#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wmy n MET 5 N 0.00 0.00 -2.16 3.23 0.00 -1.26 -4.60 117.12 112.33 2wmy n MET 5 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.31 2wmy n MET 5 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.19 2wmy n MET 5 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2wmy s PHE 6 N 0.00 1.83 -0.16 1.12 0.08 -1.26 -4.85 117.98 114.74 2wmy s PHE 6 Ca 0.00 0.60 0.13 0.00 0.12 0.00 0.00 56.93 57.78 2wmy s PHE 6 Cb 0.00 -4.22 -0.24 0.00 -0.57 0.00 0.00 43.02 38.00 2wmy s PHE 6 CO 0.00 -2.27 0.21 -3.47 -0.10 0.00 0.00 175.22 169.59 2wmy n ASP 7 N 11.78 0.63 -4.38 1.36 -0.08 -1.26 -4.87 116.55 119.73 2wmy n ASP 7 Ca 0.17 0.11 -0.33 0.00 -1.51 0.00 0.00 54.79 53.22 2wmy n ASP 7 Cb 0.51 0.41 -0.14 0.00 2.34 0.00 0.00 41.12 44.24 2wmy n ASP 7 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2wmy s SER 8 N -5.89 4.08 -0.08 1.67 0.01 -1.26 -2.41 113.70 109.82 2wmy s SER 8 Ca -0.13 -0.31 0.03 0.00 1.31 0.00 0.00 55.95 56.85 2wmy s SER 8 Cb 0.07 -1.63 0.01 0.00 0.21 0.00 0.00 66.02 64.68 2wmy s SER 8 CO 0.79 0.16 -0.16 -0.63 0.41 0.00 0.00 173.24 173.82 2wmy s ILE 9 N 0.38 1.44 -0.27 1.44 1.01 -0.47 -1.64 121.20 123.08 2wmy s ILE 9 Ca -0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 2wmy s ILE 9 Cb -0.16 -1.29 0.03 0.00 0.01 0.00 0.00 42.46 41.05 2wmy s ILE 9 CO 0.05 0.42 -0.02 -0.22 0.00 0.00 0.00 174.94 175.18 2wmy s LEU 10 N 0.61 3.52 -0.21 2.97 2.96 0.48 -1.86 118.68 127.15 2wmy s LEU 10 Ca -0.15 -0.97 -0.19 0.00 -0.22 0.00 0.00 54.13 52.60 2wmy s LEU 10 Cb -0.16 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 2wmy s LEU 10 CO 0.05 -0.18 0.53 -0.69 -1.32 0.00 0.00 176.35 174.74 2wmy s VAL 11 N 1.33 5.08 -0.09 1.68 1.01 0.05 -0.84 120.40 128.62 2wmy s VAL 11 Ca -0.01 0.97 0.03 0.00 0.00 0.00 0.00 61.98 62.97 2wmy s VAL 11 Cb -0.18 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.36 2wmy s VAL 11 CO -0.02 0.14 -0.19 -0.63 0.00 0.00 0.00 175.10 174.40 2wmy s ILE 12 N 1.84 1.70 0.00 2.22 1.01 0.64 -1.46 121.20 127.15 2wmy s ILE 12 Ca 0.24 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 60.08 2wmy s ILE 12 Cb -0.15 -1.49 0.00 0.00 0.01 0.00 0.00 42.46 40.82 2wmy s ILE 12 CO 0.09 0.48 0.00 0.00 0.00 0.00 0.00 174.94 175.51 2wmy n THR 14 N 0.00 0.87 0.20 0.00 -1.04 -1.26 -2.27 114.28 110.78 2wmy n THR 14 Ca 0.00 0.28 0.09 0.00 -2.04 0.00 0.00 64.05 62.37 2wmy n THR 14 Cb 0.00 -1.87 0.24 0.00 -1.82 0.00 0.00 70.33 66.88 2wmy n THR 14 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2wmy h GLY 15 N -0.47 0.00 -4.85 3.41 0.00 -1.93 0.25 103.07 99.49 2wmy h GLY 15 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.93 2wmy h GLY 15 CO 0.00 0.00 -0.60 -2.01 0.00 0.00 0.00 176.54 173.93 2wmy n ASN 16 N -3.22 -5.45 0.00 0.19 4.05 -1.26 -1.59 115.26 107.97 2wmy n ASN 16 Ca 0.02 -0.34 0.00 0.00 0.45 0.00 0.00 54.58 54.71 2wmy n ASN 16 Cb 0.56 -4.42 0.00 0.00 1.23 0.00 0.00 39.78 37.15 2wmy n ASN 16 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 2wmy n ILE 17 N -4.38 0.00 0.00 -1.44 -5.35 -1.26 -4.40 119.36 102.53 2wmy n ILE 17 Ca -0.08 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 2wmy n ILE 17 Cb 0.59 0.94 0.00 0.00 -1.74 0.00 0.00 39.64 39.43 2wmy n ILE 17 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wmy h ARG 19 N 0.00 -0.27 -0.34 0.00 3.08 -1.95 -3.24 114.38 111.66 2wmy h ARG 19 Ca 0.00 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 2wmy h ARG 19 Cb 0.00 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2wmy h ARG 19 CO 0.00 0.11 0.01 0.66 -1.07 0.00 0.00 179.97 179.68 2wmy h SER 20 N -0.90 0.48 -0.54 7.04 4.64 -1.89 0.34 113.55 122.73 2wmy h SER 20 Ca -0.03 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 2wmy h SER 20 Cb 0.50 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.44 2wmy h SER 20 CO 0.05 0.55 0.28 -0.65 -0.87 0.00 0.00 176.83 176.19 2wmy h PRO 21 N 0.50 0.79 -0.01 4.77 0.11 -1.85 0.11 132.00 136.42 2wmy h PRO 21 Ca 0.11 -0.09 -0.22 0.00 0.11 0.00 0.00 66.00 65.91 2wmy h PRO 21 Cb 0.31 -0.15 0.02 0.00 0.11 0.00 0.00 31.00 31.28 2wmy h PRO 21 CO 0.01 0.60 -0.84 0.82 -0.21 0.00 0.00 178.00 178.38 2wmy h ILE 22 N 0.79 1.34 -0.54 4.15 2.04 -1.26 -2.91 117.51 121.12 2wmy h ILE 22 Ca 0.20 -2.15 -0.05 0.00 1.00 0.00 0.00 64.86 63.86 2wmy h ILE 22 Cb 0.07 2.