#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdz s ASP 2 N 0.00 5.15 0.50 6.12 2.15 -1.26 -4.95 116.67 124.38 2wdz s ASP 2 Ca 0.00 -2.36 0.32 0.00 0.43 0.00 0.00 52.55 50.95 2wdz s ASP 2 Cb 0.00 -1.81 1.38 0.00 -0.30 0.00 0.00 42.92 42.19 2wdz s ASP 2 CO 0.00 -0.46 1.96 1.88 -0.17 0.00 0.00 175.17 178.38 2wdz h TYR 3 N 7.60 0.00 0.00 -5.34 0.05 -2.06 -0.86 116.97 116.36 2wdz h TYR 3 Ca -0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.70 2wdz h TYR 3 Cb 1.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.75 2wdz h TYR 3 CO 0.59 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.70 2wdz h ARG 4 N 0.00 0.00 0.00 4.88 3.08 -2.06 -3.30 114.38 116.98 2wdz h ARG 4 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2wdz h ARG 4 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2wdz h ARG 4 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 2wdz n THR 5 N -2.90 0.55 0.23 2.04 -2.24 -0.91 -4.81 114.28 106.24 2wdz n THR 5 Ca 0.04 -0.55 0.07 0.00 -2.27 0.00 0.00 64.05 61.34 2wdz n THR 5 Cb 0.48 0.74 0.61 0.00 -2.10 0.00 0.00 70.33 70.06 2wdz n THR 5 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2wdz h VAL 6 N 1.31 1.02 -0.09 2.28 3.04 -1.26 -1.06 116.25 121.49 2wdz h VAL 6 Ca 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2wdz h VAL 6 Cb 0.71 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 30.96 2wdz h VAL 6 CO 0.00 0.02 0.00 0.49 -1.01 0.00 0.00 177.57 177.07 2wdz n PHE 7 N -4.52 0.11 -2.10 3.17 3.72 -1.26 -2.62 117.46 113.95 2wdz n PHE 7 Ca -0.02 -0.05 -0.30 0.00 -0.05 0.00 0.00 57.45 57.02 2wdz n PHE 7 Cb 0.09 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 2wdz n PHE 7 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2wdz s ARG 8 N -1.89 3.62 -0.30 -1.08 1.81 -0.40 -4.86 118.95 115.85 2wdz s ARG 8 Ca 0.34 0.64 0.07 0.00 -1.72 0.00 0.00 55.73 55.06 2wdz s ARG 8 Cb 0.18 -2.16 0.46 0.00 -0.45 0.00 0.00 34.95 32.97 2wdz s ARG 8 CO 0.28 -0.45 1.28 1.28 -0.68 0.00 0.00 175.30 177.00 2wdz n LEU 9 N -2.52 4.63 -4.74 2.53 4.77 0.80 -4.55 117.00 117.92 2wdz n LEU 9 Ca 0.05 -4.48 -0.41 0.00 -0.03 0.00 0.00 56.01 51.14 2wdz n LEU 9 Cb 0.54 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 2wdz n LEU 9 CO 0.56 1.86 1.17 -1.81 -1.33 0.00 0.00 177.39 177.84 2wdz s ASP 10 N -3.32 6.54 0.00 -1.43 1.01 -1.21 -1.27 116.67 116.99 2wdz s ASP 10 Ca 0.49 2.77 0.00 0.00 0.71 0.00 0.00 52.55 56.52 2wdz s ASP 10 Cb 0.41 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.71 2wdz s ASP 10 CO 0.01 -0.79 0.00 0.61 0.21 0.00 0.00 175.17 175.21 2wdz n GLY 11 N 2.35 0.22 3.92 0.21 0.00 -1.23 -4.99 105.19 105.67 2wdz n GLY 11 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2wdz n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz s ALA 12 N -1.48 3.57 -0.18 4.61 0.00 -0.40 -4.96 121.76 122.92 2wdz s ALA 12 Ca 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.26 2wdz s ALA 12 Cb 0.00 -2.32 0.03 0.00 0.00 0.00 0.00 23.12 20.83 2wdz s ALA 12 CO 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 175.76 175.50 2wdz s ALA 14 N 1.37 3.00 -0.20 0.00 0.00 0.15 -1.33 121.76 124.76 2wdz s ALA 14 Ca 0.02 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.01 2wdz s ALA 14 Cb -0.15 -1.39 -0.05 0.00 0.00 0.00 0.00 23.12 21.53 2wdz s ALA 14 CO -0.10 0.41 0.22 0.00 0.00 0.00 0.00 175.76 176.29 2wdz s ALA 15 N -0.27 3.63 -0.17 0.00 0.00 -0.38 -0.93 121.76 123.63 2wdz s ALA 15 Ca 0.04 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.37 2wdz s ALA 15 Cb -0.13 -2.33 0.03 0.00 0.00 0.00 0.00 23.12 20.70 2wdz s ALA 15 CO 0.02 0.01 -0.13 0.08 0.00 0.00 0.00 175.76 175.75 2wdz s VAL 16 N 0.65 1.62 0.34 0.00 1.01 -0.57 -0.36 120.40 123.10 2wdz s VAL 16 Ca 0.12 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 2wdz s VAL 16 Cb -0.13 -1.59 -0.08 0.00 0.00 0.00 0.00 36.38 34.58 2wdz s VAL 16 CO 0.02 0.34 0.74 0.42 0.00 0.00 0.00 175.10 176.62 2wdz s THR 17 N 1.44 4.70 -0.98 3.92 -4.23 -0.26 -1.17 115.64 119.07 2wdz s THR 17 Ca 0.02 0.87 0.00 0.00 -1.18 0.00 0.00 61.69 61.41 2wdz s THR 17 Cb -0.14 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.06 2wdz s THR 17 CO -0.10 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.34 2wdz n GLY 18 N -0.56 0.13 0.26 3.99 0.00 0.20 -2.51 105.19 106.70 2wdz n GLY 18 Ca 0.03 -0.44 0.16 0.00 0.00 0.00 0.00 46.02 45.78 2wdz n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz h ALA 19 N 0.44 1.00 0.00 4.61 0.00 -1.63 -3.19 119.26 120.49 2wdz h ALA 19 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2wdz h ALA 19 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2wdz h ALA 19 CO 0.31 0.00 0.00 0.78 0.00 0.00 0.00 179.25 180.34 2wdz h GLY 20 N 2.21 0.00 -2.97 0.00 0.00 -1.83 -2.92 103.07 97.57 2wdz h GLY 20 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2wdz h GLY 20 CO 0.00 0.00 -0.18 -0.45 0.00 0.00 0.00 176.54 175.91 2wdz s SER 21 N -5.42 -0.10 0.75 0.19 0.15 -1.21 -4.74 113.70 103.33 2wdz s SER 21 Ca 0.04 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2wdz s SER 21 Cb 0.08 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2wdz s SER 21 CO 0.55 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2wdz n GLY 22 N -0.20 2.96 0.24 9.45 0.00 -1.26 -2.42 105.19 113.95 2wdz n GLY 22 Ca -0.13 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2wdz n GLY 22 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2wdz h ILE 23 N 0.00 1.29 -0.23 -0.61 2.04 -1.92 -2.38 117.51 115.70 2wdz h ILE 23 Ca 0.00 -1.61 0.03 0.00 1.00 0.00 0.00 64.86 64.28 2wdz h ILE 23 Cb 0.00 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 2wdz h ILE 23 CO 0.00 0.52 0.06 1.23 0.00 0.00 0.00 178.15 179.96 2wdz h GLY 24 N 0.94 0.27 0.85 5.37 0.00 -1.61 -1.14 103.07 107.76 2wdz h GLY 24 Ca 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.37 2wdz h GLY 24 CO 0.09 0.01 0.28 -2.00 0.00 0.00 0.00 176.54 174.92 2wdz h LEU 25 N 0.15 0.44 -0.96 3.11 5.85 -1.27 -1.67 115.31 120.96 2wdz h LEU 25 Ca 0.10 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2wdz h LEU 25 Cb 0.09 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2wdz h LEU 25 CO -0.13 0.31 0.35 -0.08 -0.34 0.00 0.00 178.44 178.56 2wdz h GLU 26 N 0.56 1.10 -0.26 1.25 4.57 -1.16 -1.66 114.58 118.98 2wdz h GLU 26 Ca 0.20 -0.16 0.02 0.00 -1.18 0.00 0.00 59.36 58.24 2wdz h GLU 26 Cb 0.04 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.41 2wdz h GLU 26 CO -0.10 0.85 0.11 0.82 -1.18 0.00 0.00 179.01 179.51 2wdz h ILE 27 N 1.09 0.97 -0.66 2.32 2.04 -0.98 0.30 117.51 122.58 2wdz h ILE 27 Ca 0.26 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 66.13 2wdz h ILE 27 Cb 0.13 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 36.84 2wdz h ILE 27 CO -0.03 0.04 0.31 0.00 0.00 0.00 0.00 178.15 178.47 2wdz h ARG 29 N 0.54 -0.23 -0.89 0.00 3.08 -0.87 0.43 114.38 116.44 2wdz h ARG 29 Ca 0.33 0.02 0.12 0.00 0.07 0.00 0.00 59.98 60.52 2wdz h ARG 29 Cb 0.35 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.37 2wdz h ARG 29 CO -0.27 -0.15 0.51 0.00 -1.07 0.00 0.00 179.97 178.99 2wdz h ALA 30 N 0.68 1.32 0.11 0.04 0.00 -0.34 0.45 119.26 121.52 2wdz h ALA 30 Ca 0.03 0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.71 2wdz h ALA 30 Cb 0.27 -0.11 0.03 0.00 0.00 0.00 0.00 17.79 17.98 2wdz h ALA 30 CO -0.09 0.06 -1.15 0.74 0.00 0.00 0.00 179.25 178.80 2wdz h PHE 31 N 0.78 0.95 -0.41 0.00 -1.00 -0.42 -1.86 116.94 115.00 2wdz h PHE 31 Ca 0.45 -0.60 0.08 0.00 2.81 0.00 0.00 57.97 60.72 2wdz h PHE 31 Cb 0.52 -0.08 -0.08 0.00 3.61 0.00 0.00 35.95 39.93 2wdz h PHE 31 CO -0.05 1.44 -0.09 0.00 -1.61 0.00 0.00 178.31 177.99 2wdz h ALA 32 N 0.27 0.28 0.00 2.45 0.00 0.18 -1.35 119.26 121.09 2wdz h ALA 32 Ca -0.17 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2wdz h ALA 32 Cb 1.84 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.93 2wdz h ALA 32 CO 0.22 -0.45 -0.09 0.00 0.00 0.00 0.00 179.25 178.93 2wdz h ALA 33 N 1.40 1.10 -0.47 0.00 0.00 -0.77 -2.13 119.26 118.38 2wdz h ALA 33 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2wdz h ALA 33 Cb 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wdz h ALA 33 CO -0.41 0.12 0.00 0.43 0.00 0.00 0.00 179.25 179.39 2wdz n SER 34 N -3.34 3.21 0.00 0.00 7.64 -0.59 -4.94 113.62 115.60 2wdz n SER 34 Ca -0.01 -2.20 0.00 0.00 1.01 0.00 0.00 58.87 57.67 2wdz n SER 34 Cb 0.28 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2wdz n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wdz n GLY 35 N 1.03 0.74 3.88 0.23 0.00 -0.80 -0.14 105.19 110.12 2wdz n GLY 35 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2wdz n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz s ALA 36 N -2.10 3.34 0.13 4.61 0.00 -0.72 -3.57 121.76 123.44 2wdz s ALA 36 