#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wmy s PHE 6 N 0.00 3.91 -0.04 1.12 0.08 -1.26 -4.81 117.98 116.97 2wmy s PHE 6 Ca 0.00 -2.32 0.21 0.00 0.12 0.00 0.00 56.93 54.94 2wmy s PHE 6 Cb 0.00 -3.75 -0.32 0.00 -0.57 0.00 0.00 43.02 38.38 2wmy s PHE 6 CO 0.00 -0.95 0.44 -3.47 -0.10 0.00 0.00 175.22 171.13 2wmy n ASP 7 N 3.45 0.19 -4.22 1.36 2.03 -1.26 -4.92 116.55 113.17 2wmy n ASP 7 Ca 0.17 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 55.17 2wmy n ASP 7 Cb 0.43 1.90 -0.17 0.00 -0.72 0.00 0.00 41.12 42.57 2wmy n ASP 7 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2wmy s SER 8 N -4.49 2.89 -0.06 1.67 0.01 -1.26 -2.74 113.70 109.73 2wmy s SER 8 Ca -0.08 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.70 2wmy s SER 8 Cb 0.13 -0.98 0.02 0.00 0.21 0.00 0.00 66.02 65.40 2wmy s SER 8 CO 0.87 0.20 -0.08 -0.63 0.41 0.00 0.00 173.24 174.01 2wmy s ILE 9 N 0.05 0.85 -0.30 1.44 1.01 0.15 -1.72 121.20 122.67 2wmy s ILE 9 Ca -0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 2wmy s ILE 9 Cb -0.15 -0.81 0.04 0.00 0.01 0.00 0.00 42.46 41.55 2wmy s ILE 9 CO 0.05 0.29 0.01 -0.22 0.00 0.00 0.00 174.94 175.08 2wmy s LEU 10 N 0.82 3.87 -0.10 2.97 2.96 0.16 -1.34 118.68 128.02 2wmy s LEU 10 Ca -0.12 -1.16 -0.19 0.00 -0.22 0.00 0.00 54.13 52.44 2wmy s LEU 10 Cb -0.15 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2wmy s LEU 10 CO 0.02 -0.25 0.52 -0.69 -1.32 0.00 0.00 176.35 174.62 2wmy s VAL 11 N 1.31 5.16 -0.08 1.68 1.01 0.95 -1.46 120.40 128.97 2wmy s VAL 11 Ca -0.03 1.04 0.02 0.00 0.00 0.00 0.00 61.98 63.01 2wmy s VAL 11 Cb -0.19 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.35 2wmy s VAL 11 CO -0.01 0.32 -0.13 -0.63 0.00 0.00 0.00 175.10 174.65 2wmy s ILE 12 N 0.61 1.26 0.00 2.22 1.01 0.65 -1.11 121.20 125.83 2wmy s ILE 12 Ca 0.28 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.39 2wmy s ILE 12 Cb -0.16 -1.15 0.00 0.00 0.01 0.00 0.00 42.46 41.16 2wmy s ILE 12 CO 0.12 0.39 0.00 0.00 0.00 0.00 0.00 174.94 175.44 2wmy n THR 14 N 0.00 0.40 0.22 0.00 -1.04 -1.26 -1.37 114.28 111.22 2wmy n THR 14 Ca 0.00 0.42 0.11 0.00 -2.04 0.00 0.00 64.05 62.54 2wmy n THR 14 Cb 0.00 -1.74 0.20 0.00 -1.82 0.00 0.00 70.33 66.97 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 -0.27 0.00 -6.03 3.41 0.00 -1.92 0.39 103.07 98.65 2wmy h GLY 15 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.90 2wmy h GLY 15 CO 0.00 0.00 -0.73 -2.01 0.00 0.00 0.00 176.54 173.80 2wmy n ASN 16 N -3.12 -4.85 0.00 0.19 4.05 -1.26 -1.55 115.26 108.72 2wmy n ASN 16 Ca 0.03 -0.67 0.00 0.00 0.45 0.00 0.00 54.58 54.40 2wmy n ASN 16 Cb 0.53 -4.50 0.00 0.00 1.23 0.00 0.00 39.78 37.04 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 -4.73 0.00 0.00 -1.44 -5.35 -1.26 -4.42 119.36 102.16 2wmy n ILE 17 Ca -0.04 -0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 2wmy n ILE 17 Cb 0.57 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.69 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 -0.53 0.00 0.00 3.08 -1.96 -3.14 114.38 111.83 2wmy h ARG 19 Ca 0.00 0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 2wmy h ARG 19 Cb 0.00 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2wmy h ARG 19 CO 0.00 -0.22 -0.32 0.66 -1.07 0.00 0.00 179.97 179.01 2wmy h SER 20 N -0.91 0.00 -0.45 7.04 4.64 -1.90 0.11 113.55 122.08 2wmy h SER 20 Ca -0.06 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.19 2wmy h SER 20 Cb 0.56 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 2wmy h SER 20 CO 0.09 0.32 -0.02 -0.65 -0.87 0.00 0.00 176.83 175.71 2wmy h PRO 21 N 0.00 0.81 -0.30 4.77 0.11 -1.86 -0.63 132.00 134.91 2wmy h PRO 21 Ca -0.00 -0.27 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 2wmy h PRO 21 Cb 0.58 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2wmy h PRO 21 CO 0.04 0.88 0.17 0.82 -0.21 0.00 0.00 178.00 179.70 2wmy h ILE 22 N 0.66 1.12 -0.66 4.15 2.04 -1.33 -2.04 117.51 121.44 2wmy h ILE 22 Ca 0.13 -0.29 -0.08 0.00 1.00 0.00 0.00 64.86 65.62 2wmy h ILE 22 Cb 0.53 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2wmy h ILE 22 CO 0.03 0.12 0.11 1.23 0.00 0.00 0.00 178.15 179.64 2wmy h GLY 23 N 0.37 1.18 0.89 5.37 0.00 -0.75 -1.42 103.07 108.70 2wmy h GLY 23 Ca 0.11 -0.78 0.01 0.00 0.00 0.00 0.00 47.33 46.67 2wmy h GLY 23 CO -0.02 0.72 0.05 -2.09 0.00 0.00 0.00 176.54 175.20 2wmy h GLU 24 N 1.01 0.12 -0.14 4.80 4.81 -1.03 -1.70 114.58 122.45 2wmy h GLU 24 Ca 0.20 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.30 2wmy h GLU 24 Cb 0.43 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2wmy h GLU 24 CO 0.01 0.08 -0.47 0.00 -0.73 0.00 0.00 179.01 177.90 2wmy h ARG 25 N 0.12 0.35 0.06 1.92 2.47 -1.21 -0.34 114.38 117.75 