#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4l s PRO 5 N 0.00 1.40 0.21 -2.82 0.04 -1.26 -4.97 135.00 127.61 1a4l s PRO 5 Ca 0.00 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.28 1a4l s PRO 5 Cb 0.00 -1.79 0.18 0.00 0.04 0.00 0.00 34.50 32.93 1a4l s PRO 5 CO 0.00 -2.26 1.53 0.00 0.04 0.00 0.00 177.00 176.31 1a4l h ALA 6 N -1.58 0.77 -2.02 8.56 0.00 -1.93 -3.40 119.26 119.66 1a4l h ALA 6 Ca -0.46 -0.52 -0.38 0.00 0.00 0.00 0.00 54.91 53.55 1a4l h ALA 6 Cb 1.26 -0.08 -0.32 0.00 0.00 0.00 0.00 17.79 18.65 1a4l h ALA 6 CO 0.48 0.70 -0.70 0.12 0.00 0.00 0.00 179.25 179.85 1a4l s PHE 7 N -3.91 -0.21 -0.83 0.00 5.36 -1.26 -4.94 117.98 112.19 1a4l s PHE 7 Ca -0.06 -0.85 -0.07 0.00 -0.96 0.00 0.00 56.93 54.99 1a4l s PHE 7 Cb 0.12 -0.46 -0.08 0.00 -0.34 0.00 0.00 43.02 42.26 1a4l s PHE 7 CO 0.82 -0.95 3.03 -1.71 -1.46 0.00 0.00 175.22 174.95 1a4l n ASN 8 N 4.30 7.07 -3.94 6.13 2.85 -1.26 -4.85 115.26 125.56 1a4l n ASN 8 Ca 0.10 -2.77 -0.09 0.00 -0.11 0.00 0.00 54.58 51.71 1a4l n ASN 8 Cb 0.44 -1.41 -0.09 0.00 1.24 0.00 0.00 39.78 39.96 1a4l n ASN 8 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1a4l s LYS 9 N 0.42 0.64 0.25 1.20 1.02 -1.26 -5.14 119.74 116.87 1a4l s LYS 9 Ca 0.64 -0.85 -0.19 0.00 0.02 0.00 0.00 55.97 55.59 1a4l s LYS 9 Cb 0.26 0.25 -0.13 0.00 -0.52 0.00 0.00 37.83 37.70 1a4l s LYS 9 CO -0.08 -0.16 0.21 -2.30 -0.92 0.00 0.00 175.35 172.09 1a4l n PRO 10 N 0.53 0.00 -4.16 -1.68 -0.02 -1.26 -4.92 135.00 123.49 1a4l n PRO 10 Ca -0.18 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.20 1a4l n PRO 10 Cb 0.60 -0.79 -0.10 0.00 -0.02 0.00 0.00 33.50 33.18 1a4l n PRO 10 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1a4l s LYS 11 N -0.79 0.91 -0.06 -0.52 1.02 -0.53 -4.95 119.74 114.83 1a4l s LYS 11 Ca 0.48 -1.43 0.03 0.00 0.02 0.00 0.00 55.97 55.07 1a4l s LYS 11 Cb -0.60 0.15 0.01 0.00 -0.52 0.00 0.00 37.83 36.87 1a4l s LYS 11 CO 0.47 -0.22 -0.12 0.08 -0.92 0.00 0.00 175.35 174.65 1a4l s VAL 12 N -3.96 1.11 -0.08 3.17 1.01 -1.26 -1.32 120.40 119.07 1a4l s VAL 12 Ca 0.22 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1a4l s VAL 12 Cb 0.07 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.47 1a4l s VAL 12 CO 0.00 0.34 -0.11 -0.70 0.00 0.00 0.00 175.10 174.64 1a4l s GLU 13 N 0.52 1.68 -0.09 2.72 2.12 -0.69 -4.77 118.70 120.18 1a4l s GLU 13 Ca -0.11 -0.38 0.09 0.00 0.36 0.00 0.00 54.97 54.93 1a4l s GLU 13 Cb -0.14 -1.49 -0.12 0.00 0.26 0.00 0.00 34.13 32.64 1a4l s GLU 13 CO 0.03 -0.06 0.04 1.28 -0.54 0.00 0.00 175.26 176.01 1a4l n LEU 14 N 4.16 0.00 -4.09 2.70 4.32 -1.26 -1.08 117.00 121.75 1a4l n LEU 14 Ca -0.20 0.00 -0.36 0.00 -0.02 0.00 0.00 56.01 55.44 1a4l n LEU 14 Cb 0.51 0.23 -0.08 0.00 -1.62 0.00 0.00 43.42 42.46 1a4l n LEU 14 CO 0.23 0.23 0.19 -2.28 -1.22 0.00 0.00 177.39 174.54 1a4l s HIS 15 N -2.26 3.66 -0.09 -1.77 2.46 -1.26 -4.49 115.29 111.54 1a4l s HIS 15 Ca -0.05 -2.93 -0.09 0.00 0.47 0.00 0.00 55.06 52.47 1a4l s HIS 15 Cb 0.03 -3.18 0.02 0.00 -0.13 0.00 0.00 32.58 29.32 1a4l s HIS 15 CO 0.40 -0.76 0.24 0.54 -2.47 0.00 0.00 174.74 172.69 1a4l s VAL 16 N -0.83 0.00 -0.25 0.89 0.11 -1.26 -1.98 120.40 117.08 1a4l s VAL 16 Ca 0.23 -0.03 -0.11 0.00 -2.93 0.00 0.00 61.98 59.14 1a4l s VAL 16 Cb -0.12 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 1a4l s VAL 16 CO -0.09 -0.02 0.18 -1.00 -3.33 0.00 0.00 175.10 170.84 1a4l s HIS 17 N 0.06 3.29 0.09 1.54 3.76 0.41 -0.75 115.29 123.69 1a4l s HIS 17 Ca -0.01 0.21 -0.32 0.00 -0.15 0.00 0.00 55.06 54.79 1a4l s HIS 17 Cb -0.02 -2.31 -0.15 0.00 1.11 0.00 0.00 32.58 31.21 1a4l s HIS 17 CO 0.00 0.00 1.61 1.25 -0.85 0.00 0.00 174.74 176.75 1a4l h LEU 18 N 7.75 -0.99 -0.54 0.89 5.85 -1.21 0.83 115.31 127.89 1a4l h LEU 18 Ca -0.37 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1a4l h LEU 18 Cb 1.17 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.53 1a4l h LEU 18 CO 0.63 -0.54 0.00 -0.90 -0.34 0.00 0.00 178.44 177.29 1a4l n ASP 19 N -5.49 0.27 -0.97 1.25 5.75 -1.26 -1.00 116.55 115.10 1a4l n ASP 19 Ca -0.11 0.60 0.08 0.00 -0.01 0.00 0.00 54.79 55.35 1a4l n ASP 19 Cb 0.38 -0.65 0.24 0.00 -1.03 0.00 0.00 41.12 40.06 1a4l n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1a4l n GLY 20 N -0.92 3.04 2.57 6.12 0.00 0.13 -4.54 105.19 111.59 1a4l n GLY 20 Ca 0.01 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 1a4l n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l n ALA 21 N 0.50 3.02 -2.84 4.61 0.00 -0.18 -1.84 120.51 123.79 1a4l n ALA 21 Ca 0.18 -3.11 -0.29 0.00 0.00 0.00 0.00 53.44 50.23 1a4l n ALA 21 Cb 0.65 -0.94 -0.05 0.00 0.00 0.00 0.00 19.45 19.11 1a4l n ALA 21 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a4l s ILE 22 N -2.84 4.84 0.22 0.00 1.01 -1.24 -4.80 121.20 118.39 1a4l s ILE 22 Ca 0.29 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 59.91 1a4l s ILE 22 Cb 0.43 -3.40 -0.09 0.00 0.01 0.00 0.00 42.46 39.42 1a4l s ILE 22 CO 0.01 0.04 0.91 -0.54 0.00 0.00 0.00 174.94 175.36 1a4l s LYS 23 N -2.72 4.80 0.29 2.79 1.02 -1.26 -4.75 119.74 119.91 1a4l s LYS 23 Ca 0.32 1.43 0.01 0.00 0.02 0.00 0.00 55.97 57.74 1a4l s LYS 23 Cb -0.12 -3.28 0.52 0.00 -0.52 0.00 0.00 37.83 34.44 1a4l s LYS 23 CO 0.25 0.52 1.87 -1.35 -0.92 0.00 0.00 175.35 175.72 1a4l h PRO 24 N 4.21 1.01 -0.39 -1.68 0.11 -1.98 -1.27 132.00 132.01 1a4l h PRO 24 Ca -0.45 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 65.62 1a4l h PRO 24 Cb 1.20 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 1a4l h PRO 24 CO 0.68 0.67 0.20 0.93 -0.21 0.00 0.00 178.00 180.27 1a4l h GLU 25 N 1.04 0.40 -0.12 1.05 3.07 -1.92 -1.15 114.58 116.95 1a4l h GLU 25 Ca 0.45 -0.02 -0.09 0.00 -0.50 0.00 0.00 59.36 59.19 1a4l h GLU 25 Cb 0.34 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1a4l h GLU 25 CO -0.20 0.26 -0.33 1.15 -1.40 0.00 0.00 179.01 178.49 1a4l h THR 26 N 0.41 1.27 -0.15 1.13 2.02 -1.69 -0.69 112.91 115.22 1a4l h THR 26 Ca 0.16 -1.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.00 1a4l h THR 26 Cb 0.05 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1a4l h THR 26 CO -0.10 0.40 0.01 0.40 0.37 0.00 0.00 175.52 176.59 1a4l h ILE 27 N 0.20 1.25 -0.11 3.11 2.04 -0.81 -2.90 117.51 120.30 1a4l h ILE 27 Ca 0.03 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1a4l h ILE 27 Cb 0.69 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 1a4l h ILE 27 CO 0.05 0.24 -0.07 0.25 0.00 0.00 0.00 178.15 178.62 1a4l h LEU 28 N 0.02 -0.22 -0.56 1.44 5.85 -0.88 -1.57 115.31 119.39 1a4l h LEU 28 Ca 0.04 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1a4l h LEU 28 Cb 0.36 0.12 -0.11 0.00 0.37 0.00 0.00 40.66 41.40 1a4l h LEU 28 CO 0.01 -0.09 -0.42 0.22 -0.34 0.00 0.00 178.44 177.82 1a4l h TYR 29 N -0.07 -1.22 0.00 1.25 3.20 -1.07 -1.74 116.97 117.33 1a4l h TYR 29 Ca 0.07 0.08 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 1a4l h TYR 29 Cb 0.17 0.61 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 1a4l h TYR 29 CO -0.19 -0.42 -0.51 0.74 -1.64 0.00 0.00 178.16 176.15 1a4l h PHE 30 N -0.23 0.00 -0.51 -3.82 0.04 -1.29 0.07 116.94 111.21 1a4l h PHE 30 Ca 0.18 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.93 1a4l h PHE 30 Cb 0.56 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.69 1a4l h PHE 30 CO -0.69 0.51 0.24 0.78 -0.60 0.00 0.00 178.31 178.55 1a4l h GLY 31 N 1.69 0.79 0.53 -1.45 0.00 -0.48 -0.10 103.07 104.05 1a4l h GLY 31 Ca -0.01 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 1a4l h GLY 31 CO 0.07 0.37 -0.01 0.50 0.00 0.00 0.00 176.54 177.47 1a4l h LYS 32 N 0.68 -0.03 -0.57 4.80 1.57 -1.16 -0.99 116.57 120.88 1a4l h LYS 32 Ca 0.18 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1a4l h LYS 32 Cb 0.12 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1a4l h LYS 32 CO -0.02 0.43 0.35 -0.22 -0.57 0.00 0.00 179.45 179.42 1a4l h LYS 33 N -0.50 0.76 0.00 3.15 3.64 -0.89 -2.73 116.57 120.01 1a4l h LYS 33 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1a4l h LYS 33 Cb 0.47 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1a4l h LYS 33 CO 0.00 0.53 -0.86 0.54 -2.27 0.00 0.00 179.45 177.40 1a4l n ARG 34 N -4.43 0.16 -2.15 1.90 1.74 -0.06 -4.96 116.66 108.87 1a4l n ARG 34 Ca 0.05 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.05 1a4l n ARG 34 Cb 0.07 -1.55 -0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1a4l n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1a4l n GLY 35 N 1.43 0.04 3.84 -0.13 0.00 -0.48 -5.02 105.19 104.87 1a4l n GLY 35 Ca 0.03 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 1a4l n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4l s ILE 36 N -2.42 4.99 0.57 -0.61 1.01 -0.59 -5.04 121.20 119.11 1a4l s ILE 36 Ca 0.00 -0.43 -0.15 0.00 0.00 0.00 0.00 60.65 60.08 1a4l s ILE 36 Cb 0.00 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 39.06 1a4l s ILE 36 CO 0.00 0.25 1.02 0.00 0.00 0.00 0.00 174.94 176.20 1a4l s ALA 37 N -1.34 2.98 0.04 9.38 0.00 -1.26 -4.46 121.76 127.10 1a4l s ALA 37 Ca 0.28 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.39 1a4l s ALA 37 Cb -0.12 -3.13 -0.03 0.00 0.00 0.00 0.00 23.12 19.84 1a4l s ALA 37 CO 0.20 -0.54 -0.05 -0.51 0.00 0.00 0.00 175.76 174.86 1a4l s LEU 38 N -4.55 2.29 0.00 0.00 2.01 -1.26 -4.89 118.68 112.27 1a4l s LEU 38 Ca 0.59 -0.60 0.15 0.00 0.01 0.00 0.00 54.13 54.27 1a4l s LEU 38 Cb -0.12 0.00 0.89 0.00 0.01 0.00 0.00 46.19 46.98 1a4l s LEU 38 CO 0.40 -0.31 1.31 -0.81 1.01 0.00 0.00 176.35 177.95 1a4l n PRO 39 N 1.28 0.49 -3.49 1.29 -0.04 -1.26 -4.74 135.00 128.53 1a4l n PRO 39 Ca -0.22 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.09 1a4l n PRO 39 Cb 0.56 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.50 1a4l n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a4l s ALA 40 N -2.00 -1.66 -0.83 0.55 0.00 -1.26 -4.96 121.76 111.60 1a4l s ALA 40 Ca 0.22 0.93 0.21 0.00 0.00 0.00 0.00 51.96 53.33 1a4l s ALA 40 Cb 0.10 0.38 -0.19 0.00 0.00 0.00 0.00 23.12 23.41 1a4l s ALA 40 CO 0.17 -0.53 0.87 -0.25 0.00 0.00 0.00 175.76 176.02 1a4l n ASP 41 N 0.37 0.80 -4.47 0.00 8.00 -1.26 -4.77 116.55 115.22 1a4l n ASP 41 Ca -0.18 -0.76 -0.24 0.00 0.71 0.00 0.00 54.79 54.32 1a4l n ASP 41 Cb 0.60 1.10 -0.10 0.00 -0.02 0.00 0.00 41.12 42.71 1a4l n ASP 41 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1a4l s THR 42 N -3.09 2.35 0.19 -3.53 -4.23 -1.26 -5.03 115.64 101.04 1a4l s THR 42 Ca 0.05 -2.34 -0.09 0.00 -1.18 0.00 0.00 61.69 58.13 1a4l s THR 42 Cb 0.16 -2.36 0.12 0.00 1.34 0.00 0.00 72.50 71.76 1a4l s THR 42 CO 0.86 -0.37 1.74 -0.37 -0.54 0.00 0.00 174.62 175.94 1a4l h VAL 43 N 2.24 1.26 -0.41 2.29 -1.51 -1.93 -0.45 116.25 117.73 1a4l h VAL 43 Ca -0.40 -0.86 -0.07 0.00 -1.23 0.00 0.00 66.70 64.13 1a4l h VAL 43 Cb 1.25 0.48 -0.01 0.00 -2.13 0.00 0.00 31.29 30.88 1a4l h VAL 43 CO 0.63 0.34 -0.03 -0.08 -1.23 0.00 0.00 177.57 177.19 1a4l h GLU 44 N 1.03 0.75 0.00 5.19 4.57 -1.97 0.11 114.58 124.27 1a4l h GLU 44 Ca 0.23 -0.26 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 1a4l h GLU 44 Cb 0.28 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1a4l h GLU 44 CO -0.01 0.85 -0.40 0.93 -1.18 0.00 0.00 179.01 179.20 1a4l h GLU 45 N 0.58 0.00 -0.16 1.92 4.39 -1.95 -2.45 114.58 116.91 1a4l h GLU 45 Ca 0.11 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.66 1a4l h GLU 45 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1a4l h GLU 45 CO 0.03 0.40 -0.49 1.25 -1.16 0.00 0.00 179.01 179.03 1a4l h LEU 46 N 0.00 0.72 -0.20 1.33 5.85 -0.73 -2.79 115.31 119.49 1a4l h LEU 46 Ca -0.00 -0.59 0.05 0.00 0.84 0.00 0.00 57.88 58.17 1a4l h LEU 46 Cb 0.73 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.50 1a4l h LEU 46 CO 0.05 1.18 -0.13 0.03 -0.34 0.00 0.00 178.44 179.23 1a4l h ARG 47 N 0.29 -0.12 -0.19 1.25 3.08 -0.47 -0.93 114.38 117.29 1a4l h ARG 47 Ca -0.02 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1a4l h ARG 47 Cb 1.12 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 1a4l h ARG 47 CO 0.11 -0.08 0.02 -0.91 -1.07 0.00 0.00 179.97 178.04 1a4l h ASN 48 N -0.13 0.24 0.71 7.04 2.35 -1.45 0.17 115.58 124.52 1a4l h ASN 