#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0w n LEU 2 N 0.00 2.54 -0.29 3.17 4.77 -1.26 -4.95 117.00 120.98 1k0w n LEU 2 Ca 0.00 -5.26 0.07 0.00 -0.03 0.00 0.00 56.01 50.79 1k0w n LEU 2 Cb 0.00 0.13 0.22 0.00 -2.33 0.00 0.00 43.42 41.44 1k0w n LEU 2 CO 0.00 2.29 1.10 -0.33 -1.33 0.00 0.00 177.39 179.12 1k0w h GLU 3 N 2.98 0.60 0.54 3.23 3.07 -1.99 -0.44 114.58 122.57 1k0w h GLU 3 Ca 0.11 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.91 1k0w h GLU 3 Cb 0.77 -0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.55 1k0w h GLU 3 CO 0.65 0.40 -0.26 0.22 -1.40 0.00 0.00 179.01 178.62 1k0w h ASP 4 N 0.62 -0.61 -0.92 1.42 -0.00 -2.00 -1.68 116.42 113.26 1k0w h ASP 4 Ca 0.46 0.01 0.12 0.00 -0.00 0.00 0.00 57.03 57.62 1k0w h ASP 4 Cb 0.64 0.16 -0.08 0.00 -0.00 0.00 0.00 39.33 40.05 1k0w h ASP 4 CO -0.36 -0.42 0.55 0.25 -0.00 0.00 0.00 179.24 179.25 1k0w h LEU 5 N -0.74 0.78 -1.02 2.28 6.46 -1.88 -0.83 115.31 120.35 1k0w h LEU 5 Ca -0.07 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 1k0w h LEU 5 Cb 0.56 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.36 1k0w h LEU 5 CO 0.12 0.40 0.51 0.11 -0.62 0.00 0.00 178.44 178.96 1k0w h LYS 6 N 0.86 1.18 -0.39 1.25 1.57 -0.77 0.45 116.57 120.72 1k0w h LYS 6 Ca 0.46 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 59.05 1k0w h LYS 6 Cb 0.50 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1k0w h LYS 6 CO -0.28 0.84 -0.05 -0.09 -0.57 0.00 0.00 179.45 179.30 1k0w h ARG 7 N 1.20 0.72 -0.23 3.15 1.12 -0.25 0.78 114.38 120.88 1k0w h ARG 7 Ca 0.31 -0.26 -0.01 0.00 -1.11 0.00 0.00 59.98 58.91 1k0w h ARG 7 Cb -0.03 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 29.87 1k0w h ARG 7 CO -0.06 0.84 0.11 1.96 -3.11 0.00 0.00 179.97 179.71 1k0w h GLN 8 N 0.54 0.33 -0.43 0.20 4.20 -0.81 -0.02 115.11 119.11 1k0w h GLN 8 Ca 0.10 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.69 1k0w h GLN 8 Cb 0.55 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1k0w h GLN 8 CO 0.03 0.35 -0.04 0.28 -0.67 0.00 0.00 178.83 178.78 1k0w h VAL 9 N 0.23 1.24 0.17 -0.54 2.07 -0.82 -0.58 116.25 118.02 1k0w h VAL 9 Ca 0.08 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1k0w h VAL 9 Cb 0.13 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1k0w h VAL 9 CO -0.01 0.35 -0.08 0.25 0.02 0.00 0.00 177.57 178.10 1k0w h LEU 10 N 0.68 -0.20 -0.49 2.57 7.12 -0.54 -1.36 115.31 123.09 1k0w h LEU 10 Ca 0.13 -0.06 0.02 0.00 0.13 0.00 0.00 57.88 58.09 1k0w h LEU 10 Cb 0.48 0.05 -0.03 0.00 -0.53 0.00 0.00 40.66 40.63 1k0w h LEU 10 CO 0.02 -0.06 0.30 -0.33 -0.13 0.00 0.00 178.44 178.24 1k0w h GLU 11 N -0.32 0.59 -0.94 1.25 5.08 -0.74 -0.25 114.58 119.25 1k0w h GLU 11 Ca -0.02 