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 2wmy h ILE 22 CO -0.03 0.65 0.14 1.23 0.00 0.00 0.00 178.15 180.15 2wmy h GLY 23 N 0.21 0.93 0.71 5.37 0.00 -0.88 -2.57 103.07 106.84 2wmy h GLY 23 Ca -0.10 -0.57 0.05 0.00 0.00 0.00 0.00 47.33 46.71 2wmy h GLY 23 CO 0.17 0.53 0.29 -2.09 0.00 0.00 0.00 176.54 175.44 2wmy h GLU 24 N 0.76 0.55 -0.01 4.80 4.81 -1.00 -1.73 114.58 122.75 2wmy h GLU 24 Ca 0.17 -0.03 -0.18 0.00 -0.13 0.00 0.00 59.36 59.19 2wmy h GLU 24 Cb 0.32 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2wmy h GLU 24 CO -0.00 0.36 -0.79 0.00 -0.73 0.00 0.00 179.01 177.85 2wmy h ARG 25 N 0.56 0.17 -0.23 1.92 2.47 -1.39 -0.96 114.38 116.92 2wmy h ARG 25 Ca 0.25 -0.16 -0.04 0.00 -1.26 0.00 0.00 59.98 58.77 2wmy h ARG 25 Cb 0.15 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2wmy h ARG 25 CO -0.17 0.87 0.01 -0.07 0.56 0.00 0.00 179.97 181.17 2wmy h LEU 26 N 0.10 0.40 -0.56 3.04 3.38 -1.27 -2.57 115.31 117.83 2wmy h LEU 26 Ca -0.03 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2wmy h LEU 26 Cb 1.38 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 2wmy h LEU 26 CO 0.12 0.60 0.29 -0.07 0.09 0.00 0.00 178.44 179.47 2wmy h LEU 27 N 0.18 0.72 -1.52 1.67 3.38 -1.23 -2.50 115.31 116.02 2wmy h LEU 27 Ca 0.07 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2wmy h LEU 27 Cb 0.39 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2wmy h LEU 27 CO 0.01 0.63 0.33 0.03 0.09 0.00 0.00 178.44 179.53 2wmy h ARG 28 N 0.76 0.64 -0.02 1.13 3.08 -1.15 0.42 114.38 119.25 2wmy h ARG 28 Ca 0.19 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.12 2wmy h ARG 28 Cb 0.09 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2wmy h ARG 28 CO -0.03 0.42 -0.41 -0.09 -1.07 0.00 0.00 179.97 178.80 2wmy h ARG 29 N 0.66 0.04 0.00 0.04 2.43 -1.03 -2.95 114.38 113.56 2wmy h ARG 29 Ca 0.18 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 2wmy h ARG 29 Cb -0.06 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2wmy h ARG 29 CO -0.04 0.44 -2.00 1.28 -1.51 0.00 0.00 179.97 178.14 2wmy n LEU 30 N -4.05 0.00 -3.23 3.80 4.77 -0.70 -4.55 117.00 113.04 2wmy n LEU 30 Ca -0.02 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.71 2wmy n LEU 30 Cb 0.45 0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.54 2wmy n LEU 30 CO 0.40 0.07 -0.01 0.18 -1.33 0.00 0.00 177.39 176.70 2wmy n LEU 31 N -2.29 2.92 -0.33 2.23 4.77 0.14 -4.96 117.00 119.47 2wmy n LEU 31 Ca -0.08 -5.31 0.05 0.00 -0.03 0.00 0.00 56.01 50.64 2wmy n LEU 31 Cb 0.63 -0.23 0.24 0.00 -2.33 0.00 0.00 43.42 41.73 2wmy n LEU 31 CO 0.43 2.17 1.25 -0.65 -1.33 0.00 0.00 177.39 179.25 2wmy h PRO 32 N 3.70 0.99 0.00 3.23 0.11 -1.75 -1.99 132.00 136.29 2wmy h PRO 32 Ca 0.15 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2wmy h PRO 32 Cb 0.70 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2wmy h PRO 32 CO 0.72 0.65 0.00 -1.13 -0.21 0.00 0.00 178.00 178.03 2wmy n SER 33 N -4.53 0.00 -4.86 -2.05 3.41 -1.26 -4.81 113.62 99.51 2wmy n SER 33 Ca 0.16 -0.05 -0.35 0.00 -0.26 0.00 0.00 58.87 58.37 2wmy n SER 33 Cb 0.27 -0.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.86 2wmy n SER 33 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2wmy s LYS 34 N -2.61 3.80 -0.51 4.33 1.02 -0.75 -5.04 119.74 119.98 2wmy s LYS 34 Ca 0.24 0.23 -0.28 0.00 0.02 0.00 0.00 55.97 56.18 2wmy s LYS 34 Cb 0.18 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.47 2wmy s LYS 34 CO 0.41 0.58 1.35 0.21 -0.92 0.00 0.00 175.35 176.99 2wmy s LYS 35 N -1.74 3.47 -0.15 1.68 2.20 -1.01 -4.99 119.74 119.19 2wmy s LYS 35 Ca 0.31 0.59 0.01 0.00 -0.36 0.00 0.00 55.97 56.52 2wmy s LYS 35 Cb -0.14 -4.05 0.02 0.00 -1.51 0.00 0.00 37.83 32.14 2wmy s LYS 35 CO 0.17 -1.72 -0.17 0.42 -0.36 0.00 0.00 175.35 173.69 2wmy s ILE 36 N 5.52 1.78 0.32 5.43 1.01 -1.26 -1.37 121.20 132.63 2wmy s ILE 36 Ca 0.53 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 60.45 2wmy s ILE 36 Cb -0.11 -1.62 -0.02 0.00 0.01 0.00 0.00 42.46 40.72 2wmy s ILE 36 CO 0.28 0.49 0.17 0.59 0.00 0.00 0.00 174.94 176.47 2wmy n ASN 37 N 4.51 0.51 -4.07 3.58 3.02 -0.77 -4.98 115.26 117.06 2wmy n ASN 37 Ca -0.19 -2.83 -0.08 0.00 -0.03 0.00 0.00 54.58 51.45 2wmy n ASN 37 Cb 0.50 1.07 -0.10 0.00 -0.61 0.00 0.00 39.78 40.65 2wmy n ASN 37 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wmy s SER 38 N -3.05 0.39 0.20 6.41 1.04 -1.26 -0.77 113.70 116.66 2wmy s SER 38 Ca 0.23 -1.00 -0.23 0.00 0.48 0.00 0.00 55.95 55.43 2wmy s SER 38 Cb 0.01 0.25 0.05 0.00 0.10 0.00 0.00 66.02 66.43 2wmy s SER 38 CO 0.17 -0.65 0.85 0.00 0.98 0.00 0.00 173.24 174.58 2wmy s ALA 39 N -3.94 -1.49 0.03 5.32 0.00 -0.54 -4.74 121.76 116.40 2wmy s ALA 39 Ca 0.11 -0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.08 2wmy s ALA 39 Cb 0.07 0.72 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 2wmy s ALA 39 CO -0.07 -1.02 -0.06 0.20 0.00 0.00 0.00 175.76 174.80 2wmy s GLY 40 N -2.91 0.39 0.00 0.00 0.00 -0.44 -2.09 107.32 102.26 2wmy s GLY 40 Ca 0.11 -0.59 0.29 0.00 0.00 0.00 0.00 44.72 44.53 2wmy s GLY 40 CO 0.03 -0.62 1.89 3.33 0.00 0.00 0.00 173.10 177.73 2wmy n VAL 41 N 1.87 0.00 -2.57 1.40 0.24 -0.96 -0.27 118.33 118.05 2wmy n VAL 41 Ca -0.20 -0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.02 2wmy n VAL 41 Cb 0.56 -0.44 0.04 0.00 -1.47 0.00 0.00 33.84 32.53 2wmy n VAL 41 