#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn1 s ALA 7 N 0.00 2.43 0.03 3.14 0.00 -1.26 -4.94 121.76 121.16 2wn1 s ALA 7 Ca 0.00 -1.77 0.01 0.00 0.00 0.00 0.00 51.96 50.20 2wn1 s ALA 7 Cb 0.00 -4.46 -0.02 0.00 0.00 0.00 0.00 23.12 18.64 2wn1 s ALA 7 CO 0.00 -3.86 -0.06 0.45 0.00 0.00 0.00 175.76 172.30 2wn1 s SER 8 N 5.73 0.57 0.25 0.00 0.15 -1.26 -0.62 113.70 118.53 2wn1 s SER 8 Ca 0.51 -0.47 -0.02 0.00 0.70 0.00 0.00 55.95 56.67 2wn1 s SER 8 Cb -0.04 0.05 -0.03 0.00 -1.71 0.00 0.00 66.02 64.29 2wn1 s SER 8 CO -0.00 -0.21 0.27 0.00 1.20 0.00 0.00 173.24 174.50 2wn1 s MET 9 N -1.36 1.47 0.02 5.44 0.00 0.47 -4.98 119.30 120.36 2wn1 s MET 9 Ca -0.11 -1.65 0.08 0.00 0.00 0.00 0.00 55.69 54.01 2wn1 s MET 9 Cb -0.09 0.34 -0.02 0.00 0.00 0.00 0.00 34.83 35.06 2wn1 s MET 9 CO -0.00 -0.54 -0.23 0.99 0.00 0.00 0.00 175.02 175.24 2wn1 s THR 10 N -3.85 1.84 -0.12 3.16 2.01 -1.26 -0.39 115.64 117.03 2wn1 s THR 10 Ca 0.35 -1.16 0.01 0.00 0.31 0.00 0.00 61.69 61.20 2wn1 s THR 10 Cb 0.04 -1.56 0.02 0.00 0.01 0.00 0.00 72.50 71.00 2wn1 s THR 10 CO 0.16 0.36 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.63 2wn1 s VAL 11 N -0.70 1.36 0.02 3.82 1.01 -0.34 -4.77 120.40 120.80 2wn1 s VAL 11 Ca 0.09 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 2wn1 s VAL 11 Cb -0.09 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2wn1 s VAL 11 CO 0.01 0.42 1.13 -0.75 0.00 0.00 0.00 175.10 175.91 2wn1 s LYS 12 N 1.30 4.45 -0.15 2.72 2.36 -1.26 -1.27 119.74 127.89 2wn1 s LYS 12 Ca -0.01 1.64 -0.03 0.00 -2.55 0.00 0.00 55.97 55.02 2wn1 s LYS 12 Cb -0.14 -3.42 -0.03 0.00 -1.05 0.00 0.00 37.83 33.19 2wn1 s LYS 12 CO -0.06 -0.23 -0.04 0.42 1.55 0.00 0.00 175.35 176.99 2wn1 s ILE 13 N 1.28 3.85 0.08 5.43 -1.09 -0.38 -4.25 121.20 126.12 2wn1 s ILE 13 Ca 0.56 -0.38 0.09 0.00 -2.23 0.00 0.00 60.65 58.69 2wn1 s ILE 13 Cb -0.26 -2.68 -0.03 0.00 -1.58 0.00 0.00 42.46 37.91 2wn1 s ILE 13 CO 0.27 0.50 -0.24 0.20 -1.23 0.00 0.00 174.94 174.45 2wn1 s ASN 14 N 0.28 2.87 0.37 3.58 0.01 0.03 -1.05 114.94 121.03 2wn1 s ASN 14 Ca -0.04 -0.63 -0.26 0.00 -0.71 0.00 0.00 52.86 51.22 2wn1 s ASN 14 Cb -0.14 -0.22 -0.11 0.00 0.41 0.00 0.00 41.25 41.19 2wn1 s ASN 14 CO 0.03 0.17 1.17 1.21 -1.51 0.00 0.00 177.10 178.17 2wn1 n GLU 15 N 1.44 1.77 -3.65 -0.60 2.13 -0.40 -1.17 120.64 120.16 2wn1 n GLU 15 Ca -0.18 0.62 -0.39 0.00 0.66 0.00 0.00 57.16 57.87 2wn1 n GLU 15 Cb 0.53 -2.20 -0.11 0.00 0.27 0.00 0.00 31.44 29.93 2wn1 n GLU 15 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2wn1 s SER 16 N -0.51 5.55 0.27 4.31 0.01 0.18 -0.45 113.70 123.07 2wn1 s SER 16 Ca 0.59 -1.30 0.08 0.00 1.31 0.00 0.00 55.95 56.63 2wn1 s SER 16 Cb -0.57 -1.95 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 2wn1 s SER 16 CO 0.59 -0.44 0.12 -0.76 0.41 0.00 0.00 173.24 173.16 2wn1 s LEU 17 N 1.44 3.51 0.60 2.44 1.43 -1.13 -4.71 118.68 122.25 2wn1 s LEU 17 Ca 0.01 -0.46 0.35 0.00 -1.03 0.00 0.00 54.13 53.00 2wn1 s LEU 17 Cb -0.21 -2.04 1.90 0.00 0.03 0.00 0.00 46.19 45.87 2wn1 s LEU 17 CO 0.03 -0.06 2.22 -0.65 0.23 0.00 0.00 176.35 178.12 2wn1 h PRO 18 N 1.64 0.00 0.00 1.29 0.11 -1.91 -2.92 132.00 130.21 2wn1 h PRO 18 Ca -0.46 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.51 2wn1 h PRO 18 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 2wn1 h PRO 18 CO 0.61 0.03 -1.64 1.04 -0.21 0.00 0.00 178.00 177.83 2wn1 n GLN 19 N -3.42 0.64 0.00 1.05 3.00 -1.26 -4.72 117.38 112.67 2wn1 n GLN 19 Ca -0.02 0.08 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 2wn1 n GLN 19 Cb 0.15 -1.70 0.00 0.00 0.00 0.00 0.00 30.24 28.68 2wn1 n GLN 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wn1 n GLY 20 N 1.40 -0.83 3.31 1.08 0.00 -1.10 -4.91 105.19 104.15 2wn1 n GLY 20 Ca -0.11 0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 2wn1 n GLY 20 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wn1 s ASN 21 N -4.00 3.63 0.00 1.61 -0.87 -1.26 -2.84 114.94 111.21 2wn1 s ASN 21 Ca 0.00 -0.42 0.00 0.00 -1.57 0.00 0.00 52.86 50.87 2wn1 s ASN 21 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 41.25 39.75 2wn1 s ASN 21 CO 0.00 0.17 0.00 0.61 -2.57 0.00 0.00 177.10 175.31 2wn1 n GLY 22 N 3.46 -0.15 3.74 0.66 0.00 0.41 -4.90 105.19 108.41 2wn1 n GLY 22 Ca -0.18 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 43.82 2wn1 n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wn1 s LYS 23 N 0.62 1.73 -0.07 1.61 -2.85 -1.26 -4.29 119.74 115.23 2wn1 s LYS 23 Ca 0.00 1.03 -0.30 0.00 -1.00 0.00 0.00 55.97 55.71 2wn1 s LYS 23 Cb 0.00 -1.85 -0.03 0.00 -2.06 0.00 0.00 37.83 33.89 2wn1 s LYS 23 CO 0.00 -1.97 1.19 0.00 0.10 0.00 0.00 175.35 174.67 2wn1 s ALA 24 N -2.90 3.51 -2.16 0.59 0.00 -1.26 -1.27 121.76 118.27 2wn1 s ALA 24 Ca 0.62 0.58 0.22 0.00 0.00 0.00 0.00 51.96 53.39 2wn1 s ALA 24 Cb -0.18 -3.52 0.50 0.00 0.00 0.00 0.00 23.12 19.92 2wn1 s ALA 24 CO 0.57 -0.80 1.44 1.28 0.00 0.00 0.00 175.76 178.24 2wn1 n LEU 25 N 5.36 3.62 0.00 0.00 4.77 -0.22 -4.96 117.00 125.57 2wn1 n LEU 25 Ca 0.11 -1.72 0.00 0.00 -0.03 0.00 0.00 56.01 54.37 2wn1 n LEU 25 Cb 0.46 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2wn1 