 80 CO 0.06 -0.23 1.18 -0.24 -2.21 0.00 0.00 174.62 173.18 2wn9 n SER 81 N 0.96 1.91 0.24 8.08 2.88 -1.26 -0.72 113.62 125.71 2wn9 n SER 81 Ca -0.20 1.17 0.17 0.00 -1.33 0.00 0.00 58.87 58.67 2wn9 n SER 81 Cb 0.57 -1.34 0.78 0.00 -0.75 0.00 0.00 64.21 63.47 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 2.89 1.00 0.00 -1.46 0.00 -1.40 -1.00 119.26 119.29 2wn9 h ALA 82 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2wn9 h ALA 82 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2wn9 h ALA 82 CO 0.66 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.91 2wn9 h ALA 83 N 2.06 1.00 0.00 0.00 0.00 -1.88 -3.00 119.26 117.43 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 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wn9 h ALA 83 CO 0.00 0.00 -0.05 -0.25 0.00 0.00 0.00 179.25 178.95 2wn9 n ASP 84 N -2.91 0.68 -4.34 0.00 8.00 -0.38 -4.89 116.55 112.71 2wn9 n ASP 84 Ca 0.00 0.52 -0.17 0.00 0.71 0.00 0.00 54.79 55.85 2wn9 n ASP 84 Cb 0.24 -0.67 -0.10 0.00 -0.02 0.00 0.00 41.12 40.57 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 -3.09 1.16 0.35 0.53 -4.36 -1.13 -5.00 121.20 109.66 2wn9 s ILE 85 Ca 0.11 -2.06 -0.27 0.00 -0.26 0.00 0.00 60.65 58.17 2wn9 s ILE 85 Cb 0.14 -2.29 -0.09 0.00 1.25 0.00 0.00 42.46 41.46 2wn9 s ILE 85 CO 0.60 -0.38 1.21 0.86 0.24 0.00 0.00 174.94 177.46 2wn9 s TRP 86 N -3.33 3.17 0.05 1.37 -0.00 -1.26 -4.97 118.94 113.96 2wn9 s TRP 86 Ca 0.27 1.53 0.03 0.00 -0.00 0.00 0.00 56.10 57.93 2wn9 s TRP 86 Cb 0.05 -3.48 -0.02 0.00 -0.00 0.00 0.00 33.47 30.01 2wn9 s TRP 86 CO 0.08 -1.36 -0.09 0.95 -0.00 0.00 0.00 176.95 176.53 2wn9 s THR 87 N -1.25 0.67 0.49 5.86 -4.23 -1.26 -5.10 115.64 110.82 2wn9 s THR 87 Ca 0.51 -1.12 -0.20 0.00 -1.18 0.00 0.00 61.69 59.70 2wn9 s THR 87 Cb -0.34 -0.71 -0.08 0.00 1.34 0.00 0.00 72.50 72.70 2wn9 s THR 87 CO 0.45 -0.33 1.07 -2.16 -0.54 0.00 0.00 174.62 173.10 2wn9 s PRO 88 N -1.59 3.72 -0.54 3.99 0.04 -1.26 -4.93 135.00 134.44 2wn9 s PRO 88 Ca -0.08 1.45 -0.05 0.00 0.04 0.00 0.00 61.00 62.37 2wn9 s PRO 88 Cb -0.10 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2wn9 s PRO 88 CO 0.01 -0.52 2.92 -0.40 0.04 0.00 0.00 177.00 179.05 2wn9 n ASP 89 N -0.96 6.54 -4.70 6.66 5.75 -1.26 -4.95 116.55 123.63 2wn9 n ASP 89 Ca 0.09 -3.00 -0.42 0.00 -0.01 0.00 0.00 54.79 51.45 2wn9 n ASP 89 Cb 0.52 -1.31 -0.03 0.00 -1.03 0.00 0.00 41.12 39.27 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 -1.14 4.07 -0.00 2.12 -1.09 -1.26 -2.34 121.20 121.56 2wn9 s ILE 90 Ca 0.61 1.46 -0.07 0.00 -2.23 0.00 0.00 60.65 60.42 2wn9 s ILE 90 Cb 0.33 -3.94 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 2wn9 s ILE 90 CO -0.15 0.07 0.14 0.28 -1.23 0.00 0.00 174.94 174.05 2wn9 s THR 91 N 1.51 0.07 0.24 2.92 -1.32 0.14 -4.91 115.64 114.29 2wn9 s THR 91 Ca 0.58 -0.62 -0.30 0.00 -1.21 0.00 0.00 61.69 60.15 2wn9 s THR 91 Cb -0.28 -0.41 -0.09 0.00 -1.51 0.00 0.00 72.50 70.21 2wn9 s THR 91 CO 0.27 -0.34 1.24 0.00 -2.21 0.00 0.00 174.62 173.58 2wn9 s ALA 92 N -1.22 3.48 -0.87 11.08 0.00 -1.26 -1.54 121.76 131.42 2wn9 s ALA 92 Ca -0.13 1.06 0.26 0.00 0.00 0.00 0.00 51.96 53.15 2wn9 s ALA 92 Cb -0.07 -3.43 0.69 0.00 0.00 0.00 0.00 23.12 20.31 2wn9 s ALA 92 CO 0.01 -0.44 1.57 0.66 0.00 0.00 0.00 175.76 177.56 2wn9 n TYR 93 N 1.97 0.26 -2.39 0.00 4.01 0.66 -4.09 117.16 117.59 2wn9 n TYR 93 Ca 0.03 0.08 -0.02 0.00 -0.16 0.00 0.00 57.90 57.83 2wn9 n TYR 93 Cb 0.43 -0.51 0.06 0.00 -0.31 0.00 0.00 39.34 39.02 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 -1.75 1.96 -4.76 7.72 3.41 -1.26 -5.03 113.62 113.90 2wn9 n SER 94 Ca 0.05 -2.61 -0.34 0.00 -0.26 0.00 0.00 58.87 55.71 2wn9 n SER 94 Cb 0.38 -0.40 0.04 0.00 -0.26 0.00 0.00 64.21 63.96 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 -3.07 5.21 0.00 4.04 1.04 -1.26 -1.70 113.70 117.95 2wn9 s SER 95 Ca 0.35 2.15 0.06 0.00 0.48 0.00 0.00 55.95 58.99 2wn9 s SER 95 Cb 0.37 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.91 2wn9 s SER 95 CO -0.08 -1.57 0.47 0.35 0.98 0.00 0.00 173.24 173.39 2wn9 n THR 96 N -1.99 0.00 -3.86 2.02 -2.24 -0.23 -4.82 114.28 103.16 2wn9 n THR 96 Ca 0.12 -0.42 -0.10 0.00 -2.27 0.00 0.00 64.05 61.37 2wn9 n THR 96 Cb 0.51 1.07 -0.09 0.00 -2.10 0.00 0.00 70.33 69.72 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 -1.11 0.63 0.28 -0.78 1.81 -1.25 -5.05 118.95 113.49 2wn9 s ARG 97 Ca 0.05 -0.60 -0.30 0.00 -1.72 0.00 0.00 55.73 53.15 2wn9 s ARG 97 Cb 0.05 0.26 -0.12 0.00 -0.45 0.00 0.00 34.95 34.69 2wn9 s ARG 97 CO 0.17 -0.17 1.45 -2.30 -0.68 0.00 0.00 175.30 173.77 2wn9 n PRO 98 N 0.85 2.31 -1.68 3.54 -0.02 -1.26 -4.66 135.00 134.08 2wn9 n PRO 98 Ca -0.20 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 2wn9 n PRO 98 Cb 0.58 -2.51 0.01 0.00 -0.02 0.00 0.00 33.50 31.56 2wn9 n PRO 98 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wn9 n VAL 99 N 1.61 2.39 -4.55 -1.45 0.31 -1.26 -4.87 118.33 110.51 2wn9 n VAL 99 Ca 0.09 -0.50 -0.33 0.00 -0.01 0.00 0.00 64.34 63.58 2wn9 n VAL 99 Cb 0.34 -1.46 -0.13 0.00 -0.91 0.00 0.00 33.84 31.69 2wn9 n VAL 99 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2wn9 s GLN 100 N -2.06 3.55 -0.11 5.55 -0.21 -0.66 -4.99 119.66 120.72 2wn9 s GLN 100 Ca 0.60 -0.58 -0.17 0.00 0.02 0.00 0.00 55.36 55.23 2wn9 s GLN 100 Cb -0.54 -2.80 -0.04 0.00 1.00 0.00 0.00 33.01 30.62 2wn9 s GLN 100 CO 0.59 0.25 0.44 0.08 -2.12 0.00 0.00 175.29 174.53 2wn9 s VAL 101 N 0.32 5.18 -0.54 1.09 1.01 -1.26 -1.19 120.40 125.01 2wn9 s VAL 101 Ca -0.06 0.88 0.17 0.00 0.00 0.00 0.00 61.98 62.97 2wn9 s VAL 101 Cb -0.15 -3.78 -0.22 0.00 0.00 0.00 0.00 36.38 32.24 2wn9 s VAL 101 CO 0.04 0.37 0.61 0.18 0.00 0.00 0.00 175.10 176.30 2wn9 n LEU 102 N 3.42 0.53 -4.53 3.92 4.77 0.17 -4.97 117.00 120.30 2wn9 n LEU 102 Ca -0.09 -0.33 -0.25 0.00 -0.03 0.00 0.00 56.01 55.32 2wn9 n LEU 102 Cb 0.52 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.50 2wn9 n LEU 102 CO 0.42 0.13 -0.34 -0.94 -1.33 0.00 0.00 177.39 175.33 2wn9 s SER 103 N -3.11 3.42 0.55 -1.43 1.04 -1.24 -4.94 113.70 107.99 2wn9 s SER 103 Ca 0.02 -1.26 -0.21 0.00 0.48 0.00 0.00 55.95 54.98 2wn9 s SER 103 Cb 0.12 -0.30 -0.06 0.00 0.10 0.00 0.00 66.02 65.89 2wn9 s SER 103 CO 0.71 -0.34 1.12 -2.65 0.98 0.00 0.00 173.24 173.07 2wn9 n PRO 104 N -0.79 1.28 -3.55 4.02 -0.02 -1.26 -4.84 135.00 129.84 2wn9 n PRO 104 Ca -0.05 0.48 -0.41 0.00 -2.02 0.00 0.00 63.50 61.50 2wn9 n PRO 104 Cb 0.65 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.77 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 -2.67 3.09 -0.02 -0.52 -0.21 -1.26 -4.86 119.66 113.21 2wn9 s GLN 105 Ca 0.72 -2.61 0.02 0.00 0.02 0.00 0.00 55.36 53.51 2wn9 s GLN 105 Cb -0.44 -4.05 0.01 0.00 1.00 0.00 0.00 33.01 29.53 2wn9 s GLN 105 CO 0.50 -1.23 -0.06 0.42 -2.12 0.00 0.00 175.29 172.80 2wn9 s ILE 106 N -0.16 0.54 0.24 1.08 1.01 -1.26 -1.02 121.20 121.63 2wn9 s ILE 106 Ca 0.19 -0.23 0.09 0.00 0.00 0.00 0.00 60.65 60.70 2wn9 s ILE 106 Cb -0.15 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 2wn9 s ILE 106 CO -0.06 0.18 -0.00 0.00 0.00 0.00 0.00 174.94 175.06 2wn9 s ALA 107 N 0.27 3.17 -0.18 9.38 0.00 0.10 -4.57 121.76 129.93 2wn9 s ALA 107 Ca -0.03 -1.58 -0.03 0.00 0.00 0.00 0.00 51.96 50.32 2wn9 s ALA 107 Cb -0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 2wn9 s ALA 107 CO -0.00 0.32 -0.07 0.08 0.00 0.00 0.00 175.76 176.09 2wn9 s VAL 108 N -2.16 3.32 -0.10 0.00 1.01 -0.53 -1.49 120.40 120.45 2wn9 s VAL 108 Ca 0.30 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 2wn9 s VAL 108 Cb -0.07 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2wn9 s VAL 108 CO 0.19 0.47 -0.09 -0.69 0.00 0.00 0.00 175.10 174.98 2wn9 s VAL 109 N 0.98 3.49 0.18 2.92 1.01 0.01 -1.46 120.40 127.53 2wn9 s VAL 109 Ca -0.00 -0.53 0.09 0.00 0.00 0.00 0.00 61.98 61.53 2wn9 s VAL 109 Cb -0.15 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 2wn9 s VAL 109 CO -0.00 0.55 -0.11 -0.89 0.00 0.00 0.00 175.10 174.65 2wn9 s THR 110 N -0.24 3.11 -0.09 3.92 2.01 -0.14 -0.80 115.64 123.41 2wn9 s THR 110 Ca 0.03 -1.67 0.28 0.00 0.31 0.00 0.00 61.69 60.63 2wn9 s THR 110 Cb -0.13 -2.53 0.29 0.00 0.01 0.00 0.00 72.50 70.14 2wn9 s THR 110 CO 0.03 -0.09 1.84 1.12 -0.69 0.00 0.00 174.62 176.82 2wn9 h HIS 111 N 2.99 0.00 -0.01 4.92 2.07 -1.49 0.24 115.15 123.87 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 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 2wn9 h HIS 111 CO 