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wmy n GLY 42 N 1.50 3.32 3.75 7.63 0.00 0.80 -4.93 105.19 117.26 2wmy n GLY 42 Ca 0.07 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 2wmy n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wmy s ALA 43 N -3.74 2.86 -0.80 4.61 0.00 -0.64 -4.12 121.76 119.93 2wmy s ALA 43 Ca 0.35 1.35 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 2wmy s ALA 43 Cb 0.35 -3.57 0.19 0.00 0.00 0.00 0.00 23.12 20.09 2wmy s ALA 43 CO -0.01 -1.36 0.78 -0.51 0.00 0.00 0.00 175.76 174.66 2wmy s LEU 44 N -3.45 6.44 0.04 0.00 1.43 -0.62 -4.93 118.68 117.59 2wmy s LEU 44 Ca 0.71 -2.46 -0.31 0.00 -1.03 0.00 0.00 54.13 51.04 2wmy s LEU 44 Cb -0.41 -2.24 -0.07 0.00 0.03 0.00 0.00 46.19 43.51 2wmy s LEU 44 CO 0.48 -0.69 1.42 -0.69 0.23 0.00 0.00 176.35 177.11 2wmy s VAL 45 N 0.73 3.52 0.00 -1.59 1.01 -1.26 -1.91 120.40 120.90 2wmy s VAL 45 Ca 0.18 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.14 2wmy s VAL 45 Cb -0.12 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2wmy s VAL 45 CO -0.07 0.02 0.00 0.47 0.00 0.00 0.00 175.10 175.52 2wmy n ASP 46 N 4.95 0.00 -4.75 3.32 8.00 0.23 -4.89 116.55 123.41 2wmy n ASP 46 Ca 0.13 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.23 2wmy n ASP 46 Cb 0.43 -0.12 -0.05 0.00 -0.02 0.00 0.00 41.12 41.35 2wmy n ASP 46 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2wmy s HIS 47 N -3.84 3.84 0.96 1.24 3.76 -0.80 -4.61 115.29 115.84 2wmy s HIS 47 Ca 0.00 1.84 -0.12 0.00 -0.15 0.00 0.00 55.06 56.63 2wmy s HIS 47 Cb 0.00 -3.09 0.17 0.00 1.11 0.00 0.00 32.58 30.77 2wmy s HIS 47 CO 0.00 0.09 1.09 -0.08 -0.85 0.00 0.00 174.74 174.99 2wmy s THR 48 N -1.18 2.38 0.66 1.30 -1.32 -1.26 -0.82 115.64 115.41 2wmy s THR 48 Ca 0.42 0.12 -0.17 0.00 -1.21 0.00 0.00 61.69 60.85 2wmy s THR 48 Cb -0.28 -2.52 -0.00 0.00 -1.51 0.00 0.00 72.50 68.19 2wmy s THR 48 CO 0.35 -0.16 1.28 0.00 -2.21 0.00 0.00 174.62 173.88 2wmy s ALA 49 N -2.86 2.32 0.37 11.08 0.00 -1.26 -4.82 121.76 126.60 2wmy s ALA 49 Ca 0.65 1.16 -0.27 0.00 0.00 0.00 0.00 51.96 53.50 2wmy s ALA 49 Cb -0.19 -3.54 -0.11 0.00 0.00 0.00 0.00 23.12 19.27 2wmy s ALA 49 CO 0.58 -1.66 1.32 -3.47 0.00 0.00 0.00 175.76 172.53 2wmy n ASP 50 N -2.06 2.89 -0.30 0.00 2.03 0.26 -4.79 116.55 114.58 2wmy n ASP 50 Ca 0.15 1.19 -0.00 0.00 0.52 0.00 0.00 54.79 56.65 2wmy n ASP 50 Cb 0.48 -1.51 0.13 0.00 -0.72 0.00 0.00 41.12 39.50 2wmy n ASP 50 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2wmy h GLU 51 N 2.50 0.93 0.00 -0.67 4.81 -1.91 0.94 114.58 121.18 2wmy h GLU 51 Ca -0.47 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 58.64 2wmy h GLU 51 Cb 1.28 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2wmy h GLU 51 CO 0.62 0.61 -0.31 0.77 -0.73 0.00 0.00 179.01 179.98 2wmy h SER 52 N 0.95 0.00 0.00 1.04 0.02 -1.96 -0.56 113.55 113.04 2wmy h SER 52 Ca 0.36 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.18 2wmy h SER 52 Cb 0.14 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.69 2wmy h SER 52 CO -0.16 0.31 -0.52 0.00 -1.14 0.00 0.00 176.83 175.32 2wmy h ALA 53 N 1.69 0.06 -0.75 3.77 0.00 -1.57 -2.13 119.26 120.34 2wmy h ALA 53 Ca -0.00 -0.55 0.08 0.00 0.00 0.00 0.00 54.91 54.44 2wmy h ALA 53 Cb 0.75 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 2wmy h ALA 53 CO 0.04 0.29 0.42 0.82 0.00 0.00 0.00 179.25 180.82 2wmy h ILE 54 N -0.21 0.93 0.45 0.00 2.04 -0.76 -1.17 117.51 118.79 2wmy h ILE 54 Ca -0.06 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 2wmy h ILE 54 Cb 1.24 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2wmy h ILE 54 CO 0.10 0.13 -0.32 -0.09 0.00 0.00 0.00 178.15 177.97 2wmy h ARG 55 N 0.73 -0.73 0.00 2.37 2.43 -1.05 -0.66 114.38 117.47 2wmy h ARG 55 Ca 0.35 0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.51 2wmy h ARG 55 Cb 0.28 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 2wmy h ARG 55 CO -0.22 -0.48 -0.27 -0.24 -1.51 0.00 0.00 179.97 177.24 2wmy h VAL 56 N -0.75 1.09 0.28 0.20 3.04 -1.24 -1.64 116.25 117.23 2wmy h VAL 56 Ca -0.04 -0.96 -0.01 0.00 -1.01 0.00 0.00 66.70 64.67 2wmy h VAL 56 Cb 0.64 1.53 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 2wmy h VAL 56 CO 0.01 0.26 -0.13 0.00 -1.01 0.00 0.00 177.57 176.71 2wmy h ALA 57 N 1.73 -0.38 -0.95 3.17 0.00 -0.99 -3.19 119.26 118.66 2wmy h ALA 57 Ca -0.00 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.88 2wmy h ALA 57 Cb 0.51 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.36 2wmy h ALA 57 CO 0.04 -0.46 0.60 1.49 0.00 0.00 0.00 179.25 180.92 2wmy h GLU 58 N -0.88 0.68 -0.00 0.00 4.57 -0.76 0.48 114.58 118.67 2wmy h GLU 58 Ca -0.04 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2wmy h GLU 58 Cb 0.51 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2wmy h GLU 58 CO 0.06 0.45 0.01 -0.22 -1.18 0.00 0.00 179.01 178.13 2wmy h LYS 