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.77 2wdz s ALA 36 Cb 0.00 -2.72 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2wdz s ALA 36 CO 0.00 -0.05 0.28 1.03 0.00 0.00 0.00 175.76 177.02 2wdz s ARG 37 N -3.94 3.46 -0.09 0.00 0.52 0.95 -4.36 118.95 115.48 2wdz s ARG 37 Ca 0.51 -0.51 0.04 0.00 -0.52 0.00 0.00 55.73 55.25 2wdz s ARG 37 Cb -0.10 -2.96 -0.00 0.00 0.52 0.00 0.00 34.95 32.40 2wdz s ARG 37 CO 0.33 0.52 -0.24 -0.51 0.02 0.00 0.00 175.30 175.42 2wdz s LEU 38 N -3.06 2.09 -0.38 2.53 1.43 0.92 0.32 118.68 122.52 2wdz s LEU 38 Ca 0.35 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 2wdz s LEU 38 Cb -0.12 -1.40 0.03 0.00 0.03 0.00 0.00 46.19 44.73 2wdz s LEU 38 CO 0.28 0.17 0.23 -0.63 0.23 0.00 0.00 176.35 176.63 2wdz s ILE 39 N 0.27 4.71 -0.17 -0.59 -1.09 -0.11 -0.19 121.20 124.03 2wdz s ILE 39 Ca -0.17 -0.82 -0.12 0.00 -2.23 0.00 0.00 60.65 57.31 2wdz s ILE 39 Cb -0.17 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.03 2wdz s ILE 39 CO 0.08 -0.25 0.23 -0.76 -1.23 0.00 0.00 174.94 173.01 2wdz s LEU 40 N 1.58 4.24 -0.06 2.97 1.43 -0.05 -1.51 118.68 127.28 2wdz s LEU 40 Ca 0.03 0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 53.52 2wdz s LEU 40 Cb -0.19 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.80 2wdz s LEU 40 CO 0.07 0.14 -0.02 -0.63 0.23 0.00 0.00 176.35 176.15 2wdz s ILE 41 N 0.37 0.45 -0.08 -0.59 1.09 -0.31 0.04 121.20 122.18 2wdz s ILE 41 Ca 0.13 0.02 -0.23 0.00 -1.10 0.00 0.00 60.65 59.47 2wdz s ILE 41 Cb -0.12 -0.55 0.05 0.00 -1.06 0.00 0.00 42.46 40.78 2wdz s ILE 41 CO 0.02 0.25 0.53 -0.62 -0.10 0.00 0.00 174.94 175.02 2wdz s ASP 42 N 1.54 -0.49 0.51 3.58 -1.08 -1.16 -0.63 116.67 118.93 2wdz s ASP 42 Ca -0.01 0.62 0.32 0.00 -0.52 0.00 0.00 52.55 52.95 2wdz s ASP 42 Cb -0.13 0.61 1.24 0.00 -1.46 0.00 0.00 42.92 43.18 2wdz s ASP 42 CO -0.03 -0.46 1.92 0.08 0.52 0.00 0.00 175.17 177.20 2wdz h ARG 43 N 3.81 0.00 -5.03 4.34 0.11 -1.68 -2.34 114.38 113.59 2wdz h ARG 43 Ca -0.28 0.00 -0.67 0.00 0.10 0.00 0.00 59.98 59.12 2wdz h ARG 43 Cb 1.16 0.00 -0.18 0.00 1.11 0.00 0.00 29.97 32.06 2wdz h ARG 43 CO 0.34 0.00 0.20 -2.00 0.10 0.00 0.00 179.97 178.60 2wdz s GLU 44 N -3.59 3.11 0.25 0.08 2.12 -1.26 -4.74 118.70 114.67 2wdz s GLU 44 Ca 0.02 -0.97 -0.05 0.00 0.36 0.00 0.00 54.97 54.34 2wdz s GLU 44 Cb 0.09 -4.17 0.36 0.00 0.26 0.00 0.00 34.13 30.67 2wdz s GLU 44 CO 0.54 -1.44 1.84 0.00 -0.54 0.00 0.00 175.26 175.66 2wdz h ALA 45 N 9.18 1.21 -0.11 6.30 0.00 -1.99 -1.79 119.26 132.05 2wdz h ALA 45 Ca -0.28 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.64 2wdz h ALA 45 Cb 1.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2wdz h ALA 45 CO 1.06 0.25 0.05 0.00 0.00 0.00 0.00 179.25 180.61 2wdz h ALA 46 N 1.42 0.13 -0.64 0.00 0.00 -1.98 -2.27 119.26 115.93 2wdz h ALA 46 Ca 0.39 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.29 2wdz h ALA 46 Cb 0.22 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2wdz h ALA 46 CO -0.19 -0.40 0.34 0.00 0.00 0.00 0.00 179.25 179.00 2wdz h ALA 47 N 1.06 0.82 -0.43 0.00 0.00 -1.82 -2.91 119.26 115.97 2wdz h ALA 47 Ca 0.05 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2wdz h ALA 47 Cb 0.01 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 17.48 2wdz h ALA 47 CO -0.04 0.34 0.03 -0.07 0.00 0.00 0.00 179.25 179.51 2wdz h LEU 48 N 0.87 -0.12 -0.94 0.00 3.38 -1.04 -0.32 115.31 117.13 2wdz h LEU 48 Ca 0.22 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.19 2wdz h LEU 48 Cb 0.06 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2wdz h LEU 48 CO -0.03 -0.03 -0.28 -0.78 0.09 0.00 0.00 178.44 177.41 2wdz h ASP 49 N 0.14 0.44 0.21 -0.43 -0.00 -1.28 0.11 116.42 115.61 2wdz h ASP 49 Ca 0.21 -0.16 -0.01 0.00 -0.00 0.00 0.00 57.03 57.08 2wdz h ASP 49 Cb 0.30 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 39.51 2wdz h ASP 49 CO -0.33 0.72 -0.10 0.03 -0.00 0.00 0.00 179.24 179.55 2wdz h ARG 50 N 0.39 -0.27 -0.35 0.28 3.08 -1.32 0.25 114.38 116.44 2wdz h ARG 50 Ca 0.05 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.20 2wdz h ARG 50 Cb 0.69 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.72 2wdz h ARG 50 CO 0.05 -0.09 -0.30 0.00 -1.07 0.00 0.00 179.97 178.56 2wdz h ALA 51 N 0.37 -0.16 -0.62 0.04 0.00 -0.70 -1.95 119.26 116.25 2wdz h ALA 51 Ca -0.03 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2wdz h ALA 51 Cb 0.30 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2wdz h ALA 51 CO 0.05 -0.71 0.13 0.00 0.00 0.00 0.00 179.25 178.73 2wdz h ALA 52 N 0.77 0.81 -0.36 0.00 0.00 -0.55 -0.49 119.26 119.45 2wdz h ALA 52 Ca 0.16 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2wdz h ALA 52 Cb 0.52 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2wdz h ALA 52 CO -0.49 0.54 0.24 0.37 0.00 0.00 0.00 179.25 179.91 2wdz h GLN 53 N 0.91 0.32 0.20 0.00 4.15 -0.34 -2.03 115.11 118.31 2wdz h GLN 53 Ca 0.19 -0.02 -0.34 0.00 0.77 0.00 0.00 58.65 59.26 2wdz h GLN 53 Cb 0.38 -0.07 0.02 0.00 0.21 0.00 0.00 27.48 28.01 2wdz h GLN 53 CO 0.01 0.21 -1.62 1.49 -1.93 0.00 0.00 178.83 176.99 2wdz h GLU 54 N 0.33 0.42 -0.00 1.69 4.81 -0.64 -3.35 114.58 117.83 2wdz h GLU 54 Ca 0.15 -0.71 -0.10 0.00 -0.13 0.00 0.00 59.36 58.57 2wdz h GLU 54 Cb 0.20 0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2wdz h GLU 54 CO -0.03 1.34 -0.48 -0.07 -0.73 0.00 0.00 179.01 179.04 2wdz h LEU 55 N 0.06 0.01 0.00 1.64 3.38 -0.99 -3.49 115.31 115.92 2wdz h LEU 55 Ca -0.31 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2wdz h LEU 55 Cb 2.07 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.81 2wdz h LEU 55 CO 0.19 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.82 2wdz n GLY 56 N -0.15 1.29 0.07 0.83 0.00 -0.78 -3.70 105.19 102.76 2wdz n GLY 56 Ca -0.02 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.57 2wdz n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz n ALA 57 N 10.32 1.94 0.46 4.61 0.00 -1.26 -2.69 120.51 133.89 2wdz n ALA 57 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2wdz n ALA 57 Cb 0.00 -1.39 0.43 0.00 0.00 0.00 0.00 19.45 18.49 2wdz n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdz n ALA 58 N -1.66 1.71 -2.58 0.00 0.00 -1.24 -4.68 120.51 112.05 2wdz n ALA 58 Ca 0.04 0.03 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 2wdz n ALA 58 Cb 0.28 -1.34 -0.06 0.00 0.00 0.00 0.00 19.45 18.33 2wdz n ALA 58 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wdz s VAL 59 N -3.19 4.89 -0.11 0.00 1.01 -1.09 -0.06 120.40 121.85 2wdz s VAL 59 Ca 0.06 0.67 0.08 0.00 0.00 0.00 0.00 61.98 62.78 2wdz s VAL 59 Cb 0.10 -4.07 -0.24 0.00 0.00 0.00 0.00 36.38 32.17 2wdz s VAL 59 CO 0.36 -0.28 0.41 0.00 0.00 0.00 0.00 175.10 175.59 2wdz n ALA 60 N 6.03 1.33 -3.20 5.51 0.00 0.74 -4.89 120.51 126.04 2wdz n ALA 60 Ca -0.01 -0.84 -0.11 0.00 0.00 0.00 0.00 53.44 52.48 2wdz n ALA 60 Cb 0.49 -0.63 -0.04 0.00 0.00 0.00 0.00 19.45 19.27 2wdz n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdz s ALA 61 N -2.56 -1.14 -0.06 0.00 0.00 -0.98 -5.00 121.76 112.02 2wdz s ALA 61 Ca -0.13 0.08 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2wdz s ALA 61 Cb 0.07 0.79 0.02 0.00 0.00 0.00 0.00 23.12 24.00 2wdz s ALA 61 CO 0.79 -0.72 -0.04 -0.98 0.00 0.00 0.00 175.76 174.81 2wdz s ARG 62 N -3.80 0.90 -0.20 0.00 1.70 -1.26 -0.87 118.95 115.42 2wdz s ARG 62 Ca 0.04 -0.09 0.01 0.00 -0.47 0.00 0.00 55.73 55.21 2wdz s ARG 62 Cb 0.00 -0.97 0.04 0.00 -0.57 0.00 0.00 34.95 33.45 2wdz s ARG 62 CO -0.10 -0.14 -0.11 0.42 -1.08 0.00 0.00 175.30 174.28 2wdz s ILE 63 N 1.20 1.71 -0.12 4.99 1.01 0.11 -4.95 121.20 125.14 2wdz s ILE 63 Ca -0.06 -1.02 -0.29 0.00 0.00 0.00 0.00 60.65 59.27 2wdz s ILE 63 Cb -0.14 -1.75 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 2wdz s ILE 63 CO -0.02 0.21 1.30 -0.69 0.00 0.00 0.00 174.94 175.75 2wdz s VAL 64 N 1.37 4.16 -0.25 2.92 1.01 -1.26 -2.98 120.40 125.37 2wdz s VAL 64 Ca -0.01 1.43 -0.26 0.00 0.00 0.00 0.00 61.98 63.15 2wdz s VAL 64 Cb -0.16 -3.92 0.08 0.00 0.00 0.00 0.00 36.38 32.38 2wdz s VAL 64 CO -0.09 -0.09 0.77 0.00 0.00 0.00 0.00 175.10 175.70 2wdz s ALA 65 N 3.22 -1.81 -0.27 5.51 0.00 -0.88 -4.95 121.76 122.57 2wdz s ALA 65 Ca 0.58 1.94 -0.21 0.00 0.00 0.00 0.00 51.96 54.27 2wdz s ALA 65 Cb -0.24 -1.12 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 2wdz s ALA 65 CO 0.18 -0.32 0.65 0.34 0.00 0.00 0.00 175.76 176.61 2wdz s ASP 66 N 0.21 6.57 0.60 0.00 -1.08 -1.26 -1.81 116.67 119.89 2wdz s ASP 66 Ca -0.00 0.63 0.34 0.00 -0.52 0.00 0.00 52.55 53.00 2wdz s ASP 66 Cb -0.05 -2.35 1.91 0.00 -1.46 0.00 0.00 42.92 40.98 2wdz s ASP 66 CO 0.00 -0.43 2.24 -0.37 0.52 0.00 0.00 175.17 177.13 2wdz h VAL 67 N 5.47 0.33 0.00 1.11 -1.51 -1.96 -2.49 116.25 117.20 