2wmy h ARG 25 Ca 0.06 -0.19 -0.00 0.00 -1.26 0.00 0.00 59.98 58.59 2wmy h ARG 25 Cb 0.03 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 2wmy h ARG 25 CO -0.06 0.75 -0.03 -0.07 0.56 0.00 0.00 179.97 181.11 2wmy h LEU 26 N 0.28 -0.07 -1.08 3.04 3.38 -1.14 -2.57 115.31 117.15 2wmy h LEU 26 Ca 0.02 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2wmy h LEU 26 Cb 0.94 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 2wmy h LEU 26 CO 0.08 -0.03 -0.07 -0.07 0.09 0.00 0.00 178.44 178.44 2wmy h LEU 27 N -0.11 0.55 -0.80 1.67 3.38 -1.10 -2.47 115.31 116.42 2wmy h LEU 27 Ca -0.01 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2wmy h LEU 27 Cb 0.09 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2wmy h LEU 27 CO 0.01 0.67 0.52 0.03 0.09 0.00 0.00 178.44 179.77 2wmy h ARG 28 N 0.54 1.02 -0.65 1.13 3.08 -0.93 0.52 114.38 119.08 2wmy h ARG 28 Ca 0.10 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 2wmy h ARG 28 Cb 0.45 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 2wmy h ARG 28 CO 0.02 0.67 0.34 0.00 -1.07 0.00 0.00 179.97 179.94 2wmy h ARG 29 N 1.05 0.92 0.00 0.04 3.08 -1.04 -3.04 114.38 115.38 2wmy h ARG 29 Ca 0.31 -0.12 -0.15 0.00 0.07 0.00 0.00 59.98 60.09 2wmy h ARG 29 Cb -0.06 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2wmy h ARG 29 CO -0.09 0.71 -0.70 -0.07 -1.07 0.00 0.00 179.97 178.75 2wmy h LEU 30 N 0.89 0.00 -6.02 3.04 3.38 -0.96 -3.39 115.31 112.25 2wmy h LEU 30 Ca 0.23 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.63 2wmy h LEU 30 Cb 0.07 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.42 2wmy h LEU 30 CO -0.03 0.70 -0.98 0.18 0.09 0.00 0.00 178.44 178.40 2wmy n LEU 31 N -3.42 1.23 0.34 1.67 4.77 0.18 -4.98 117.00 116.79 2wmy n LEU 31 Ca 0.00 -4.93 0.23 0.00 -0.03 0.00 0.00 56.01 51.28 2wmy n LEU 31 Cb 0.76 0.29 1.19 0.00 -2.33 0.00 0.00 43.42 43.33 2wmy n LEU 31 CO 0.43 2.10 1.18 -0.65 -1.33 0.00 0.00 177.39 179.11 2wmy h PRO 32 N 3.93 0.00 -0.01 3.23 0.11 -1.74 -2.52 132.00 135.00 2wmy h PRO 32 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2wmy h PRO 32 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2wmy h PRO 32 CO 0.57 0.00 -0.26 -1.13 -0.21 0.00 0.00 178.00 176.97 2wmy n SER 33 N -3.09 1.03 -4.85 -2.05 3.41 -1.26 -4.93 113.62 101.87 2wmy n SER 33 Ca -0.03 -0.89 -0.28 0.00 -0.26 0.00 0.00 58.87 57.41 2wmy n SER 33 Cb 0.09 0.14 -0.05 0.00 -0.26 0.00 0.00 64.21 64.12 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 -2.50 3.11 -0.61 4.33 1.02 -0.95 -5.05 119.74 119.08 2wmy s LYS 34 Ca 0.24 -0.69 -0.27 0.00 0.02 0.00 0.00 55.97 55.27 2wmy s LYS 34 Cb 0.19 -2.80 0.03 0.00 -0.52 0.00 0.00 37.83 34.73 2wmy s LYS 34 CO 0.52 0.53 1.15 0.21 -0.92 0.00 0.00 175.35 176.84 2wmy s LYS 35 N -2.87 3.40 -0.13 1.68 2.20 -1.11 -4.98 119.74 117.93 2wmy s LYS 35 Ca 0.32 0.02 0.03 0.00 -0.36 0.00 0.00 55.97 55.97 2wmy s LYS 35 Cb -0.11 -4.06 0.01 0.00 -1.51 0.00 0.00 37.83 32.15 2wmy s LYS 35 CO 0.25 -1.74 -0.22 0.42 -0.36 0.00 0.00 175.35 173.71 2wmy s ILE 36 N 4.87 2.13 0.33 5.43 1.01 -1.26 -0.68 121.20 133.03 2wmy s ILE 36 Ca 0.38 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 60.09 2wmy s ILE 36 Cb -0.09 -1.85 -0.01 0.00 0.01 0.00 0.00 42.46 40.53 2wmy s ILE 36 CO 0.22 0.55 0.38 0.59 0.00 0.00 0.00 174.94 176.68 2wmy n ASN 37 N 3.94 -1.04 -3.91 3.58 3.02 -0.45 -5.00 115.26 115.40 2wmy n ASN 37 Ca -0.20 -2.92 -0.09 0.00 -0.03 0.00 0.00 54.58 51.35 2wmy n ASN 37 Cb 0.52 2.08 -0.08 0.00 -0.61 0.00 0.00 39.78 41.68 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 -3.13 0.18 0.28 6.41 1.04 -1.26 -0.04 113.70 117.19 2wmy s SER 38 Ca 0.32 -0.65 -0.21 0.00 0.48 0.00 0.00 55.95 55.89 2wmy s SER 38 Cb 0.00 0.29 0.03 0.00 0.10 0.00 0.00 66.02 66.44 2wmy s SER 38 CO 0.23 -0.65 0.76 0.00 0.98 0.00 0.00 173.24 174.56 2wmy s ALA 39 N -3.48 -1.22 0.04 5.32 0.00 -0.27 -4.67 121.76 117.48 2wmy s ALA 39 Ca 0.02 -0.31 0.04 0.00 0.00 0.00 0.00 51.96 51.71 2wmy s ALA 39 Cb 0.04 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 2wmy s ALA 39 CO -0.09 -1.04 -0.11 0.20 0.00 0.00 0.00 175.76 174.72 2wmy s GLY 40 N -2.94 0.66 0.00 0.00 0.00 0.12 -1.61 107.32 103.54 2wmy s GLY 40 Ca 0.12 -0.76 0.28 0.00 0.00 0.00 0.00 44.72 44.36 2wmy s GLY 40 CO 0.07 -0.76 1.83 3.33 0.00 0.00 0.00 173.10 177.57 2wmy n VAL 41 N 1.83 0.00 -2.64 1.40 0.24 -0.47 -0.80 118.33 117.88 2wmy n VAL 41 Ca -0.19 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.34 61.97 2wmy n VAL 41 Cb 0.55 -0.16 0.03 0.00 -1.47 0.00 0.00 33.84 32.78 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 1.36 2.16 3.77 7.63 0.00 0.13 -4.92 105.19 115.32 2wmy n GLY 42 Ca 0.12 -1.48 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 