59 N 0.71 0.00 -0.12 1.92 3.64 -1.31 -2.58 116.57 118.83 2wmy h LYS 59 Ca 0.51 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.89 2wmy h LYS 59 Cb 0.84 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 2wmy h LYS 59 CO -0.27 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.00 2wmy n ASN 60 N -3.16 2.61 -0.45 4.20 3.02 0.16 -4.96 115.26 116.67 2wmy n ASN 60 Ca -0.03 -2.47 -0.05 0.00 -0.03 0.00 0.00 54.58 52.00 2wmy n ASN 60 Cb 0.08 -0.26 -0.01 0.00 -0.61 0.00 0.00 39.78 38.98 2wmy n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wmy n GLY 61 N -0.54 0.48 3.39 7.41 0.00 -0.97 -5.03 105.19 109.93 2wmy n GLY 61 Ca 0.10 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 45.01 2wmy n GLY 61 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wmy s LEU 62 N -1.23 2.95 -0.19 0.99 2.96 -0.36 -4.99 118.68 118.81 2wmy s LEU 62 Ca 0.00 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.56 2wmy s LEU 62 Cb 0.00 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 2wmy s LEU 62 CO 0.00 0.10 0.03 0.00 -1.32 0.00 0.00 176.35 175.16 2wmy n LEU 64 N 3.97 3.42 -4.73 0.00 4.77 -1.26 -4.99 117.00 118.18 2wmy n LEU 64 Ca -0.17 -1.67 -0.42 0.00 -0.03 0.00 0.00 56.01 53.72 2wmy n LEU 64 Cb 0.52 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2wmy n LEU 64 CO 0.33 0.78 1.23 0.29 -1.33 0.00 0.00 177.39 178.69 2wmy n LYS 65 N 1.34 2.60 0.00 3.23 5.02 -1.26 -1.99 118.16 127.10 2wmy n LYS 65 Ca 0.19 0.93 0.00 0.00 -2.02 0.00 0.00 58.31 57.41 2wmy n LYS 65 Cb 0.56 -2.70 0.00 0.00 -0.02 0.00 0.00 35.03 32.87 2wmy n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wmy n GLY 66 N 2.45 0.59 3.73 0.72 0.00 -1.26 -5.07 105.19 106.35 2wmy n GLY 66 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2wmy n GLY 66 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wmy s HIS 67 N -2.05 3.41 -0.06 1.61 5.04 -0.84 -5.03 115.29 117.36 2wmy s HIS 67 Ca 0.00 1.35 0.01 0.00 -1.54 0.00 0.00 55.06 54.89 2wmy s HIS 67 Cb 0.00 -3.46 0.02 0.00 0.04 0.00 0.00 32.58 29.18 2wmy s HIS 67 CO 0.00 -1.34 -0.08 0.50 -2.34 0.00 0.00 174.74 171.48 2wmy s ARG 68 N 0.12 1.24 0.24 2.88 3.52 -1.26 -4.27 118.95 121.43 2wmy s ARG 68 Ca 0.55 -0.24 -0.31 0.00 -0.13 0.00 0.00 55.73 55.60 2wmy s ARG 68 Cb -0.32 -1.14 -0.12 0.00 -1.56 0.00 0.00 34.95 31.81 2wmy s ARG 68 CO 0.35 -0.05 1.68 0.41 -0.81 0.00 0.00 175.30 176.87 2wmy n GLY 69 N 4.04 1.47 2.92 8.12 0.00 0.00 -4.78 105.19 116.96 2wmy n GLY 69 Ca -0.23 0.56 -0.17 0.00 0.00 0.00 0.00 46.02 46.19 2wmy n GLY 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wmy s THR 70 N 0.74 0.37 0.11 2.61 -4.23 -1.26 -0.60 115.64 113.38 2wmy s THR 70 Ca 0.71 -0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.77 2wmy s THR 70 Cb -0.50 -0.36 -0.06 0.00 1.34 0.00 0.00 72.50 72.92 2wmy s THR 70 CO 0.38 0.13 1.02 -0.75 -0.54 0.00 0.00 174.62 174.87 2wmy s LYS 71 N 0.24 4.63 0.08 3.99 2.47 -1.26 -1.33 119.74 128.56 2wmy s LYS 71 Ca -0.02 1.54 -0.30 0.00 -1.56 0.00 0.00 55.97 55.62 2wmy s LYS 71 Cb -0.06 -3.36 -0.06 0.00 -1.46 0.00 0.00 37.83 32.89 2wmy s LYS 71 CO -0.00 0.10 1.12 0.12 0.16 0.00 0.00 175.35 176.84 2wmy s PHE 72 N 0.18 3.54 0.06 4.03 5.36 0.63 -4.72 117.98 127.06 2wmy s PHE 72 Ca 0.49 1.48 0.01 0.00 -0.96 0.00 0.00 56.93 57.96 2wmy s PHE 72 Cb -0.25 -3.31 -0.03 0.00 -0.34 0.00 0.00 43.02 39.09 2wmy s PHE 72 CO 0.31 -0.78 -0.06 0.95 -1.46 0.00 0.00 175.22 174.18 2wmy s THR 73 N 0.65 0.47 0.22 0.12 -4.23 -1.26 -4.86 115.64 106.75 2wmy s THR 73 Ca 0.54 -1.50 -0.14 0.00 -1.18 0.00 0.00 61.69 59.41 2wmy s THR 73 Cb -0.27 -1.12 0.26 0.00 1.34 0.00 0.00 72.50 72.71 2wmy s THR 73 CO 0.31 -0.69 1.60 -1.28 -0.54 0.00 0.00 174.62 174.01 2wmy h SER 74 N 3.71 -0.87 -0.45 3.99 0.87 -1.97 -0.72 113.55 118.12 2wmy h SER 74 Ca -0.35 0.23 0.06 0.00 -1.23 0.00 0.00 61.79 60.51 2wmy h SER 74 Cb 1.18 0.51 -0.05 0.00 -0.44 0.00 0.00 62.40 63.60 2wmy h SER 74 CO 0.54 -0.27 0.14 0.00 -0.53 0.00 0.00 176.83 176.71 2wmy h ALA 75 N 1.53 0.52 -0.72 6.23 0.00 -1.96 -2.50 119.26 122.37 2wmy h ALA 75 Ca 0.33 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.25 2wmy h ALA 75 Cb 0.56 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2wmy h ALA 75 CO -0.77 -0.26 0.23 1.25 0.00 0.00 0.00 179.25 179.70 2wmy h LEU 76 N 0.29 1.05 -1.63 0.00 5.85 -1.68 -2.89 115.31 116.31 2wmy h LEU 76 Ca 0.21 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2wmy h LEU 76 Cb 0.23 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2wmy h LEU 76 CO -0.24 0.98 0.06 0.00 -0.34 0.00 0.00 178.44 178.91 2wmy h ALA 77 N 1.11 1.71 0.00 1.25 0.00 -0.73 -1.83 119.26 120.76 2wmy h ALA 77 Ca 0.23 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wmy h ALA 77 Cb 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2wmy h ALA 77 CO -0.01 0.23 -0.00 0.00 0.00 0.00 0.00 179.25 179.47 2wmy h ARG 78 N 