#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn0 s ASP 5 N 0.00 2.71 0.11 0.53 1.01 -1.26 -5.13 116.67 114.64 2wn0 s ASP 5 Ca 0.00 -0.43 0.05 0.00 0.71 0.00 0.00 52.55 52.89 2wn0 s ASP 5 Cb 0.00 -0.30 -0.04 0.00 1.01 0.00 0.00 42.92 43.60 2wn0 s ASP 5 CO 0.00 0.28 -0.13 -0.54 0.21 0.00 0.00 175.17 174.98 2wn0 s LYS 6 N -0.60 0.98 0.42 8.23 1.02 -1.26 -5.12 119.74 123.41 2wn0 s LYS 6 Ca 0.09 -1.21 -0.26 0.00 0.02 0.00 0.00 55.97 54.61 2wn0 s LYS 6 Cb -0.09 -0.84 -0.10 0.00 -0.52 0.00 0.00 37.83 36.28 2wn0 s LYS 6 CO -0.01 0.16 1.35 0.00 -0.92 0.00 0.00 175.35 175.93 2wn0 n ALA 7 N 0.59 1.65 -3.41 5.17 0.00 -1.26 -4.81 120.51 118.44 2wn0 n ALA 7 Ca -0.16 0.27 -0.15 0.00 0.00 0.00 0.00 53.44 53.40 2wn0 n ALA 7 Cb 0.57 -2.32 -0.08 0.00 0.00 0.00 0.00 19.45 17.62 2wn0 n ALA 7 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wn0 s SER 8 N -0.46 -0.48 0.12 0.00 0.15 -1.26 -1.20 113.70 110.57 2wn0 s SER 8 Ca 0.60 0.61 -0.14 0.00 0.70 0.00 0.00 55.95 57.72 2wn0 s SER 8 Cb -0.49 0.61 0.02 0.00 -1.71 0.00 0.00 66.02 64.46 2wn0 s SER 8 CO 0.59 -0.45 0.34 0.00 1.20 0.00 0.00 173.24 174.91 2wn0 s MET 9 N -0.86 1.02 0.03 5.44 0.23 -0.38 -5.02 119.30 119.77 2wn0 s MET 9 Ca -0.09 -0.81 0.07 0.00 -1.03 0.00 0.00 55.69 53.83 2wn0 s MET 9 Cb -0.03 0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 33.67 2wn0 s MET 9 CO 0.06 -0.38 -0.20 0.99 -2.03 0.00 0.00 175.02 173.46 2wn0 s THR 10 N -3.83 2.62 -0.08 3.16 2.01 -1.26 -0.58 115.64 117.67 2wn0 s THR 10 Ca 0.04 -1.20 0.03 0.00 0.31 0.00 0.00 61.69 60.87 2wn0 s THR 10 Cb 0.03 -2.07 0.01 0.00 0.01 0.00 0.00 72.50 70.47 2wn0 s THR 10 CO -0.11 0.37 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.33 2wn0 s VAL 11 N -0.87 1.54 0.11 3.82 1.01 0.06 -4.75 120.40 121.32 2wn0 s VAL 11 Ca 0.13 -0.71 -0.25 0.00 0.00 0.00 0.00 61.98 61.15 2wn0 s VAL 11 Cb -0.10 -1.37 -0.07 0.00 0.00 0.00 0.00 36.38 34.84 2wn0 s VAL 11 CO 0.04 0.45 0.78 -0.75 0.00 0.00 0.00 175.10 175.61 2wn0 s LYS 12 N 0.58 4.54 -0.11 2.72 2.47 -1.26 -1.01 119.74 127.67 2wn0 s LYS 12 Ca -0.15 1.13 0.00 0.00 -1.56 0.00 0.00 55.97 55.39 2wn0 s LYS 12 Cb -0.17 -3.31 -0.02 0.00 -1.46 0.00 0.00 37.83 32.87 2wn0 s LYS 12 CO 0.05 0.43 -0.11 0.42 0.16 0.00 0.00 175.35 176.30 2wn0 s ILE 13 N -0.61 3.30 0.00 5.43 -1.09 -0.23 -4.26 121.20 123.75 2wn0 s ILE 13 Ca 0.37 -0.59 0.07 0.00 -2.23 0.00 0.00 60.65 58.27 2wn0 s ILE 13 Cb -0.22 -2.37 -0.02 0.00 -1.58 0.00 0.00 42.46 38.27 2wn0 s ILE 13 CO 0.25 0.54 -0.22 0.20 -1.23 0.00 0.00 174.94 174.49 2wn0 s ASN 14 N -0.06 2.56 0.25 3.58 0.01 0.15 -1.44 114.94 119.99 2wn0 s ASN 14 Ca -0.01 -0.43 -0.28 0.00 -0.71 0.00 0.00 52.86 51.42 2wn0 s ASN 14 Cb -0.14 -0.26 -0.15 0.00 0.41 0.00 0.00 41.25 41.11 2wn0 s ASN 14 CO 0.03 0.24 0.86 1.21 -1.51 0.00 0.00 177.10 177.94 2wn0 n GLU 15 N 2.34 0.91 -3.70 -0.60 2.13 0.23 -0.19 120.64 121.75 2wn0 n GLU 15 Ca -0.16 0.32 -0.38 0.00 0.66 0.00 0.00 57.16 57.60 2wn0 n GLU 15 Cb 0.53 -1.58 -0.12 0.00 0.27 0.00 0.00 31.44 30.54 2wn0 n GLU 15 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2wn0 s SER 16 N -0.67 5.40 0.31 4.31 0.01 0.08 -0.25 113.70 122.89 2wn0 s SER 16 Ca 0.61 -0.95 0.08 0.00 1.31 0.00 0.00 55.95 57.01 2wn0 s SER 16 Cb -0.78 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 63.48 2wn0 s SER 16 CO 0.58 -0.30 0.12 -0.76 0.41 0.00 0.00 173.24 173.29 2wn0 s LEU 17 N 1.48 3.33 0.40 2.44 1.43 -0.04 -4.61 118.68 123.12 2wn0 s LEU 17 Ca 0.01 -0.65 0.08 0.00 -1.03 0.00 0.00 54.13 52.54 2wn0 s LEU 17 Cb -0.19 -1.84 0.87 0.00 0.03 0.00 0.00 46.19 45.06 2wn0 s LEU 17 CO 0.04 -0.18 2.01 -0.65 0.23 0.00 0.00 176.35 177.80 2wn0 h PRO 18 N 1.62 0.56 0.00 1.29 0.11 -1.93 -2.65 132.00 131.00 2wn0 h PRO 18 Ca -0.44 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.42 2wn0 h PRO 18 Cb 1.25 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2wn0 h PRO 18 CO 0.62 0.37 -0.91 0.37 -0.21 0.00 0.00 178.00 178.24 2wn0 h GLN 19 N 0.58 0.31 0.00 1.05 4.15 -1.95 -3.43 115.11 115.81 2wn0 h GLN 19 Ca 0.22 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.31 2wn0 h GLN 19 Cb 0.17 0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.95 2wn0 h GLN 19 CO -0.06 1.03 0.00 0.41 -1.93 0.00 0.00 178.83 178.28 2wn0 n GLY 20 N 0.91 -0.51 3.73 2.39 0.00 -1.00 -4.87 105.19 105.83 2wn0 n GLY 20 Ca -0.05 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 2wn0 n GLY 20 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wn0 s ASN 21 N -4.00 7.00 0.00 1.61 0.01 -1.26 -0.86 114.94 117.44 2wn0 s ASN 21 Ca 0.00 2.24 0.00 0.00 -0.71 0.00 0.00 52.86 54.39 2wn0 s ASN 21 Cb 0.00 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.06 2wn0 s ASN 21 CO 0.00 -0.47 0.00 0.61 -1.51 0.00 0.00 177.10 175.73 2wn0 n GLY 22 N 2.63 1.57 3.70 0.66 0.00 0.66 -4.85 105.19 109.56 2wn0 n GLY 22 Ca 0.07 -1.78 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 2wn0 n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wn0 n LYS 23 N 0.00 0.82 -2.57 1.61 5.02 -1.26 -4.42 118.16 117.35 2wn0 n LYS 23 Ca 0.00 0.34 -0.41 0.00 -2.02 0.00 0.00 58.31 56.22 2wn0 n LYS 23 Cb 0.00 -2.46 -0.04 0.00 -0.02 0.00 0.00 35.03 32.51 2wn0 n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wn0 