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 -3.23 3.23 -1.00 4.61 0.00 -0.89 -4.02 121.76 120.46 2wmy s ALA 43 Ca 0.30 1.02 -0.17 0.00 0.00 0.00 0.00 51.96 53.11 2wmy s ALA 43 Cb 0.44 -3.40 0.14 0.00 0.00 0.00 0.00 23.12 20.30 2wmy s ALA 43 CO 0.00 -0.54 1.21 -0.51 0.00 0.00 0.00 175.76 175.93 2wmy s LEU 44 N -2.29 5.04 0.03 0.00 1.43 -0.60 -4.92 118.68 117.38 2wmy s LEU 44 Ca 0.55 -2.29 -0.30 0.00 -1.03 0.00 0.00 54.13 51.05 2wmy s LEU 44 Cb -0.33 -2.40 -0.07 0.00 0.03 0.00 0.00 46.19 43.42 2wmy s LEU 44 CO 0.42 -0.98 1.60 -0.69 0.23 0.00 0.00 176.35 176.93 2wmy s VAL 45 N 2.41 3.29 0.00 -1.59 1.01 -1.26 -1.96 120.40 122.30 2wmy s VAL 45 Ca 0.35 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2wmy s VAL 45 Cb -0.04 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2wmy s VAL 45 CO -0.07 -0.01 0.00 0.47 0.00 0.00 0.00 175.10 175.49 2wmy n ASP 46 N 5.88 -0.59 -4.82 3.32 8.00 -0.22 -4.89 116.55 123.24 2wmy n ASP 46 Ca 0.16 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.31 2wmy n ASP 46 Cb 0.42 -0.10 -0.06 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 -3.46 3.48 1.00 1.24 3.76 -0.83 -4.61 115.29 115.87 2wmy s HIS 47 Ca 0.00 1.50 -0.14 0.00 -0.15 0.00 0.00 55.06 56.27 2wmy s HIS 47 Cb 0.00 -2.74 0.19 0.00 1.11 0.00 0.00 32.58 31.14 2wmy s HIS 47 CO 0.00 0.11 1.13 0.95 -0.85 0.00 0.00 174.74 176.08 2wmy s THR 48 N -1.87 1.93 0.69 1.30 -4.23 -1.26 -0.50 115.64 111.70 2wmy s THR 48 Ca 0.53 0.00 -0.17 0.00 -1.18 0.00 0.00 61.69 60.88 2wmy s THR 48 Cb -0.13 -2.63 0.01 0.00 1.34 0.00 0.00 72.50 71.08 2wmy s THR 48 CO 0.18 0.00 1.13 0.00 -0.54 0.00 0.00 174.62 175.39 2wmy n ALA 49 N -4.09 0.37 -1.77 3.99 0.00 -1.26 -4.81 120.51 112.94 2wmy n ALA 49 Ca 0.08 -0.12 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 2wmy n ALA 49 Cb 0.59 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.82 2wmy n ALA 49 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wmy s ASP 50 N -1.57 6.23 0.19 0.00 2.15 0.15 -4.83 116.67 118.99 2wmy s ASP 50 Ca 0.77 2.85 -0.12 0.00 0.43 0.00 0.00 52.55 56.49 2wmy s ASP 50 Cb -0.36 -2.65 0.23 0.00 -0.30 0.00 0.00 42.92 39.84 2wmy s ASP 50 CO 0.46 -0.93 1.70 -0.33 -0.17 0.00 0.00 175.17 175.90 2wmy h GLU 51 N 2.73 0.19 -0.31 4.34 5.08 -1.92 0.01 114.58 124.71 2wmy h GLU 51 Ca -0.50 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 57.81 2wmy h GLU 51 Cb 1.25 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 2wmy h GLU 51 CO 0.63 0.13 0.03 0.77 -1.00 0.00 0.00 179.01 179.56 2wmy h SER 52 N 0.20 0.43 0.02 1.42 0.02 -1.97 -0.04 113.55 113.63 2wmy h SER 52 Ca 0.27 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2wmy h SER 52 Cb 0.40 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2wmy h SER 52 CO -0.39 0.47 -0.01 0.00 -1.14 0.00 0.00 176.83 175.76 2wmy h ALA 53 N 1.59 -0.03 -0.96 3.77 0.00 -1.46 -1.77 119.26 120.40 2wmy h ALA 53 Ca 0.10 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.94 2wmy h ALA 53 Cb 0.25 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 2wmy h ALA 53 CO 0.00 -0.36 0.60 0.82 0.00 0.00 0.00 179.25 180.31 2wmy h ILE 54 N -0.33 1.02 -0.13 0.00 2.04 -0.81 -0.49 117.51 118.81 2wmy h ILE 54 Ca -0.00 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2wmy h ILE 54 Cb 0.32 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.26 2wmy h ILE 54 CO 0.00 0.19 0.08 -0.09 0.00 0.00 0.00 178.15 178.34 2wmy h ARG 55 N 1.05 0.17 -0.20 2.37 2.43 -0.77 0.26 114.38 119.69 2wmy h ARG 55 Ca 0.43 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.47 2wmy h ARG 55 Cb 0.27 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 2wmy h ARG 55 CO -0.20 0.12 -0.40 -0.24 -1.51 0.00 0.00 179.97 177.74 2wmy h VAL 56 N 0.17 1.30 0.88 0.20 3.04 -1.00 -1.01 116.25 119.83 2wmy h VAL 56 Ca 0.05 -1.55 -0.04 0.00 -1.01 0.00 0.00 66.70 64.14 2wmy h VAL 56 Cb -0.01 1.59 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 2wmy h VAL 56 CO -0.01 0.48 -0.48 0.00 -1.01 0.00 0.00 177.57 176.55 2wmy h ALA 57 N 1.18 -1.28 -0.99 3.17 0.00 -0.70 -2.67 119.26 117.97 2wmy h ALA 57 Ca 0.03 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.72 2wmy h ALA 57 Cb 0.87 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 19.16 2wmy h ALA 57 CO 0.07 -1.23 0.65 0.93 0.00 0.00 0.00 179.25 179.67 2wmy h GLU 58 N -1.25 1.20 -1.00 0.00 5.08 -0.38 0.90 114.58 119.12 2wmy h GLU 58 Ca -0.12 -0.07 0.18 0.00 -1.00 0.00 0.00 59.36 58.35 2wmy h GLU 58 Cb 0.98 -0.27 -0.10 0.00 0.50 0.00 0.00 28.75 29.86 2wmy h GLU 58 CO 0.16 0.79 0.61 0.87 -1.00 0.00 0.00 179.01 180.45 2wmy h LYS 59 N 1.23 0.74 -0.69 2.33 1.57 -1.13 0.26 116.57 120.89 2wmy h LYS 59 Ca 0.41 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 