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1k0w h GLU 11 Cb 0.25 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1k0w h GLU 11 CO 0.04 0.39 0.62 0.00 -1.00 0.00 0.00 179.01 179.06 1k0w h ALA 12 N 1.20 1.33 -0.24 3.43 0.00 -1.02 -0.02 119.26 123.95 1k0w h ALA 12 Ca 0.19 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1k0w h ALA 12 Cb -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1k0w h ALA 12 CO -0.07 0.62 -0.06 -0.91 0.00 0.00 0.00 179.25 178.83 1k0w h ASN 13 N 1.27 0.47 0.37 0.00 2.35 -0.68 -2.65 115.58 116.71 1k0w h ASN 13 Ca 0.34 -0.37 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1k0w h ASN 13 Cb -0.15 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.09 1k0w h ASN 13 CO -0.07 0.73 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.33 1k0w h LEU 14 N 0.21 0.00 -0.25 1.61 4.07 -0.65 -1.60 115.31 118.69 1k0w h LEU 14 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1k0w h LEU 14 Cb 0.53 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1k0w h LEU 14 CO 0.02 0.04 0.00 0.00 -1.08 0.00 0.00 178.44 177.42 1k0w h ALA 15 N 1.96 1.00 0.81 1.53 0.00 -0.64 -3.33 119.26 120.59 1k0w h ALA 15 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1k0w h ALA 15 Cb 0.23 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1k0w h ALA 15 CO 0.00 0.00 -0.39 -0.07 0.00 0.00 0.00 179.25 178.79 1k0w h LEU 16 N 0.00 -0.94 -1.55 0.00 4.07 -1.20 -2.27 115.31 113.42 1k0w h LEU 16 Ca 0.00 0.03 -0.05 0.00 0.08 0.00 0.00 57.88 57.95 1k0w h LEU 16 Cb 0.75 0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.73 1k0w h LEU 16 CO 0.00 -0.66 -0.21 1.55 -1.08 0.00 0.00 178.44 178.03 1k0w h PRO 17 N -1.09 0.00 -0.59 1.13 0.13 -1.75 -2.21 132.00 127.62 1k0w h PRO 17 Ca -0.11 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.97 1k0w h PRO 17 Cb 0.84 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.94 1k0w h PRO 17 CO 0.18 0.21 0.16 0.87 -0.23 0.00 0.00 178.00 179.20 1k0w h LYS 18 N 0.00 0.90 -0.69 0.86 1.57 -1.61 -1.98 116.57 115.61 1k0w h LYS 18 Ca -0.00 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1k0w h LYS 18 Cb 0.52 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 1k0w h LYS 18 CO 0.03 0.79 0.01 0.72 -0.57 0.00 0.00 179.45 180.42 1k0w n HIS 19 N -4.28 1.58 -4.07 -1.35 8.25 -0.87 -4.93 115.22 109.56 1k0w n HIS 19 Ca 0.04 -0.56 -0.32 0.00 -0.26 0.00 0.00 57.72 56.63 1k0w n HIS 19 Cb 0.22 -0.42 -0.01 0.00 1.12 0.00 0.00 29.99 30.90 1k0w n HIS 19 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1k0w n ASN 20 N 0.45 -2.92 -0.16 0.41 3.02 -0.75 -4.84 115.26 110.46 1k0w n ASN 20 Ca 0.21 -0.94 0.11 0.00 -0.03 0.00 0.00 54.58 53.92 1k0w n ASN 20 Cb 0.97 -3.16 -0.03 0.00 -0.61 0.00 0.00 39.78 36.95 1k0w n ASN 20 