48 Ca 0.12 -0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.63 1a4l h ASN 48 Cb 0.30 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.57 1a4l h ASN 48 CO -0.28 0.27 -1.41 -0.29 -1.65 0.00 0.00 177.43 174.07 1a4l h ILE 49 N 0.26 0.72 0.00 2.81 2.10 -1.17 -3.33 117.51 118.90 1a4l h ILE 49 Ca 0.06 -2.34 -0.19 0.00 1.08 0.00 0.00 64.86 63.48 1a4l h ILE 49 Cb 0.14 2.24 -0.03 0.00 -1.09 0.00 0.00 36.82 38.09 1a4l h ILE 49 CO -0.00 0.41 -1.16 0.40 -1.08 0.00 0.00 178.15 176.72 1a4l h ILE 50 N 0.00 0.94 -3.65 2.19 2.04 -1.03 -3.47 117.51 114.54 1a4l h ILE 50 Ca -0.18 -2.53 -0.49 0.00 1.00 0.00 0.00 64.86 62.65 1a4l h ILE 50 Cb 1.72 2.40 0.04 0.00 -0.74 0.00 0.00 36.82 40.24 1a4l h ILE 50 CO 0.06 0.54 0.14 -0.83 0.00 0.00 0.00 178.15 178.06 1a4l s GLY 51 N -4.76 1.53 -0.05 5.37 0.00 0.60 -4.55 107.32 105.45 1a4l s GLY 51 Ca -0.01 -0.45 0.04 0.00 0.00 0.00 0.00 44.72 44.30 1a4l s GLY 51 CO 0.80 -0.28 -0.16 1.06 0.00 0.00 0.00 173.10 174.52 1a4l s MET 52 N -4.74 2.55 -0.08 2.90 -1.94 -0.34 -4.87 119.30 112.77 1a4l s MET 52 Ca 0.48 -0.74 0.16 0.00 -1.71 0.00 0.00 55.69 53.89 1a4l s MET 52 Cb -0.10 -2.35 -0.24 0.00 2.01 0.00 0.00 34.83 34.15 1a4l s MET 52 CO 0.45 0.56 0.24 -0.25 -0.01 0.00 0.00 175.02 176.01 1a4l n ASP 53 N 2.49 1.02 -4.01 3.03 9.92 -1.26 -4.78 116.55 122.96 1a4l n ASP 53 Ca -0.17 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.00 1a4l n ASP 53 Cb 0.52 1.41 -0.11 0.00 -0.64 0.00 0.00 41.12 42.31 1a4l n ASP 53 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1a4l s LYS 54 N -2.86 0.41 0.23 -1.24 1.02 -1.26 -5.08 119.74 110.96 1a4l s LYS 54 Ca -0.07 -0.80 -0.30 0.00 0.02 0.00 0.00 55.97 54.82 1a4l s LYS 54 Cb 0.08 0.14 -0.15 0.00 -0.52 0.00 0.00 37.83 37.39 1a4l s LYS 54 CO 0.70 -0.07 1.03 -2.30 -0.92 0.00 0.00 175.35 173.78 1a4l n PRO 55 N 1.11 1.14 0.00 -1.68 -0.02 -1.26 -4.90 135.00 129.39 1a4l n PRO 55 Ca -0.21 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1a4l n PRO 55 Cb 0.57 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1a4l n PRO 55 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1a4l n LEU 56 N 1.62 0.00 -3.76 2.45 0.00 0.10 -4.96 117.00 112.46 1a4l n LEU 56 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 56.01 56.07 1a4l n LEU 56 Cb 0.28 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 43.68 1a4l n LEU 56 CO 0.60 0.00 0.55 -0.94 0.00 0.00 0.00 177.39 177.60 1a4l s SER 57 N 1.00 -0.28 0.08 1.96 1.04 -1.07 -4.45 113.70 111.99 1a4l s SER 57 Ca 0.00 -0.44 -0.26 0.00 0.48 0.00 0.00 55.95 55.72 1a4l s SER 57 Cb 0.00 0.62 -0.16 0.00 0.10 0.00 0.00 66.02 66.58 1a4l s SER 57 CO 0.00 -1.13 1.69 0.25 0.98 0.00 0.00 173.24 175.03 1a4l h LEU 58 N 2.00 -0.25 -1.35 2.42 5.85 -1.93 0.17 115.31 122.22 1a4l h LEU 58 Ca -0.22 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 1a4l h LEU 58 Cb 1.25 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 1a4l h LEU 58 CO 0.26 -0.17 0.32 -0.65 -0.34 0.00 0.00 178.44 177.86 1a4l h PRO 59 N -0.31 0.76 -0.33 5.25 0.11 -1.96 -0.69 132.00 134.83 1a4l h PRO 59 Ca -0.03 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.01 1a4l h PRO 59 Cb 0.24 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.17 1a4l h PRO 59 CO 0.05 0.55 0.18 0.78 -0.21 0.00 0.00 178.00 179.35 1a4l h GLY 60 N 0.83 0.49 1.41 -0.55 0.00 -1.81 -2.56 103.07 100.88 1a4l h GLY 60 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 1a4l h GLY 60 CO -0.04 0.21 -0.07 -2.75 0.00 0.00 0.00 176.54 173.89 1a4l h PHE 61 N 0.41 0.77 0.00 5.60 3.57 -0.07 -2.99 116.94 124.23 1a4l h PHE 61 Ca 0.12 -0.12 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1a4l h PHE 61 Cb 0.05 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 1a4l h PHE 61 CO -0.03 0.76 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.67 1a4l h LEU 62 N 0.66 0.00 -0.95 0.59 3.38 -0.74 -2.66 115.31 115.58 1a4l h LEU 62 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1a4l h LEU 62 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1a4l h LEU 62 CO 0.03 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.63 1a4l h ALA 63 N 1.93 1.00 0.00 1.53 0.00 -1.34 -3.09 119.26 119.29 1a4l h ALA 63 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1a4l h ALA 63 Cb 0.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1a4l h ALA 63 CO 0.01 0.00 -0.30 0.87 0.00 0.00 0.00 179.25 179.83 1a4l h LYS 64 N 0.00 0.00 0.00 0.00 1.79 -1.64 -2.80 116.57 113.92 1a4l h LYS 64 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1a4l h LYS 64 Cb 0.43 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.07 1a4l h LYS 64 CO 0.00 0.30 -0.26 0.74 -1.08 0.00 0.00 179.45 179.15 1a4l h PHE 65 N 0.00 0.00 -0.07 -1.35 -1.00 -1.75 -2.43 116.94 110.34 1a4l h PHE 65 Ca -0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.75 1a4l h PHE 65 Cb 0.58 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.13 1a4l h PHE 65 CO 0.00 0.26 -0.06 -0.44 -1.61 0.00 0.00 178.31 176.45 1a4l h ASP 66 N 0.00 0.09 -0.34 2.17 3.32 -1.70 -0.43 116.42 119.53 1a4l h ASP 66 Ca -0.00 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1a4l h ASP 66 Cb 0.55 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 1a4l h ASP 66 CO 0.03 0.17 0.20 1.88 -1.72 0.00 0.00 179.24 179.80 1a4l h TYR 67 N 0.10 0.37 0.00 4.55 0.05 -1.57 -3.40 116.97 117.07 1a4l h TYR 67 Ca 0.02 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 1a4l h TYR 67 Cb 0.18 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1a4l h TYR 67 CO 0.00 0.22 -1.19 2.48 -1.05 0.00 0.00 178.16 178.62 1a4l n TYR 68 N -4.90 0.00 -0.31 4.88 4.11 -1.09 -4.58 117.16 115.27 1a4l n TYR 68 Ca -0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.04 1a4l n TYR 68 Cb 0.05 -0.13 0.33 0.00 -0.00 0.00 0.00 39.34 39.59 1a4l n TYR 68 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.86 177.38 1a4l h MET 69 N 0.00 0.38 -0.95 -3.48 2.86 -1.28 -1.25 114.93 111.21 1a4l h MET 69 Ca -0.05 -0.02 0.25 0.00 -2.06 0.00 0.00 59.70 57.81 1a4l h MET 69 Cb 0.82 -0.09 -0.06 0.00 0.06 0.00 0.00 31.60 32.34 1a4l h MET 69 CO 0.00 0.25 0.66 -1.35 1.06 0.00 0.00 176.91 177.53 1a4l h PRO 70 N 0.39 0.19 0.00 -0.22 0.11 -1.80 0.10 132.00 130.77 1a4l h PRO 70 Ca 0.58 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.52 1a4l h PRO 70 Cb 1.13 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1a4l h PRO 70 CO -0.54 0.12 -0.75 0.28 -0.21 0.00 0.00 178.00 176.90 1a4l h VAL 71 N 0.19 1.33 0.00 3.15 2.07 -1.56 -3.37 116.25 118.05 1a4l h VAL 71 Ca 0.48 -2.79 -0.27 0.00 0.82 0.00 0.00 66.70 64.95 1a4l h VAL 71 Cb 1.57 2.60 -0.04 0.00 -1.52 0.00 0.00 31.29 33.89 1a4l h VAL 71 CO -0.11 0.74 -1.50 -0.38 0.02 0.00 0.00 177.57 176.34 1a4l n ILE 72 N -3.34 1.53 -1.64 4.57 2.08 -0.22 -4.76 119.36 117.58 1a4l n ILE 72 Ca 0.01 -0.09 -0.46 0.00 0.56 0.00 0.00 62.75 62.77 1a4l n ILE 72 Cb 0.82 -2.02 -0.03 0.00 -0.75 0.00 0.00 39.64 37.66 1a4l n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1a4l n ALA 73 N -3.60 0.55 0.00 -1.39 0.00 0.19 -2.17 120.51 114.10 1a4l n ALA 73 Ca -0.36 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1a4l n ALA 73 Cb 0.71 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.96 1a4l n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a4l n GLY 74 N 2.20 2.47 3.39 0.00 0.00 -0.45 -4.90 105.19 107.90 1a4l n GLY 74 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1a4l n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l h ARG 76 N 8.26 0.45 0.00 0.00 3.08 -1.96 -1.57 114.38 122.64 1a4l h ARG 76 Ca -0.33 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.65 1a4l h ARG 76 Cb 1.14 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1a4l h ARG 76 CO 0.60 0.30 -0.18 1.05 -1.07 0.00 0.00 179.97 180.67 1a4l h GLU 77 N 0.47 0.00 -0.00 0.04 4.11 -1.96 -2.58 114.58 114.65 1a4l h GLU 77 Ca 0.20 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.60 1a4l h GLU 77 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1a4l h GLU 77 CO -0.14 0.18 -0.11 0.00 0.07 0.00 0.00 179.01 179.01 1a4l h ALA 78 N 1.82 0.02 -0.31 1.06 0.00 -1.70 -1.93 119.26 118.22 1a4l h ALA 78 Ca -0.00 -0.42 0.06 0.00 0.00 0.00 0.00 54.91 54.55 1a4l h ALA 78 Cb 0.33 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 1a4l h ALA 78 CO 0.02 -0.02 -0.09 0.82 0.00 0.00 0.00 179.25 179.98 1a4l h ILE 79 N -0.64 0.67 -0.42 0.00 2.04 -1.20 -1.13 117.51 116.81 1a4l h ILE 79 Ca -0.01 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 1a4l h ILE 79 Cb 0.88 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1a4l h ILE 79 CO 0.02 0.00 -0.02 0.50 0.00 0.00 0.00 178.15 178.66 1a4l h LYS 80 N -0.02 0.76 -0.40 2.37 3.64 -1.56 -3.04 116.57 118.32 1a4l h LYS 80 Ca 0.15 -0.25 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1a4l h LYS 80 Cb 0.25 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 1a4l h LYS 80 CO -0.33 0.84 0.18 -0.09 -2.27 0.00 0.00 179.45 177.78 1a4l h ARG 81 N 0.59 0.35 0.00 1.90 2.43 -0.82 -0.93 114.38 117.90 1a4l h ARG 81 Ca 0.12 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1a4l h ARG 81 Cb 0.51 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1a4l h ARG 81 CO 0.02 0.23 -0.11 -0.84 -1.51 0.00 0.00 179.97 177.76 1a4l h ILE 82 N 0.36 0.45 -0.00 1.20 3.07 -1.23 -0.33 117.51 121.04 1a4l h ILE 82 Ca 0.17 -0.59 -0.00 0.00 1.55 0.00 0.00 64.86 66.00 1a4l h ILE 82 Cb 0.11 1.41 0.00 0.00 -0.27 0.00 0.00 36.82 38.07 1a4l h ILE 82 CO -0.14 0.11 -0.01 0.00 -1.05 0.00 0.00 178.15 177.06 1a4l h ALA 83 N 1.89 0.00 -0.43 0.16 0.00 -1.18 -1.82 119.26 117.89 1a4l h ALA 83 Ca -0.00 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1a4l h ALA 83 Cb 0.40 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1a4l h ALA 83 CO 0.01 -0.16 0.25 -0.92 0.00 0.00 0.00 179.25 178.44 1a4l h TYR 84 N -0.66 0.57 0.00 0.00 3.20 -0.81 -2.64 116.97 116.62 1a4l h TYR 84 Ca -0.00 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 1a4l h TYR 84 Cb 0.67 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1a4l h TYR 84 CO 0.16 0.40 -0.23 0.93 -1.64 0.00 0.00 178.16 177.78 1a4l h GLU 85 N 0.56 0.00 0.37 1.82 5.08 -1.14 -3.00 114.58 118.28 1a4l h GLU 85 Ca 0.15 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1a4l h GLU 85 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1a4l h GLU 85 CO -0.03 0.23 -0.18 0.35 -1.00 0.00 0.00 179.01 178.39 1a4l h PHE 86 N 0.00 -0.46 -0.34 4.33 3.57 -0.95 -1.64 116.94 121.45 1a4l h PHE 86 Ca -0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1a4l h PHE 86 Cb 0.52 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.35 1a4l h PHE 86 CO 0.00 -0.25 -0.10 0.28 -2.23 0.00 0.00 178.31 176.02 1a4l h VAL 87 N -0.56 0.64 -0.49 1.41 2.07 -1.44 -0.98 116.25 116.90 1a4l h VAL 87 Ca -0.05 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.56 1a4l h VAL 87 Cb 0.42 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 1a4l h VAL 87 CO 0.08 0.00 0.02 -0.08 0.02 0.00 0.00 177.57 177.62 1a4l h GLU 88 N -0.02 0.14 -0.82 1.57 4.81 -1.45 0.88 114.58 119.69 1a4l h GLU 88 Ca 0.17 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 1a4l h GLU 88 Cb 0.27 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.55 1a4l h GLU 88 CO -0.36 0.09 0.49 0.52 -0.73 0.00 0.00 179.01 179.02 1a4l h MET 89 N 0.14 0.84 -0.19 1.92 2.86 -0.22 -2.42 114.93 117.86 1a4l h MET 89 Ca 0.25 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.72 1a4l h MET 89 Cb 0.36 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 1a4l h MET 89 CO -0.39 0.56 -0.33 0.87 1.06 0.00 0.00 176.91 178.68 1a4l h LYS 90 N 0.87 0.56 -0.51 1.72 1.79 -0.20 -3.13 116.57 117.66 1a4l h LYS 90 Ca 0.37 -0.35 0.10 0.00 -2.18 0.00 0.00 60.65 58.59 1a4l h LYS 90 Cb 0.23 0.04 -0.08 0.00 -1.58 0.00 0.00 32.23 30.84 1a4l h LYS 90 CO -0.20 0.95 0.00 0.00 -1.08 0.00 0.00 179.45 179.13 1a4l h ALA 91 N 0.60 0.49 0.00 3.86 0.00 -0.61 0.55 119.26 124.15 1a4l h ALA 91 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a4l h ALA 91 Cb 0.92 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1a4l h ALA 91 CO 0.07 -0.39 0.00 1.63 0.00 0.00 0.00 179.25 180.57 1a4l n LYS 92 N -5.23 0.11 0.00 0.00 5.02 -0.94 -0.83 