s ALA 24 N -1.61 3.34 -0.58 7.82 0.00 -1.26 -0.60 121.76 128.87 2wn0 s ALA 24 Ca 0.79 0.75 0.10 0.00 0.00 0.00 0.00 51.96 53.60 2wn0 s ALA 24 Cb -0.36 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.36 2wn0 s ALA 24 CO 0.44 -0.14 0.47 1.28 0.00 0.00 0.00 175.76 177.81 2wn0 n LEU 25 N 2.37 0.66 0.00 0.00 4.77 -0.52 -4.91 117.00 119.36 2wn0 n LEU 25 Ca 0.02 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2wn0 n LEU 25 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2wn0 n LEU 25 CO 0.53 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 2wn0 n GLY 26 N 1.13 0.38 3.31 -0.72 0.00 -1.24 -0.78 105.19 107.27 2wn0 n GLY 26 Ca 0.02 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.03 2wn0 n GLY 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wn0 s THR 27 N -1.38 0.64 -0.05 2.61 -4.23 -0.67 -1.06 115.64 111.50 2wn0 s THR 27 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 2wn0 s THR 27 Cb 0.00 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.33 2wn0 s THR 27 CO 0.00 -0.11 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.21 2wn0 s VAL 28 N -3.70 0.69 -0.20 2.29 1.01 -0.18 0.17 120.40 120.49 2wn0 s VAL 28 Ca 0.35 -0.22 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 2wn0 s VAL 28 Cb 0.07 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 2wn0 s VAL 28 CO 0.12 0.26 0.20 -0.89 0.00 0.00 0.00 175.10 174.79 2wn0 s THR 29 N 0.86 5.35 -0.23 3.92 2.01 0.32 -0.76 115.64 127.10 2wn0 s THR 29 Ca -0.12 0.33 -0.07 0.00 0.31 0.00 0.00 61.69 62.15 2wn0 s THR 29 Cb -0.15 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 2wn0 s THR 29 CO 0.01 0.39 0.05 -0.69 -0.69 0.00 0.00 174.62 173.69 2wn0 s VAL 30 N 0.61 4.24 -0.04 3.82 1.01 0.25 -0.50 120.40 129.80 2wn0 s VAL 30 Ca 0.11 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2wn0 s VAL 30 Cb -0.12 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.29 2wn0 s VAL 30 CO 0.02 0.37 -0.13 -0.89 0.00 0.00 0.00 175.10 174.47 2wn0 s THR 31 N 1.41 1.09 -0.01 3.92 2.01 -0.23 -1.25 115.64 122.58 2wn0 s THR 31 Ca 0.05 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 2wn0 s THR 31 Cb -0.15 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.36 2wn0 s THR 31 CO 0.03 0.33 1.19 -1.61 -0.69 0.00 0.00 174.62 173.87 2wn0 s GLU 32 N 0.20 4.39 0.42 4.92 2.02 -0.34 -0.13 118.70 130.18 2wn0 s GLU 32 Ca -0.05 1.69 0.05 0.00 0.02 0.00 0.00 54.97 56.68 2wn0 s GLU 32 Cb -0.11 -3.48 -0.06 0.00 0.10 0.00 0.00 34.13 30.58 2wn0 s GLU 32 CO 0.02 -0.36 0.03 0.95 0.02 0.00 0.00 175.26 175.91 2wn0 s THR 33 N 1.77 1.55 -1.33 3.63 -4.23 -0.51 -4.60 115.64 111.91 2wn0 s THR 33 Ca 0.57 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.18 2wn0 s THR 33 Cb -0.26 -2.72 0.15 0.00 1.34 0.00 0.00 72.50 71.02 2wn0 s THR 33 CO 0.25 0.00 1.23 0.00 -0.54 0.00 0.00 174.62 175.55 2wn0 n ALA 34 N -0.98 1.59 -0.15 3.99 0.00 -1.26 -2.38 120.51 121.32 2wn0 n ALA 34 Ca -0.08 -0.04 0.01 0.00 0.00 0.00 0.00 53.44 53.33 2wn0 n ALA 34 Cb 0.67 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.97 2wn0 n ALA 34 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wn0 n TYR 35 N -1.33 0.00 0.00 0.00 4.02 -1.26 -5.11 117.16 113.48 2wn0 n TYR 35 Ca 0.04 -0.53 0.00 0.00 -0.01 0.00 0.00 57.90 57.40 2wn0 n TYR 35 Cb 0.09 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.35 2wn0 n TYR 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wn0 n GLY 36 N -0.58 -0.00 3.70 2.72 0.00 -1.00 -4.22 105.19 105.81 2wn0 n GLY 36 Ca 0.02 -2.28 -0.42 0.00 0.00 0.00 0.00 46.02 43.33 2wn0 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wn0 s LEU 37 N 0.00 4.33 -0.22 0.99 1.43 0.29 -1.43 118.68 124.07 2wn0 s LEU 37 Ca 0.00 1.81 -0.09 0.00 -1.03 0.00 0.00 54.13 54.82 2wn0 s LEU 37 Cb 0.00 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.61 2wn0 s LEU 37 CO 0.00 -0.45 0.12 -0.22 0.23 0.00 0.00 176.35 176.03 2wn0 s LEU 38 N 1.52 3.95 -0.38 1.79 2.96 0.81 -0.74 118.68 128.59 2wn0 s LEU 38 Ca 0.55 0.07 -0.13 0.00 -0.22 0.00 0.00 54.13 54.40 2wn0 s LEU 38 Cb -0.25 -2.04 0.01 0.00 0.50 0.00 0.00 46.19 44.42 2wn0 s LEU 38 CO 0.25 0.09 0.24 -0.36 -1.32 0.00 0.00 176.35 175.25 2wn0 s PHE 39 N 0.90 3.23 -0.36 5.38 0.40 0.41 -1.07 117.98 126.88 2wn0 s PHE 39 Ca 0.06 -0.65 -0.09 0.00 -0.60 0.00 0.00 56.93 55.65 2wn0 s PHE 39 Cb -0.13 -2.50 0.03 0.00 0.51 0.00 0.00 43.02 40.93 2wn0 s PHE 39 CO 0.03 -0.56 0.16 0.99 0.70 0.00 0.00 175.22 176.54 2wn0 s THR 40 N 1.64 4.21 0.36 0.64 2.01 0.34 -0.70 115.64 124.13 2wn0 s THR 40 Ca 0.04 -0.97 -0.25 0.00 0.31 0.00 0.00 61.69 60.82 2wn0 s THR 40 Cb -0.19 -3.35 -0.10 0.00 0.01 0.00 0.00 72.50 68.87 2wn0 s THR 40 CO 0.09 -0.20 0.98 -2.16 -0.69 0.00 0.00 174.62 172.64 2wn0 s PRO 41 N 1.49 4.41 -0.46 4.92 0.05 -1.26 -0.52 135.00 143.63 2wn0 s PRO 41 Ca 0.00 1.38 0.06 0.00 0.05 0.00 0.00 61.00 62.50 2wn0 s PRO 41 Cb -0.19 -2.67 0.22 0.00 0.05 0.00 0.00 34.50 31.91 2wn0 s PRO 41 CO 0.05 0.11 0.49 0.72 0.05 0.00 0.00 177.00 178.42 2wn0 n HIS 42 N 0.26 0.35 -4.34 0.56 8.25 0.13 -4.06 115.22 116.36 2wn0 n HIS 42 Ca 0.03 -3.63 -0.23 0.00 -0.26 0.00 0.00 57.72 53.63 2wn0 n HIS 42 Cb 0.50 -0.21 -0.12 0.00 1.12 0.00 0.00 29.99 31.28 2wn0 n HIS 42 