0.30 0.00 -0.01 0.00 3.08 -1.28 -0.87 114.38 115.61 2wmy h ARG 78 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2wmy h ARG 78 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2wmy h ARG 78 CO -0.01 0.00 -0.07 0.94 -1.07 0.00 0.00 179.97 179.76 2wmy n GLN 79 N -3.10 1.23 -4.86 0.04 7.27 -0.69 -4.89 117.38 112.38 2wmy n GLN 79 Ca -0.02 -0.61 -0.27 0.00 0.07 0.00 0.00 57.00 56.16 2wmy n GLN 79 Cb 0.11 -1.49 -0.15 0.00 2.41 0.00 0.00 30.24 31.12 2wmy n GLN 79 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2wmy s TYR 80 N -2.19 1.98 -0.03 3.69 2.02 -0.33 -4.92 117.35 117.57 2wmy s TYR 80 Ca 0.35 -0.38 0.12 0.00 -0.37 0.00 0.00 57.07 56.79 2wmy s TYR 80 Cb 0.21 -1.22 -0.20 0.00 -0.40 0.00 0.00 41.96 40.34 2wmy s TYR 80 CO 0.40 0.05 0.83 -0.44 -1.57 0.00 0.00 175.55 174.82 2wmy h ASP 81 N 5.11 0.00 -3.55 2.29 3.32 -1.62 -3.46 116.42 118.51 2wmy h ASP 81 Ca -0.43 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.33 2wmy h ASP 81 Cb 1.15 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.37 2wmy h ASP 81 CO 0.45 0.92 -0.73 -0.22 -1.72 0.00 0.00 179.24 177.94 2wmy s LEU 82 N -6.17 1.22 -0.16 1.55 2.96 -0.65 -4.87 118.68 112.55 2wmy s LEU 82 Ca -0.03 0.03 -0.05 0.00 -0.22 0.00 0.00 54.13 53.86 2wmy s LEU 82 Cb 0.08 -0.07 -0.03 0.00 0.50 0.00 0.00 46.19 46.67 2wmy s LEU 82 CO 0.82 -0.11 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.97 2wmy s LEU 83 N 0.91 3.39 -0.22 -0.68 1.02 -0.69 -0.39 118.68 122.02 2wmy s LEU 83 Ca -0.08 -0.08 -0.00 0.00 0.02 0.00 0.00 54.13 53.99 2wmy s LEU 83 Cb -0.11 -1.83 0.03 0.00 0.02 0.00 0.00 46.19 44.30 2wmy s LEU 83 CO -0.02 0.17 -0.13 -0.76 0.02 0.00 0.00 176.35 175.63 2wmy s LEU 84 N 0.37 2.75 0.21 1.79 1.43 -0.02 -0.50 118.68 124.71 2wmy s LEU 84 Ca -0.02 -0.81 0.07 0.00 -1.03 0.00 0.00 54.13 52.33 2wmy s LEU 84 Cb -0.14 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 2wmy s LEU 84 CO 0.02 -0.07 0.13 0.68 0.23 0.00 0.00 176.35 177.35 2wmy s VAL 85 N 1.29 4.30 0.02 -1.59 -7.23 -0.26 -0.26 120.40 116.67 2wmy s VAL 85 Ca 0.01 -1.33 -0.07 0.00 -1.81 0.00 0.00 61.98 58.79 2wmy s VAL 85 Cb -0.15 -3.25 -0.30 0.00 0.56 0.00 0.00 36.38 33.23 2wmy s VAL 85 CO -0.08 -0.23 0.94 0.24 -0.31 0.00 0.00 175.10 175.65 2wmy h MET 86 N 2.01 0.33 -5.72 4.82 0.00 -1.78 0.44 114.93 115.04 2wmy h MET 86 Ca -0.48 -0.56 -0.48 0.00 0.00 0.00 0.00 59.70 58.18 2wmy h MET 86 Cb 1.22 0.21 -0.21 0.00 0.00 0.00 0.00 31.60 32.82 2wmy h MET 86 CO 0.61 1.23 -0.80 -1.21 0.00 0.00 0.00 176.91 176.74 2wmy s GLU 87 N -2.62 0.97 0.33 1.72 2.02 -1.26 -1.32 118.70 118.54 2wmy s GLU 87 Ca -0.08 -1.06 0.11 0.00 0.02 0.00 0.00 54.97 53.96 2wmy s GLU 87 Cb 0.06 -1.09 0.94 0.00 0.10 0.00 0.00 34.13 34.15 2wmy s GLU 87 CO 0.88 0.25 1.73 1.88 0.02 0.00 0.00 175.26 180.01 2wmy h TYR 88 N 4.15 0.95 0.00 1.61 0.05 -1.96 0.35 116.97 122.13 2wmy h TYR 88 Ca -0.43 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.33 2wmy h TYR 88 Cb 1.19 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.65 2wmy h TYR 88 CO 0.63 0.04 -0.23 0.66 -1.05 0.00 0.00 178.16 178.21 2wmy h SER 89 N 0.53 0.00 0.21 3.88 4.64 -2.01 -2.03 113.55 118.76 2wmy h SER 89 Ca 0.65 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.92 2wmy h SER 89 Cb 1.32 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 2wmy h SER 89 CO -0.46 0.23 -0.22 0.45 -0.87 0.00 0.00 176.83 175.96 2wmy h HIS 90 N 0.00 0.02 -0.16 4.77 3.86 -1.33 -2.88 115.15 119.43 2wmy h HIS 90 Ca -0.00 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 2wmy h HIS 90 Cb 0.65 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 29.09 2wmy h HIS 90 CO 0.00 0.24 -0.04 -0.07 0.86 0.00 0.00 177.93 178.92 2wmy h LEU 91 N 0.02 -0.14 -0.97 2.43 3.38 -1.37 0.12 115.31 118.77 2wmy h LEU 91 Ca 0.00 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2wmy h LEU 91 Cb 0.40 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.19 2wmy h LEU 91 CO 0.03 -0.05 0.64 -0.33 0.09 0.00 0.00 178.44 178.82 2wmy h GLU 92 N 0.00 1.21 -0.42 1.13 4.39 -1.62 -1.02 114.58 118.26 2wmy h GLU 92 Ca 0.08 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 2wmy h GLU 92 Cb 0.11 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 2wmy h GLU 92 CO -0.16 0.80 0.06 1.96 -1.16 0.00 0.00 179.01 180.50 2wmy h GLN 93 N 1.25 0.70 -0.74 2.33 4.20 -1.16 0.11 115.11 121.79 2wmy h GLN 93 Ca 0.38 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2wmy h GLN 93 Cb -0.02 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.64 2wmy h GLN 93 CO -0.12 0.75 0.47 0.82 -0.67 0.00 0.00 178.83 180.08 2wmy h ILE 94 N 0.55 1.20 -0.57 2.54 5.03 -0.50 0.42 117.51 126.18 2wmy h ILE 94 Ca 0.12 -0.40 -0.03 0.00 -0.12 0.00 0.00 64.86 64.43 2wmy h ILE 94 Cb 0.39 0.13 -0.03 0.00 -3.03 0.00 0.00 36.82 34.29 2wmy h ILE 94 CO 0.01 0.20 0.25 0.28 -0.68 0.00 0.00 178.15 178.21 2wmy h SER 95 N 