n LEU 25 CO 0.55 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 178.06 2wn1 n GLY 26 N 1.49 0.21 3.34 -0.72 0.00 -1.24 -0.48 105.19 107.79 2wn1 n GLY 26 Ca 0.21 -1.98 -0.21 0.00 0.00 0.00 0.00 46.02 44.04 2wn1 n GLY 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wn1 s THR 27 N 0.00 0.13 -0.04 2.61 -4.23 -1.08 -1.24 115.64 111.79 2wn1 s THR 27 Ca 0.00 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 2wn1 s THR 27 Cb 0.00 -2.45 0.03 0.00 1.34 0.00 0.00 72.50 71.42 2wn1 s THR 27 CO 0.00 0.00 0.08 -0.69 -0.54 0.00 0.00 174.62 173.47 2wn1 s VAL 28 N -3.40 -0.09 -0.12 2.29 1.01 -0.40 -0.61 120.40 119.08 2wn1 s VAL 28 Ca 0.36 0.27 -0.19 0.00 0.00 0.00 0.00 61.98 62.42 2wn1 s VAL 28 Cb 0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 2wn1 s VAL 28 CO 0.24 0.11 0.52 -0.89 0.00 0.00 0.00 175.10 175.09 2wn1 s THR 29 N 1.49 5.15 -0.25 3.92 2.01 0.55 -1.20 115.64 127.32 2wn1 s THR 29 Ca -0.05 1.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.94 2wn1 s THR 29 Cb -0.12 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2wn1 s THR 29 CO -0.04 0.29 0.02 -0.69 -0.69 0.00 0.00 174.62 173.51 2wn1 s VAL 30 N 0.78 3.75 -0.04 3.82 1.01 0.47 -0.46 120.40 129.72 2wn1 s VAL 30 Ca 0.28 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.83 2wn1 s VAL 30 Cb -0.16 -2.78 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 2wn1 s VAL 30 CO 0.11 0.31 -0.19 -0.89 0.00 0.00 0.00 175.10 174.45 2wn1 s THR 31 N 1.51 1.54 -0.03 3.92 2.01 -0.34 -0.40 115.64 123.86 2wn1 s THR 31 Ca 0.05 -0.79 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 2wn1 s THR 31 Cb -0.15 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.02 2wn1 s THR 31 CO -0.00 0.44 1.03 -1.61 -0.69 0.00 0.00 174.62 173.79 2wn1 s GLU 32 N -0.09 4.49 0.49 4.92 2.02 0.21 -0.38 118.70 130.36 2wn1 s GLU 32 Ca -0.01 1.47 0.02 0.00 0.02 0.00 0.00 54.97 56.46 2wn1 s GLU 32 Cb -0.11 -3.48 -0.01 0.00 0.10 0.00 0.00 34.13 30.63 2wn1 s GLU 32 CO 0.02 -0.19 0.05 0.95 0.02 0.00 0.00 175.26 176.11 2wn1 s THR 33 N 1.43 0.87 -1.97 3.63 -4.23 -0.91 -4.68 115.64 109.78 2wn1 s THR 33 Ca 0.52 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.26 2wn1 s THR 33 Cb -0.21 -2.14 0.63 0.00 1.34 0.00 0.00 72.50 72.12 2wn1 s THR 33 CO 0.24 0.00 1.74 0.00 -0.54 0.00 0.00 174.62 176.06 2wn1 n ALA 34 N -1.17 2.34 -0.42 3.99 0.00 -1.26 -3.07 120.51 120.91 2wn1 n ALA 34 Ca -0.16 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2wn1 n ALA 34 Cb 0.66 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.74 2wn1 n ALA 34 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wn1 n TYR 35 N -1.02 0.00 0.00 0.00 4.01 -1.26 -5.13 117.16 113.77 2wn1 n TYR 35 Ca 0.17 -0.22 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 2wn1 n TYR 35 Cb 0.08 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 2wn1 n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wn1 n GLY 36 N -0.22 0.86 3.70 2.72 0.00 -1.17 -4.33 105.19 106.75 2wn1 n GLY 36 Ca 0.00 -2.29 -0.42 0.00 0.00 0.00 0.00 46.02 43.31 2wn1 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wn1 s LEU 37 N 0.00 4.34 -0.24 0.99 1.43 -0.47 -2.15 118.68 122.58 2wn1 s LEU 37 Ca 0.00 2.03 -0.08 0.00 -1.03 0.00 0.00 54.13 55.04 2wn1 s LEU 37 Cb 0.00 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.61 2wn1 s LEU 37 CO 0.00 -0.57 0.10 -0.22 0.23 0.00 0.00 176.35 175.89 2wn1 s LEU 38 N 1.62 3.72 -0.50 1.79 2.96 0.49 -1.09 118.68 127.67 2wn1 s LEU 38 Ca 0.60 -0.06 -0.16 0.00 -0.22 0.00 0.00 54.13 54.28 2wn1 s LEU 38 Cb -0.30 -1.99 0.08 0.00 0.50 0.00 0.00 46.19 44.48 2wn1 s LEU 38 CO 0.27 0.02 0.47 -0.36 -1.32 0.00 0.00 176.35 175.44 2wn1 s PHE 39 N 1.29 3.20 -0.42 5.38 0.40 -0.04 -1.20 117.98 126.59 2wn1 s PHE 39 Ca 0.06 -0.94 -0.17 0.00 -0.60 0.00 0.00 56.93 55.28 2wn1 s PHE 39 Cb -0.15 -3.41 0.03 0.00 0.51 0.00 0.00 43.02 40.00 2wn1 s PHE 39 CO 0.05 -0.91 0.40 0.99 0.70 0.00 0.00 175.22 176.45 2wn1 s THR 40 N 1.86 5.14 0.48 0.64 2.01 0.39 -1.45 115.64 124.71 2wn1 s THR 40 Ca 0.06 -0.49 -0.20 0.00 0.31 0.00 0.00 61.69 61.37 2wn1 s THR 40 Cb -0.25 -4.02 -0.09 0.00 0.01 0.00 0.00 72.50 68.15 2wn1 s THR 40 CO 0.07 -0.42 1.01 -2.84 -0.69 0.00 0.00 174.62 171.76 2wn1 s PRO 41 N 1.99 3.88 -0.34 4.92 0.02 -1.26 -0.33 135.00 143.88 2wn1 s PRO 41 Ca 0.10 1.26 0.16 0.00 0.02 0.00 0.00 61.00 62.54 2wn1 s PRO 41 Cb -0.18 -2.11 0.44 0.00 0.02 0.00 0.00 34.50 32.66 2wn1 s PRO 41 CO 0.12 -0.35 0.92 0.72 -0.33 0.00 0.00 177.00 178.08 2wn1 n HIS 42 N -1.00 1.11 -3.82 6.54 8.25 0.22 -4.23 115.22 122.29 2wn1 n HIS 42 Ca 0.08 -2.99 -0.20 0.00 -0.26 0.00 0.00 57.72 54.35 2wn1 n HIS 42 Cb 0.53 -0.37 -0.02 0.00 1.12 0.00 0.00 29.99 31.25 2wn1 n HIS 42 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wn1 s LEU 43 N -3.03 4.13 0.08 2.41 1.43 -1.01 -2.62 118.68 120.07 2wn1 s LEU 43 Ca 0.30 -0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 53.29 2wn1 s LEU 43 Cb 0.44 -2.75 -0.02 0.00 0.03 0.00 0.00 46.19 43.89 2wn1 s LEU 43 CO 0.01 -0.19 0.10 0.28 0.23 0.00 0.00 176.35 176.78 2wn1 s THR 44 N -2.07 0.16 -1.00 5.49 -1.32 0.37 -1.79 115.64 115.48 2wn1 s THR 44 