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wn0 s LEU 43 N -1.01 2.40 0.19 2.41 1.43 -0.88 -1.67 118.68 121.55 2wn0 s LEU 43 Ca 0.34 -0.81 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2wn0 s LEU 43 Cb 0.11 -0.91 -0.05 0.00 0.03 0.00 0.00 46.19 45.37 2wn0 s LEU 43 CO -0.13 0.02 0.03 0.42 0.23 0.00 0.00 176.35 176.92 2wn0 s THR 44 N -1.72 0.58 -0.72 5.49 -4.23 0.04 -1.15 115.64 113.93 2wn0 s THR 44 Ca 0.14 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.66 2wn0 s THR 44 Cb -0.07 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.51 2wn0 s THR 44 CO 0.06 -0.34 0.07 0.61 -0.54 0.00 0.00 174.62 174.49 2wn0 n GLY 45 N -0.29 0.05 3.60 3.99 0.00 -1.00 -4.75 105.19 106.80 2wn0 n GLY 45 Ca -0.05 -0.48 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 2wn0 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wn0 s LEU 46 N -2.70 3.16 0.12 0.99 1.43 -0.08 -5.06 118.68 116.55 2wn0 s LEU 46 Ca 0.04 -0.22 -0.31 0.00 -1.03 0.00 0.00 54.13 52.61 2wn0 s LEU 46 Cb -0.02 -1.87 -0.10 0.00 0.03 0.00 0.00 46.19 44.23 2wn0 s LEU 46 CO 0.05 0.24 1.85 0.00 0.23 0.00 0.00 176.35 178.71 2wn0 s ALA 47 N -1.10 3.76 0.31 4.21 0.00 -1.26 -4.10 121.76 123.58 2wn0 s ALA 47 Ca 0.19 1.46 -0.27 0.00 0.00 0.00 0.00 51.96 53.34 2wn0 s ALA 47 Cb -0.11 -3.77 -0.14 0.00 0.00 0.00 0.00 23.12 19.10 2wn0 s ALA 47 CO 0.11 -1.25 0.96 -2.30 0.00 0.00 0.00 175.76 173.28 2wn0 n PRO 48 N 5.77 1.25 0.00 0.00 -0.02 -1.26 -4.78 135.00 135.97 2wn0 n PRO 48 Ca 0.18 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2wn0 n PRO 48 Cb 0.38 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2wn0 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wn0 n GLY 49 N 1.28 0.62 3.42 -1.23 0.00 -0.52 -4.97 105.19 103.79 2wn0 n GLY 49 Ca 0.10 -2.16 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 2wn0 n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wn0 s ILE 50 N -0.90 3.81 -0.01 -0.61 1.01 -1.26 0.35 121.20 123.58 2wn0 s ILE 50 Ca 0.00 -0.36 0.06 0.00 0.00 0.00 0.00 60.65 60.34 2wn0 s ILE 50 Cb 0.00 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2wn0 s ILE 50 CO 0.00 0.44 -0.18 -1.00 0.00 0.00 0.00 174.94 174.19 2wn0 s HIS 51 N 0.99 2.56 0.27 3.97 3.76 0.43 -3.65 115.29 123.61 2wn0 s HIS 51 Ca 0.01 -0.26 -0.30 0.00 -0.15 0.00 0.00 55.06 54.36 2wn0 s HIS 51 Cb -0.14 -1.54 -0.14 0.00 1.11 0.00 0.00 32.58 31.87 2wn0 s HIS 51 CO 0.01 0.16 1.22 0.41 -0.85 0.00 0.00 174.74 175.69 2wn0 n GLY 52 N 2.08 0.30 2.72 -2.22 0.00 0.04 -0.45 105.19 107.65 2wn0 n GLY 52 Ca -0.17 0.41 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 2wn0 n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wn0 s PHE 53 N -0.61 -0.26 0.05 1.61 5.36 -1.26 -1.05 117.98 121.82 2wn0 s PHE 53 Ca 0.63 -0.17 -0.01 0.00 -0.96 0.00 0.00 56.93 56.42 2wn0 s PHE 53 Cb -0.68 -0.51 -0.04 0.00 -0.34 0.00 0.00 43.02 41.46 2wn0 s PHE 53 CO 0.56 -0.80 -0.02 -1.01 -1.46 0.00 0.00 175.22 172.49 2wn0 s HIS 54 N 2.30 0.47 -0.20 10.12 3.76 -0.96 -2.57 115.29 128.22 2wn0 s HIS 54 Ca 0.08 -0.98 -0.17 0.00 -0.15 0.00 0.00 55.06 53.85 2wn0 s HIS 54 Cb -0.15 -0.35 -0.04 0.00 1.11 0.00 0.00 32.58 33.16 2wn0 s HIS 54 CO -0.27 -0.37 0.44 -0.51 -0.85 0.00 0.00 174.74 173.19 2wn0 s LEU 55 N -2.75 4.16 0.13 0.89 1.43 0.27 -0.40 118.68 122.40 2wn0 s LEU 55 Ca 0.04 0.58 0.03 0.00 -1.03 0.00 0.00 54.13 53.76 2wn0 s LEU 55 Cb 0.06 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 2wn0 s LEU 55 CO -0.09 -0.11 0.22 -1.00 0.23 0.00 0.00 176.35 175.59 2wn0 s HIS 56 N 1.40 3.37 0.17 0.29 3.76 0.85 -0.46 115.29 124.67 2wn0 s HIS 56 Ca 0.21 0.10 -0.21 0.00 -0.15 0.00 0.00 55.06 55.00 2wn0 s HIS 56 Cb -0.15 -1.63 0.08 0.00 1.11 0.00 0.00 32.58 31.98 2wn0 s HIS 56 CO 0.09 0.53 1.61 0.93 -0.85 0.00 0.00 174.74 177.05 2wn0 h GLU 57 N 2.45 -0.20 -5.99 1.40 4.39 -0.56 -2.42 114.58 113.64 2wn0 h GLU 57 Ca -0.48 0.01 -0.61 0.00 0.34 0.00 0.00 59.36 58.63 2wn0 h GLU 57 Cb 1.19 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.83 2wn0 h GLU 57 CO 0.68 -0.14 -0.29 0.15 -1.16 0.00 0.00 179.01 178.25 2wn0 s LYS 58 N -6.06 3.72 0.00 2.33 1.02 0.28 -4.59 119.74 116.45 2wn0 s LYS 58 Ca -0.15 0.14 -0.02 0.00 0.02 0.00 0.00 55.97 55.96 2wn0 s LYS 58 Cb 0.14 -3.09 -0.11 0.00 -0.52 0.00 0.00 37.83 34.25 2wn0 s LYS 58 CO 0.69 0.63 2.09 -2.30 -0.92 0.00 0.00 175.35 175.55 2wn0 n PRO 59 N 1.27 1.07 -3.85 -1.68 -0.02 -1.23 -3.03 135.00 127.52 2wn0 n PRO 59 Ca -0.11 -0.41 -0.12 0.00 -2.02 0.00 0.00 63.50 60.84 2wn0 n PRO 59 Cb 0.53 -1.58 -0.12 0.00 -0.02 0.00 0.00 33.50 32.31 2wn0 n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wn0 s SER 60 N 2.21 -0.06 0.00 2.55 0.15 -1.26 -4.96 113.70 112.32 2wn0 s SER 60 Ca 0.27 0.09 0.13 0.00 0.70 0.00 0.00 55.95 57.14 2wn0 s SER 60 Cb 0.13 0.21 0.35 0.00 -1.71 0.00 0.00 66.02 65.00 2wn0 s SER 60 CO 0.00 -0.11 1.28 0.00 1.20 0.00 0.00 173.24 175.60 2wn0 s ALA 62 N -1.01 2.65 0.78 0.00 0.00 -1.26 -3.43 121.76 119.49 2wn0 s ALA 62 Ca 0.27 0.90 -0.15 0.00 0.00 0.00 0.00 51.96 52.98 2wn0 s ALA 62 Cb 0.14 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.89 2wn0 s ALA 62 CO 0.19 -0.91 0.84 -2.30 0.00 0.00 0.00 175.76 173.58 2wn0 n PRO 63 N -1.38 0.22 -4.24 0.00 -0.02 -1.26 -1.04 135.00 