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1k0w n LEU 21 N -4.46 1.28 -4.08 3.41 4.77 -0.86 -4.84 117.00 112.23 1k0w n LEU 21 Ca -0.04 -0.53 -0.10 0.00 -0.03 0.00 0.00 56.01 55.31 1k0w n LEU 21 Cb 0.55 -0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 1k0w n LEU 21 CO 0.80 0.28 -0.04 0.54 -1.33 0.00 0.00 177.39 177.64 1k0w s VAL 22 N -2.82 0.02 0.09 4.08 0.11 -1.25 -2.67 120.40 117.95 1k0w s VAL 22 Ca 0.12 -1.65 0.03 0.00 -2.93 0.00 0.00 61.98 57.55 1k0w s VAL 22 Cb 0.17 -2.24 -0.04 0.00 -1.53 0.00 0.00 36.38 32.74 1k0w s VAL 22 CO 0.75 -0.08 -0.10 -0.89 -3.33 0.00 0.00 175.10 171.45 1k0w s THR 23 N -4.06 0.89 0.00 5.04 2.01 -1.26 -4.76 115.64 113.49 1k0w s THR 23 Ca 0.28 -1.61 0.00 0.00 0.31 0.00 0.00 61.69 60.67 1k0w s THR 23 Cb 0.03 -1.31 0.00 0.00 0.01 0.00 0.00 72.50 71.23 1k0w s THR 23 CO 0.08 -0.56 0.00 0.18 -0.69 0.00 0.00 174.62 173.63 1k0w n LEU 24 N 0.61 0.00 -1.00 4.42 4.77 -1.26 -1.20 117.00 123.34 1k0w n LEU 24 Ca -0.16 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.89 1k0w n LEU 24 Cb 0.58 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 41.91 1k0w n LEU 24 CO 0.26 0.00 0.71 0.35 -1.33 0.00 0.00 177.39 177.38 1k0w n THR 25 N 0.00 1.57 -0.87 -5.08 -2.24 -1.26 -4.82 114.28 101.57 1k0w n THR 25 Ca 0.00 -1.29 -0.30 0.00 -2.27 0.00 0.00 64.05 60.20 1k0w n THR 25 Cb 0.00 0.20 0.18 0.00 -2.10 0.00 0.00 70.33 68.61 1k0w n THR 25 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1k0w s TRP 26 N -1.71 1.85 0.00 4.78 0.51 -0.34 -4.90 118.94 119.12 1k0w s TRP 26 Ca 0.37 1.39 0.00 0.00 -2.12 0.00 0.00 56.10 55.74 1k0w s TRP 26 Cb 0.24 -3.19 0.00 0.00 -0.81 0.00 0.00 33.47 29.71 1k0w s TRP 26 CO 0.17 -2.93 0.00 0.41 -0.51 0.00 0.00 176.95 174.09 1k0w n GLY 27 N -0.20 -1.60 3.61 0.98 0.00 -1.26 -4.65 105.19 102.07 1k0w n GLY 27 Ca 0.07 -1.51 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 1k0w n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k0w s ASN 28 N -2.93 -0.33 0.05 1.61 2.20 -0.11 -5.00 114.94 110.42 1k0w s ASN 28 Ca 0.00 0.47 0.06 0.00 -0.94 0.00 0.00 52.86 52.45 1k0w s ASN 28 Cb 0.00 0.41 -0.02 0.00 -2.00 0.00 0.00 41.25 39.64 1k0w s ASN 28 CO 0.00 -0.24 -0.16 -0.69 -2.94 0.00 0.00 177.10 173.07 1k0w s VAL 29 N -0.66 1.31 0.13 3.54 1.01 -1.26 -1.13 120.40 123.34 1k0w s VAL 29 Ca 0.01 -1.13 -0.02 0.00 0.00 0.00 0.00 61.98 60.84 1k0w s VAL 29 Cb -0.02 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1k0w s VAL 29 CO -0.03 0.03 0.08 -0.94 0.00 0.00 0.00 175.10 174.24 1k0w s SER 30 N -1.28 0.28 -0.05 3.32 1.04 -0.36 -2.74 113.70 113.91 1k0w s SER 30 Ca 0.03 -1.18 -0.09 0.00 0.48 0.00 0.00 55.95 55.19 1k0w s SER 30 Cb -0.08 0.31 0.02 0.00 0.10 0.00 0.00 66.02 66.36 1k0w s SER 30 CO 0.02 -0.75 0.22 0.00 