Ca 0.38 -1.49 -0.02 0.00 -1.21 0.00 0.00 61.69 59.34 2wn1 s THR 44 Cb -0.09 -1.50 0.00 0.00 -1.51 0.00 0.00 72.50 69.40 2wn1 s THR 44 CO 0.29 -0.74 0.31 0.61 -2.21 0.00 0.00 174.62 172.88 2wn1 n GLY 45 N -0.01 -0.09 3.72 6.08 0.00 -0.96 -4.80 105.19 109.13 2wn1 n GLY 45 Ca -0.13 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 2wn1 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wn1 s LEU 46 N -4.23 3.46 0.14 0.99 1.43 0.11 -5.06 118.68 115.52 2wn1 s LEU 46 Ca 0.15 -0.42 -0.31 0.00 -1.03 0.00 0.00 54.13 52.52 2wn1 s LEU 46 Cb -0.07 -2.02 -0.08 0.00 0.03 0.00 0.00 46.19 44.05 2wn1 s LEU 46 CO 0.19 0.02 1.39 0.00 0.23 0.00 0.00 176.35 178.18 2wn1 s ALA 47 N -2.07 3.59 0.45 4.21 0.00 -1.26 -4.30 121.76 122.38 2wn1 s ALA 47 Ca 0.31 1.14 -0.25 0.00 0.00 0.00 0.00 51.96 53.16 2wn1 s ALA 47 Cb -0.08 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 2wn1 s ALA 47 CO 0.21 -0.62 1.44 -2.30 0.00 0.00 0.00 175.76 174.50 2wn1 n PRO 48 N 3.66 2.29 0.00 0.00 -0.02 -1.26 -4.75 135.00 134.93 2wn1 n PRO 48 Ca 0.11 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2wn1 n PRO 48 Cb 0.42 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2wn1 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wn1 n GLY 49 N 0.56 0.61 3.47 -1.23 0.00 -0.72 -4.96 105.19 102.93 2wn1 n GLY 49 Ca 0.05 -2.16 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 2wn1 n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wn1 s ILE 50 N -0.89 4.32 -0.01 -0.61 1.01 -1.26 -0.26 121.20 123.50 2wn1 s ILE 50 Ca 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 60.65 60.51 2wn1 s ILE 50 Cb 0.00 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 2wn1 s ILE 50 CO 0.00 0.37 -0.09 -1.00 0.00 0.00 0.00 174.94 174.22 2wn1 s HIS 51 N 1.32 2.83 0.14 3.97 3.76 0.04 -3.61 115.29 123.74 2wn1 s HIS 51 Ca 0.05 -0.07 -0.33 0.00 -0.15 0.00 0.00 55.06 54.56 2wn1 s HIS 51 Cb -0.15 -1.61 -0.13 0.00 1.11 0.00 0.00 32.58 31.81 2wn1 s HIS 51 CO 0.03 0.33 1.70 0.41 -0.85 0.00 0.00 174.74 176.36 2wn1 n GLY 52 N 1.75 1.36 2.64 -2.22 0.00 0.00 -0.64 105.19 108.07 2wn1 n GLY 52 Ca -0.16 0.68 -0.29 0.00 0.00 0.00 0.00 46.02 46.25 2wn1 n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wn1 s PHE 53 N 1.69 1.08 0.11 1.61 5.36 -1.26 -0.25 117.98 126.32 2wn1 s PHE 53 Ca 0.80 -1.40 0.03 0.00 -0.96 0.00 0.00 56.93 55.40 2wn1 s PHE 53 Cb -0.60 -1.34 -0.04 0.00 -0.34 0.00 0.00 43.02 40.70 2wn1 s PHE 53 CO 0.38 -0.85 -0.09 -1.01 -1.46 0.00 0.00 175.22 172.19 2wn1 s HIS 54 N 1.73 1.05 -0.21 10.12 3.76 -0.74 -2.56 115.29 128.45 2wn1 s HIS 54 Ca 0.10 -0.79 -0.14 0.00 -0.15 0.00 0.00 55.06 54.08 2wn1 s HIS 54 Cb -0.17 -0.57 -0.04 0.00 1.11 0.00 0.00 32.58 32.90 2wn1 s HIS 54 CO -0.27 -0.03 0.32 -0.51 -0.85 0.00 0.00 174.74 173.39 2wn1 s LEU 55 N -2.92 4.16 0.14 0.89 1.43 0.31 0.23 118.68 122.92 2wn1 s LEU 55 Ca 0.12 0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.66 2wn1 s LEU 55 Cb 0.02 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 2wn1 s LEU 55 CO -0.02 -0.01 0.21 -1.00 0.23 0.00 0.00 176.35 175.76 2wn1 s HIS 56 N 1.11 3.34 0.05 0.29 3.76 0.59 -0.77 115.29 123.65 2wn1 s HIS 56 Ca 0.16 0.07 -0.15 0.00 -0.15 0.00 0.00 55.06 54.99 2wn1 s HIS 56 Cb -0.14 -1.61 -0.06 0.00 1.11 0.00 0.00 32.58 31.88 2wn1 s HIS 56 CO 0.06 0.52 1.24 0.93 -0.85 0.00 0.00 174.74 176.64 2wn1 h GLU 57 N 2.39 -0.30 -6.40 1.40 5.08 -1.01 -2.78 114.58 112.97 2wn1 h GLU 57 Ca -0.48 0.02 -0.55 0.00 -1.00 0.00 0.00 59.36 57.36 2wn1 h GLU 57 Cb 1.19 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.47 2wn1 h GLU 57 CO 0.67 -0.20 0.06 0.15 -1.00 0.00 0.00 179.01 178.69 2wn1 s LYS 58 N -4.18 4.34 -1.14 2.33 1.02 -0.05 -4.59 119.74 117.46 2wn1 s LYS 58 Ca -0.07 0.90 -0.14 0.00 0.02 0.00 0.00 55.97 56.68 2wn1 s LYS 58 Cb 0.03 -3.18 -0.07 0.00 -0.52 0.00 0.00 37.83 34.09 2wn1 s LYS 58 CO 0.26 0.57 2.22 -2.30 -0.92 0.00 0.00 175.35 175.18 2wn1 n PRO 59 N 1.48 2.38 -3.68 -1.68 -0.02 -1.25 -3.59 135.00 128.63 2wn1 n PRO 59 Ca -0.07 -2.05 -0.15 0.00 -2.02 0.00 0.00 63.50 59.21 2wn1 n PRO 59 Cb 0.50 -2.92 -0.08 0.00 -0.02 0.00 0.00 33.50 30.98 2wn1 n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wn1 s SER 60 N 3.69 -0.40 -0.10 2.55 0.15 -1.26 -4.96 113.70 113.36 2wn1 s SER 60 Ca 0.53 0.50 0.14 0.00 0.70 0.00 0.00 55.95 57.81 2wn1 s SER 60 Cb 0.14 0.56 0.22 0.00 -1.71 0.00 0.00 66.02 65.22 2wn1 s SER 60 CO -0.00 -0.42 1.10 0.00 1.20 0.00 0.00 173.24 175.12 2wn1 s ALA 62 N -2.29 2.93 0.95 0.00 0.00 -1.26 -3.86 121.76 118.22 2wn1 s ALA 62 Ca 0.24 0.31 -0.12 0.00 0.00 0.00 0.00 51.96 52.39 2wn1 s ALA 62 Cb 0.21 -3.17 0.16 0.00 0.00 0.00 0.00 23.12 20.32 2wn1 s ALA 62 CO 0.02 -0.44 1.09 -2.14 0.00 0.00 0.00 175.76 174.29 2wn1 s PRO 63 N -3.96 0.81 0.27 0.00 0.02 -1.26 -1.74 135.00 129.14 2wn1 s PRO 63 Ca 0.61 0.95 0.00 0.00 0.02 0.00 0.00 61.00 62.58 2wn1 s PRO 63 Cb -0.13 -1.75 -0.03 0.00 0.02 0.00 0.00 34.50 32.62 2wn1 s PRO 63 CO 0.31 -2.59 0.26 0.20 -0.33 0.00 0.00 177.00 174.86 2wn1 s GLY 64 N -3.13 1.63 -0.20 0.52 0.00 -0.40 -4.31 107.32 101.44 2wn1 s GLY 64 Ca 0.65 -1.70 -0.04 0.00 0.00 0.00 0.00 44.72 43.62 2wn1 s