59.06 2wmy h LYS 59 Cb 0.05 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.14 2wmy h LYS 59 CO -0.14 0.49 0.10 0.09 -0.57 0.00 0.00 179.45 179.42 2wmy n ASN 60 N -4.73 4.98 -2.93 0.86 3.02 0.14 -4.92 115.26 111.67 2wmy n ASN 60 Ca 0.23 -2.93 -0.22 0.00 -0.03 0.00 0.00 54.58 51.62 2wmy n ASN 60 Cb 0.56 -0.69 0.03 0.00 -0.61 0.00 0.00 39.78 39.07 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 0.30 -0.52 3.50 7.41 0.00 0.08 -5.00 105.19 110.96 2wmy n GLY 61 Ca 0.30 0.11 -0.33 0.00 0.00 0.00 0.00 46.02 46.10 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 -6.59 2.86 -0.17 0.99 2.96 -0.22 -4.98 118.68 113.52 2wmy s LEU 62 Ca 0.26 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 53.96 2wmy s LEU 62 Cb -0.11 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 2wmy s LEU 62 CO 0.32 0.33 -0.01 0.00 -1.32 0.00 0.00 176.35 175.67 2wmy n LEU 64 N 3.74 3.01 -4.76 0.00 4.32 -1.26 -4.93 117.00 117.12 2wmy n LEU 64 Ca -0.17 -2.01 -0.37 0.00 -0.02 0.00 0.00 56.01 53.44 2wmy n LEU 64 Cb 0.52 -0.25 0.02 0.00 -1.62 0.00 0.00 43.42 42.09 2wmy n LEU 64 CO 0.33 0.75 0.90 -0.54 -1.22 0.00 0.00 177.39 177.61 2wmy s LYS 65 N -1.01 3.32 0.00 3.23 1.02 -1.26 -2.94 119.74 122.10 2wmy s LYS 65 Ca 0.25 1.99 0.00 0.00 0.02 0.00 0.00 55.97 58.23 2wmy s LYS 65 Cb 0.13 -2.24 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 2wmy s LYS 65 CO 0.17 -0.97 0.00 0.41 -0.92 0.00 0.00 175.35 174.04 2wmy n GLY 66 N 0.59 0.86 3.78 -3.33 0.00 -1.26 -5.04 105.19 100.78 2wmy n GLY 66 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.40 2.80 -0.07 1.61 5.04 -1.15 -5.06 115.29 115.05 2wmy s HIS 67 Ca 0.00 1.55 -0.03 0.00 -1.54 0.00 0.00 55.06 55.04 2wmy s HIS 67 Cb 0.00 -3.24 0.04 0.00 0.04 0.00 0.00 32.58 29.42 2wmy s HIS 67 CO 0.00 -1.35 0.15 0.50 -2.34 0.00 0.00 174.74 171.70 2wmy s ARG 68 N -3.17 0.05 0.07 2.88 3.52 -1.26 -4.51 118.95 116.52 2wmy s ARG 68 Ca 0.70 0.48 -0.34 0.00 -0.13 0.00 0.00 55.73 56.44 2wmy s ARG 68 Cb -0.23 -0.25 -0.13 0.00 -1.56 0.00 0.00 34.95 32.79 2wmy s ARG 68 CO 0.26 -0.26 1.70 0.41 -0.81 0.00 0.00 175.30 176.60 2wmy n GLY 69 N 4.91 1.27 3.04 8.12 0.00 0.34 -4.78 105.19 118.10 2wmy n GLY 69 Ca -0.13 0.73 -0.23 0.00 0.00 0.00 0.00 46.02 46.39 2wmy n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wmy s THR 70 N 2.14 1.05 0.03 2.61 2.01 -1.26 -1.05 115.64 121.17 2wmy s THR 70 Ca 0.84 -0.48 -0.30 0.00 0.31 0.00 0.00 61.69 62.06 2wmy s THR 70 Cb -0.67 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 2wmy s THR 70 CO 0.43 0.32 1.05 -0.75 -0.69 0.00 0.00 174.62 174.98 2wmy s LYS 71 N 0.34 4.53 -0.04 4.92 2.47 -1.26 -0.70 119.74 130.00 2wmy s LYS 71 Ca -0.07 1.54 -0.30 0.00 -1.56 0.00 0.00 55.97 55.58 2wmy s LYS 71 Cb -0.12 -3.41 -0.04 0.00 -1.46 0.00 0.00 37.83 32.80 2wmy s LYS 71 CO 0.02 -0.10 1.32 0.12 0.16 0.00 0.00 175.35 176.87 2wmy s PHE 72 N 0.92 2.96 0.32 4.03 5.36 0.02 -4.77 117.98 126.83 2wmy s PHE 72 Ca 0.54 0.97 0.04 0.00 -0.96 0.00 0.00 56.93 57.52 2wmy s PHE 72 Cb -0.24 -3.56 -0.06 0.00 -0.34 0.00 0.00 43.02 38.81 2wmy s PHE 72 CO 0.29 -1.97 0.04 0.95 -1.46 0.00 0.00 175.22 173.07 2wmy s THR 73 N 2.46 1.27 0.19 0.12 -4.23 -1.26 -4.89 115.64 109.29 2wmy s THR 73 Ca 0.60 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.06 2wmy s THR 73 Cb -0.28 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 2wmy s THR 73 CO 0.24 -0.03 1.52 0.77 -0.54 0.00 0.00 174.62 176.57 2wmy h SER 74 N 2.12 0.69 -0.93 3.99 4.64 -1.96 -2.45 113.55 119.65 2wmy h SER 74 Ca -0.41 -0.34 0.01 0.00 -0.47 0.00 0.00 61.79 60.58 2wmy h SER 74 Cb 1.24 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 63.09 2wmy h SER 74 CO 0.70 1.06 0.61 0.00 -0.87 0.00 0.00 176.83 178.33 2wmy h ALA 75 N 0.96 1.18 -0.46 5.18 0.00 -1.96 -2.57 119.26 121.59 2wmy h ALA 75 Ca 0.02 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2wmy h ALA 75 Cb 1.03 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2wmy h ALA 75 CO 0.10 0.56 -0.23 1.25 0.00 0.00 0.00 179.25 180.92 2wmy h LEU 76 N 1.24 1.00 -1.80 0.00 5.85 -1.93 -3.16 115.31 116.51 2wmy h LEU 76 Ca 0.34 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 2wmy h LEU 76 Cb -0.12 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.63 2wmy h LEU 76 CO -0.08 1.18 -0.11 0.00 -0.34 0.00 0.00 178.44 179.09 2wmy h ALA 77 N 0.85 1.78 0.00 1.25 0.00 -1.05 -2.36 119.26 119.73 2wmy h ALA 77 Ca 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wmy h ALA 77 Cb 0.81 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2wmy h ALA 77 CO 0.07 0.14 -0.03 0.00 0.00 0.00 0.00 179.25 179.42 2wmy h ARG 78 N 0.00 0.00 -0.62 0.00 3.08 -1.44 -2.45 114.38 112.95 2wmy h ARG 78 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2wmy