2wdz h VAL 67 Ca -0.26 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 2wdz h VAL 67 Cb 1.12 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2wdz h VAL 67 CO 0.80 0.03 0.00 0.71 -1.23 0.00 0.00 177.57 177.87 2wdz h THR 68 N 0.00 0.00 -2.43 7.19 1.35 -1.88 -3.38 112.91 113.76 2wdz h THR 68 Ca -0.00 -0.47 -0.63 0.00 -0.55 0.00 0.00 66.41 64.76 2wdz h THR 68 Cb 0.11 1.40 -0.14 0.00 -1.73 0.00 0.00 68.15 67.79 2wdz h THR 68 CO 0.00 0.00 0.75 -0.62 -0.25 0.00 0.00 175.52 175.40 2wdz s ASP 69 N -5.29 6.30 0.25 5.36 -1.08 -0.94 -4.84 116.67 116.43 2wdz s ASP 69 Ca 0.03 -1.20 -0.04 0.00 -0.52 0.00 0.00 52.55 50.82 2wdz s ASP 69 Cb 0.09 -2.44 0.48 0.00 -1.46 0.00 0.00 42.92 39.58 2wdz s ASP 69 CO 0.51 -1.41 1.72 0.00 0.52 0.00 0.00 175.17 176.51 2wdz h ALA 70 N 9.48 1.05 0.00 3.66 0.00 -1.85 -1.87 119.26 129.73 2wdz h ALA 70 Ca -0.15 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2wdz h ALA 70 Cb 1.05 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2wdz h ALA 70 CO 1.20 -0.25 -0.51 1.05 0.00 0.00 0.00 179.25 180.73 2wdz h GLU 71 N 0.39 0.00 -0.14 0.00 4.11 -1.96 -2.36 114.58 114.62 2wdz h GLU 71 Ca 0.42 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.76 2wdz h GLU 71 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2wdz h GLU 71 CO -0.44 0.51 -0.31 0.00 0.07 0.00 0.00 179.01 178.85 2wdz h ALA 72 N 1.49 1.22 -0.23 1.06 0.00 -1.69 -2.41 119.26 118.70 2wdz h ALA 72 Ca -0.01 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 2wdz h ALA 72 Cb 0.98 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2wdz h ALA 72 CO 0.07 0.52 -0.25 0.52 0.00 0.00 0.00 179.25 180.11 2wdz h MET 73 N 0.24 0.57 -0.52 0.00 2.86 -1.10 -1.01 114.93 115.97 2wdz h MET 73 Ca 0.03 -0.31 0.07 0.00 -2.06 0.00 0.00 59.70 57.43 2wdz h MET 73 Cb 0.67 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 32.29 2wdz h MET 73 CO 0.05 0.91 0.20 1.15 1.06 0.00 0.00 176.91 180.27 2wdz h THR 74 N 0.27 0.84 -0.46 2.22 2.02 -1.44 0.43 112.91 116.78 2wdz h THR 74 Ca 0.03 -0.13 -0.05 0.00 0.77 0.00 0.00 66.41 67.03 2wdz h THR 74 Cb 0.81 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2wdz h THR 74 CO 0.06 0.07 0.08 0.00 0.37 0.00 0.00 175.52 176.10 2wdz h ALA 75 N 1.34 0.61 -0.62 6.16 0.00 -1.41 -1.73 119.26 123.60 2wdz h ALA 75 Ca 0.25 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2wdz h ALA 75 Cb 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2wdz h ALA 75 CO -0.24 0.33 0.38 0.00 0.00 0.00 0.00 179.25 179.72 2wdz h ALA 76 N 0.95 0.81 -0.73 0.00 0.00 -0.62 0.20 119.26 119.88 2wdz h ALA 76 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2wdz h ALA 76 Cb 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2wdz h ALA 76 CO 0.01 0.13 0.48 0.00 0.00 0.00 0.00 179.25 179.87 2wdz h ALA 77 N 1.27 0.93 0.10 0.00 0.00 -0.74 0.11 119.26 120.92 2wdz h ALA 77 Ca 0.25 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2wdz h ALA 77 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2wdz h ALA 77 CO -0.10 0.36 -0.13 0.00 0.00 0.00 0.00 179.25 179.38 2wdz h ALA 78 N 1.26 -0.22 -0.36 0.00 0.00 -0.54 0.66 119.26 120.06 2wdz h ALA 78 Ca 0.27 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2wdz h ALA 78 Cb -0.10 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2wdz h ALA 78 CO -0.06 -0.65 0.15 0.93 0.00 0.00 0.00 179.25 179.63 2wdz h GLU 79 N -0.26 0.31 -0.51 0.00 5.08 -0.45 -2.55 114.58 116.20 2wdz h GLU 79 Ca 0.01 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 2wdz h GLU 79 Cb 0.27 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2wdz h GLU 79 CO -0.06 0.21 0.00 0.00 -1.00 0.00 0.00 179.01 178.16 2wdz h ALA 80 N 1.21 0.69 0.00 3.43 0.00 -0.70 -2.49 119.26 121.40 2wdz h ALA 80 Ca 0.16 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 2wdz h ALA 80 Cb 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2wdz h ALA 80 CO -0.13 0.50 -0.15 0.93 0.00 0.00 0.00 179.25 180.40 2wdz h GLU 81 N 0.77 0.00 -0.06 0.00 4.39 -0.79 -1.92 114.58 116.97 2wdz h GLU 81 Ca 0.15 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.71 2wdz h GLU 81 Cb 0.52 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2wdz h GLU 81 CO 0.03 0.15 -0.55 0.00 -1.16 0.00 0.00 179.01 177.47 2wdz h ALA 82 N 1.85 0.96 0.06 3.43 0.00 -1.02 -3.31 119.26 121.24 2wdz h ALA 82 Ca -0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2wdz h ALA 82 Cb 0.34 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2wdz h ALA 82 CO 0.02 0.69 -0.03 0.28 0.00 0.00 0.00 179.25 180.21 2wdz h VAL 83 N 0.14 0.97 -2.42 0.00 2.07 -1.25 -3.48 116.25 112.28 2wdz h VAL 83 Ca -0.00 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 65.91 2wdz h VAL 83 Cb 1.02 1.77 -0.21 0.00 -1.52 0.00 0.00 31.29 32.34 2wdz h VAL 83 CO 0.08 0.30 -0.05 0.00 0.02 0.00 0.00 177.57 177.93 2wdz s ALA 84 N -2.89 -1.36 0.01 1.67 0.00 -0.79 -5.12 121.76 113.29 2wdz s ALA 84 Ca -0.12 1.31 -0.35 0.00 0.00 0.00 0.00 51.96 52.80 2wdz s ALA 84 Cb -0.01 -0.56 -0.14 0.00 0.00 0.00 0.00 23.12 22.42 2wdz s ALA 84 CO 0.43 -0.28 1.67 -2.30 0.00 0.00 0.00 175.76 175.28 2wdz n PRO 85 N 2.14 1.91 -3.06 0.00 -0.02 -1.25 -4.02 135.00 130.70 2wdz n PRO 85 Ca -0.16 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.60 2wdz n PRO 85 Cb 0.56 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.52 2wdz n PRO 85 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wdz s VAL 86 N 2.24 4.87 -0.65 -1.45 1.01 -1.26 -4.30 120.40 120.87 2wdz s VAL 86 Ca 0.87 0.88 0.12 0.00 0.00 0.00 0.00 61.98 63.84 2wdz s VAL 86 Cb -0.77 -4.07 -0.11 0.00 0.00 0.00 0.00 36.38 31.44 2wdz s VAL 86 CO 0.47 -0.23 0.53 -1.54 0.00 0.00 0.00 175.10 174.33 2wdz n SER 87 N 6.05 0.69 -4.09 3.32 3.41 -0.44 -4.63 113.62 117.93 2wdz n SER 87 Ca 0.00 -0.85 -0.22 0.00 -0.26 0.00 0.00 58.87 57.55 2wdz n SER 87 Cb 0.49 0.91 -0.15 0.00 -0.26 0.00 0.00 64.21 65.20 2wdz n SER 87 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wdz s ILE 88 N -2.01 1.05 -0.08 -1.33 1.01 -1.18 -1.10 121.20 117.54 2wdz s ILE 88 Ca 0.05 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.14 2wdz s ILE 88 Cb 0.09 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.71 2wdz s ILE 88 CO 0.45 0.29 -0.09 -0.22 0.00 0.00 0.00 174.94 175.38 2wdz s LEU 89 N -0.32 1.37 -0.25 2.97 2.96 -0.51 -1.25 118.68 123.65 2wdz s LEU 89 Ca 0.05 -0.27 -0.05 0.00 -0.22 0.00 0.00 54.13 53.64 2wdz s LEU 89 Cb -0.05 -0.77 -0.00 0.00 0.50 0.00 0.00 46.19 45.86 2wdz s LEU 89 CO -0.01 -0.05 0.01 -0.69 -1.32 0.00 0.00 176.35 174.29 2wdz s VAL 90 N 1.20 3.62 -0.92 1.68 1.01 0.52 -0.58 120.40 126.93 2wdz s VAL 90 Ca -0.05 -0.58 -0.17 0.00 0.00 0.00 0.00 61.98 61.18 2wdz s VAL 90 Cb -0.14 -2.75 0.16 0.00 0.00 0.00 0.00 36.38 33.65 2wdz s VAL 90 CO -0.02 0.27 1.03 0.20 0.00 0.00 0.00 175.10 176.58 2wdz s ASN 91 N 1.48 6.70 -0.06 3.32 0.02 -0.41 -1.10 114.94 124.89 2wdz s ASN 91 Ca 0.04 -2.31 0.14 0.00 -1.02 0.00 0.00 52.86 49.71 2wdz s ASN 91 Cb -0.16 -2.34 -0.21 0.00 0.02 0.00 0.00 41.25 38.57 2wdz s ASN 91 CO -0.01 -0.89 0.22 -0.24 0.02 0.00 0.00 177.10 176.20 2wdz n SER 92 N 5.67 1.61 -4.71 -1.22 2.88 -1.04 -1.80 113.62 115.01 2wdz n SER 92 Ca 0.22 0.00 -0.57 0.00 -1.33 0.00 0.00 58.87 57.18 2wdz n SER 92 Cb 0.48 1.36 -0.07 0.00 -0.75 0.00 0.00 64.21 65.23 2wdz n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wdz n ALA 93 N -2.20 -0.27 -3.61 -1.46 0.00 -1.09 -4.74 120.51 107.14 2wdz n ALA 93 Ca -0.10 0.40 -0.05 0.00 0.00 0.00 0.00 53.44 53.69 2wdz n ALA 93 Cb 0.60 -2.21 -0.02 0.00 0.00 0.00 0.00 19.45 17.83 2wdz n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wdz s GLY 94 N 3.34 -0.36 0.07 0.00 0.00 -1.26 -4.67 107.32 104.43 2wdz s GLY 94 Ca 0.98 0.81 0.01 0.00 0.00 0.00 0.00 44.72 46.51 2wdz s GLY 94 CO 0.65 0.24 -0.05 -0.26 0.00 0.00 0.00 173.10 173.68 2wdz s ILE 95 N -2.96 0.47 -0.02 0.90 -4.36 -1.26 -5.03 121.20 108.93 2wdz s ILE 95 Ca 0.09 -1.71 0.02 0.00 -0.26 0.00 0.00 60.65 58.80 2wdz s ILE 95 Cb -0.00 -1.39 0.00 0.00 1.25 0.00 0.00 42.46 42.32 2wdz s ILE 95 CO -0.04 -0.83 -0.09 0.00 0.24 0.00 0.00 174.94 174.22 2wdz s ALA 96 N -3.28 0.82 -0.06 2.27 0.00 -1.26 -4.92 121.76 115.33 2wdz s ALA 96 Ca 0.05 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.70 2wdz s ALA 96 Cb 0.03 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.87 2wdz s ALA 96 CO -0.06 0.14 -0.06 1.03 0.00 0.00 0.00 175.76 176.81 2wdz s ARG 97 N 0.17 1.10 0.16 0.00 1.81 -1.26 -5.12 118.95 115.80 2wdz s ARG 97 Ca -0.03 -0.18 -0.30 0.00 -1.72 0.00 0.00 55.73 53.51 2wdz s ARG 97 Cb -0.08 -1.07 -0.07 0.00 -0.45 0.00 0.00 34.95 33.28 2wdz s ARG 97 CO 0.00 -0.09 0.98 -0.51 -0.68 0.00 0.00 175.30 175.01 2wdz s LEU 98 N 1.02 4.54 -0.16 2.53 1.43 -1.26 -4.69 118.68 122.09 2wdz s LEU 98 Ca -0.09 1.90 -0.25 0.00 -1.03 0.00 0.00 54.13 54.66 2wdz s LEU 98 Cb -0.14 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.54 2wdz s LEU 98 CO -0.00 -0.04 0.65 -1.38 0.23 0.00 0.00 176.35 175.81 2wdz s HIS 99 N -0.38 -0.67 0.16 0.29 -3.43 -0.16 -4.99 115.29 106.11 2wdz s HIS 99 Ca 0.46 1.44 -0.30 0.00 -0.80 0.00 0.00 55.06 55.86 2wdz s HIS 99 Cb -0.25 0.30 -0.07 0.00 -1.43 0.00 0.00 32.58 31.13 2wdz s HIS 99 CO 0.32 -0.45 0.96 -0.51 -2.00 0.00 0.00 174.74 173.06 2wdz s ASP 100 N -0.32 7.53 0.17 7.38 -0.00 -1.26 -3.64 116.67 126.54 2wdz s ASP 100 Ca -0.05 1.86 -0.14 0.00 -0.00 0.00 0.00 52.55 54.22 2wdz s ASP 100 Cb -0.03 -2.60 0.12 0.00 -0.00 0.00 0.00 42.92 40.41 2wdz s ASP 100 CO 0.04 -0.00 1.76 0.00 -0.00 0.00 0.00 175.17 176.98 2wdz h ALA 101 N 5.08 0.56 0.00 5.23 0.00 -1.99 -1.19 119.26 126.94 2wdz h ALA 101 Ca -0.44 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 2wdz h ALA 101 Cb 1.