GLY 64 CO 0.59 -1.28 -0.02 1.06 0.00 0.00 0.00 173.10 173.45 2wn1 s MET 65 N -3.76 3.56 -0.07 2.90 -1.94 -1.26 -1.15 119.30 117.57 2wn1 s MET 65 Ca 0.37 -0.55 -0.02 0.00 -1.71 0.00 0.00 55.69 53.78 2wn1 s MET 65 Cb 0.04 -3.03 0.03 0.00 2.01 0.00 0.00 34.83 33.88 2wn1 s MET 65 CO 0.18 -0.01 0.03 0.15 -0.01 0.00 0.00 175.02 175.36 2wn1 s LYS 66 N 1.03 0.29 -1.77 2.03 1.02 -0.88 -4.79 119.74 116.66 2wn1 s LYS 66 Ca 0.01 0.18 0.00 0.00 0.02 0.00 0.00 55.97 56.19 2wn1 s LYS 66 Cb -0.14 -0.89 0.00 0.00 -0.52 0.00 0.00 37.83 36.27 2wn1 s LYS 66 CO 0.01 -0.36 0.00 -0.40 -0.92 0.00 0.00 175.35 173.69 2wn1 n ASP 67 N 5.21 -5.26 0.00 2.83 3.85 -1.26 -1.81 116.55 120.12 2wn1 n ASP 67 Ca -0.05 0.21 0.00 0.00 -0.71 0.00 0.00 54.79 54.23 2wn1 n ASP 67 Cb 0.50 -4.51 0.00 0.00 -1.35 0.00 0.00 41.12 35.76 2wn1 n ASP 67 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2wn1 n GLY 68 N -0.72 1.29 3.98 6.12 0.00 -1.26 -5.05 105.19 109.54 2wn1 n GLY 68 Ca -0.21 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.61 2wn1 n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wn1 s LYS 69 N -0.64 3.16 -0.22 1.61 0.00 -0.75 -5.07 119.74 117.83 2wn1 s LYS 69 Ca 0.00 -0.83 -0.20 0.00 0.00 0.00 0.00 55.97 54.94 2wn1 s LYS 69 Cb 0.00 -2.76 -0.02 0.00 0.00 0.00 0.00 37.83 35.04 2wn1 s LYS 69 CO 0.00 0.04 0.62 0.00 0.00 0.00 0.00 175.35 176.00 2wn1 s ALA 70 N -2.24 3.58 -0.20 0.59 0.00 -1.26 -2.08 121.76 120.14 2wn1 s ALA 70 Ca 0.44 -0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.04 2wn1 s ALA 70 Cb -0.10 -2.99 0.02 0.00 0.00 0.00 0.00 23.12 20.06 2wn1 s ALA 70 CO 0.33 -0.67 -0.15 0.08 0.00 0.00 0.00 175.76 175.35 2wn1 s VAL 71 N 2.17 2.32 0.15 0.00 1.01 -0.30 -4.82 120.40 120.93 2wn1 s VAL 71 Ca 0.27 -1.00 -0.34 0.00 0.00 0.00 0.00 61.98 60.92 2wn1 s VAL 71 Cb -0.16 -2.07 -0.13 0.00 0.00 0.00 0.00 36.38 34.02 2wn1 s VAL 71 CO 0.09 0.41 1.62 -2.65 0.00 0.00 0.00 175.10 174.57 2wn1 n PRO 72 N 4.62 2.26 -2.20 2.72 -0.02 -1.26 -1.27 135.00 139.84 2wn1 n PRO 72 Ca -0.19 0.82 -0.18 0.00 -2.02 0.00 0.00 63.50 61.92 2wn1 n PRO 72 Cb 0.49 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 2wn1 n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wn1 n ALA 73 N 3.75 -0.57 0.21 3.55 0.00 -1.20 -4.55 120.51 121.70 2wn1 n ALA 73 Ca 0.17 0.18 0.08 0.00 0.00 0.00 0.00 53.44 53.88 2wn1 n ALA 73 Cb 0.30 -1.96 0.45 0.00 0.00 0.00 0.00 19.45 18.24 2wn1 n ALA 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wn1 h LEU 74 N 0.00 0.00 0.00 0.00 5.85 -1.35 -2.97 115.31 116.84 2wn1 h LEU 74 Ca -0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.30 2wn1 h LEU 74 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.32 2wn1 h LEU 74 CO 0.53 0.28 0.00 0.00 -0.34 0.00 0.00 178.44 178.90 2wn1 n ALA 75 N -2.29 1.48 0.73 1.25 0.00 -0.71 -2.15 120.51 118.83 2wn1 n ALA 75 Ca -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.52 2wn1 n ALA 75 Cb 0.42 -1.14 0.49 0.00 0.00 0.00 0.00 19.45 19.22 2wn1 n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wn1 n ALA 76 N -1.39 2.14 -0.33 0.00 0.00 -1.12 -4.58 120.51 115.23 2wn1 n ALA 76 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2wn1 n ALA 76 Cb 0.08 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2wn1 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wn1 n GLY 77 N 1.03 -0.90 0.00 0.00 0.00 -0.91 -0.87 105.19 103.54 2wn1 n GLY 77 Ca 0.05 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.90 2wn1 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn1 n GLY 78 N 0.00 0.04 3.78 -0.02 0.00 -1.26 -4.67 105.19 103.07 2wn1 n GLY 78 Ca 0.00 -1.65 -0.38 0.00 0.00 0.00 0.00 46.02 43.99 2wn1 n GLY 78 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wn1 s HIS 79 N 0.32 3.82 -0.21 1.61 3.76 -1.26 -1.06 115.29 122.27 2wn1 s HIS 79 Ca 0.00 1.63 -0.38 0.00 -0.15 0.00 0.00 55.06 56.16 2wn1 s HIS 79 Cb 0.00 -2.78 -0.14 0.00 1.11 0.00 0.00 32.58 30.77 2wn1 s HIS 79 CO 0.00 0.41 1.79 -0.11 -0.85 0.00 0.00 174.74 175.98 2wn1 n LEU 80 N 1.19 2.77 -2.99 0.89 7.94 0.05 -4.49 117.00 122.36 2wn1 n LEU 80 Ca -0.03 1.04 -0.15 0.00 -1.11 0.00 0.00 56.01 55.76 2wn1 n LEU 80 Cb 0.49 -1.23 0.01 0.00 0.53 0.00 0.00 43.42 43.23 2wn1 n LEU 80 CO 0.45 -0.30 -0.00 -0.67 -1.11 0.00 0.00 177.39 175.76 2wn1 n ASP 81 N 5.80 -0.78 0.26 1.96 2.03 -1.26 -1.36 116.55 123.20 2wn1 n ASP 81 Ca 0.25 -3.22 0.09 0.00 0.52 0.00 0.00 54.79 52.43 2wn1 n ASP 81 Cb 0.19 0.52 0.69 0.00 -0.72 0.00 0.00 41.12 41.79 2wn1 n ASP 81 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wn1 h PRO 82 N 3.29 0.00 -0.00 -0.67 0.11 -1.95 -0.23 132.00 132.55 2wn1 h PRO 82 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2wn1 h PRO 82 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2wn1 h PRO 82 CO 0.35 0.02 -0.03 0.09 -0.21 0.00 0.00 178.00 178.22 2wn1 n ASN 83 N -4.35 0.10 -3.63 -2.05 4.13 -1.26 -4.93 115.26 103.27 2wn1 n ASN 83 Ca -0.03 -0.18 -0.22 0.00 1.68 0.00 0.00 54.58 55.83 2wn1 n ASN 83 Cb 0.11 -0.25 0.06 0.00 -1.54 0.00 0.00 39.78 38.16 2wn1 n ASN 83 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2wn1 n LYS 84 N -1.24 -6.14 0.10 3.52 4.01 -0.10 -4.89 