#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wn1 h ARG 2 N 0.00 0.08 -0.89 2.12 3.08 -1.92 -0.46 114.38 116.39 1wn1 h ARG 2 Ca 0.00 -0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.13 1wn1 h ARG 2 Cb 0.00 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 1wn1 h ARG 2 CO 0.00 0.05 0.58 1.25 -1.07 0.00 0.00 179.97 180.78 1wn1 h LEU 3 N 0.08 0.84 -0.59 3.04 5.85 -1.90 0.23 115.31 122.86 1wn1 h LEU 3 Ca 0.08 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.67 1wn1 h LEU 3 Cb 0.09 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1wn1 h LEU 3 CO -0.13 0.52 -0.49 -0.33 -0.34 0.00 0.00 178.44 177.67 1wn1 h GLU 4 N 0.94 0.55 -0.22 1.25 3.07 -1.77 -0.53 114.58 117.87 1wn1 h GLU 4 Ca 0.40 -0.31 -0.05 0.00 -0.50 0.00 0.00 59.36 58.90 1wn1 h GLU 4 Cb 0.32 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.25 1wn1 h GLU 4 CO -0.16 0.91 -0.06 0.87 -1.40 0.00 0.00 179.01 179.17 1wn1 h LYS 5 N 0.43 0.42 -0.48 2.33 1.57 0.07 -1.60 116.57 119.31 1wn1 h LYS 5 Ca 0.02 -0.16 0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1wn1 h LYS 5 Cb 1.01 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.24 1wn1 h LYS 5 CO 0.09 0.67 0.19 0.35 -0.57 0.00 0.00 179.45 180.18 1wn1 h PHE 6 N 0.15 0.35 -0.46 -1.35 3.57 -0.44 0.61 116.94 119.38 1wn1 h PHE 6 Ca 0.05 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1wn1 h PHE 6 Cb 0.51 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1wn1 h PHE 6 CO 0.05 0.14 0.30 0.82 -2.23 0.00 0.00 178.31 177.39 1wn1 h ILE 7 N 0.39 1.11 -0.37 1.41 2.04 -0.93 0.66 117.51 121.81 1wn1 h ILE 7 Ca 0.23 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 1wn1 h ILE 7 Cb 0.21 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1wn1 h ILE 7 CO -0.21 0.11 0.22 -0.74 0.00 0.00 0.00 178.15 177.53 1wn1 h HIS 8 N 0.61 0.50 -0.25 1.37 2.76 -0.70 -2.21 115.15 117.24 1wn1 h HIS 8 Ca 0.17 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 1wn1 h HIS 8 Cb -0.06 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 28.72 1wn1 h HIS 8 CO -0.05 0.38 0.12 1.25 -1.30 0.00 0.00 177.93 178.33 1wn1 h LEU 9 N 0.48 0.30 -0.28 0.26 5.85 -0.46 -1.53 115.31 119.93 1wn1 h LEU 9 Ca 0.13 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1wn1 h LEU 9 Cb 0.03 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1wn1 h LEU 9 CO -0.02 0.26 0.12 -0.07 -0.34 0.00 0.00 178.44 178.38 1wn1 h LEU 10 N 0.34 0.16 -0.20 2.25 3.38 -0.25 -1.73 115.31 119.26 1wn1 h LEU 10 Ca 0.09 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1wn1 h LEU 10 Cb 0.04 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1wn1 h LEU 10 CO -0.01 0.12 -0.19 1.23 0.09 0.00 0.00 178.44 179.69 1wn1 h GLY 11 N 0.25 0.52 1.50 0.83 0.00 -1.24 -0.59 103.07 104.35 1wn1 h GLY 11 Ca 0.12 -0.53 0.03 0.00 0.00 0.00 0.00 47.33 46.96 1wn1 h GLY 11 CO -0.10 0.47 0.22 -2.09 0.00 0.00 0.00 176.54 175.04 1wn1 h GLU 12 N 0.15 0.00 -0.35 4.80 4.81 -1.06 -0.02 114.58 122.92 1wn1 h GLU 12 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1wn1 h GLU 12 Cb 0.73 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1wn1 h GLU 12 CO 0.05 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.87 1wn1 n ARG 13 N -3.40 2.29 -0.98 1.92 5.12 -0.67 -4.99 116.66 115.95 1wn1 n ARG 13 Ca 0.00 -2.04 0.00 0.00 -1.93 0.00 0.00 57.85 53.88 1wn1 n ARG 13 Cb 0.31 -1.37 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 1wn1 n ARG 13 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1wn1 n GLY 14 N 0.99 0.47 3.86 -0.13 0.00 -0.02 -5.05 105.19 105.32 1wn1 n GLY 14 Ca 0.15 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 1wn1 n GLY 14 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wn1 s PHE 15 N -2.00 3.41 -0.11 1.61 0.08 -0.26 -4.85 117.98 115.86 1wn1 s PHE 15 Ca 0.00 1.03 0.16 0.00 0.12 0.00 0.00 56.93 58.24 1wn1 s PHE 15 Cb 0.00 -2.38 -0.19 0.00 -0.57 0.00 0.00 43.02 39.88 1wn1 s PHE 15 CO 0.00 0.20 0.64 -0.25 -0.10 0.00 0.00 175.22 175.71 1wn1 n ASP 16 N -0.21 0.67 -0.93 1.36 8.00 -0.29 -4.33 116.55 120.83 1wn1 n ASP 16 Ca 0.02 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.82 1wn1 n ASP 16 Cb 0.53 0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.99 1wn1 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wn1 n GLY 17 N 1.48 1.27 3.43 0.44 0.00 -1.19 -0.70 105.19 109.94 1wn1 n GLY 17 Ca -0.15 -0.89 -0.16 0.00 0.00 0.00 0.00 46.02 44.82 1wn1 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wn1 s ALA 18 N -1.00 -1.42 -0.19 4.61 0.00 0.52 -1.52 121.76 122.77 1wn1 s ALA 18 Ca 0.00 1.10 0.01 0.00 0.00 0.00 0.00 51.96 53.07 1wn1 s ALA 18 Cb 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 22.97 1wn1 s ALA 18 CO 0.00 -0.32 -0.15 -0.51 0.00 0.00 0.00 175.76 174.78 1wn1 s LEU 19 N -0.92 2.25 -0.29 0.00 1.43 -0.05 -0.79 118.68 120.31 1wn1 s LEU 19 Ca -0.09 -0.77 0.03 0.00 -1.03 0.00 0.00 54.13 52.27 1wn1 s LEU 19 Cb -0.02 -1.37 0.07 0.00 0.03 0.00 0.00 46.19 44.90 1wn1 s LEU 19 CO 0.06 -0.07 -0.06 -0.63 0.23 0.00 0.00 176.35 175.89 1wn1 s ILE 20 N 1.33 2.18 0.83 -0.59 1.01 -0.26 -1.70 121.20 123.99 1wn1 s ILE 20 Ca 0.02 -1.85 -0.12 0.00 0.00 0.00 0.00 60.65 58.70 1wn1 s ILE 20 Cb -0.15 -2.39 0.09 0.00 0.01 0.00 0.00 42.46 40.02 1wn1 s ILE 20 CO -0.10 -0.22 1.11 -0.94 0.00 0.00 0.00 174.94 174.79 1wn1 s SER 21 N 1.05 4.25 0.61 3.58 1.04 -1.26 -1.46 113.70 121.51 1wn1 s SER 21 Ca -0.02 1.22 -0.19 0.00 0.48 0.00 0.00 55.95 57.44 1wn1 s SER 21 Cb -0.20 -1.92 -0.03 0.00 0.10 0.00 0.00 66.02 63.97 1wn1 s SER 21 CO -0.06 -2.11 1.15 -0.81 0.98 0.00 0.00 173.24 172.39 1wn1 n PRO 22 N -3.51 1.08 -2.40 4.02 -0.04 -1.26 -4.49 135.00 128.41 1wn1 n PRO 22 Ca 0.07 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 1wn1 n PRO 22 Cb 0.57 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1wn1 n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wn1 n GLY 23 N 1.07 0.08 0.19 0.55 0.00 -1.26 -4.92 105.19 100.90 1wn1 n GLY 23 Ca 0.14 -1.43 -0.09 0.00 0.00 0.00 0.00 46.02 44.65 1wn1 n GLY 23 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1wn1 h THR 24 N 0.00 1.19 -0.74 2.61 1.35 -1.93 -2.33 112.91 113.06 1wn1 h THR 24 Ca 0.00 -0.56 -0.03 0.00 -0.55 0.00 0.00 66.41 65.28 1wn1 h THR 24 Cb 0.00 0.83 -0.03 0.00 -1.73 0.00 0.00 68.15 67.21 1wn1 h THR 24 CO 0.00 0.20 0.36 0.78 -0.25 0.00 0.00 175.52 176.62 1wn1 h ASN 25 N 0.49 0.97 -0.03 5.36 2.35 -1.93 0.20 115.58 122.98 1wn1 h ASN 25 Ca 0.13 -0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.76 1wn1 h ASN 25 Cb 0.16 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1wn1 h ASN 25 CO -0.01 0.82 -0.01 0.25 -1.65 0.00 0.00 177.43 176.83 1wn1 h LEU 26 N 1.04 -0.04 -0.30 1.61 5.85 -1.76 -1.96 115.31 119.74 1wn1 h LEU 26 Ca 0.26 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.03 1wn1 h LEU 26 Cb 0.11 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 1wn1 h LEU 26 CO -0.03 -0.02 0.07 0.22 -0.34 0.00 0.00 178.44 178.34 1wn1 h TYR 27 N -0.01 0.12 -0.57 1.25 3.20 -0.99 -1.23 116.97 118.73 1wn1 h TYR 27 Ca 0.02 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.02 1wn1 h TYR 27 Cb 0.03 -0.01 -0.10 0.00 1.54 0.00 0.00 36.73 38.20 1wn1 h TYR 27 CO -0.11 0.03 0.01 -0.92 -1.64 0.00 0.00 178.16 175.54 1wn1 h TYR 28 N 0.18 -0.02 0.00 -3.82 3.20 -0.28 0.58 116.97 116.81 1wn1 h TYR 28 Ca 0.14 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1wn1 h TYR 28 Cb 0.14 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 1wn1 h TYR 28 CO -0.16 -0.14 -0.16 -0.07 -1.64 0.00 0.00 178.16 175.99 1wn1 h LEU 29 N 0.13 0.00 0.00 2.82 4.07 -1.04 -3.41 115.31 117.87 1wn1 h LEU 29 Ca 0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.26 1wn1 h LEU 29 Cb 0.47 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.21 1wn1 h LEU 29 CO -0.48 0.06 -0.01 0.35 -1.08 0.00 0.00 178.44 177.28 1wn1 n THR 30 N -3.07 0.00 -0.12 0.22 -2.24 -0.49 -3.98 114.28 104.60 1wn1 n THR 30 Ca 0.03 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1wn1 n THR 30 Cb 0.56 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 1wn1 n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wn1 n GLY 31 N 0.02 2.14 3.74 3.38 0.00 0.20 -5.01 105.19 109.67 1wn1 n GLY 31 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1wn1 n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wn1 s LEU 32 N 0.00 4.39 -0.08 0.99 1.43 -1.26 -4.91 118.68 119.24 1wn1 s LEU 32 Ca 0.00 2.65 -0.03 0.00 -1.03 0.00 0.00 54.13 55.72 1wn1 s LEU 32 Cb 0.00 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.64 1wn1 s LEU 32 CO 0.00 -0.69 0.10 -0.60 0.23 0.00 0.00 176.35 175.39 1wn1 s ARG 33 N -0.32 -0.02 -0.10 1.70 3.52 -1.26 -3.83 118.95 118.65 1wn1 s ARG 33 Ca 0.59 0.36 -0.03 0.00 -0.13 0.00 0.00 55.73 56.53 1wn1 s ARG 33 Cb -0.41 -0.66 -0.03 0.00 -1.56 0.00 0.00 34.95 32.28 1wn1 s ARG 33 CO 0.43 -0.38 0.01 -0.51 -0.81 0.00 0.00 175.30 174.03 1wn1 s LEU 34 N 2.21 3.64 -0.09 -0.88 1.43 -1.26 -4.95 118.68 118.77 1wn1 s LEU 34 Ca 0.04 0.14 -0.23 0.00 -1.03 0.00 0.00 54.13 53.05 1wn1 s LEU 34 Cb -0.13 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 1wn1 s LEU 34 CO -0.05 0.35 0.70 -2.28 0.23 0.00 0.00 176.35 175.30 1wn1 s HIS 35 N -0.71 3.55 -0.18 0.29 5.65 -1.26 -4.55 115.29 118.07 1wn1 s HIS 35 Ca 0.11 1.22 -0.16 0.00 0.25 0.00 0.00 55.06 56.48 1wn1 s HIS 35 Cb -0.12 -2.82 0.02 0.00 -1.18 0.00 0.00 32.58 28.49 1wn1 s HIS 35 CO 0.02 0.04 0.27 0.39 -0.65 0.00 0.00 174.74 174.81 1wn1 n GLU 36 N 4.01 -0.82 0.09 2.88 1.02 -1.26 -4.88 120.64 121.68 1wn1 n GLU 36 Ca -0.01 0.70 -0.15 0.00 -0.02 0.00 0.00 57.16 57.68 1wn1 n GLU 36 Cb 0.51 -0.97 -0.10 0.00 -0.02 0.00 0.00 31.44 30.86 1wn1 n GLU 36 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1wn1 h VAL 37 N 1.60 1.44 0.00 2.62 2.07 -1.94 -3.48 116.25 118.57 1wn1 h VAL 37 Ca -0.23 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.52 1wn1 h VAL 37 Cb 0.75 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 1wn1 h VAL 37 CO 0.09 0.82 0.00 0.61 0.02 0.00 0.00 177.57 179.11 1wn1 n GLY 38 N 1.29 3.32 0.23 2.17 0.00 -1.26 -2.32 105.19 108.63 1wn1 n GLY 38 Ca -0.08 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1wn1 n GLY 38 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wn1 h GLU 39 N 0.00 0.00 -6.32 1.61 5.08 -2.04 -3.45 114.58 109.46 1wn1 h GLU 39 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1wn1 h GLU 39 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1wn1 h GLU 39 CO 0.00 0.17 1.15 1.03 -1.00 0.00 0.00 179.01 180.36 1wn1 s ARG 40 N -3.57 3.65 -0.06 2.33 0.52 -0.98 -4.93 118.95 115.92 1wn1 s ARG 40 Ca 0.01 1.48 -0.37 0.00 -0.52 0.00 0.00 55.73 56.34 1wn1 s ARG 40 Cb 0.09 -4.07 -0.15 0.00 0.52 0.00 0.00 34.95 31.34 1wn1 s ARG 40 CO 0.62 -1.47 1.58 -0.11 0.02 0.00 0.00 175.30 175.95 1wn1 n LEU 41 N 8.92 2.31 -3.61 2.53 7.94 -1.26 -4.87 117.00 128.96 1wn1 n LEU 41 Ca 0.19 1.08 -0.19 0.00 -1.11 0.00 0.00 56.01 55.98 1wn1 n LEU 41 Cb 0.46 -1.22 -0.15 0.00 0.53 0.00 0.00 43.42 43.04 1wn1 n LEU 41 CO 0.66 -0.61 -0.25 0.00 -1.11 0.00 0.00 177.39 176.08 1wn1 s ALA 42 N 2.08 -0.07 -0.09 1.96 0.00 -1.26 -4.03 121.76 120.35 1wn1 s ALA 42 Ca 0.90 0.30 -0.04 0.00 0.00 0.00 0.00 51.96 53.12 1wn1 s ALA 42 Cb -0.93 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 21.24 1wn1 s ALA 42 CO 0.53 -0.85 0.21 0.42 0.00 0.00 0.00 175.76 176.07 1wn1 s ILE 43 N 2.27 -0.08 -0.24 0.00 1.01 0.55 -4.00 121.20 120.72 1wn1 s ILE 43 Ca 0.04 0.18 -0.23 0.00 0.00 0.00 0.00 60.65 60.64 1wn1 s ILE 43 Cb -0.14 -0.33 -0.01 0.00 0.01 0.00 0.00 42.46 41.99 1wn1 s ILE 43 CO -0.08 0.07 0.76 -0.22 0.00 0.00 0.00 174.94 175.47 1wn1 s LEU 44 N 1.35 4.09 -0.17 2.97 2.96 -0.54 -0.84 118.68 128.50 1wn1 s LEU 44 Ca -0.08 0.94 -0.06 0.00 -0.22 0.00 0.00 54.13 54.71 1wn1 s LEU 44 Cb -0.11 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.47 1wn1 s LEU 44 CO -0.08 -0.45 0.02 0.00 -1.32 0.00 0.00 176.35 174.53 1wn1 s ALA 45 N 2.62 3.24 -0.04 5.97 0.00 0.17 -1.10 121.76 132.61 1wn1 s ALA 45 Ca 0.32 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1wn1 s ALA 45 Cb -0.15 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1wn1 s ALA 45 CO 0.08 0.20 -0.14 0.08 0.00 0.00 0.00 175.76 175.99 1wn1 s VAL 46 N 0.34 1.17 0.10 0.00 1.01 0.03 -1.72 120.40 121.32 1wn1 s VAL 46 Ca 0.00 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1wn1 