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2wdz h ALA 101 CO 0.71 -0.18 -0.21 -0.07 0.00 0.00 0.00 179.25 179.50 2wdz h LEU 102 N 0.39 0.00 -5.39 0.00 3.38 -2.05 -3.13 115.31 108.50 2wdz h LEU 102 Ca 0.21 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.49 2wdz h LEU 102 Cb 0.16 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.57 2wdz h LEU 102 CO -0.18 0.21 0.16 -0.62 0.09 0.00 0.00 178.44 178.09 2wdz n GLU 103 N -3.84 3.88 -4.02 1.13 -0.58 -0.46 -5.02 120.64 111.73 2wdz n GLU 103 Ca -0.02 -4.51 -0.35 0.00 -0.42 0.00 0.00 57.16 51.86 2wdz n GLU 103 Cb 0.30 -2.32 -0.13 0.00 -0.57 0.00 0.00 31.44 28.73 2wdz n GLU 103 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2wdz s THR 104 N -4.74 3.80 0.31 2.62 2.01 -1.13 -4.36 115.64 114.15 2wdz s THR 104 Ca 0.46 -0.36 -0.28 0.00 0.31 0.00 0.00 61.69 61.82 2wdz s THR 104 Cb 0.30 -2.72 -0.09 0.00 0.01 0.00 0.00 72.50 69.99 2wdz s THR 104 CO -0.19 0.42 1.07 1.51 -0.69 0.00 0.00 174.62 176.73 2wdz s ASP 105 N 1.18 7.15 0.41 3.53 1.47 -1.26 -4.91 116.67 124.25 2wdz s ASP 105 Ca 0.03 2.17 0.19 0.00 1.18 0.00 0.00 52.55 56.12 2wdz s ASP 105 Cb -0.15 -2.61 1.12 0.00 -0.34 0.00 0.00 42.92 40.94 2wdz s ASP 105 CO 0.01 -0.22 1.79 0.44 0.68 0.00 0.00 175.17 177.88 2wdz h ASP 106 N 3.46 0.41 0.26 2.11 5.19 -2.00 -1.66 116.42 124.19 2wdz h ASP 106 Ca -0.47 0.07 -0.17 0.00 -0.62 0.00 0.00 57.03 55.84 2wdz h ASP 106 Cb 1.21 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.71 2wdz h ASP 106 CO 0.66 0.10 -0.66 0.00 -3.12 0.00 0.00 179.24 176.22 2wdz h ALA 107 N 1.60 0.69 -0.15 3.45 0.00 -1.99 -1.17 119.26 121.70 2wdz h ALA 107 Ca 0.56 -0.57 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2wdz h ALA 107 Cb 1.47 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2wdz h ALA 107 CO -0.25 0.74 0.03 1.15 0.00 0.00 0.00 179.25 180.92 2wdz h THR 108 N 0.26 1.22 0.18 0.00 2.02 -1.69 -0.96 112.91 113.93 2wdz h THR 108 Ca -0.02 -0.70 0.01 0.00 0.77 0.00 0.00 66.41 66.48 2wdz h THR 108 Cb 1.21 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 2wdz h THR 108 CO 0.11 0.21 -0.23 -0.25 0.37 0.00 0.00 175.52 175.73 2wdz h TRP 109 N 0.04 -0.61 -0.64 3.16 2.91 -1.28 -2.24 115.95 117.29 2wdz h TRP 109 Ca 0.05 0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.17 2wdz h TRP 109 Cb 0.29 0.24 -0.07 0.00 -0.51 0.00 0.00 29.16 29.12 2wdz h TRP 109 CO 0.02 -0.33 0.27 0.00 -1.03 0.00 0.00 178.44 177.36 2wdz h ARG 110 N -0.46 0.46 -0.20 2.65 3.08 -1.20 -2.50 114.38 116.20 2wdz h ARG 110 Ca 0.01 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 59.82 2wdz h ARG 110 Cb 0.45 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.41 2wdz h ARG 110 CO -0.09 0.30 -0.70 0.37 -1.07 0.00 0.00 179.97 178.78 2wdz h GLN 111 N 0.47 0.80 -0.46 0.04 5.75 -0.90 -0.14 115.11 120.68 2wdz h GLN 111 Ca 0.32 -0.60 -0.01 0.00 -0.15 0.00 0.00 58.65 58.20 2wdz h GLN 111 Cb 0.38 0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 2wdz h GLN 111 CO -0.29 1.22 0.24 0.28 -2.65 0.00 0.00 178.83 177.63 2wdz h VAL 112 N 0.57 1.17 -0.57 2.39 2.07 -1.35 -1.47 116.25 119.08 2wdz h VAL 112 Ca -0.03 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 66.93 2wdz h VAL 112 Cb 1.32 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2wdz h VAL 112 CO 0.15 0.19 0.00 0.24 0.02 0.00 0.00 177.57 178.16 2wdz h MET 113 N 0.60 0.97 -0.17 1.57 2.86 -1.43 -0.99 114.93 118.35 2wdz h MET 113 Ca 0.16 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2wdz h MET 113 Cb 0.08 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2wdz h MET 113 CO -0.02 0.96 0.11 0.00 1.06 0.00 0.00 176.91 179.02 2wdz h ALA 114 N 1.09 0.22 0.06 6.32 0.00 -0.85 -1.13 119.26 124.97 2wdz h ALA 114 Ca 0.16 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wdz h ALA 114 Cb 0.52 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2wdz h ALA 114 CO 0.03 -0.31 -0.03 0.28 0.00 0.00 0.00 179.25 179.22 2wdz h VAL 115 N 0.23 0.93 -0.29 0.00 2.07 -1.23 0.14 116.25 118.10 2wdz h VAL 115 Ca 0.06 -1.51 -0.07 0.00 0.82 0.00 0.00 66.70 66.00 2wdz h VAL 115 Cb -0.02 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2wdz h VAL 115 CO -0.02 0.29 -0.13 0.78 0.02 0.00 0.00 177.57 178.51 2wdz h ASN 116 N -0.95 0.48 0.00 0.57 4.21 -1.27 -3.26 115.58 115.37 2wdz h ASN 116 Ca -0.01 -0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.38 2wdz h ASN 116 Cb 0.54 -0.13 0.00 0.00 -1.12 0.00 0.00 38.32 37.61 2wdz h ASN 116 CO 0.01 0.64 -0.32 0.52 -1.29 0.00 0.00 177.43 177.00 2wdz n VAL 117 N -4.20 0.99 -0.03 2.81 0.31 -0.53 -4.42 118.33 113.26 2wdz n VAL 117 Ca 0.00 0.27 -0.10 0.00 -0.01 0.00 0.00 64.34 64.51 2wdz n VAL 117 Cb 0.33 -1.73 -0.04 0.00 -0.91 0.00 0.00 33.84 31.49 2wdz n VAL 117 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2wdz h ASP 118 N -0.32 0.09 -0.99 4.52 3.32 -1.20 -2.08 116.42 119.76 2wdz h ASP 118 Ca 0.00 0.01 0.14 0.00 0.02 0.00 0.00 57.03 57.20 2wdz h ASP 118 Cb 0.32 -0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.78 2wdz h ASP 118 CO 0.00 0.08 0.62 1.23 -1.72 0.00 0.00 179.24 179.45 2wdz h GLY 119 N 0.15 1.62 1.20 2.75 0.00 -0.75 0.37 103.07 108.41 2wdz h GLY 119 Ca 0.07 -0.40 -0.15 0.00 0.00 0.00 0.00 47.33 46.85 2wdz h GLY 119 CO -0.06 0.11 -0.36 1.98 0.00 0.00 0.00 176.54 178.22 2wdz h MET 120 N 0.92 0.89 0.22 4.80 1.85 -1.55 -1.26 114.93 120.79 2wdz h MET 120 Ca 0.51 -0.45 -0.01 0.00 -0.61 0.00 0.00 59.70 59.14 2wdz h MET 120 Cb 0.59 0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.63 2wdz h MET 120 CO -0.28 1.09 -0.10 0.35 -0.40 0.00 0.00 176.91 177.57 2wdz h PHE 121 N 0.73 -0.27 -0.41 1.39 3.57 -0.76 0.94 116.94 122.13 2wdz h PHE 121 Ca 0.07 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.64 2wdz h PHE 121 Cb 0.93 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.69 2wdz h PHE 121 CO 0.06 -0.07 -0.05 -1.49 -2.23 0.00 0.00 178.31 174.53 2wdz h TRP 122 N -0.42 -0.11 -0.47 0.41 -0.00 -0.85 0.16 115.95 114.68 2wdz h TRP 122 Ca -0.03 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 58.87 2wdz h TRP 122 Cb 0.32 0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 29.57 2wdz h TRP 122 CO -0.03 -0.13 0.18 0.00 -0.00 0.00 0.00 178.44 178.47 2wdz h ALA 123 N 1.39 0.61 -0.50 1.49 0.00 -1.15 -2.08 119.26 119.01 2wdz h ALA 123 Ca 0.20 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2wdz h ALA 123 Cb 0.30 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2wdz h ALA 123 CO -0.38 0.22 -0.12 0.77 0.00 0.00 0.00 179.25 179.74 2wdz h SER 124 N 0.61 0.94 -0.47 0.00 0.02 -0.19 0.08 113.55 114.54 2wdz h SER 124 Ca 0.16 -0.31 -0.04 0.00 -0.84 0.00 0.00 61.79 60.75 2wdz h SER 124 Cb 0.20 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 2wdz h SER 124 CO -0.01 1.07 0.13 -0.09 -1.14 0.00 0.00 176.83 176.78 2wdz h ARG 125 N 0.84 0.75 0.24 3.45 2.43 -0.68 -0.76 114.38 120.66 2wdz h ARG 125 Ca 0.13 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2wdz h ARG 125 Cb 0.66 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2wdz h ARG 125 CO 0.05 0.73 -0.12 0.00 -1.51 0.00 0.00 179.97 179.12 2wdz h ALA 126 N 0.99 -0.33 0.00 2.80 0.00 -0.93 -2.59 119.26 119.20 2wdz h ALA 126 Ca 0.15 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 2wdz h ALA 126 Cb 0.31 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2wdz h ALA 126 CO -0.00 -0.53 -0.57 0.74 0.00 0.00 0.00 179.25 178.90 2wdz h PHE 127 N -0.65 0.00 0.00 0.00 0.04 -1.09 -3.28 116.94 111.96 2wdz h PHE 127 Ca -0.03 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.69 2wdz h PHE 127 Cb 0.46 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 2wdz h PHE 127 CO 0.02 0.57 -0.24 0.78 -0.60 0.00 0.00 178.31 178.84 2wdz h GLY 128 N 2.40 0.00 0.02 -1.45 0.00 -1.18 -3.28 103.07 99.59 2wdz h GLY 128 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2wdz h GLY 