h ARG 78 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2wmy h ARG 78 CO 0.01 0.03 0.00 0.00 -1.07 0.00 0.00 179.97 178.95 2wmy n GLN 79 N -3.38 3.02 -4.52 0.04 10.64 -0.89 -4.87 117.38 117.43 2wmy n GLN 79 Ca -0.02 -2.11 -0.21 0.00 -1.83 0.00 0.00 57.00 52.83 2wmy n GLN 79 Cb 0.16 -1.73 -0.15 0.00 -0.86 0.00 0.00 30.24 27.66 2wmy n GLN 79 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2wmy s TYR 80 N -1.76 1.13 0.09 2.61 2.02 -0.92 -4.94 117.35 115.57 2wmy s TYR 80 Ca 0.38 -0.24 0.08 0.00 -0.37 0.00 0.00 57.07 56.92 2wmy s TYR 80 Cb 0.24 -0.71 -0.22 0.00 -0.40 0.00 0.00 41.96 40.87 2wmy s TYR 80 CO 0.18 -0.01 1.15 -0.44 -1.57 0.00 0.00 175.55 174.87 2wmy h ASP 81 N 5.67 0.01 -3.64 2.29 3.32 -1.72 -3.46 116.42 118.89 2wmy h ASP 81 Ca -0.34 -0.01 -0.39 0.00 0.02 0.00 0.00 57.03 56.31 2wmy h ASP 81 Cb 1.17 -0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.40 2wmy h ASP 81 CO 0.48 1.01 -0.77 -0.22 -1.72 0.00 0.00 179.24 178.02 2wmy s LEU 82 N -6.60 1.57 -0.13 1.55 2.96 -0.70 -4.88 118.68 112.45 2wmy s LEU 82 Ca -0.00 -0.13 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 2wmy s LEU 82 Cb 0.10 -0.42 -0.03 0.00 0.50 0.00 0.00 46.19 46.34 2wmy s LEU 82 CO 0.82 -0.00 -0.06 -0.76 -1.32 0.00 0.00 176.35 175.03 2wmy s LEU 83 N 0.53 3.12 -0.22 -0.68 1.02 -0.50 -0.66 118.68 121.29 2wmy s LEU 83 Ca -0.07 -0.15 0.01 0.00 0.02 0.00 0.00 54.13 53.94 2wmy s LEU 83 Cb -0.11 -1.73 0.05 0.00 0.02 0.00 0.00 46.19 44.42 2wmy s LEU 83 CO 0.00 0.21 -0.11 -0.76 0.02 0.00 0.00 176.35 175.70 2wmy s LEU 84 N 0.14 2.61 0.18 1.79 1.43 -0.53 -0.41 118.68 123.88 2wmy s LEU 84 Ca -0.03 -1.03 0.04 0.00 -1.03 0.00 0.00 54.13 52.09 2wmy s LEU 84 Cb -0.14 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 2wmy s LEU 84 CO 0.03 -0.15 0.22 0.68 0.23 0.00 0.00 176.35 177.36 2wmy s VAL 85 N 1.30 4.84 0.05 -1.59 -7.23 -0.24 -0.26 120.40 117.28 2wmy s VAL 85 Ca -0.03 -0.99 -0.13 0.00 -1.81 0.00 0.00 61.98 59.02 2wmy s VAL 85 Cb -0.17 -3.52 -0.31 0.00 0.56 0.00 0.00 36.38 32.94 2wmy s VAL 85 CO -0.08 -0.16 1.08 0.24 -0.31 0.00 0.00 175.10 175.87 2wmy h MET 86 N 2.05 0.54 -6.33 4.82 0.00 -1.70 0.57 114.93 114.89 2wmy h MET 86 Ca -0.49 -0.81 -0.59 0.00 0.00 0.00 0.00 59.70 57.82 2wmy h MET 86 Cb 1.21 0.28 -0.20 0.00 0.00 0.00 0.00 31.60 32.89 2wmy h MET 86 CO 0.64 1.37 -0.82 -1.21 0.00 0.00 0.00 176.91 176.89 2wmy s GLU 87 N -2.81 1.27 0.22 1.72 2.02 -1.26 -1.69 118.70 118.17 2wmy s GLU 87 Ca -0.08 -1.31 -0.07 0.00 0.02 0.00 0.00 54.97 53.53 2wmy s GLU 87 Cb 0.05 -1.54 0.32 0.00 0.10 0.00 0.00 34.13 33.06 2wmy s GLU 87 CO 0.93 0.35 1.79 1.88 0.02 0.00 0.00 175.26 180.23 2wmy h TYR 88 N 3.72 0.69 -0.02 1.61 0.05 -1.96 -0.80 116.97 120.26 2wmy h TYR 88 Ca -0.46 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.35 2wmy h TYR 88 Cb 1.19 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 38.73 2wmy h TYR 88 CO 0.64 0.28 0.03 0.66 -1.05 0.00 0.00 178.16 178.72 2wmy h SER 89 N 0.66 0.00 -0.17 3.88 4.64 -2.01 -0.68 113.55 119.86 2wmy h SER 89 Ca 0.34 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.60 2wmy h SER 89 Cb 0.32 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 2wmy h SER 89 CO -0.24 0.00 -0.09 0.45 -0.87 0.00 0.00 176.83 176.08 2wmy h HIS 90 N 0.00 0.56 -0.22 4.77 3.86 -1.55 -3.05 115.15 119.51 2wmy h HIS 90 Ca 0.01 -0.08 0.06 0.00 -1.16 0.00 0.00 60.37 59.20 2wmy h HIS 90 Cb 0.08 -0.15 -0.07 0.00 1.06 0.00 0.00 27.41 28.32 2wmy h HIS 90 CO 0.00 0.61 -0.26 -0.07 0.86 0.00 0.00 177.93 179.06 2wmy h LEU 91 N 0.49 -0.84 -0.44 2.43 3.38 -1.16 -0.39 115.31 118.78 2wmy h LEU 91 Ca 0.09 0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.29 2wmy h LEU 91 Cb 0.46 0.39 -0.07 0.00 0.09 0.00 0.00 40.66 41.52 2wmy h LEU 91 CO 0.02 -0.30 0.01 -0.33 0.09 0.00 0.00 178.44 177.93 2wmy h GLU 92 N -0.28 0.11 0.00 1.13 3.07 -1.64 0.14 114.58 117.11 2wmy h GLU 92 Ca 0.13 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 2wmy h GLU 92 Cb 0.48 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.37 2wmy h GLU 92 CO -0.39 0.08 -0.05 1.96 -1.40 0.00 0.00 179.01 179.21 2wmy h GLN 93 N 0.12 0.00 0.58 2.33 4.20 -1.28 0.11 115.11 121.17 2wmy h GLN 93 Ca 0.22 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.90 2wmy h GLN 93 Cb 0.32 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.11 2wmy h GLN 93 CO -0.36 0.05 -0.28 0.82 -0.67 0.00 0.00 178.83 178.39 2wmy h ILE 94 N 0.00 0.00 -0.31 2.54 1.08 0.64 -0.17 117.51 121.30 2wmy h ILE 94 Ca -0.00 -0.25 0.09 0.00 -0.39 0.00 0.00 64.86 64.31 2wmy h ILE 94 Cb 0.10 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.83 2wmy h ILE 94 CO 0.01 0.00 0.29 0.77 -0.69 0.00 0.00 178.15 178.52 2wmy h SER 95 