118.16 116.29 1a4l n LYS 92 Ca 0.06 0.55 0.12 0.00 -2.02 0.00 0.00 58.31 57.02 1a4l n LYS 92 Cb 0.28 -1.83 0.16 0.00 -0.02 0.00 0.00 35.03 33.62 1a4l n LYS 92 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1a4l n GLU 93 N -2.06 0.42 -0.32 1.97 1.02 0.19 -4.94 120.64 116.92 1a4l n GLU 93 Ca -0.00 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 56.85 1a4l n GLU 93 Cb 0.07 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1a4l n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4l n GLY 94 N 1.44 0.80 3.64 0.62 0.00 -0.01 -4.91 105.19 106.76 1a4l n GLY 94 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1a4l n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4l s VAL 95 N -2.15 4.17 -0.18 1.61 1.01 -1.06 -1.45 120.40 122.35 1a4l s VAL 95 Ca 0.00 1.34 0.20 0.00 0.00 0.00 0.00 61.98 63.53 1a4l s VAL 95 Cb 0.00 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 1a4l s VAL 95 CO 0.00 -0.39 0.92 1.33 0.00 0.00 0.00 175.10 176.96 1a4l n VAL 96 N 6.02 0.80 -3.73 2.92 0.24 -0.43 -4.35 118.33 119.80 1a4l n VAL 96 Ca 0.15 -0.60 -0.13 0.00 -2.04 0.00 0.00 64.34 61.72 1a4l n VAL 96 Cb 0.46 -0.46 -0.13 0.00 -1.47 0.00 0.00 33.84 32.24 1a4l n VAL 96 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1a4l s TYR 97 N -3.21 -0.31 0.03 6.34 5.04 -1.21 -1.27 117.35 122.76 1a4l s TYR 97 Ca -0.02 0.75 -0.00 0.00 -2.44 0.00 0.00 57.07 55.36 1a4l s TYR 97 Cb 0.09 0.03 -0.03 0.00 0.35 0.00 0.00 41.96 42.41 1a4l s TYR 97 CO 0.80 -0.22 -0.03 0.08 -1.34 0.00 0.00 175.55 174.84 1a4l s VAL 98 N 1.24 0.18 -0.15 3.14 1.01 -0.90 -1.71 120.40 123.21 1a4l s VAL 98 Ca -0.09 -1.32 -0.00 0.00 0.00 0.00 0.00 61.98 60.57 1a4l s VAL 98 Cb -0.10 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.47 1a4l s VAL 98 CO -0.08 -0.72 -0.09 -1.61 0.00 0.00 0.00 175.10 172.60 1a4l s GLU 99 N -2.56 1.78 -0.15 2.72 2.02 -0.24 -1.38 118.70 120.89 1a4l s GLU 99 Ca -0.06 -0.49 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 1a4l s GLU 99 Cb -0.02 -1.96 -0.04 0.00 0.10 0.00 0.00 34.13 32.21 1a4l s GLU 99 CO -0.05 -0.33 0.10 0.08 0.02 0.00 0.00 175.26 175.08 1a4l s VAL 100 N 1.58 5.13 0.11 2.63 1.01 -0.15 -4.00 120.40 126.72 1a4l s VAL 100 Ca 0.03 0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.15 1a4l s VAL 100 Cb -0.14 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1a4l s VAL 100 CO -0.09 0.53 -0.05 0.00 0.00 0.00 0.00 175.10 175.49 1a4l s ARG 101 N -0.29 2.32 -0.15 2.72 1.70 0.07 -0.64 118.95 124.69 1a4l s ARG 101 Ca 0.10 -0.97 -0.30 0.00 -0.47 0.00 0.00 55.73 54.09 1a4l s ARG 101 Cb -0.12 -2.40 0.12 0.00 -0.57 0.00 0.00 34.95 31.99 1a4l s ARG 101 CO 0.01 0.51 0.99 1.52 -1.08 0.00 0.00 175.30 177.25 1a4l s TYR 102 N -1.33 -0.37 -0.33 5.89 1.13 -0.95 -0.64 117.35 120.75 1a4l s TYR 102 Ca 0.24 0.60 -0.20 0.00 -1.41 0.00 0.00 57.07 56.30 1a4l s TYR 102 Cb -0.11 0.46 -0.00 0.00 -1.10 0.00 0.00 41.96 41.20 1a4l s TYR 102 CO 0.16 -0.36 0.62 0.45 -2.51 0.00 0.00 175.55 173.91 1a4l s SER 103 N -1.22 6.45 0.30 -0.18 0.15 -1.26 -1.34 113.70 116.60 1a4l s SER 103 Ca -0.01 0.27 0.02 0.00 0.70 0.00 0.00 55.95 56.92 1a4l s SER 103 Cb -0.00 -2.32 0.49 0.00 -1.71 0.00 0.00 66.02 62.47 1a4l s SER 103 CO 0.01 -0.52 1.82 1.55 1.20 0.00 0.00 173.24 177.30 1a4l h PRO 104 N 8.33 0.63 -0.28 5.44 0.13 -1.90 -2.90 132.00 141.44 1a4l h PRO 104 Ca -0.27 -0.15 -0.05 0.00 -0.87 0.00 0.00 66.00 64.66 1a4l h PRO 104 Cb 1.12 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.15 1a4l h PRO 104 CO 0.81 0.66 -0.04 0.45 -0.23 0.00 0.00 178.00 179.65 1a4l h HIS 105 N 0.59 0.45 0.00 1.56 3.86 -1.91 -2.59 115.15 117.12 1a4l h HIS 105 Ca 0.12 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1a4l h HIS 105 Cb 0.39 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.73 1a4l h HIS 105 CO 0.02 0.48 0.00 1.28 0.86 0.00 0.00 177.93 180.57 1a4l n LEU 106 N -4.28 0.00 -0.40 2.43 4.77 -1.09 -2.67 117.00 115.76 1a4l n LEU 106 Ca 0.01 0.48 0.06 0.00 -0.03 0.00 0.00 56.01 56.52 1a4l n LEU 106 Cb 0.25 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 40.90 1a4l n LEU 106 CO 0.39 -0.19 0.37 0.18 -1.33 0.00 0.00 177.39 176.81 1a4l n LEU 107 N -1.48 1.76 -4.94 2.23 7.99 -0.98 -4.80 117.00 116.77 1a4l n LEU 107 Ca 0.05 -0.92 -0.24 0.00 -0.01 0.00 0.00 56.01 54.88 1a4l n LEU 107 Cb 0.20 0.00 0.03 0.00 -0.11 0.00 0.00 43.42 43.54 1a4l n LEU 107 CO 0.16 0.33 0.42 0.00 -1.51 0.00 0.00 177.39 176.80 1a4l s ALA 108 N -1.14 3.55 0.00 -1.18 0.00 -1.09 -1.34 121.76 120.55 1a4l s ALA 108 Ca 0.12 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.22 1a4l s ALA 108 Cb 0.10 -2.35 0.12 0.00 0.00 0.00 0.00 23.12 20.98 1a4l s ALA 108 CO 0.19 -0.66 0.98 0.27 0.00 0.00 0.00 175.76 176.53 1a4l n ASN 109 N -2.38 0.20 -3.59 0.00 2.04 0.04 -4.57 115.26 107.00 1a4l n ASN 109 Ca 0.04 -1.86 -0.16 0.00 -0.44 0.00 0.00 54.58 52.16 1a4l n ASN 109 Cb 0.58 -0.16 -0.07 0.00 -2.53 0.00 0.00 39.78 37.60 1a4l n ASN 109 CO 0.00 0.00 0.00 -0.55 -0.44 0.00 0.00 177.26 176.27 1a4l s SER 110 N -1.14 -0.68 -1.39 0.53 0.15 -1.01 -0.43 113.70 109.73 1a4l s SER 110 Ca 0.10 1.04 -0.09 0.00 0.70 0.00 0.00 55.95 57.69 1a4l s SER 110 Cb 0.11 0.97 0.03 0.00 -1.71 0.00 0.00 66.02 65.42 1a4l s SER 110 CO -0.05 -0.42 1.13 0.29 1.20 0.00 0.00 173.24 175.39 1a4l n LYS 111 N 1.83 -7.36 -3.75 5.44 5.02 -1.26 -4.14 118.16 113.93 1a4l n LYS 111 Ca -0.17 0.78 -0.24 0.00 -2.02 0.00 0.00 58.31 56.67 1a4l n LYS 111 Cb 0.56 -5.79 -0.17 0.00 -0.02 0.00 0.00 35.03 29.60 1a4l n LYS 111 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1a4l s VAL 112 N -3.32 0.36 0.00 -0.18 1.01 -1.26 -4.73 120.40 112.28 1a4l s VAL 112 Ca 0.56 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 62.50 1a4l s VAL 112 Cb -0.25 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 1a4l s VAL 112 CO 0.75 0.16 0.88 -0.78 0.00 0.00 0.00 175.10 176.11 1a4l h ASP 113 N 8.32 -0.17 -2.58 3.32 1.82 -2.00 -3.31 116.42 121.82 1a4l h ASP 113 Ca -0.19 0.01 -0.54 0.00 -0.39 0.00 0.00 57.03 55.92 1a4l h ASP 113 Cb 1.12 0.04 -0.06 0.00 0.68 0.00 0.00 39.33 41.12 1a4l h ASP 113 CO 0.27 -0.10 1.13 -2.84 -1.61 0.00 0.00 179.24 176.09 1a4l s PRO 114 N -3.04 3.17 -0.04 0.28 0.02 -1.26 -4.91 135.00 129.22 1a4l s PRO 114 Ca -0.03 0.32 -0.29 0.00 0.02 0.00 0.00 61.00 61.02 1a4l s PRO 114 Cb 0.00 -4.18 -0.08 0.00 0.02 0.00 0.00 34.50 30.27 1a4l s PRO 114 CO 0.09 -2.11 2.06 1.41 -0.33 0.00 0.00 177.00 178.11 1a4l s MET 115 N 5.80 3.81 0.63 5.54 1.75 -1.25 -4.96 119.30 130.63 1a4l s MET 115 Ca 0.51 2.43 -0.16 0.00 -1.25 0.00 0.00 55.69 57.21 1a4l s MET 115 Cb -0.10 -4.23 -0.01 0.00 2.84 0.00 0.00 34.83 33.32 1a4l s MET 115 CO 0.22 -1.33 1.14 -2.14 -0.65 0.00 0.00 175.02 172.26 1a4l s PRO 116 N 5.08 2.85 -0.71 4.11 0.02 -1.26 -3.77 135.00 141.33 1a4l s PRO 116 Ca 0.93 1.54 -0.03 0.00 0.02 0.00 0.00 61.00 63.46 1a4l s PRO 116 Cb -0.40 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.20 1a4l s PRO 116 CO 0.40 -1.23 0.12 0.91 -0.33 0.00 0.00 177.00 176.86 1a4l n TRP 117 N -2.11 -1.70 -2.41 6.54 7.02 -1.26 -1.23 117.44 122.29 1a4l n TRP 117 Ca 0.11 0.12 -0.15 0.00 -1.02 0.00 0.00 57.50 56.56 1a4l n TRP 117 Cb 0.51 -2.02 -0.01 0.00 -2.42 0.00 0.00 31.31 27.37 1a4l n TRP 117 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1a4l n ASN 118 N -1.80 -4.59 -4.74 -0.99 4.13 -1.25 -4.90 115.26 101.13 1a4l n ASN 118 Ca -0.05 0.13 -0.36 0.00 1.68 0.00 0.00 54.58 55.98 1a4l n ASN 118 Cb 0.54 -3.87 0.06 0.00 -1.54 0.00 0.00 39.78 34.97 1a4l n ASN 118 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1a4l s GLN 119 N -5.00 2.68 -0.05 3.52 -0.21 -0.37 -4.99 119.66 115.24 1a4l s GLN 119 Ca 0.00 1.94 -0.21 0.00 0.02 0.00 0.00 55.36 57.11 1a4l s GLN 119 Cb 0.00 -1.88 -0.05 0.00 1.00 0.00 0.00 33.01 32.09 1a4l s GLN 119 CO 0.00 -1.47 0.60 0.99 -2.12 0.00 0.00 175.29 173.30 1a4l s THR 120 N -1.53 5.00 0.06 -0.19 2.01 -1.26 -4.94 115.64 114.79 1a4l s THR 120 Ca 0.80 1.25 -0.33 0.00 0.31 0.00 0.00 61.69 63.72 1a4l s THR 120 Cb -0.34 -3.94 -0.17 0.00 0.01 0.00 0.00 72.50 68.06 1a4l s THR 120 CO 0.38 0.35 0.81 -0.62 -0.69 0.00 0.00 174.62 174.84 1a4l n GLU 121 N 3.23 0.00 0.00 4.92 -0.58 -1.26 -4.97 120.64 121.98 1a4l n GLU 121 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 1a4l n GLU 121 Cb 0.51 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 30.16 1a4l n GLU 121 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1a4l n GLY 122 N 1.53 5.48 0.00 0.62 0.00 0.43 -5.04 105.19 108.21 1a4l n GLY 122 Ca 0.18 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1a4l n GLY 122 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1a4l n ASP 123 N 0.00 0.72 -4.53 1.61 5.68 -1.26 -4.62 116.55 114.15 1a4l n ASP 123 Ca 0.00 -1.20 -0.42 0.00 -0.50 0.00 0.00 54.79 52.67 1a4l n ASP 123 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 1a4l n ASP 123 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1a4l s VAL 124 N -0.20 3.94 0.51 2.12 1.01 -1.26 -4.88 120.40 121.65 1a4l s VAL 124 Ca 0.00 0.30 -0.17 0.00 0.00 0.00 0.00 61.98 62.11 1a4l s VAL 124 Cb 0.00 -4.81 -0.08 0.00 0.00 0.00 0.00 36.38 31.49 1a4l s VAL 124 CO 0.00 -1.64 0.99 -0.89 0.00 0.00 0.00 175.10 173.56 1a4l s THR 125 N 5.13 4.49 0.28 3.92 2.01 -1.26 -0.78 115.64 129.43 1a4l s THR 125 Ca 0.33 1.21 0.02 0.00 0.31 0.00 0.00 61.69 63.56 1a4l s THR 125 Cb -0.10 -3.70 0.29 0.00 0.01 0.00 0.00 72.50 68.99 1a4l s THR 125 CO 0.16 -0.67 1.82 -0.65 -0.69 0.00 0.00 174.62 174.59 1a4l h PRO 126 N 0.93 0.92 -0.62 4.92 0.11 -1.84 0.78 132.00 137.21 1a4l h PRO 126 Ca -0.47 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1a4l h PRO 126 Cb 1.19 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 1a4l h PRO 126 CO 0.61 0.61 0.39 0.22 -0.21 0.00 0.00 178.00 179.63 1a4l h ASP 127 N 0.95 0.73 -0.84 -2.05 1.82 -1.93 -2.19 116.42 112.91 1a4l h ASP 127 Ca 0.51 -0.04 0.02 0.00 -0.39 0.00 0.00 57.03 57.13 1a4l h ASP 127 Cb 0.56 -0.18 -0.04 0.00 0.68 0.00 0.00 39.33 40.34 1a4l h ASP 127 CO -0.29 0.56 0.56 0.44 -1.61 0.00 0.00 179.24 178.90 1a4l h ASP 128 N 0.85 0.95 0.36 2.28 3.32 -1.26 -1.09 116.42 121.84 1a4l h ASP 128 Ca 0.23 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 1a4l h ASP 128 Cb -0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1a4l h ASP 128 CO -0.05 0.68 -0.42 -0.37 -1.72 0.00 0.00 179.24 177.36 1a4l h VAL 129 N 1.12 1.31 -0.43 -1.35 -1.51 -0.64 -0.92 116.25 113.83 1a4l h VAL 129 Ca 0.32 -1.48 -0.14 0.00 -1.23 0.00 0.00 66.70 64.16 1a4l h VAL 129 Cb -0.09 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 30.81 1a4l h VAL 129 CO -0.08 0.43 -0.30 0.58 -1.23 0.00 0.00 177.57 176.98 1a4l h VAL 130 N 0.06 1.27 -0.25 7.19 2.07 -0.76 -1.26 116.25 124.57 1a4l h VAL 130 Ca 0.00 -1.47 -0.14 0.00 0.82 0.00 0.00 66.70 65.92 1a4l h VAL 130 Cb 0.77 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1a4l h VAL 130 CO 0.06 0.50 -0.41 -0.78 0.02 0.00 0.00 177.57 176.95 1a4l h ASP 131 N 0.79 0.64 -0.26 0.57 3.58 -0.94 -1.97 116.42 118.83 1a4l h ASP 131 Ca 0.09 -0.29 -0.03 0.00 0.42 0.00 0.00 57.03 57.22 1a4l h ASP 131 Cb 0.88 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 1a4l h ASP 131 CO 0.08 0.98 0.05 -0.07 -2.88 0.00 0.00 179.24 177.39 1a4l h LEU 132 N 0.49 0.41 -0.99 2.28 4.07 -1.03 -2.54 115.31 118.00 1a4l h LEU 132 Ca 0.04 -0.25 -0.04 0.00 0.08 0.00 0.00 57.88 57.71 1a4l h LEU 132 Cb 0.92 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 42.52 1a4l h LEU 132 CO 0.08 0.56 0.26 0.58 -1.08 0.00 0.00 178.44 178.84 1a4l h VAL 133 N 0.25 1.23 -0.21 1.22 2.07 -1.16 -2.26 116.25 117.39 1a4l h VAL 133 Ca 0.08 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 1a4l h VAL 133 Cb 0.32 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1a4l h VAL 133 CO 0.00 0.30 0.12 0.78 0.02 0.00 0.00 177.57 178.79 1a4l h ASN 134 N 0.96 0.26 0.06 0.57 -0.26 -1.27 -0.44 115.58 115.47 1a4l h ASN 134 Ca 0.22 -0.07 0.01 0.00 -0.56 0.00 0.00 56.30 55.91 1a4l h ASN 134 Cb 0.20 -0.07 -0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1a4l h ASN 134 CO -0.02 0.25 -0.12 1.56 -1.06 0.00 0.00 177.43 178.05 1a4l h GLN 135 N 0.24 -0.22 -0.18 0.81 4.20 -1.21 0.53 