128 CO 0.07 0.00 -0.41 -0.09 0.00 0.00 0.00 176.54 176.11 2wdz h ARG 129 N 0.00 -0.47 -0.14 4.80 2.43 -1.52 0.73 114.38 120.22 2wdz h ARG 129 Ca -0.00 0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 2wdz h ARG 129 Cb 1.09 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 2wdz h ARG 129 CO 0.03 -0.31 -0.39 0.00 -1.51 0.00 0.00 179.97 177.79 2wdz h ALA 130 N 0.14 1.09 -0.36 2.80 0.00 -1.78 -2.29 119.26 118.87 2wdz h ALA 130 Ca 0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2wdz h ALA 130 Cb 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2wdz h ALA 130 CO -0.39 0.59 0.18 0.52 0.00 0.00 0.00 179.25 180.14 2wdz h MET 131 N 0.25 0.52 -0.73 0.00 2.86 -1.52 0.97 114.93 117.28 2wdz h MET 131 Ca 0.03 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2wdz h MET 131 Cb 0.80 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.33 2wdz h MET 131 CO 0.06 0.46 0.45 0.28 1.06 0.00 0.00 176.91 179.22 2wdz h VAL 132 N 0.45 1.20 -0.61 -2.22 2.07 -0.80 -1.37 116.25 114.98 2wdz h VAL 132 Ca 0.12 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.25 2wdz h VAL 132 Cb 0.11 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.02 2wdz h VAL 132 CO -0.02 0.21 0.34 0.00 0.02 0.00 0.00 177.57 178.12 2wdz h ALA 133 N 1.24 0.80 0.00 1.67 0.00 -1.03 -2.25 119.26 119.68 2wdz h ALA 133 Ca 0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2wdz h ALA 133 Cb -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2wdz h ALA 133 CO -0.05 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.22 2wdz h ARG 134 N 0.64 0.00 -0.15 0.00 3.08 -0.47 -3.47 114.38 114.01 2wdz h ARG 134 Ca 0.26 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.25 2wdz h ARG 134 Cb 0.13 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2wdz h ARG 134 CO -0.16 0.00 -0.06 0.41 -1.07 0.00 0.00 179.97 179.10 2wdz n GLY 135 N 0.37 0.62 3.52 0.04 0.00 -0.60 -5.03 105.19 104.12 2wdz n GLY 135 Ca 0.02 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 2wdz n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz s ALA 136 N -2.09 -1.55 0.00 4.61 0.00 -0.71 -4.16 121.76 117.86 2wdz s ALA 136 Ca 0.00 1.88 0.00 0.00 0.00 0.00 0.00 51.96 53.84 2wdz s ALA 136 Cb 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 22.02 2wdz s ALA 136 CO 0.00 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.86 2wdz n GLY 137 N 3.28 1.83 2.93 0.00 0.00 -1.09 -4.54 105.19 107.60 2wdz n GLY 137 Ca -0.16 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.07 2wdz n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz s ALA 138 N -2.00 0.72 -0.07 4.61 0.00 -0.26 -1.03 121.76 123.74 2wdz s ALA 138 Ca 0.00 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 51.88 2wdz s ALA 138 Cb 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 2wdz s ALA 138 CO 0.00 0.04 -0.22 0.42 0.00 0.00 0.00 175.76 176.00 2wdz s ILE 139 N 0.68 2.36 -0.21 0.00 1.01 -0.40 -1.42 121.20 123.22 2wdz s ILE 139 Ca -0.10 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.62 2wdz s ILE 139 Cb -0.13 -1.89 0.04 0.00 0.01 0.00 0.00 42.46 40.49 2wdz s ILE 139 CO 0.01 0.57 -0.16 -0.69 0.00 0.00 0.00 174.94 174.67 2wdz s VAL 140 N -0.15 2.04 -0.01 2.92 1.01 0.25 -2.06 120.40 124.39 2wdz s VAL 140 Ca -0.03 -1.18 -0.16 0.00 0.00 0.00 0.00 61.98 60.61 2wdz s VAL 140 Cb -0.14 -1.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.21 2wdz s VAL 140 CO 0.04 0.30 0.44 0.20 0.00 0.00 0.00 175.10 176.08 2wdz s ASN 141 N 1.24 6.83 -0.90 3.32 0.01 0.12 -1.29 114.94 124.28 2wdz s ASN 141 Ca -0.00 0.98 -0.22 0.00 -0.71 0.00 0.00 52.86 52.90 2wdz s ASN 141 Cb -0.16 -2.27 0.07 0.00 0.41 0.00 0.00 41.25 39.30 2wdz s ASN 141 CO -0.10 0.27 1.26 -0.76 -1.51 0.00 0.00 177.10 176.27 2wdz s LEU 142 N -0.83 4.02 0.00 0.60 1.02 -0.74 -1.17 118.68 121.58 2wdz s LEU 142 Ca 0.25 -1.40 0.00 0.00 0.02 0.00 0.00 54.13 53.00 2wdz s LEU 142 Cb -0.17 -2.50 0.00 0.00 0.02 0.00 0.00 46.19 43.54 2wdz s LEU 142 CO 0.14 -1.43 0.00 0.61 0.02 0.00 0.00 176.35 175.69 2wdz n GLY 143 N 6.03 0.93 3.52 -3.19 0.00 0.54 -4.95 105.19 108.08 2wdz n GLY 143 Ca 0.20 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.63 2wdz n GLY 143 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wdz s SER 144 N -1.00 -0.41 0.58 1.61 0.15 -1.18 -4.45 113.70 109.00 2wdz s SER 144 Ca 0.00 0.19 0.29 0.00 0.70 0.00 0.00 55.95 57.13 2wdz s SER 144 Cb 0.00 0.38 1.51 0.00 -1.71 0.00 0.00 66.02 66.21 2wdz s SER 144 CO 0.00 -0.55 1.95 0.00 1.20 0.00 0.00 173.24 175.83 2wdz h MET 145 N 2.27 0.00 0.00 5.44 -0.00 -1.18 -1.48 114.93 119.98 2wdz h MET 145 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.48 2wdz h MET 145 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.81 2wdz h MET 145 CO 0.32 0.00 0.00 0.43 -0.00 0.00 0.00 176.91 177.66 2wdz n SER 146 N -3.78 0.00 -0.44 -0.10 7.64 -1.26 -1.36 113.62 114.31 2wdz n SER 146 Ca 0.07 0.43 0.14 0.00 1.01 0.00 0.00 58.87 60.52 2wdz n SER 146 Cb 0.60 -0.46 0.54 0.00 -1.01 0.00 0.00 64.21 63.87 2wdz n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wdz n GLY 147 N 0.05 -0.08 0.80 0.23 0.00 -0.56 -4.42 105.19 101.22 2wdz n GLY 147 Ca 0.04 -0.43 -0.03 0.00 0.00 0.00 0.00 46.02 45.60 2wdz n GLY 147 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wdz n THR 148 N 0.07 0.17 -4.49 2.61 -1.04 -0.47 -4.29 114.28 106.86 2wdz n THR 148 Ca 0.19 -0.05 -0.21 0.00 -2.04 0.00 0.00 64.05 61.94 2wdz n THR 148 Cb 0.34 -1.44 -0.05 0.00 -1.82 0.00 0.00 70.33 67.37 2wdz n THR 148 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2wdz n ILE 149 N -3.08 0.00 -5.12 12.58 -6.64 -0.86 -5.16 119.36 111.09 2wdz n ILE 149 Ca -0.06 -1.60 -0.32 0.00 -1.77 0.00 0.00 62.75 59.00 2wdz n ILE 149 Cb 0.55 0.35 -0.16 0.00 -1.44 0.00 0.00 39.64 38.93 2wdz n ILE 149 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 2wdz s VAL 150 N -2.26 2.32 0.65 7.28 1.01 -1.26 -4.33 120.40 123.81 2wdz s VAL 150 Ca 0.01 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 2wdz s VAL 150 Cb 0.00 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.47 2wdz s VAL 150 CO 0.01 0.56 1.09 0.20 0.00 0.00 0.00 175.10 176.96 2wdz s ASN 151 N 0.18 5.29 0.04 3.32 0.01 -1.26 -5.08 114.94 117.45 2wdz s ASN 151 Ca -0.12 1.92 -0.03 0.00 -0.71 0.00 0.00 52.86 53.92 2wdz s ASN 151 Cb -0.16 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 38.93 2wdz s ASN 151 CO 0.07 -1.51 0.03 0.00 -1.51 0.00 0.00 177.10 174.18 2wdz s ARG 152 N -4.17 0.56 0.25 -0.60 1.70 -1.26 -4.62 118.95 110.80 2wdz s ARG 152 Ca 0.65 -0.91 0.24 0.00 -0.47 0.00 0.00 55.73 55.24 2wdz s ARG 152 Cb -0.19 0.21 0.31 0.00 -0.57 0.00 0.00 34.95 34.71 2wdz s ARG 152 CO 0.41 -0.12 1.38 -1.00 -1.08 0.00 0.00 175.30 174.90 2wdz h PRO 153 N 3.61 0.00 -7.17 3.89 0.13 -1.87 -3.43 132.00 127.16 2wdz h PRO 153 Ca -0.33 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.26 2wdz h PRO 153 Cb 1.17 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.46 2wdz h PRO 153 CO 0.55 0.00 0.40 1.14 -0.23 0.00 0.00 178.00 179.86 2wdz s GLN 154 N -3.23 2.16 -0.12 0.86 0.00 -1.26 -5.03 119.66 113.03 2wdz s GLN 154 Ca 0.05 1.79 -0.01 0.00 -0.00 0.00 0.00 55.36 57.19 2wdz s GLN 154 Cb 0.10 -1.83 -0.02 0.00 0.00 0.00 0.00 33.01 31.25 2wdz s GLN 154 CO 0.71 -1.83 -0.10 -0.06 0.00 0.00 0.00 175.29 174.01 2wdz s PHE 155 N -1.93 2.88 -0.46 9.60 2.99 -1.26 -4.79 117.98 125.01 2wdz s PHE 155 Ca 0.75 -0.42 0.07 0.00 0.00 0.00 0.00 56.93 57.32 2wdz s PHE 155 Cb -0.30 -1.84 0.30 0.00 0.00 0.00 0.00 43.02 41.18 2wdz s PHE 155 CO 0.45 -0.06 1.00 0.00 -0.00 0.00 0.00 175.22 176.61 2wdz n ALA 156 N 3.27 -0.64 -0.01 5.36 0.00 -1.24 -0.99 120.51 126.26 2wdz n ALA 156 Ca -0.18 -1.66 0.16 0.00 0.00 0.00 0.00 53.44 51.77 2wdz n ALA 156 Cb 0.53 -1.18 0.62 0.00 0.00 0.00 0.00 19.45 19.41 2wdz n ALA 156 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wdz h SER 157 N 3.32 0.13 -0.14 0.00 4.64 -1.89 -1.14 113.55 118.47 2wdz h SER 157 Ca -0.09 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.20 2wdz h SER 157 Cb 1.06 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 2wdz h SER 157 CO 0.23 0.08 -0.00 0.77 -0.87 0.00 0.00 176.83 177.03 2wdz h SER 158 N 0.15 0.33 -0.04 4.97 4.64 -1.93 -2.24 113.55 119.44 2wdz h SER 158 Ca 0.24 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.40 2wdz h SER 158 Cb 0.76 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.78 2wdz h SER 158 CO -0.03 0.40 -0.42 0.22 -0.87 0.00 0.00 176.83 176.12 2wdz h TYR 159 N 0.36 0.49 -0.11 4.77 3.20 -1.55 -0.07 116.97 124.06 2wdz h TYR 159 Ca 0.08 -0.24 0.01 0.00 3.14 0.00 0.00 58.73 61.72 2wdz h TYR 159 Cb 0.25 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2wdz h TYR 159 CO 0.01 1.03 0.04 0.52 -1.64 0.00 0.00 178.16 178.11 2wdz h MET 160 N -0.18 