N -1.02 0.00 -0.00 1.72 4.64 -0.78 1.63 113.55 119.74 2wmy h SER 95 Ca -0.08 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.06 2wmy h SER 95 Cb 0.59 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.70 2wmy h SER 95 CO 0.13 0.00 -0.69 0.03 -0.87 0.00 0.00 176.83 175.43 2wmy h ARG 96 N 0.00 0.47 0.10 4.77 3.08 -0.77 -2.89 114.38 119.15 2wmy h ARG 96 Ca 0.15 -0.50 -0.32 0.00 0.07 0.00 0.00 59.98 59.37 2wmy h ARG 96 Cb 0.72 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 2wmy h ARG 96 CO -0.00 1.15 -1.69 0.82 -1.07 0.00 0.00 179.97 179.18 2wmy h ILE 97 N -0.00 0.95 -1.75 2.04 2.04 0.53 -3.42 117.51 117.90 2wmy h ILE 97 Ca -0.09 -2.65 -0.51 0.00 1.00 0.00 0.00 64.86 62.61 2wmy h ILE 97 Cb 1.39 2.64 -0.36 0.00 -0.74 0.00 0.00 36.82 39.75 2wmy h ILE 97 CO 0.14 0.78 -1.04 0.00 0.00 0.00 0.00 178.15 178.03 2wmy n ALA 98 N -2.74 1.93 -0.31 1.87 0.00 0.54 -4.37 120.51 117.44 2wmy n ALA 98 Ca -0.21 -3.15 0.15 0.00 0.00 0.00 0.00 53.44 50.23 2wmy n ALA 98 Cb 1.05 -0.88 0.33 0.00 0.00 0.00 0.00 19.45 19.95 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 3.95 0.29 0.00 0.00 0.11 -1.53 0.48 132.00 135.30 2wmy h PRO 99 Ca 0.04 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2wmy h PRO 99 Cb 0.90 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.95 2wmy h PRO 99 CO 0.44 0.19 0.00 -0.85 -0.21 0.00 0.00 178.00 177.58 2wmy n GLU 100 N -5.13 0.09 0.00 1.05 0.00 -1.26 -2.14 120.64 113.26 2wmy n GLU 100 Ca 0.24 0.35 0.11 0.00 0.00 0.00 0.00 57.16 57.85 2wmy n GLU 100 Cb 0.73 -1.68 -0.03 0.00 0.00 0.00 0.00 31.44 30.46 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 -1.63 4.09 -0.34 -1.84 0.00 0.16 -4.40 120.51 116.56 2wmy n ALA 101 Ca 0.03 -0.51 0.11 0.00 0.00 0.00 0.00 53.44 53.07 2wmy n ALA 101 Cb 0.19 -0.87 0.32 0.00 0.00 0.00 0.00 19.45 19.08 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 0.78 0.00 0.00 9.65 -1.42 -1.35 114.38 122.04 2wmy h ARG 102 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2wmy h ARG 102 Cb 0.59 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 2wmy h ARG 102 CO 0.00 0.52 0.00 0.41 2.80 0.00 0.00 179.97 183.70 2wmy n GLY 103 N -1.37 -1.14 0.54 2.80 0.00 -1.26 -2.20 105.19 102.56 2wmy n GLY 103 Ca 0.21 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.33 2wmy n GLY 103 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wmy n LYS 104 N -1.87 2.07 -4.25 1.61 2.85 -0.52 -5.01 118.16 113.05 2wmy n LYS 104 Ca 0.03 -2.77 -0.35 0.00 -1.05 0.00 0.00 58.31 54.17 2wmy n LYS 104 Cb 0.20 -1.69 -0.10 0.00 -0.65 0.00 0.00 35.03 32.80 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 -2.90 4.44 0.18 0.58 2.01 -0.93 -1.41 115.64 117.60 2wmy s THR 105 Ca 0.38 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.19 2wmy s THR 105 Cb 0.32 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.87 2wmy s THR 105 CO 0.05 0.55 0.10 -0.04 -0.69 0.00 0.00 174.62 174.59 2wmy s MET 106 N -0.36 1.10 0.18 4.92 -1.94 0.46 -4.97 119.30 118.68 2wmy s MET 106 Ca 0.08 -1.56 -0.30 0.00 -1.71 0.00 0.00 55.69 52.19 2wmy s MET 106 Cb -0.12 0.26 -0.08 0.00 2.01 0.00 0.00 34.83 36.90 2wmy s MET 106 CO 0.02 -0.34 1.14 -0.51 -0.01 0.00 0.00 175.02 175.31 2wmy s LEU 107 N -3.12 4.47 0.30 -0.03 1.43 -1.26 -1.08 118.68 119.39 2wmy s LEU 107 Ca 0.34 2.14 0.02 0.00 -1.03 0.00 0.00 54.13 55.60 2wmy s LEU 107 Cb 0.07 -3.60 0.58 0.00 0.03 0.00 0.00 46.19 43.26 2wmy s LEU 107 CO 0.08 -0.28 1.87 0.15 0.23 0.00 0.00 176.35 178.40 2wmy h PHE 108 N 5.18 1.07 -0.81 0.29 3.57 -0.09 -1.47 116.94 124.68 2wmy h PHE 108 Ca -0.44 0.03 -0.47 0.00 3.53 0.00 0.00 57.97 60.61 2wmy h PHE 108 Cb 1.21 -0.34 -0.24 0.00 2.79 0.00 0.00 35.95 39.37 2wmy h PHE 108 CO 0.62 0.47 0.61 0.41 -2.23 0.00 0.00 178.31 178.19 2wmy n GLY 109 N -1.38 4.52 0.38 2.40 0.00 -1.19 -4.66 105.19 105.26 2wmy n GLY 109 Ca 0.17 -1.29 -0.00 0.00 0.00 0.00 0.00 46.02 44.89 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 1.22 1.24 -0.00 1.61 6.17 -1.46 -2.25 115.15 121.68 2wmy h HIS 110 Ca 0.51 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.62 2wmy h HIS 110 Cb 1.82 -0.41 0.00 0.00 2.52 0.00 0.00 27.41 31.33 2wmy h HIS 110 CO 1.25 0.74 -0.02 0.91 0.71 0.00 0.00 177.93 181.52 2wmy n TRP 111 N -4.42 0.00 -2.41 5.26 7.02 -1.26 -4.84 117.44 116.79 2wmy n TRP 111 Ca 0.13 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.33 2wmy n TRP 111 Cb 0.07 -0.06 0.01 0.00 -2.42 0.00 0.00 31.31 28.90 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 -2.13 3.47 0.13 -0.99 1.43 -0.85 -5.00 118.68 114.75 2wmy s LEU 112 Ca 0.41 1.03 -0.19 0.00 -1.03 0.00 0.00 54.13 54.36 2wmy s LEU 112 Cb 0.21 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.40 2wmy s LEU 112 CO 0.39 -0.72 1.78 0.44 0.23 0.00 0.00 176.35 178.47 2wmy h ASP 113 N 0.03 0.30 -3.58 2.29 3.32 -1.88 -3.37 116.42 113.53 2wmy h ASP 113 Ca -0.46 -0.02 -0.66 0.00 0.02 0.00 0.00 57.03 55.91 2wmy h ASP 113 Cb 1.21 -0.07 -0.25 0.00 0.22 0.00 0.00 39.33 40.43 2wmy h ASP 113 CO 0.62 0.23 -0.64 -0.55 -1.72 0.00 0.00 179.24 177.18 2wmy s SER 114 N -5.44 4.99 0.09 6.45 0.15 -1.26 -5.02 113.70 113.66 2wmy s SER 114 Ca -0.13 -0.45 -0.08 0.00 0.70 0.00 0.00 55.95 55.99 2wmy s SER 114 Cb 0.09 -1.87 -0.20 0.00 -1.71 0.00 0.00 66.02 62.32 2wmy s SER 114 CO 0.70 -0.10 1.20 0.11 1.20 0.00 0.00 173.24 176.36 2wmy h LYS 115 N 8.22 0.45 -6.78 5.44 1.57 -1.74 -3.45 116.57 120.28 2wmy h LYS 115 Ca -0.36 -0.58 -0.52 0.00 -1.87 0.00 0.00 60.65 57.32 2wmy h LYS 115 Cb 1.15 0.19 0.06 0.00 0.08 0.00 0.00 32.23 33.71 2wmy h LYS 115 CO 0.59 1.22 0.71 -1.21 -0.57 0.00 0.00 179.45 180.20 2wmy s GLU 116 N -3.04 4.31 -0.39 3.15 2.02 -1.26 -3.19 118.70 120.30 2wmy s GLU 116 Ca -0.07 2.25 -0.17 0.00 0.02 0.00 0.00 54.97 57.01 2wmy s GLU 116 Cb 0.07 -3.10 0.01 0.00 0.10 0.00 0.00 34.13 31.21 2wmy s GLU 116 CO 0.89 -0.33 0.41 0.42 0.02 0.00 0.00 175.26 176.68 2wmy s ILE 117 N -0.38 5.11 0.80 -1.63 -1.09 -0.68 -4.98 121.20 118.35 2wmy s ILE 117 Ca 0.55 -0.15 -0.12 0.00 -2.23 0.00 0.00 60.65 58.71 2wmy s ILE 117 Cb -0.41 -3.95 0.08 0.00 -1.58 0.00 0.00 42.46 36.60 2wmy s ILE 117 CO 0.46 -0.28 1.14 -2.84 -1.23 0.00 0.00 174.94 172.19 2wmy s PRO 118 N 2.11 1.86 -0.27 2.79 0.02 -1.26 -4.69 135.00 135.56 2wmy s PRO 118 Ca 0.12 1.45 -0.29 0.00 0.02 0.00 0.00 61.00 62.31 2wmy s PRO 118 Cb -0.17 -1.83 0.01 0.00 0.02 0.00 0.00 34.50 32.53 2wmy s PRO 118 CO 0.13 -1.98 1.10 0.34 -0.33 0.00 0.00 177.00 176.26 2wmy s ASP 119 N -2.76 6.97 0.04 2.53 -1.08 -1.26 -4.93 116.67 116.18 2wmy s ASP 119 Ca 0.67 1.25 0.23 0.00 -0.52 0.00 0.00 52.55 54.17 2wmy s ASP 119 Cb -0.22 -2.54 0.15 0.00 -1.46 0.00 0.00 42.92 38.85 2wmy s ASP 119 CO 0.53 -0.81 1.13 -0.81 0.52 0.00 0.00 175.17 175.72 2wmy n PRO 120 N 6.69 0.19 -1.62 4.34 -0.04 -1.26 -4.94 135.00 138.36 2wmy n PRO 120 Ca 0.12 0.01 -0.53 0.00 -0.04 0.00 0.00 63.50 63.06 2wmy n PRO 120 Cb 0.46 -1.57 -0.06 0.00 -0.04 0.00 0.00 33.50 32.29 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 -1.81 1.66 -0.56 0.54 9.36 -1.26 -0.37 117.16 124.72 2wmy n TYR 121 Ca 0.03 0.60 0.00 0.00 3.32 0.00 0.00 57.90 61.85 2wmy n TYR 121 Cb 0.40 -2.37 0.00 0.00 -0.63 0.00 0.00 39.34 36.74 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 3.22 0.00 -2.35 2.98 1.74 -1.26 -5.00 116.66 115.99 2wmy n ARG 122 Ca 0.20 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 57.03 2wmy n ARG 122 Cb 0.18 -2.47 0.12 0.00 -1.02 0.00 0.00 32.46 29.27 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 -0.10 1.52 0.91 5.56 -1.94 0.50 -5.07 119.30 120.68 2wmy s MET 123 Ca 0.00 -0.78 -0.12 0.00 -1.71 0.00 0.00 55.69 53.09 2wmy s MET 123 Cb 0.00 -2.18 0.14 0.00 2.01 0.00 0.00 34.83 34.79 2wmy s MET 123 CO 0.00 -1.64 1.09 -1.54 -0.01 0.00 0.00 175.02 172.92 2wmy s SER 124 N -4.73 3.35 0.29 3.03 1.04 -1.26 -4.84 113.70 110.58 2wmy s SER 124 Ca 0.67 1.48 -0.02 0.00 0.48 0.00 0.00 55.95 58.56 2wmy s SER 124 Cb -0.06 -2.16 0.42 0.00 0.10 0.00 0.00 66.02 64.32 2wmy s SER 124 CO 0.46 -2.72 1.91 0.44 0.98 0.00 0.00 173.24 174.32 2wmy h ASP 125 N -1.60 0.90 -0.25 7.02 3.32 -1.97 -1.58 116.42 122.25 2wmy h ASP 125 Ca -0.50 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 56.48 2wmy h ASP 125 Cb 1.29 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 2wmy h ASP 125 CO 0.54 0.73 0.17 -0.33 -1.72 0.00 0.00 179.24 178.63 2wmy h GLU 126 N 1.01 0.31 -0.04 3.56 3.07 -1.99 0.27 114.58 120.77 2wmy h GLU 126 Ca 0.26 -0.02 -0.23 0.00 -0.50 0.00 0.00 59.36 58.87 2wmy h GLU 126 Cb 0.03 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 27.88 2wmy h GLU 126 CO -0.04 0.21 -0.91 0.00 -1.40 0.00 0.00 179.01 176.86 2wmy h ALA 127 N 1.85 0.33 -0.64 3.43 0.00 -1.68 -2.41 119.26 120.14 2wmy h ALA 127 Ca 0.09 -0.67 -0.07 0.00 0.00 0.00 0.00 54.91 54.26 2wmy h ALA 127 Cb -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2wmy h ALA 127 CO -0.02 0.75 0.12 0.74 0.00 0.00 0.00 179.25 180.84 2wmy h PHE 128 N 0.33 1.07 -0.43 0.00 0.04 -0.37 -1.39 116.94 116.19 2wmy h PHE 128 Ca -0.08 -0.13 0.01 0.00 2.80 0.00 0.00 57.97 60.57 2wmy h PHE 128 Cb 1.54 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 39.37 2wmy h PHE 128 CO 0.07 0.90 0.27 -0.44 -0.60 0.00 0.00 178.31 178.51 2wmy h ASP 129 N 0.97 0.46 -0.36 2.17 3.32 -0.45 0.16 116.42 122.69 2wmy h ASP 129 Ca 0.20 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 2wmy h ASP 129 Cb 0.39 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2wmy h ASP 129 CO 0.01 