118.16 113.41 2wn1 n LYS 84 Ca 0.14 0.73 -0.04 0.00 -0.51 0.00 0.00 58.31 58.62 2wn1 n LYS 84 Cb 0.26 -5.58 0.02 0.00 -0.51 0.00 0.00 35.03 29.22 2wn1 n LYS 84 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 2wn1 h THR 85 N -2.08 1.56 -5.27 -0.18 1.35 -1.89 -3.48 112.91 102.92 2wn1 h THR 85 Ca -0.59 -2.79 -0.41 0.00 -0.55 0.00 0.00 66.41 62.07 2wn1 h THR 85 Cb 1.36 2.51 0.06 0.00 -1.73 0.00 0.00 68.15 70.35 2wn1 h THR 85 CO 0.56 0.79 -0.65 0.61 -0.25 0.00 0.00 175.52 176.58 2wn1 n GLY 86 N 0.85 -0.53 3.43 5.82 0.00 -1.26 -4.99 105.19 108.51 2wn1 n GLY 86 Ca -0.00 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 2wn1 n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wn1 s VAL 87 N -3.22 -0.00 -0.34 1.61 0.11 -1.26 -5.07 120.40 112.22 2wn1 s VAL 87 Ca 0.46 0.01 -0.20 0.00 -2.93 0.00 0.00 61.98 59.32 2wn1 s VAL 87 Cb -0.21 -0.74 -0.00 0.00 -1.53 0.00 0.00 36.38 33.89 2wn1 s VAL 87 CO 0.57 0.01 0.60 -2.28 -3.33 0.00 0.00 175.10 170.66 2wn1 s HIS 88 N 0.56 3.17 0.00 1.54 2.46 -1.26 -1.09 115.29 120.67 2wn1 s HIS 88 Ca -0.02 0.36 0.00 0.00 0.47 0.00 0.00 55.06 55.87 2wn1 s HIS 88 Cb -0.04 -3.04 0.00 0.00 -0.13 0.00 0.00 32.58 29.37 2wn1 s HIS 88 CO -0.03 -0.56 0.52 1.28 -2.47 0.00 0.00 174.74 173.48 2wn1 n LEU 89 N 5.92 0.52 0.00 8.88 4.77 -1.25 -3.52 117.00 132.32 2wn1 n LEU 89 Ca -0.02 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2wn1 n LEU 89 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2wn1 n LEU 89 CO 0.47 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2wn1 n GLY 90 N -0.11 -3.33 0.06 -0.72 0.00 -1.24 -4.34 105.19 95.51 2wn1 n GLY 90 Ca 0.00 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.27 2wn1 n GLY 90 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wn1 n PRO 91 N -0.33 0.15 -0.05 1.61 -0.02 -1.19 -3.71 135.00 131.45 2wn1 n PRO 91 Ca 0.00 0.15 0.03 0.00 -2.02 0.00 0.00 63.50 61.66 2wn1 n PRO 91 Cb 0.00 -1.68 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 2wn1 n PRO 91 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2wn1 n TYR 92 N -1.94 0.14 -4.03 6.00 0.53 -1.26 -4.28 117.16 112.32 2wn1 n TYR 92 Ca 0.06 -0.32 -0.31 0.00 -1.02 0.00 0.00 57.90 56.30 2wn1 n TYR 92 Cb 0.37 -0.03 -0.16 0.00 -1.03 0.00 0.00 39.34 38.49 2wn1 n TYR 92 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 2wn1 s ASN 93 N -0.80 3.13 0.00 7.72 3.84 -1.24 -5.00 114.94 122.58 2wn1 s ASN 93 Ca 0.09 -0.72 0.13 0.00 0.21 0.00 0.00 52.86 52.58 2wn1 s ASN 93 Cb 0.05 -1.27 0.60 0.00 -0.55 0.00 0.00 41.25 40.08 2wn1 s ASN 93 CO 0.07 -0.09 1.40 0.47 -2.79 0.00 0.00 177.10 176.16 2wn1 n ASP 94 N 4.69 0.00 -0.51 -4.21 8.00 -1.26 -3.05 116.55 120.21 2wn1 n ASP 94 Ca -0.17 0.36 0.09 0.00 0.71 0.00 0.00 54.79 55.78 2wn1 n ASP 94 Cb 0.48 -0.43 0.32 0.00 -0.02 0.00 0.00 41.12 41.48 2wn1 n ASP 94 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wn1 n LYS 95 N -1.43 1.66 -3.14 -1.24 5.02 -1.26 -4.92 118.16 112.85 2wn1 n LYS 95 Ca 0.04 -1.00 -0.12 0.00 -2.02 0.00 0.00 58.31 55.21 2wn1 n LYS 95 Cb 0.14 -1.34 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 2wn1 n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wn1 n GLY 96 N 1.06 3.70 3.66 0.72 0.00 -1.17 -4.76 105.19 108.41 2wn1 n GLY 96 Ca 0.14 -2.02 -0.55 0.00 0.00 0.00 0.00 46.02 43.59 2wn1 n GLY 96 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wn1 n HIS 97 N -0.44 2.03 0.32 1.61 8.25 -0.25 -4.81 115.22 121.93 2wn1 n HIS 97 Ca -0.03 0.40 0.19 0.00 -0.26 0.00 0.00 57.72 58.02 2wn1 n HIS 97 Cb 0.29 -2.51 1.01 0.00 1.12 0.00 0.00 29.99 29.90 2wn1 n HIS 97 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2wn1 h LEU 98 N 8.42 0.00 -1.00 2.41 5.85 -1.77 -0.94 115.31 128.28 2wn1 h LEU 98 Ca -0.43 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2wn1 h LEU 98 Cb 1.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.34 2wn1 h LEU 98 CO 0.97 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 179.68 2wn1 n GLY 99 N -1.19 0.67 3.53 3.75 0.00 -0.46 -4.82 105.19 106.67 2wn1 n GLY 99 Ca -0.02 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 2wn1 n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wn1 s ASP 100 N -0.62 6.36 0.25 1.61 1.01 -0.36 -0.53 116.67 124.40 2wn1 s ASP 100 Ca 0.11 -0.28 0.04 0.00 0.71 0.00 0.00 52.55 53.13 2wn1 s ASP 100 Cb 0.07 -2.43 -0.03 0.00 1.01 0.00 0.00 42.92 41.54 2wn1 s ASP 100 CO 0.05 -1.16 0.38 -0.76 0.21 0.00 0.00 175.17 173.89 2wn1 s LEU 101 N 3.82 4.28 0.87 1.23 1.43 -1.06 -3.17 118.68 126.08 2wn1 s LEU 101 Ca 0.31 0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 53.41 2wn1 s LEU 101 Cb -0.12 -2.92 0.11 0.00 0.03 0.00 0.00 46.19 43.29 2wn1 s LEU 101 CO 0.20 -0.10 1.11 -2.65 0.23 0.00 0.00 176.35 175.15 2wn1 n PRO 102 N -1.44 -0.15 -1.75 1.29 -0.02 -1.26 -4.58 135.00 127.09 2wn1 n PRO 102 Ca -0.08 0.03 -0.40 0.00 -2.02 0.00 0.00 63.50 61.02 2wn1 n PRO 102 Cb 0.57 -2.36 0.01 0.00 -0.02 0.00 0.00 33.50 31.70 2wn1 n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wn1 n GLY 103 N 0.50 0.94 3.67 -1.23 0.00 -1.26 -4.49 105.19 103.32 2wn1 n GLY 103 Ca 0.12 0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 