115.11 119.28 1a4l h GLN 135 Ca 0.08 0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.82 1a4l h GLN 135 Cb 0.05 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1a4l h GLN 135 CO -0.01 -0.15 0.04 0.78 -0.67 0.00 0.00 178.83 178.82 1a4l h GLY 136 N -0.23 0.20 0.99 3.46 0.00 -1.26 0.12 103.07 106.36 1a4l h GLY 136 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 1a4l h GLY 136 CO -0.08 -0.00 0.27 1.41 0.00 0.00 0.00 176.54 178.14 1a4l h LEU 137 N 0.11 0.82 -1.04 3.11 3.38 -0.92 0.67 115.31 121.43 1a4l h LEU 137 Ca 0.08 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1a4l h LEU 137 Cb 0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1a4l h LEU 137 CO -0.11 0.74 -0.13 1.56 0.09 0.00 0.00 178.44 180.60 1a4l h GLN 138 N 0.84 0.54 -0.09 1.13 4.20 -0.50 0.85 115.11 122.07 1a4l h GLN 138 Ca 0.21 -0.16 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 1a4l h GLN 138 Cb 0.16 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1a4l h GLN 138 CO -0.02 0.66 -0.67 0.93 -0.67 0.00 0.00 178.83 179.06 1a4l h GLU 139 N 0.49 0.39 -0.71 1.46 5.08 -0.46 -2.65 114.58 118.18 1a4l h GLU 139 Ca 0.09 -0.29 -0.06 0.00 -1.00 0.00 0.00 59.36 58.10 1a4l h GLU 139 Cb 0.52 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1a4l h GLU 139 CO 0.03 0.92 0.22 0.78 -1.00 0.00 0.00 179.01 179.96 1a4l h GLY 140 N 1.30 1.19 0.96 -3.84 0.00 -0.08 0.21 103.07 102.81 1a4l h GLY 140 Ca -0.02 -0.70 -0.04 0.00 0.00 0.00 0.00 47.33 46.57 1a4l h GLY 140 CO 0.11 0.66 -0.39 0.83 0.00 0.00 0.00 176.54 177.75 1a4l h GLU 141 N 1.05 -1.02 -0.50 4.80 5.08 -0.72 -0.43 114.58 122.84 1a4l h GLU 141 Ca 0.23 0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 1a4l h GLU 141 Cb 0.31 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1a4l h GLU 141 CO -0.01 -0.68 0.22 1.96 -1.00 0.00 0.00 179.01 179.51 1a4l h GLN 142 N -1.06 0.42 -0.39 2.33 7.50 -1.38 0.27 115.11 122.81 1a4l h GLN 142 Ca -0.10 -0.03 -0.08 0.00 0.50 0.00 0.00 58.65 58.94 1a4l h GLN 142 Cb 0.82 -0.10 -0.02 0.00 0.05 0.00 0.00 27.48 28.24 1a4l h GLN 142 CO 0.15 0.28 -0.09 0.00 -1.50 0.00 0.00 178.83 177.67 1a4l h ALA 143 N 1.30 1.12 0.00 3.87 0.00 -0.87 -3.34 119.26 121.33 1a4l h ALA 143 Ca 0.23 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1a4l h ALA 143 Cb 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1a4l h ALA 143 CO -0.19 0.55 -0.36 1.19 0.00 0.00 0.00 179.25 180.44 1a4l n PHE 144 N -4.19 0.00 -2.43 0.00 3.72 -0.18 -5.06 117.46 109.32 1a4l n PHE 144 Ca 0.01 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.37 1a4l n PHE 144 Cb 0.33 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.89 1a4l n PHE 144 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1a4l n GLY 145 N 1.19 0.40 3.06 1.37 0.00 0.94 -5.01 105.19 107.13 1a4l n GLY 145 Ca 0.01 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 1a4l n GLY 145 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1a4l s ILE 146 N -3.07 0.07 -0.07 -0.61 -4.36 -1.24 -5.00 121.20 106.92 1a4l s ILE 146 Ca 0.04 -0.59 -0.26 0.00 -0.26 0.00 0.00 60.65 59.57 1a4l s ILE 146 Cb -0.02 -0.34 -0.03 0.00 1.25 0.00 0.00 42.46 43.32 1a4l s ILE 146 CO 0.15 -0.33 0.85 -0.75 0.24 0.00 0.00 174.94 175.10 1a4l s LYS 147 N -1.10 4.44 -0.09 0.37 2.20 -0.40 -4.42 119.74 120.74 1a4l s LYS 147 Ca -0.12 1.13 0.01 0.00 -0.36 0.00 0.00 55.97 56.63 1a4l s LYS 147 Cb -0.07 -3.49 0.02 0.00 -1.51 0.00 0.00 37.83 32.78 1a4l s LYS 147 CO 0.01 -0.10 -0.11 0.08 -0.36 0.00 0.00 175.35 174.87 1a4l s VAL 148 N 1.29 1.16 0.24 4.02 1.01 -1.26 -2.12 120.40 124.74 1a4l s VAL 148 Ca 0.43 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 62.04 1a4l s VAL 148 Cb -0.19 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 1a4l s VAL 148 CO 0.20 0.37 -0.11 -0.13 0.00 0.00 0.00 175.10 175.43 1a4l s ARG 149 N 1.02 1.43 0.32 2.72 1.81 -0.48 -4.87 118.95 120.90 1a4l s ARG 149 Ca -0.08 -1.68 0.10 0.00 -1.72 0.00 0.00 55.73 52.36 1a4l s ARG 149 Cb -0.15 -1.15 -0.06 0.00 -0.45 0.00 0.00 34.95 33.15 1a4l s ARG 149 CO -0.01 0.13 -0.11 -1.54 -0.68 0.00 0.00 175.30 173.09 1a4l s SER 150 N -3.37 3.79 -0.03 0.23 1.04 0.41 -0.97 113.70 114.80 1a4l s SER 150 Ca 0.26 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1a4l s SER 150 Cb 0.01 -0.39 0.03 0.00 0.10 0.00 0.00 66.02 65.77 1a4l s SER 150 CO 0.09 -0.11 0.02 -0.63 0.98 0.00 0.00 173.24 173.59 1a4l s ILE 151 N -2.55 0.06 -0.20 -1.02 1.01 0.19 -0.48 121.20 118.22 1a4l s ILE 151 Ca 0.32 0.16 -0.16 0.00 0.00 0.00 0.00 60.65 60.97 1a4l s ILE 151 Cb -0.01 -0.19 -0.04 0.00 0.01 0.00 0.00 42.46 42.23 1a4l s ILE 151 CO 0.17 0.12 0.42 -0.76 0.00 0.00 0.00 174.94 174.89 1a4l s LEU 152 N 1.12 4.16 -0.14 2.97 1.43 -0.97 -2.24 118.68 125.01 1a4l s LEU 152 Ca -0.08 0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 53.36 1a4l s LEU 152 Cb -0.13 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 1a4l s LEU 152 CO -0.02 -0.09 0.59 0.00 0.23 0.00 0.00 176.35 177.06 1a4l s MET 155 N -0.97 4.08 0.40 0.00 -1.94 -1.26 -0.72 119.30 118.88 1a4l s MET 155 Ca 0.35 -0.00 0.21 0.00 -1.71 0.00 0.00 55.69 54.53 1a4l s MET 155 Cb -0.22 -3.59 1.19 0.00 2.01 0.00 0.00 34.83 34.22 1a4l s MET 155 CO 0.24 -0.11 1.70 0.00 -0.01 0.00 0.00 175.02 176.84 1a4l h ARG 156 N 7.77 0.28 -0.01 2.03 3.08 -1.17 0.10 114.38 126.48 1a4l h ARG 156 Ca -0.35 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1a4l h ARG 156 Cb 1.17 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1a4l h ARG 156 CO 0.66 0.19 -0.06 -2.39 -1.07 0.00 0.00 179.97 177.30 1a4l n HIS 157 N -4.75 0.00 -3.49 3.04 1.44 -1.26 -4.51 115.22 105.70 1a4l n HIS 157 Ca 0.30 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.74 1a4l n HIS 157 Cb 1.07 -0.06 -0.11 0.00 0.12 0.00 0.00 29.99 31.00 1a4l n HIS 157 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1a4l s GLN 158 N -2.19 0.99 0.13 -1.40 -1.52 0.36 -4.96 119.66 111.07 1a4l s GLN 158 Ca 0.36 -2.01 0.25 0.00 -1.95 0.00 0.00 55.36 52.01 1a4l s GLN 158 Cb 0.21 -1.65 0.94 0.00 -0.22 0.00 0.00 33.01 32.28 1a4l s GLN 158 CO 0.40 -1.31 1.76 -2.30 -0.25 0.00 0.00 175.29 173.60 1a4l n PRO 159 N 3.14 0.14 0.20 2.91 -0.02 -1.26 -3.18 135.00 136.94 1a4l n PRO 159 Ca 0.22 0.20 0.08 0.00 -2.02 0.00 0.00 63.50 61.98 1a4l n PRO 159 Cb 0.43 -1.69 0.38 0.00 -0.02 0.00 0.00 33.50 32.60 1a4l n PRO 159 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1a4l h SER 160 N 0.00 0.00 1.74 2.55 4.64 -1.93 -2.89 113.55 117.66 1a4l h SER 160 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1a4l h SER 160 Cb 0.53 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1a4l h SER 160 CO 0.00 0.31 -0.09 -0.50 -0.87 0.00 0.00 176.83 175.68 1a4l h TRP 161 N 0.00 0.00 -0.27 4.77 6.55 -1.94 -3.38 115.95 121.68 1a4l h TRP 161 Ca -0.00 0.00 0.05 0.00 0.95 0.00 0.00 58.89 59.89 1a4l h TRP 161 Cb 0.84 0.00 -0.05 0.00 -0.86 0.00 0.00 29.16 29.09 1a4l h TRP 161 CO 0.00 0.09 -0.03 0.77 -1.05 0.00 0.00 178.44 178.21 1a4l h SER 162 N 0.00 -0.18 0.39 -3.49 0.02 -1.65 -0.65 113.55 107.99 1a4l h SER 162 Ca -0.00 0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 1a4l h SER 162 Cb 0.98 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1a4l h SER 162 CO 0.01 -0.05 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.31 1a4l h LEU 163 N 0.04 0.00 -0.39 5.07 3.38 -1.76 -1.81 115.31 119.84 1a4l h LEU 163 Ca 0.13 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 1a4l h LEU 163 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1a4l h LEU 163 CO -0.24 0.27 -0.68 -0.08 0.09 0.00 0.00 178.44 177.79 1a4l h GLU 164 N 0.00 0.53 -0.38 1.13 4.81 -1.68 -2.48 114.58 116.51 1a4l h GLU 164 Ca -0.00 -0.40 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 1a4l h GLU 164 Cb 0.53 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1a4l h GLU 164 CO 0.03 1.02 0.17 0.28 -0.73 0.00 0.00 179.01 179.79 1a4l h VAL 165 N 0.37 1.18 -0.82 0.32 2.07 -0.57 -2.27 116.25 116.53 1a4l h VAL 165 Ca -0.02 -0.51 0.15 0.00 0.82 0.00 0.00 66.70 67.13 1a4l h VAL 165 Cb 1.26 0.81 -0.10 0.00 -1.52 0.00 0.00 31.29 31.75 1a4l h VAL 165 CO 0.13 0.19 0.39 0.25 0.02 0.00 0.00 177.57 178.54 1a4l h LEU 166 N 0.47 0.43 -0.64 2.57 5.85 -1.14 0.24 115.31 123.08 1a4l h LEU 166 Ca 0.13 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.85 1a4l h LEU 166 Cb 0.14 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1a4l h LEU 166 CO -0.01 0.16 -0.08 -0.33 -0.34 0.00 0.00 178.44 177.84 1a4l h GLU 167 N 0.54 0.98 -0.79 1.25 4.39 -1.12 -2.11 114.58 117.72 1a4l h GLU 167 Ca 0.45 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.77 1a4l h GLU 167 Cb 0.68 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.22 1a4l h GLU 167 CO -0.39 1.01 0.33 -0.07 -1.16 0.00 0.00 179.01 178.73 1a4l h LEU 168 N 0.88 1.08 -1.11 1.33 -0.00 -0.42 0.12 115.31 117.18 1a4l h LEU 168 Ca 0.14 -0.17 -0.05 0.00 -0.00 0.00 0.00 57.88 57.81 1a4l h LEU 168 Cb 0.63 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 40.98 1a4l h LEU 168 CO 0.04 0.95 0.11 0.00 -0.00 0.00 0.00 178.44 179.54 1a4l h LYS 170 N 0.72 -0.08 -0.24 0.00 1.57 -0.77 -2.46 116.57 115.31 1a4l h LYS 170 Ca 0.16 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1a4l h LYS 170 Cb 0.27 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.57 1a4l h LYS 170 CO -0.00 0.37 0.05 -0.22 -0.57 0.00 0.00 179.45 179.08 1a4l h LYS 171 N -0.57 0.14 -0.99 3.15 3.64 -0.56 -2.76 116.57 118.62 1a4l h LYS 171 Ca -0.01 -0.01 -0.66 0.00 -1.27 0.00 0.00 60.65 58.70 1a4l h LYS 171 Cb 0.49 -0.03 -0.29 0.00 -0.41 0.00 0.00 32.23 31.98 1a4l h LYS 171 CO 0.01 0.09 0.81 0.66 -2.27 0.00 0.00 179.45 178.76 1a4l n TYR 172 N -5.08 3.20 -1.70 1.91 4.01 -0.03 -4.95 117.16 114.52 1a4l n TYR 172 Ca -0.02 -2.90 -0.42 0.00 -0.16 0.00 0.00 57.90 54.41 1a4l n TYR 172 Cb 0.10 -1.38 -0.03 0.00 -0.31 0.00 0.00 39.34 37.72 1a4l n TYR 172 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1a4l s ASN 173 N -1.82 6.38 0.00 7.72 3.84 -0.93 -2.14 114.94 127.99 1a4l s ASN 173 Ca 0.64 2.55 0.00 0.00 0.21 0.00 0.00 52.86 56.26 1a4l s ASN 173 Cb 0.50 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.68 1a4l s ASN 173 CO 0.00 -1.13 0.00 0.00 -2.79 0.00 0.00 177.10 173.18 1a4l n GLN 174 N 7.62 0.00 -1.87 0.43 1.13 0.86 -4.73 117.38 120.82 1a4l n GLN 174 Ca 0.21 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.86 1a4l n GLN 174 Cb 0.42 -3.28 -0.01 0.00 0.11 0.00 0.00 30.24 27.47 1a4l n GLN 174 CO 0.00 0.00 0.00 1.17 -1.44 0.00 0.00 177.06 176.79 1a4l n LYS 175 N -1.91 4.24 0.00 -1.09 4.81 -0.91 -4.59 118.16 118.70 1a4l n LYS 175 Ca 0.00 -3.16 0.00 0.00 -0.87 0.00 0.00 58.31 54.28 1a4l n LYS 175 Cb 0.00 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.33 1a4l n LYS 175 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1a4l n THR 176 N 2.42 0.00 -1.99 3.15 -2.24 -1.26 -4.86 114.28 109.51 1a4l n THR 176 Ca 0.63 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.99 1a4l n THR 176 Cb 0.26 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 1a4l n THR 176 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1a4l s VAL 177 N 0.00 3.54 -0.03 2.28 1.01 -1.10 -0.44 120.40 125.66 1a4l s VAL 177 Ca 0.00 0.63 0.11 0.00 0.00 0.00 0.00 61.98 62.72 1a4l s VAL 177 Cb 0.00 -3.49 -0.17 0.00 0.00 0.00 0.00 36.38 32.72 1a4l s VAL 177 CO 0.00 -0.15 0.23 1.33 0.00 0.00 0.00 175.10 176.51 1a4l n VAL 178 N 6.05 0.09 -3.87 2.92 0.24 0.37 -0.10 118.33 124.02 1a4l n VAL 178 Ca 0.19 -0.29 -0.09 0.00 -2.04 0.00 0.00 64.34 62.11 1a4l n VAL 178 Cb 0.44 0.12 -0.00 0.00 -1.47 0.00 0.00 33.84 32.93 1a4l n VAL 178 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1a4l s ALA 179 N -2.74 -0.60 -0.04 2.33 0.00 -1.25 -3.88 121.76 115.59 1a4l s ALA 179 Ca -0.04 -0.77 0.07 0.00 0.00 0.00 0.00 51.96 51.21 1a4l s ALA 179 Cb 0.07 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.99 1a4l s ALA 179 CO 0.48 -0.96 -0.24 1.41 0.00 0.00 0.00 175.76 176.45 1a4l s MET 180 N -2.90 2.16 0.37 0.00 1.75 -0.17 -2.29 119.30 118.23 1a4l s MET 180 Ca 0.17 -0.86 0.07 0.00 -1.25 0.00 0.00 55.69 53.83 1a4l s MET 180 Cb -0.04 -1.97 -0.07 0.00 2.84 0.00 0.00 34.83 35.59 1a4l s MET 180 CO 0.12 0.45 -0.02 0.34 -0.65 0.00 0.00 175.02 175.25 1a4l s ASP 181 N -0.37 3.59 -0.26 1.11 2.15 -0.19 -1.02 116.67 121.69 1a4l s ASP 181 Ca 0.03 -1.31 -0.01 0.00 0.43 0.00 0.00 52.55 51.69 1a4l s ASP 181 Cb -0.11 -0.33 0.08 0.00 -0.30 0.00 0.00 42.92 42.25 1a4l s ASP 181 CO 0.01 -0.39 0.05 -0.22 -0.17 0.00 0.00 175.17 174.45 1a4l s LEU 182 N -3.64 1.99 0.50 -1.34 2.96 -1.20 0.08 118.68 118.03 1a4l s LEU 182 Ca 0.34 -1.29 0.02 0.00 -0.22 0.00 0.00 54.13 52.98 1a4l s LEU 182 Cb 0.07 -0.