0.98 0.00 0.00 173.24 173.71 1k0w s ALA 31 N -4.04 -0.53 0.30 5.32 0.00 -0.73 -1.42 121.76 120.65 1k0w s ALA 31 Ca 0.24 0.35 0.07 0.00 0.00 0.00 0.00 51.96 52.62 1k0w s ALA 31 Cb 0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 1k0w s ALA 31 CO 0.02 -0.16 0.32 0.54 0.00 0.00 0.00 175.76 176.47 1k0w s VAL 32 N -0.58 4.17 -0.37 0.00 0.11 -0.37 -0.57 120.40 122.78 1k0w s VAL 32 Ca -0.07 -1.23 0.00 0.00 -2.93 0.00 0.00 61.98 57.75 1k0w s VAL 32 Cb -0.04 -3.40 0.13 0.00 -1.53 0.00 0.00 36.38 31.54 1k0w s VAL 32 CO 0.01 -0.24 0.21 -0.62 -3.33 0.00 0.00 175.10 171.13 1k0w s ASP 33 N -3.99 3.23 0.20 3.54 3.68 0.39 -4.96 116.67 118.75 1k0w s ASP 33 Ca 0.39 -2.23 -0.11 0.00 2.13 0.00 0.00 52.55 52.72 1k0w s ASP 33 Cb -0.08 -0.59 0.21 0.00 -1.45 0.00 0.00 42.92 41.02 1k0w s ASP 33 CO 0.28 -0.31 1.76 0.03 0.13 0.00 0.00 175.17 177.06 1k0w h ARG 34 N 7.06 0.44 -0.91 4.34 -0.00 -1.97 -1.79 114.38 121.55 1k0w h ARG 34 Ca 0.02 -0.03 0.10 0.00 -0.50 0.00 0.00 59.98 59.58 1k0w h ARG 34 Cb 0.96 -0.10 -0.07 0.00 0.00 0.00 0.00 29.97 30.77 1k0w h ARG 34 CO 0.34 0.29 0.58 0.93 0.00 0.00 0.00 179.97 182.11 1k0w h GLU 35 N 0.45 0.86 -0.56 0.04 5.08 -1.95 -0.15 114.58 118.34 1k0w h GLU 35 Ca 0.27 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1k0w h GLU 35 Cb 0.26 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1k0w h GLU 35 CO -0.24 0.57 0.00 0.54 -1.00 0.00 0.00 179.01 178.88 1k0w n ARG 36 N -4.54 2.37 -4.02 2.33 1.74 -0.97 -4.96 116.66 108.61 1k0w n ARG 36 Ca 0.16 -2.13 -0.30 0.00 -0.77 0.00 0.00 57.85 54.82 1k0w n ARG 36 Cb 0.33 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.29 1k0w n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k0w n GLY 37 N 1.45 -0.35 3.38 -0.13 0.00 -0.07 -4.97 105.19 104.50 1k0w n GLY 37 Ca 0.20 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 46.27 1k0w n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k0w s VAL 38 N -3.59 0.05 0.04 1.61 0.11 -1.02 -1.88 120.40 115.72 1k0w s VAL 38 Ca 0.38 -1.34 0.00 0.00 -2.93 0.00 0.00 61.98 58.09 1k0w s VAL 38 Cb -0.20 -1.87 -0.03 0.00 -1.53 0.00 0.00 36.38 32.75 1k0w s VAL 38 CO 0.89 -0.24 -0.04 0.72 -3.33 0.00 0.00 175.10 173.10 1k0w s PHE 39 N -3.97 0.45 -0.18 1.54 -0.71 -0.47 -0.46 117.98 114.17 1k0w s PHE 39 Ca 0.18 -0.69 -0.03 0.00 -1.04 0.00 0.00 56.93 55.35 1k0w s PHE 39 Cb 0.03 -0.30 -0.01 0.00 -1.21 0.00 0.00 43.02 41.52 1k0w s PHE 39 CO 0.01 -0.21 -0.07 0.08 -1.34 0.00 0.00 175.22 173.69 1k0w s VAL 40 N -2.22 3.36 0.13 -2.49 1.01 0.26 -0.33 120.40 120.12 1k0w s VAL 40 Ca -0.07 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.44 1k0w s VAL 40 Cb -0.04 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1k0w s VAL 40 CO -0.03 0.47 -0.13 -0.51 