2wn1 n GLY 103 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wn1 s LEU 104 N -2.34 4.15 -0.28 0.99 2.96 0.18 -4.81 118.68 119.54 2wn1 s LEU 104 Ca 0.60 1.45 -0.22 0.00 -0.22 0.00 0.00 54.13 55.73 2wn1 s LEU 104 Cb -0.47 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 42.67 2wn1 s LEU 104 CO 0.59 -0.60 0.73 -0.69 -1.32 0.00 0.00 176.35 175.06 2wn1 s VAL 105 N 2.81 4.87 -0.17 1.68 1.01 -1.26 -0.78 120.40 128.56 2wn1 s VAL 105 Ca 0.46 1.21 -0.04 0.00 0.00 0.00 0.00 61.98 63.60 2wn1 s VAL 105 Cb -0.16 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 2wn1 s VAL 105 CO 0.10 -0.13 -0.02 -0.69 0.00 0.00 0.00 175.10 174.37 2wn1 s VAL 106 N 2.77 4.05 1.01 2.92 1.01 0.64 -4.33 120.40 128.47 2wn1 s VAL 106 Ca 0.30 -0.30 -0.15 0.00 0.00 0.00 0.00 61.98 61.84 2wn1 s VAL 106 Cb -0.15 -2.79 0.20 0.00 0.00 0.00 0.00 36.38 33.63 2wn1 s VAL 106 CO 0.10 0.48 1.16 0.20 0.00 0.00 0.00 175.10 177.05 2wn1 s ASN 107 N 0.45 2.65 0.27 3.32 0.01 0.82 -1.75 114.94 120.71 2wn1 s ASN 107 Ca -0.02 0.74 -0.02 0.00 -0.71 0.00 0.00 52.86 52.85 2wn1 s ASN 107 Cb -0.14 -1.13 0.37 0.00 0.41 0.00 0.00 41.25 40.77 2wn1 s ASN 107 CO 0.02 -3.07 1.84 0.00 -1.51 0.00 0.00 177.10 174.38 2wn1 h ALA 108 N -1.86 1.22 0.00 0.60 0.00 -1.97 -1.35 119.26 115.89 2wn1 h ALA 108 Ca -0.48 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2wn1 h ALA 108 Cb 1.30 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2wn1 h ALA 108 CO 0.49 0.56 0.00 -0.40 0.00 0.00 0.00 179.25 179.90 2wn1 n ASP 109 N -4.29 0.00 0.00 0.00 5.68 -1.26 -4.81 116.55 111.87 2wn1 n ASP 109 Ca 0.05 -0.24 0.00 0.00 -0.50 0.00 0.00 54.79 54.10 2wn1 n ASP 109 Cb 0.20 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 2wn1 n ASP 109 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wn1 n GLY 110 N 0.32 0.75 3.96 6.12 0.00 -0.51 -4.73 105.19 111.10 2wn1 n GLY 110 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 2wn1 n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wn1 s THR 111 N -2.10 5.10 -0.19 2.61 -4.23 -1.26 -0.71 115.64 114.86 2wn1 s THR 111 Ca 0.00 -0.78 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 2wn1 s THR 111 Cb 0.00 -3.82 0.03 0.00 1.34 0.00 0.00 72.50 70.05 2wn1 s THR 111 CO 0.00 -0.40 -0.15 0.00 -0.54 0.00 0.00 174.62 173.52 2wn1 s ALA 112 N -2.13 2.19 0.00 3.99 0.00 -0.74 -0.13 121.76 124.95 2wn1 s ALA 112 Ca 0.37 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2wn1 s ALA 112 Cb -0.09 -1.23 0.00 0.00 0.00 0.00 0.00 23.12 21.80 2wn1 s ALA 112 CO 0.32 -0.57 0.00 0.25 0.00 0.00 0.00 175.76 175.76 2wn1 n THR 113 N 4.64 0.00 -2.31 0.00 -2.24 -1.26 -2.42 114.28 110.70 2wn1 n THR 113 Ca -0.18 -0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.11 2wn1 n THR 113 Cb 0.48 0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 69.18 2wn1 n THR 113 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2wn1 s TYR 114 N -0.56 2.48 0.35 4.78 5.04 -1.26 -4.49 117.35 123.69 2wn1 s TYR 114 Ca 0.00 0.75 -0.28 0.00 -2.44 0.00 0.00 57.07 55.10 2wn1 s TYR 114 Cb 0.00 -3.90 -0.10 0.00 0.35 0.00 0.00 41.96 38.31 2wn1 s TYR 114 CO 0.00 -2.18 1.31 -2.14 -1.34 0.00 0.00 175.55 171.20 2wn1 s PRO 115 N 4.29 4.27 -0.09 4.97 0.02 -1.26 -4.54 135.00 142.65 2wn1 s PRO 115 Ca 0.62 2.21 0.03 0.00 0.02 0.00 0.00 61.00 63.87 2wn1 s PRO 115 Cb -0.20 -3.00 0.01 0.00 0.02 0.00 0.00 34.50 31.33 2wn1 s PRO 115 CO 0.25 -0.26 -0.17 0.14 -0.33 0.00 0.00 177.00 176.63 2wn1 s VAL 116 N -1.17 1.53 -0.21 3.83 -7.23 -0.53 -4.97 120.40 111.66 2wn1 s VAL 116 Ca 0.51 -0.69 -0.16 0.00 -1.81 0.00 0.00 61.98 59.82 2wn1 s VAL 116 Cb -0.39 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 2wn1 s VAL 116 CO 0.52 0.45 0.43 -0.22 -0.31 0.00 0.00 175.10 175.97 2wn1 s LEU 117 N 0.70 4.13 -0.64 1.32 2.96 -1.26 -0.86 118.68 125.03 2wn1 s LEU 117 Ca -0.13 0.53 -0.11 0.00 -0.22 0.00 0.00 54.13 54.20 2wn1 s LEU 117 Cb -0.16 -2.56 0.17 0.00 0.50 0.00 0.00 46.19 44.14 2wn1 s LEU 117 CO 0.03 -0.12 0.54 0.00 -1.32 0.00 0.00 176.35 175.48 2wn1 s ALA 118 N 1.52 3.72 0.51 5.97 0.00 -0.25 -4.69 121.76 128.55 2wn1 s ALA 118 Ca 0.20 -2.97 0.29 0.00 0.00 0.00 0.00 51.96 49.48 2wn1 s ALA 118 Cb -0.15 -3.11 1.67 0.00 0.00 0.00 0.00 23.12 21.53 2wn1 s ALA 118 CO 0.09 -2.10 2.18 -1.35 0.00 0.00 0.00 175.76 174.58 2wn1 h PRO 119 N 7.99 0.00 -0.01 0.00 0.11 -1.75 -2.79 132.00 135.55 2wn1 h PRO 119 Ca -0.07 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.86 2wn1 h PRO 119 Cb 1.04 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2wn1 h PRO 119 CO 0.82 0.05 -0.81 0.00 -0.21 0.00 0.00 178.00 177.85 2wn1 h ARG 120 N 0.00 0.15 -6.61 1.05 3.08 -1.86 -3.41 114.38 106.78 2wn1 h ARG 120 Ca -0.00 -0.16 -0.51 0.00 0.07 0.00 0.00 59.98 59.38 2wn1 h ARG 120 Cb 0.15 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2wn1 h ARG 120 CO 0.01 0.88 0.34 -0.51 -1.07 0.00 0.00 179.97 179.62 2wn1 s LEU 121 N -7.46 4.55 0.00 3.04 2.01 -1.06 -4.97 118.68 114.79 2wn1 s LEU 121 Ca -0.02 1.82 0.00 0.00 0.01 0.00 0.00 54.13 55.94 2wn1 s LEU 121 Cb 0.11 -3.57 0.00 0.00 0.01 0.00 0.00 46.19 42.74 2wn1 s LEU 121 CO 0.81 0.02 0.00 0.29 1.01 0.00 0.00 176.35 