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.90 1a4l s LEU 182 CO 0.17 -0.35 0.03 0.00 -1.32 0.00 0.00 176.35 174.89 1a4l s ALA 183 N 1.65 4.04 0.00 5.97 0.00 0.10 -2.33 121.76 131.19 1a4l s ALA 183 Ca 0.03 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.35 1a4l s ALA 183 Cb -0.17 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1a4l s ALA 183 CO -0.16 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1a4l n GLY 184 N -1.27 0.31 3.47 0.00 0.00 -1.26 -0.51 105.19 105.92 1a4l n GLY 184 Ca -0.16 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.32 1a4l n GLY 184 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4l s ASP 185 N -4.00 6.24 0.27 1.61 -1.08 -1.26 -4.87 116.67 113.57 1a4l s ASP 185 Ca 0.00 -1.07 0.22 0.00 -0.52 0.00 0.00 52.55 51.17 1a4l s ASP 185 Cb 0.00 -2.44 1.01 0.00 -1.46 0.00 0.00 42.92 40.03 1a4l s ASP 185 CO 0.00 -1.45 1.66 1.21 0.52 0.00 0.00 175.17 177.11 1a4l n GLU 186 N 7.84 0.16 0.06 4.34 2.13 -1.26 -2.04 120.64 131.87 1a4l n GLU 186 Ca 0.02 0.50 0.11 0.00 0.66 0.00 0.00 57.16 58.45 1a4l n GLU 186 Cb 0.47 -1.88 0.43 0.00 0.27 0.00 0.00 31.44 30.73 1a4l n GLU 186 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1a4l n THR 187 N -2.20 0.73 -2.03 6.31 -2.24 -1.26 -4.59 114.28 109.00 1a4l n THR 187 Ca 0.01 0.13 -0.39 0.00 -2.27 0.00 0.00 64.05 61.53 1a4l n THR 187 Cb 0.15 -0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 67.43 1a4l n THR 187 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1a4l s ILE 188 N -3.12 3.36 -0.29 2.28 1.01 -0.87 -4.90 121.20 118.68 1a4l s ILE 188 Ca 0.08 0.24 -0.41 0.00 0.00 0.00 0.00 60.65 60.55 1a4l s ILE 188 Cb 0.11 -3.89 -0.16 0.00 0.01 0.00 0.00 42.46 38.53 1a4l s ILE 188 CO 0.40 -0.83 1.72 1.21 0.00 0.00 0.00 174.94 177.43 1a4l n GLU 189 N 9.09 1.03 -1.04 2.79 2.13 -1.26 -1.54 120.64 131.85 1a4l n GLU 189 Ca 0.21 0.38 -0.01 0.00 0.66 0.00 0.00 57.16 58.40 1a4l n GLU 189 Cb 0.52 -2.04 -0.01 0.00 0.27 0.00 0.00 31.44 30.18 1a4l n GLU 189 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1a4l n GLY 190 N 4.14 0.43 0.25 8.31 0.00 -1.26 -4.91 105.19 112.16 1a4l n GLY 190 Ca 0.27 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1a4l n GLY 190 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1a4l h SER 191 N 0.00 0.00 -0.35 1.61 4.64 -1.63 -1.69 113.55 116.13 1a4l h SER 191 Ca -0.03 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.32 1a4l h SER 191 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1a4l h SER 191 CO 0.04 0.07 0.24 0.28 -0.87 0.00 0.00 176.83 176.59 1a4l h SER 192 N 0.00 0.34 -0.43 4.97 0.02 -1.91 -2.79 113.55 113.75 1a4l h SER 192 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1a4l h SER 192 Cb 0.13 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1a4l h SER 192 CO 0.01 0.24 0.00 0.18 -1.14 0.00 0.00 176.83 176.12 1a4l n LEU 193 N -4.49 2.80 -4.74 5.07 4.32 -0.64 -4.35 117.00 114.97 1a4l n LEU 193 Ca 0.03 -1.31 -0.42 0.00 -0.02 0.00 0.00 56.01 54.29 1a4l n LEU 193 Cb 0.13 -0.29 -0.02 0.00 -1.62 0.00 0.00 43.42 41.63 1a4l n LEU 193 CO 0.35 0.66 1.27 0.49 -1.22 0.00 0.00 177.39 178.93 1a4l n PHE 194 N 1.04 2.80 -0.31 -1.77 3.72 -1.06 -4.73 117.46 117.16 1a4l n PHE 194 Ca 0.18 0.21 0.16 0.00 -0.05 0.00 0.00 57.45 57.94 1a4l n PHE 194 Cb 0.47 -2.61 0.33 0.00 -0.94 0.00 0.00 39.48 36.73 1a4l n PHE 194 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1a4l h PRO 195 N 5.29 0.15 -0.85 -1.08 0.11 -1.92 0.76 132.00 134.46 1a4l h PRO 195 Ca -0.46 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.70 1a4l h PRO 195 Cb 1.22 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1a4l h PRO 195 CO 0.83 0.10 0.53 0.78 -0.21 0.00 0.00 178.00 180.04 1a4l h GLY 196 N 0.16 1.27 0.42 -0.55 0.00 -1.89 0.17 103.07 102.65 1a4l h GLY 196 Ca 0.60 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 1a4l h GLY 196 CO -0.71 0.29 -0.02 0.45 0.00 0.00 0.00 176.54 176.54 1a4l h HIS 197 N 0.99 -0.06 -0.19 5.60 3.86 -1.10 -2.73 115.15 121.53 1a4l h HIS 197 Ca 0.36 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 59.62 1a4l h HIS 197 Cb 0.12 0.02 -0.07 0.00 1.06 0.00 0.00 27.41 28.54 1a4l h HIS 197 CO -0.03 0.48 -0.43 0.28 0.86 0.00 0.00 177.93 179.10 1a4l h VAL 198 N -0.64 0.13 -0.91 2.45 2.07 -0.92 -1.04 116.25 117.38 1a4l h VAL 198 Ca -0.01 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.67 1a4l h VAL 198 Cb 0.57 0.13 -0.10 0.00 -1.52 0.00 0.00 31.29 30.37 1a4l h VAL 198 CO 0.01 0.00 0.51 -0.33 0.02 0.00 0.00 177.57 177.78 1a4l h GLU 199 N -0.46 0.70 -0.16 1.57 5.08 -0.74 -0.38 114.58 120.20 1a4l h GLU 199 Ca 0.09 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1a4l h GLU 199 Cb 0.62 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1a4l h GLU 199 CO -0.44 0.46 0.07 0.00 -1.00 0.00 0.00 179.01 178.11 1a4l h ALA 200 N 1.58 0.20 -0.37 3.43 0.00 -0.89 -1.14 119.26 122.06 1a4l h ALA 200 Ca 0.50 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 55.18 1a4l h ALA 200 Cb 0.69 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1a4l h ALA 200 CO -0.35 -0.23 -0.34 1.88 0.00 0.00 0.00 179.25 180.20 1a4l h TYR 201 N 0.12 1.00 -0.80 0.00 -1.99 -0.70 -0.71 116.97 113.89 1a4l h TYR 201 Ca 0.05 -0.28 0.02 0.00 2.00 0.00 0.00 58.73 60.52 1a4l h TYR 201 Cb 0.13 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 38.59 1a4l h TYR 201 CO -0.03 1.06 0.52 0.93 -0.00 0.00 0.00 178.16 180.65 1a4l h GLU 202 N 0.70 1.02 -0.19 4.88 5.08 -1.00 -0.65 114.58 124.42 1a4l h GLU 202 Ca 0.07 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1a4l h GLU 202 Cb 0.90 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1a4l h GLU 202 CO 0.08 0.67 -0.28 0.78 -1.00 0.00 0.00 179.01 179.26 1a4l h GLY 203 N 1.05 0.40 1.20 -3.84 0.00 -0.98 -2.17 103.07 98.73 1a4l h GLY 203 Ca 0.30 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1a4l h GLY 203 CO -0.08 0.30 0.11 0.00 0.00 0.00 0.00 176.54 176.86 1a4l h ALA 204 N 1.38 1.03 -0.50 3.60 0.00 0.28 -1.21 119.26 123.84 1a4l h ALA 204 Ca 0.05 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1a4l h ALA 204 Cb 0.67 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1a4l h ALA 204 CO 0.05 0.62 0.08 0.28 0.00 0.00 0.00 179.25 180.29 1a4l h VAL 205 N 0.93 1.25 0.00 0.00 2.07 -0.78 0.41 116.25 120.13 1a4l h VAL 205 Ca 0.19 -0.93 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 1a4l h VAL 205 Cb 0.39 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1a4l h VAL 205 CO 0.01 0.33 -0.31 0.11 0.02 0.00 0.00 177.57 177.73 1a4l h LYS 206 N 0.71 0.00 -0.48 1.57 1.57 -1.09 -3.13 116.57 115.71 1a4l h LYS 206 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1a4l h LYS 206 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1a4l h LYS 206 CO 0.01 0.31 0.00 0.09 -0.57 0.00 0.00 179.45 179.29 1a4l n ASN 207 N -3.91 3.61 -0.82 0.86 3.02 -0.48 -4.98 115.26 112.56 1a4l n ASN 207 Ca -0.02 -2.20 -0.11 0.00 -0.03 0.00 0.00 54.58 52.23 1a4l n ASN 207 Cb 0.38 -0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 39.11 1a4l n ASN 207 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4l n GLY 208 N 0.78 1.14 3.71 7.41 0.00 -0.06 -4.97 105.19 113.20 1a4l n GLY 208 Ca 0.18 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1a4l n GLY 208 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a4l s ILE 209 N -2.19 4.90 0.46 -0.61 -1.09 -0.08 -5.01 121.20 117.58 1a4l s ILE 209 Ca 0.00 1.94 -0.23 0.00 -2.23 0.00 0.00 60.65 60.13 1a4l s ILE 209 Cb 0.00 -4.27 -0.07 0.00 -1.58 0.00 0.00 42.46 36.54 1a4l s ILE 209 CO 0.00 0.17 1.24 -1.00 -1.23 0.00 0.00 174.94 174.12 1a4l s HIS 210 N 1.00 2.74 0.06 3.97 3.76 -1.25 -4.42 115.29 121.15 1a4l s HIS 210 Ca 0.49 1.48 0.09 0.00 -0.15 0.00 0.00 55.06 56.96 1a4l s HIS 210 Cb -0.20 -3.53 -0.03 0.00 1.11 0.00 0.00 32.58 29.93 1a4l s HIS 210 CO 0.26 -1.92 -0.24 1.03 -0.85 0.00 0.00 174.74 173.02 1a4l s ARG 211 N -2.63 1.57 -0.03 1.40 0.52 -1.26 -1.00 118.95 117.51 1a4l s ARG 211 Ca 0.64 -1.08 -0.06 0.00 -0.52 0.00 0.00 55.73 54.71 1a4l s ARG 211 Cb -0.33 -1.76 0.01 0.00 0.52 0.00 0.00 34.95 33.38 1a4l s ARG 211 CO 0.41 0.45 0.14 -0.08 0.02 0.00 0.00 175.30 176.23 1a4l s THR 212 N -0.85 0.03 -0.04 0.02 -1.32 -0.18 -2.19 115.64 111.10 1a4l s THR 212 Ca 0.10 -0.28 -0.04 0.00 -1.21 0.00 0.00 61.69 60.27 1a4l s THR 212 Cb -0.10 -0.30 0.01 0.00 -1.51 0.00 0.00 72.50 70.61 1a4l s THR 212 CO 0.03 -0.15 0.10 -0.69 -2.21 0.00 0.00 174.62 171.69 1a4l s VAL 213 N -0.50 -0.00 -0.03 5.08 1.01 -1.22 -3.26 120.40 121.48 1a4l s VAL 213 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.64 1a4l s VAL 213 Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 1a4l s VAL 213 CO 0.01 0.00 0.95 -1.00 0.00 0.00 0.00 175.10 175.06 1a4l s HIS 214 N 0.08 3.62 -0.20 5.22 3.76 -0.98 -0.01 115.29 126.78 1a4l s HIS 214 Ca -0.00 1.62 -0.28 0.00 -0.15 0.00 0.00 55.06 56.25 1a4l s HIS 214 Cb -0.01 -3.09 0.11 0.00 1.11 0.00 0.00 32.58 30.70 1a4l s HIS 214 CO 0.00 -0.04 0.95 0.00 -0.85 0.00 0.00 174.74 174.80 1a4l s ALA 215 N 1.19 -1.92 -0.08 -1.40 0.00 -0.79 -4.89 121.76 113.87 1a4l s ALA 215 Ca 0.49 1.69 0.00 0.00 0.00 0.00 0.00 51.96 54.14 1a4l s ALA 215 Cb -0.20 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.00 1a4l s ALA 215 CO 0.25 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1a4l n GLY 216 N 1.43 0.42 0.13 0.00 0.00 -1.26 -0.67 105.19 105.23 1a4l n GLY 216 Ca -0.12 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 1a4l n GLY 216 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1a4l h GLU 217 N 0.63 -0.19 0.00 1.61 4.81 -1.91 -1.41 114.58 118.12 1a4l h GLU 217 Ca -0.02 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1a4l h GLU 217 Cb 0.29 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1a4l h GLU 217 CO 0.02 0.25 -0.64 0.28 -0.73 0.00 0.00 179.01 178.19 1a4l n VAL 218 N -4.90 0.00 -2.13 0.32 0.31 -1.26 -4.54 118.33 106.12 1a4l n VAL 218 Ca -0.07 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 63.99 1a4l n VAL 218 Cb 0.26 0.30 0.09 0.00 -0.91 0.00 0.00 33.84 33.58 1a4l n VAL 218 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1a4l s GLY 219 N -1.30 1.68 0.93 2.92 0.00 -1.26 -5.02 107.32 105.27 1a4l s GLY 219 Ca 0.00 -0.95 -0.13 0.00 0.00 0.00 0.00 44.72 43.64 1a4l s GLY 219 CO 0.00 -0.48 1.14 -1.35 0.00 0.00 0.00 173.10 172.41 1a4l s SER 220 N -4.59 3.29 0.20 1.64 1.04 -1.26 -4.18 113.70 109.85 1a4l s SER 220 Ca 0.63 0.93 0.18 0.00 0.48 0.00 0.00 55.95 58.17 1a4l s SER 220 Cb -0.10 -1.47 0.85 0.00 0.10 0.00 0.00 66.02 65.40 1a4l s SER 220 CO 0.46 -2.68 1.56 -0.81 0.98 0.00 0.00 173.24 172.75 1a4l n PRO 221 N -3.85 0.12 0.20 4.02 -0.04 -1.26 -1.48 135.00 132.71 1a4l n PRO 221 Ca 0.07 0.48 0.06 0.00 -0.04 0.00 0.00 63.50 64.07 1a4l n PRO 221 Cb 0.59 -1.79 0.41 0.00 -0.04 0.00 0.00 33.50 32.67 1a4l n PRO 221 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1a4l h GLU 222 N 0.00 0.00 0.04 0.54 4.57 -1.93 -1.43 114.58 116.36 1a4l h GLU 222 Ca 0.00 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.96 1a4l h GLU 222 Cb 0.18 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1a4l h GLU 222 CO 0.00 0.33 -1.01 0.28 -1.18 0.00 0.00 179.01 177.43 1a4l h VAL 223 N 0.00 1.57 -0.23 0.32 2.07 -1.61 -2.55 116.25 115.82 1a4l h VAL 223 Ca -0.00 -3.00 -0.11 0.00 0.82 0.00 0.00 66.70 64.40 1a4l h VAL 223 Cb 0.74 2.72 -0.01 0.00 -1.52 0.00 0.00 31.29 33.22 1a4l h VAL 223 CO 0.04 0.87 -0.34 0.58 0.02 0.00 0.00 177.57 178.74 1a4l h VAL 224 N 0.06 1.29 -0.19 2.57 2.07 -1.45 -1.97 116.25 118.63 1a4l h VAL 224 Ca -0.06 -1.45 -0.11 0.00 0.82 0.00 0.00 66.70 65.91 1a4l h VAL 224 Cb 1.71 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.95 1a4l h VAL 224 CO 0.15 0.45 -0.36 -0.09 0.02 0.00 0.00 177.57 177.74 1a4l h ARG 225 N 0.42 0.40 -0.40 1.57 2.43 -1.22 -0.54 114.38 117.04 1a4l h ARG 225 Ca 0.05 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 58.95 1a4l h ARG 225 Cb 0.80 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1a4l h ARG 225 CO 0.06 0.71 -0.08 0.93 -1.51 0.00 0.00 179.97 180.08 1a4l h GLU 226 N 0.34 0.76 -0.39 0.20 5.08 -1.01 0.22 114.58 119.78 1a4l h GLU 226 Ca 0.04 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1a4l h GLU 226 Cb 0.80 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1a4l h GLU 226 CO 0.06 0.89 0.25 0.00 -1.00 0.00 0.00 179.01 179.22 1a4l h ALA 227 N 0.85 0.49 0.24 3.43 0.00 -1.11 0.38 119.26 123.54 1a4l h ALA 227 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1a4l h ALA 227 Cb 0.60 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1a4l h ALA 227 CO 0.04 -0.05 -0.11 0.28 0.00 0.00 0.00 179.25 179.41 1a4l h VAL 228 N 0.52 0.66 0.01 0.00 2.07 -0.98 0.97 116.25 119.50 1a4l h VAL 228 Ca 0.14 -0.93 -0.16 0.00 0.82 0.00 0.00 66.70 66.57 1a4l h VAL 228 Cb -0.05 1.