s VAL 46 Cb -0.13 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1wn1 s VAL 46 CO 0.01 0.35 0.20 -0.55 0.00 0.00 0.00 175.10 175.11 1wn1 s SER 47 N 0.16 6.13 0.00 3.32 0.15 -0.64 -0.36 113.70 122.47 1wn1 s SER 47 Ca -0.05 0.16 0.20 0.00 0.70 0.00 0.00 55.95 56.96 1wn1 s SER 47 Cb -0.11 -1.81 0.93 0.00 -1.71 0.00 0.00 66.02 63.31 1wn1 s SER 47 CO 0.02 0.13 1.64 0.00 1.20 0.00 0.00 173.24 176.22 1wn1 n ALA 48 N 0.02 1.98 0.08 5.45 0.00 0.13 -2.78 120.51 125.38 1wn1 n ALA 48 Ca -0.06 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.10 1wn1 n ALA 48 Cb 0.52 -1.33 -0.11 0.00 0.00 0.00 0.00 19.45 18.54 1wn1 n ALA 48 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1wn1 h GLU 49 N 0.00 0.57 0.00 0.00 4.39 -1.92 -3.44 114.58 114.18 1wn1 h GLU 49 Ca 0.00 -0.71 0.00 0.00 0.34 0.00 0.00 59.36 58.99 1wn1 h GLU 49 Cb 0.28 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1wn1 h GLU 49 CO 0.00 1.30 0.00 0.41 -1.16 0.00 0.00 179.01 179.56 1wn1 n GLY 50 N 1.24 0.90 3.87 -3.84 0.00 -1.12 -5.11 105.19 101.13 1wn1 n GLY 50 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1wn1 n GLY 50 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wn1 s ASP 51 N 0.00 6.47 -0.09 1.61 2.15 -1.26 -4.89 116.67 120.66 1wn1 s ASP 51 Ca 0.00 1.26 -0.31 0.00 0.43 0.00 0.00 52.55 53.93 1wn1 s ASP 51 Cb 0.00 -2.38 0.09 0.00 -0.30 0.00 0.00 42.92 40.33 1wn1 s ASP 51 CO 0.00 -0.55 0.79 -0.72 -0.17 0.00 0.00 175.17 174.52 1wn1 s TYR 52 N -2.61 -0.56 -0.07 -5.34 -0.85 -1.26 -1.62 117.35 105.04 1wn1 s TYR 52 Ca 0.53 0.95 -0.08 0.00 -0.52 0.00 0.00 57.07 57.96 1wn1 s TYR 52 Cb -0.10 0.42 0.02 0.00 0.38 0.00 0.00 41.96 42.68 1wn1 s TYR 52 CO 0.37 -0.52 0.21 0.50 -1.52 0.00 0.00 175.55 174.59 1wn1 s ARG 53 N -1.18 0.29 -0.30 -3.49 3.52 -0.70 -4.87 118.95 112.22 1wn1 s ARG 53 Ca -0.08 0.20 -0.10 0.00 -0.13 0.00 0.00 55.73 55.63 1wn1 s ARG 53 Cb -0.00 0.14 -0.02 0.00 -1.56 0.00 0.00 34.95 33.51 1wn1 s ARG 53 CO 0.07 -0.04 0.15 0.12 -0.81 0.00 0.00 175.30 174.79 1wn1 s PHE 54 N -0.11 3.17 -0.21 5.12 5.36 -0.55 -0.66 117.98 130.11 1wn1 s PHE 54 Ca -0.02 -0.40 -0.17 0.00 -0.96 0.00 0.00 56.93 55.38 1wn1 s PHE 54 Cb -0.02 -2.35 -0.03 0.00 -0.34 0.00 0.00 43.02 40.27 1wn1 s PHE 54 CO 0.01 -0.38 0.48 -1.17 -1.46 0.00 0.00 175.22 172.69 1wn1 s LEU 55 N 1.65 4.13 0.12 6.12 2.96 -0.02 -1.77 118.68 131.87 1wn1 s LEU 55 Ca 0.05 0.59 -0.09 0.00 -0.22 0.00 0.00 54.13 54.46 1wn1 s LEU 55 Cb -0.17 -2.63 -0.00 0.00 0.50 0.00 0.00 46.19 43.89 1wn1 s LEU 55 CO 0.07 -0.16 0.24 0.00 -1.32 0.00 0.00 176.35 175.18 1wn1 s ALA 56 N 1.64 -0.20 0.46 5.97 0.00 -0.92 -0.33 121.76 128.38 1wn1 s ALA 56 Ca 0.22 -0.67 -0.24 0.00 0.00 0.00 0.00 51.96 51.27 1wn1 s ALA 56 Cb -0.15 0.63 -0.07 0.00 0.00 0.00 0.00 23.12 23.53 1wn1 s ALA 56 CO 0.09 -0.57 1.28 -2.14 0.00 0.00 0.00 175.76 174.42 1wn1 s PRO 57 N -3.89 3.65 0.47 0.00 0.02 -1.26 -1.29 135.00 132.70 1wn1 s PRO 57 Ca 0.09 2.07 0.22 0.00 0.02 0.00 0.00 61.00 63.41 1wn1 s PRO 57 Cb 0.04 -2.50 1.23 0.00 0.02 0.00 0.00 34.50 33.29 1wn1 s PRO 57 CO -0.07 -0.73 1.88 0.66 -0.33 0.00 0.00 177.00 178.41 1wn1 h SER 58 N 2.12 0.25 0.00 2.53 4.64 -1.54 -1.36 113.55 120.17 1wn1 h SER 58 Ca -0.50 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1wn1 h SER 58 Cb 1.26 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1wn1 h SER 58 CO 0.60 0.10 0.20 -0.07 -0.87 0.00 0.00 176.83 176.79 1wn1 h LEU 59 N 0.25 0.00 -2.67 5.97 -0.00 -1.90 -1.97 115.31 114.99 1wn1 h LEU 59 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.31 1wn1 h LEU 59 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 1wn1 h LEU 59 CO -0.11 0.00 0.00 -1.22 -0.00 0.00 0.00 178.44 177.11 1wn1 n TYR 60 N -2.21 0.51 0.22 1.13 4.01 -0.51 -4.60 117.16 115.70 1wn1 n TYR 60 Ca -0.01 -0.43 0.11 0.00 -0.16 0.00 0.00 57.90 57.41 1wn1 n TYR 60 Cb 0.23 -0.02 0.59 0.00 -0.31 0.00 0.00 39.34 39.82 1wn1 n TYR 60 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 1wn1 h GLU 61 N 2.62 0.00 0.10 -0.72 4.81 -1.52 -2.18 114.58 117.69 1wn1 h GLU 61 Ca 0.00 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.93 1wn1 h GLU 61 Cb 0.77 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1wn1 h GLU 61 CO 0.00 0.00 -1.58 -0.91 -0.73 0.00 0.00 179.01 175.79 1wn1 h ASN 62 N 0.00 0.35 1.13 1.04 4.21 -1.84 -3.39 115.58 117.07 1wn1 h ASN 62 Ca 0.00 -0.83 -0.06 0.00 1.21 0.00 0.00 56.30 56.61 1wn1 h ASN 62 Cb 0.42 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.50 1wn1 h ASN 62 CO 0.00 1.68 -0.31 0.58 -1.29 0.00 0.00 177.43 178.09 1wn1 h VAL 63 N -0.28 0.65 0.00 2.81 2.07 -1.74 -3.25 116.25 116.51 1wn1 h VAL 63 Ca -0.35 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 65.70 1wn1 h VAL 63 Cb 1.79 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.54 1wn1 h VAL 63 CO 0.03 0.30 0.00 0.52 0.02 0.00 0.00 177.57 178.44 1wn1 n VAL 64 N -3.35 0.75 -2.55 2.57 0.31 -1.03 -4.80 118.33 110.24 1wn1 n VAL 64 Ca 0.01 0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.53 1wn1 n VAL 64 Cb 0.53 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 1wn1 n VAL 64 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1wn1 n ASN 65 N -1.34 0.00 -1.47 4.52 3.02 -1.23 -2.05 115.26 116.72 1wn1 n ASN 65 Ca 0.06 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.49 1wn1 n ASN 65 Cb 0.12 0.00 0.16 0.00 -0.61 0.00 0.00 39.78 39.45 1wn1 n ASN 65 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1wn1 n ASN 66 N 1.47 3.39 -4.74 6.41 2.04 -1.26 -4.96 115.26 117.62 1wn1 n ASN 66 Ca 0.00 -3.79 -0.41 0.00 -0.44 0.00 0.00 54.58 49.94 1wn1 n ASN 66 Cb 0.00 -0.64 -0.03 0.00 -2.53 0.00 0.00 39.78 36.58 1wn1 n ASN 66 CO 0.00 0.00 0.00 0.12 -0.44 0.00 0.00 177.26 176.94 1wn1 s PHE 67 N -3.37 3.30 -0.38 -2.53 5.36 -0.87 -4.85 117.98 114.64 1wn1 s PHE 67 Ca 0.48 1.30 -0.40 0.00 -0.96 0.00 0.00 56.93 57.35 1wn1 s PHE 67 Cb 0.42 -3.55 -0.16 0.00 -0.34 0.00 0.00 43.02 39.40 1wn1 s PHE 67 CO 0.01 -1.65 1.97 -2.30 -1.46 0.00 0.00 175.22 171.78 1wn1 n PRO 68 N 2.50 0.74 -4.30 10.12 -0.02 -1.26 -4.89 135.00 137.89 1wn1 n PRO 68 Ca 0.05 0.24 -0.17 0.00 -2.02 0.00 0.00 63.50 61.60 1wn1 n PRO 68 Cb 0.43 -2.01 -0.09 0.00 -0.02 0.00 0.00 33.50 31.81 1wn1 n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wn1 s ALA 69 N 5.26 1.75 -0.20 3.55 0.00 -1.26 -1.49 121.76 129.38 1wn1 s ALA 69 Ca 1.08 -1.80 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 1wn1 s ALA 69 Cb -1.15 1.24 0.10 0.00 0.00 0.00 0.00 23.12 23.31 1wn1 s ALA 69 CO 0.62 -0.54 0.36 0.99 0.00 0.00 0.00 175.76 177.19 1wn1 s THR 70 N -3.72 -0.57 0.22 0.00 2.01 -0.73 -4.87 115.64 107.99 1wn1 s THR 70 Ca 0.37 0.11 0.01 0.00 0.31 0.00 0.00 61.69 62.49 1wn1 s THR 70 Cb 0.05 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 1wn1 s THR 70 CO 0.17 0.02 0.40 -0.36 -0.69 0.00 0.00 174.62 174.16 1wn1 s PHE 71 N 2.54 3.48 -0.04 4.92 0.40 -1.26 -2.17 117.98 125.85 1wn1 s PHE 71 Ca 0.03 0.27 0.04 0.00 -0.60 0.00 0.00 56.93 56.67 1wn1 s PHE 71 Cb -0.13 -1.80 -0.00 0.00 0.51 0.00 0.00 43.02 41.59 1wn1 s PHE 71 CO -0.13 0.36 -0.16 1.67 0.70 0.00 0.00 175.22 177.67 1wn1 s TRP 72 N -1.94 1.58 0.02 0.36 1.48 -0.41 -4.90 118.94 115.13 1wn1 s TRP 72 Ca 0.38 -0.42 -0.07 0.00 -1.06 0.00 0.00 56.10 54.92 1wn1 s TRP 72 Cb -0.10 -1.06 -0.05 0.00 -1.16 0.00 0.00 33.47 31.09 1wn1 s TRP 72 CO 0.30 -0.14 0.29 -1.01 -4.06 0.00 0.00 176.95 172.33 1wn1 s HIS 73 N -0.01 3.58 0.20 1.66 3.76 -1.26 -1.30 115.29 121.91 1wn1 s HIS 73 Ca -0.02 0.60 -0.32 0.00 -0.15 0.00 0.00 55.06 55.17 1wn1 s HIS 73 Cb -0.10 -2.01 -0.15 0.00 1.11 0.00 0.00 32.58 31.43 1wn1 s HIS 73 CO 0.01 0.60 1.31 -0.25 -0.85 0.00 0.00 174.74 175.56 1wn1 n ASP 74 N 1.08 2.10 0.00 1.40 10.43 -1.26 -1.20 116.55 129.10 1wn1 n ASP 74 Ca -0.11 1.14 0.00 0.00 2.57 0.00 0.00 54.79 58.39 1wn1 n ASP 74 Cb 0.53 -1.32 0.00 0.00 1.84 0.00 0.00 41.12 42.16 1wn1 n ASP 74 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1wn1 n GLY 75 N 2.18 2.56 3.94 0.44 0.00 -1.26 -5.08 105.19 107.97 1wn1 n GLY 75 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 1wn1 n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wn1 s GLU 76 N -0.31 3.42 -0.75 1.61 2.02 -0.34 -5.05 118.70 119.30 1wn1 s GLU 76 Ca 0.00 -0.31 -0.18 0.00 0.02 0.00 0.00 54.97 54.50 1wn1 s GLU 76 Cb 0.00 -2.62 0.13 0.00 0.10 0.00 0.00 34.13 31.74 1wn1 s GLU 76 CO 0.00 0.05 0.88 1.21 0.02 0.00 0.00 175.26 177.41 1wn1 s ASN 77 N -4.07 6.42 0.35 -0.19 2.47 -1.26 -4.91 114.94 113.75 1wn1 s ASN 77 Ca 0.42 -1.80 0.14 0.00 0.42 0.00 0.00 52.86 52.04 1wn1 s ASN 77 Cb -0.10 -2.33 1.01 0.00 -1.45 0.00 0.00 41.25 38.38 1wn1 s ASN 77 CO 0.37 -1.04 1.72 -0.65 -3.72 0.00 0.00 177.10 173.78 1wn1 h PRO 78 N 8.87 0.44 -0.58 0.43 0.11 -1.96 0.20 132.00 139.50 1wn1 h PRO 78 Ca -0.08 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.93 1wn1 h PRO 78 Cb 1.06 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 1wn1 h PRO 78 CO 1.05 0.29 0.08 1.88 -0.21 0.00 0.00 178.00 181.10 1wn1 h TYR 79 N 0.45 0.99 -0.29 0.65 0.05 -1.98 0.77 116.97 117.62 1wn1 h TYR 79 Ca 0.67 -0.13 -0.09 0.00 0.05 0.00 0.00 58.73 59.24 1wn1 h TYR 79 Cb 1.47 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 38.92 1wn1 h TYR 79 CO -0.01 0.85 -0.15 0.00 -1.05 0.00 0.00 178.16 177.81 1wn1 h ALA 80 N 1.20 0.41 -0.85 3.88 0.00 -1.05 -0.88 119.26 121.96 1wn1 h ALA 80 Ca 0.18 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1wn1 h ALA 80 Cb 0.41 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1wn1 h ALA 80 CO 0.01 0.31 0.56 0.87 0.00 0.00 0.00 179.25 181.00 1wn1 h LYS 81 N 0.36 1.11 -0.59 0.00 1.57 -1.10 -1.77 116.57 116.15 1wn1 h LYS 81 Ca 0.06 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1wn1 h LYS 81 Cb 0.68 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1wn1 h LYS 81 CO 0.05 0.73 0.13 1.25 -0.57 0.00 0.00 179.45 181.04 1wn1 h LEU 82 N 1.14 0.90 -0.51 2.94 5.85 -0.61 -2.37 115.31 122.65 1wn1 h LEU 82 Ca 0.31 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.84 1wn1 h LEU 82 Cb -0.12 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.63 1wn1 h LEU 82 CO -0.07 0.91 0.25 -0.09 -0.34 0.00 0.00 178.44 179.09 1wn1 h ARG 83 N 0.86 0.47 -0.16 1.25 2.43 -0.33 0.22 114.38 119.11 1wn1 h ARG 83 Ca 0.18 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1wn1 h ARG 83 Cb 0.37 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1wn1 h ARG 83 CO 0.00 0.31 0.06 0.93 -1.51 0.00 0.00 179.97 179.77 1wn1 h GLU 84 N 0.48 0.14 -0.43 0.20 5.08 -1.21 -1.93 114.58 116.91 1wn1 h GLU 84 Ca 0.23 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.64 1wn1 h GLU 84 Cb 0.16 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 1wn1 h GLU 84 CO -0.18 0.10 0.14 0.82 -1.00 0.00 0.00 179.01 178.89 1wn1 h ILE 85 N 0.15 0.84 -0.43 3.13 2.04 -0.88 -0.35 117.51 122.01 1wn1 h ILE 85 Ca 0.07 -0.10 0.07 0.00 1.00 0.00 0.00 64.86 65.89 1wn1 h ILE 85 Cb 0.03 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1wn1 h ILE 85 CO -0.06 0.05 0.29 -0.07 0.00 0.00 0.00 178.15 178.37 1wn1 h LEU 86 N 0.30 0.26 -0.10 1.44 3.38 -0.10 -2.09 115.31 118.40 1wn1 h LEU 86 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1wn1 h LEU 86 Cb 0.21 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1wn1 h LEU 86 CO -0.22 0.17 -0.18 -0.33 0.09 0.00 0.00 178.44 177.96 1wn1 h GLU 87 N 0.29 0.30 -0.84 1.13 5.08 -0.34 0.49 114.58 120.70 1wn1 h GLU 87 Ca 0.19 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1wn1 h GLU 87 Cb 0.39 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 1wn1 h GLU 87 CO -0.04 0.77 0.53 0.93 -1.00 0.00 0.00 179.01 180.21 1wn1 h GLU 88 N -0.15 1.12 0.00 2.33 5.08 -0.92 -0.73 114.58 121.31 1wn1 h GLU 88 Ca 0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1wn1 h GLU 88 Cb 0.76 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1wn1 h GLU 88 CO 0.04 0.76 -0.11 1.28 -1.00 0.00 0.00 179.01 179.97 1wn1 n LEU 89 N -4.39 0.37 -0.86 1.33 4.77 -0.82 -4.94 117.00 112.46 1wn1 n LEU 89 Ca 0.09 0.44 -0.06 0.00 -0.03 0.00 0.00 56.01 56.45 1wn1 n LEU 89 Cb 0.04 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1wn1 n LEU 89 CO 0.37 -0.05 -0.04 0.61 -1.33 0.00 0.00 177.39 176.95 1wn1 n GLY 90 N 1.43 0.22 2.32 -0.72 0.00 -0.25 -4.88 105.19 103.31 1wn1 n GLY 90 Ca 0.06 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 