178.48 2wn1 n LYS 122 N 2.34 0.56 -3.86 1.70 4.76 -1.26 -1.37 118.16 121.02 2wn1 n LYS 122 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 2wn1 n LYS 122 Cb 0.49 -0.97 -0.10 0.00 -1.84 0.00 0.00 35.03 32.61 2wn1 n LYS 122 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2wn1 s SER 123 N -1.95 0.02 0.60 4.39 1.04 -1.26 -4.78 113.70 111.76 2wn1 s SER 123 Ca 0.00 -0.21 0.29 0.00 0.48 0.00 0.00 55.95 56.51 2wn1 s SER 123 Cb 0.00 0.22 1.66 0.00 0.10 0.00 0.00 66.02 68.00 2wn1 s SER 123 CO 0.00 -0.40 2.07 -0.07 0.98 0.00 0.00 173.24 175.82 2wn1 h LEU 124 N 4.15 0.00 -1.59 2.42 3.38 -1.96 -1.08 115.31 120.62 2wn1 h LEU 124 Ca -0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2wn1 h LEU 124 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2wn1 h LEU 124 CO 0.41 0.00 0.04 0.77 0.09 0.00 0.00 178.44 179.76 2wn1 h SER 125 N 0.00 0.28 0.98 -0.43 4.64 -1.96 -1.26 113.55 115.80 2wn1 h SER 125 Ca 0.10 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2wn1 h SER 125 Cb 0.59 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2wn1 h SER 125 CO -0.00 0.29 0.00 -0.62 -0.87 0.00 0.00 176.83 175.63 2wn1 n GLU 126 N -4.40 0.21 -0.02 4.77 1.02 -0.41 -3.13 120.64 118.67 2wn1 n GLU 126 Ca 0.00 0.34 0.07 0.00 -0.02 0.00 0.00 57.16 57.54 2wn1 n GLU 126 Cb 0.15 -1.83 -0.15 0.00 -0.02 0.00 0.00 31.44 29.59 2wn1 n GLU 126 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2wn1 n VAL 127 N -2.21 0.24 -2.03 2.62 0.31 -0.53 -4.98 118.33 111.74 2wn1 n VAL 127 Ca 0.03 -0.52 -0.41 0.00 -0.01 0.00 0.00 64.34 63.44 2wn1 n VAL 127 Cb 0.30 -0.06 -0.01 0.00 -0.91 0.00 0.00 33.84 33.15 2wn1 n VAL 127 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2wn1 s LYS 128 N -3.22 4.25 -0.83 5.55 1.02 -0.85 -3.42 119.74 122.24 2wn1 s LYS 128 Ca -0.08 2.29 -0.05 0.00 0.02 0.00 0.00 55.97 58.16 2wn1 s LYS 128 Cb 0.11 -3.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.42 2wn1 s LYS 128 CO 0.82 -0.31 0.62 1.04 -0.92 0.00 0.00 175.35 176.60 2wn1 n GLN 129 N 0.64 -4.27 -4.12 1.68 1.13 0.12 -5.02 117.38 107.54 2wn1 n GLN 129 Ca 0.01 0.50 -0.08 0.00 -1.94 0.00 0.00 57.00 55.49 2wn1 n GLN 129 Cb 0.41 -4.53 -0.10 0.00 0.11 0.00 0.00 30.24 26.13 2wn1 n GLN 129 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2wn1 s HIS 130 N -3.12 0.66 -0.23 1.08 3.76 -1.22 -3.94 115.29 112.29 2wn1 s HIS 130 Ca 0.31 -1.05 -0.17 0.00 -0.15 0.00 0.00 55.06 54.00 2wn1 s HIS 130 Cb -0.13 -0.44 -0.03 0.00 1.11 0.00 0.00 32.58 33.08 2wn1 s HIS 130 CO 0.38 -0.33 0.47 0.00 -0.85 0.00 0.00 174.74 174.41 2wn1 s ALA 131 N -3.85 3.57 -0.47 -1.40 0.00 -1.05 -0.87 121.76 117.69 2wn1 s ALA 131 Ca 0.10 -0.55 -0.26 0.00 0.00 0.00 0.00 51.96 51.25 2wn1 s ALA 131 Cb 0.07 -2.79 0.03 0.00 0.00 0.00 0.00 23.12 20.44 2wn1 s ALA 131 CO -0.07 -0.54 0.99 -1.17 0.00 0.00 0.00 175.76 174.97 2wn1 s LEU 132 N 1.85 3.90 -0.10 0.00 2.96 -0.25 -0.30 118.68 126.74 2wn1 s LEU 132 Ca 0.21 0.22 -0.04 0.00 -0.22 0.00 0.00 54.13 54.30 2wn1 s LEU 132 Cb -0.15 -3.30 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 2wn1 s LEU 132 CO 0.09 -1.11 0.06 -0.32 -1.32 0.00 0.00 176.35 173.75 2wn1 s MET 133 N 3.96 3.18 -0.15 1.98 -2.45 0.14 -2.23 119.30 123.72 2wn1 s MET 133 Ca 0.40 -0.29 0.01 0.00 -1.25 0.00 0.00 55.69 54.56 2wn1 s MET 133 Cb -0.09 -2.96 0.02 0.00 1.25 0.00 0.00 34.83 33.05 2wn1 s MET 133 CO 0.28 0.73 -0.18 0.42 1.05 0.00 0.00 175.02 177.32 2wn1 s ILE 134 N -0.93 1.85 0.42 10.11 1.01 0.35 -1.79 121.20 132.21 2wn1 s ILE 134 Ca 0.14 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.99 2wn1 s ILE 134 Cb -0.12 -1.68 -0.00 0.00 0.01 0.00 0.00 42.46 40.67 2wn1 s ILE 134 CO 0.03 0.51 0.60 -1.00 0.00 0.00 0.00 174.94 175.08 2wn1 s HIS 135 N 1.16 3.13 -0.00 3.97 3.76 0.65 -1.55 115.29 126.41 2wn1 s HIS 135 Ca -0.00 0.02 -0.22 0.00 -0.15 0.00 0.00 55.06 54.70 2wn1 s HIS 135 Cb -0.14 -2.24 -0.19 0.00 1.11 0.00 0.00 32.58 31.12 2wn1 s HIS 135 CO -0.08 -0.29 1.21 0.00 -0.85 0.00 0.00 174.74 174.73 2wn1 h ALA 136 N 0.55 0.12 -4.56 -1.40 0.00 -1.09 -3.37 119.26 109.51 2wn1 h ALA 136 Ca -0.45 -0.38 -0.43 0.00 0.00 0.00 0.00 54.91 53.65 2wn1 h ALA 136 Cb 1.26 -0.01 0.13 0.00 0.00 0.00 0.00 17.79 19.16 2wn1 h ALA 136 CO 0.55 0.07 0.27 0.41 0.00 0.00 0.00 179.25 180.55 2wn1 n GLY 137 N 0.55 -0.54 0.00 0.00 0.00 0.86 -4.85 105.19 101.22 2wn1 n GLY 137 Ca -0.08 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.09 2wn1 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn1 n GLY 138 N -2.88 0.60 3.21 -0.02 0.00 -1.24 -0.82 105.19 104.05 2wn1 n GLY 138 Ca 0.16 -1.63 0.03 0.00 0.00 0.00 0.00 46.02 44.59 2wn1 n GLY 138 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wn1 s ASP 139 N -1.00 -1.33 -0.08 1.61 -1.08 -1.19 -2.62 116.67 110.98 2wn1 s ASP 139 Ca 0.00 0.95 0.17 0.00 -0.52 0.00 0.00 52.55 53.14 2wn1 s ASP 139 Cb 0.00 2.16 0.62 0.00 -1.46 0.00 0.00 42.92 44.24 2wn1 s ASP 139 CO 0.00 -0.25 1.51 -0.46 0.52 0.00 0.00 175.17 176.49 2wn1 n ASN 140 N 5.43 4.08 -2.57 -0.34 6.94 -1.08 -4.82 115.26 122.89 2wn1 n ASN 140 Ca -0.03 -2.32 -0.20 0.00 -0.02 0.00 0.00 54.58 52.01 2wn1 n ASN 140 Cb 0.51 -0.52 0.02 0.00 -2.36 0.00 