0.00 0.00 0.00 175.10 174.90 1k0w s ILE 41 N 0.95 1.28 0.45 2.22 2.07 0.04 -1.78 121.20 126.43 1k0w s ILE 41 Ca -0.01 -1.83 -0.25 0.00 -1.41 0.00 0.00 60.65 57.15 1k0w s ILE 41 Cb -0.15 -1.63 -0.09 0.00 0.13 0.00 0.00 42.46 40.73 1k0w s ILE 41 CO 0.00 -0.53 1.29 1.17 -1.91 0.00 0.00 174.94 174.96 1k0w n LYS 42 N 0.28 1.90 -1.91 3.50 4.81 -1.11 -1.51 118.16 124.13 1k0w n LYS 42 Ca -0.14 0.68 -0.30 0.00 -0.87 0.00 0.00 58.31 57.68 1k0w n LYS 42 Cb 0.58 -2.43 0.03 0.00 0.02 0.00 0.00 35.03 33.24 1k0w n LYS 42 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1k0w s PRO 43 N -2.34 3.10 -0.08 1.64 0.04 -1.26 -1.36 135.00 134.74 1k0w s PRO 43 Ca 0.63 0.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.12 1k0w s PRO 43 Cb -0.49 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 1k0w s PRO 43 CO 0.57 -0.87 0.20 0.45 0.04 0.00 0.00 177.00 177.39 1k0w s SER 44 N -4.30 6.47 0.00 6.66 0.15 0.32 -4.46 113.70 118.54 1k0w s SER 44 Ca 0.57 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.77 1k0w s SER 44 Cb -0.11 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.10 1k0w s SER 44 CO 0.52 0.37 0.00 0.61 1.20 0.00 0.00 173.24 175.94 1k0w n GLY 45 N 1.80 0.61 2.83 9.45 0.00 -1.26 -4.53 105.19 114.09 1k0w n GLY 45 Ca -0.18 -0.79 -0.23 0.00 0.00 0.00 0.00 46.02 44.83 1k0w n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k0w s VAL 46 N -2.00 0.53 0.40 1.61 1.01 -1.26 -5.13 120.40 115.56 1k0w s VAL 46 Ca 0.00 -0.02 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 1k0w s VAL 46 Cb 0.00 -0.62 -0.09 0.00 0.00 0.00 0.00 36.38 35.67 1k0w s VAL 46 CO 0.00 0.27 1.22 -1.81 0.00 0.00 0.00 175.10 174.78 1k0w s ASP 47 N 1.57 6.46 0.41 3.32 1.01 -1.26 -4.85 116.67 123.32 1k0w s ASP 47 Ca -0.00 2.47 0.15 0.00 0.71 0.00 0.00 52.55 55.87 1k0w s ASP 47 Cb -0.13 -2.62 1.01 0.00 1.01 0.00 0.00 42.92 42.19 1k0w s ASP 47 CO -0.04 -0.73 1.88 1.88 0.21 0.00 0.00 175.17 178.37 1k0w h TYR 48 N 2.69 0.58 0.00 4.23 0.05 -1.96 -1.13 116.97 121.44 1k0w h TYR 48 Ca -0.49 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.31 1k0w h TYR 48 Cb 1.24 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1k0w h TYR 48 CO 0.54 0.19 0.00 0.66 -1.05 0.00 0.00 178.16 178.50 1k0w h SER 49 N 0.47 0.00 0.00 3.88 4.64 -1.98 -3.20 113.55 117.36 1k0w h SER 49 Ca 0.43 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.74 1k0w h SER 49 Cb 0.96 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1k0w h SER 49 CO -0.16 0.00 -1.47 -0.38 -0.87 0.00 0.00 176.83 173.94 1k0w n ILE 50 N -2.43 0.02 -1.65 0.95 2.08 -0.52 -5.04 119.36 112.77 1k0w n ILE 50 Ca 0.02 -0.24 -0.46 0.00 0.56 0.00 0.00 62.75 62.64 1k0w n ILE 50 Cb 0.28 0.24 -0.03 0.00 -0.75 0.00 0.00 39.64 39.37 1k0w n ILE 