1wn1 n GLY 90 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1wn1 n ILE 91 N -3.81 2.08 0.13 -0.61 -5.35 0.16 -4.78 119.36 107.18 1wn1 n ILE 91 Ca -0.05 -3.80 -0.09 0.00 -0.27 0.00 0.00 62.75 58.54 1wn1 n ILE 91 Cb 0.55 -0.31 0.07 0.00 -1.74 0.00 0.00 39.64 38.21 1wn1 n ILE 91 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1wn1 n SER 92 N -0.65 3.27 0.00 7.28 3.41 -1.19 -4.79 113.62 120.96 1wn1 n SER 92 Ca 0.31 -2.62 0.00 0.00 -0.26 0.00 0.00 58.87 56.30 1wn1 n SER 92 Cb 0.90 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1wn1 n SER 92 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1wn1 n LYS 93 N -0.13 0.00 0.00 4.33 4.81 -1.26 -4.03 118.16 121.88 1wn1 n LYS 93 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.67 1wn1 n LYS 93 Cb 0.95 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.00 1wn1 n LYS 93 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wn1 n GLY 94 N -0.24 0.69 3.63 3.14 0.00 -1.08 -4.98 105.19 106.35 1wn1 n GLY 94 Ca 0.00 -2.26 -0.43 0.00 0.00 0.00 0.00 46.02 43.33 1wn1 n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wn1 s ARG 95 N -0.75 4.02 -0.07 1.61 0.52 -1.26 -1.78 118.95 121.23 1wn1 s ARG 95 Ca 0.00 1.04 0.05 0.00 -0.52 0.00 0.00 55.73 56.30 1wn1 s ARG 95 Cb 0.00 -3.77 -0.01 0.00 0.52 0.00 0.00 34.95 31.69 1wn1 s ARG 95 CO 0.00 -0.97 -0.22 0.42 0.02 0.00 0.00 175.30 174.55 1wn1 s ILE 96 N 3.80 2.26 0.19 1.52 -1.09 0.39 -1.14 121.20 127.14 1wn1 s ILE 96 Ca 0.47 -0.98 -0.27 0.00 -2.23 0.00 0.00 60.65 57.64 1wn1 s ILE 96 Cb -0.12 -1.85 -0.08 0.00 -1.58 0.00 0.00 42.46 38.82 1wn1 s ILE 96 CO 0.18 0.57 0.84 -0.76 -1.23 0.00 0.00 174.94 174.53 1wn1 s LEU 97 N -0.06 4.62 -0.13 2.97 1.43 -0.57 -2.96 118.68 123.97 1wn1 s LEU 97 Ca -0.06 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 54.82 1wn1 s LEU 97 Cb -0.14 -3.41 0.02 0.00 0.03 0.00 0.00 46.19 42.68 1wn1 s LEU 97 CO 0.05 0.19 -0.17 -0.63 0.23 0.00 0.00 176.35 176.02 1wn1 s ILE 98 N -1.16 1.67 -0.04 -0.59 -1.09 0.23 -0.87 121.20 119.35 1wn1 s ILE 98 Ca 0.38 -0.73 -0.38 0.00 -2.23 0.00 0.00 60.65 57.68 1wn1 s ILE 98 Cb -0.24 -1.51 -0.17 0.00 -1.58 0.00 0.00 42.46 38.95 1wn1 s ILE 98 CO 0.28 0.47 1.43 1.21 -1.23 0.00 0.00 174.94 177.11 1wn1 n GLU 99 N 4.29 0.99 -0.36 2.79 4.07 -0.69 -0.27 120.64 131.46 1wn1 n GLU 99 Ca -0.19 0.36 0.10 0.00 -0.06 0.00 0.00 57.16 57.37 1wn1 n GLU 99 Cb 0.51 -1.99 0.28 0.00 -0.06 0.00 0.00 31.44 30.18 1wn1 n GLU 99 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1wn1 h ASP 100 N 5.11 0.86 -0.09 4.31 5.19 -1.93 -2.67 116.42 127.21 1wn1 h ASP 100 Ca -0.48 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 1wn1 h ASP 100 Cb 1.34 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.76 1wn1 h ASP 100 CO 0.82 0.39 0.00 0.35 -3.12 0.00 0.00 179.24 177.68 1wn1 n THR 101 N -4.69 0.10 -1.73 0.35 -2.24 -1.26 -4.96 114.28 99.86 1wn1 n THR 101 Ca 0.21 -0.31 -0.38 0.00 -2.27 0.00 0.00 64.05 61.30 1wn1 n THR 101 Cb 0.46 0.48 0.05 0.00 -2.10 0.00 0.00 70.33 69.21 1wn1 n THR 101 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1wn1 n MET 102 N 0.29 1.49 -2.04 -0.78 0.00 -1.01 -4.93 117.12 110.14 1wn1 n MET 102 Ca 0.18 0.55 -0.38 0.00 0.00 0.00 0.00 57.70 58.05 1wn1 n MET 102 Cb 0.35 -2.52 0.01 0.00 0.00 0.00 0.00 33.22 31.07 1wn1 n MET 102 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1wn1 s ARG 103 N -2.96 3.62 0.22 2.12 0.52 -1.26 -4.93 118.95 116.28 1wn1 s ARG 103 Ca 0.74 2.04 -0.07 0.00 -0.52 0.00 0.00 55.73 57.92 1wn1 s ARG 103 Cb -0.41 -2.46 0.18 0.00 0.52 0.00 0.00 34.95 32.77 1wn1 s ARG 103 CO 0.47 -0.74 1.74 0.00 0.02 0.00 0.00 175.30 176.79 1wn1 h ALA 104 N 2.05 1.00 -0.22 2.13 0.00 -1.99 -2.23 119.26 120.00 1wn1 h ALA 104 Ca -0.50 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.14 1wn1 h ALA 104 Cb 1.26 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1wn1 h ALA 104 CO 0.60 0.65 0.00 0.38 0.00 0.00 0.00 179.25 180.88 1wn1 h ASP 105 N 1.03 0.29 -0.34 0.00 2.03 -1.99 0.42 116.42 117.86 1wn1 h ASP 105 Ca 0.21 -0.04 -0.10 0.00 -0.73 0.00 0.00 57.03 56.38 1wn1 h ASP 105 Cb 0.36 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 38.78 1wn1 h ASP 105 CO 0.00 0.35 -0.18 -0.50 -1.03 0.00 0.00 179.24 177.88 1wn1 h TRP 106 N 0.31 0.84 -0.65 4.15 4.06 -1.79 -1.99 115.95 120.88 1wn1 h TRP 106 Ca 0.07 -0.21 -0.03 0.00 2.06 0.00 0.00 58.89 60.78 1wn1 h TRP 106 Cb 0.21 -0.19 -0.03 0.00 -1.00 0.00 0.00 29.16 28.15 1wn1 h TRP 106 CO 0.00 0.93 0.27 1.25 -3.56 0.00 0.00 178.44 177.34 1wn1 h LEU 107 N 0.50 0.88 -0.47 -4.49 6.46 -0.99 0.27 115.31 117.47 1wn1 h LEU 107 Ca 0.07 -0.16 0.02 0.00 -0.12 0.00 0.00 57.88 57.69 1wn1 h LEU 107 Cb 0.72 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.39 1wn1 h LEU 107 CO 0.05 0.80 0.29 0.40 -0.62 0.00 0.00 178.44 179.37 1wn1 h ILE 108 N 0.91 1.07 -0.70 4.05 2.04 -0.85 0.89 117.51 124.92 1wn1 h ILE 108 Ca 0.22 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 1wn1 h ILE 108 Cb 0.18 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1wn1 h ILE 108 CO -0.02 0.11 0.27 1.23 0.00 0.00 0.00 178.15 179.74 1wn1 h GLY 109 N 0.59 1.13 2.00 5.37 0.00 -0.85 -2.38 103.07 108.93 1wn1 h GLY 109 Ca 0.18 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 1wn1 h GLY 109 CO -0.07 0.58 -0.17 -2.22 0.00 0.00 0.00 176.54 174.66 1wn1 h ILE 110 N 1.00 0.98 0.00 2.60 2.04 0.34 -2.22 117.51 122.26 1wn1 h ILE 110 Ca 0.23 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1wn1 h ILE 110 Cb 0.22 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1wn1 h ILE 110 CO -0.02 0.17 -0.04 0.24 0.00 0.00 0.00 178.15 178.51 1wn1 h MET 111 N 0.00 0.00 0.00 2.37 2.86 -0.30 -2.29 114.93 117.57 1wn1 h MET 111 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1wn1 h MET 111 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1wn1 h MET 111 CO 0.02 0.04 -0.38 1.63 1.06 0.00 0.00 176.91 179.28 1wn1 n LYS 112 N -3.29 0.08 -0.08 1.72 5.02 -0.83 -4.03 118.16 116.74 1wn1 n LYS 112 Ca -0.02 0.03 0.09 0.00 -2.02 0.00 0.00 58.31 56.40 1wn1 n LYS 112 Cb 0.18 -1.56 0.35 0.00 -0.02 0.00 0.00 35.03 33.98 1wn1 n LYS 112 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wn1 n LEU 113 N -1.69 1.39 0.00 -0.35 4.77 -0.86 -4.98 117.00 115.28 1wn1 n LEU 113 Ca 0.05 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1wn1 n LEU 113 Cb 0.37 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1wn1 n LEU 113 CO 0.33 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1wn1 n GLY 114 N 1.05 0.80 3.32 -0.72 0.00 -1.26 -4.88 105.19 103.50 1wn1 n GLY 114 Ca 0.15 -1.14 -0.44 0.00 0.00 0.00 0.00 46.02 44.59 1wn1 n GLY 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wn1 s LYS 115 N -2.00 2.84 0.39 1.61 -2.85 -1.26 -4.84 119.74 113.64 1wn1 s LYS 115 Ca 0.00 -1.54 0.07 0.00 -1.00 0.00 0.00 55.97 53.50 1wn1 s LYS 115 Cb 0.00 -4.09 -0.08 0.00 -2.06 0.00 0.00 37.83 31.60 1wn1 s LYS 115 CO 0.00 -1.14 -0.01 -0.06 0.10 0.00 0.00 175.35 174.25 1wn1 s PHE 116 N 1.55 2.47 -0.11 1.78 0.40 -1.26 -2.65 117.98 120.16 1wn1 s PHE 116 Ca 0.04 -0.66 0.03 0.00 -0.60 0.00 0.00 56.93 55.74 1wn1 s PHE 116 Cb -0.26 -1.68 -0.00 0.00 0.51 0.00 0.00 43.02 41.58 1wn1 s PHE 116 CO 0.04 0.45 -0.21 0.99 0.70 0.00 0.00 175.22 177.19 1wn1 s THR 117 N -2.73 2.37 0.14 0.64 2.01 -0.73 -4.94 115.64 112.39 1wn1 s THR 117 Ca 0.35 -0.91 0.07 0.00 0.31 0.00 0.00 61.69 61.50 1wn1 s THR 117 Cb 0.09 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 1wn1 s THR 117 CO 0.18 0.55 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.28 1wn1 s PHE 118 N 0.34 2.87 -0.06 4.92 2.99 -1.26 -0.47 117.98 127.32 1wn1 s PHE 118 Ca -0.16 -0.11 -0.20 0.00 0.00 0.00 0.00 56.93 56.46 1wn1 s PHE 118 Cb -0.17 -1.43 0.04 0.00 0.00 0.00 0.00 43.02 41.46 1wn1 s PHE 118 CO 0.08 0.49 0.46 -0.65 -0.00 0.00 0.00 175.22 175.60 1wn1 s GLN 119 N -2.65 0.77 0.32 0.44 -0.21 -1.16 -4.98 119.66 112.20 1wn1 s GLN 119 Ca 0.26 0.11 -0.29 0.00 0.02 0.00 0.00 55.36 55.46 1wn1 s GLN 119 Cb -0.10 0.36 -0.10 0.00 1.00 0.00 0.00 33.01 34.16 1wn1 s GLN 119 CO 0.18 -0.21 1.30 -2.14 -2.12 0.00 0.00 175.29 172.30 1wn1 s PRO 120 N -0.99 4.37 0.29 2.91 0.02 -1.26 -0.60 135.00 139.74 1wn1 s PRO 120 Ca -0.10 2.19 -0.01 0.00 0.02 0.00 0.00 61.00 63.10 1wn1 s PRO 120 Cb -0.03 -3.08 0.47 0.00 0.02 0.00 0.00 34.50 31.88 1wn1 s PRO 120 CO 0.05 -0.18 1.91 1.25 -0.33 0.00 0.00 177.00 179.70 1wn1 h LEU 121 N 3.56 0.96 -1.74 -5.54 5.85 -0.95 -2.48 115.31 114.98 1wn1 h LEU 121 Ca -0.48 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.40 1wn1 h LEU 121 Cb 1.22 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1wn1 h LEU 121 CO 0.67 0.63 0.49 0.77 -0.34 0.00 0.00 178.44 180.66 1wn1 h SER 122 N 1.10 0.23 -0.14 1.25 4.64 -1.92 -0.92 113.55 117.79 1wn1 h SER 122 Ca 0.39 0.02 0.04 0.00 -0.47 0.00 0.00 61.79 61.77 1wn1 h SER 122 Cb 0.14 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1wn1 h SER 122 CO -0.14 0.12 0.27 0.77 -0.87 0.00 0.00 176.83 176.97 1wn1 h SER 123 N 0.25 0.00 0.00 4.97 4.64 -1.83 -2.25 113.55 119.32 1wn1 h SER 123 Ca 0.35 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.65 1wn1 h SER 123 Cb 1.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1wn1 h SER 123 CO -0.08 0.00 -1.09 -0.11 -0.87 0.00 0.00 176.83 174.68 1wn1 n LEU 124 N -3.36 2.74 0.17 5.97 0.00 -0.45 -4.73 117.00 117.32 1wn1 n LEU 124 Ca 0.01 -0.01 0.03 0.00 0.00 0.00 0.00 56.01 56.04 1wn1 n LEU 124 Cb 0.37 -0.06 0.41 0.00 0.00 0.00 0.00 43.42 44.14 1wn1 n LEU 124 CO 0.21 0.48 0.84 -0.29 0.00 0.00 0.00 177.39 178.64 1wn1 h ILE 125 N -0.01 1.19 -0.51 1.96 6.09 -1.30 -2.58 117.51 122.36 1wn1 h ILE 125 Ca -0.04 -0.90 0.15 0.00 -1.37 0.00 0.00 64.86 62.71 1wn1 h ILE 125 Cb 1.05 1.39 -0.02 0.00 0.47 0.00 0.00 36.82 39.71 1wn1 h ILE 125 CO -0.01 0.26 0.48 0.07 -3.07 0.00 0.00 178.15 175.89 1wn1 h LYS 126 N 0.10 0.00 -0.18 2.19 2.10 -1.64 0.24 116.57 119.38 1wn1 h LYS 126 Ca 0.02 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.62 1wn1 h LYS 126 Cb 0.45 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.77 1wn1 h LYS 126 CO 0.03 0.00 -0.11 0.93 -2.00 0.00 0.00 179.45 178.30 1wn1 h GLU 127 N 0.00 0.29 0.00 0.07 5.08 -1.72 -1.97 114.58 116.33 1wn1 h GLU 127 Ca 0.24 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.37 1wn1 h GLU 127 Cb 1.20 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 1wn1 h GLU 127 CO -0.00 0.42 -0.97 -0.07 -1.00 0.00 0.00 179.01 177.38 1wn1 h LEU 128 N 0.28 0.00 -2.01 1.33 3.38 -0.72 -3.39 115.31 114.18 1wn1 h LEU 128 Ca 0.06 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1wn1 h LEU 128 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1wn1 h LEU 128 CO 0.02 1.32 0.00 0.03 0.09 0.00 0.00 178.44 179.90 1wn1 h ARG 129 N -1.00 0.00 -0.01 1.13 3.08 -1.34 -2.80 114.38 113.43 1wn1 h ARG 129 Ca -0.26 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.70 1wn1 h ARG 129 Cb 1.