0.33 0.16 -1.28 -1.72 0.00 0.00 179.24 176.74 2wmy h SER 130 N 0.55 0.48 -0.46 6.45 0.87 -1.29 -1.96 113.55 118.20 2wmy h SER 130 Ca 0.16 -0.15 -0.10 0.00 -1.23 0.00 0.00 61.79 60.47 2wmy h SER 130 Cb -0.04 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 2wmy h SER 130 CO -0.05 0.49 -0.12 0.58 -0.53 0.00 0.00 176.83 177.21 2wmy h VAL 131 N 0.44 1.27 -0.01 2.23 2.07 -1.02 -2.73 116.25 118.50 2wmy h VAL 131 Ca 0.12 -1.24 0.03 0.00 0.82 0.00 0.00 66.70 66.43 2wmy h VAL 131 Cb 0.15 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 2wmy h VAL 131 CO -0.01 0.42 -0.18 0.22 0.02 0.00 0.00 177.57 178.04 2wmy h TYR 132 N 0.72 -0.47 -0.88 1.57 3.20 -0.56 -1.01 116.97 119.55 2wmy h TYR 132 Ca 0.11 0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.19 2wmy h TYR 132 Cb 0.66 0.21 -0.11 0.00 1.54 0.00 0.00 36.73 39.03 2wmy h TYR 132 CO 0.05 -0.26 0.43 1.96 -1.64 0.00 0.00 178.16 178.70 2wmy h GLN 133 N -0.29 0.51 -0.39 1.82 4.20 -1.28 0.13 115.11 119.80 2wmy h GLN 133 Ca 0.06 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 2wmy h GLN 133 Cb 0.36 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 2wmy h GLN 133 CO -0.17 0.34 0.07 -0.07 -0.67 0.00 0.00 178.83 178.32 2wmy h LEU 134 N 0.52 0.62 -1.60 1.46 3.38 -1.11 -0.66 115.31 117.93 2wmy h LEU 134 Ca 0.52 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2wmy h LEU 134 Cb 0.87 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 2wmy h LEU 134 CO -0.44 0.72 0.13 -0.07 0.09 0.00 0.00 178.44 178.87 2wmy h LEU 135 N 0.50 0.35 -0.03 1.67 3.38 0.06 -0.89 115.31 120.35 2wmy h LEU 135 Ca 0.12 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2wmy h LEU 135 Cb 0.36 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2wmy h LEU 135 CO 0.01 0.31 -0.09 -0.08 0.09 0.00 0.00 178.44 178.68 2wmy h GLU 136 N 0.40 0.12 -0.13 1.13 4.81 -0.35 -1.24 114.58 119.31 2wmy h GLU 136 Ca 0.10 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2wmy h GLU 136 Cb 0.06 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2wmy h GLU 136 CO -0.01 0.70 -0.04 1.96 -0.73 0.00 0.00 179.01 180.88 2wmy h GLN 137 N -0.44 -0.01 -0.51 1.92 4.20 -0.87 -2.11 115.11 117.27 2wmy h GLN 137 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2wmy h GLN 137 Cb 0.70 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 2wmy h GLN 137 CO 0.02 -0.01 0.21 0.00 -0.67 0.00 0.00 178.83 178.38 2wmy h ALA 138 N 1.11 0.66 -0.41 3.87 0.00 -1.20 -2.34 119.26 120.96 2wmy h ALA 138 Ca 0.07 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2wmy h ALA 138 Cb 0.11 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 2wmy h ALA 138 CO -0.14 0.27 0.20 0.66 0.00 0.00 0.00 179.25 180.23 2wmy h SER 139 N 0.68 0.28 -0.61 0.00 4.64 -1.05 0.19 113.55 117.69 2wmy h SER 139 Ca 0.17 0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.54 2wmy h SER 139 Cb 0.19 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.22 2wmy h SER 139 CO -0.01 0.20 0.38 0.11 -0.87 0.00 0.00 176.83 176.64 2wmy h LYS 140 N 0.40 0.73 -0.30 4.77 1.57 -1.19 0.62 116.57 123.18 2wmy h LYS 140 Ca 0.18 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 2wmy h LYS 140 Cb 0.10 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2wmy h LYS 140 CO -0.13 0.49 0.05 0.00 -0.57 0.00 0.00 179.45 179.29 2wmy h ARG 141 N 0.76 0.50 -0.92 3.15 3.08 -1.03 -0.87 114.38 119.06 2wmy h ARG 141 Ca 0.24 -0.13 0.05 0.00 0.07 0.00 0.00 59.98 60.21 2wmy h ARG 141 Cb -0.00 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 2wmy h ARG 141 CO -0.09 0.59 0.59 -1.49 -1.07 0.00 0.00 179.97 178.50 2wmy h TRP 142 N 0.33 1.09 -0.61 3.04 4.06 -0.62 -1.00 115.95 122.25 2wmy h TRP 142 Ca 0.09 0.03 -0.04 0.00 2.06 0.00 0.00 58.89 61.04 2wmy h TRP 142 Cb 0.33 -0.36 -0.03 0.00 -1.00 0.00 0.00 29.16 28.11 2wmy h TRP 142 CO 0.02 0.59 0.24 0.00 -3.56 0.00 0.00 178.44 175.73 2wmy h ALA 143 N 1.40 0.79 -0.41 1.49 0.00 -0.56 -0.54 119.26 121.43 2wmy h ALA 143 Ca 0.38 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2wmy h ALA 143 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2wmy h ALA 143 CO -0.15 0.40 0.09 1.49 0.00 0.00 0.00 179.25 181.09 2wmy h GLU 144 N 0.84 0.61 -0.07 0.00 4.81 -0.59 -2.90 114.58 117.29 2wmy h GLU 144 Ca 0.20 -0.11 -0.21 0.00 -0.13 0.00 0.00 59.36 59.11 2wmy h GLU 144 Cb 0.20 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2wmy h GLU 144 CO -0.02 0.57 -0.82 -0.22 -0.73 0.00 0.00 179.01 177.79 2wmy h LYS 145 N 0.60 0.51 -0.02 1.92 1.63 -0.66 -3.51 116.57 117.03 2wmy h LYS 145 Ca 0.14 -0.46 0.00 0.00 -0.85 0.00 0.00 60.65 59.48 2wmy h LYS 145 Cb 0.24 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.98 2wmy h LYS 145 CO -0.00 1.09 0.00 1.28 -3.45 0.00 0.00 179.45 178.37