0.65 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 175.11 2wn9 n ASP 112 N -2.50 0.23 0.00 3.10 5.75 -1.26 -1.92 116.55 119.95 2wn9 n ASP 112 Ca -0.00 -1.24 0.00 0.00 -0.01 0.00 0.00 54.79 53.54 2wn9 n ASP 112 Cb 0.13 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 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 0.95 0.71 3.78 6.12 0.00 0.85 -4.74 105.19 112.86 2wn9 n GLY 113 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.76 7.01 -0.01 1.61 0.01 -1.21 -1.15 113.70 117.21 2wn9 s SER 114 Ca 0.00 2.01 0.05 0.00 1.31 0.00 0.00 55.95 59.32 2wn9 s SER 114 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 2wn9 s SER 114 CO 0.00 -0.31 -0.16 -0.69 0.41 0.00 0.00 173.24 172.48 2wn9 s VAL 115 N -1.57 1.28 -0.07 3.43 1.01 0.75 -0.97 120.40 124.25 2wn9 s VAL 115 Ca 0.54 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.80 2wn9 s VAL 115 Cb -0.22 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.10 2wn9 s VAL 115 CO 0.28 0.33 -0.10 -0.32 0.00 0.00 0.00 175.10 175.29 2wn9 s MET 116 N -0.46 1.57 -0.04 2.72 0.00 -0.54 -2.03 119.30 120.52 2wn9 s MET 116 Ca 0.06 -0.34 -0.00 0.00 0.00 0.00 0.00 55.69 55.40 2wn9 s MET 116 Cb -0.06 -1.39 0.03 0.00 0.00 0.00 0.00 34.83 33.40 2wn9 s MET 116 CO -0.00 -0.06 0.02 0.12 0.00 0.00 0.00 175.02 175.10 2wn9 s PHE 117 N 0.94 0.31 -0.52 4.11 5.36 0.08 -1.46 117.98 126.80 2wn9 s PHE 117 Ca -0.10 0.03 0.06 0.00 -0.96 0.00 0.00 56.93 55.97 2wn9 s PHE 117 Cb -0.15 -0.49 0.21 0.00 -0.34 0.00 0.00 43.02 42.25 2wn9 s PHE 117 CO 0.00 -0.18 0.50 -0.89 -1.46 0.00 0.00 175.22 173.20 2wn9 n ILE 118 N 4.59 0.26 -2.27 3.12 5.41 -1.26 -0.43 119.36 128.78 2wn9 n ILE 118 Ca -0.18 -4.26 -0.42 0.00 1.00 0.00 0.00 62.75 58.90 2wn9 n ILE 118 Cb 0.50 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.46 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 -1.11 4.40 0.12 0.38 0.04 -1.21 -4.75 135.00 132.86 2wn9 s PRO 119 Ca 0.33 1.98 -0.25 0.00 0.04 0.00 0.00 61.00 63.10 2wn9 s PRO 119 Cb 0.08 -3.24 -0.07 0.00 0.04 0.00 0.00 34.50 31.30 2wn9 s PRO 119 CO -0.13 -0.27 0.75 0.00 0.04 0.00 0.00 177.00 177.39 2wn9 s ALA 120 N 0.49 3.44 0.02 8.56 0.00 -1.26 -1.33 121.76 131.68 2wn9 s ALA 120 Ca 0.58 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.85 2wn9 s ALA 120 Cb -0.35 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 2wn9 s ALA 120 CO 0.34 0.23 -0.04 -0.65 0.00 0.00 0.00 175.76 175.65 2wn9 s GLN 121 N -0.81 0.32 -0.18 0.00 -0.21 0.04 0.41 119.66 119.23 2wn9 s GLN 121 Ca 0.36 -0.55 -0.04 0.00 0.02 0.00 0.00 55.36 55.15 2wn9 s GLN 121 Cb -0.22 -0.01 -0.02 0.00 1.00 0.00 0.00 33.01 33.76 2wn9 s GLN 121 CO 0.25 -0.02 -0.03 0.50 -2.12 0.00 0.00 175.29 173.87 2wn9 s ARG 122 N -1.25 3.60 -0.08 2.91 3.52 -0.33 -1.56 118.95 125.76 2wn9 s ARG 122 Ca -0.12 -0.54 0.03 0.00 -0.13 0.00 0.00 55.73 54.97 2wn9 s ARG 122 Cb -0.08 -2.98 0.01 0.00 -1.56 0.00 0.00 34.95 30.34 2wn9 s ARG 122 CO -0.01 0.10 -0.17 -1.17 -0.81 0.00 0.00 175.30 173.24 2wn9 s LEU 123 N 0.74 1.83 -0.18 -0.88 2.96 0.07 -1.65 118.68 121.58 2wn9 s LEU 123 Ca -0.01 -0.40 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 2wn9 s LEU 123 Cb -0.14 -1.05 -0.05 0.00 0.50 0.00 0.00 46.19 45.45 2wn9 s LEU 123 CO 0.02 0.09 0.18 -0.44 -1.32 0.00 0.00 176.35 174.89 2wn9 s SER 124 N 0.48 6.30 0.13 3.68 0.01 -1.26 -0.99 113.70 122.04 2wn9 s SER 124 Ca -0.15 0.34 -0.03 0.00 1.31 0.00 0.00 55.95 57.42 2wn9 s SER 124 Cb -0.16 -2.12 -0.03 0.00 0.21 0.00 0.00 66.02 63.92 2wn9 s SER 124 CO 0.05 0.17 0.09 0.72 0.41 0.00 0.00 173.24 174.69 2wn9 s PHE 125 N 0.28 0.70 -0.13 2.43 -0.12 -0.50 -1.06 117.98 119.57 2wn9 s PHE 125 Ca 0.11 -1.10 -0.29 0.00 -0.05 0.00 0.00 56.93 55.60 2wn9 s PHE 125 Cb -0.12 -0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 41.86 2wn9 s PHE 125 CO 0.00 -0.54 1.64 -1.64 -0.05 0.00 0.00 175.22 174.63 2wn9 s MET 126 N -4.01 4.00 -0.29 1.99 -1.94 -0.69 -1.54 119.30 116.82 2wn9 s MET 126 Ca 0.20 1.96 -0.13 0.00 -1.71 0.00 0.00 55.69 56.01 2wn9 s MET 126 Cb 0.07 -4.01 0.11 0.00 2.01 0.00 0.00 34.83 33.01 2wn9 s MET 126 CO -0.00 -1.05 0.70 0.00 -0.01 0.00 0.00 175.02 174.65 2wn9 s ASP 128 N 2.36 6.46 -0.03 0.00 -1.08 -1.26 -3.01 116.67 120.10 2wn9 s ASP 