0.00 39.78 37.42 2wn1 n ASN 140 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2wn1 n TYR 141 N 1.04 -1.47 -3.96 -2.53 0.53 -1.26 -4.98 117.16 104.53 2wn1 n TYR 141 Ca 0.22 0.29 -0.10 0.00 -1.02 0.00 0.00 57.90 57.30 2wn1 n TYR 141 Cb 0.75 -4.07 -0.06 0.00 -1.03 0.00 0.00 39.34 34.93 2wn1 n TYR 141 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 2wn1 s SER 142 N -2.49 -0.04 0.00 7.72 0.15 -1.25 -3.63 113.70 114.17 2wn1 s SER 142 Ca 0.17 -0.87 0.26 0.00 0.70 0.00 0.00 55.95 56.21 2wn1 s SER 142 Cb -0.08 0.50 0.69 0.00 -1.71 0.00 0.00 66.02 65.43 2wn1 s SER 142 CO 0.21 -0.99 1.54 0.47 1.20 0.00 0.00 173.24 175.67 2wn1 n ASP 143 N -0.29 2.13 -4.24 5.45 8.00 -1.23 0.31 116.55 126.68 2wn1 n ASP 143 Ca -0.05 -1.71 -0.31 0.00 0.71 0.00 0.00 54.79 53.43 2wn1 n ASP 143 Cb 0.63 -0.01 -0.16 0.00 -0.02 0.00 0.00 41.12 41.55 2wn1 n ASP 143 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2wn1 s HIS 144 N -1.98 2.32 0.09 1.24 2.46 -1.26 -3.40 115.29 114.76 2wn1 s HIS 144 Ca 0.34 -0.71 -0.03 0.00 0.47 0.00 0.00 55.06 55.13 2wn1 s HIS 144 Cb 0.21 -1.53 -0.24 0.00 -0.13 0.00 0.00 32.58 30.89 2wn1 s HIS 144 CO 0.32 -0.23 1.19 -1.35 -2.47 0.00 0.00 174.74 172.20 2wn1 h PRO 145 N 6.15 0.26 -6.05 2.88 0.11 -1.97 -3.48 132.00 129.89 2wn1 h PRO 145 Ca -0.31 -0.40 -0.60 0.00 0.11 0.00 0.00 66.00 64.80 2wn1 h PRO 145 Cb 1.18 0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.39 2wn1 h PRO 145 CO 0.47 1.17 -0.34 -1.64 -0.21 0.00 0.00 178.00 177.45 2wn1 s MET 146 N -2.76 3.62 0.65 1.05 -1.94 -1.25 -5.07 119.30 113.61 2wn1 s MET 146 Ca -0.04 -0.06 -0.17 0.00 -1.71 0.00 0.00 55.69 53.71 2wn1 s MET 146 Cb 0.08 -2.97 -0.00 0.00 2.01 0.00 0.00 34.83 33.94 2wn1 s MET 146 CO 0.87 0.56 1.25 -2.14 -0.01 0.00 0.00 175.02 175.55 2wn1 s PRO 147 N -2.21 2.56 -1.51 2.03 0.02 -1.22 -3.38 135.00 131.29 2wn1 s PRO 147 Ca 0.35 1.93 -0.13 0.00 0.02 0.00 0.00 61.00 63.16 2wn1 s PRO 147 Cb -0.13 -1.86 0.09 0.00 0.02 0.00 0.00 34.50 32.62 2wn1 s PRO 147 CO 0.21 -1.56 0.81 1.28 -0.33 0.00 0.00 177.00 177.41 2wn1 n LEU 148 N -2.03 -2.16 0.00 -5.54 4.77 -1.25 -1.37 117.00 109.42 2wn1 n LEU 148 Ca 0.15 -0.69 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 2wn1 n LEU 148 Cb 0.49 -2.39 0.00 0.00 -2.33 0.00 0.00 43.42 39.19 2wn1 n LEU 148 CO 0.46 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2wn1 n GLY 149 N -1.50 0.58 2.10 -0.72 0.00 0.15 -3.35 105.19 102.44 2wn1 n GLY 149 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 2wn1 n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn1 n GLY 150 N -2.19 0.56 0.24 -0.02 0.00 -0.47 -2.65 105.19 100.66 2wn1 n GLY 150 Ca 0.00 -0.86 0.09 0.00 0.00 0.00 0.00 46.02 45.25 2wn1 n GLY 150 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wn1 h GLY 151 N 0.00 0.00 0.00 -0.02 0.00 -1.50 -3.28 103.07 98.27 2wn1 h GLY 151 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2wn1 h GLY 151 CO 0.11 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.26 2wn1 n GLY 152 N -0.85 3.27 3.75 4.60 0.00 -1.26 -0.10 105.19 114.60 2wn1 n GLY 152 Ca -0.02 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2wn1 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wn1 s ALA 153 N -1.97 2.35 -0.26 4.61 0.00 -1.26 -4.80 121.76 120.42 2wn1 s ALA 153 Ca 0.00 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.48 2wn1 s ALA 153 Cb 0.00 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 2wn1 s ALA 153 CO 0.00 -1.47 0.49 1.03 0.00 0.00 0.00 175.76 175.81 2wn1 s ARG 154 N -3.97 4.06 -0.04 0.00 0.52 -1.26 -1.38 118.95 116.87 2wn1 s ARG 154 Ca 0.70 0.28 0.06 0.00 -0.52 0.00 0.00 55.73 56.25 2wn1 s ARG 154 Cb -0.24 -3.65 -0.09 0.00 0.52 0.00 0.00 34.95 31.48 2wn1 s ARG 154 CO 0.42 -0.34 0.07 -0.12 0.02 0.00 0.00 175.30 175.35 2wn1 n MET 155 N 5.51 1.90 -3.76 3.54 0.00 -0.60 -4.68 117.12 119.03 2wn1 n MET 155 Ca -0.05 -0.03 -0.13 0.00 -0.00 0.00 0.00 57.70 57.49 2wn1 n MET 155 Cb 0.50 -1.17 -0.09 0.00 0.00 0.00 0.00 33.22 32.46 2wn1 n MET 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2wn1 s ALA 156 N -2.29 -0.79 0.03 -5.12 0.00 -0.80 -0.64 121.76 112.15 2wn1 s ALA 156 Ca -0.03 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.20 2wn1 s ALA 156 Cb 0.03 -0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.10 2wn1 s ALA 156 CO 0.28 -0.23 0.51 0.00 0.00 0.00 0.00 175.76 176.32 2wn1 s GLY 158 N -1.80 -0.53 0.01 0.00 0.00 -0.95 -0.79 107.32 103.26 2wn1 s GLY 158 Ca -0.07 2.00 -0.30 0.00 0.00 0.00 0.00 44.72 46.35 2wn1 s GLY 158 CO 0.00 2.40 1.21 0.14 0.00 0.00 0.00 173.10 176.85 2wn1 s VAL 159 N 2.10 4.13 -0.30 1.40 1.01 -1.26 -1.09 120.40 126.39 2wn1 s VAL 159 Ca -0.07 1.50 -0.21 0.00 0.00 0.00 0.00 61.98 63.20 2wn1 s VAL 159 Cb -0.09 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2wn1 s VAL 159 CO -0.16 0.06 0.65 -0.63 0.00 0.00 0.00 175.10 175.01 2wn1 s ILE 160 N 1.61 4.93 0.00 2.22 1.01 -0.05 -4.72 121.20 126.19 2wn1 s ILE 160 Ca 0.58 0.93 0.00 0.00 0.00 0.00 0.00 60.65 62.16 2wn1 s ILE 160 Cb -0.27 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.19 2wn1 s ILE 160 CO 0.26 -0.13 0.00 1.21 0.00 0.00 0.00 174.94 176.28