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 1wn1 h ARG 129 CO -0.15 0.00 -0.44 0.52 -1.07 0.00 0.00 179.97 178.83 1wn1 h MET 130 N 0.00 0.03 -4.28 0.04 2.86 -1.54 -3.39 114.93 108.65 1wn1 h MET 130 Ca 0.00 -0.01 -0.73 0.00 -2.06 0.00 0.00 59.70 56.89 1wn1 h MET 130 Cb 0.14 -0.00 -0.27 0.00 0.06 0.00 0.00 31.60 31.53 1wn1 h MET 130 CO 0.00 0.46 -0.35 0.42 1.06 0.00 0.00 176.91 178.50 1wn1 s ILE 131 N -4.04 4.62 0.29 -1.22 -1.09 -1.06 -3.65 121.20 115.05 1wn1 s ILE 131 Ca -0.03 -1.52 -0.29 0.00 -2.23 0.00 0.00 60.65 56.58 1wn1 s ILE 131 Cb 0.14 -3.93 -0.09 0.00 -1.58 0.00 0.00 42.46 36.99 1wn1 s ILE 131 CO 0.74 -0.71 1.09 -0.54 -1.23 0.00 0.00 174.94 174.29 1wn1 s LYS 132 N 1.48 4.60 0.82 2.79 3.01 0.10 -4.95 119.74 127.58 1wn1 s LYS 132 Ca 0.04 1.78 -0.08 0.00 -1.01 0.00 0.00 55.97 56.70 1wn1 s LYS 132 Cb -0.26 -3.13 0.14 0.00 -1.01 0.00 0.00 37.83 33.57 1wn1 s LYS 132 CO 0.02 0.18 1.13 0.16 0.51 0.00 0.00 175.35 177.35 1wn1 s ASP 133 N -0.94 3.94 0.24 2.83 3.84 -1.26 -4.68 116.67 120.65 1wn1 s ASP 133 Ca 0.46 0.06 -0.05 0.00 -0.00 0.00 0.00 52.55 53.02 1wn1 s ASP 133 Cb -0.31 -0.36 0.43 0.00 -1.38 0.00 0.00 42.92 41.30 1wn1 s ASP 133 CO 0.40 -2.16 1.75 0.11 -0.00 0.00 0.00 175.17 175.26 1wn1 h LYS 134 N -1.00 0.49 -0.35 2.11 6.56 -2.00 -1.51 116.57 120.88 1wn1 h LYS 134 Ca -0.41 -0.03 -0.14 0.00 -1.06 0.00 0.00 60.65 59.01 1wn1 h LYS 134 Cb 1.26 -0.11 -0.01 0.00 -0.57 0.00 0.00 32.23 32.80 1wn1 h LYS 134 CO 0.44 0.32 -0.33 0.93 -2.06 0.00 0.00 179.45 178.75 1wn1 h GLU 135 N 0.50 0.78 -0.57 3.15 4.39 -1.99 -1.96 114.58 118.88 1wn1 h GLU 135 Ca 0.40 -0.37 -0.04 0.00 0.34 0.00 0.00 59.36 59.70 1wn1 h GLU 135 Cb 0.56 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 1wn1 h GLU 135 CO -0.36 0.99 0.22 0.93 -1.16 0.00 0.00 179.01 179.63 1wn1 h GLU 136 N 0.66 0.86 -0.75 2.33 5.08 -1.77 -0.63 114.58 120.36 1wn1 h GLU 136 Ca 0.07 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1wn1 h GLU 136 Cb 0.87 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1wn1 h GLU 136 CO 0.08 0.75 0.37 0.28 -1.00 0.00 0.00 179.01 179.49 1wn1 h VAL 137 N 0.79 1.24 -0.30 3.13 2.07 -1.14 -0.52 116.25 121.53 1wn1 h VAL 137 Ca 0.19 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1wn1 h VAL 137 Cb 0.22 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1wn1 h VAL 137 CO -0.01 0.28 0.17 0.11 0.02 0.00 0.00 177.57 178.14 1wn1 h LYS 138 N 1.04 0.34 -0.61 1.57 1.57 -0.89 0.17 116.57 119.77 1wn1 h LYS 138 Ca 0.26 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1wn1 h LYS 138 Cb 0.10 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 1wn1 h LYS 138 CO -0.03 0.23 0.39 0.52 -0.57 0.00 0.00 179.45 179.98 1wn1 h MET 139 N 0.35 0.75 -0.07 3.15 2.86 -0.77 -1.58 114.93 119.63 1wn1 h MET 139 Ca 0.12 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.62 1wn1 h MET 139 Cb -0.00 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 1wn1 h MET 139 CO -0.05 0.50 -0.39 0.52 1.06 0.00 0.00 176.91 178.55 1wn1 h MET 140 N 0.77 0.14 -0.41 1.72 2.86 -0.56 -2.14 114.93 117.31 1wn1 h MET 140 Ca 0.24 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.83 1wn1 h MET 140 Cb -0.03 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 1wn1 h MET 140 CO -0.08 0.51 0.26 0.93 1.06 0.00 0.00 176.91 179.59 1wn1 h GLU 141 N 0.12 0.51 -0.27 1.72 5.08 0.16 -0.09 114.58 121.81 1wn1 h GLU 141 Ca 0.01 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 1wn1 h GLU 141 Cb 0.74 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1wn1 h GLU 141 CO 0.06 0.34 -0.35 1.25 -1.00 0.00 0.00 179.01 179.31 1wn1 h HIS 142 N 0.53 0.69 -0.60 4.33 2.76 -0.98 0.01 115.15 121.89 1wn1 h HIS 142 Ca 0.15 -0.18 -0.05 0.00 -2.20 0.00 0.00 60.37 58.09 1wn1 h HIS 142 Cb -0.04 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 28.74 1wn1 h HIS 142 CO -0.06 0.86 0.19 0.00 -1.30 0.00 0.00 177.93 177.62 1wn1 h ALA 143 N 1.12 1.21 -0.10 5.26 0.00 -0.93 0.29 119.26 126.10 1wn1 h ALA 143 Ca 0.05 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 1wn1 h ALA 143 Cb 0.84 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1wn1 h ALA 143 CO 0.07 0.56 -0.69 0.77 0.00 0.00 0.00 179.25 179.96 1wn1 h SER 144 N 0.87 0.52 -0.74 0.00 0.02 -0.71 -2.23 113.55 111.28 1wn1 h SER 144 Ca 0.20 -0.32 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1wn1 h SER 144 Cb 0.25 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1wn1 h SER 144 CO -0.01 1.05 0.42 -0.09 -1.14 0.00 0.00 176.83 177.07 1wn1 h ARG 145 N 0.31 1.02 -0.16 3.45 2.43 -0.30 -0.82 114.38 120.31 1wn1 h ARG 145 Ca -0.02 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 58.93 1wn1 h ARG 145 Cb 1.25 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 1wn1 h ARG 145 CO 0.12 0.74 -0.37 0.82 -1.51 0.00 0.00 179.97 179.77 1wn1 h ILE 146 N 1.01 1.30 -0.45 1.20 2.04 -0.80 -1.30 117.51 120.51 1wn1 h ILE 146 Ca 0.26 -1.47 -0.11 0.00 1.00 0.00 0.00 64.86 64.55 1wn1 h ILE 146 Cb 0.01 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1wn1 h ILE 146 CO -0.05 0.45 -0.17 0.00 0.00 0.00 0.00 178.15 178.39 1wn1 h ALA 147 N 1.31 0.86 -0.15 1.87 0.00 -0.82 0.44 119.26 122.78 1wn1 h ALA 147 Ca 0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1wn1 h ALA 147 Cb 0.80 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1wn1 h ALA 147 CO 0.06 0.64 0.05 -0.44 0.00 0.00 0.00 179.25 179.56 1wn1 h ASP 148 N 0.76 0.21 -0.39 0.00 3.45 -0.89 -2.38 116.42 117.17 1wn1 h ASP 148 Ca 0.11 -0.19 0.01 0.00 0.43 0.00 0.00 57.03 57.39 1wn1 h ASP 148 Cb 0.69 -0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 39.38 1wn1 h ASP 148 CO 0.05 0.34 0.25 0.50 -1.57 0.00 0.00 179.24 178.81 1wn1 h LYS 149 N 0.07 0.50 -0.93 3.56 3.64 -0.91 -2.23 116.57 120.27 1wn1 h LYS 149 Ca 0.05 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.47 1wn1 h LYS 149 Cb 0.20 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 31.84 1wn1 h LYS 149 CO -0.00 0.33 0.58 0.28 -2.27 0.00 0.00 179.45 178.37 1wn1 h VAL 150 N 0.52 1.02 -0.15 2.00 2.07 -0.82 -1.60 116.25 119.29 1wn1 h VAL 150 Ca 0.15 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1wn1 h VAL 150 Cb -0.05 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.61 1wn1 h VAL 150 CO -0.04 0.19 0.05 0.15 0.02 0.00 0.00 177.57 177.94 1wn1 h PHE 151 N 1.03 0.10 -0.96 1.57 3.57 -0.88 -1.14 116.94 120.21 1wn1 h PHE 151 Ca 0.42 0.01 0.12 0.00 3.53 0.00 0.00 57.97 62.04 1wn1 h PHE 151 Cb 0.24 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.88 1wn1 h PHE 151 CO -0.02 0.05 0.61 0.93 -2.23 0.00 0.00 178.31 177.65 1wn1 h GLU 152 N 0.13 0.90 -0.28 1.11 5.08 -0.81 -1.99 114.58 118.72 1wn1 h GLU 152 Ca 0.06 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 1wn1 h GLU 152 Cb 0.04 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.08 1wn1 h GLU 152 CO -0.06 0.60 -0.25 1.49 -1.00 0.00 0.00 179.01 179.78 1wn1 h GLU 153 N 0.93 0.66 -0.85 2.33 4.57 -0.89 -3.06 114.58 118.28 1wn1 h GLU 153 Ca 0.47 -0.34 0.12 0.00 -1.18 0.00 0.00 59.36 58.43 1wn1 h GLU 153 Cb 0.50 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.04 1wn1 h GLU 153 CO -0.23 0.95 0.55 0.82 -1.18 0.00 0.00 179.01 179.91 1wn1 h ILE 154 N 0.40 0.90 0.00 2.32 2.04 -0.50 0.04 117.51 122.71 1wn1 h ILE 154 Ca 0.05 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1wn1 h ILE 154 Cb 0.81 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1wn1 h ILE 154 CO 0.06 0.13 0.00 0.18 0.00 0.00 0.00 178.15 178.53 1wn1 n LEU 155 N -4.53 0.39 -0.60 1.44 4.77 -0.94 -1.86 117.00 115.67 1wn1 n LEU 155 Ca 0.15 0.60 0.13 0.00 -0.03 0.00 0.00 56.01 56.86 1wn1 n LEU 155 Cb 0.39 -0.55 0.37 0.00 -2.33 0.00 0.00 43.42 41.29 1wn1 n LEU 155 CO 0.31 -0.44 0.76 0.35 -1.33 0.00 0.00 177.39 177.03 1wn1 n THR 156 N -1.94 0.00 -2.94 -5.08 -2.24 -0.00 -4.92 114.28 97.16 1wn1 n THR 156 Ca 0.03 -0.31 -0.25 0.00 -2.27 0.00 0.00 64.05 61.24 1wn1 n THR 156 Cb 0.20 0.81 -0.00 0.00 -2.10 0.00 0.00 70.33 69.24 1wn1 n THR 156 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1wn1 s TRP 157 N -2.06 3.48 -0.55 4.78 0.51 -0.78 -5.05 118.94 119.27 1wn1 s TRP 157 Ca 0.33 0.56 -0.16 0.00 -2.12 0.00 0.00 56.10 54.71 1wn1 s TRP 157 Cb 0.20 -2.18 0.13 0.00 -0.81 0.00 0.00 33.47 30.82 1wn1 s TRP 157 CO 0.35 -0.17 0.53 0.34 -0.51 0.00 0.00 176.95 177.49 1wn1 s ASP 158 N -4.11 6.21 0.13 2.95 3.68 -1.26 -4.94 116.67 119.32 1wn1 s ASP 158 Ca 0.45 -1.79 -0.07 0.00 2.13 0.00 0.00 52.55 53.27 1wn1 s ASP 158 Cb -0.10 -2.22 -0.09 0.00 -1.45 0.00 0.00 42.92 39.06 1wn1 s ASP 158 CO 0.41 -0.87 1.32 -0.07 0.13 0.00 0.00 175.17 176.08 1wn1 h LEU 159 N 8.95 0.66 -9.10 -1.34 4.07 -1.96 -3.45 115.31 113.14 1wn1 h LEU 159 Ca -0.29 -0.49 -0.76 0.00 0.08 0.00 0.00 57.88 56.43 1wn1 h LEU 159 Cb 1.10 -0.20 0.05 0.00 1.08 0.00 0.00 40.66 42.68 1wn1 h LEU 159 CO 1.04 1.27 0.28 -0.38 -1.08 0.00 0.00 178.44 179.57 1wn1 n ILE 160 N -3.82 0.02 0.00 1.22 2.08 -1.26 -0.04 119.36 117.55 1wn1 n ILE 160 Ca -0.07 -0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.24 1wn1 n ILE 160 Cb 0.79 -0.38 0.00 0.00 -0.75 0.00 0.00 39.64 39.30 1wn1 n ILE 160 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1wn1 n GLY 161 N 2.17 3.26 3.77 7.39 0.00 -0.67 -5.01 105.19 116.10 1wn1 n GLY 161 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1wn1 n GLY 161 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1wn1 s MET 162 N -0.55 4.13 -0.03 1.61 0.00 0.94 -4.66 119.30 120.73 1wn1 s MET 162 Ca 0.00 1.69 -0.05 0.00 0.00 0.00 0.00 55.69 57.33 1wn1 s MET 162 Cb 0.00 -2.65 -0.04 0.00 0.00 0.00 0.00 34.83 32.14 1wn1 s MET 162 CO 0.00 -0.22 0.20 0.15 0.00 0.00 0.00 175.02 175.15 1wn1 s LYS 163 N -2.33 3.49 0.23 4.11 1.02 -1.26 -0.09 119.74 124.91 1wn1 s LYS 163 Ca 0.57 -0.19 -0.17 0.00 0.02 0.00 0.00 55.97 56.20 1wn1 s LYS 163 Cb -0.27 -3.12 0.25 0.00 -0.52 0.00 0.00 37.83 34.17 1wn1 s LYS 163 CO 0.34 0.69 1.54 0.39 -0.92 0.00 0.00 175.35 177.39 1wn1 n GLU 164 N 1.27 -0.23 -0.27 1.68 1.02 -0.85 0.11 120.64 123.37 1wn1 n GLU 164 Ca -0.13 1.53 0.08 0.00 -0.02 0.00 0.00 57.16 58.62 1wn1 n GLU 164 Cb 0.53 -2.26 0.32 0.00 -0.02 0.00 0.00 31.44 30.01 1wn1 n GLU 164 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1wn1 h ARG 165 N 0.00 0.80 -0.20 3.49 2.43 -1.17 -0.44 114.38 119.30 1wn1 h ARG 165 Ca 0.35 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.43 1wn1 h ARG 165 Cb 0.60 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1wn1 h ARG 165 CO -0.98 0.53 -0.06 0.93 -1.51 0.00 0.00 179.97 178.88 1wn1 h GLU 166 N 0.83 0.38 -0.61 0.20 5.08 0.55 -1.48 114.58 119.53 1wn1 h GLU 166 Ca 0.41 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.59 1wn1 h GLU 166 Cb 0.47 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1wn1 h GLU 166 CO -0.18 0.65 0.25 1.25 -1.00 0.00 0.00 179.01 179.98 1wn1 h LEU 167 N 0.10 0.84 -0.88 1.33 5.85 -0.54 -1.87 115.31 120.13 1wn1 h LEU 167 Ca 0.05 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1wn1 h LEU 167 Cb 0.51 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1wn1 h LEU 167 CO 0.02 0.77 0.57 0.00 -0.34 0.00 0.00 178.44 179.46 1wn1 h ALA 168 N 1.10 1.12 -0.36 1.25 0.00 -1.03 -0.94 119.26 120.40 1wn1 h ALA 168 Ca 0.21 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1wn1 h ALA 168 Cb 0.19 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1wn1 h ALA 168 CO -0.02 0.55 -0.16 1.25 0.00 0.00 0.00 179.25 180.87 1wn1 h LEU 169 N 1.21 0.66 -0.18 0.00 5.85 -0.86 0.36 115.31 122.35 1wn1 h LEU 169 Ca 0.32 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 1wn1 h LEU 169 Cb -0.10 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1wn1 h LEU 169 CO -0.07 0.83 0.02 0.11 -0.34 0.00 0.00 178.44 178.99 1wn1 h LYS 170 N 0.59 0.30 -0.46 1.25 1.57 -0.77 0.22 116.57 119.28 1wn1 h LYS 170 Ca 0.10 -0.09 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1wn1 h LYS 170 Cb 0.62 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 1wn1 h LYS 170 CO 0.04 0.48 0.16 0.82 -0.57 0.00 0.00 179.45 180.38 1wn1 h ILE 171 N 0.07 0.84 -0.23 1.86 2.04 -0.98 -0.97 117.51 120.15 1wn1 h ILE 171 Ca 0.05 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.82 1wn1 h ILE 171 Cb 0.34 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1wn1 h ILE 171 CO 0.01 0.06 0.10 -0.08 0.00 0.00 0.00 178.15 178.24 1wn1 h GLU 172 N 0.32 0.22 -0.72 2.37 4.81 -0.65 -0.58 114.58 120.36 1wn1 h GLU 172 Ca 0.22 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 1wn1 h GLU 172 Cb 0.22 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1wn1 h GLU 172 CO -0.23 0.14 0.29 -0.07 -0.73 0.00 0.00 179.01 178.42 1wn1 h LEU 173 N 0.22 0.96 -0.31 1.64 -0.00 -0.52 -0.82 115.31 116.50 1wn1 h LEU 173 Ca 0.10 -0.14 -0.01 0.00 -0.00 0.00 0.00 57.88 57.83 1wn1 h LEU 173 Cb 0.04 -0.25 -0.01 0.00 -0.00 0.00 0.00 40.66 40.44 1wn1 h LEU 173 CO -0.08 0.85 0.13 0.25 -0.00 0.00 0.00 178.44 179.60 1wn1 h LEU 174 N 1.03 0.41 -0.72 1.67 5.85 -0.81 -0.16 115.31 122.58 1wn1 h LEU 174 Ca 0.24 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.83 1wn1 h LEU 174 Cb 0.19 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1wn1 h LEU 174 CO -0.02 0.45 0.47 0.40 -0.34 0.00 0.00 178.44 179.39 1wn1 h ILE 175 N 0.35 1.16 0.00 4.05 2.04 -0.67 0.11 117.51 124.55 1wn1 h ILE 175 Ca 0.10 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 1wn1 h ILE 175 Cb 0.15 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 1wn1 h ILE 175 CO -0.01 0.17 -0.19 0.03 0.00 0.00 0.00 178.15 178.15 1wn1 h ARG 176 N 0.95 0.00 0.08 2.37 3.08 -0.85 0.28 114.38 120.29 1wn1 h ARG 176 Ca 0.27 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 1wn1 h ARG 176 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1wn1 h ARG 176 CO -0.07 0.19 -0.04 