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1a4l h VAL 228 CO -0.03 0.16 -0.64 0.44 0.02 0.00 0.00 177.57 177.51 1a4l h ASP 229 N -0.90 0.55 0.00 0.57 3.32 -0.61 -3.02 116.42 116.33 1a4l h ASP 229 Ca -0.03 -0.78 -0.23 0.00 0.02 0.00 0.00 57.03 56.01 1a4l h ASP 229 Cb 0.50 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 1a4l h ASP 229 CO 0.05 1.25 -1.36 -0.38 -1.72 0.00 0.00 179.24 177.09 1a4l n ILE 230 N -4.19 1.52 0.38 0.35 2.08 -0.01 -4.48 119.36 115.01 1a4l n ILE 230 Ca -0.11 -0.05 0.14 0.00 0.56 0.00 0.00 62.75 63.29 1a4l n ILE 230 Cb 0.70 -2.07 0.44 0.00 -0.75 0.00 0.00 39.64 37.96 1a4l n ILE 230 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1a4l h LEU 231 N -1.00 0.00 -0.48 1.39 4.07 -1.00 -3.45 115.31 114.84 1a4l h LEU 231 Ca -0.35 0.00 -0.38 0.00 0.08 0.00 0.00 57.88 57.22 1a4l h LEU 231 Cb 1.24 0.00 0.12 0.00 1.08 0.00 0.00 40.66 43.10 1a4l h LEU 231 CO -0.21 0.00 -0.63 0.29 -1.08 0.00 0.00 178.44 176.80 1a4l n LYS 232 N -2.67 -7.02 -1.63 1.13 4.76 0.28 -4.75 118.16 108.26 1a4l n LYS 232 Ca 0.03 0.81 -0.36 0.00 -2.87 0.00 0.00 58.31 55.92 1a4l n LYS 232 Cb 0.37 -5.72 0.08 0.00 -1.84 0.00 0.00 35.03 27.93 1a4l n LYS 232 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1a4l s THR 233 N -3.27 2.12 -0.22 -0.18 -4.23 -0.86 -4.81 115.64 104.18 1a4l s THR 233 Ca 0.51 0.07 0.09 0.00 -1.18 0.00 0.00 61.69 61.17 1a4l s THR 233 Cb -0.22 -2.89 -0.21 0.00 1.34 0.00 0.00 72.50 70.52 1a4l s THR 233 CO 0.63 -0.02 -0.04 -0.62 -0.54 0.00 0.00 174.62 174.03 1a4l n GLU 234 N -2.21 0.67 -4.47 3.99 1.02 -0.93 -4.87 120.64 113.84 1a4l n GLU 234 Ca 0.15 0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 57.16 1a4l n GLU 234 Cb 0.49 -1.54 -0.11 0.00 -0.02 0.00 0.00 31.44 30.26 1a4l n GLU 234 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1a4l s ARG 235 N -2.51 1.65 -0.14 3.49 0.52 -1.23 -3.95 118.95 116.78 1a4l s ARG 235 Ca -0.23 -1.88 -0.01 0.00 -0.52 0.00 0.00 55.73 53.09 1a4l s ARG 235 Cb 0.08 -1.13 0.04 0.00 0.52 0.00 0.00 34.95 34.45 1a4l s ARG 235 CO 0.71 -0.05 -0.01 0.08 0.02 0.00 0.00 175.30 176.05 1a4l s VAL 236 N -3.06 0.72 -0.24 3.52 1.01 -0.40 -3.38 120.40 118.58 1a4l s VAL 236 Ca 0.33 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 1a4l s VAL 236 Cb 0.06 -0.96 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 1a4l s VAL 236 CO 0.14 0.10 1.40 -0.83 0.00 0.00 0.00 175.10 175.92 1a4l s GLY 237 N 1.81 1.40 0.00 4.51 0.00 0.98 -0.66 107.32 115.36 1a4l s GLY 237 Ca 0.02 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.07 1a4l s GLY 237 CO -0.07 2.71 0.00 1.42 0.00 0.00 0.00 173.10 177.16 1a4l n HIS 238 N 7.63 0.00 -1.15 1.90 8.25 0.61 -1.89 115.22 130.57 1a4l n HIS 238 Ca 0.16 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.57 1a4l n HIS 238 Cb 0.46 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.54 1a4l n HIS 238 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a4l n GLY 239 N 0.00 0.78 0.35 -1.41 0.00 0.15 -4.43 105.19 100.63 1a4l n GLY 239 Ca 0.00 -0.68 0.04 0.00 0.00 0.00 0.00 46.02 45.38 1a4l n GLY 239 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1a4l h TYR 240 N 0.00 0.84 0.00 1.61 0.05 -1.58 -2.26 116.97 115.63 1a4l h TYR 240 Ca -0.11 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.69 1a4l h TYR 240 Cb 0.38 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1a4l h TYR 240 CO 0.17 0.48 0.00 0.72 -1.05 0.00 0.00 178.16 178.49 1a4l n HIS 241 N -4.46 0.00 -0.33 4.88 8.25 -0.61 -3.70 115.22 119.24 1a4l n HIS 241 Ca 0.09 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.65 1a4l n HIS 241 Cb 0.13 -0.46 0.29 0.00 1.12 0.00 0.00 29.99 31.08 1a4l n HIS 241 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1a4l h THR 242 N 0.00 0.86 0.00 1.59 2.02 -1.67 -0.86 112.91 114.86 1a4l h THR 242 Ca 0.00 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.88 1a4l h THR 242 Cb 0.40 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1a4l h THR 242 CO 0.00 0.16 0.00 2.30 0.37 0.00 0.00 175.52 178.35 1a4l n ILE 243 N -4.62 1.11 0.69 3.11 -5.35 -1.24 -1.39 119.36 111.67 1a4l n ILE 243 Ca 0.19 0.28 0.13 0.00 -0.27 0.00 0.00 62.75 63.08 1a4l n ILE 243 Cb 0.42 -1.21 0.43 0.00 -1.74 0.00 0.00 39.64 37.55 1a4l n ILE 243 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1a4l n GLU 244 N -1.33 0.22 -3.93 6.28 1.02 -0.33 -4.04 120.64 118.53 1a4l n GLU 244 Ca 0.02 0.17 -0.30 0.00 -0.02 0.00 0.00 57.16 57.03 1a4l n GLU 244 Cb 0.04 -1.75 -0.14 0.00 -0.02 0.00 0.00 31.44 29.58 1a4l n GLU 244 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1a4l s ASP 245 N -4.24 4.40 0.24 1.62 -1.08 -0.49 -4.99 116.67 112.13 1a4l s ASP 245 Ca 0.11 -3.19 -0.09 0.00 -0.52 0.00 0.00 52.55 48.86 1a4l s ASP 245 Cb 0.14 -1.63 0.37 0.00 -1.46 0.00 0.00 42.92 40.34 1a4l s ASP 245 CO 0.59 -0.20 1.63 -0.33 0.52 0.00 0.00 175.17 177.38 1a4l h GLU 246 N 6.26 0.06 -0.65 4.34 4.39 -1.78 0.19 114.58 127.39 1a4l h GLU 246 Ca -0.03 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.71 1a4l h GLU 246 Cb 0.86 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.45 1a4l h GLU 246 CO 0.69 0.04 0.38 0.00 -1.16 0.00 0.00 179.01 178.96 1a4l h ALA 247 N 1.70 0.86 -0.29 3.43 0.00 -1.94 -0.14 119.26 122.88 1a4l h ALA 247 Ca 0.38 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 1a4l h ALA 247 Cb 0.64 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1a4l h ALA 247 CO -0.68 0.09 -0.17 1.25 0.00 0.00 0.00 179.25 179.74 1a4l h LEU 248 N 0.73 0.66 0.54 0.00 5.85 -1.62 -1.76 115.31 119.69 1a4l h LEU 248 Ca 0.28 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1a4l h LEU 248 Cb 0.11 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1a4l h LEU 248 CO -0.14 0.94 -0.42 0.22 -0.34 0.00 0.00 178.44 178.69 1a4l h TYR 249 N 0.38 -1.15 -0.05 1.25 3.20 -0.58 0.46 116.97 120.48 1a4l h TYR 249 Ca 0.06 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.94 1a4l h TYR 249 Cb 0.71 0.43 -0.00 0.00 1.54 0.00 0.00 36.73 39.41 1a4l h TYR 249 CO 0.06 -0.59 0.04 -0.91 -1.64 0.00 0.00 178.16 175.12 1a4l h ASN 250 N -0.93 0.00 -0.08 -2.11 -0.26 -1.11 0.42 115.58 111.52 1a4l h ASN 250 Ca -0.07 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.65 1a4l h ASN 250 Cb 0.77 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.03 1a4l h ASN 250 CO 0.01 0.00 -0.03 -0.09 -1.06 0.00 0.00 177.43 176.26 1a4l h ARG 251 N 0.00 0.17 -0.13 0.81 2.43 -0.92 0.14 114.38 116.88 1a4l h ARG 251 Ca 0.02 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1a4l h ARG 251 Cb 0.10 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1a4l h ARG 251 CO -0.00 0.52 -0.31 -0.07 -1.51 0.00 0.00 179.97 178.60 1a4l h LEU 252 N -0.19 0.24 -0.12 3.80 4.07 0.17 -1.53 115.31 121.76 1a4l h LEU 252 Ca 0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 57.88 1a4l h LEU 252 Cb 0.46 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 1a4l h LEU 252 CO 0.01 0.55 -0.00 0.25 -1.08 0.00 0.00 178.44 178.17 1a4l h LEU 253 N 0.21 0.20 -0.44 1.67 5.85 -0.05 -0.61 115.31 122.15 1a4l h LEU 253 Ca 0.03 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1a4l h LEU 253 Cb 0.66 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1a4l h LEU 253 CO 0.05 0.47 0.00 1.17 -0.34 0.00 0.00 178.44 179.79 1a4l n LYS 254 N -4.79 0.12 -0.06 1.25 4.81 0.46 -2.04 118.16 117.92 1a4l n LYS 254 Ca -0.06 0.36 0.11 0.00 -0.87 0.00 0.00 58.31 57.85 1a4l n LYS 254 Cb 0.21 -1.74 0.13 0.00 0.02 0.00 0.00 35.03 33.66 1a4l n LYS 254 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1a4l n GLU 255 N -1.97 2.28 -3.41 1.64 1.02 -0.59 -4.97 120.64 114.64 1a4l n GLU 255 Ca 0.03 -2.00 -0.20 0.00 -0.02 0.00 0.00 57.16 54.97 1a4l n GLU 255 Cb 0.21 -1.46 0.07 0.00 -0.02 0.00 0.00 31.44 30.24 1a4l n GLU 255 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1a4l n ASN 256 N 1.34 -5.59 -4.74 1.62 4.05 -0.86 -4.95 115.26 106.14 1a4l n ASN 256 Ca 0.15 -0.45 -0.42 0.00 0.45 0.00 0.00 54.58 54.32 1a4l n ASN 256 Cb 0.58 -4.26 -0.03 0.00 1.23 0.00 0.00 39.78 37.30 1a4l n ASN 256 CO 0.00 0.00 0.00 -0.32 -3.05 0.00 0.00 177.26 173.89 1a4l s MET 257 N -6.08 4.30 -0.13 1.20 -2.45 -0.29 -4.91 119.30 110.96 1a4l s MET 257 Ca 0.48 2.21 -0.17 0.00 -1.25 0.00 0.00 55.69 56.96 1a4l s MET 257 Cb -0.21 -3.16 -0.04 0.00 1.25 0.00 0.00 34.83 32.67 1a4l s MET 257 CO 0.60 -0.40 0.41 -1.58 1.05 0.00 0.00 175.02 175.11 1a4l s HIS 258 N 0.32 3.51 -0.20 4.11 2.46 -1.25 -4.18 115.29 120.05 1a4l s HIS 258 Ca 0.61 0.80 -0.05 0.00 0.47 0.00 0.00 55.06 56.89 1a4l s HIS 258 Cb -0.40 -2.47 -0.02 0.00 -0.13 0.00 0.00 32.58 29.56 1a4l s HIS 258 CO 0.39 0.22 -0.01 -0.06 -2.47 0.00 0.00 174.74 172.80 1a4l s PHE 259 N 0.48 3.02 -0.77 3.88 0.08 -0.48 -1.27 117.98 122.93 1a4l s PHE 259 Ca 0.23 -0.54 -0.22 0.00 0.12 0.00 0.00 56.93 56.53 1a4l s PHE 259 Cb -0.14 -2.08 0.09 0.00 -0.57 0.00 0.00 43.02 40.31 1a4l s PHE 259 CO 0.08 -0.29 1.06 -1.21 -0.10 0.00 0.00 175.22 174.77 1a4l s GLU 260 N 1.06 3.30 0.02 0.44 2.02 0.16 -1.70 118.70 124.00 1a4l s GLU 260 Ca 0.02 -1.12 -0.15 0.00 0.02 0.00 0.00 54.97 53.74 1a4l s GLU 260 Cb -0.14 -4.52 -0.06 0.00 0.10 0.00 0.00 34.13 29.51 1a4l s GLU 260 CO 0.01 -1.84 0.43 0.08 0.02 0.00 0.00 175.26 173.96 1a4l s VAL 261 N 3.76 4.99 -0.41 2.63 1.01 -0.20 -0.29 120.40 131.90 1a4l s VAL 261 Ca 0.27 0.86 0.01 0.00 0.00 0.00 0.00 61.98 63.13 1a4l s VAL 261 Cb -0.12 -3.73 0.14 0.00 0.00 0.00 0.00 36.38 32.67 1a4l s VAL 261 CO 0.03 0.55 0.23 0.00 0.00 0.00 0.00 175.10 175.91 1a4l h PRO 263 N 6.81 -0.59 0.16 0.00 0.11 -1.93 -1.68 132.00 134.89 1a4l h PRO 263 Ca 0.02 0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 1a4l h PRO 263 Cb 0.94 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1a4l h PRO 263 CO 0.41 -0.39 -0.07 2.35 -0.21 0.00 0.00 178.00 180.08 1a4l h TRP 264 N -0.61 -0.19 -0.65 0.65 -0.00 -1.90 -3.09 115.95 110.16 1a4l h TRP 264 Ca 0.04 -0.00 0.12 0.00 -0.00 0.00 0.00 58.89 59.04 1a4l h TRP 264 Cb 0.67 0.06 -0.12 0.00 -0.00 0.00 0.00 29.16 29.77 1a4l h TRP 264 CO -0.43 0.01 -0.28 1.03 -0.00 0.00 0.00 178.44 178.77 1a4l h SER 265 N -0.37 -0.99 -0.52 2.65 0.87 -1.81 0.16 113.55 113.54 1a4l h SER 265 Ca -0.02 0.23 0.13 0.00 -1.23 0.00 0.00 61.79 60.90 1a4l h SER 265 Cb 0.29 0.53 -0.02 0.00 -0.44 0.00 0.00 62.40 62.76 1a4l h SER 265 CO 0.03 -0.28 0.36 0.77 -0.53 0.00 0.00 176.83 177.19 1a4l h SER 266 N -0.10 0.08 0.15 6.23 4.64 -1.26 -0.63 113.55 122.66 1a4l h SER 266 Ca 0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 1a4l h SER 266 Cb 0.54 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1a4l h SER 266 CO -0.71 0.04 -0.07 0.22 -0.87 0.00 0.00 176.83 175.44 1a4l h TYR 267 N 0.09 -0.19 -0.43 4.77 3.20 -0.63 0.85 116.97 124.63 1a4l h TYR 267 Ca 0.25 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 1a4l h TYR 267 Cb 0.86 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 39.17 1a4l h TYR 267 CO -0.00 0.24 0.22 -0.07 -1.64 0.00 0.00 178.16 176.92 1a4l h LEU 268 N -0.88 0.52 0.00 2.82 