128 Ca -0.07 0.01 0.03 0.00 -0.52 0.00 0.00 52.55 51.99 2wn9 s ASP 128 Cb -0.09 -2.42 0.14 0.00 -1.46 0.00 0.00 42.92 39.10 2wn9 s ASP 128 CO -0.19 -0.97 0.84 -0.81 0.52 0.00 0.00 175.17 174.55 2wn9 n PRO 129 N 6.92 1.61 -1.66 4.34 -0.04 -1.26 -4.70 135.00 140.21 2wn9 n PRO 129 Ca 0.04 -0.56 -0.46 0.00 -0.04 0.00 0.00 63.50 62.48 2wn9 n PRO 129 Cb 0.48 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.42 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 0.39 -0.02 0.52 -1.04 -1.26 -1.26 114.28 111.66 2wn9 n THR 130 Ca 0.05 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 2wn9 n THR 130 Cb 0.34 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.42 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 2.81 0.50 0.26 3.41 0.00 -1.26 -4.40 105.19 106.50 2wn9 n GLY 131 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 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 0.97 -0.38 1.61 3.04 -1.36 -1.78 116.25 118.35 2wn9 h VAL 132 Ca 0.00 -0.15 -0.15 0.00 -1.01 0.00 0.00 66.70 65.40 2wn9 h VAL 132 Cb 0.00 1.08 -0.09 0.00 -2.01 0.00 0.00 31.29 30.27 2wn9 h VAL 132 CO 0.00 0.04 0.19 -0.90 -1.01 0.00 0.00 177.57 175.89 2wn9 n ASP 133 N -4.41 3.27 -4.32 3.17 5.75 -1.26 -0.28 116.55 118.47 2wn9 n ASP 133 Ca -0.03 -2.61 -0.17 0.00 -0.01 0.00 0.00 54.79 51.97 2wn9 n ASP 133 Cb 0.13 -0.63 -0.10 0.00 -1.03 0.00 0.00 41.12 39.49 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 -0.15 1.99 0.34 -1.12 1.04 -0.68 -5.00 113.70 110.12 2wn9 s SER 134 Ca 0.25 -1.14 0.02 0.00 0.48 0.00 0.00 55.95 55.56 2wn9 s SER 134 Cb 0.21 -0.03 0.61 0.00 0.10 0.00 0.00 66.02 66.91 2wn9 s SER 134 CO 0.06 -0.42 1.98 -0.08 0.98 0.00 0.00 173.24 175.76 2wn9 h GLU 135 N 2.54 0.88 0.00 4.02 4.81 -1.90 -2.66 114.58 122.27 2wn9 h GLU 135 Ca -0.38 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.79 2wn9 h GLU 135 Cb 1.21 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 2wn9 h GLU 135 CO 0.64 0.58 -0.03 1.05 -0.73 0.00 0.00 179.01 180.52 2wn9 h GLU 136 N 0.90 0.00 0.00 1.92 9.09 -1.96 -3.49 114.58 121.04 2wn9 h GLU 136 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.70 2wn9 h GLU 136 Cb 0.02 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.12 2wn9 h GLU 136 CO -0.08 0.03 -0.00 0.41 0.05 0.00 0.00 179.01 179.42 2wn9 n GLY 137 N 0.96 -2.05 3.77 1.06 0.00 -1.00 -4.83 105.19 103.10 2wn9 n GLY 137 Ca 0.03 -1.41 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 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 -1.07 3.46 -0.05 4.61 0.00 0.70 -4.29 121.76 125.12 2wn9 s ALA 138 Ca 0.00 -1.43 0.02 0.00 0.00 0.00 0.00 51.96 50.54 2wn9 s ALA 138 Cb 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 23.12 21.97 2wn9 s ALA 138 CO 0.00 0.31 -0.09 0.99 0.00 0.00 0.00 175.76 176.98 2wn9 s THR 139 N -2.08 0.84 0.14 0.00 2.01 -1.26 -1.18 115.64 114.11 2wn9 s THR 139 Ca 0.32 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.00 2wn9 s THR 139 Cb -0.08 -0.79 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 2wn9 s THR 139 CO 0.23 0.28 0.00 0.00 -0.69 0.00 0.00 174.62 174.45 2wn9 s ALA 141 N -3.79 -0.49 -0.12 0.00 0.00 -1.26 -1.32 121.76 114.79 2wn9 s ALA 141 Ca 0.20 0.16 -0.08 0.00 0.00 0.00 0.00 51.96 52.24 2wn9 s ALA 141 Cb 0.07 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.21 2wn9 s ALA 141 CO 0.01 -0.19 0.29 0.54 0.00 0.00 0.00 175.76 176.40 2wn9 s VAL 142 N -1.00 -0.02 0.01 0.00 0.11 -0.11 -4.92 120.40 114.47 2wn9 s VAL 142 Ca -0.11 0.08 -0.17 0.00 -2.93 0.00 0.00 61.98 58.85 2wn9 s VAL 142 Cb -0.06 -0.43 -0.06 0.00 -1.53 0.00 0.00 36.38 34.30 2wn9 s VAL 142 CO 0.02 0.03 0.47 -0.54 -3.33 0.00 0.00 175.10 171.75 2wn9 s LYS 143 N 0.82 4.06 -0.08 1.54 1.02 -1.26 -0.66 119.74 125.17 2wn9 s LYS 143 Ca -0.05 0.52 0.05 0.00 0.02 0.00 0.00 55.97 56.50 2wn9 s LYS 143 Cb -0.06 -3.25 -0.00 0.00 -0.52 0.00 0.00 37.83 33.99 2wn9 s LYS 143 CO -0.05 0.61 -0.24 -0.06 -0.92 0.00 0.00 175.35 174.68 2wn9 s PHE 144 N -0.87 2.46 0.14 3.18 0.08 -0.13 -0.24 117.98 122.59 2wn9 s PHE 144 Ca 0.26 -0.89 -0.24 0.00 0.12 0.00 0.00 56.93 56.18 2wn9 s PHE 144 Cb -0.17 -1.63 0.08 0.00 -0.57 0.00 0.00 43.02 40.73 2wn9 s PHE 144 CO 0.15 -0.33 1.08 0.20 -0.10 0.00 0.00 175.22 