127.27 2wn0 n PRO 63 Ca 0.12 0.13 -0.19 0.00 -2.02 0.00 0.00 63.50 61.55 2wn0 n PRO 63 Cb 0.50 -2.13 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 2wn0 n PRO 63 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2wn0 s GLY 64 N -1.80 1.08 -0.05 -1.23 0.00 0.33 -4.22 107.32 101.43 2wn0 s GLY 64 Ca 0.69 -1.27 -0.16 0.00 0.00 0.00 0.00 44.72 43.98 2wn0 s GLY 64 CO 0.55 -1.33 0.42 -0.29 0.00 0.00 0.00 173.10 172.45 2wn0 s MET 65 N -2.55 4.09 -0.23 2.90 1.75 -1.26 0.10 119.30 124.10 2wn0 s MET 65 Ca 0.08 0.39 -0.06 0.00 -1.25 0.00 0.00 55.69 54.85 2wn0 s MET 65 Cb -0.06 -3.31 0.11 0.00 2.84 0.00 0.00 34.83 34.42 2wn0 s MET 65 CO 0.03 0.48 0.45 0.21 -0.65 0.00 0.00 175.02 175.54 2wn0 s LYS 66 N -0.39 0.38 -1.51 4.11 2.20 -0.47 -4.90 119.74 119.16 2wn0 s LYS 66 Ca 0.24 0.97 -0.05 0.00 -0.36 0.00 0.00 55.97 56.77 2wn0 s LYS 66 Cb -0.16 0.23 0.02 0.00 -1.51 0.00 0.00 37.83 36.41 2wn0 s LYS 66 CO 0.11 -0.37 0.53 -0.25 -0.36 0.00 0.00 175.35 175.02 2wn0 n ASP 67 N 5.40 -5.63 0.00 1.43 8.00 -1.26 -2.07 116.55 122.42 2wn0 n ASP 67 Ca -0.07 -0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2wn0 n ASP 67 Cb 0.50 -4.58 0.00 0.00 -0.02 0.00 0.00 41.12 37.02 2wn0 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wn0 n GLY 68 N -1.41 0.54 3.30 0.44 0.00 -1.26 -5.03 105.19 101.77 2wn0 n GLY 68 Ca -0.11 -0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 2wn0 n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wn0 s LYS 69 N -0.09 1.51 -0.54 1.61 -0.14 -0.88 -5.09 119.74 116.12 2wn0 s LYS 69 Ca 0.00 -1.05 -0.27 0.00 -1.36 0.00 0.00 55.97 53.29 2wn0 s LYS 69 Cb 0.00 -1.69 0.03 0.00 -1.68 0.00 0.00 37.83 34.49 2wn0 s LYS 69 CO 0.00 0.43 1.10 0.00 -0.76 0.00 0.00 175.35 176.12 2wn0 s ALA 70 N -0.85 3.08 -0.25 5.17 0.00 -1.26 -1.36 121.76 126.29 2wn0 s ALA 70 Ca 0.09 -0.84 -0.16 0.00 0.00 0.00 0.00 51.96 51.05 2wn0 s ALA 70 Cb -0.09 -3.91 -0.03 0.00 0.00 0.00 0.00 23.12 19.09 2wn0 s ALA 70 CO 0.02 -2.47 0.43 0.08 0.00 0.00 0.00 175.76 173.82 2wn0 s VAL 71 N 4.53 5.14 0.25 0.00 1.01 0.12 -4.59 120.40 126.86 2wn0 s VAL 71 Ca 0.41 0.70 -0.31 0.00 0.00 0.00 0.00 61.98 62.78 2wn0 s VAL 71 Cb -0.09 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.41 2wn0 s VAL 71 CO 0.25 0.15 1.42 -2.65 0.00 0.00 0.00 175.10 174.27 2wn0 n PRO 72 N 5.25 2.11 -0.99 2.72 -0.02 -1.26 -0.51 135.00 142.30 2wn0 n PRO 72 Ca -0.07 0.75 -0.05 0.00 -2.02 0.00 0.00 63.50 62.11 2wn0 n PRO 72 Cb 0.50 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 2wn0 n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wn0 n ALA 73 N 1.80 -0.08 0.32 3.55 0.00 -1.21 -4.61 120.51 120.27 2wn0 n ALA 73 Ca 0.11 0.09 0.20 0.00 0.00 0.00 0.00 53.44 53.83 2wn0 n ALA 73 Cb 0.32 -1.27 1.04 0.00 0.00 0.00 0.00 19.45 19.54 2wn0 n ALA 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wn0 h LEU 74 N 0.00 0.00 -0.90 0.00 5.85 -1.31 -2.27 115.31 116.68 2wn0 h LEU 74 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2wn0 h LEU 74 Cb 0.83 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.86 2wn0 h LEU 74 CO 0.16 0.01 0.00 0.00 -0.34 0.00 0.00 178.44 178.28 2wn0 h ALA 75 N 1.99 1.00 0.00 1.25 0.00 -1.26 -2.85 119.26 119.39 2wn0 h ALA 75 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wn0 h ALA 75 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2wn0 h ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2wn0 n ALA 76 N -1.83 1.85 -0.51 0.00 0.00 -0.85 -4.64 120.51 114.53 2wn0 n ALA 76 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2wn0 n ALA 76 Cb 0.23 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2wn0 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wn0 n GLY 77 N 0.34 -0.27 0.56 0.00 0.00 -1.08 -0.55 105.19 104.20 2wn0 n GLY 77 Ca 0.05 -1.07 -0.04 0.00 0.00 0.00 0.00 46.02 44.96 2wn0 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn0 n GLY 78 N 0.00 -0.42 3.77 -0.02 0.00 -1.26 -4.62 105.19 102.63 2wn0 n GLY 78 Ca 0.00 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.83 2wn0 n GLY 78 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wn0 s HIS 79 N -0.96 3.23 -0.15 1.61 3.76 -1.26 -0.32 115.29 121.20 2wn0 s HIS 79 Ca 0.10 1.52 -0.35 0.00 -0.15 0.00 0.00 55.06 56.19 2wn0 s HIS 79 Cb -0.00 -3.53 -0.12 0.00 1.11 0.00 0.00 32.58 30.04 2wn0 s HIS 79 CO 0.07 -1.38 1.90 -0.11 -0.85 0.00 0.00 174.74 174.38 2wn0 n LEU 80 N 0.88 3.17 -3.03 0.89 7.94 0.39 -4.53 117.00 122.71 2wn0 n LEU 80 Ca -0.00 0.91 -0.17 0.00 -1.11 0.00 0.00 56.01 55.64 2wn0 n LEU 80 Cb 0.43 -1.33 -0.01 0.00 0.53 0.00 0.00 43.42 43.04 2wn0 n LEU 80 CO 0.57 -0.19 -0.09 -0.67 -1.11 0.00 0.00 177.39 175.90 2wn0 n ASP 81 N 6.95 -0.70 -0.20 1.96 2.03 -1.26 -1.15 116.55 124.18 2wn0 n ASP 81 Ca 0.25 -3.04 0.09 0.00 0.52 0.00 0.00 54.79 52.61 2wn0 n ASP 81 Cb 0.27 0.27 0.38 0.00 -0.72 0.00 0.00 41.12 41.31 2wn0 n ASP 81 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wn0 h PRO 82 N 3.63 0.68 -0.01 -0.67 0.11 -1.97 0.27 132.00 134.05 2wn0 h PRO 82 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2wn0 h PRO 82 Cb 0.96 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2wn0 h PRO 82 CO 0.40 0.45 0.00 0.09 -0.21 0.00 0.00 178.00 178.73 2wn0 n ASN 83 N -4.50 