50 CO 0.00 0.00 0.00 0.80 0.56 0.00 0.00 176.55 177.91 1k0w n MET 51 N -1.87 1.83 -4.33 0.38 1.56 -0.63 -5.02 117.12 109.04 1k0w n MET 51 Ca -0.02 0.65 -0.17 0.00 -0.27 0.00 0.00 57.70 57.89 1k0w n MET 51 Cb 0.28 -2.27 -0.10 0.00 2.15 0.00 0.00 33.22 33.28 1k0w n MET 51 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 1k0w s THR 52 N -0.13 1.05 0.52 1.12 -4.23 -1.26 -5.03 115.64 107.68 1k0w s THR 52 Ca 0.69 -2.04 0.21 0.00 -1.18 0.00 0.00 61.69 59.38 1k0w s THR 52 Cb -0.69 -2.35 0.35 0.00 1.34 0.00 0.00 72.50 71.15 1k0w s THR 52 CO 0.51 -0.32 2.04 0.00 -0.54 0.00 0.00 174.62 176.31 1k0w h ALA 53 N 2.46 2.30 0.00 3.99 0.00 -1.96 0.11 119.26 126.17 1k0w h ALA 53 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1k0w h ALA 53 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1k0w h ALA 53 CO 0.65 -0.40 0.00 -3.47 0.00 0.00 0.00 179.25 176.02 1k0w n ASP 54 N -4.44 0.58 0.08 0.00 2.03 -1.26 -2.64 116.55 110.90 1k0w n ASP 54 Ca 0.06 0.64 0.12 0.00 0.52 0.00 0.00 54.79 56.13 1k0w n ASP 54 Cb 0.42 -0.76 0.21 0.00 -0.72 0.00 0.00 41.12 40.27 1k0w n ASP 54 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1k0w h ASP 55 N 0.00 0.00 -3.74 1.67 3.45 -1.18 -3.44 116.42 113.18 1k0w h ASP 55 Ca 0.00 -0.14 -0.53 0.00 0.43 0.00 0.00 57.03 56.79 1k0w h ASP 55 Cb 0.35 0.00 0.07 0.00 -0.56 0.00 0.00 39.33 39.18 1k0w h ASP 55 CO 0.00 0.07 0.68 -0.04 -1.57 0.00 0.00 179.24 178.38 1k0w s MET 56 N -3.17 4.31 -0.14 3.56 -1.94 -1.08 -4.27 119.30 116.57 1k0w s MET 56 Ca 0.07 2.27 -0.06 0.00 -1.71 0.00 0.00 55.69 56.26 1k0w s MET 56 Cb 0.12 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.85 1k0w s MET 56 CO 0.70 -0.29 0.06 0.08 -0.01 0.00 0.00 175.02 175.56 1k0w s VAL 57 N -0.80 4.83 -0.25 -6.03 1.01 -0.57 -4.69 120.40 113.89 1k0w s VAL 57 Ca 0.52 -0.04 -0.13 0.00 0.00 0.00 0.00 61.98 62.34 1k0w s VAL 57 Cb -0.41 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1k0w s VAL 57 CO 0.51 0.55 0.27 -0.69 0.00 0.00 0.00 175.10 175.74 1k0w s VAL 58 N -0.40 5.27 -0.04 2.92 1.01 0.04 -0.78 120.40 128.42 1k0w s VAL 58 Ca 0.09 0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.51 1k0w s VAL 58 Cb -0.12 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1k0w s VAL 58 CO 0.02 0.25 -0.24 -0.69 0.00 0.00 0.00 175.10 174.44 1k0w s VAL 59 N 1.59 1.91 0.11 2.92 1.01 0.54 0.11 120.40 128.59 1k0w s VAL 59 Ca 0.11 -1.01 -0.31 0.00 0.00 0.00 0.00 61.98 60.77 1k0w s VAL 59 Cb -0.15 -1.60 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 1k0w s VAL 59 CO 0.08 0.54 1.44 -0.55 0.00 0.00 0.00 175.10 176.61 1k0w s SER 60 N -0.34 6.77 0.13 3.32 0.15 -0.04 -1.37 113.70 122.32 1k0w s SER 60 Ca 0.03 2.36 -0.14 0.00 0.70 0.00 0.00 55.95 58.89 1k0w s SER 60 Cb -0.11 