176.22 2wn9 s GLY 145 N 0.14 0.00 0.34 4.36 0.00 -0.59 -0.35 107.32 111.21 2wn9 s GLY 145 Ca -0.12 -0.16 -0.28 0.00 0.00 0.00 0.00 44.72 44.16 2wn9 s GLY 145 CO 0.07 2.48 1.36 -1.26 0.00 0.00 0.00 173.10 175.75 2wn9 n SER 146 N -1.06 3.06 -0.01 1.64 2.88 -1.26 -0.68 113.62 118.18 2wn9 n SER 146 Ca -0.03 1.20 -0.17 0.00 -1.33 0.00 0.00 58.87 58.55 2wn9 n SER 146 Cb 0.60 -1.52 -0.10 0.00 -0.75 0.00 0.00 64.21 62.44 2wn9 n SER 146 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 2wn9 h TRP 147 N 2.91 0.63 0.00 0.66 2.91 -1.81 -3.41 115.95 117.84 2wn9 h TRP 147 Ca -0.47 -0.31 0.00 0.00 1.13 0.00 0.00 58.89 59.24 2wn9 h TRP 147 Cb 1.27 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2wn9 h TRP 147 CO 0.52 1.10 -0.36 1.33 -1.03 0.00 0.00 178.44 180.00 2wn9 n VAL 148 N -4.24 0.00 -3.90 2.65 0.24 -1.26 -4.97 118.33 106.85 2wn9 n VAL 148 Ca -0.09 -0.34 -0.35 0.00 -2.04 0.00 0.00 64.34 61.52 2wn9 n VAL 148 Cb 0.63 0.96 -0.10 0.00 -1.47 0.00 0.00 33.84 33.85 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 -1.66 3.24 0.99 6.34 2.02 -1.26 -5.10 117.35 121.92 2wn9 s TYR 149 Ca 0.02 0.03 -0.16 0.00 -0.37 0.00 0.00 57.07 56.58 2wn9 s TYR 149 Cb 0.05 -2.14 0.21 0.00 -0.40 0.00 0.00 41.96 39.68 2wn9 s TYR 149 CO 0.26 0.05 1.31 -1.54 -1.57 0.00 0.00 175.55 174.07 2wn9 s SER 150 N 0.72 2.87 0.22 2.29 1.04 -1.26 -4.57 113.70 115.00 2wn9 s SER 150 Ca 0.04 0.27 0.19 0.00 0.48 0.00 0.00 55.95 56.94 2wn9 s SER 150 Cb -0.13 -0.31 0.89 0.00 0.10 0.00 0.00 66.02 66.58 2wn9 s SER 150 CO 0.02 -2.89 1.59 0.61 0.98 0.00 0.00 173.24 173.55 2wn9 n GLY 151 N -3.56 -1.02 0.05 7.32 0.00 0.60 -0.93 105.19 107.65 2wn9 n GLY 151 Ca 0.15 0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.07 0.45 -0.04 1.61 3.72 -1.26 -4.28 117.46 115.58 2wn9 n PHE 152 Ca 0.01 0.13 -0.07 0.00 -0.05 0.00 0.00 57.45 57.47 2wn9 n PHE 152 Cb 0.13 -0.71 -0.03 0.00 -0.94 0.00 0.00 39.48 37.93 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 -1.87 0.17 -4.02 -1.08 4.71 -0.22 -4.17 120.64 114.17 2wn9 n GLU 153 Ca 0.06 0.06 -0.30 0.00 -0.01 0.00 0.00 57.16 56.97 2wn9 n GLU 153 Cb 0.38 -0.93 -0.16 0.00 -1.01 0.00 0.00 31.44 29.72 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 -2.14 1.59 0.15 -3.67 1.01 -0.11 -1.15 121.20 116.88 2wn9 s ILE 154 Ca -0.10 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 59.94 2wn9 s ILE 154 Cb 0.03 -1.49 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2wn9 s ILE 154 CO 0.15 0.45 0.15 -0.62 0.00 0.00 0.00 174.94 175.06 2wn9 s ASP 155 N 1.48 5.62 0.17 3.58 2.15 -0.24 -3.93 116.67 125.50 2wn9 s ASP 155 Ca 0.05 -0.07 0.10 0.00 0.43 0.00 0.00 52.55 53.05 2wn9 s ASP 155 Cb -0.13 -1.51 -0.04 0.00 -0.30 0.00 0.00 42.92 40.94 2wn9 s ASP 155 CO -0.11 0.08 -0.22 -0.76 -0.17 0.00 0.00 175.17 173.99 2wn9 s LEU 156 N -3.01 2.41 0.11 -1.34 1.43 -1.26 -0.70 118.68 116.32 2wn9 s LEU 156 Ca 0.31 -0.84 -0.07 0.00 -1.03 0.00 0.00 54.13 52.50 2wn9 s LEU 156 Cb -0.10 -1.03 -0.01 0.00 0.03 0.00 0.00 46.19 45.07 2wn9 s LEU 156 CO 0.24 0.07 0.19 -1.59 0.23 0.00 0.00 176.35 175.48 2wn9 s LYS 157 N -2.58 0.94 0.28 1.70 -2.85 -0.70 -4.91 119.74 111.62 2wn9 s LYS 157 Ca 0.17 -1.10 0.12 0.00 -1.00 0.00 0.00 55.97 54.15 2wn9 s LYS 157 Cb -0.08 0.33 -0.05 0.00 -2.06 0.00 0.00 37.83 35.98 2wn9 s LYS 157 CO 0.08 -0.30 -0.19 0.95 0.10 0.00 0.00 175.35 175.98 2wn9 s THR 158 N -3.92 2.49 -0.15 3.79 -4.23 -1.26 -0.99 115.64 111.37 2wn9 s THR 158 Ca 0.11 -2.39 0.18 0.00 -1.18 0.00 0.00 61.69 58.41 2wn9 s THR 158 Cb 0.05 -2.32 -0.08 0.00 1.34 0.00 0.00 72.50 71.49 2wn9 s THR 158 CO -0.06 -0.39 0.96 0.44 -0.54 0.00 0.00 174.62 175.02 2wn9 h ASP 159 N 2.25 0.00 -5.05 3.99 3.32 -1.98 -3.48 116.42 115.48 2wn9 h ASP 159 Ca -0.40 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 2wn9 h ASP 159 Cb 1.26 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.67 2wn9 h ASP 159 CO 0.60 0.46 -0.02 0.28 -1.72 0.00 0.00 179.24 178.84 2wn9 s THR 160 N -3.01 0.05 -2.40 0.35 -1.32 -1.26 -5.03 115.64 103.01 2wn9 s THR 160 Ca -0.01 -0.41 0.22 0.00 -1.21 0.00 0.00 61.69 60.28 2wn9 s THR 160 Cb 0.09 -1.06 0.44 0.00 -1.51 0.00 0.00 72.50 70.45 2wn9 s THR 160 CO 0.80 -0.23 1.44 0.47 -2.21 0.00 0.00 174.62 174.89 2wn9 