0.09 -0.75 1.82 2.86 -1.39 -1.66 114.93 115.71 2wdz h MET 160 Ca -0.04 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 2wdz h MET 160 Cb 1.11 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 2wdz h MET 160 CO 0.08 0.06 0.34 0.00 1.06 0.00 0.00 176.91 178.45 2wdz h ALA 161 N 1.07 0.97 -0.85 6.32 0.00 -1.34 -0.95 119.26 124.47 2wdz h ALA 161 Ca 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2wdz h ALA 161 Cb 0.02 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2wdz h ALA 161 CO -0.05 0.56 0.46 0.66 0.00 0.00 0.00 179.25 180.88 2wdz h SER 162 N 1.06 1.07 0.28 0.00 4.64 -0.74 -1.65 113.55 118.21 2wdz h SER 162 Ca 0.25 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.31 2wdz h SER 162 Cb 0.15 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.97 2wdz h SER 162 CO -0.03 0.86 -0.70 0.11 -0.87 0.00 0.00 176.83 176.21 2wdz h LYS 163 N 1.20 0.37 -0.81 4.77 1.79 -0.99 0.13 116.57 123.02 2wdz h LYS 163 Ca 0.30 -0.29 0.11 0.00 -2.18 0.00 0.00 60.65 58.59 2wdz h LYS 163 Cb 0.03 0.06 -0.08 0.00 -1.58 0.00 0.00 32.23 30.66 2wdz h LYS 163 CO -0.05 0.92 0.44 0.78 -1.08 0.00 0.00 179.45 180.46 2wdz h GLY 164 N 1.34 1.27 0.97 3.86 0.00 -0.81 -0.98 103.07 108.72 2wdz h GLY 164 Ca -0.02 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 2wdz h GLY 164 CO 0.12 0.06 -0.28 0.00 0.00 0.00 0.00 176.54 176.44 2wdz h ALA 165 N 1.48 0.43 -0.73 3.60 0.00 -0.73 -2.26 119.26 121.05 2wdz h ALA 165 Ca 0.41 -0.40 0.09 0.00 0.00 0.00 0.00 54.91 55.02 2wdz h ALA 165 Cb 0.46 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 2wdz h ALA 165 CO -0.29 0.44 0.38 0.28 0.00 0.00 0.00 179.25 180.06 2wdz h VAL 166 N 0.46 0.86 -0.13 0.00 2.07 -0.43 0.43 116.25 119.50 2wdz h VAL 166 Ca 0.05 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 2wdz h VAL 166 Cb 0.85 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2wdz h VAL 166 CO 0.07 0.12 -0.10 0.45 0.02 0.00 0.00 177.57 178.13 2wdz h HIS 167 N 0.64 0.36 -0.33 1.57 3.86 -1.07 -1.35 115.15 118.82 2wdz h HIS 167 Ca 0.36 -0.10 -0.09 0.00 -1.16 0.00 0.00 60.37 59.38 2wdz h HIS 167 Cb 0.37 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 2wdz h HIS 167 CO -0.10 0.67 -0.19 1.96 0.86 0.00 0.00 177.93 181.14 2wdz h GLN 168 N -0.06 0.61 -0.49 2.45 1.08 -1.14 -1.81 115.11 115.74 2wdz h GLN 168 Ca 0.03 -0.22 0.04 0.00 -1.45 0.00 0.00 58.65 57.05 2wdz h GLN 168 Cb 0.60 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.95 2wdz h GLN 168 CO 0.03 0.76 0.27 1.25 -0.95 0.00 0.00 178.83 180.19 2wdz h LEU 169 N 0.54 0.40 -0.16 1.46 6.46 -0.06 0.22 115.31 124.18 2wdz h LEU 169 Ca 0.09 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.88 2wdz h LEU 169 Cb 0.63 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 2wdz h LEU 169 CO 0.04 0.28 0.04 0.74 -0.62 0.00 0.00 178.44 178.92 2wdz h THR 170 N 0.52 0.94 -0.52 1.05 2.02 -0.98 -2.02 112.91 113.92 2wdz h THR 170 Ca 0.21 -0.04 -0.06 0.00 0.77 0.00 0.00 66.41 67.29 2wdz h THR 170 Cb 0.09 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2wdz h THR 170 CO -0.13 0.02 0.08 0.03 0.37 0.00 0.00 175.52 175.89 2wdz h ARG 171 N 0.10 0.86 -0.82 6.66 3.08 -1.10 -1.19 114.38 121.97 2wdz h ARG 171 Ca 0.07 -0.23 0.04 0.00 0.07 0.00 0.00 59.98 59.92 2wdz h ARG 171 Cb 0.06 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 29.96 2wdz h ARG 171 CO -0.09 0.85 0.52 0.00 -1.07 0.00 0.00 179.97 180.18 2wdz h ALA 172 N 0.97 1.09 0.06 0.04 0.00 -0.33 -1.02 119.26 120.07 2wdz h ALA 172 Ca 0.16 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.79 2wdz h ALA 172 Cb 0.41 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2wdz h ALA 172 CO 0.01 0.33 -1.17 -0.07 0.00 0.00 0.00 179.25 178.35 2wdz h LEU 173 N 1.00 0.21 -0.13 0.00 3.38 -1.34 -1.25 115.31 117.18 2wdz h LEU 173 Ca 0.33 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 58.12 2wdz h LEU 173 Cb 0.04 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 2wdz h LEU 173 CO -0.12 1.18 -0.30 0.00 0.09 0.00 0.00 178.44 179.29 2wdz h ALA 174 N 0.78 -0.33 -0.33 1.53 0.00 -1.01 -0.44 119.26 119.46 2wdz h ALA 174 Ca -0.09 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2wdz h ALA 174 Cb 1.88 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 20.23 2wdz h ALA 174 CO 0.16 -0.77 0.19 0.00 0.00 0.00 0.00 179.25 178.83 2wdz h ALA 175 N 0.48 0.42 -0.22 0.00 0.00 -1.14 -0.48 119.26 118.31 2wdz h ALA 175 Ca 0.10 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2wdz h ALA 175 Cb 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2wdz h ALA 175 CO -0.34 -0.07 -0.23 1.49 0.00 0.00 0.00 179.25 180.10 2wdz h GLU 176 N 0.42 0.41 -0.01 0.00 4.81 -1.13 -3.31 114.58 115.77 2wdz h GLU 176 Ca 0.12 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2wdz h GLU 176 Cb 0.03 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2wdz h GLU 176 CO -0.02 0.62 -0.21 0.91 -0.73 0.00 0.00 179.01 179.58 2wdz n TRP 177 N -4.15 0.00 -0.25 0.92 8.01 -0.18 -4.60 117.44 117.20 2wdz n TRP 177 Ca -0.00 0.00 0.02 0.00 -1.31 0.00 0.00 57.50 56.20 2wdz n TRP 177 Cb 0.38 0.00 0.14 0.00 -2.01 0.00 0.00 31.31 29.82 2wdz n TRP 177 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2wdz h ALA 178 N 2.35 1.00 0.00 6.99 0.00 -1.17 0.29 119.26 128.71 2wdz h ALA 178 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wdz h ALA 178 Cb 0.47 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2wdz h ALA 178 CO 0.00 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.60 2wdz n GLY 179 N -1.30 -0.90 0.31 0.00 0.00 -1.26 -2.30 105.19 99.74 2wdz n GLY 179 Ca 0.11 0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.29 2wdz n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdz n ARG 180 N -1.94 1.20 -1.06 1.61 1.74 0.05 -5.00 116.66 113.27 2wdz n ARG 180 Ca 0.01 -2.62 -0.01 0.00 -0.77 0.00 0.00 57.85 54.46 2wdz n ARG 180 Cb 0.10 -1.39 -0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2wdz n ARG 180 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wdz n GLY 181 N -1.15 0.44 3.29 -0.13 0.00 -0.97 -3.76 105.19 102.92 2wdz n GLY 181 Ca 0.15 -1.05 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 2wdz n GLY 181 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wdz s VAL 182 N -2.03 3.42 0.20 1.61 1.01 -1.16 -2.68 120.40 120.77 2wdz s VAL 182 Ca 0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.19 2wdz s VAL 182 Cb 0.00 -2.66 -0.07 0.00 0.00 0.00 0.00 36.38 33.65 2wdz s VAL 182 CO 0.00 0.28 0.57 -0.13 0.00 0.00 0.00 175.10 175.82 2wdz s ARG 183 N 1.45 3.91 -0.07 2.72 0.52 -0.19 -4.08 118.95 123.20 2wdz s ARG 183 Ca 0.04 0.42 -0.03 0.00 -0.52 0.00 0.00 55.73 55.64 2wdz s ARG 183 Cb -0.16 -2.75 0.04 0.00 0.52 0.00 0.00 34.95 32.60 2wdz s ARG 183 CO -0.02 0.37 0.13 0.08 0.02 0.00 0.00 175.30 175.88 2wdz s VAL 184 N -1.68 -0.21 0.07 3.52 1.01 -1.26 -1.27 120.40 120.58 2wdz s VAL 184 Ca 0.44 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.79 2wdz s VAL 184 Cb -0.13 -0.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 2wdz s VAL 184 CO 0.20 0.15 -0.05 0.20 0.00 0.00 0.00 175.10 175.61 2wdz s ASN 185 N 2.25 0.76 0.09 3.32 0.01 -0.88 0.02 114.94 120.51 2wdz s ASN 185 Ca 0.04 -0.97 0.07 0.00 -0.71 0.00 0.00 52.86 51.29 2wdz s ASN 185 Cb -0.12 0.15 -0.03 0.00 0.41 0.00 0.00 41.25 41.66 2wdz s ASN 185 CO -0.05 -0.52 -0.20 0.00 -1.51 0.00 0.00 177.10 174.82 2wdz s ALA 186 N -3.64 1.67 0.09 0.60 0.00 -0.53 0.16 121.76 120.12 2wdz s ALA 186 Ca 0.08 -1.17 -0.06 0.00 0.00 0.00 0.00 51.96 50.80 2wdz s ALA 186 Cb 0.06 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.89 2wdz s ALA 186 CO -0.07 0.33 0.35 -0.51 0.00 0.00 0.00 175.76 175.85 2wdz s LEU 187 N -1.77 4.32 -0.63 0.00 1.43 -0.31 -0.91 118.68 120.80 2wdz s LEU 187 Ca 0.05 0.61 0.05 0.00 -1.03 0.00 0.00 54.13 53.81 2wdz s LEU 187 Cb -0.10 -3.05 0.19 0.00 0.03 0.00 0.00 46.19 43.26 2wdz s LEU 187 CO 0.04 0.14 0.51 0.00 0.23 0.00 0.00 176.35 177.27 2wdz n ALA 188 N 0.55 3.38 -1.71 4.21 0.00 0.09 -0.34 120.51 126.69 2wdz n ALA 188 Ca -0.06 -4.26 -0.36 0.00 0.00 0.00 0.00 53.44 48.76 2wdz n ALA 188 Cb 0.52 -0.95 0.05 0.00 0.00 0.00 0.00 19.45 19.07 2wdz n ALA 188 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2wdz s PRO 189 N -1.36 2.79 0.00 0.00 0.02 -1.26 -2.07 135.00 133.12 2wdz s PRO 189 Ca 0.29 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.20 2wdz s PRO 189 Cb 0.02 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.64 2wdz s PRO 189 CO -0.15 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 175.57 2wdz n GLY 190 N 0.60 -1.12 3.74 0.52 0.00 -0.21 -1.09 105.19 107.63 2wdz n GLY 190 Ca 0.14 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2wdz n GLY 190 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wdz s TYR 191 N 0.00 