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.60 1k0w s SER 60 CO 0.01 -0.71 1.59 0.40 1.20 0.00 0.00 173.24 175.74 1k0w h ILE 61 N 4.34 1.25 -0.20 6.45 2.04 -1.70 0.18 117.51 129.87 1k0w h ILE 61 Ca -0.42 -0.96 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 1k0w h ILE 61 Cb 1.20 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1k0w h ILE 61 CO 0.88 0.33 -0.11 -0.08 0.00 0.00 0.00 178.15 179.17 1k0w h GLU 62 N 0.56 0.42 0.00 2.37 4.81 -1.92 -3.37 114.58 117.46 1k0w h GLU 62 Ca 0.12 -0.19 -0.16 0.00 -0.13 0.00 0.00 59.36 59.00 1k0w h GLU 62 Cb 0.43 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1k0w h GLU 62 CO 0.02 0.72 -2.09 0.25 -0.73 0.00 0.00 179.01 177.18 1k0w n THR 63 N -4.55 0.62 -0.89 0.32 -2.24 -1.24 -4.98 114.28 101.33 1k0w n THR 63 Ca -0.05 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1k0w n THR 63 Cb 0.33 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 1k0w n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k0w n GLY 64 N 1.60 0.77 3.80 3.38 0.00 0.64 -5.00 105.19 110.38 1k0w n GLY 64 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1k0w n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k0w s GLU 65 N -0.11 4.28 -0.02 1.61 2.56 -1.26 -4.69 118.70 121.07 1k0w s GLU 65 Ca 0.00 1.26 -0.30 0.00 0.00 0.00 0.00 54.97 55.93 1k0w s GLU 65 Cb 0.00 -2.40 -0.04 0.00 2.00 0.00 0.00 34.13 33.68 1k0w s GLU 65 CO 0.00 0.01 1.27 0.54 -0.56 0.00 0.00 175.26 176.52 1k0w s VAL 66 N -1.92 4.03 -0.10 3.70 0.11 -1.26 -0.86 120.40 124.09 1k0w s VAL 66 Ca 0.58 1.39 0.14 0.00 -2.93 0.00 0.00 61.98 61.16 1k0w s VAL 66 Cb -0.14 -3.89 -0.24 0.00 -1.53 0.00 0.00 36.38 30.58 1k0w s VAL 66 CO 0.19 0.01 0.46 0.52 -3.33 0.00 0.00 175.10 172.95 1k0w n VAL 67 N 4.54 1.54 -3.63 2.04 0.31 0.12 -4.90 118.33 118.34 1k0w n VAL 67 Ca 0.11 -0.81 -0.11 0.00 -0.01 0.00 0.00 64.34 63.53 1k0w n VAL 67 Cb 0.45 -0.87 -0.07 0.00 -0.91 0.00 0.00 33.84 32.45 1k0w n VAL 67 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1k0w s GLU 68 N -2.56 0.60 0.00 5.55 2.12 -1.11 -4.99 118.70 118.30 1k0w s GLU 68 Ca -0.07 0.65 0.00 0.00 0.36 0.00 0.00 54.97 55.92 1k0w s GLU 68 Cb 0.07 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.75 1k0w s GLU 68 CO 0.82 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.87 1k0w n GLY 69 N 2.20 4.33 0.11 -1.50 0.00 -1.26 -0.78 105.19 108.29 1k0w n GLY 69 Ca -0.13 -1.17 0.02 0.00 0.00 0.00 0.00 46.02 44.74 1k0w n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0w h ALA 70 N 0.00 0.65 -2.27 4.61 0.00 -1.89 -3.47 119.26 116.88 1k0w h ALA 70 Ca 0.00 -0.62 -0.48 0.00 0.00 0.00 0.00 54.91 53.81 1k0w h ALA 70 Cb 0.00 0.12 0.02 0.00 0.00 0.00 0.00 17.79 17.94 1k0w h ALA 70 CO 0.00 0.72 -0.05 0.15 