0.24 -3.80 -2.05 3.02 -1.26 -4.91 115.26 102.00 2wn0 n ASN 83 Ca 0.12 -1.15 -0.27 0.00 -0.03 0.00 0.00 54.58 53.26 2wn0 n ASN 83 Cb 0.31 -0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.52 2wn0 n ASN 83 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2wn0 n LYS 84 N -0.78 -5.87 0.02 3.52 4.01 0.08 -4.88 118.16 114.26 2wn0 n LYS 84 Ca 0.22 0.65 -0.04 0.00 -0.51 0.00 0.00 58.31 58.63 2wn0 n LYS 84 Cb 0.14 -5.51 0.18 0.00 -0.51 0.00 0.00 35.03 29.34 2wn0 n LYS 84 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 2wn0 h THR 85 N -2.15 1.28 -0.46 -0.18 1.35 -1.87 -3.47 112.91 107.41 2wn0 h THR 85 Ca -0.59 -1.35 -0.20 0.00 -0.55 0.00 0.00 66.41 63.72 2wn0 h THR 85 Cb 1.37 1.42 -0.08 0.00 -1.73 0.00 0.00 68.15 69.13 2wn0 h THR 85 CO 0.62 0.43 -0.18 0.61 -0.25 0.00 0.00 175.52 176.75 2wn0 n GLY 86 N -0.29 1.12 2.96 5.82 0.00 -1.26 -5.00 105.19 108.53 2wn0 n GLY 86 Ca -0.01 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 2wn0 n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wn0 s VAL 87 N -2.33 0.10 -0.39 1.61 0.11 -1.26 -5.05 120.40 113.18 2wn0 s VAL 87 Ca 0.00 -0.70 -0.13 0.00 -2.93 0.00 0.00 61.98 58.21 2wn0 s VAL 87 Cb 0.00 -0.22 0.02 0.00 -1.53 0.00 0.00 36.38 34.66 2wn0 s VAL 87 CO 0.00 -0.38 0.26 -2.28 -3.33 0.00 0.00 175.10 169.37 2wn0 s HIS 88 N -1.12 3.24 0.00 1.54 2.46 -1.26 -0.67 115.29 119.49 2wn0 s HIS 88 Ca -0.12 -0.75 0.00 0.00 0.47 0.00 0.00 55.06 54.66 2wn0 s HIS 88 Cb -0.08 -2.53 0.00 0.00 -0.13 0.00 0.00 32.58 29.85 2wn0 s HIS 88 CO -0.01 -0.62 0.58 1.28 -2.47 0.00 0.00 174.74 173.51 2wn0 n LEU 89 N 5.09 0.88 0.00 8.88 4.77 -1.26 -3.28 117.00 132.08 2wn0 n LEU 89 Ca -0.11 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 2wn0 n LEU 89 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2wn0 n LEU 89 CO 0.39 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 2wn0 n GLY 90 N -0.17 -2.74 0.01 -0.72 0.00 -1.25 -4.37 105.19 95.96 2wn0 n GLY 90 Ca 0.00 -1.67 0.14 0.00 0.00 0.00 0.00 46.02 44.49 2wn0 n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2wn0 n PRO 91 N -0.74 0.28 -0.18 1.61 -0.04 -1.24 -3.43 135.00 131.26 2wn0 n PRO 91 Ca 0.00 -0.01 0.05 0.00 -0.04 0.00 0.00 63.50 63.50 2wn0 n PRO 91 Cb 0.00 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.10 2wn0 n PRO 91 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2wn0 n TYR 92 N -1.35 0.42 -3.84 0.54 0.53 -1.26 -4.27 117.16 107.92 2wn0 n TYR 92 Ca 0.11 -0.60 -0.23 0.00 -1.02 0.00 0.00 57.90 56.16 2wn0 n TYR 92 Cb 0.28 -0.09 -0.17 0.00 -1.03 0.00 0.00 39.34 38.33 2wn0 n TYR 92 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 2wn0 s ASN 93 N -1.28 1.65 0.00 7.72 3.84 -1.22 -5.03 114.94 120.62 2wn0 s ASN 93 Ca 0.22 -0.14 0.23 0.00 0.21 0.00 0.00 52.86 53.38 2wn0 s ASN 93 Cb 0.14 -0.53 1.06 0.00 -0.55 0.00 0.00 41.25 41.38 2wn0 s ASN 93 CO 0.10 -0.16 1.74 0.47 -2.79 0.00 0.00 177.10 176.46 2wn0 n ASP 94 N 4.98 0.00 -0.17 -4.21 8.00 -1.26 -3.33 116.55 120.56 2wn0 n ASP 94 Ca -0.10 0.22 0.14 0.00 0.71 0.00 0.00 54.79 55.75 2wn0 n ASP 94 Cb 0.50 -0.39 0.49 0.00 -0.02 0.00 0.00 41.12 41.71 2wn0 n ASP 94 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wn0 n LYS 95 N -1.39 0.73 -3.02 -1.24 5.02 -1.26 -4.92 118.16 112.09 2wn0 n LYS 95 Ca 0.08 -0.35 -0.14 0.00 -2.02 0.00 0.00 58.31 55.89 2wn0 n LYS 95 Cb 0.22 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.72 2wn0 n LYS 95 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wn0 n GLY 96 N 1.32 3.70 3.65 0.72 0.00 -1.21 -4.74 105.19 108.62 2wn0 n GLY 96 Ca 0.13 -2.27 -0.56 0.00 0.00 0.00 0.00 46.02 43.32 2wn0 n GLY 96 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wn0 n HIS 97 N -0.67 1.73 0.30 1.61 8.25 0.15 -4.85 115.22 121.75 2wn0 n HIS 97 Ca -0.07 0.64 0.16 0.00 -0.26 0.00 0.00 57.72 58.18 2wn0 n HIS 97 Cb 0.28 -2.37 0.93 0.00 1.12 0.00 0.00 29.99 29.95 2wn0 n HIS 97 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2wn0 h LEU 98 N 5.75 0.00 0.00 2.41 5.85 -1.78 -2.30 115.31 125.24 2wn0 h LEU 98 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2wn0 h LEU 98 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 2wn0 h LEU 98 CO 0.87 0.02 0.00 0.61 -0.34 0.00 0.00 178.44 179.60 2wn0 n GLY 99 N -1.18 -1.09 3.66 3.75 0.00 -0.30 -4.83 105.19 105.20 2wn0 n GLY 99 Ca -0.03 -0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 2wn0 n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wn0 s ASP 100 N -2.23 6.75 0.33 1.61 1.01 -0.87 -0.57 116.67 122.71 2wn0 s ASP 100 Ca 0.39 1.89 0.09 0.00 0.71 0.00 0.00 52.55 55.63 2wn0 s ASP 100 Cb 0.21 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.56 2wn0 s ASP 100 CO 0.40 -0.90 0.07 -0.76 0.21 0.00 0.00 175.17 174.18 2wn0 s LEU 101 N 3.96 3.13 0.73 1.23 1.43 -1.06 -3.62 118.68 124.48 2wn0 s LEU 101 Ca 0.64 -0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 52.74 2wn0 s LEU 101 Cb -0.27 -1.57 0.04 0.00 0.03 0.00 0.00 46.19 44.42 2wn0 s LEU 101 CO 0.23 -0.23 1.24 -2.84 0.23 0.00 0.00 176.35 174.97 2wn0 s PRO 102 N -3.77 2.10 0.29 1.29 0.02 -1.26 -4.54 135.00 129.13 2wn0 s PRO 102 Ca 0.36 1.87 -0.30 0.00 0.02 0.00 0.00 61.00 62.96 2wn0 s PRO 102 Cb -0.02 -1.82 -0.13 0.00 0.02 0.00 0.00 34.50 