n ASP 161 N 0.05 3.01 -4.59 8.08 8.00 -1.26 -4.79 116.55 125.05 2wn9 n ASP 161 Ca -0.17 -1.93 -0.41 0.00 0.71 0.00 0.00 54.79 52.99 2wn9 n ASP 161 Cb 0.62 -0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 41.42 2wn9 n ASP 161 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2wn9 s GLN 162 N -1.55 3.86 0.35 -1.24 -1.52 -1.26 -0.55 119.66 117.75 2wn9 s GLN 162 Ca 0.37 0.15 -0.29 0.00 -1.95 0.00 0.00 55.36 53.64 2wn9 s GLN 162 Cb 0.21 -3.73 -0.11 0.00 -0.22 0.00 0.00 33.01 29.16 2wn9 s GLN 162 CO 0.30 -0.52 1.52 0.28 -0.25 0.00 0.00 175.29 176.61 2wn9 n VAL 163 N 5.33 1.70 -2.25 1.09 0.31 -0.77 -4.87 118.33 118.87 2wn9 n VAL 163 Ca -0.03 -0.43 -0.43 0.00 -0.01 0.00 0.00 64.34 63.44 2wn9 n VAL 163 Cb 0.49 -1.96 -0.02 0.00 -0.91 0.00 0.00 33.84 31.43 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 0.06 6.46 -0.02 4.52 2.15 -0.73 -4.87 116.67 124.23 2wn9 s ASP 164 Ca 0.57 1.36 0.13 0.00 0.43 0.00 0.00 52.55 55.03 2wn9 s ASP 164 Cb -0.48 -2.54 0.37 0.00 -0.30 0.00 0.00 42.92 39.97 2wn9 s ASP 164 CO 0.59 -1.24 1.31 0.18 -0.17 0.00 0.00 175.17 175.85 2wn9 n LEU 165 N 8.28 3.18 0.18 -1.34 4.77 -1.26 -1.98 117.00 128.83 2wn9 n LEU 165 Ca 0.17 -2.13 0.14 0.00 -0.03 0.00 0.00 56.01 54.16 2wn9 n LEU 165 Cb 0.46 -0.30 0.55 0.00 -2.33 0.00 0.00 43.42 41.80 2wn9 n LEU 165 CO 0.65 0.75 0.90 0.77 -1.33 0.00 0.00 177.39 179.13 2wn9 h SER 166 N 2.26 0.00 -0.35 -1.43 4.64 -1.89 -2.28 113.55 114.49 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 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2wn9 h SER 166 CO 0.03 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.79 2wn9 n SER 167 N -2.52 3.08 -4.73 4.97 7.64 -1.26 -5.03 113.62 115.76 2wn9 n SER 167 Ca 0.02 -2.12 -0.42 0.00 1.01 0.00 0.00 58.87 57.36 2wn9 n SER 167 Cb 0.27 -0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 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 -1.21 3.17 -0.03 1.43 5.04 -0.86 -4.61 117.35 120.28 2wn9 s TYR 168 Ca 0.26 1.01 -0.30 0.00 -2.44 0.00 0.00 57.07 55.61 2wn9 s TYR 168 Cb 0.15 -3.72 -0.07 0.00 0.35 0.00 0.00 41.96 38.67 2wn9 s TYR 168 CO 0.15 -2.43 1.84 -0.47 -1.34 0.00 0.00 175.55 173.31 2wn9 s TYR 169 N 0.54 1.59 0.31 4.97 5.04 0.39 -4.86 117.35 125.32 2wn9 s TYR 169 Ca 0.62 -0.08 0.35 0.00 -2.44 0.00 0.00 57.07 55.52 2wn9 s TYR 169 Cb -0.39 -4.08 1.64 0.00 0.35 0.00 0.00 41.96 39.48 2wn9 s TYR 169 CO 0.36 -4.65 2.09 0.00 -1.34 0.00 0.00 175.55 172.02 2wn9 h ALA 170 N 10.54 1.05 -0.26 3.97 0.00 -1.90 -2.64 119.26 130.01 2wn9 h ALA 170 Ca -0.44 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2wn9 h ALA 170 Cb 1.21 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 2wn9 h ALA 170 CO 0.95 0.04 -0.03 0.43 0.00 0.00 0.00 179.25 180.65 2wn9 n SER 171 N -3.19 3.20 -4.51 0.00 7.64 -1.26 -5.03 113.62 110.47 2wn9 n SER 171 Ca -0.01 -3.30 -0.34 0.00 1.01 0.00 0.00 58.87 56.23 2wn9 n SER 171 Cb 0.24 -0.57 0.10 0.00 -1.01 0.00 0.00 64.21 62.98 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 -0.84 -0.94 0.27 6.43 2.88 -1.00 -4.89 113.62 115.53 2wn9 n SER 172 Ca 0.25 0.50 0.17 0.00 -1.33 0.00 0.00 58.87 58.46 2wn9 n SER 172 Cb 0.92 -1.29 0.66 0.00 -0.75 0.00 0.00 64.21 63.75 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 -0.94 0.00 -5.67 -1.46 1.79 -1.90 -3.44 116.57 104.95 2wn9 h LYS 173 Ca -0.45 0.00 -0.65 0.00 -2.18 0.00 0.00 60.65 57.37 2wn9 h LYS 173 Cb 1.31 0.00 -0.32 0.00 -1.58 0.00 0.00 32.23 31.64 2wn9 h LYS 173 CO 0.40 0.00 -0.87 0.71 -1.08 0.00 0.00 179.45 178.61 2wn9 s TYR 174 N -3.63 2.27 0.01 -1.35 2.02 -1.26 -1.64 117.35 113.77 2wn9 s TYR 174 Ca 0.02 -0.73 -0.09 0.00 -0.37 0.00 0.00 57.07 55.89 2wn9 s TYR 174 Cb 0.09 -1.51 -0.05 0.00 -0.40 0.00 0.00 41.96 40.09 2wn9 s TYR 174 CO 0.54 -0.25 0.31 -1.83 -1.57 0.00 0.00 175.55 172.75 2wn9 s GLU 175 N 0.01 3.68 -0.20 -0.62 -1.05 0.26 -4.82 118.70 115.95 2wn9 s GLU 175 Ca -0.07 0.08 -0.21 0.00 -0.15 0.00 0.00 54.97 54.62 2wn9 s GLU 175 Cb -0.14 -3.10 -0.02 0.00 -0.44 0.00 0.00 34.13 30.43 2wn9 s GLU 175 CO 0.04 0.65 0.63 0.42 0.95 0.00 0.00 175.26 177.96 2wn9 s ILE 176 N -1.25 5.01 -0.09 1.83 -1.09 -1.26 -1.50 121.20 122.85 2wn9 s ILE 176 Ca 0.27 1.19 -0.12 0.00 -2.23 0.00 0.00 60.65 