2.90 -0.06 1.61 2.02 -1.26 -4.89 117.35 117.67 2wdz s TYR 191 Ca 0.00 0.77 0.04 0.00 -0.37 0.00 0.00 57.07 57.51 2wdz s TYR 191 Cb 0.00 -3.98 -0.00 0.00 -0.40 0.00 0.00 41.96 37.58 2wdz s TYR 191 CO 0.00 -3.39 -0.19 0.08 -1.57 0.00 0.00 175.55 170.48 2wdz s VAL 192 N 0.35 1.62 -1.09 0.71 1.01 -1.26 -0.83 120.40 120.91 2wdz s VAL 192 Ca 0.65 -0.80 -0.25 0.00 0.00 0.00 0.00 61.98 61.58 2wdz s VAL 192 Cb -0.46 -1.41 -0.17 0.00 0.00 0.00 0.00 36.38 34.35 2wdz s VAL 192 CO 0.42 0.46 2.07 0.00 0.00 0.00 0.00 175.10 178.05 2wdz s ALA 193 N 0.21 0.97 0.16 5.51 0.00 -0.83 -4.68 121.76 123.09 2wdz s ALA 193 Ca -0.10 -1.65 0.02 0.00 0.00 0.00 0.00 51.96 50.23 2wdz s ALA 193 Cb -0.14 -4.68 -0.01 0.00 0.00 0.00 0.00 23.12 18.29 2wdz s ALA 193 CO 0.04 -6.22 0.06 0.25 0.00 0.00 0.00 175.76 169.90 2wdz n THR 194 N 8.57 0.00 -0.37 0.00 -2.24 -1.26 -4.64 114.28 114.35 2wdz n THR 194 Ca 0.43 -0.94 -0.01 0.00 -2.27 0.00 0.00 64.05 61.26 2wdz n THR 194 Cb 0.46 0.34 0.13 0.00 -2.10 0.00 0.00 70.33 69.17 2wdz n THR 194 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2wdz h GLU 195 N 0.00 1.28 0.00 -0.78 4.39 -1.98 -2.45 114.58 115.04 2wdz h GLU 195 Ca -0.12 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 2wdz h GLU 195 Cb 0.48 -0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2wdz h GLU 195 CO 0.20 0.85 -0.02 1.98 -1.16 0.00 0.00 179.01 180.86 2wdz h MET 196 N 1.32 0.00 0.00 2.33 4.05 -1.97 -2.93 114.93 117.73 2wdz h MET 196 Ca 0.37 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.79 2wdz h MET 196 Cb -0.12 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.68 2wdz h MET 196 CO -0.09 0.02 -0.01 0.25 0.23 0.00 0.00 176.91 177.31 2wdz n THR 197 N -3.54 1.50 0.04 -0.77 -2.24 -1.06 -4.78 114.28 103.42 2wdz n THR 197 Ca -0.03 -1.72 -0.12 0.00 -2.27 0.00 0.00 64.05 59.91 2wdz n THR 197 Cb 0.11 0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.32 2wdz n THR 197 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2wdz h LEU 198 N 0.00 -0.14 -1.04 3.22 6.46 -1.25 -1.95 115.31 120.61 2wdz h LEU 198 Ca 0.00 -0.42 0.16 0.00 -0.12 0.00 0.00 57.88 57.51 2wdz h LEU 198 Cb 0.82 0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 40.68 2wdz h LEU 198 CO 0.00 0.40 0.62 0.11 -0.62 0.00 0.00 178.44 178.95 2wdz h LYS 199 N -0.74 0.81 0.13 1.25 1.57 -1.87 -2.18 116.57 115.55 2wdz h LYS 199 Ca -0.02 -0.05 -0.28 0.00 -1.87 0.00 0.00 60.65 58.44 2wdz h LYS 199 Cb 0.54 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.67 2wdz h LYS 199 CO 0.03 0.54 -1.25 0.52 -0.57 0.00 0.00 179.45 178.71 2wdz h MET 200 N 0.84 0.28 0.00 3.15 2.86 -1.89 -3.16 114.93 117.00 2wdz h MET 200 Ca 0.54 -0.47 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2wdz h MET 200 Cb 0.75 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2wdz h MET 200 CO -0.32 1.22 0.00 0.00 1.06 0.00 0.00 176.91 178.87 2wdz h ARG 201 N 0.08 0.00 -0.00 1.72 3.08 -0.86 -2.23 114.38 116.17 2wdz h ARG 201 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2wdz h ARG 201 Cb 1.98 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.03 2wdz h ARG 201 CO 0.20 0.00 -0.05 0.39 -1.07 0.00 0.00 179.97 179.45 2wdz n GLU 202 N -2.59 0.48 -3.82 0.04 1.02 -0.86 -4.69 120.64 110.22 2wdz n GLU 202 Ca 0.01 -0.07 -0.34 0.00 -0.02 0.00 0.00 57.16 56.74 2wdz n GLU 202 Cb 0.20 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.01 2wdz n GLU 202 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2wdz s ARG 203 N -2.57 2.34 0.57 3.49 0.52 -0.84 -5.00 118.95 117.46 2wdz s ARG 203 Ca 0.28 -2.61 0.28 0.00 -0.52 0.00 0.00 55.73 53.16 2wdz s ARG 203 Cb 0.20 -3.56 1.49 0.00 0.52 0.00 0.00 34.95 33.60 2wdz s ARG 203 CO 0.47 -1.15 1.96 -1.35 0.02 0.00 0.00 175.30 175.26 2wdz h PRO 204 N 6.74 0.00 0.00 3.54 0.11 -1.83 0.53 132.00 141.08 2wdz h PRO 204 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2wdz h PRO 204 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2wdz h PRO 204 CO 0.70 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.64 2wdz n GLU 205 N -3.95 0.15 -0.11 1.05 0.00 -1.26 -1.38 120.64 115.14 2wdz n GLU 205 Ca 0.08 0.49 -0.23 0.00 0.00 0.00 0.00 57.16 57.49 2wdz n GLU 205 Cb 0.61 -1.85 -0.08 0.00 0.00 0.00 0.00 31.44 30.12 2wdz n GLU 205 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2wdz n LEU 206 N -2.14 1.55 -0.21 -1.84 4.32 0.16 -4.73 117.00 114.11 2wdz n LEU 206 Ca 0.01 0.27 -0.07 0.00 -0.02 0.00 0.00 56.01 56.19 2wdz n LEU 206 Cb 0.14 -0.65 0.03 0.00 -1.62 0.00 0.00 43.42 41.33 2wdz n LEU 206 CO 0.15 0.44 1.01 0.15 -1.22 0.00 0.00 177.39 177.92 2wdz h PHE 207 N -0.79 0.87 -0.09 -1.77 3.57 -0.54 -1.79 116.94 116.39 2wdz h PHE 207 Ca -0.55 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 60.85 2wdz h PHE 207 Cb 1.48 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 2wdz h PHE 207 CO -0.08 0.68 -0.18 0.93 -2.23 0.00 0.00 178.31 177.43 2wdz h GLU 208 N 0.81 0.14 -0.43 1.11 5.08 -1.49 -2.31 114.58 117.47 2wdz h GLU 208 Ca 0.20 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 2wdz h GLU 208 Cb 0.15 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2wdz h GLU 208 CO -0.02 0.32 -0.04 1.15 -1.00 0.00 0.00 179.01 179.42 2wdz h THR 209 N 0.13 1.27 -0.26 1.13 2.02 -1.58 -2.44 112.91 113.17 2wdz h THR 209 Ca 0.03 -1.11 0.05 0.00 0.77 0.00 0.00 66.41 66.15 2wdz h THR 209 Cb 0.40 1.11 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 2wdz h THR 209 CO 0.03 0.38 -0.08 -0.50 0.37 0.00 0.00 175.52 175.71 2wdz h TRP 210 N 0.63 -0.18 -0.19 3.16 4.06 -0.79 -1.93 115.95 120.71 2wdz h TRP 210 Ca 0.12 0.03 -0.21 0.00 2.06 0.00 0.00 58.89 60.88 2wdz h TRP 210 Cb 0.55 0.12 0.01 0.00 -1.00 0.00 0.00 29.16 28.84 2wdz h TRP 210 CO 0.04 -0.13 -0.72 -0.07 -3.56 0.00 0.00 178.44 174.00 2wdz h LEU 211 N -0.02 0.94 -1.39 -4.49 3.38 -1.55 -2.70 115.31 109.48 2wdz h LEU 211 Ca 0.13 -0.59 0.10 0.00 0.09 0.00 0.00 57.88 57.61 2wdz h LEU 211 Cb 0.22 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 2wdz h LEU 211 CO -0.28 1.39 0.50 -0.78 0.09 0.00 0.00 178.44 179.36 2wdz h ASP 212 N 0.57 0.61 0.82 -0.43 3.58 -1.26 -0.64 116.42 119.68 2wdz h ASP 212 Ca -0.04 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2wdz h ASP 212 Cb 1.34 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.28 2wdz h ASP 212 CO 0.15 0.36 -0.11 0.23 -2.88 0.00 0.00 179.24 177.00 2wdz n MET 213 N -4.50 0.08 -3.61 0.28 2.81 -0.74 -4.74 117.12 106.70 2wdz n MET 213 Ca 0.13 -0.02 -0.40 0.00 -1.81 0.00 0.00 57.70 55.60 2wdz n MET 213 Cb 0.34 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.24 2wdz n MET 213 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2wdz s THR 214 N -2.93 4.54 0.24 2.03 2.01 -0.25 -4.66 115.64 116.63 2wdz s THR 214 Ca 0.16 -0.82 -0.06 0.00 0.31 0.00 0.00 61.69 61.28 2wdz s THR 214 Cb 0.19 -3.51 0.25 0.00 0.01 0.00 0.00 72.50 69.44 2wdz s THR 214 CO 0.56 -0.19 1.67 -0.65 -0.69 0.00 0.00 174.62 175.31 2wdz h PRO 215 N 8.41 0.20 0.00 4.92 0.11 -1.80 0.55 132.00 144.40 2wdz h PRO 215 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2wdz h PRO 215 Cb 1.11 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2wdz h PRO 215 CO 0.66 0.13 0.00 -1.33 -0.21 0.00 0.00 178.00 177.25 2wdz n MET 216 N -5.22 0.10 -2.42 1.05 2.81 -0.39 -4.89 117.12 108.16 2wdz n MET 216 Ca 0.14 0.23 -0.21 0.00 -1.81 0.00 0.00 57.70 56.05 2wdz n MET 216 Cb 0.47 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.47 2wdz n MET 216 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wdz n GLY 217 N -0.39 -0.49 3.46 3.03 0.00 0.19 -4.98 105.19 106.01 2wdz n GLY 217 Ca 0.04 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 2wdz n GLY 217 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wdz s ARG 218 N -5.07 1.19 0.63 1.61 1.70 -1.26 -4.95 118.95 112.80 2wdz s ARG 218 Ca 0.02 -0.18 -0.15 0.00 -0.47 0.00 0.00 55.73 54.94 2wdz s ARG 218 Cb -0.01 0.55 -0.02 0.00 -0.57 0.00 0.00 34.95 34.91 2wdz s ARG 218 CO 0.02 -0.47 1.09 0.00 -1.08 0.00 0.00 175.30 174.86 2wdz s GLY 220 N -2.61 1.66 -0.05 0.00 0.00 -0.01 -4.87 107.32 101.44 2wdz s GLY 220 Ca 0.66 0.01 -0.09 0.00 0.00 0.00 0.00 44.72 45.30 2wdz s GLY 220 CO 0.39 0.31 0.25 -0.54 0.00 0.00 0.00 173.10 173.51 2wdz s GLU 221 N -5.10 3.60 0.33 2.90 0.41 -1.26 -1.97 118.70 117.61 2wdz s GLU 221 Ca 0.57 0.02 0.12 0.00 -0.41 0.00 0.00 54.97 55.27 2wdz s GLU 221 Cb -0.13 -3.16 0.99 0.00 -1.78 0.00 0.00 34.13 30.05 2wdz s GLU 221 CO 0.55 0.71 1.69 -1.35 -0.49 0.00 0.00 175.26 176.37 2wdz h PRO 222 N 4.58 0.42 0.00 0.39 0.11 -1.95 0.56 132.00 136.10 2wdz h PRO 222 Ca -0.52 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.56 2wdz h PRO 222 Cb 1.22 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2wdz h PRO 222 CO 0.62 0.28 -0.02 0.66 -0.21 0.00 0.00 178.00 179.33 2wdz h SER 223 N 0.43 0.00 1.09 -2.05 4.64 -1.94 -1.17 113.55 114.55 2wdz h SER 223 Ca 0.69 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.90 2wdz h SER 223 Cb 1.47 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.54 2wdz h SER 223 CO -0.55 0.02 -0.53 -0.33 -0.87 0.00 0.00 176.83 174.57 2wdz h GLU 224 N 0.00 0.00 0.07 4.77 5.08 -0.26 -0.58 114.58 123.66 2wdz h GLU 224 Ca -0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2wdz h GLU 224 Cb 0.