4.07 -0.79 -2.54 115.31 118.50 1a4l h LEU 268 Ca -0.02 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.91 1a4l h LEU 268 Cb 0.52 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.13 1a4l h LEU 268 CO 0.03 0.43 -0.25 0.71 -1.08 0.00 0.00 178.44 178.28 1a4l h THR 269 N 0.59 0.00 0.00 0.22 1.35 -1.26 0.29 112.91 114.10 1a4l h THR 269 Ca 0.15 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1a4l h THR 269 Cb 0.03 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 1a4l h THR 269 CO -0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.86 1a4l n GLY 270 N 1.19 0.60 0.36 5.82 0.00 -0.96 -2.60 105.19 109.60 1a4l n GLY 270 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.22 1a4l n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4l h ALA 271 N 0.00 2.30 -3.25 4.61 0.00 -1.54 -3.39 119.26 118.00 1a4l h ALA 271 Ca 0.00 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 54.23 1a4l h ALA 271 Cb 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 17.49 1a4l h ALA 271 CO 0.00 -0.43 -0.81 -0.46 0.00 0.00 0.00 179.25 177.55 1a4l s TRP 272 N -5.12 2.75 -0.45 0.00 -0.00 0.20 -4.83 118.94 111.49 1a4l s TRP 272 Ca -0.06 -0.96 -0.28 0.00 -0.00 0.00 0.00 56.10 54.80 1a4l s TRP 272 Cb 0.19 -1.85 0.03 0.00 -0.00 0.00 0.00 33.47 31.84 1a4l s TRP 272 CO 0.73 -0.41 1.06 0.34 -0.00 0.00 0.00 176.95 178.67 1a4l s ASP 273 N 0.63 6.63 0.62 5.86 -1.08 -1.26 -4.66 116.67 123.41 1a4l s ASP 273 Ca -0.09 0.44 0.40 0.00 -0.52 0.00 0.00 52.55 52.78 1a4l s ASP 273 Cb -0.16 -2.52 2.17 0.00 -1.46 0.00 0.00 42.92 40.95 1a4l s ASP 273 CO 0.03 -1.14 2.22 1.55 0.52 0.00 0.00 175.17 178.34 1a4l h PRO 274 N 9.04 0.00 0.00 4.34 0.13 -1.95 0.03 132.00 143.59 1a4l h PRO 274 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1a4l h PRO 274 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1a4l h PRO 274 CO 1.08 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.48 1a4l n LYS 275 N -2.94 0.22 -4.35 0.86 5.02 -1.26 -4.77 118.16 110.93 1a4l n LYS 275 Ca -0.03 0.09 -0.26 0.00 -2.02 0.00 0.00 58.31 56.09 1a4l n LYS 275 Cb 0.11 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.49 1a4l n LYS 275 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1a4l s THR 276 N -2.71 2.04 0.13 -0.18 -4.23 -0.00 -5.11 115.64 105.58 1a4l s THR 276 Ca 0.18 -1.74 -0.31 0.00 -1.18 0.00 0.00 61.69 58.64 1a4l s THR 276 Cb 0.15 -1.85 -0.10 0.00 1.34 0.00 0.00 72.50 72.04 1a4l s THR 276 CO 0.36 -0.03 1.69 0.28 -0.54 0.00 0.00 174.62 176.37 1a4l s THR 277 N -1.28 2.65 0.34 3.99 -1.32 -1.26 -4.82 115.64 113.93 1a4l s THR 277 Ca 0.12 0.29 -0.28 0.00 -1.21 0.00 0.00 61.69 60.62 1a4l s THR 277 Cb -0.09 -3.19 -0.12 0.00 -1.51 0.00 0.00 72.50 67.59 1a4l s THR 277 CO 0.06 0.01 1.28 1.57 -2.21 0.00 0.00 174.62 175.33 1a4l n HIS 278 N 4.97 2.26 -0.32 9.09 -0.00 -1.26 -4.88 115.22 125.08 1a4l n HIS 278 Ca 0.16 0.55 0.12 0.00 0.46 0.00 0.00 57.72 59.01 1a4l n HIS 278 Cb 0.39 -2.41 0.33 0.00 -0.12 0.00 0.00 29.99 28.18 1a4l n HIS 278 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1a4l h ALA 279 N 2.52 1.73 -0.04 1.57 0.00 -1.91 -0.58 119.26 122.54 1a4l h ALA 279 Ca -0.46 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.50 1a4l h ALA 279 Cb 1.28 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1a4l h ALA 279 CO 0.62 -0.03 0.11 -0.24 0.00 0.00 0.00 179.25 179.72 1a4l h VAL 280 N 0.77 0.20 -0.23 0.00 3.04 -1.95 0.69 116.25 118.78 1a4l h VAL 280 Ca 0.51 0.00 -0.18 0.00 -1.01 0.00 0.00 66.70 66.02 1a4l h VAL 280 Cb 0.76 0.90 -0.00 0.00 -2.01 0.00 0.00 31.29 30.94 1a4l h VAL 280 CO -0.28 0.00 -0.59 0.58 -1.01 0.00 0.00 177.57 176.28 1a4l h VAL 281 N 0.00 1.30 -0.08 1.51 2.07 -1.45 0.14 116.25 119.73 1a4l h VAL 281 Ca 0.02 -1.80 -0.02 0.00 0.82 0.00 0.00 66.70 65.71 1a4l h VAL 281 Cb 0.24 1.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1a4l h VAL 281 CO -0.00 0.57 -0.04 -0.09 0.02 0.00 0.00 177.57 178.04 1a4l h ARG 282 N 0.56 0.18 -0.66 1.57 9.65 -1.03 -1.40 114.38 123.24 1a4l h ARG 282 Ca 0.00 -0.08 0.13 0.00 -1.10 0.00 0.00 59.98 58.93 1a4l h ARG 282 Cb 1.17 -0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 29.66 1a4l h ARG 282 CO 0.12 0.54 0.17 0.74 2.80 0.00 0.00 179.97 184.34 1a4l h PHE 283 N -0.19 0.28 0.31 2.20 0.04 -0.99 0.18 116.94 118.77 1a4l h PHE 283 Ca 0.02 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 1a4l h PHE 283 Cb 0.48 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.61 1a4l h PHE 283 CO 0.07 -0.02 -0.15 -0.22 -0.60 0.00 0.00 178.31 177.39 1a4l h LYS 284 N 0.30 -0.40 0.00 1.51 3.64 -0.60 -0.25 116.57 120.78 1a4l h LYS 284 Ca 0.35 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.75 1a4l h LYS 284 Cb 0.54 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1a4l h LYS 284 CO -0.42 -0.24 -0.06 -0.91 -2.27 0.00 0.00 179.45 175.55 1a4l h ASN 285 N -0.46 0.00 -0.06 4.20 2.35 -0.18 -1.23 115.58 120.21 1a4l h ASN 285 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1a4l h ASN 285 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1a4l h ASN 285 CO 0.07 0.06 0.00 0.47 -1.65 0.00 0.00 177.43 176.38 1a4l n ASP 286 N -3.93 1.97 -3.14 5.81 8.00 0.52 -4.94 116.55 120.85 1a4l n ASP 286 Ca -0.03 -1.67 -0.23 0.00 0.71 0.00 0.00 54.79 53.58 1a4l n ASP 286 Cb 0.14 -0.03 0.05 0.00 -0.02 0.00 0.00 41.12 41.26 1a4l n ASP 286 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1a4l n LYS 287 N 0.54 -5.64 -1.37 -1.24 4.76 -0.46 -4.97 118.16 109.78 1a4l n LYS 287 Ca 0.17 0.89 -0.32 0.00 -2.87 0.00 0.00 58.31 56.19 1a4l n LYS 287 Cb 0.42 -5.80 0.08 0.00 -1.84 0.00 0.00 35.03 27.90 1a4l n LYS 287 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1a4l s ALA 288 N -3.22 2.27 -0.53 7.82 0.00 -0.15 -4.97 121.76 122.98 1a4l s ALA 288 Ca 0.37 0.38 -0.22 0.00 0.00 0.00 0.00 51.96 52.49 1a4l s ALA 288 Cb -0.16 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 19.70 1a4l s ALA 288 CO 0.46 -1.69 0.82 1.21 0.00 0.00 0.00 175.76 176.57 1a4l s ASN 289 N -3.08 6.31 0.31 0.00 3.04 -1.26 -4.88 114.94 115.38 1a4l s ASN 289 Ca 0.63 -0.51 -0.05 0.00 0.04 0.00 0.00 52.86 52.98 1a4l s ASN 289 Cb -0.19 -2.38 -0.00 0.00 -1.54 0.00 0.00 41.25 37.14 1a4l s ASN 289 CO 0.52 -1.09 0.45 -0.72 -3.04 0.00 0.00 177.10 173.22 1a4l s TYR 290 N 3.46 0.92 0.05 0.43 1.13 -1.26 -1.38 117.35 120.70 1a4l s TYR 290 Ca 0.25 -1.18 -0.05 0.00 -1.41 0.00 0.00 57.07 54.68 1a4l s TYR 290 Cb -0.15 -0.05 -0.01 0.00 -1.10 0.00 0.00 41.96 40.65 1a4l s TYR 290 CO 0.17 -1.07 0.10 -1.54 -2.51 0.00 0.00 175.55 170.69 1a4l s SER 291 N -3.18 0.21 -0.27 -0.18 1.04 -0.69 -4.51 113.70 106.12 1a4l s SER 291 Ca 0.29 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 56.01 1a4l s SER 291 Cb 0.00 0.24 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 1a4l s SER 291 CO 0.17 -0.56 0.12 -0.76 0.98 0.00 0.00 173.24 173.19 1a4l s LEU 292 N -2.38 3.72 0.26 2.42 1.02 -1.26 -1.03 118.68 121.43 1a4l s LEU 292 Ca -0.01 -0.18 0.07 0.00 0.02 0.00 0.00 54.13 54.03 1a4l s LEU 292 Cb 0.01 -2.00 -0.05 0.00 0.02 0.00 0.00 46.19 44.17 1a4l s LEU 292 CO -0.07 -0.06 -0.10 0.20 0.02 0.00 0.00 176.35 176.34 1a4l s ASN 293 N 1.66 2.79 -0.13 2.29 -0.87 0.18 -4.82 114.94 116.03 1a4l s ASN 293 Ca 0.06 -1.12 0.16 0.00 -1.57 0.00 0.00 52.86 50.39 1a4l s ASN 293 Cb -0.16 -0.17 -0.24 0.00 -0.02 0.00 0.00 41.25 40.66 1a4l s ASN 293 CO 0.06 -0.25 0.32 1.07 -2.57 0.00 0.00 177.10 175.73 1a4l n THR 294 N -0.52 1.46 0.00 1.60 5.66 -1.25 -4.25 114.28 116.97 1a4l n THR 294 Ca -0.06 -0.83 0.00 0.00 -3.05 0.00 0.00 64.05 60.11 1a4l n THR 294 Cb 0.62 -0.69 0.00 0.00 -1.55 0.00 0.00 70.33 68.72 1a4l n THR 294 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1a4l n ASP 295 N -2.86 0.00 -3.37 1.09 2.03 -0.84 -4.25 116.55 108.35 1a4l n ASP 295 Ca -0.26 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 54.78 1a4l n ASP 295 Cb 1.11 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 41.41 1a4l n ASP 295 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1a4l n ASP 296 N 3.92 -0.29 -0.25 1.67 9.92 -1.26 -0.44 116.55 129.82 1a4l n ASP 296 Ca 0.00 -2.45 0.19 0.00 -0.53 0.00 0.00 54.79 52.00 1a4l n ASP 296 Cb 0.00 -0.57 0.51 0.00 -0.64 0.00 0.00 41.12 40.42 1a4l n ASP 296 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 1a4l h PRO 297 N 5.34 0.40 0.77 -0.24 0.11 -1.71 0.10 132.00 136.77 1a4l h PRO 297 Ca 0.23 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 1a4l h PRO 297 Cb 0.90 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.93 1a4l h PRO 297 CO 0.39 0.26 -0.37 1.25 -0.21 0.00 0.00 178.00 179.33 1a4l h LEU 298 N 0.41 -0.87 -1.53 2.35 5.85 -1.64 0.24 115.31 120.12 1a4l h LEU 298 Ca 0.48 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.20 1a4l h LEU 298 Cb 1.18 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 1a4l h LEU 298 CO -0.19 -0.62 -0.15 0.40 -0.34 0.00 0.00 178.44 177.54 1a4l h ILE 299 N -1.03 0.47 -0.02 4.05 2.04 -1.64 -2.62 117.51 118.76 1a4l h ILE 299 Ca -0.11 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1a4l h ILE 299 Cb 0.79 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 1a4l h ILE 299 CO 0.17 0.15 -0.14 0.49 0.00 0.00 0.00 178.15 178.83 1a4l n PHE 300 N -3.43 0.00 -3.79 1.37 3.72 -0.01 -1.20 117.46 114.12 1a4l n PHE 300 Ca -0.01 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.12 1a4l n PHE 300 Cb 0.33 -0.01 0.02 0.00 -0.94 0.00 0.00 39.48 38.88 1a4l n PHE 300 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1a4l n LYS 301 N 0.70 -2.76 -4.25 -1.08 5.02 0.67 -4.82 118.16 111.65 1a4l n LYS 301 Ca 0.13 0.47 -0.16 0.00 -2.02 0.00 0.00 58.31 56.73 1a4l n LYS 301 Cb 0.51 -4.49 -0.09 0.00 -0.02 0.00 0.00 35.03 30.94 1a4l n LYS 301 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1a4l s SER 302 N -4.01 1.03 0.35 4.39 1.04 -0.17 -5.04 113.70 111.29 1a4l s SER 302 Ca 0.19 -1.59 0.04 0.00 0.48 0.00 0.00 55.95 55.08 1a4l s SER 302 Cb -0.07 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.50 1a4l s SER 302 CO 0.86 -0.95 0.14 0.35 0.98 0.00 0.00 173.24 174.62 1a4l n THR 303 N -0.47 0.00 0.11 2.02 -2.24 -1.26 -4.66 114.28 107.77 1a4l n THR 303 Ca 0.05 -2.06 -0.02 0.00 -2.27 0.00 0.00 64.05 59.75 1a4l n THR 303 Cb 0.64 0.77 0.22 0.00 -2.10 0.00 0.00 70.33 69.86 1a4l n THR 303 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1a4l h LEU 304 N 0.00 0.19 -1.07 3.22 5.85 -1.98 -2.38 115.31 119.14 1a4l h LEU 304 Ca -0.27 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1a4l h LEU 304 Cb 1.05 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.02 1a4l h LEU 304 CO 0.42 0.63 0.00 -0.67 -0.34 0.00 0.00 178.44 178.48 1a4l n ASP 305 N -3.98 0.58 -0.08 1.25 2.03 -1.26 -2.11 116.55 112.98 1a4l n ASP 305 Ca -0.02 0.71 -0.12 0.00 0.52 0.00 0.00 54.79 55.88 1a4l n ASP 305 Cb 0.51 -0.81 -0.05 0.00 -0.72 0.00 0.00 41.12 40.05 1a4l n ASP 305 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1a4l h THR 306 N 0.00 1.30 -0.19 5.18 2.02 -1.83 -1.59 112.91 117.79 1a4l h THR 306 Ca 0.00 -1.17 -0.10 0.00 0.77 0.00 0.00 66.41 65.91 1a4l h THR 306 Cb 0.16 1.55 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1a4l h THR 306 CO 0.00 0.36 -0.25 0.44 0.37 0.00 0.00 175.52 176.44 1a4l h ASP 307 N 0.22 0.56 0.08 4.18 3.32 -1.58 -2.38 116.42 120.82 1a4l h ASP 307 Ca 0.06 -0.51 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 1a4l h ASP 307 Cb 0.60 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1a4l h ASP 307 CO 0.03 0.96 -0.04 1.88 -1.72 0.00 0.00 179.24 180.35 1a4l h TYR 308 N 0.18 -0.10 -0.34 4.55 -1.99 -1.57 -1.04 116.97 116.67 1a4l h TYR 308 Ca 0.02 -0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.80 1a4l h TYR 308 Cb 0.82 0.03 -0.04 0.00 2.00 0.00 0.00 36.73 39.54 1a4l h TYR 308 CO 0.09 -0.01 0.09 1.96 -0.00 0.00 0.00 178.16 180.28 1a4l h GLN 309 N -0.16 0.21 -0.36 4.88 1.08 -1.34 0.11 115.11 119.53 1a4l h GLN 309 Ca -0.01 -0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.25 1a4l h GLN 309 Cb 0.13 -0.05 -0.08 0.00 -0.05 0.00 0.00 27.48 27.43 1a4l h GLN 309 CO 0.02 0.14 -0.18 1.98 -0.95 0.00 0.00 178.83 179.84 1a4l h MET 310 N 0.21 -0.11 0.00 1.46 4.05 -1.22 0.40 114.93 119.72 1a4l