59.75 2wn9 s ILE 176 Cb -0.14 -3.95 -0.28 0.00 -1.58 0.00 0.00 42.46 36.51 2wn9 s ILE 176 CO 0.15 0.10 0.56 -0.07 -1.23 0.00 0.00 174.94 174.45 2wn9 h LEU 177 N 8.28 0.48 -7.14 2.97 3.38 -1.00 -3.49 115.31 118.80 2wn9 h LEU 177 Ca -0.31 -0.90 -0.06 0.00 0.09 0.00 0.00 57.88 56.70 2wn9 h LEU 177 Cb 1.14 -0.16 -0.16 0.00 0.09 0.00 0.00 40.66 41.57 2wn9 h LEU 177 CO 0.77 1.73 0.09 -0.94 0.09 0.00 0.00 178.44 180.19 2wn9 s SER 178 N -7.15 -0.50 -0.19 -0.43 1.04 -1.03 -4.98 113.70 100.46 2wn9 s SER 178 Ca -0.19 0.27 -0.05 0.00 0.48 0.00 0.00 55.95 56.46 2wn9 s SER 178 Cb 0.05 0.51 0.09 0.00 0.10 0.00 0.00 66.02 66.78 2wn9 s SER 178 CO 0.80 -0.73 0.33 0.00 0.98 0.00 0.00 173.24 174.62 2wn9 s ALA 179 N -2.33 -0.80 0.18 5.32 0.00 -1.26 -0.94 121.76 121.93 2wn9 s ALA 179 Ca -0.06 0.95 0.10 0.00 0.00 0.00 0.00 51.96 52.96 2wn9 s ALA 179 Cb -0.01 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 2wn9 s ALA 179 CO -0.01 -0.93 -0.22 0.95 0.00 0.00 0.00 175.76 175.55 2wn9 s THR 180 N 2.49 2.16 -0.13 0.00 -4.23 -0.16 -1.85 115.64 113.92 2wn9 s THR 180 Ca 0.05 -1.96 -0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2wn9 s THR 180 Cb -0.14 -2.00 0.04 0.00 1.34 0.00 0.00 72.50 71.74 2wn9 s THR 180 CO -0.12 -0.16 0.00 0.00 -0.54 0.00 0.00 174.62 173.80 2wn9 s GLN 181 N -2.63 0.75 -0.09 3.99 -2.07 0.28 -1.44 119.66 118.46 2wn9 s GLN 181 Ca 0.18 -0.16 0.00 0.00 -1.82 0.00 0.00 55.36 53.57 2wn9 s GLN 181 Cb -0.08 -1.51 0.02 0.00 -1.09 0.00 0.00 33.01 30.35 2wn9 s GLN 181 CO 0.08 -0.43 -0.07 0.99 -1.32 0.00 0.00 175.29 174.54 2wn9 s THR 182 N 1.89 0.89 0.25 3.63 2.01 -0.69 -4.22 115.64 119.40 2wn9 s THR 182 Ca 0.03 -0.26 -0.31 0.00 0.31 0.00 0.00 61.69 61.46 2wn9 s THR 182 Cb -0.14 -0.90 -0.11 0.00 0.01 0.00 0.00 72.50 71.35 2wn9 s THR 182 CO -0.07 0.33 1.58 -0.60 -0.69 0.00 0.00 174.62 175.17 2wn9 s ARG 183 N 1.36 4.17 0.08 4.92 3.52 -1.26 -0.43 118.95 131.31 2wn9 s ARG 183 Ca -0.02 2.48 0.06 0.00 -0.13 0.00 0.00 55.73 58.12 2wn9 s ARG 183 Cb -0.14 -3.07 -0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2wn9 s ARG 183 CO -0.04 -0.60 -0.15 -0.65 -0.81 0.00 0.00 175.30 173.05 2wn9 s GLN 184 N 0.10 0.87 -0.32 5.12 -0.21 0.10 -4.92 119.66 120.41 2wn9 s GLN 184 Ca 0.65 -0.99 -0.10 0.00 0.02 0.00 0.00 55.36 54.95 2wn9 s GLN 184 Cb -0.46 -0.92 -0.00 0.00 1.00 0.00 0.00 33.01 32.62 2wn9 s GLN 184 CO 0.41 0.21 0.15 0.08 -2.12 0.00 0.00 175.29 174.02 2wn9 s VAL 185 N -1.25 4.57 -0.20 1.09 1.01 -1.26 -1.48 120.40 122.87 2wn9 s VAL 185 Ca -0.01 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 2wn9 s VAL 185 Cb -0.10 -3.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 2wn9 s VAL 185 CO 0.03 0.04 0.00 -1.58 0.00 0.00 0.00 175.10 173.58 2wn9 s GLN 186 N 1.60 3.60 -0.28 2.72 2.00 0.62 -4.95 119.66 124.97 2wn9 s GLN 186 Ca 0.04 -0.53 -0.10 0.00 -2.00 0.00 0.00 55.36 52.77 2wn9 s GLN 186 Cb -0.17 -3.08 -0.03 0.00 0.80 0.00 0.00 33.01 30.52 2wn9 s GLN 186 CO 0.06 -0.01 0.16 -1.01 -0.50 0.00 0.00 175.29 173.99 2wn9 s HIS 187 N 1.06 3.18 -0.11 1.67 3.76 -1.26 -1.27 115.29 122.31 2wn9 s HIS 187 Ca 0.02 -0.15 -0.02 0.00 -0.15 0.00 0.00 55.06 54.76 2wn9 s HIS 187 Cb -0.14 -2.35 -0.03 0.00 1.11 0.00 0.00 32.58 31.16 2wn9 s HIS 187 CO 0.02 -0.28 -0.04 0.71 -0.85 0.00 0.00 174.74 174.30 2wn9 s TYR 188 N 1.70 3.03 -1.18 1.40 1.51 -1.26 -5.02 117.35 117.53 2wn9 s TYR 188 Ca 0.06 -0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.11 2wn9 s TYR 188 Cb -0.16 -1.85 0.31 0.00 -0.11 0.00 0.00 41.96 40.15 2wn9 s TYR 188 CO 0.08 0.19 1.15 -1.13 -1.11 0.00 0.00 175.55 174.74 2wn9 n SER 189 N 2.82 0.00 0.07 2.29 3.41 -1.26 -2.14 113.62 118.80 2wn9 n SER 189 Ca -0.18 0.37 -0.03 0.00 -0.26 0.00 0.00 58.87 58.77 2wn9 n SER 189 Cb 0.53 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.00 2wn9 n SER 189 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wn9 h PRO 192 N 7.14 0.00 -5.75 0.00 0.13 -1.91 -3.41 132.00 128.20 2wn9 h PRO 192 Ca -0.39 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.09 2wn9 h PRO 192 Cb 1.15 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.21 2wn9 h PRO 192 CO 0.48 0.27 -0.39 -1.21 -0.23 0.00 0.00 178.00 176.91 2wn9 s GLU 193 N -3.46 3.60 0.57 0.86 