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2wdz h GLU 224 CO 0.00 0.53 -0.91 0.82 -1.00 0.00 0.00 179.01 178.46 2wdz h ILE 225 N 0.00 1.30 -0.60 3.13 1.08 -1.10 -3.26 117.51 118.05 2wdz h ILE 225 Ca -0.01 -2.37 0.12 0.00 -0.39 0.00 0.00 64.86 62.21 2wdz h ILE 225 Cb 1.22 2.89 -0.11 0.00 -3.07 0.00 0.00 36.82 37.74 2wdz h ILE 225 CO 0.07 0.61 -0.15 0.00 -0.69 0.00 0.00 178.15 177.99 2wdz h ALA 226 N -0.10 0.40 -0.98 1.87 0.00 -1.29 -0.45 119.26 118.70 2wdz h ALA 226 Ca -0.20 0.23 0.15 0.00 0.00 0.00 0.00 54.91 55.09 2wdz h ALA 226 Cb 1.46 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 19.61 2wdz h ALA 226 CO 0.01 -0.43 0.62 0.00 0.00 0.00 0.00 179.25 179.45 2wdz h ALA 227 N 1.60 1.66 -0.11 0.00 0.00 -1.20 0.03 119.26 121.23 2wdz h ALA 227 Ca 0.29 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.04 2wdz h ALA 227 Cb 0.44 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2wdz h ALA 227 CO -0.61 0.04 -0.72 0.00 0.00 0.00 0.00 179.25 177.96 2wdz h ALA 228 N 1.59 0.52 -0.79 0.00 0.00 -1.31 -1.90 119.26 117.37 2wdz h ALA 228 Ca 0.52 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2wdz h ALA 228 Cb 0.71 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2wdz h ALA 228 CO -0.29 0.73 0.47 0.00 0.00 0.00 0.00 179.25 180.16 2wdz h ALA 229 N 0.83 1.01 -0.34 0.00 0.00 -0.40 -2.52 119.26 117.83 2wdz h ALA 229 Ca -0.03 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.83 2wdz h ALA 229 Cb 1.31 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2wdz h ALA 229 CO 0.13 0.48 0.10 1.25 0.00 0.00 0.00 179.25 181.21 2wdz h LEU 230 N 1.08 0.08 -0.14 0.00 5.85 -0.74 -0.77 115.31 120.67 2wdz h LEU 230 Ca 0.28 0.05 0.05 0.00 0.84 0.00 0.00 57.88 59.10 2wdz h LEU 230 Cb -0.03 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 2wdz h LEU 230 CO -0.05 0.08 -0.29 0.15 -0.34 0.00 0.00 178.44 177.98 2wdz h PHE 231 N 0.23 -0.80 -0.40 1.25 3.57 -1.27 0.23 116.94 119.75 2wdz h PHE 231 Ca 0.16 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2wdz h PHE 231 Cb 0.15 0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 2wdz h PHE 231 CO -0.16 -0.37 0.21 -0.07 -2.23 0.00 0.00 178.31 175.69 2wdz h LEU 232 N -0.36 0.48 0.00 0.59 3.38 -0.97 -2.28 115.31 116.14 2wdz h LEU 232 Ca 0.10 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 2wdz h LEU 232 Cb 0.52 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2wdz h LEU 232 CO -0.34 0.39 -0.56 0.00 0.09 0.00 0.00 178.44 178.02 2wdz h ALA 233 N 1.69 0.66 -2.29 1.53 0.00 -0.84 -3.44 119.26 116.55 2wdz h ALA 233 Ca 0.14 -0.49 -0.47 0.00 0.00 0.00 0.00 54.91 54.09 2wdz h ALA 233 Cb 0.02 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 17.81 2wdz h ALA 233 CO -0.02 0.67 0.21 -1.54 0.00 0.00 0.00 179.25 178.56 2wdz s SER 234 N -6.45 5.28 0.63 0.00 1.04 0.04 -4.85 113.70 109.39 2wdz s SER 234 Ca 0.04 0.63 0.30 0.00 0.48 0.00 0.00 55.95 57.40 2wdz s SER 234 Cb 0.08 -1.48 1.66 0.00 0.10 0.00 0.00 66.02 66.38 2wdz s SER 234 CO 0.75 -1.29 1.92 -0.65 0.98 0.00 0.00 173.24 174.96 2wdz h PRO 235 N -0.37 0.00 -0.69 4.02 0.11 -1.80 -0.57 132.00 132.71 2wdz h PRO 235 Ca -0.45 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.74 2wdz h PRO 235 Cb 1.28 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 2wdz h PRO 235 CO 0.61 0.00 0.45 0.00 -0.21 0.00 0.00 178.00 178.85 2wdz h ALA 236 N 1.44 1.80 -0.79 -0.75 0.00 -1.74 -2.67 119.26 116.54 2wdz h ALA 236 Ca 0.00 -0.02 -0.47 0.00 0.00 0.00 0.00 54.91 54.43 2wdz h ALA 236 Cb 0.55 -0.16 -0.24 0.00 0.00 0.00 0.00 17.79 17.94 2wdz h ALA 236 CO 0.00 0.08 0.60 0.00 0.00 0.00 0.00 179.25 179.93 2wdz n ALA 237 N -2.47 5.35 0.30 0.00 0.00 -0.22 -4.68 120.51 118.79 2wdz n ALA 237 Ca 0.10 -2.50 0.17 0.00 0.00 0.00 0.00 53.44 51.21 2wdz n ALA 237 Cb 0.27 -1.47 0.66 0.00 0.00 0.00 0.00 19.45 18.91 2wdz n ALA 237 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wdz h SER 238 N 1.22 0.00 -0.45 0.00 4.64 -1.64 -2.47 113.55 114.85 2wdz h SER 238 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2wdz h SER 238 Cb 1.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 2wdz h SER 238 CO 1.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 177.01 2wdz n TYR 239 N -2.95 1.14 -3.72 4.77 9.36 -1.26 -4.90 117.16 119.60 2wdz n TYR 239 Ca 0.01 -0.68 -0.38 0.00 3.32 0.00 0.00 57.90 60.16 2wdz n TYR 239 Cb 0.29 -0.24 -0.12 0.00 -0.63 0.00 0.00 39.34 38.64 2wdz n TYR 239 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2wdz s VAL 240 N -2.05 3.89 0.02 2.97 1.01 -0.93 -5.07 120.40 120.24 2wdz s VAL 240 Ca 0.42 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 61.22 2wdz s VAL 240 Cb 0.29 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 2wdz s VAL 240 CO 0.17 -0.25 -0.02 0.28 0.00 0.00 0.00 175.10 175.28 2wdz s THR 241 N 1.41 0.10 -0.48 3.92 -1.32 -1.26 -4.70 115.64 113.30 2wdz s THR 241 Ca -0.00 -0.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 2wdz s THR 241 Cb -0.20 -0.22 0.00 0.00 -1.51 0.00 0.00 72.50 70.57 2wdz s THR 241 CO 0.03 -0.40 0.00 0.61 -2.21 0.00 0.00 174.62 172.65 2wdz n GLY 242 N 1.89 0.66 3.82 6.08 0.00 0.10 -4.97 105.19 112.77 2wdz n GLY 242 Ca -0.22 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.21 2wdz n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdz s ALA 243 N -1.89 3.35 -0.38 4.61 0.00 -1.26 -4.75 121.76 121.44 2wdz s ALA 243 Ca 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 2wdz s ALA 243 Cb 0.00 -2.87 0.09 0.00 0.00 0.00 0.00 23.12 20.33 2wdz s ALA 243 CO 0.00 0.30 0.16 0.42 0.00 0.00 0.00 175.76 176.64 2wdz s ILE 244 N -1.65 3.39 -0.39 0.00 -1.09 -1.26 -1.45 121.20 118.76 2wdz s ILE 244 Ca 0.47 -1.74 -0.19 0.00 -2.23 0.00 0.00 60.65 56.96 2wdz s ILE 244 Cb -0.15 -3.18 0.01 0.00 -1.58 0.00 0.00 42.46 37.56 2wdz s ILE 244 CO 0.20 -0.50 0.53 -0.22 -1.23 0.00 0.00 174.94 173.73 2wdz s LEU 245 N 1.23 4.49 -0.03 2.97 2.96 -0.09 -4.89 118.68 125.31 2wdz s LEU 245 Ca 0.04 -0.23 -0.30 0.00 -0.22 0.00 0.00 54.13 53.41 2wdz s LEU 245 Cb -0.22 -2.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.84 2wdz s LEU 245 CO -0.02 -0.57 1.43 0.00 -1.32 0.00 0.00 176.35 175.87 2wdz s ALA 246 N 2.45 3.60 -0.57 5.97 0.00 -1.26 -0.73 121.76 131.21 2wdz s ALA 246 Ca 0.18 0.84 0.06 0.00 0.00 0.00 0.00 51.96 53.04 2wdz s ALA 246 Cb -0.15 -3.63 0.21 0.00 0.00 0.00 0.00 23.12 19.55 2wdz s ALA 246 CO 0.15 -1.05 0.57 0.28 0.00 0.00 0.00 175.76 175.71 2wdz n VAL 247 N 4.92 0.99 -1.16 0.00 0.31 -0.88 -4.91 118.33 117.60 2wdz n VAL 247 Ca 0.14 -4.60 0.01 0.00 -0.01 0.00 0.00 64.34 59.88 2wdz n VAL 247 Cb 0.44 -2.03 0.01 0.00 -0.91 0.00 0.00 33.84 31.35 2wdz n VAL 247 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2wdz n ASP 248 N 1.58 0.42 -1.22 4.52 5.68 -1.26 -1.04 116.55 125.23 2wdz n ASP 248 Ca 0.25 -1.56 -0.15 0.00 -0.50 0.00 0.00 54.79 52.83 2wdz n ASP 248 Cb 0.43 -0.09 -0.06 0.00 -1.14 0.00 0.00 41.12 40.26 2wdz n ASP 248 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wdz n GLY 249 N -0.17 1.34 0.98 6.12 0.00 -1.26 -1.46 105.19 110.74 2wdz n GLY 249 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2wdz n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdz n GLY 250 N -1.11 0.76 0.21 -0.02 0.00 -1.26 -1.27 105.19 102.51 2wdz n GLY 250 Ca -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 2wdz n GLY 250 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2wdz h TYR 251 N 0.00 0.56 0.00 1.61 3.20 -1.52 0.01 116.97 120.83 2wdz h TYR 251 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2wdz h TYR 251 Cb 0.00 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.10 2wdz h TYR 251 CO 0.00 0.30 0.00 0.25 -1.64 0.00 0.00 178.16 177.07 2wdz n THR 252 N -4.82 0.18 -0.05 1.81 -2.24 -1.26 -3.40 114.28 104.50 2wdz n THR 252 Ca 0.04 0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.74 2wdz n THR 252 Cb 0.10 -0.69 -0.07 0.00 -2.10 0.00 0.00 70.33 67.57 2wdz n THR 252 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2wdz h VAL 253 N 0.00 1.35 0.00 2.28 2.07 -1.39 -3.52 116.25 117.04 2wdz h VAL 253 Ca 0.00 -1.32 0.00 0.00 0.82 0.00 0.00 66.70 66.20 2wdz h VAL 253 Cb 0.11 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2wdz h VAL 253 CO 0.00 0.39 0.00 0.79 0.02 0.00 0.00 177.57 178.77