0.93 -1.07 0.00 0.00 179.97 179.91 1wn1 h GLU 177 N 0.00 -0.10 0.00 0.04 5.08 0.71 -3.36 114.58 116.95 1wn1 h GLU 177 Ca -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1wn1 h GLU 177 Cb 0.46 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1wn1 h GLU 177 CO 0.02 0.45 0.00 -0.07 -1.00 0.00 0.00 179.01 178.41 1wn1 h LEU 178 N -0.84 0.00 0.00 1.33 4.07 -0.69 -3.48 115.31 115.70 1wn1 h LEU 178 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1wn1 h LEU 178 Cb 0.60 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.34 1wn1 h LEU 178 CO 0.02 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 175.84 1wn1 n SER 179 N -2.77 0.28 0.08 -0.43 3.41 0.07 -5.02 113.62 109.23 1wn1 n SER 179 Ca 0.03 -0.62 0.13 0.00 -0.26 0.00 0.00 58.87 58.15 1wn1 n SER 179 Cb 0.42 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.83 1wn1 n SER 179 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1wn1 n ASP 180 N -1.69 0.55 0.00 4.04 10.43 -0.24 -4.71 116.55 124.93 1wn1 n ASP 180 Ca 0.00 0.57 0.00 0.00 2.57 0.00 0.00 54.79 57.93 1wn1 n ASP 180 Cb 0.00 -0.71 0.00 0.00 1.84 0.00 0.00 41.12 42.25 1wn1 n ASP 180 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1wn1 n GLY 181 N 1.11 2.76 3.76 0.44 0.00 -1.24 -4.94 105.19 107.09 1wn1 n GLY 181 Ca 0.05 -1.51 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 1wn1 n GLY 181 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wn1 s ILE 182 N -1.99 3.26 -0.42 -0.61 -4.36 -1.26 -0.44 121.20 115.38 1wn1 s ILE 182 Ca 0.00 1.22 0.26 0.00 -0.26 0.00 0.00 60.65 61.87 1wn1 s ILE 182 Cb 0.00 -3.76 0.32 0.00 1.25 0.00 0.00 42.46 40.28 1wn1 s ILE 182 CO 0.00 0.25 1.74 0.00 0.24 0.00 0.00 174.94 177.18 1wn1 h ALA 183 N 3.46 1.00 -1.33 2.27 0.00 -1.34 -3.44 119.26 119.88 1wn1 h ALA 183 Ca -0.48 0.00 0.33 0.00 0.00 0.00 0.00 54.91 54.76 1wn1 h ALA 183 Cb 1.22 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.86 1wn1 h ALA 183 CO 0.66 0.00 0.87 -0.59 0.00 0.00 0.00 179.25 180.19 1wn1 s PHE 184 N -3.28 -0.05 0.04 0.00 -0.12 -1.26 -4.82 117.98 108.49 1wn1 s PHE 184 Ca 0.06 -0.01 -0.30 0.00 -0.05 0.00 0.00 56.93 56.63 1wn1 s PHE 184 Cb 0.08 0.53 -0.09 0.00 -0.63 0.00 0.00 43.02 42.91 1wn1 s PHE 184 CO 0.59 -0.18 1.97 0.39 -0.05 0.00 0.00 175.22 177.93 1wn1 n GLU 185 N -0.36 2.86 -1.15 1.99 1.02 -1.26 -4.67 120.64 119.07 1wn1 n GLU 185 Ca -0.06 1.05 -0.35 0.00 -0.02 0.00 0.00 57.16 57.79 1wn1 n GLU 185 Cb 0.61 -3.00 0.09 0.00 -0.02 0.00 0.00 31.44 29.13 1wn1 n GLU 185 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1wn1 n PRO 186 N 7.39 0.19 -4.20 3.49 -0.02 -1.26 -4.94 135.00 135.64 1wn1 n PRO 186 Ca 0.20 0.12 -0.28 0.00 -2.02 0.00 0.00 63.50 61.52 1wn1 n PRO 186 Cb 0.40 -2.00 -0.17 0.00 -0.02 0.00 0.00 33.50 31.72 1wn1 n PRO 186 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1wn1 s ILE 187 N -2.03 1.28 -0.17 4.25 1.01 0.80 -4.82 121.20 121.52 1wn1 s ILE 187 Ca 0.66 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.83 1wn1 s ILE 187 Cb -0.31 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 40.96 1wn1 s ILE 187 CO 0.57 0.40 -0.17 -0.69 0.00 0.00 0.00 174.94 175.06 1wn1 s VAL 188 N 1.28 1.88 -0.18 2.92 1.01 -1.26 -1.39 120.40 124.65 1wn1 s VAL 188 Ca -0.02 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 1wn1 s VAL 188 Cb -0.14 -1.73 0.04 0.00 0.00 0.00 0.00 36.38 34.55 1wn1 s VAL 188 CO -0.05 0.48 -0.06 0.00 0.00 0.00 0.00 175.10 175.47 1wn1 s ALA 189 N 1.36 1.59 0.18 5.51 0.00 -0.92 -4.26 121.76 125.22 1wn1 s ALA 189 Ca 0.04 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.16 1wn1 s ALA 189 Cb -0.13 -1.17 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 1wn1 s ALA 189 CO -0.12 -0.81 -0.05 -1.54 0.00 0.00 0.00 175.76 173.24 1wn1 s SER 190 N 1.58 4.49 0.60 0.00 1.04 -1.26 -1.26 113.70 118.89 1wn1 s SER 190 Ca 0.00 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1wn1 s SER 190 Cb -0.16 -0.85 0.00 0.00 0.10 0.00 0.00 66.02 65.11 1wn1 s SER 190 CO -0.08 0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.85 1wn1 n GLY 191 N -0.07 2.08 0.34 7.32 0.00 -0.54 -1.21 105.19 113.11 1wn1 n GLY 191 Ca -0.10 -0.38 0.18 0.00 0.00 0.00 0.00 46.02 45.72 1wn1 n GLY 191 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1wn1 h GLU 192 N 0.00 0.00 0.00 1.61 9.09 -1.87 -0.59 114.58 122.82 1wn1 h GLU 192 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 1wn1 h GLU 192 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1wn1 h GLU 192 CO 0.00 0.00 -0.04 -0.91 0.05 0.00 0.00 179.01 178.11 1wn1 h ASN 193 N 0.00 0.00 0.38 3.06 -0.26 -1.51 -1.99 115.58 115.27 1wn1 h ASN 193 Ca 0.05 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1wn1 h ASN 193 Cb 0.56 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.82 1wn1 h ASN 193 CO -0.00 0.04 0.00 0.00 -1.06 0.00 0.00 177.43 176.41 1wn1 n ALA 194 N -2.13 1.74 0.42 -0.83 0.00 -0.23 -2.01 120.51 117.47 1wn1 n ALA 194 Ca -0.01 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1wn1 n ALA 194 Cb 0.24 -1.23 0.43 0.00 0.00 0.00 0.00 19.45 18.88 1wn1 n ALA 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wn1 h ALA 195 N 2.59 1.00 -2.25 0.00 0.00 -1.45 -3.17 119.26 115.98 1wn1 h ALA 195 Ca 0.00 0.00 -0.75 0.00 0.00 0.00 0.00 54.91 54.16 1wn1 h ALA 195 Cb 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 17.79 17.74 1wn1 h ALA 195 CO 0.00 0.00 -0.29 1.21 0.00 0.00 0.00 179.25 180.17 1wn1 s ASN 196 N -4.99 6.11 0.54 0.00 3.04 -0.85 -4.65 114.94 114.15 1wn1 s ASN 196 Ca 0.06 -1.59 0.30 0.00 0.04 0.00 0.00 52.86 51.67 1wn1 s ASN 196 Cb 0.09 -2.17 1.47 0.00 -1.54 0.00 0.00 41.25 39.09 1wn1 s ASN 196 CO 0.55 -0.74 1.91 1.55 -3.04 0.00 0.00 177.10 177.32 1wn1 h PRO 197 N 8.78 0.00 -0.68 0.43 0.13 -1.86 0.31 132.00 139.11 1wn1 h PRO 197 Ca -0.28 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.50 1wn1 h PRO 197 Cb 1.10 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.03 1wn1 h PRO 197 CO 0.95 0.00 0.29 0.72 -0.23 0.00 0.00 178.00 179.73 1wn1 n HIS 198 N -4.21 2.10 -1.70 1.56 8.25 -1.26 -5.03 115.22 114.93 1wn1 n HIS 198 Ca 0.16 -1.70 -0.40 0.00 -0.26 0.00 0.00 57.72 55.51 1wn1 n HIS 198 Cb 0.86 -0.72 0.02 0.00 1.12 0.00 0.00 29.99 31.27 1wn1 n HIS 198 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1wn1 n HIS 199 N -1.09 2.09 -3.80 4.41 -0.00 0.09 -4.99 115.22 111.93 1wn1 n HIS 199 Ca 0.46 0.48 -0.36 0.00 0.46 0.00 0.00 57.72 58.76 1wn1 n HIS 199 Cb 1.36 -2.36 -0.13 0.00 -0.12 0.00 0.00 29.99 28.74 1wn1 n HIS 199 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 1wn1 s GLU 200 N -2.34 3.26 0.12 1.57 2.12 -1.26 -4.88 118.70 117.29 1wn1 s GLU 200 Ca 0.63 -0.73 -0.33 0.00 0.36 0.00 0.00 54.97 54.90 1wn1 s GLU 200 Cb -0.49 -3.26 -0.18 0.00 0.26 0.00 0.00 34.13 30.46 1wn1 s GLU 200 CO 0.56 -0.33 0.80 -2.30 -0.54 0.00 0.00 175.26 173.45 1wn1 n PRO 201 N 4.85 0.11 0.00 4.30 -0.02 -1.26 -4.94 135.00 138.04 1wn1 n PRO 201 Ca -0.16 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1wn1 n PRO 201 Cb 0.49 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 1wn1 n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wn1 n GLY 202 N 1.79 5.44 0.02 -1.23 0.00 -1.26 -4.65 105.19 105.30 1wn1 n GLY 202 Ca 0.18 -1.19 0.13 0.00 0.00 0.00 0.00 46.02 45.14 1wn1 n GLY 202 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wn1 n GLU 203 N 0.00 0.08 -1.59 1.61 -0.58 -1.26 -0.68 120.64 118.22 1wn1 n GLU 203 Ca 0.00 0.03 -0.47 0.00 -0.42 0.00 0.00 57.16 56.30 1wn1 n GLU 203 Cb 0.00 -1.56 -0.03 0.00 -0.57 0.00 0.00 31.44 29.28 1wn1 n GLU 203 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1wn1 n ARG 204 N -1.68 1.32 -3.25 3.49 0.63 -1.26 -4.68 116.66 111.23 1wn1 n ARG 204 Ca 0.05 0.47 -0.38 0.00 -0.92 0.00 0.00 57.85 57.07 1wn1 n ARG 204 Cb 0.37 -1.96 -0.06 0.00 0.45 0.00 0.00 32.46 31.26 1wn1 n ARG 204 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 1wn1 s LYS 205 N -0.64 4.31 -0.01 -0.14 2.20 -1.26 -2.01 119.74 122.19 1wn1 s LYS 205 Ca 0.69 0.62 -0.30 0.00 -0.36 0.00 0.00 55.97 56.62 1wn1 s LYS 205 Cb -0.79 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.10 1wn1 s LYS 205 CO 0.54 0.27 1.27 0.42 -0.36 0.00 0.00 175.35 177.49 1wn1 s ILE 206 N 0.18 4.00 0.33 5.43 1.01 0.88 -4.94 121.20 128.08 1wn1 s ILE 206 Ca 0.29 1.38 0.09 0.00 0.00 0.00 0.00 60.65 62.41 1wn1 s ILE 206 Cb -0.17 -3.88 -0.06 0.00 0.01 0.00 0.00 42.46 38.35 1wn1 s ILE 206 CO 0.14 0.02 -0.09 -0.13 0.00 0.00 0.00 174.94 174.89 1wn1 s ARG 207 N 1.99 1.74 0.45 2.79 0.52 -1.26 -1.67 118.95 123.51 1wn1 s ARG 207 Ca 0.59 -1.89 -0.25 0.00 -0.52 0.00 0.00 55.73 53.65 1wn1 s ARG 207 Cb -0.28 -1.55 -0.09 0.00 0.52 0.00 0.00 34.95 33.55 1wn1 s ARG 207 CO 0.25 0.11 1.42 1.17 0.02 0.00 0.00 175.30 178.28 1wn1 n LYS 208 N -0.73 2.24 0.00 3.54 4.81 -1.26 -2.02 118.16 124.73 1wn1 n LYS 208 Ca -0.05 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1wn1 n LYS 208 Cb 0.63 -2.61 0.00 0.00 0.02 0.00 0.00 35.03 33.07 1wn1 n LYS 208 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wn1 n GLY 209 N 0.60 1.41 3.77 3.14 0.00 0.14 -5.01 105.19 109.24 1wn1 n GLY 209 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1wn1 n GLY 209 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wn1 s ASP 210 N -2.40 7.45 0.21 1.61 1.11 -0.86 -4.44 116.67 119.36 1wn1 s ASP 210 Ca 0.00 1.77 -0.10 0.00 0.18 0.00 0.00 52.55 54.39 1wn1 s ASP 210 Cb 0.00 -2.54 -0.07 0.00 1.07 0.00 0.00 42.92 41.37 1wn1 s ASP 210 CO 0.00 0.14 0.54 -0.51 1.18 0.00 0.00 175.17 176.52 1wn1 s ILE 211 N -1.26 4.93 -0.03 0.77 2.07 -1.26 -1.74 121.20 124.67 1wn1 s ILE 211 Ca 0.40 0.52 -0.00 0.00 -1.41 0.00 0.00 60.65 60.16 1wn1 s ILE 211 Cb -0.23 -3.63 0.03 0.00 0.13 0.00 0.00 42.46 38.75 1wn1 s ILE 211 CO 0.28 -0.01 0.01 -0.63 -1.91 0.00 0.00 174.94 172.67 1wn1 s ILE 212 N -1.75 0.13 -0.20 2.00 1.01 0.79 -1.47 121.20 121.72 1wn1 s ILE 212 Ca 0.46 0.14 -0.12 0.00 0.00 0.00 0.00 60.65 61.13 1wn1 s ILE 212 Cb -0.12 -0.26 -0.05 0.00 0.01 0.00 0.00 42.46 42.05 1wn1 s ILE 212 CO 0.21 0.15 0.21 -0.63 0.00 0.00 0.00 174.94 174.87 1wn1 s ILE 213 N 1.22 5.35 -0.21 2.92 1.01 -0.39 -0.98 121.20 130.12 1wn1 s ILE 213 Ca -0.07 0.34 -0.00 0.00 0.00 0.00 0.00 60.65 60.92 1wn1 s ILE 213 Cb -0.13 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.81 1wn1 s ILE 213 CO -0.02 0.39 -0.14 -0.76 0.00 0.00 0.00 174.94 174.41 1wn1 s LEU 214 N 0.60 2.62 -0.14 2.97 1.43 0.42 -2.16 118.68 124.42 1wn1 s LEU 214 Ca 0.11 -0.74 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1wn1 s LEU 214 Cb -0.12 -1.57 0.04 0.00 0.03 0.00 0.00 46.19 44.57 1wn1 s LEU 214 CO 0.02 -0.05 -0.04 -0.62 0.23 0.00 0.00 176.35 175.89 1wn1 s ASP 215 N 1.31 2.52 0.24 2.29 -1.08 -0.49 -1.23 116.67 120.22 1wn1 s ASP 215 Ca 0.03 -0.52 -0.19 0.00 -0.52 0.00 0.00 52.55 51.34 1wn1 s ASP 215 Cb -0.15 -0.79 0.02 0.00 -1.46 0.00 0.00 42.92 40.55 1wn1 s ASP 215 CO -0.09 -0.19 0.61 -0.72 0.52 0.00 0.00 175.17 175.31 1wn1 s TYR 216 N 1.73 -0.13 0.04 -5.34 -0.85 -0.95 -0.14 117.35 111.70 1wn1 s TYR 216 Ca 0.02 -0.25 -0.12 0.00 -0.52 0.00 0.00 57.07 56.20 1wn1 s TYR 216 Cb -0.14 0.52 0.01 0.00 0.38 0.00 0.00 41.96 42.73 1wn1 s TYR 216 CO -0.07 -1.06 0.26 0.20 -1.52 0.00 0.00 175.55 173.36 1wn1 s GLY 217 N -2.90 -0.07 0.41 5.49 0.00 -1.26 -1.25 107.32 107.74 1wn1 s GLY 217 Ca 0.11 -0.06 0.07 0.00 0.00 0.00 0.00 44.72 44.84 1wn1 s GLY 217 CO 0.02 -0.26 0.16 0.00 0.00 0.00 0.00 173.10 173.02 1wn1 s ALA 218 N -2.40 3.54 -0.06 3.20 0.00 -1.22 -1.17 121.76 123.64 1wn1 s ALA 218 Ca -0.06 -2.11 0.03 0.00 0.00 0.00 0.00 51.96 49.82 1wn1 s ALA 218 Cb -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1wn1 s ALA 218 CO -0.03 -0.15 -0.16 1.03 0.00 0.00 0.00 175.76 176.46 1wn1 s ARG 219 N -3.88 1.88 -0.20 0.00 0.52 0.42 -1.75 118.95 115.94 1wn1 s ARG 219 Ca 0.40 -0.55 -0.01 0.00 -0.52 0.00 0.00 55.73 55.05 1wn1 s ARG 219 Cb 0.04 -1.56 0.06 0.00 0.52 0.00 0.00 34.95 34.00 1wn1 s ARG 219 CO 0.22 0.14 -0.01 -0.46 0.02 0.00 0.00 175.30 175.21 1wn1 s TRP 220 N 0.35 1.55 -1.39 -0.53 -0.11 0.86 -1.08 118.94 118.59 1wn1 s TRP 220 Ca -0.10 -1.14 -0.03 0.00 1.22 0.00 0.00 56.10 56.04 1wn1 s TRP 220 Cb -0.14 -1.24 0.02 0.00 -1.50 0.00 0.00 33.47 30.61 1wn1 s TRP 220 CO 0.04 -0.65 0.25 1.63 -4.62 0.00 0.00 176.95 173.60 1wn1 n LYS 221 N 4.91 -3.03 0.00 5.86 4.76 -1.26 -0.90 