2.02 -1.26 -5.04 118.70 116.00 2wn9 s GLU 193 Ca 0.02 0.04 -0.14 0.00 0.02 0.00 0.00 54.97 54.91 2wn9 s GLU 193 Cb 0.09 -3.20 -0.06 0.00 0.10 0.00 0.00 34.13 31.06 2wn9 s GLU 193 CO 0.66 0.74 1.01 -1.25 0.02 0.00 0.00 175.26 176.45 2wn9 s PRO 194 N -1.02 3.72 0.01 0.39 0.04 -1.26 -4.80 135.00 132.09 2wn9 s PRO 194 Ca 0.18 0.87 0.02 0.00 0.04 0.00 0.00 61.00 62.11 2wn9 s PRO 194 Cb -0.13 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2wn9 s PRO 194 CO 0.07 -0.47 -0.02 0.71 0.04 0.00 0.00 177.00 177.33 2wn9 s TYR 195 N -2.89 2.99 -0.05 0.56 1.51 -0.40 -0.29 117.35 118.78 2wn9 s TYR 195 Ca 0.57 0.02 -0.10 0.00 -1.01 0.00 0.00 57.07 56.55 2wn9 s TYR 195 Cb -0.11 -1.63 -0.05 0.00 -0.11 0.00 0.00 41.96 40.06 2wn9 s TYR 195 CO 0.43 0.43 0.27 0.42 -1.11 0.00 0.00 175.55 176.00 2wn9 s ILE 196 N -1.08 5.28 0.14 2.71 -1.09 -1.26 -0.28 121.20 125.62 2wn9 s ILE 196 Ca 0.19 0.47 0.01 0.00 -2.23 0.00 0.00 60.65 59.09 2wn9 s ILE 196 Cb -0.11 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.17 2wn9 s ILE 196 CO 0.10 0.56 0.01 1.51 -1.23 0.00 0.00 174.94 175.89 2wn9 s ASP 197 N -1.16 0.90 -0.22 3.58 -4.77 -0.55 -4.22 116.67 110.23 2wn9 s ASP 197 Ca 0.21 -1.15 -0.05 0.00 -3.30 0.00 0.00 52.55 48.26 2wn9 s ASP 197 Cb -0.14 0.17 -0.02 0.00 -1.09 0.00 0.00 42.92 41.84 2wn9 s ASP 197 CO 0.10 -0.60 0.01 -0.69 0.70 0.00 0.00 175.17 174.68 2wn9 s VAL 198 N -3.78 3.87 -0.32 2.11 1.01 0.52 0.02 120.40 123.83 2wn9 s VAL 198 Ca 0.21 -0.33 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 2wn9 s VAL 198 Cb 0.07 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2wn9 s VAL 198 CO 0.01 0.40 0.46 0.21 0.00 0.00 0.00 175.10 176.17 2wn9 s ASN 199 N 1.36 6.29 -0.30 3.32 2.47 0.43 -0.96 114.94 127.55 2wn9 s ASN 199 Ca 0.04 0.05 -0.16 0.00 0.42 0.00 0.00 52.86 53.22 2wn9 s ASN 199 Cb -0.15 -2.24 -0.02 0.00 -1.45 0.00 0.00 41.25 37.39 2wn9 s ASN 199 CO 0.01 -0.37 0.42 -0.22 -3.72 0.00 0.00 177.10 173.21 2wn9 s LEU 200 N 2.25 4.17 -0.16 3.21 2.96 0.17 -1.71 118.68 129.56 2wn9 s LEU 200 Ca 0.17 0.17 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2wn9 s LEU 200 Cb -0.16 -2.47 0.02 0.00 0.50 0.00 0.00 46.19 44.08 2wn9 s LEU 200 CO 0.12 -0.28 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.97 2wn9 s VAL 201 N 2.16 2.02 -0.10 1.68 1.01 -0.52 -0.93 120.40 125.71 2wn9 s VAL 201 Ca 0.16 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2wn9 s VAL 201 Cb -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.42 2wn9 s VAL 201 CO 0.11 0.54 -0.15 -0.69 0.00 0.00 0.00 175.10 174.90 2wn9 s VAL 202 N 1.15 1.48 -0.16 2.92 1.01 -0.44 -0.99 120.40 125.38 2wn9 s VAL 202 Ca 0.01 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 2wn9 s VAL 202 Cb -0.14 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 2wn9 s VAL 202 CO -0.09 0.44 -0.04 -0.54 0.00 0.00 0.00 175.10 174.87 2wn9 s LYS 203 N 0.89 3.67 0.12 2.72 1.02 -0.11 -1.39 119.74 126.66 2wn9 s LYS 203 Ca -0.09 -0.52 -0.15 0.00 0.02 0.00 0.00 55.97 55.23 2wn9 s LYS 203 Cb -0.15 -2.92 0.03 0.00 -0.52 0.00 0.00 37.83 34.27 2wn9 s LYS 203 CO -0.00 0.23 0.37 -0.59 -0.92 0.00 0.00 175.35 174.44 2wn9 s PHE 204 N 0.38 -0.15 0.06 3.18 -0.12 -0.32 -0.28 117.98 120.72 2wn9 s PHE 204 Ca -0.04 -0.17 -0.14 0.00 -0.05 0.00 0.00 56.93 56.53 2wn9 s PHE 204 Cb -0.14 0.21 0.02 0.00 -0.63 0.00 0.00 43.02 42.48 2wn9 s PHE 204 CO 0.03 -0.67 0.32 -0.98 -0.05 0.00 0.00 175.22 173.87 2wn9 s ARG 205 N -3.75 0.86 0.21 1.99 1.70 -0.56 -0.21 118.95 119.18 2wn9 s ARG 205 Ca 0.03 -0.54 -0.32 0.00 -0.47 0.00 0.00 55.73 54.42 2wn9 s ARG 205 Cb 0.02 0.37 -0.14 0.00 -0.57 0.00 0.00 34.95 34.64 2wn9 s ARG 205 CO -0.11 -0.29 1.44 0.39 -1.08 0.00 0.00 175.30 175.65 2wn9 n GLU 206 N 0.42 1.99 -1.82 3.89 1.02 0.61 -0.57 120.64 126.18 2wn9 n GLU 206 Ca -0.18 0.71 -0.38 0.00 -0.02 0.00 0.00 57.16 57.30 2wn9 n GLU 206 Cb 0.60 -2.39 0.05 0.00 -0.02 0.00 0.00 31.44 29.68 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 0.01 2.93 0.00 3.49 3.52 -0.65 -4.72 118.95 123.53 2wn9 s ARG 207 Ca 0.72 2.11 0.32 0.00 -0.13 0.00 0.00 55.73 58.74 2wn9 s ARG 207 Cb -0.68 -2.07 1.89 0.00 -1.56 0.00 0.00 34.95 32.52 2wn9 s ARG 207 CO 0.46 -1.31 2.21 0.54 -0.81 0.00 0.00 175.30 176.39