1.02 0.78 0.36 1.72 0.02 -0.66 0.59 113.55 117.37 2wmy h SER 95 Ca 0.27 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2wmy h SER 95 Cb -0.08 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.26 2wmy h SER 95 CO -0.05 0.72 -0.17 0.03 -1.14 0.00 0.00 176.83 176.21 2wmy h ARG 96 N 0.79 -0.47 -0.25 3.45 2.47 0.09 -3.07 114.38 117.39 2wmy h ARG 96 Ca 0.19 0.03 -0.10 0.00 -1.26 0.00 0.00 59.98 58.85 2wmy h ARG 96 Cb 0.17 0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.59 2wmy h ARG 96 CO -0.02 -0.31 -0.26 0.82 0.56 0.00 0.00 179.97 180.76 2wmy h ILE 97 N -0.55 1.27 -1.62 2.04 2.04 -0.22 -3.37 117.51 117.10 2wmy h ILE 97 Ca -0.05 -1.29 -0.49 0.00 1.00 0.00 0.00 64.86 64.03 2wmy h ILE 97 Cb 0.37 1.37 -0.34 0.00 -0.74 0.00 0.00 36.82 37.48 2wmy h ILE 97 CO 0.08 0.41 -0.98 0.00 0.00 0.00 0.00 178.15 177.66 2wmy n ALA 98 N -2.49 1.67 -0.10 1.87 0.00 0.20 -4.28 120.51 117.38 2wmy n ALA 98 Ca -0.00 -2.99 0.14 0.00 0.00 0.00 0.00 53.44 50.58 2wmy n ALA 98 Cb 0.41 -0.92 0.52 0.00 0.00 0.00 0.00 19.45 19.47 2wmy n ALA 98 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2wmy h PRO 99 N 4.04 0.36 -0.11 0.00 0.11 -1.56 -0.29 132.00 134.56 2wmy h PRO 99 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2wmy h PRO 99 Cb 0.91 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2wmy h PRO 99 CO 0.43 0.24 0.00 -0.85 -0.21 0.00 0.00 178.00 177.61 2wmy n GLU 100 N -4.46 1.36 -0.00 1.05 0.00 -1.26 -3.14 120.64 114.19 2wmy n GLU 100 Ca 0.11 -0.55 0.06 0.00 0.00 0.00 0.00 57.16 56.78 2wmy n GLU 100 Cb 0.45 -1.27 -0.07 0.00 0.00 0.00 0.00 31.44 30.55 2wmy n GLU 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wmy n ALA 101 N -0.17 3.26 -0.17 -1.84 0.00 -0.12 -4.60 120.51 116.87 2wmy n ALA 101 Ca 0.12 -0.32 0.08 0.00 0.00 0.00 0.00 53.44 53.32 2wmy n ALA 101 Cb 0.17 -0.43 0.39 0.00 0.00 0.00 0.00 19.45 19.59 2wmy n ALA 101 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wmy h ARG 102 N 0.00 0.65 0.00 0.00 9.65 -1.59 -1.71 114.38 121.38 2wmy h ARG 102 Ca 0.00 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 2wmy h ARG 102 Cb 0.35 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 2wmy h ARG 102 CO 0.00 0.43 0.00 0.78 2.80 0.00 0.00 179.97 183.98 2wmy h GLY 103 N 0.67 0.00 -0.46 2.80 0.00 -1.82 -2.21 103.07 102.05 2wmy h GLY 103 Ca 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.64 2wmy h GLY 103 CO -0.11 0.00 -0.22 0.58 0.00 0.00 0.00 176.54 176.79 2wmy n LYS 104 N -2.38 1.32 -4.25 4.80 2.85 -0.65 -5.02 118.16 114.84 2wmy n LYS 104 Ca -0.00 -2.78 -0.34 0.00 -1.05 0.00 0.00 58.31 54.14 2wmy n LYS 104 Cb 0.11 -1.48 -0.11 0.00 -0.65 0.00 0.00 35.03 32.90 2wmy n LYS 104 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2wmy s THR 105 N -2.85 4.21 0.20 0.58 2.01 -0.83 -1.70 115.64 117.26 2wmy s THR 105 Ca 0.33 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.12 2wmy s THR 105 Cb 0.31 -2.87 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 2wmy s THR 105 CO -0.01 0.48 -0.00 -0.04 -0.69 0.00 0.00 174.62 174.36 2wmy s MET 106 N 0.39 1.23 0.23 4.92 -1.94 0.35 -4.98 119.30 119.50 2wmy s MET 106 Ca -0.01 -1.61 -0.30 0.00 -1.71 0.00 0.00 55.69 52.06 2wmy s MET 106 Cb -0.14 -0.46 -0.09 0.00 2.01 0.00 0.00 34.83 36.16 2wmy s MET 106 CO 0.02 -0.11 1.10 -0.51 -0.01 0.00 0.00 175.02 175.51 2wmy s LEU 107 N -3.24 4.52 0.21 -0.03 1.43 -1.26 -1.10 118.68 119.21 2wmy s LEU 107 Ca 0.26 2.18 -0.09 0.00 -1.03 0.00 0.00 54.13 55.45 2wmy s LEU 107 Cb 0.06 -3.62 0.31 0.00 0.03 0.00 0.00 46.19 42.97 2wmy s LEU 107 CO 0.07 -0.17 1.72 0.15 0.23 0.00 0.00 176.35 178.34 2wmy h PHE 108 N 4.47 0.31 -0.21 0.29 3.57 -0.35 -1.63 116.94 123.38 2wmy h PHE 108 Ca -0.45 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.08 2wmy h PHE 108 Cb 1.21 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2wmy h PHE 108 CO 0.61 0.03 0.00 0.41 -2.23 0.00 0.00 178.31 177.12 2wmy n GLY 109 N -1.31 1.47 0.47 2.40 0.00 -1.22 -4.57 105.19 102.43 2wmy n GLY 109 Ca 0.09 -0.30 0.31 0.00 0.00 0.00 0.00 46.02 46.12 2wmy n GLY 109 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2wmy h HIS 110 N 1.40 0.41 -0.49 1.61 6.17 -1.48 0.17 115.15 122.94 2wmy h HIS 110 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.10 2wmy h HIS 110 Cb 0.81 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 30.63 2wmy h HIS 110 CO 0.32 -0.01 0.00 0.91 0.71 0.00 0.00 177.93 179.85 2wmy n TRP 111 N -4.48 0.65 -3.15 5.26 7.02 -1.26 -4.92 117.44 116.56 2wmy n TRP 111 Ca 0.29 -0.32 -0.21 0.00 -1.02 0.00 0.00 57.50 56.23 2wmy n TRP 111 Cb 1.15 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 30.04 2wmy n TRP 111 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2wmy s LEU 112 N -1.07 3.75 0.10 -0.99 1.43 0.60 -5.03 118.68 117.47 2wmy s LEU 112 Ca 0.35 0.05 -0.20 0.00 -1.03 0.00 0.00 54.13 53.29 2wmy s LEU 112 