32.56 2wn0 s PRO 102 CO 0.21 -1.89 1.33 0.41 -0.33 0.00 0.00 177.00 176.72 2wn0 n GLY 103 N 0.62 0.62 3.69 0.52 0.00 -1.26 -4.53 105.19 104.85 2wn0 n GLY 103 Ca 0.14 0.40 -0.42 0.00 0.00 0.00 0.00 46.02 46.15 2wn0 n GLY 103 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wn0 s LEU 104 N -0.37 4.31 -0.26 0.99 2.96 0.40 -4.83 118.68 121.88 2wn0 s LEU 104 Ca 0.62 1.96 -0.14 0.00 -0.22 0.00 0.00 54.13 56.35 2wn0 s LEU 104 Cb -0.62 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.47 2wn0 s LEU 104 CO 0.56 -0.61 0.31 -0.69 -1.32 0.00 0.00 176.35 174.60 2wn0 s VAL 105 N 2.07 5.22 -0.21 1.68 1.01 -1.26 -0.43 120.40 128.48 2wn0 s VAL 105 Ca 0.59 0.46 -0.05 0.00 0.00 0.00 0.00 61.98 62.98 2wn0 s VAL 105 Cb -0.28 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 2wn0 s VAL 105 CO 0.25 0.20 -0.00 -0.69 0.00 0.00 0.00 175.10 174.86 2wn0 s VAL 106 N 1.83 3.85 1.11 2.92 1.01 0.15 -4.20 120.40 127.07 2wn0 s VAL 106 Ca 0.13 -0.34 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 2wn0 s VAL 106 Cb -0.16 -2.75 0.26 0.00 0.00 0.00 0.00 36.38 33.73 2wn0 s VAL 106 CO 0.09 0.42 1.05 0.20 0.00 0.00 0.00 175.10 176.86 2wn0 s ASN 107 N 1.16 1.38 0.55 3.32 0.01 0.12 -1.44 114.94 120.05 2wn0 s ASN 107 Ca 0.03 1.61 0.28 0.00 -0.71 0.00 0.00 52.86 54.07 2wn0 s ASN 107 Cb -0.14 -2.33 1.59 0.00 0.41 0.00 0.00 41.25 40.77 2wn0 s ASN 107 CO 0.01 -3.97 2.14 0.00 -1.51 0.00 0.00 177.10 173.77 2wn0 h ALA 108 N -2.46 1.37 -0.25 0.60 0.00 -1.97 -1.85 119.26 114.71 2wn0 h ALA 108 Ca -0.58 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2wn0 h ALA 108 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2wn0 h ALA 108 CO 0.49 0.10 0.00 -0.40 0.00 0.00 0.00 179.25 179.44 2wn0 n ASP 109 N -3.72 1.58 0.00 0.00 5.68 -1.26 -4.75 116.55 114.08 2wn0 n ASP 109 Ca -0.02 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 2wn0 n ASP 109 Cb 0.18 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 2wn0 n ASP 109 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wn0 n GLY 110 N 1.03 1.11 3.89 6.12 0.00 -0.70 -4.77 105.19 111.87 2wn0 n GLY 110 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2wn0 n GLY 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wn0 s THR 111 N -3.27 4.90 -0.12 2.61 -4.23 -1.26 -0.90 115.64 113.38 2wn0 s THR 111 Ca 0.00 0.35 0.02 0.00 -1.18 0.00 0.00 61.69 60.88 2wn0 s THR 111 Cb 0.00 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.12 2wn0 s THR 111 CO 0.00 -0.43 -0.19 0.00 -0.54 0.00 0.00 174.62 173.46 2wn0 s ALA 112 N -2.23 1.99 0.00 3.99 0.00 -0.30 0.16 121.76 125.36 2wn0 s ALA 112 Ca 0.48 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.52 2wn0 s ALA 112 Cb -0.10 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.12 2wn0 s ALA 112 CO 0.31 -0.00 0.00 0.25 0.00 0.00 0.00 175.76 176.31 2wn0 n THR 113 N 4.05 0.00 -1.97 0.00 -2.24 -1.26 -2.07 114.28 110.79 2wn0 n THR 113 Ca -0.20 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 2wn0 n THR 113 Cb 0.52 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2wn0 n THR 113 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2wn0 s TYR 114 N -0.58 1.84 0.33 4.78 5.04 -1.26 -4.33 117.35 123.16 2wn0 s TYR 114 Ca 0.00 0.37 -0.29 0.00 -2.44 0.00 0.00 57.07 54.71 2wn0 s TYR 114 Cb 0.00 -4.01 -0.11 0.00 0.35 0.00 0.00 41.96 38.20 2wn0 s TYR 114 CO 0.00 -3.56 1.40 -2.14 -1.34 0.00 0.00 175.55 169.90 2wn0 s PRO 115 N 4.84 4.25 -0.06 4.97 0.02 -1.26 -4.57 135.00 143.20 2wn0 s PRO 115 Ca 0.78 2.36 0.04 0.00 0.02 0.00 0.00 61.00 64.20 2wn0 s PRO 115 Cb -0.29 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.19 2wn0 s PRO 115 CO 0.32 -0.35 -0.16 0.14 -0.33 0.00 0.00 177.00 176.62 2wn0 s VAL 116 N -0.89 1.37 -0.18 3.83 -7.23 0.12 -4.97 120.40 112.45 2wn0 s VAL 116 Ca 0.52 -0.66 -0.11 0.00 -1.81 0.00 0.00 61.98 59.93 2wn0 s VAL 116 Cb -0.43 -1.20 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 2wn0 s VAL 116 CO 0.54 0.40 0.18 -0.22 -0.31 0.00 0.00 175.10 175.69 2wn0 s LEU 117 N 0.27 4.25 -0.65 1.32 2.96 -1.26 -0.44 118.68 125.12 2wn0 s LEU 117 Ca -0.09 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.15 2wn0 s LEU 117 Cb -0.13 -2.17 0.17 0.00 0.50 0.00 0.00 46.19 44.56 2wn0 s LEU 117 CO 0.03 0.19 0.46 0.00 -1.32 0.00 0.00 176.35 175.72 2wn0 s ALA 118 N 0.18 3.65 0.60 5.97 0.00 0.08 -4.62 121.76 127.61 2wn0 s ALA 118 Ca 0.11 -3.39 0.32 0.00 0.00 0.00 0.00 51.96 49.01 2wn0 s ALA 118 Cb -0.12 -2.59 1.92 0.00 0.00 0.00 0.00 23.12 22.33 2wn0 s ALA 118 CO 0.01 -2.11 2.27 -1.00 0.00 0.00 0.00 175.76 174.93 2wn0 h PRO 119 N 6.72 0.00 0.00 0.00 0.13 -1.77 -1.93 132.00 135.15 2wn0 h PRO 119 Ca 0.01 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 2wn0 h PRO 119 Cb 0.91 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.04 2wn0 h PRO 119 CO 0.73 0.00 -0.14 0.00 -0.23 0.00 0.00 178.00 178.36 2wn0 h ARG 120 N 0.00 0.00 -5.53 0.86 3.08 -1.86 -3.41 114.38 107.52 2wn0 h ARG 120 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.47 2wn0 h ARG 120 Cb 0.03 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.98 2wn0 h ARG 120 CO -0.00 0.14 -0.30 -0.51 -1.07 0.00 0.00 179.97 178.23 2wn0 s LEU 121 N -6.41 4.25 -0.14 3.04 1.43 -0.73 -4.99 118.68 115.13 