118.16 128.50 1wn1 n LYS 221 Ca -0.10 0.75 0.00 0.00 -2.87 0.00 0.00 58.31 56.08 1wn1 n LYS 221 Cb 0.46 -5.45 0.00 0.00 -1.84 0.00 0.00 35.03 28.20 1wn1 n LYS 221 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wn1 n GLY 222 N -1.11 3.34 3.80 0.72 0.00 -1.26 -5.06 105.19 105.62 1wn1 n GLY 222 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 1wn1 n GLY 222 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wn1 s TYR 223 N -2.78 3.79 0.18 1.61 1.51 -0.08 -4.41 117.35 117.17 1wn1 s TYR 223 Ca 0.00 1.25 0.04 0.00 -1.01 0.00 0.00 57.07 57.35 1wn1 s TYR 223 Cb 0.00 -2.50 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1wn1 s TYR 223 CO 0.00 0.56 0.28 0.00 -1.11 0.00 0.00 175.55 175.27 1wn1 s SER 225 N -3.43 2.82 -0.27 0.00 1.04 -0.72 -4.65 113.70 108.50 1wn1 s SER 225 Ca 0.34 -0.97 -0.00 0.00 0.48 0.00 0.00 55.95 55.79 1wn1 s SER 225 Cb -0.10 -0.18 0.16 0.00 0.10 0.00 0.00 66.02 66.00 1wn1 s SER 225 CO 0.28 -0.08 0.44 -0.62 0.98 0.00 0.00 173.24 174.24 1wn1 s ASP 226 N -3.15 -0.17 0.28 7.02 3.68 -1.26 -3.39 116.67 119.68 1wn1 s ASP 226 Ca 0.22 0.18 0.10 0.00 2.13 0.00 0.00 52.55 55.18 1wn1 s ASP 226 Cb -0.03 1.38 -0.05 0.00 -1.45 0.00 0.00 42.92 42.77 1wn1 s ASP 226 CO 0.08 -0.31 -0.15 -0.51 0.13 0.00 0.00 175.17 174.42 1wn1 s ILE 227 N 2.63 2.21 -0.17 4.11 2.07 -0.38 -4.41 121.20 127.25 1wn1 s ILE 227 Ca 0.13 -2.30 -0.08 0.00 -1.41 0.00 0.00 60.65 56.99 1wn1 s ILE 227 Cb -0.14 -2.35 0.06 0.00 0.13 0.00 0.00 42.46 40.16 1wn1 s ILE 227 CO -0.22 -0.38 0.39 -0.89 -1.91 0.00 0.00 174.94 171.93 1wn1 s THR 228 N -2.67 -0.12 0.02 4.00 2.01 -1.20 -2.24 115.64 115.44 1wn1 s THR 228 Ca 0.29 0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.42 1wn1 s THR 228 Cb -0.02 -0.59 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 1wn1 s THR 228 CO 0.14 0.05 -0.05 -0.13 -0.69 0.00 0.00 174.62 173.93 1wn1 s ARG 229 N 1.59 0.40 -0.17 4.92 1.81 -0.37 -1.50 118.95 125.62 1wn1 s ARG 229 Ca -0.08 -0.47 -0.00 0.00 -1.72 0.00 0.00 55.73 53.45 1wn1 s ARG 229 Cb -0.09 -0.23 0.00 0.00 -0.45 0.00 0.00 34.95 34.18 1wn1 s ARG 229 CO -0.12 0.05 -0.14 0.99 -0.68 0.00 0.00 175.30 175.39 1wn1 s THR 230 N -0.85 2.63 0.36 0.02 2.01 -1.25 -0.44 115.64 118.12 1wn1 s THR 230 Ca -0.06 -0.77 0.09 0.00 0.31 0.00 0.00 61.69 61.26 1wn1 s THR 230 Cb -0.06 -2.13 -0.06 0.00 0.01 0.00 0.00 72.50 70.26 1wn1 s THR 230 CO -0.00 0.50 -0.02 0.27 -0.69 0.00 0.00 174.62 174.69 1wn1 s ILE 231 N 1.08 2.31 0.10 1.82 -4.36 -0.16 -4.54 121.20 117.45 1wn1 s ILE 231 Ca -0.00 -2.05 0.09 0.00 -0.26 0.00 0.00 60.65 58.43 1wn1 s ILE 231 Cb -0.14 -2.80 -0.03 0.00 1.25 0.00 0.00 42.46 40.73 1wn1 s ILE 231 CO -0.04 -0.14 -0.23 -0.83 0.24 0.00 0.00 174.94 173.94 1wn1 s GLY 232 N -3.69 1.31 -0.27 6.27 0.00 -0.41 -0.15 107.32 110.39 1wn1 s GLY 232 Ca 0.34 -1.28 -0.07 0.00 0.00 0.00 0.00 44.72 43.72 1wn1 s GLY 232 CO 0.18 -1.26 0.07 1.08 0.00 0.00 0.00 173.10 173.18 1wn1 s LEU 233 N -1.81 3.65 0.00 0.66 1.02 -0.71 -0.85 118.68 120.64 1wn1 s LEU 233 Ca 0.09 -0.51 0.00 0.00 0.02 0.00 0.00 54.13 53.73 1wn1 s LEU 233 Cb -0.10 -1.89 0.00 0.00 0.02 0.00 0.00 46.19 44.22 1wn1 s LEU 233 CO 0.04 -0.13 0.00 0.61 0.02 0.00 0.00 176.35 176.90 1wn1 n GLY 234 N 4.89 0.68 3.68 -3.19 0.00 -1.26 0.28 105.19 110.27 1wn1 n GLY 234 Ca -0.15 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 1wn1 n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wn1 s GLU 235 N 0.00 4.37 0.40 1.61 0.41 -1.26 -4.71 118.70 119.52 1wn1 s GLU 235 Ca 0.00 1.17 -0.15 0.00 -0.41 0.00 0.00 54.97 55.58 1wn1 s GLU 235 Cb 0.00 -3.55 -0.09 0.00 -1.78 0.00 0.00 34.13 28.72 1wn1 s GLU 235 CO 0.00 -0.28 0.83 -0.51 -0.49 0.00 0.00 175.26 174.81 1wn1 s LEU 236 N 1.94 3.90 0.21 1.80 1.43 -1.26 -4.38 118.68 122.32 1wn1 s LEU 236 Ca 0.43 1.38 -0.32 0.00 -1.03 0.00 0.00 54.13 54.59 1wn1 s LEU 236 Cb -0.17 -4.24 -0.14 0.00 0.03 0.00 0.00 46.19 41.67 1wn1 s LEU 236 CO 0.16 -0.36 1.39 -0.67 0.23 0.00 0.00 176.35 177.10 1wn1 n ASP 237 N -0.88 2.52 -0.01 2.29 -0.08 -1.26 -4.84 116.55 114.30 1wn1 n ASP 237 Ca 0.05 1.13 0.19 0.00 -1.51 0.00 0.00 54.79 54.65 1wn1 n ASP 237 Cb 0.54 -1.38 0.66 0.00 2.34 0.00 0.00 41.12 43.27 1wn1 n ASP 237 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1wn1 h GLU 238 N 4.31 0.07 0.00 -0.67 9.09 -2.01 -1.33 114.58 124.04 1wn1 h GLU 238 Ca -0.45 -0.00 -0.05 0.00 0.05 0.00 0.00 59.36 58.91 1wn1 h GLU 238 Cb 1.29 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.36 1wn1 h GLU 238 CO 0.77 0.04 -0.24 0.00 0.05 0.00 0.00 179.01 179.63 1wn1 h ARG 239 N 0.07 0.00 0.00 1.06 3.08 -2.01 -2.76 114.38 113.82 1wn1 h ARG 239 Ca 0.26 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.14 1wn1 h ARG 239 Cb 0.92 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.95 1wn1 h ARG 239 CO -0.02 0.24 -0.99 -0.07 -1.07 0.00 0.00 179.97 178.06 1wn1 h LEU 240 N 0.00 0.00 -0.39 3.04 3.38 -1.60 -3.03 115.31 116.72 1wn1 h LEU 240 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1wn1 h LEU 240 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1wn1 h LEU 240 CO 0.03 0.66 -0.47 0.58 0.09 0.00 0.00 178.44 179.33 1wn1 h VAL 241 N 0.00 1.28 0.08 1.22 2.07 -1.37 -1.66 116.25 117.88 1wn1 h VAL 241 Ca -0.08 -1.66 -0.00 0.00 0.82 0.00 0.00 66.70 65.78 1wn1 h VAL 241 Cb 1.58 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1wn1 h VAL 241 CO 0.07 0.54 -0.04 0.11 0.02 0.00 0.00 177.57 178.28 1wn1 h LYS 242 N 0.67 -0.11 -0.83 1.57 1.57 -1.60 -2.79 116.57 115.04 1wn1 h LYS 242 Ca 0.03 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 1wn1 h LYS 242 Cb 1.06 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 33.30 1wn1 h LYS 242 CO 0.11 0.14 0.41 0.82 -0.57 0.00 0.00 179.45 180.35 1wn1 h ILE 243 N -0.34 0.69 0.32 1.86 2.04 -1.48 -2.26 117.51 118.34 1wn1 h ILE 243 Ca -0.01 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1wn1 h ILE 243 Cb 0.29 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 1wn1 h ILE 243 CO 0.02 0.10 -0.28 0.22 0.00 0.00 0.00 178.15 178.22 1wn1 h TYR 244 N 0.57 -0.73 -0.86 1.37 5.03 -1.12 -0.95 116.97 120.28 1wn1 h TYR 244 Ca 0.46 0.00 0.15 0.00 2.58 0.00 0.00 58.73 61.92 1wn1 h TYR 244 Cb 0.69 0.28 -0.06 0.00 1.55 0.00 0.00 36.73 39.18 1wn1 h TYR 244 CO -0.11 -0.41 0.56 0.93 -1.32 0.00 0.00 178.16 177.81 1wn1 h GLU 245 N -0.61 0.58 0.24 1.82 3.07 -1.16 0.15 114.58 118.68 1wn1 h GLU 245 Ca -0.02 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1wn1 h GLU 245 Cb 0.55 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1wn1 h GLU 245 CO -0.03 0.39 -0.11 0.28 -1.40 0.00 0.00 179.01 178.13 1wn1 h VAL 246 N 0.60 0.83 -0.98 3.13 2.07 -0.94 -1.00 116.25 119.96 1wn1 h VAL 246 Ca 0.43 -0.53 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1wn1 h VAL 246 Cb 0.78 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.61 1wn1 h VAL 246 CO -0.18 0.11 0.64 0.58 0.02 0.00 0.00 177.57 178.74 1wn1 h VAL 247 N -0.60 1.10 -0.31 2.57 2.07 -0.29 0.13 116.25 120.92 1wn1 h VAL 247 Ca -0.03 -0.40 0.02 0.00 0.82 0.00 0.00 66.70 67.11 1wn1 h VAL 247 Cb 0.43 -0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1wn1 h VAL 247 CO 0.05 0.21 0.15 0.50 0.02 0.00 0.00 177.57 178.51 1wn1 h LYS 248 N 1.16 0.31 -0.61 1.57 3.64 -0.54 0.10 116.57 122.21 1wn1 h LYS 248 Ca 0.42 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.77 1wn1 h LYS 248 Cb 0.15 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 1wn1 h LYS 248 CO -0.16 0.21 0.34 -0.44 -2.27 0.00 0.00 179.45 177.13 1wn1 h ASP 249 N 0.32 0.75 -0.28 4.20 3.45 0.02 -1.66 116.42 123.23 1wn1 h ASP 249 Ca 0.13 -0.09 -0.01 0.00 0.43 0.00 0.00 57.03 57.50 1wn1 h ASP 249 Cb 0.05 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1wn1 h ASP 249 CO -0.09 0.62 0.15 0.00 -1.57 0.00 0.00 179.24 178.35 1wn1 h ALA 250 N 1.16 0.36 -0.55 3.45 0.00 -0.15 0.02 119.26 123.56 1wn1 h ALA 250 Ca 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1wn1 h ALA 250 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1wn1 h ALA 250 CO -0.04 -0.11 0.29 0.37 0.00 0.00 0.00 179.25 179.77 1wn1 h GLN 251 N 0.34 0.77 -0.52 0.00 -0.00 -0.61 0.84 115.11 115.94 1wn1 h GLN 251 Ca 0.10 -0.10 -0.11 0.00 -0.00 0.00 0.00 58.65 58.55 1wn1 h GLN 251 Cb 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 27.38 1wn1 h GLN 251 CO -0.02 0.61 -0.10 1.49 0.00 0.00 0.00 178.83 180.82 1wn1 h GLU 252 N 0.74 0.95 0.02 1.69 4.57 -1.22 -1.69 114.58 119.64 1wn1 h GLU 252 Ca 0.19 -0.33 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1wn1 h GLU 252 Cb 0.07 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1wn1 h GLU 252 CO -0.03 1.00 -0.01 1.03 -1.18 0.00 0.00 179.01 179.82 1wn1 h SER 253 N 0.85 -0.03 -0.92 1.04 0.87 -0.45 -0.92 113.55 114.01 1wn1 h SER 253 Ca 0.14 -0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.65 1wn1 h SER 253 Cb 0.63 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.55 1wn1 h SER 253 CO 0.04 0.08 0.60 0.00 -0.53 0.00 0.00 176.83 177.02 1wn1 h ALA 254 N 0.85 1.45 -0.11 6.23 0.00 -0.76 -2.50 119.26 124.42 1wn1 h ALA 254 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1wn1 h ALA 254 Cb 0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1wn1 h ALA 254 CO 0.01 0.43 0.03 0.35 0.00 0.00 0.00 179.25 180.07 1wn1 h PHE 255 N 1.10 0.18 -0.67 0.00 3.57 -0.86 -2.97 116.94 117.30 1wn1 h PHE 255 Ca 0.38 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.91 1wn1 h PHE 255 Cb 0.10 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 1wn1 h PHE 255 CO -0.00 0.32 0.44 0.87 -2.23 0.00 0.00 178.31 177.71 1wn1 h LYS 256 N -0.02 0.71 0.00 1.11 1.79 -0.81 -0.99 116.57 118.36 1wn1 h LYS 256 Ca 0.03 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 1wn1 h LYS 256 Cb 0.23 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1wn1 h LYS 256 CO -0.00 0.47 -0.09 0.00 -1.08 0.00 0.00 179.45 178.75 1wn1 h ALA 257 N 1.63 1.27 -1.89 3.86 0.00 -1.30 -3.44 119.26 119.39 1wn1 h ALA 257 Ca 0.28 -0.08 -0.63 0.00 0.00 0.00 0.00 54.91 54.47 1wn1 h ALA 257 Cb 0.18 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1wn1 h ALA 257 CO -0.08 0.11 1.14 0.28 0.00 0.00 0.00 179.25 180.70 1wn1 n VAL 258 N -3.59 0.51 -3.62 0.00 0.31 -0.38 -4.93 118.33 106.64 1wn1 n VAL 258 Ca -0.02 -0.14 -0.16 0.00 -0.01 0.00 0.00 64.34 64.01 1wn1 n VAL 258 Cb 0.21 -1.84 -0.07 0.00 -0.91 0.00 0.00 33.84 31.23 1wn1 n VAL 258 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1wn1 s ARG 259 N 4.41 0.90 0.30 5.55 3.52 -1.26 -2.59 118.95 129.79 1wn1 s ARG 259 Ca 0.96 0.05 -0.29 0.00 -0.13 0.00 0.00 55.73 56.32 1wn1 s ARG 259 Cb -0.72 0.42 -0.10 0.00 -1.56 0.00 0.00 34.95 32.98 1wn1 s ARG 259 CO 0.52 -0.27 1.41 -1.21 -0.81 0.00 0.00 175.30 174.94 1wn1 s GLU 260 N -1.31 4.26 0.00 5.12 2.02 -1.06 -3.02 118.70 124.71 1wn1 s GLU 260 Ca -0.12 2.34 0.00 0.00 0.02 0.00 0.00 54.97 57.21 1wn1 s GLU 260 Cb -0.02 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 31.14 1wn1 s GLU 260 CO 0.07 -0.38 0.00 0.41 0.02 0.00 0.00 175.26 175.38 1wn1 n GLY 261 N 1.41 3.02 3.87 -1.39 0.00 -0.73 -5.01 105.19 106.36 1wn1 n GLY 261 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1wn1 n GLY 261 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wn1 s ILE 262 N -2.71 4.97 0.43 -0.61 -4.36 -1.17 -4.82 121.20 112.93 1wn1 s ILE 262 Ca 0.00 0.46 -0.22 0.00 -0.26 0.00 0.00 60.65 60.63 1wn1 s ILE 262 Cb 0.00 -3.64 -0.09 0.00 1.25 0.00 0.00 42.46 39.98 1wn1 s ILE 262 CO 0.00 0.02 1.03 -0.54 0.24 0.00 0.00 174.94 175.68 1wn1 s LYS 263 N -2.60 4.06 0.26 0.37 1.02 -1.26 -1.56 119.74 120.03 1wn1 s LYS 263 Ca 0.44 1.40 -0.02 0.00 0.02 0.00 0.00 55.97 57.81 1wn1 s LYS 263 Cb -0.12 -2.35 0.50 0.00 -0.52 0.00 0.00 37.83 35.34 1wn1 s LYS 263 CO 0.21 -0.21 1.77 0.00 -0.92 0.00 0.00 175.35 176.21 1wn1 h ALA 264 N 2.12 1.25 -0.12 5.17 0.00 -0.67 0.34 119.26 127.35 1wn1 h ALA 264 Ca -0.49 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.53 1wn1 h ALA 264 Cb 1.21 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1wn1 h ALA 264 CO 0.61 -0.04 0.11 1.57 0.00 0.00 0.00 179.25 181.50 1wn1 h LYS 265 N 0.67 0.00 -0.01 0.00 2.10 -1.18 -1.28 116.57 116.87 1wn1 h LYS 265 Ca 0.45 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.97 1wn1 h LYS 265 Cb 0.58 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.89 1wn1 h LYS 265 CO -0.33 0.00 -0.59 -0.44 -2.00 0.00 0.00 179.45 176.09 1wn1 h ASP 266 N 0.00 0.03 -0.19 7.07 3.32 -1.21 -0.22 116.42 125.21 1wn1 h ASP 266 Ca 0.06 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 1wn1 h ASP 266 Cb 0.27 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1wn1 h ASP 266 CO -0.00 0.61 -0.09 0.58 -1.72 0.00 0.00 179.24 178.62 1wn1 h VAL 267 N 0.02 1.30 -0.82 -1.35 2.07 -1.24 -1.37 116.25 114.87 1wn1 h VAL 267 Ca -0.01 -1.13 0.04 0.00 0.82 0.00 0.00 66.70 66.42 1wn1 h VAL 267 Cb 1.04 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 32.40 1wn1 h VAL 267 CO 0.08 0.34 0.52 -0.78 0.02 0.00 0.00 177.57 177.75 1wn1 h ASP 268 N 0.10 0.86 -0.18 0.57 3.58 -1.25 -1.87 116.42 118.24 1wn1 h ASP 268 Ca 0.04 -0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.43 1wn1 h ASP 268 Cb 0.56 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.41 1wn1 h ASP 268 CO 0.03 0.59 -0.07 -1.28 -2.88 0.00 0.00 179.24 175.62 1wn1 h SER 269 N 1.01 0.48 0.10 2.28 0.87 -0.85 0.29 113.55 117.73 1wn1 h SER 269 Ca 0.33 -0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.72 1wn1 h SER 269 Cb 0.03 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1wn1 h SER 269 CO -0.12 0.60 -0.23 -0.09 -0.53 0.00 0.00 176.83 176.46 1wn1 h ARG 270 N 0.47 0.23 0.10 2.24 9.65 -0.41 -0.18 114.38 126.49 1wn1 h ARG 270 Ca 0.09 -0.07 -0.32 0.00 -1.10 0.00 0.00 59.98 58.58 1wn1 h ARG 270 Cb 0.42 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.96 1wn1 h ARG 270 CO 0.02 0.45 -1.69 0.00 2.80 0.00 0.00 179.97 181.55 1wn1 h ALA 271 N 1.56 0.41 -0.36 2.80 0.00 -1.27 -3.33 119.26 119.05 1wn1 h ALA 271 Ca 0.04 -1.25 0.02 0.00 0.00 0.00 0.00 54.91 53.71 1wn1 h ALA 271 Cb 0.53 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1wn1 h ALA 271 CO 0.04 1.27 0.20 -0.09 0.00 0.00 0.00 179.25 180.66 1wn1 h ARG 272 N 0.06 0.39 -0.49 0.00 2.43 -0.69 -2.76 114.38 113.32 1wn1 h ARG 272 Ca -0.30 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.80 1wn1 h ARG 272 Cb 2.02 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 31.46 1wn1 h ARG 272 CO 0.13 0.26 0.12 1.05 -1.51 0.00 0.00 179.97 180.02 1wn1 h GLU 273 N 0.40 0.74 -0.84 0.20 4.11 -1.19 -1.78 114.58 116.22 1wn1 h GLU 273 Ca 0.15 -0.14 -0.02 0.00 0.07 0.00 0.00 59.36 59.42 1wn1 h GLU 273 Cb 0.03 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 1wn1 h GLU 273 CO -0.09 0.67 0.44 0.28 0.07 0.00 0.00 179.01 180.38 1wn1 h VAL 274 N 0.72 1.25 0.00 -1.06 2.07 -1.60 -1.01 116.25 116.62 1wn1 h VAL 274 Ca 0.16 -0.66 -0.14 0.00 0.82 0.00 0.00 66.70 66.88 1wn1 h VAL 274 Cb 0.26 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1wn1 h VAL 274 CO -0.00 0.29 -0.65 0.40 0.02 0.00 0.00 177.57 177.63 1wn1 h ILE 275 N 1.18 1.42 -0.06 4.57 2.04 -1.26 -3.21 117.51 122.20 1wn1 h ILE 275 Ca 0.29 -2.27 -0.19 0.00 1.00 0.00 0.00 64.86 63.69 1wn1 h ILE 275 Cb 0.07 2.24 0.01 0.00 -0.74 0.00 0.00 36.82 38.40 1wn1 h ILE 275 CO -0.04 0.64 -0.70 0.28 0.00 0.00 0.00 178.15 178.33 1wn1 h SER 276 N 0.00 0.71 -0.03 1.72 0.02 -0.96 -2.33 113.55 112.68 1wn1 h SER 276 Ca -0.01 -0.70 0.01 0.00 -0.84 0.00 0.00 61.79 60.25 1wn1 h SER 276 Cb 1.19 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 1wn1 h SER 276 CO 0.08 1.31 0.08 0.11 -1.14 0.00 0.00 176.83 177.28 1wn1 h LYS 277 N 0.18 0.00 -0.02 3.45 1.57 -1.23 0.12 116.57 120.64 1wn1 h LYS 277 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1wn1 h LYS 277 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1wn1 h LYS 277 CO 0.14 0.00 -0.22 0.00 -0.57 0.00 0.00 179.45 178.80 1wn1 n ALA 278 N -2.14 3.00 -0.53 3.86 0.00 -1.20 -4.97 120.51 118.53 1wn1 n ALA 278 Ca -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1wn1 n ALA 278 Cb 0.16 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1wn1 n ALA 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wn1 n GLY 279 N 1.34 0.74 1.26 0.00 0.00 0.42 -4.95 105.19 104.00 1wn1 n GLY 279 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 1wn1 n GLY 279 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wn1 n TYR 280 N -2.36 1.25 -0.34 1.61 4.02 -0.88 -4.71 117.16 115.74 1wn1 n TYR 280 Ca 0.00 -0.70 0.21 0.00 -0.01 0.00 0.00 57.90 57.40 1wn1 n TYR 280 Cb 0.00 -0.28 0.44 0.00 -0.02 0.00 0.00 39.34 39.47 1wn1 n TYR 280 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1wn1 h GLY 281 N 3.00 1.88 2.00 2.72 0.00 -1.79 -0.42 103.07 110.46 1wn1 h GLY 281 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1wn1 h GLY 281 CO 0.24 -0.32 0.00 1.05 0.00 0.00 0.00 176.54 177.51 1wn1 h GLU 282 N 0.47 0.00 -0.00 4.80 4.11 -1.93 -3.05 114.58 118.97 1wn1 h GLU 282 Ca 0.68 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.11 1wn1 h GLU 282 Cb 1.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.69 1wn1 h GLU 282 CO -0.50 0.00 -0.47 0.66 0.07 0.00 0.00 179.01 178.77 1wn1 n TYR 283 N -3.02 0.00 -2.64 2.06 4.01 -0.17 -4.54 117.16 112.86 1wn1 n TYR 283 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.31 1wn1 n TYR 283 Cb 0.28 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.14 1wn1 n TYR 283 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1wn1 n PHE 284 N -1.17 3.70 -0.54 -0.72 -0.00 -1.15 -1.03 117.46 116.56 1wn1 n PHE 284 Ca 0.08 -3.02 -0.03 0.00 -0.00 0.00 0.00 57.45 54.47 1wn1 n PHE 284 Cb 0.34 -1.97 0.01 0.00 -0.00 0.00 0.00 39.48 37.86 1wn1 n PHE 284 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 1wn1 n ILE 285 N 3.61 2.13 -3.64 -2.13 5.41 -1.26 -4.91 119.36 118.57 1wn1 n ILE 285 Ca 0.37 -0.72 -0.02 0.00 1.00 0.00 0.00 62.75 63.37 1wn1 n ILE 285 Cb 0.38 -1.45 -0.01 0.00 -0.71 0.00 0.00 39.64 37.85 1wn1 n ILE 285 CO 0.00 0.00 0.00 -1.38 0.00 0.00 0.00 176.55 175.17 1wn1 s HIS 286 N -0.38 -0.13 0.77 1.39 -3.43 -1.26 -5.09 115.29 107.16 1wn1 s HIS 286 Ca 0.06 -0.03 -0.14 0.00 -0.80 0.00 0.00 55.06 54.15 1wn1 s HIS 286 Cb 0.05 0.57 0.06 0.00 -1.43 0.00 0.00 32.58 31.83 1wn1 s HIS 286 CO -0.00 -0.48 1.19 1.03 -2.00 0.00 0.00 174.74 174.48 1wn1 s ARG 287 N -2.80 1.91 0.43 -0.38 0.52 -1.26 -4.92 118.95 112.46 1wn1 s ARG 287 Ca 0.11 1.71 0.24 0.00 -0.52 0.00 0.00 55.73 57.27 1wn1 s ARG 287 Cb 0.01 -1.81 0.87 0.00 0.52 0.00 0.00 34.95 34.54 1wn1 s ARG 287 CO -0.03 -2.00 1.80 1.15 0.02 0.00 0.00 175.30 176.25 1wn1 h THR 288 N -0.64 0.55 -2.12 0.02 2.02 -1.53 -3.45 112.91 107.75 1wn1 h THR 288 Ca -0.47 -1.16 0.31 0.00 0.77 0.00 0.00 66.41 65.86 1wn1 h THR 288 Cb 1.29 1.80 -0.07 0.00 -1.74 0.00 0.00 68.15 69.43 1wn1 h THR 288 CO 0.48 0.23 0.84 -0.83 0.37 0.00 0.00 175.52 176.60 1wn1 s GLY 289 N -4.29 -0.12 0.06 2.16 0.00 -0.81 0.52 107.32 104.84 1wn1 s GLY 289 Ca 0.01 0.04 -0.11 0.00 0.00 0.00 0.00 44.72 44.66 1wn1 s GLY 289 CO 0.64 4.41 0.25 -2.38 0.00 0.00 0.00 173.10 176.02 1wn1 s HIS 290 N -2.10 -0.00 0.77 1.90 -3.43 -1.23 -1.31 115.29 109.88 1wn1 s HIS 290 Ca 0.26 -0.24 -0.12 0.00 -0.80 0.00 0.00 55.06 54.16 1wn1 s HIS 290 Cb -0.00 0.03 0.05 0.00 -1.43 0.00 0.00 32.58 31.23 1wn1 s HIS 290 CO 0.00 -0.50 1.12 0.20 -2.00 0.00 0.00 174.74 173.55 1wn1 s GLY 291 N -2.31 1.62 0.16 -1.38 0.00 -0.42 0.62 107.32 105.61 1wn1 s GLY 291 Ca -0.02 -0.38 -0.15 0.00 0.00 0.00 0.00 44.72 44.17 1wn1 s GLY 291 CO -0.06 0.04 0.42 0.48 0.00 0.00 0.00 173.10 173.98 1wn1 s LEU 292 N -5.56 0.41 0.00 0.66 0.05 -0.98 -1.81 118.68 111.45 1wn1 s LEU 292 Ca 0.60 -0.50 0.00 0.00 0.05 0.00 0.00 54.13 54.28 1wn1 s LEU 292 Cb -0.12 1.82 0.00 0.00 -2.05 0.00 0.00 46.19 45.84 1wn1 s LEU 292 CO 0.52 -0.94 0.00 0.61 -0.55 0.00 0.00 176.35 175.99 1wn1 n GLY 293 N -0.27 -1.00 0.25 -3.48 0.00 -1.26 -4.65 105.19 94.78 1wn1 n GLY 293 Ca -0.12 0.68 0.16 0.00 0.00 0.00 0.00 46.02 46.74 1wn1 n GLY 293 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wn1 h LEU 294 N 0.00 0.00 -9.27 0.99 3.38 -1.94 0.15 115.31 108.62 1wn1 h LEU 294 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1wn1 h LEU 294 Cb 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 1wn1 h LEU 294 CO 0.00 0.00 -0.69 -1.81 0.09 0.00 0.00 178.44 176.03 1wn1 s ASP 295 N -5.66 3.31 0.16 -0.43 1.11 -1.26 -4.74 116.67 109.16 1wn1 s ASP 295 Ca 0.03 -1.16 0.03 0.00 0.18 0.00 0.00 52.55 51.63 1wn1 s ASP 295 Cb 0.08 -0.27 -0.02 0.00 1.07 0.00 0.00 42.92 43.78 1wn1 s ASP 295 CO 0.56 -0.21 1.37 0.58 1.18 0.00 0.00 175.17 178.64 1wn1 h VAL 296 N 2.18 1.52 -3.54 -1.27 2.07 -1.87 -3.40 116.25 111.93 1wn1 h VAL 296 Ca -0.41 -2.72 -0.60 0.00 0.82 0.00 0.00 66.70 63.80 1wn1 h VAL 296 Cb 1.24 2.52 -0.38 0.00 -1.52 0.00 0.00 31.29 33.15 1wn1 h VAL 296 CO 0.67 0.79 -0.79 -1.00 0.02 0.00 0.00 177.57 177.26 1wn1 s HIS 297 N -3.14 2.22 0.36 1.57 3.76 -1.26 -4.44 115.29 114.36 1wn1 s HIS 297 Ca -0.02 -1.58 -0.06 0.00 -0.15 0.00 0.00 55.06 53.24 1wn1 s HIS 297 Cb 0.10 -1.52 0.02 0.00 1.11 0.00 0.00 32.58 32.29 1wn1 s HIS 297 CO 0.82 -0.74 0.58 -1.83 -0.85 0.00 0.00 174.74 172.73 1wn1 s GLU 298 N 1.46 2.05 0.61 1.40 -1.05 -0.75 -4.97 118.70 117.44 1wn1 s GLU 298 Ca -0.04 -1.68 -0.17 0.00 -0.15 0.00 0.00 54.97 52.92 1wn1 s GLU 298 Cb -0.18 0.50 -0.02 0.00 -0.44 0.00 0.00 34.13 33.99 1wn1 s GLU 298 CO -0.07 -0.89 1.15 -1.21 0.95 0.00 0.00 175.26 175.19 1wn1 s GLU 299 N -2.74 2.95 0.35 -4.83 0.41 -1.26 -1.30 118.70 112.27 1wn1 s GLU 299 Ca 0.26 1.62 -0.02 0.00 -0.41 0.00 0.00 54.97 56.42 1wn1 s GLU 299 Cb -0.02 -1.95 -0.04 0.00 -1.78 0.00 0.00 34.13 30.34 1wn1 s GLU 299 CO 0.18 -1.17 0.59 -1.25 -0.49 0.00 0.00 175.26 173.12 1wn1 s PRO 300 N -3.61 3.54 -0.05 0.39 0.04 -1.26 -4.45 135.00 129.60 1wn1 s PRO 300 Ca 0.72 -0.15 -0.14 0.00 0.04 0.00 0.00 61.00 61.48 1wn1 s PRO 300 Cb -0.25 -2.61 -0.05 0.00 0.04 0.00 0.00 34.50 31.63 1wn1 s PRO 300 CO 0.35 0.11 0.37 0.71 0.04 0.00 0.00 177.00 178.58 1wn1 s TYR 301 N -2.32 3.66 -0.98 0.56 1.51 -1.26 -1.31 117.35 117.20 1wn1 s TYR 301 Ca 0.42 0.88 -0.02 0.00 -1.01 0.00 0.00 57.07 57.35 1wn1 s TYR 301 Cb -0.10 -2.29 0.30 0.00 -0.11 0.00 0.00 41.96 39.76 1wn1 s TYR 301 CO 0.36 0.55 1.32 -0.89 -1.11 0.00 0.00 175.55 175.78 1wn1 n ILE 302 N 2.27 4.68 -4.45 2.71 2.08 -0.43 -4.31 119.36 121.91 1wn1 n ILE 302 Ca -0.14 -5.78 -0.25 0.00 0.56 0.00 0.00 62.75 57.14 1wn1 n ILE 302 Cb 0.52 -2.08 -0.08 0.00 -0.75 0.00 0.00 39.64 37.26 1wn1 n ILE 302 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1wn1 s GLY 303 N -1.97 2.63 0.08 7.39 0.00 -1.26 -1.32 107.32 112.87 1wn1 s GLY 303 Ca 0.33 -1.41 0.07 0.00 0.00 0.00 0.00 44.72 43.71 1wn1 s GLY 303 CO 0.08 -1.73 1.22 -1.55 0.00 0.00 0.00 173.10 171.13 1wn1 n PRO 304 N -0.87 0.04 -0.28 2.90 -0.04 -1.26 -1.14 135.00 134.35 1wn1 n PRO 304 Ca -0.02 0.50 0.07 0.00 -0.04 0.00 0.00 63.50 64.01 1wn1 n PRO 304 Cb 0.64 -1.62 0.20 0.00 -0.04 0.00 0.00 33.50 32.69 1wn1 n PRO 304 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1wn1 n ASP 305 N -1.69 3.35 -4.58 3.54 5.68 -1.26 -4.89 116.55 116.70 1wn1 n ASP 305 Ca 0.00 -2.26 -0.43 0.00 -0.50 0.00 0.00 54.79 51.60 1wn1 n ASP 305 Cb 0.03 -0.34 -0.03 0.00 -1.14 0.00 0.00 41.12 39.64 1wn1 n ASP 305 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1wn1 s GLY 306 N -1.19 1.35 0.04 6.12 0.00 -0.29 -4.88 107.32 108.46 1wn1 s GLY 306 Ca 0.31 -0.68 0.24 0.00 0.00 0.00 0.00 44.72 44.59 1wn1 s GLY 306 CO 0.16 2.27 1.23 1.18 0.00 0.00 0.00 173.10 177.94 1wn1 n GLU 307 N 7.65 0.14 -1.81 2.90 -0.58 -1.26 -1.01 120.64 126.66 1wn1 n GLU 307 Ca 0.09 0.01 -0.41 0.00 -0.42 0.00 0.00 57.16 56.43 1wn1 n GLU 307 Cb 0.49 -1.56 -0.01 0.00 -0.57 0.00 0.00 31.44 29.79 1wn1 n GLU 307 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wn1 s VAL 308 N -3.09 2.09 -0.33 2.62 1.01 -1.26 -4.70 120.40 116.74 1wn1 s VAL 308 Ca 0.08 0.08 -0.17 0.00 0.00 0.00 0.00 61.98 61.97 1wn1 s VAL 308 Cb 0.16 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 1wn1 s VAL 308 CO 0.75 0.02 0.47 -0.63 0.00 0.00 0.00 175.10 175.70 1wn1 s ILE 309 N -0.67 5.07 0.39 2.22 1.01 -1.26 -0.22 121.20 127.74 1wn1 s ILE 309 Ca 0.57 0.37 -0.26 0.00 0.00 0.00 0.00 60.65 61.33 1wn1 s ILE 309 Cb -0.47 -3.89 -0.11 0.00 0.01 0.00 0.00 42.46 38.01 1wn1 s ILE 309 CO 0.57 -0.11 1.22 0.18 0.00 0.00 0.00 174.94 176.79 1wn1 n LEU 310 N 5.60 3.53 -3.99 2.97 4.77 -0.60 -4.82 117.00 124.45 1wn1 n LEU 310 Ca -0.06 1.13 -0.08 0.00 -0.03 0.00 0.00 56.01 56.96 1wn1 n LEU 310 Cb 0.49 -1.46 -0.08 0.00 -2.33 0.00 0.00 43.42 40.04 1wn1 n LEU 310 CO 0.43 -0.79 -0.20 -0.54 -1.33 0.00 0.00 177.39 174.96 1wn1 s LYS 311 N -2.05 0.83 0.32 3.23 1.02 -1.26 -1.77 119.74 120.06 1wn1 s LYS 311 Ca 0.60 -1.15 -0.29 0.00 0.02 0.00 0.00 55.97 55.15 1wn1 s LYS 311 Cb -0.54 0.29 -0.12 0.00 -0.52 0.00 0.00 37.83 36.94 1wn1 s LYS 311 CO 0.59 -0.24 1.41 0.09 -0.92 0.00 0.00 175.35 176.27 1wn1 n ASN 312 N -0.04 3.18 0.00 2.83 3.02 -1.26 -2.29 115.26 120.70 1wn1 n ASN 312 Ca -0.12 1.19 0.00 0.00 -0.03 0.00 0.00 54.58 55.62 1wn1 n ASN 312 Cb 0.62 -1.