Cb 0.18 -2.96 -0.09 0.00 0.03 0.00 0.00 46.19 43.35 2wmy s LEU 112 CO 0.24 -0.63 1.68 0.44 0.23 0.00 0.00 176.35 178.30 2wmy h ASP 113 N 0.58 0.21 -3.55 2.29 3.32 -1.91 -3.37 116.42 113.98 2wmy h ASP 113 Ca -0.45 -0.11 -0.66 0.00 0.02 0.00 0.00 57.03 55.82 2wmy h ASP 113 Cb 1.26 -0.05 -0.26 0.00 0.22 0.00 0.00 39.33 40.49 2wmy h ASP 113 CO 0.55 0.26 -0.66 -0.55 -1.72 0.00 0.00 179.24 177.12 2wmy s SER 114 N -5.48 4.85 0.25 6.45 0.15 -1.26 -5.02 113.70 113.64 2wmy s SER 114 Ca -0.13 -0.51 0.04 0.00 0.70 0.00 0.00 55.95 56.05 2wmy s SER 114 Cb 0.07 -1.84 0.32 0.00 -1.71 0.00 0.00 66.02 62.86 2wmy s SER 114 CO 0.70 -0.10 1.62 0.11 1.20 0.00 0.00 173.24 176.76 2wmy h LYS 115 N 8.19 0.31 -6.80 5.44 1.57 -1.77 -3.45 116.57 120.05 2wmy h LYS 115 Ca -0.36 -0.17 -0.51 0.00 -1.87 0.00 0.00 60.65 57.74 2wmy h LYS 115 Cb 1.15 0.01 0.03 0.00 0.08 0.00 0.00 32.23 33.50 2wmy h LYS 115 CO 0.59 0.73 0.53 -1.21 -0.57 0.00 0.00 179.45 179.53 2wmy s GLU 116 N -4.00 4.55 -0.47 3.15 2.02 -1.26 -3.46 118.70 119.22 2wmy s GLU 116 Ca -0.05 1.92 -0.19 0.00 0.02 0.00 0.00 54.97 56.67 2wmy s GLU 116 Cb 0.13 -3.17 0.04 0.00 0.10 0.00 0.00 34.13 31.23 2wmy s GLU 116 CO 0.79 0.07 0.58 0.42 0.02 0.00 0.00 175.26 177.14 2wmy s ILE 117 N -0.99 4.92 0.54 -1.63 -1.09 -0.43 -4.97 121.20 117.54 2wmy s ILE 117 Ca 0.47 -0.34 -0.20 0.00 -2.23 0.00 0.00 60.65 58.35 2wmy s ILE 117 Cb -0.34 -4.22 -0.07 0.00 -1.58 0.00 0.00 42.46 36.25 2wmy s ILE 117 CO 0.43 -0.67 0.92 -2.65 -1.23 0.00 0.00 174.94 171.75 2wmy n PRO 118 N 6.05 1.01 -2.83 2.79 -0.02 -1.26 -4.68 135.00 136.06 2wmy n PRO 118 Ca -0.06 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 2wmy n PRO 118 Cb 0.46 -2.07 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 2wmy n PRO 118 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wmy s ASP 119 N -1.06 6.83 0.00 2.55 2.15 -1.26 -4.94 116.67 120.94 2wmy s ASP 119 Ca 0.70 0.95 0.26 0.00 0.43 0.00 0.00 52.55 54.88 2wmy s ASP 119 Cb -0.47 -2.46 0.60 0.00 -0.30 0.00 0.00 42.92 40.29 2wmy s ASP 119 CO 0.51 -0.65 1.47 -0.81 -0.17 0.00 0.00 175.17 175.53 2wmy n PRO 120 N 6.30 0.28 -1.66 4.34 -0.04 -1.26 -4.95 135.00 138.00 2wmy n PRO 120 Ca 0.07 -0.16 -0.47 0.00 -0.04 0.00 0.00 63.50 62.90 2wmy n PRO 120 Cb 0.47 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.39 2wmy n PRO 120 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2wmy n TYR 121 N -1.22 2.20 -0.98 0.54 9.36 -1.26 -0.85 117.16 124.94 2wmy n TYR 121 Ca 0.08 0.26 0.00 0.00 3.32 0.00 0.00 57.90 61.56 2wmy n TYR 121 Cb 0.34 -2.54 0.00 0.00 -0.63 0.00 0.00 39.34 36.51 2wmy n TYR 121 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2wmy n ARG 122 N 3.92 0.00 -2.89 2.98 1.74 -1.26 -5.02 116.66 116.13 2wmy n ARG 122 Ca 0.18 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 57.07 2wmy n ARG 122 Cb 0.28 -2.48 0.05 0.00 -1.02 0.00 0.00 32.46 29.28 2wmy n ARG 122 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2wmy s MET 123 N -0.02 2.45 0.88 5.56 -1.94 -0.03 -5.11 119.30 121.09 2wmy s MET 123 Ca 0.00 -1.27 -0.11 0.00 -1.71 0.00 0.00 55.69 52.59 2wmy s MET 123 Cb 0.00 -2.62 0.17 0.00 2.01 0.00 0.00 34.83 34.40 2wmy s MET 123 CO 0.00 -0.71 1.22 -1.54 -0.01 0.00 0.00 175.02 173.98 2wmy s SER 124 N -4.52 3.53 0.36 3.03 1.04 -1.26 -4.88 113.70 111.00 2wmy s SER 124 Ca 0.59 0.10 0.04 0.00 0.48 0.00 0.00 55.95 57.16 2wmy s SER 124 Cb -0.08 -0.26 0.68 0.00 0.10 0.00 0.00 66.02 66.46 2wmy s SER 124 CO 0.37 -2.45 1.99 0.44 0.98 0.00 0.00 173.24 174.57 2wmy h ASP 125 N -1.29 0.61 -0.65 7.02 3.32 -1.98 -1.87 116.42 121.57 2wmy h ASP 125 Ca -0.42 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 56.55 2wmy h ASP 125 Cb 1.25 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 2wmy h ASP 125 CO 0.40 0.50 0.29 -0.33 -1.72 0.00 0.00 179.24 178.37 2wmy h GLU 126 N 0.69 0.99 -0.92 3.56 3.07 -1.98 0.63 114.58 120.62 2wmy h GLU 126 Ca 0.18 -0.15 0.03 0.00 -0.50 0.00 0.00 59.36 58.91 2wmy h GLU 126 Cb 0.03 -0.17 -0.05 0.00 -0.84 0.00 0.00 28.75 27.71 2wmy h GLU 126 CO -0.03 0.79 0.60 0.00 -1.40 0.00 0.00 179.01 178.97 2wmy h ALA 127 N 1.34 1.21 -0.04 3.43 0.00 -1.70 -0.78 119.26 122.71 2wmy h ALA 127 Ca 0.23 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 2wmy h ALA 127 Cb 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2wmy h ALA 127 CO -0.02 0.48 -0.87 0.74 0.00 0.00 0.00 179.25 179.58 2wmy h PHE 128 N 1.17 0.67 -0.56 0.00 0.04 -1.01 -1.99 116.94 115.26 2wmy h PHE 128 Ca 0.36 -0.34 0.09 0.00 2.80 0.00 0.00 57.97 60.88 2wmy h PHE 128 Cb -0.02 -0.09 -0.07 0.00 2.20 0.00 0.00 35.95 37.97 2wmy h PHE 128 CO -0.01 1.14 0.19 -0.44 -0.60 0.00 0.00 178.31 178.59 2wmy h ASP 129 N 0.29 0.17 -0.16 2.17 3.32 0.50 -1.18 116.42 121.53 2wmy h ASP 129 Ca -0.07 0.08 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 2wmy h ASP 129 Cb 1.49 