h MET 310 Ca 0.16 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.56 1a4l h MET 310 Cb 0.16 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.99 1a4l h MET 310 CO -0.19 -0.08 -0.15 1.79 0.23 0.00 0.00 176.91 178.52 1a4l h THR 311 N -0.12 0.44 0.00 -0.77 1.35 -0.66 -1.74 112.91 111.41 1a4l h THR 311 Ca 0.18 -0.79 -0.01 0.00 -0.55 0.00 0.00 66.41 65.25 1a4l h THR 311 Cb 0.39 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 68.37 1a4l h THR 311 CO -0.43 0.14 -0.06 0.50 -0.25 0.00 0.00 175.52 175.42 1a4l h LYS 312 N 0.00 0.00 -0.05 4.72 3.64 0.96 0.10 116.57 125.94 1a4l h LYS 312 Ca -0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1a4l h LYS 312 Cb 0.55 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1a4l h LYS 312 CO 0.02 0.29 0.02 0.87 -2.27 0.00 0.00 179.45 178.38 1a4l h LYS 313 N -1.00 0.08 -6.17 1.90 1.57 -0.32 -3.30 116.57 109.32 1a4l h LYS 313 Ca -0.01 -0.01 -0.50 0.00 -1.87 0.00 0.00 60.65 58.25 1a4l h LYS 313 Cb 0.32 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 1a4l h LYS 313 CO -0.00 0.20 -0.45 -0.51 -0.57 0.00 0.00 179.45 178.11 1a4l s ASP 314 N -5.41 5.15 0.00 0.86 1.01 -0.66 -4.63 116.67 113.00 1a4l s ASP 314 Ca -0.14 -0.58 0.00 0.00 0.71 0.00 0.00 52.55 52.54 1a4l s ASP 314 Cb 0.05 -0.87 0.00 0.00 1.01 0.00 0.00 42.92 43.11 1a4l s ASP 314 CO 0.68 -0.39 0.00 0.23 0.21 0.00 0.00 175.17 175.90 1a4l n MET 315 N -1.36 0.00 -1.50 8.23 2.81 -1.26 -4.11 117.12 119.93 1a4l n MET 315 Ca -0.01 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.77 1a4l n MET 315 Cb 0.60 -2.12 -0.04 0.00 -0.71 0.00 0.00 33.22 30.96 1a4l n MET 315 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a4l n GLY 316 N -1.62 0.93 3.75 3.03 0.00 -1.07 -4.95 105.19 105.26 1a4l n GLY 316 Ca 0.00 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1a4l n GLY 316 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a4l s PHE 317 N -2.43 2.96 0.41 1.61 0.40 0.33 -4.97 117.98 116.28 1a4l s PHE 317 Ca 0.00 1.02 0.08 0.00 -0.60 0.00 0.00 56.93 57.42 1a4l s PHE 317 Cb 0.00 -3.86 -0.01 0.00 0.51 0.00 0.00 43.02 39.66 1a4l s PHE 317 CO 0.00 -2.78 0.46 0.95 0.70 0.00 0.00 175.22 174.55 1a4l s THR 318 N -0.12 2.96 0.39 0.64 -4.23 -1.26 -4.57 115.64 109.45 1a4l s THR 318 Ca 0.59 -1.18 0.05 0.00 -1.18 0.00 0.00 61.69 59.97 1a4l s THR 318 Cb -0.43 -3.04 0.26 0.00 1.34 0.00 0.00 72.50 70.63 1a4l s THR 318 CO 0.45 -0.02 2.03 -0.08 -0.54 0.00 0.00 174.62 176.46 1a4l h GLU 319 N 0.87 0.63 0.12 3.99 4.81 -1.96 -2.09 114.58 120.96 1a4l h GLU 319 Ca -0.41 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1a4l h GLU 319 Cb 1.27 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1a4l h GLU 319 CO 0.52 0.43 -0.06 1.49 -0.73 0.00 0.00 179.01 180.66 1a4l h GLU 320 N 0.64 -0.16 -0.04 1.92 4.81 -2.00 -1.84 114.58 117.91 1a4l h GLU 320 Ca 0.17 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1a4l h GLU 320 Cb -0.04 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1a4l h GLU 320 CO -0.03 -0.09 -0.08 1.49 -0.73 0.00 0.00 179.01 179.57 1a4l h GLU 321 N -0.19 0.06 -0.28 1.92 4.57 -1.79 -1.47 114.58 117.40 1a4l h GLU 321 Ca -0.02 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.06 1a4l h GLU 321 Cb 0.14 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 1a4l h GLU 321 CO 0.03 0.15 -0.18 0.74 -1.18 0.00 0.00 179.01 178.56 1a4l h PHE 322 N 0.06 0.73 0.37 0.92 0.04 -0.96 -0.05 116.94 118.06 1a4l h PHE 322 Ca 0.01 -0.19 -0.02 0.00 2.80 0.00 0.00 57.97 60.57 1a4l h PHE 322 Cb 0.18 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.18 1a4l h PHE 322 CO 0.00 0.89 -0.18 0.87 -0.60 0.00 0.00 178.31 179.29 1a4l h LYS 323 N 0.36 -0.48 -0.55 1.51 1.57 -0.83 -0.73 116.57 117.43 1a4l h LYS 323 Ca 0.06 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.94 1a4l h LYS 323 Cb 0.72 0.11 -0.06 0.00 0.08 0.00 0.00 32.23 33.08 1a4l h LYS 323 CO 0.05 -0.29 0.21 -0.09 -0.57 0.00 0.00 179.45 178.77 1a4l h ARG 324 N -0.56 0.39 -0.85 3.15 2.43 -1.30 0.49 114.38 118.13 1a4l h ARG 324 Ca -0.05 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1a4l h ARG 324 Cb 0.42 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.84 1a4l h ARG 324 CO 0.08 0.26 0.56 1.25 -1.51 0.00 0.00 179.97 180.62 1a4l h LEU 325 N 0.41 0.95 0.02 3.80 6.46 -0.85 -1.16 115.31 124.94 1a4l h LEU 325 Ca 0.26 -0.02 -0.26 0.00 -0.12 0.00 0.00 57.88 57.74 1a4l h LEU 325 Cb 0.28 -0.23 0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1a4l h LEU 325 CO -0.25 0.68 -1.15 0.78 -0.62 0.00 0.00 178.44 177.88 1a4l h ASN 326 N 1.12 0.49 -0.79 1.25 4.21 0.14 -2.55 115.58 119.44 1a4l h ASN 326 Ca 0.32 -0.47 -0.04 0.00 1.21 0.00 0.00 56.30 57.32 1a4l h ASN 326 Cb -0.07 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 36.94 1a4l h ASN 326 CO -0.08 1.33 0.33 0.40 -1.29 0.00 0.00 177.43 178.12 1a4l h ILE 327 N 0.13 1.26 -0.38 2.81 2.04 -0.73 -1.04 117.51 121.60 1a4l h ILE 327 Ca -0.12 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 1a4l h ILE 327 Cb 1.84 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 1a4l h ILE 327 CO 0.19 0.33 0.12 0.78 0.00 0.00 0.00 178.15 179.57 1a4l h ASN 328 N 1.15 0.49 0.15 1.72 2.35 -1.18 -0.84 115.58 119.42 1a4l h ASN 328 Ca 0.27 -0.06 -0.18 0.00 -0.55 0.00 0.00 56.30 55.78 1a4l h ASN 328 Cb 0.19 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1a4l h ASN 328 CO -0.03 0.47 -0.67 0.00 -1.65 0.00 0.00 177.43 175.55 1a4l h ALA 329 N 1.60 0.61 -0.00 -0.83 0.00 -0.91 -1.65 119.26 118.08 1a4l h ALA 329 Ca 0.13 -0.57 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1a4l h ALA 329 Cb 0.16 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1a4l h ALA 329 CO -0.01 0.73 0.00 0.00 0.00 0.00 0.00 179.25 179.97 1a4l h ALA 330 N 0.92 0.00 -0.43 0.00 0.00 -0.34 -0.91 119.26 118.49 1a4l h ALA 330 Ca -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1a4l h ALA 330 Cb 1.24 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1a4l h ALA 330 CO 0.12 -0.41 0.27 0.87 0.00 0.00 0.00 179.25 180.10 1a4l h LYS 331 N -0.19 0.58 -0.08 0.00 1.57 -1.21 -2.54 116.57 114.70 1a4l h LYS 331 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1a4l h LYS 331 Cb 0.19 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1a4l h LYS 331 CO -0.00 0.42 0.00 0.43 -0.57 0.00 0.00 179.45 179.73 1a4l n SER 332 N -4.75 0.47 -4.62 0.86 7.64 -0.62 -4.90 113.62 107.68 1a4l n SER 332 Ca 0.01 -1.90 -0.29 0.00 1.01 0.00 0.00 58.87 57.70 1a4l n SER 332 Cb 0.05 -0.05 0.19 0.00 -1.01 0.00 0.00 64.21 63.38 1a4l n SER 332 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1a4l s SER 333 N -1.11 2.38 -0.43 6.43 1.04 -0.36 -4.94 113.70 116.72 1a4l s SER 333 Ca 0.10 1.13 0.05 0.00 0.48 0.00 0.00 55.95 57.71 1a4l s SER 333 Cb 0.05 -1.77 0.65 0.00 0.10 0.00 0.00 66.02 65.04 1a4l s SER 333 CO 0.08 -3.28 1.86 0.49 0.98 0.00 0.00 173.24 173.36 1a4l n PHE 334 N -4.26 2.79 -2.93 5.02 3.72 -1.26 -4.97 117.46 115.57 1a4l n PHE 334 Ca 0.05 -1.82 -0.28 0.00 -0.05 0.00 0.00 57.45 55.35 1a4l n PHE 334 Cb 0.57 -0.89 -0.02 0.00 -0.94 0.00 0.00 39.48 38.21 1a4l n PHE 334 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1a4l s LEU 335 N -3.30 3.82 0.64 4.37 2.96 -1.26 -4.86 118.68 121.05 1a4l s LEU 335 Ca 0.55 0.87 -0.13 0.00 -0.22 0.00 0.00 54.13 55.20 1a4l s LEU 335 Cb 0.47 -3.76 -0.01 0.00 0.50 0.00 0.00 46.19 43.38 1a4l s LEU 335 CO 0.09 -0.42 1.06 -2.84 -1.32 0.00 0.00 176.35 172.92 1a4l s PRO 336 N -4.22 3.14 0.25 0.98 0.02 -1.26 -4.77 135.00 129.13 1a4l s PRO 336 Ca 0.47 1.07 -0.06 0.00 0.02 0.00 0.00 61.00 62.50 1a4l s PRO 336 Cb -0.10 -2.01 0.46 0.00 0.02 0.00 0.00 34.50 32.86 1a4l s PRO 336 CO 0.37 -0.94 1.65 0.93 -0.33 0.00 0.00 177.00 178.67 1a4l h GLU 337 N -0.13 0.14 -0.03 5.54 4.39 -1.98 -0.68 114.58 121.82 1a4l h GLU 337 Ca -0.45 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.25 1a4l h GLU 337 Cb 1.21 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 1a4l h GLU 337 CO 0.57 0.09 -0.06 0.93 -1.16 0.00 0.00 179.01 179.38 1a4l h GLU 338 N 0.14 -0.09 -0.32 2.33 3.07 -2.00 -1.22 114.58 116.49 1a4l h GLU 338 Ca 0.42 0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.20 1a4l h GLU 338 Cb 0.75 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 1a4l h GLU 338 CO -0.63 -0.06 -0.17 0.93 -1.40 0.00 0.00 179.01 177.68 1a4l h GLU 339 N -0.09 0.58 -0.32 2.33 5.08 -1.79 -2.46 114.58 117.90 1a4l h GLU 339 Ca 0.04 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 1a4l h GLU 339 Cb 0.14 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1a4l h GLU 339 CO -0.09 0.72 -0.10 -0.22 -1.00 0.00 0.00 179.01 178.33 1a4l h LYS 340 N 0.52 0.54 -0.11 2.33 3.64 -0.76 -1.89 116.57 120.84 1a4l h LYS 340 Ca 0.09 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1a4l h LYS 340 Cb 0.59 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1a4l h LYS 340 CO 0.04 0.64 -0.02 0.87 -2.27 0.00 0.00 179.45 178.71 1a4l h LYS 341 N 0.50 0.20 -1.00 1.90 1.79 -0.88 -1.51 116.57 117.58 1a4l h LYS 341 Ca 0.09 -0.07 0.19 0.00 -2.18 0.00 0.00 60.65 58.68 1a4l h LYS 341 Cb 0.48 -0.01 -0.10 0.00 -1.58 0.00 0.00 32.23 31.01 1a4l h LYS 341 CO 0.03 0.49 0.61 0.93 -1.08 0.00 0.00 179.45 180.44 1a4l h GLU 342 N -0.11 0.73 0.57 3.15 5.08 -1.12 0.30 114.58 123.18 1a4l h GLU 342 Ca 0.03 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1a4l h GLU 342 Cb 0.42 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1a4l h GLU 342 CO 0.01 0.48 -0.27 1.25 -1.00 0.00 0.00 179.01 179.48 1a4l h LEU 343 N 0.75 -0.65 -2.01 1.33 6.46 -1.08 -2.24 115.31 117.87 1a4l h LEU 343 Ca 0.57 -0.04 0.16 0.00 -0.12 0.00 0.00 57.88 58.45 1a4l h LEU 343 Cb 0.91 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.99 1a4l h LEU 343 CO -0.37 -0.29 0.42 -0.07 -0.62 0.00 0.00 178.44 177.52 1a4l h LEU 344 N -1.04 0.00 -0.17 2.25 3.38 -0.32 0.17 115.31 119.57 1a4l h LEU 344 Ca -0.08 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1a4l h LEU 344 Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1a4l h LEU 344 CO 0.13 0.00 -0.07 -0.33 0.09 0.00 0.00 178.44 178.26 1a4l h GLU 345 N 0.00 0.36 -0.06 1.13 5.08 -0.82 -1.42 114.58 118.86 1a4l h GLU 345 Ca 0.26 -0.15 0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1a4l h GLU 345 Cb 1.10 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1a4l h GLU 345 CO -0.00 0.65 -0.06 -0.09 -1.00 0.00 0.00 179.01 178.51 1a4l h ARG 346 N 0.05 -0.08 0.35 2.33 2.43 -0.11 0.66 114.38 120.00 1a4l h ARG 346 Ca 0.04 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1a4l h ARG 346 Cb 0.54 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1a4l h ARG 346 CO 0.02 -0.05 -0.19 -0.07 -1.51 0.00 0.00 179.97 178.17 1a4l h LEU 347 N -0.08 -0.46 -1.67 3.80 3.38 -1.24 -0.89 115.31 118.14 1a4l h LEU 347 Ca 0.04 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1a4l h LEU 347 Cb 0.14 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1a4l h LEU 347 CO -0.11 -0.31 0.24 1.88 0.09 0.00 0.00 178.44 180.23 1a4l h TYR 348 N -0.50 0.42 0.15 1.13 -1.99 -1.10 0.70 116.97 115.78 1a4l h TYR 348 Ca -0.04 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.69 1a4l h TYR 348 Cb 0.40 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.99 1a4l h TYR 348 CO -0.07 0.26 -0.07 -0.09 -0.00 0.00 0.00 178.16 178.19 1a4l h ARG 349 N 0.45 -0.20 -0.00 4.88 2.43 -0.66 -3.23 114.38 118.05 1a4l h ARG 349 Ca 0.14 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1a4l h ARG 349 Cb -0.01 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1a4l h ARG 349 CO -0.03 0.20 0.00 0.39 -1.51 0.00 0.00 179.97 179.02 1a4l n GLU 350 N -4.98 1.03 0.00 0.20 1.02 -0.36 -3.23 120.64 114.32 1a4l n GLU 350 Ca -0.09 -0.04 0.10 0.00 -0.02 0.00 0.00 57.16 57.12 1a4l n GLU 350 Cb 0.25 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 30.25 1a4l n GLU 350 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1a4l n TYR 351 N -0.84 0.00 1.21 -0.32 4.01 0.21 -4.84 117.16 116.59 1a4l n TYR 351 Ca 0.18 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.02 1a4l n TYR 351 Cb 0.09 0.00 0.57 0.00 -0.31 0.00 0.00 39.34 39.70 1a4l n TYR 351 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44