2wn0 s LEU 121 Ca 0.03 0.55 0.06 0.00 -1.03 0.00 0.00 54.13 53.74 2wn0 s LEU 121 Cb 0.08 -2.41 -0.13 0.00 0.03 0.00 0.00 46.19 43.76 2wn0 s LEU 121 CO 0.63 0.09 -0.04 0.29 0.23 0.00 0.00 176.35 177.55 2wn0 n LYS 122 N 3.55 1.24 -4.10 1.70 4.76 -1.26 -0.54 118.16 123.50 2wn0 n LYS 122 Ca -0.11 0.04 -0.13 0.00 -2.87 0.00 0.00 58.31 55.23 2wn0 n LYS 122 Cb 0.52 -1.32 -0.11 0.00 -1.84 0.00 0.00 35.03 32.28 2wn0 n LYS 122 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2wn0 s SER 123 N -4.99 1.06 0.49 4.39 1.04 -1.26 -4.64 113.70 109.79 2wn0 s SER 123 Ca -0.13 -0.66 0.23 0.00 0.48 0.00 0.00 55.95 55.87 2wn0 s SER 123 Cb 0.05 0.03 1.28 0.00 0.10 0.00 0.00 66.02 67.48 2wn0 s SER 123 CO 0.44 -0.24 1.95 -0.07 0.98 0.00 0.00 173.24 176.30 2wn0 h LEU 124 N 4.13 0.15 -1.86 2.42 3.38 -1.97 -0.83 115.31 120.74 2wn0 h LEU 124 Ca -0.36 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2wn0 h LEU 124 Cb 1.19 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2wn0 h LEU 124 CO 0.46 0.07 0.08 0.77 0.09 0.00 0.00 178.44 179.91 2wn0 h SER 125 N 0.16 0.00 0.83 -0.43 4.64 -1.96 -1.09 113.55 115.70 2wn0 h SER 125 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2wn0 h SER 125 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2wn0 h SER 125 CO -0.05 0.00 -0.83 -0.33 -0.87 0.00 0.00 176.83 174.75 2wn0 h GLU 126 N 0.00 0.00 0.00 4.77 5.08 -1.57 -3.36 114.58 119.49 2wn0 h GLU 126 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wn0 h GLU 126 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2wn0 h GLU 126 CO 0.00 0.00 -0.81 1.33 -1.00 0.00 0.00 179.01 178.53 2wn0 n VAL 127 N -2.28 0.00 -2.10 3.13 0.24 -0.46 -4.99 118.33 111.87 2wn0 n VAL 127 Ca 0.02 -0.26 -0.38 0.00 -2.04 0.00 0.00 64.34 61.68 2wn0 n VAL 127 Cb 0.48 0.70 -0.00 0.00 -1.47 0.00 0.00 33.84 33.55 2wn0 n VAL 127 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2wn0 s LYS 128 N -2.11 3.77 -1.25 7.34 1.02 -0.93 -2.98 119.74 124.60 2wn0 s LYS 128 Ca 0.00 2.01 0.00 0.00 0.02 0.00 0.00 55.97 58.00 2wn0 s LYS 128 Cb 0.06 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.82 2wn0 s LYS 128 CO 0.34 -0.61 0.00 1.04 -0.92 0.00 0.00 175.35 175.20 2wn0 n GLN 129 N -0.27 -1.13 -4.37 1.68 1.13 -0.55 -5.02 117.38 108.86 2wn0 n GLN 129 Ca 0.06 0.72 -0.19 0.00 -1.94 0.00 0.00 57.00 55.65 2wn0 n GLN 129 Cb 0.46 -5.00 -0.10 0.00 0.11 0.00 0.00 30.24 25.70 2wn0 n GLN 129 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2wn0 s HIS 130 N -2.70 1.72 -0.17 1.08 3.76 -1.16 -3.58 115.29 114.25 2wn0 s HIS 130 Ca 0.00 -1.01 -0.10 0.00 -0.15 0.00 0.00 55.06 53.81 2wn0 s HIS 130 Cb 0.00 -1.05 -0.05 0.00 1.11 0.00 0.00 32.58 32.59 2wn0 s HIS 130 CO 0.00 -0.10 0.16 0.00 -0.85 0.00 0.00 174.74 173.95 2wn0 s ALA 131 N -3.46 3.73 -0.33 -1.40 0.00 -0.91 -1.00 121.76 118.39 2wn0 s ALA 131 Ca 0.34 -0.64 -0.21 0.00 0.00 0.00 0.00 51.96 51.45 2wn0 s ALA 131 Cb 0.07 -2.15 -0.00 0.00 0.00 0.00 0.00 23.12 21.05 2wn0 s ALA 131 CO 0.13 0.28 0.68 -1.17 0.00 0.00 0.00 175.76 175.68 2wn0 s LEU 132 N -0.04 4.17 -0.06 0.00 2.96 0.12 -0.10 118.68 125.73 2wn0 s LEU 132 Ca 0.11 0.37 0.02 0.00 -0.22 0.00 0.00 54.13 54.42 2wn0 s LEU 132 Cb -0.12 -2.88 -0.03 0.00 0.50 0.00 0.00 46.19 43.67 2wn0 s LEU 132 CO 0.01 -0.57 -0.10 -0.32 -1.32 0.00 0.00 176.35 174.04 2wn0 s MET 133 N 2.76 2.64 -0.20 1.98 -2.45 0.46 -1.20 119.30 123.29 2wn0 s MET 133 Ca 0.27 -0.62 0.01 0.00 -1.25 0.00 0.00 55.69 54.10 2wn0 s MET 133 Cb -0.14 -2.49 0.04 0.00 1.25 0.00 0.00 34.83 33.49 2wn0 s MET 133 CO 0.13 0.64 -0.12 0.42 1.05 0.00 0.00 175.02 177.14 2wn0 s ILE 134 N -0.75 1.77 0.52 10.11 1.01 0.54 -2.26 121.20 132.13 2wn0 s ILE 134 Ca 0.12 -1.07 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 2wn0 s ILE 134 Cb -0.11 -1.81 -0.00 0.00 0.01 0.00 0.00 42.46 40.56 2wn0 s ILE 134 CO 0.01 0.21 0.78 -1.00 0.00 0.00 0.00 174.94 174.94 2wn0 s HIS 135 N 1.34 3.26 0.09 3.97 3.76 -0.21 -1.42 115.29 126.09 2wn0 s HIS 135 Ca -0.01 0.46 -0.11 0.00 -0.15 0.00 0.00 55.06 55.25 2wn0 s HIS 135 Cb -0.16 -2.51 -0.19 0.00 1.11 0.00 0.00 32.58 30.84 2wn0 s HIS 135 CO -0.09 -0.57 1.23 0.00 -0.85 0.00 0.00 174.74 174.47 2wn0 h ALA 136 N 0.12 0.21 -4.45 -1.40 0.00 -0.95 -3.39 119.26 109.40 2wn0 h ALA 136 Ca -0.46 -0.70 -0.26 0.00 0.00 0.00 0.00 54.91 53.50 2wn0 h ALA 136 Cb 1.25 0.03 0.06 0.00 0.00 0.00 0.00 17.79 19.13 2wn0 h ALA 136 CO 0.59 0.72 0.10 0.41 0.00 0.00 0.00 179.25 181.08 2wn0 n GLY 137 N 1.02 0.27 0.00 0.00 0.00 0.03 -4.91 105.19 101.60 2wn0 n GLY 137 Ca -0.10 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2wn0 n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn0 n GLY 138 N 0.57 1.45 3.15 -0.02 0.00 -1.24 -0.78 105.19 108.32 2wn0 n GLY 138 Ca 0.09 -1.68 0.04 0.00 0.00 0.00 0.00 46.02 44.48 2wn0 n GLY 138 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wn0 s ASP 139 N -1.00 -1.31 -0.07 1.61 -1.08 -1.22 -3.01 116.67 110.59 2wn0 s ASP 139 Ca 0.00 0.59 0.13 0.00 -0.52 0.00 0.00 52.55 52.74 2wn0 s ASP 139 Cb 0.00 2.00 0.49 0.00 -1.46 0.00 0.00 42.92 43.95 2wn0 s ASP 139 CO 0.00 -0.24 1.35 -0.46 0.52 0.00 0.00 175.17 176.34 2wn0 n ASN 140 N 5.42 3.35 -3.27 -0.34 6.94 -1.02 -4.83 115.26 121.51 2wn0 n ASN 140 Ca 