0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.11 2wmy h ASP 129 CO 0.15 0.11 -0.41 0.28 -1.72 0.00 0.00 179.24 177.65 2wmy h SER 130 N 0.36 0.64 0.24 6.45 0.02 -1.09 -2.72 113.55 117.45 2wmy h SER 130 Ca 0.28 -0.58 -0.06 0.00 -0.84 0.00 0.00 61.79 60.59 2wmy h SER 130 Cb 0.34 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 2wmy h SER 130 CO -0.30 1.11 -0.28 0.58 -1.14 0.00 0.00 176.83 176.80 2wmy h VAL 131 N 0.21 1.22 0.07 2.27 2.07 -1.26 -1.72 116.25 119.12 2wmy h VAL 131 Ca -0.01 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.49 2wmy h VAL 131 Cb 1.03 1.50 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2wmy h VAL 131 CO 0.09 0.30 -0.04 0.22 0.02 0.00 0.00 177.57 178.16 2wmy h TYR 132 N 0.07 -0.09 -0.89 1.57 3.20 -1.12 -0.28 116.97 119.42 2wmy h TYR 132 Ca 0.01 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 2wmy h TYR 132 Cb 0.53 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.77 2wmy h TYR 132 CO 0.00 0.15 0.57 0.37 -1.64 0.00 0.00 178.16 177.61 2wmy h GLN 133 N -0.33 1.07 -0.65 1.82 5.75 -1.23 0.22 115.11 121.77 2wmy h GLN 133 Ca -0.01 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.36 2wmy h GLN 133 Cb 0.28 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 2wmy h GLN 133 CO 0.02 0.71 0.14 -0.07 -2.65 0.00 0.00 178.83 176.98 2wmy h LEU 134 N 1.10 1.00 -0.62 -2.39 3.38 -1.21 -1.05 115.31 115.52 2wmy h LEU 134 Ca 0.36 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2wmy h LEU 134 Cb 0.02 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 2wmy h LEU 134 CO -0.12 0.98 0.23 -0.07 0.09 0.00 0.00 178.44 179.55 2wmy h LEU 135 N 0.97 0.88 -0.06 1.67 3.38 -0.07 -1.23 115.31 120.85 2wmy h LEU 135 Ca 0.20 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2wmy h LEU 135 Cb 0.39 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2wmy h LEU 135 CO 0.01 0.83 0.03 -0.08 0.09 0.00 0.00 178.44 179.31 2wmy h GLU 136 N 0.88 0.09 -0.61 1.13 4.81 -0.29 -0.50 114.58 120.08 2wmy h GLU 136 Ca 0.20 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 2wmy h GLU 136 Cb 0.24 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 2wmy h GLU 136 CO -0.01 0.18 0.29 0.37 -0.73 0.00 0.00 179.01 179.11 2wmy h GLN 137 N -0.02 0.89 -0.88 1.92 5.75 -1.12 -1.05 115.11 120.60 2wmy h GLN 137 Ca 0.02 -0.14 0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2wmy h GLN 137 Cb 0.12 -0.16 -0.05 0.00 1.07 0.00 0.00 27.48 28.47 2wmy h GLN 137 CO -0.00 0.73 0.58 0.00 -2.65 0.00 0.00 178.83 177.48 2wmy h ALA 138 N 1.12 1.12 -0.31 3.38 0.00 -1.07 -2.48 119.26 121.02 2wmy h ALA 138 Ca 0.21 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2wmy h ALA 138 Cb 0.14 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2wmy h ALA 138 CO -0.02 0.49 0.12 0.77 0.00 0.00 0.00 179.25 180.61 2wmy h SER 139 N 1.17 0.43 -0.99 0.00 0.02 -0.51 -1.10 113.55 112.57 2wmy h SER 139 Ca 0.33 -0.17 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 2wmy h SER 139 Cb -0.11 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 62.27 2wmy h SER 139 CO -0.08 0.48 0.65 0.11 -1.14 0.00 0.00 176.83 176.85 2wmy h LYS 140 N 0.36 1.26 -0.13 3.45 1.57 -1.02 -0.27 116.57 121.79 2wmy h LYS 140 Ca 0.10 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.64 2wmy h LYS 140 Cb 0.19 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2wmy h LYS 140 CO -0.01 0.84 -0.62 0.00 -0.57 0.00 0.00 179.45 179.09 2wmy h ARG 141 N 1.30 0.46 -0.30 3.15 3.08 -1.28 -1.98 114.38 118.81 2wmy h ARG 141 Ca 0.38 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 2wmy h ARG 141 Cb -0.08 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2wmy h ARG 141 CO -0.10 0.94 0.08 -1.49 -1.07 0.00 0.00 179.97 178.33 2wmy h TRP 142 N 0.34 0.50 -0.66 3.04 4.06 -0.75 -1.44 115.95 121.05 2wmy h TRP 142 Ca -0.01 -0.06 0.02 0.00 2.06 0.00 0.00 58.89 60.90 2wmy h TRP 142 Cb 1.17 -0.14 -0.04 0.00 -1.00 0.00 0.00 29.16 29.15 2wmy h TRP 142 CO 0.04 0.53 0.42 0.00 -3.56 0.00 0.00 178.44 175.88 2wmy h ALA 143 N 0.91 0.84 -0.45 1.49 0.00 -1.02 -1.11 119.26 119.92 2wmy h ALA 143 Ca 0.10 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2wmy h ALA 143 Cb 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2wmy h ALA 143 CO 0.00 0.21 0.24 1.49 0.00 0.00 0.00 179.25 181.18 2wmy h GLU 144 N 0.84 0.46 0.00 0.00 4.81 -1.18 -2.03 114.58 117.48 2wmy h GLU 144 Ca 0.25 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 2wmy h GLU 144 Cb -0.03 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 2wmy h GLU 144 CO -0.08 0.30 -0.32 0.87 -0.73 0.00 0.00 179.01 179.06 2wmy h LYS 145 N 0.47 0.00 -0.03 1.92 1.79 -0.82 -3.51 116.57 116.39 2wmy h LYS 145 Ca 0.19 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.66 2wmy h LYS 145 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2wmy h LYS 145 CO -0.12 0.32 0.00 1.28 -1.08 0.00 0.00 179.45 179.84