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.27 1wn1 n ASN 312 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wn1 n GLY 313 N 1.17 3.13 3.77 7.41 0.00 -0.56 -4.82 105.19 115.29 1wn1 n GLY 313 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1wn1 n GLY 313 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1wn1 s MET 314 N -0.94 4.23 -0.05 1.61 -1.94 -0.97 -0.72 119.30 120.53 1wn1 s MET 314 Ca 0.00 1.74 0.03 0.00 -1.71 0.00 0.00 55.69 55.75 1wn1 s MET 314 Cb 0.00 -2.77 0.00 0.00 2.01 0.00 0.00 34.83 34.08 1wn1 s MET 314 CO 0.00 -0.14 -0.14 0.95 -0.01 0.00 0.00 175.02 175.68 1wn1 s THR 315 N -1.42 1.23 0.25 2.05 -4.23 -1.26 -1.63 115.64 110.63 1wn1 s THR 315 Ca 0.54 -0.58 -0.21 0.00 -1.18 0.00 0.00 61.69 60.26 1wn1 s THR 315 Cb -0.29 -1.08 0.04 0.00 1.34 0.00 0.00 72.50 72.51 1wn1 s THR 315 CO 0.36 0.37 0.82 0.72 -0.54 0.00 0.00 174.62 176.35 1wn1 s PHE 316 N 0.30 -0.10 0.25 3.99 -0.12 -0.49 -2.31 117.98 119.50 1wn1 s PHE 316 Ca -0.08 -0.34 0.07 0.00 -0.05 0.00 0.00 56.93 56.53 1wn1 s PHE 316 Cb -0.13 0.71 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 1wn1 s PHE 316 CO 0.03 -1.15 0.20 0.95 -0.05 0.00 0.00 175.22 175.19 1wn1 s THR 317 N -3.36 4.45 -0.21 -4.49 -4.23 0.20 0.11 115.64 108.12 1wn1 s THR 317 Ca 0.13 -1.40 -0.02 0.00 -1.18 0.00 0.00 61.69 59.22 1wn1 s THR 317 Cb -0.04 -3.41 0.06 0.00 1.34 0.00 0.00 72.50 70.45 1wn1 s THR 317 CO 0.06 -0.35 0.02 -0.63 -0.54 0.00 0.00 174.62 173.18 1wn1 s ILE 318 N -2.13 0.80 -0.41 2.99 1.01 -0.88 -3.57 121.20 119.01 1wn1 s ILE 318 Ca 0.33 -0.79 0.09 0.00 0.00 0.00 0.00 60.65 60.29 1wn1 s ILE 318 Cb -0.08 -1.27 0.32 0.00 0.01 0.00 0.00 42.46 41.44 1wn1 s ILE 318 CO 0.25 -0.22 0.82 -1.84 0.00 0.00 0.00 174.94 173.95 1wn1 n GLU 319 N 4.94 0.93 -1.31 2.79 0.28 0.19 -2.37 120.64 126.09 1wn1 n GLU 319 Ca -0.09 -2.83 -0.33 0.00 -0.16 0.00 0.00 57.16 53.74 1wn1 n GLU 319 Cb 0.46 -1.43 0.10 0.00 1.43 0.00 0.00 31.44 32.00 1wn1 n GLU 319 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1wn1 s PRO 320 N -1.27 2.03 0.12 3.44 0.04 -1.25 -4.71 135.00 133.40 1wn1 s PRO 320 Ca 0.34 1.58 -0.09 0.00 0.04 0.00 0.00 61.00 62.87 1wn1 s PRO 320 Cb 0.30 -1.84 -0.00 0.00 0.04 0.00 0.00 34.50 33.00 1wn1 s PRO 320 CO -0.09 -1.88 0.24 0.20 0.04 0.00 0.00 177.00 175.51 1wn1 s GLY 321 N -2.43 0.23 -0.12 0.56 0.00 -1.26 -3.56 107.32 100.74 1wn1 s GLY 321 Ca 0.70 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.72 1wn1 s GLY 321 CO 0.49 -0.79 -0.10 -0.42 0.00 0.00 0.00 173.10 172.28 1wn1 s ILE 322 N -3.90 1.22 -0.20 0.90 1.01 -0.66 -4.10 121.20 115.47 1wn1 s ILE 322 Ca 0.10 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1wn1 s ILE 322 Cb 0.04 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.35 1wn1 s ILE 322 CO -0.06 0.40 -0.17 -0.31 0.00 0.00 0.00 174.94 174.79 1wn1 s TYR 323 N 1.57 2.91 -0.36 3.97 1.51 -0.19 -1.83 117.35 124.92 1wn1 s TYR 323 Ca 0.04 -1.81 -0.01 0.00 -1.01 0.00 0.00 57.07 54.28 1wn1 s TYR 323 Cb -0.13 -1.93 0.09 0.00 -0.11 0.00 0.00 41.96 39.88 1wn1 s TYR 323 CO -0.08 -0.82 0.11 0.08 -1.11 0.00 0.00 175.55 173.72 1wn1 s VAL 324 N 1.25 2.97 0.15 0.71 1.01 0.25 -4.62 120.40 122.12 1wn1 s VAL 324 Ca 0.01 -1.91 -0.34 0.00 0.00 0.00 0.00 61.98 59.75 1wn1 s VAL 324 Cb -0.15 -2.96 -0.16 0.00 0.00 0.00 0.00 36.38 33.11 1wn1 s VAL 324 CO -0.11 -0.49 1.24 -2.65 0.00 0.00 0.00 175.10 173.10 1wn1 n PRO 325 N 4.53 1.25 0.00 2.72 -0.02 -1.26 -1.06 135.00 141.16 1wn1 n PRO 325 Ca -0.04 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1wn1 n PRO 325 Cb 0.42 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1wn1 n PRO 325 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wn1 n GLY 326 N 2.22 2.37 0.96 -1.23 0.00 -1.26 -4.76 105.19 103.49 1wn1 n GLY 326 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1wn1 n GLY 326 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wn1 n LEU 327 N 0.00 0.19 0.00 0.99 7.94 -0.50 -4.80 117.00 120.81 1wn1 n LEU 327 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1wn1 n LEU 327 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1wn1 n LEU 327 CO 0.00 0.02 0.00 0.61 -1.11 0.00 0.00 177.39 176.91 1wn1 n GLY 328 N 2.99 0.40 3.70 -3.96 0.00 -0.22 -4.05 105.19 104.06 1wn1 n GLY 328 Ca 0.00 -1.51 -0.05 0.00 0.00 0.00 0.00 46.02 44.45 1wn1 n GLY 328 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wn1 s GLY 329 N 0.00 -0.28 -0.07 -0.02 0.00 -1.20 -0.58 107.32 105.17 1wn1 s GLY 329 Ca 0.00 0.25 -0.04 0.00 0.00 0.00 0.00 44.72 44.93 1wn1 s GLY 329 CO 0.00 0.06 0.17 0.14 0.00 0.00 0.00 173.10 173.47 1wn1 s VAL 330 N -3.37 -0.03 -0.05 1.40 1.01 -0.76 -4.82 120.40 113.79 1wn1 s VAL 330 Ca 0.10 0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.15 1wn1 s VAL 330 Cb -0.02 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.13 1wn1 s VAL 330 CO -0.00 0.04 0.11 -0.60 0.00 0.00 0.00 175.10 174.65 1wn1 s ARG 331 N 0.71 0.10 -0.19 2.72 3.52 -1.26 -1.65 118.95 122.90 1wn1 s ARG 331 Ca -0.05 0.21 0.01 0.00 -0.13 0.00 0.00 55.73 55.77 1wn1 s ARG 331 Cb -0.07 -0.04 0.04 0.00 -1.56 0.00 0.00 34.95 33.32 1wn1 s ARG 331 CO -0.04 -0.07 -0.11 0.42 -0.81 0.00 0.00 175.30 174.69 1wn1 s ILE 332 N 0.47 1.59 -0.05 4.11 1.01 -1.23 -3.84 121.20 123.26 1wn1 s ILE 332 Ca -0.03 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 59.77 1wn1 s ILE 332 Cb -0.05 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.77 1wn1 s ILE 332 CO -0.02 0.23 -0.22 -0.70 0.00 0.00 0.00 174.94 174.23 1wn1 s GLU 333 N 1.43 2.16 0.14 2.79 2.12 -0.57 -4.00 118.70 122.77 1wn1 s GLU 333 Ca 0.00 -0.79 0.07 0.00 0.36 0.00 0.00 54.97 54.61 1wn1 s GLU 333 Cb -0.15 -1.88 -0.04 0.00 0.26 0.00 0.00 34.13 32.31 1wn1 s GLU 333 CO -0.09 0.36 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.33 1wn1 s ASP 334 N -0.17 2.21 -0.21 -1.70 1.01 -1.00 -3.24 116.67 113.57 1wn1 s ASP 334 Ca -0.01 -0.83 -0.12 0.00 0.71 0.00 0.00 52.55 52.30 1wn1 s ASP 334 Cb -0.12 -0.09 -0.05 0.00 1.01 0.00 0.00 42.92 43.67 1wn1 s ASP 334 CO 0.02 -0.11 0.20 -1.81 0.21 0.00 0.00 175.17 173.68 1wn1 s ASP 335 N -2.53 6.24 0.04 0.27 1.01 -1.26 -2.08 116.67 118.36 1wn1 s ASP 335 Ca 0.11 0.27 0.08 0.00 0.71 0.00 0.00 52.55 53.72 1wn1 s ASP 335 Cb -0.05 -2.13 -0.03 0.00 1.01 0.00 0.00 42.92 41.72 1wn1 s ASP 335 CO 0.04 0.10 -0.21 -0.63 0.21 0.00 0.00 175.17 174.68 1wn1 s ILE 336 N 0.73 2.55 -0.09 0.77 1.09 0.12 -0.37 121.20 126.00 1wn1 s ILE 336 Ca 0.11 -1.25 0.04 0.00 -1.10 0.00 0.00 60.65 58.45 1wn1 s ILE 336 Cb -0.13 -2.04 0.00 0.00 -1.06 0.00 0.00 42.46 39.23 1wn1 s ILE 336 CO 0.02 0.36 -0.21 0.54 -0.10 0.00 0.00 174.94 175.55 1wn1 s VAL 337 N -0.87 1.81 -0.24 2.92 0.11 -0.57 -1.40 120.40 122.15 1wn1 s VAL 337 Ca 0.13 -0.88 -0.29 0.00 -2.93 0.00 0.00 61.98 58.01 1wn1 s VAL 337 Cb -0.10 -1.57 0.00 0.00 -1.53 0.00 0.00 36.38 33.18 1wn1 s VAL 337 CO 0.04 0.50 1.19 -0.69 -3.33 0.00 0.00 175.10 172.81 1wn1 s VAL 338 N 0.36 4.38 -0.03 2.04 1.01 -0.65 -1.53 120.40 125.97 1wn1 s VAL 338 Ca -0.16 1.63 0.01 0.00 0.00 0.00 0.00 61.98 63.46 1wn1 s VAL 338 Cb -0.17 -4.19 0.02 0.00 0.00 0.00 0.00 36.38 32.04 1wn1 s VAL 338 CO 0.07 -0.30 -0.04 -0.62 0.00 0.00 0.00 175.10 174.21 1wn1 s ASP 339 N 1.95 0.82 -1.44 3.32 2.15 0.79 -1.49 116.67 122.77 1wn1 s ASP 339 Ca 0.51 -0.11 -0.10 0.00 0.43 0.00 0.00 52.55 53.28 1wn1 s ASP 339 Cb -0.17 -0.35 0.06 0.00 -0.30 0.00 0.00 42.92 42.16 1wn1 s ASP 339 CO 0.15 -0.03 0.72 -0.62 -0.17 0.00 0.00 175.17 175.21 1wn1 n GLU 340 N 3.84 -4.63 -1.00 4.34 -0.58 -1.26 -0.64 120.64 120.70 1wn1 n GLU 340 Ca -0.24 0.63 0.00 0.00 -0.42 0.00 0.00 57.16 57.13 1wn1 n GLU 340 Cb 0.52 -5.45 0.00 0.00 -0.57 0.00 0.00 31.44 25.94 1wn1 n GLU 340 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wn1 n GLY 341 N -1.47 0.32 3.19 0.62 0.00 -1.26 -5.00 105.19 101.59 1wn1 n GLY 341 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1wn1 n GLY 341 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wn1 s LYS 342 N -0.70 0.89 0.20 1.61 2.20 0.19 -2.57 119.74 121.56 1wn1 s LYS 342 Ca 0.00 -1.32 -0.30 0.00 -0.36 0.00 0.00 55.97 53.99 1wn1 s LYS 342 Cb 0.00 -0.38 -0.08 0.00 -1.51 0.00 0.00 37.83 35.86 1wn1 s LYS 342 CO 0.00 0.03 1.09 0.20 -0.36 0.00 0.00 175.35 176.30 1wn1 s GLY 343 N -2.94 2.91 -0.08 5.54 0.00 -1.07 -0.15 107.32 111.53 1wn1 s GLY 343 Ca 0.12 0.81 -0.01 0.00 0.00 0.00 0.00 44.72 45.64 1wn1 s GLY 343 CO -0.02 1.60 -0.04 -1.60 0.00 0.00 0.00 173.10 173.04 1wn1 s ARG 344 N -0.60 1.02 -0.00 2.90 3.52 -0.58 -4.89 118.95 120.32 1wn1 s ARG 344 Ca 0.48 -0.08 -0.30 0.00 -0.13 0.00 0.00 55.73 55.70 1wn1 s ARG 344 Cb -0.30 -1.20 -0.06 0.00 -1.56 0.00 0.00 34.95 31.84 1wn1 s ARG 344 CO 0.36 -0.24 1.47 1.03 -0.81 0.00 0.00 175.30 177.10 1wn1 s ARG 345 N 1.67 4.25 0.09 5.12 0.52 -1.26 -1.52 118.95 127.82 1wn1 s ARG 345 Ca 0.02 2.05 0.12 0.00 -0.52 0.00 0.00 55.73 57.39 1wn1 s ARG 345 Cb -0.13 -3.64 -0.16 0.00 0.52 0.00 0.00 34.95 31.54 1wn1 s ARG 345 CO -0.05 -0.65 1.04 -0.07 0.02 0.00 0.00 175.30 175.59 1wn1 h LEU 346 N 8.70 0.00 -9.10 2.53 3.38 -1.07 -3.45 115.31 116.30 1wn1 h LEU 346 Ca -0.38 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.97 1wn1 h LEU 346 Cb 1.18 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.77 1wn1 h LEU 346 CO 0.92 0.84 -0.56 0.42 0.09 0.00 0.00 178.44 180.15 1wn1 s THR 347 N -2.75 4.79 -0.65 0.22 -4.23 -1.24 -4.43 115.64 107.35 1wn1 s THR 347 Ca -0.01 -0.03 0.14 0.00 -1.18 0.00 0.00 61.69 60.60 1wn1 s THR 347 Cb 0.09 -3.16 -0.15 0.00 1.34 0.00 0.00 72.50 70.62 1wn1 s THR 347 CO 0.81 0.46 0.58 0.29 -0.54 0.00 0.00 174.62 176.22 1wn1 n LYS 348 N 3.51 2.41 -1.32 3.99 5.02 -1.26 -4.85 118.16 125.67 1wn1 n LYS 348 Ca -0.17 -0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.69 1wn1 n LYS 348 Cb 0.52 -1.15 -0.01 0.00 -0.02 0.00 0.00 35.03 34.37 1wn1 n LYS 348 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wn1 n ALA 349 N -1.33 -2.95 -1.54 7.82 0.00 -1.26 -4.79 120.51 116.46 1wn1 n ALA 349 Ca 0.03 0.18 -0.58 0.00 0.00 0.00 0.00 53.44 53.06 1wn1 n ALA 349 Cb 0.22 -1.51 -0.08 0.00 0.00 0.00 0.00 19.45 18.08 1wn1 n ALA 349 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1wn1 n GLU 350 N 1.26 0.25 -0.02 0.00 4.07 -1.26 -4.92 120.64 120.01 1wn1 n GLU 350 Ca 0.13 0.09 0.06 0.00 -0.06 0.00 0.00 57.16 57.38 1wn1 n GLU 350 Cb 0.37 -1.62 -0.14 0.00 -0.06 0.00 0.00 31.44 29.99 1wn1 n GLU 350 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1wn1 n ARG 351 N 1.92 0.67 -2.29 5.31 1.74 -1.26 -4.98 116.66 117.77 1wn1 n ARG 351 Ca 0.20 -0.14 -0.36 0.00 -0.77 0.00 0.00 57.85 56.78 1wn1 n ARG 351 Cb 0.09 -1.44 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 1wn1 n ARG 351 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1wn1 s GLU 352 N -3.15 3.55 -0.05 5.56 0.41 -1.26 -4.92 118.70 118.83 1wn1 s GLU 352 Ca -0.07 1.64 -0.30 0.00 -0.41 0.00 0.00 54.97 55.83 1wn1 s GLU 352 Cb 0.11 -2.16 -0.08 0.00 -1.78 0.00 0.00 34.13 30.22 1wn1 s GLU 352 CO 0.77 -0.70 2.05 -0.11 -0.49 0.00 0.00 175.26 176.78 1wn1 n LEU 353 N -0.97 3.83 -4.65 1.80 0.00 -1.26 -4.96 117.00 110.79 1wn1 n LEU 353 Ca 0.10 0.69 -0.37 0.00 0.00 0.00 0.00 56.01 56.43 1wn1 n LEU 353 Cb 0.50 -1.52 -0.09 0.00 0.00 0.00 0.00 43.42 42.30 1wn1 n LEU 353 CO 0.44 -0.09 -0.11 -0.63 0.00 0.00 0.00 177.39 177.00 1wn1 s ILE 354 N 5.64 5.31 -0.39 1.96 1.01 -1.26 -5.03 121.20 128.45 1wn1 s ILE 354 Ca 0.93 0.30 -0.05 0.00 0.00 0.00 0.00 60.65 61.82 1wn1 s ILE 354 Cb -0.43 -3.56 0.08 0.00 0.01 0.00 0.00 42.46 38.57 1wn1 s ILE 354 CO 0.41 0.30 0.18 -0.63 0.00 0.00 0.00 174.94 175.20 1wn1 s ILE 355 N 1.29 3.65 -2.00 2.92 -1.09 -1.26 -1.29 121.20 123.43 1wn1 s ILE 355 Ca 0.10 -1.60 0.22 0.00 -2.23 0.00 0.00 60.65 57.13 1wn1 s ILE 355 Cb -0.14 -3.29 0.62 0.00 -1.58 0.00 0.00 42.46 38.07 1wn1 s ILE 355 CO 0.07 -0.48 1.69 0.18 -1.23 0.00 0.00 174.94 175.16