0.00 -2.28 -0.23 0.00 -0.02 0.00 0.00 54.58 52.05 2wn0 n ASN 140 Cb 0.52 -0.47 0.05 0.00 -2.36 0.00 0.00 39.78 37.53 2wn0 n ASN 140 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2wn0 n TYR 141 N 0.71 -2.37 -3.54 -2.53 0.53 -1.26 -4.97 117.16 103.72 2wn0 n TYR 141 Ca 0.18 0.74 -0.11 0.00 -1.02 0.00 0.00 57.90 57.68 2wn0 n TYR 141 Cb 0.63 -4.76 -0.04 0.00 -1.03 0.00 0.00 39.34 34.15 2wn0 n TYR 141 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 2wn0 s SER 142 N -2.97 -0.38 0.00 7.72 0.15 -1.21 -3.77 113.70 113.25 2wn0 s SER 142 Ca 0.43 -0.18 0.17 0.00 0.70 0.00 0.00 55.95 57.07 2wn0 s SER 142 Cb -0.19 0.53 0.54 0.00 -1.71 0.00 0.00 66.02 65.19 2wn0 s SER 142 CO 0.53 -0.90 1.42 0.47 1.20 0.00 0.00 173.24 175.96 2wn0 n ASP 143 N -0.28 1.97 -4.20 5.45 8.00 -1.21 -0.41 116.55 125.87 2wn0 n ASP 143 Ca -0.16 -1.86 -0.26 0.00 0.71 0.00 0.00 54.79 53.21 2wn0 n ASP 143 Cb 0.64 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.40 2wn0 n ASP 143 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2wn0 s HIS 144 N -1.63 1.74 -1.10 1.24 3.76 -1.26 -3.55 115.29 114.49 2wn0 s HIS 144 Ca 0.30 -0.33 0.28 0.00 -0.15 0.00 0.00 55.06 55.16 2wn0 s HIS 144 Cb 0.16 -1.12 1.25 0.00 1.11 0.00 0.00 32.58 33.99 2wn0 s HIS 144 CO 0.23 -0.02 1.92 -0.35 -0.85 0.00 0.00 174.74 175.66 2wn0 n PRO 145 N 2.56 0.10 -4.29 8.40 -0.05 -1.26 -4.95 135.00 135.50 2wn0 n PRO 145 Ca -0.15 0.02 -0.24 0.00 -0.05 0.00 0.00 63.50 63.08 2wn0 n PRO 145 Cb 0.53 -1.50 -0.12 0.00 -0.05 0.00 0.00 33.50 32.36 2wn0 n PRO 145 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 175.50 173.81 2wn0 s MET 146 N -2.90 1.12 0.47 0.54 -1.94 -1.23 -5.09 119.30 110.27 2wn0 s MET 146 Ca 0.17 -1.17 -0.24 0.00 -1.71 0.00 0.00 55.69 52.73 2wn0 s MET 146 Cb 0.18 -1.37 -0.07 0.00 2.01 0.00 0.00 34.83 35.59 2wn0 s MET 146 CO 0.49 0.31 1.31 -2.14 -0.01 0.00 0.00 175.02 174.98 2wn0 s PRO 147 N -1.97 3.62 -1.48 2.03 0.02 -1.23 -3.38 135.00 132.61 2wn0 s PRO 147 Ca 0.07 2.13 -0.07 0.00 0.02 0.00 0.00 61.00 63.15 2wn0 s PRO 147 Cb -0.10 -2.51 0.02 0.00 0.02 0.00 0.00 34.50 31.94 2wn0 s PRO 147 CO 0.04 -0.77 0.77 1.28 -0.33 0.00 0.00 177.00 177.99 2wn0 n LEU 148 N -0.42 -2.69 0.00 -5.54 4.77 -1.25 -1.90 117.00 109.97 2wn0 n LEU 148 Ca 0.07 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 2wn0 n LEU 148 Cb 0.45 -2.84 0.00 0.00 -2.33 0.00 0.00 43.42 38.70 2wn0 n LEU 148 CO 0.53 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 2wn0 n GLY 149 N -1.62 0.77 2.00 -0.72 0.00 0.45 -3.00 105.19 103.08 2wn0 n GLY 149 Ca -0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.96 2wn0 n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn0 n GLY 150 N -2.10 0.38 0.25 -0.02 0.00 -0.80 -2.44 105.19 100.47 2wn0 n GLY 150 Ca 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 46.02 45.04 2wn0 n GLY 150 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wn0 h GLY 151 N 0.00 0.16 0.00 -0.02 0.00 -1.45 -3.30 103.07 98.46 2wn0 h GLY 151 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2wn0 h GLY 151 CO 0.00 0.08 0.00 0.61 0.00 0.00 0.00 176.54 177.23 2wn0 n GLY 152 N -1.17 2.93 3.74 4.60 0.00 -1.26 -0.79 105.19 113.24 2wn0 n GLY 152 Ca -0.01 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.30 2wn0 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wn0 s ALA 153 N -2.00 2.15 -0.18 4.61 0.00 -1.26 -4.74 121.76 120.34 2wn0 s ALA 153 Ca 0.00 0.54 -0.15 0.00 0.00 0.00 0.00 51.96 52.35 2wn0 s ALA 153 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 2wn0 s ALA 153 CO 0.00 -1.82 0.36 1.03 0.00 0.00 0.00 175.76 175.33 2wn0 s ARG 154 N -4.39 4.23 0.00 0.00 0.52 -1.26 -0.92 118.95 117.13 2wn0 s ARG 154 Ca 0.67 0.18 0.00 0.00 -0.52 0.00 0.00 55.73 56.06 2wn0 s ARG 154 Cb -0.22 -3.48 0.00 0.00 0.52 0.00 0.00 34.95 31.77 2wn0 s ARG 154 CO 0.50 0.10 0.18 0.00 0.02 0.00 0.00 175.30 176.09 2wn0 n MET 155 N 4.01 2.49 -3.58 3.54 0.00 -0.51 -4.76 117.12 118.31 2wn0 n MET 155 Ca -0.10 -0.18 -0.15 0.00 0.00 0.00 0.00 57.70 57.28 2wn0 n MET 155 Cb 0.51 -0.62 -0.06 0.00 0.00 0.00 0.00 33.22 33.05 2wn0 n MET 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2wn0 s ALA 156 N -0.41 -1.82 0.03 3.17 0.00 -1.01 -0.74 121.76 120.98 2wn0 s ALA 156 Ca 0.00 1.69 -0.23 0.00 0.00 0.00 0.00 51.96 53.42 2wn0 s ALA 156 Cb 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.46 2wn0 s ALA 156 CO 0.00 -0.33 0.53 0.00 0.00 0.00 0.00 175.76 175.96 2wn0 s GLY 158 N -1.80 -0.25 -0.24 0.00 0.00 -0.34 -0.67 107.32 104.01 2wn0 s GLY 158 Ca -0.07 0.92 -0.20 0.00 0.00 0.00 0.00 44.72 45.37 2wn0 s GLY 158 CO 0.01 0.78 0.62 0.14 0.00 0.00 0.00 173.10 174.65 2wn0 s VAL 159 N 0.02 5.00 0.03 1.40 1.01 -1.26 0.16 120.40 126.76 2wn0 s VAL 159 Ca -0.01 1.13 -0.30 0.00 0.00 0.00 0.00 61.98 62.79 2wn0 s VAL 159 Cb -0.03 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2wn0 s VAL 159 CO 0.01 0.05 1.25 -0.63 0.00 0.00 0.00 175.10 175.78 2wn0 s ILE 160 N 2.35 3.96 0.00 2.22 1.01 -0.17 -4.77 121.20 125.81 2wn0 s ILE 160 Ca 0.26 1.37 0.00 0.00 0.00 0.00 0.00 60.65 62.29 2wn0 s ILE 160 Cb -0.16 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.43 2wn0 s ILE 160 CO 0.09 0.06 0.00 1.21 0.00 0.00 0.00 174.94 176.30