0.00 0.00 0.00 179.25 180.07 1k0w s LYS 71 N -2.98 3.52 0.05 0.00 1.02 -1.26 -5.06 119.74 115.03 1k0w s LYS 71 Ca -0.00 -0.07 -0.30 0.00 0.02 0.00 0.00 55.97 55.61 1k0w s LYS 71 Cb 0.08 -2.53 -0.05 0.00 -0.52 0.00 0.00 37.83 34.82 1k0w s LYS 71 CO 0.78 -0.01 1.14 0.21 -0.92 0.00 0.00 175.35 176.55 1k0w s LYS 72 N -4.48 4.47 0.83 1.68 2.36 -1.26 -4.89 119.74 118.44 1k0w s LYS 72 Ca 0.44 1.68 -0.10 0.00 -2.55 0.00 0.00 55.97 55.43 1k0w s LYS 72 Cb -0.10 -3.38 0.09 0.00 -1.05 0.00 0.00 37.83 33.40 1k0w s LYS 72 CO 0.40 -0.20 1.11 -1.25 1.55 0.00 0.00 175.35 176.96 1k0w s PRO 73 N 1.03 1.78 0.40 4.03 0.04 -1.26 0.12 135.00 141.14 1k0w s PRO 73 Ca 0.57 1.27 -0.24 0.00 0.04 0.00 0.00 61.00 62.63 1k0w s PRO 73 Cb -0.27 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.32 1k0w s PRO 73 CO 0.29 -2.01 0.90 0.45 0.04 0.00 0.00 177.00 176.67 1k0w n SER 74 N -3.78 0.74 0.10 6.66 2.88 -0.47 -4.01 113.62 115.74 1k0w n SER 74 Ca 0.10 1.02 0.09 0.00 -1.33 0.00 0.00 58.87 58.75 1k0w n SER 74 Cb 0.53 -1.29 0.41 0.00 -0.75 0.00 0.00 64.21 63.11 1k0w n SER 74 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1k0w n SER 75 N 0.76 0.41 -0.43 -3.46 3.41 -1.26 -1.12 113.62 111.93 1k0w n SER 75 Ca 0.10 0.64 0.14 0.00 -0.26 0.00 0.00 58.87 59.49 1k0w n SER 75 Cb 0.38 -0.71 0.50 0.00 -0.26 0.00 0.00 64.21 64.12 1k0w n SER 75 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1k0w n ASP 76 N -1.99 1.40 -0.31 4.04 10.43 -1.26 -4.45 116.55 124.41 1k0w n ASP 76 Ca 0.01 -1.38 0.14 0.00 2.57 0.00 0.00 54.79 56.13 1k0w n ASP 76 Cb 0.13 0.02 0.32 0.00 1.84 0.00 0.00 41.12 43.43 1k0w n ASP 76 CO 0.00 0.00 0.00 0.74 -1.07 0.00 0.00 177.20 176.87 1k0w h THR 77 N 2.12 0.44 -0.52 -3.53 2.02 -1.46 -0.89 112.91 111.09 1k0w h THR 77 Ca 0.00 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.03 1k0w h THR 77 Cb 0.50 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1k0w h THR 77 CO 0.00 0.07 0.26 -0.65 0.37 0.00 0.00 175.52 175.57 1k0w h PRO 78 N 0.38 0.73 -0.41 6.66 0.11 -1.84 -0.15 132.00 137.48 1k0w h PRO 78 Ca 0.58 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 66.52 1k0w h PRO 78 Cb 1.12 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1k0w h PRO 78 CO -0.55 0.56 -0.08 1.15 -0.21 0.00 0.00 178.00 178.87 1k0w h THR 79 N 0.73 1.27 -0.24 -1.15 2.02 -1.20 -1.49 112.91 112.85 1k0w h THR 79 Ca 0.18 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 66.20 1k0w h THR 79 Cb 0.07 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1k0w h THR 79 CO -0.03 0.39 0.15 0.45 0.37 0.00 0.00 175.52 176.86 1k0w h HIS 80 N 0.59 0.30 -0.33 3.16 3.86 -1.04 -2.14 115.15 119.56 1k0w h HIS 80 Ca 0.11 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.35 1k0w h HIS 80 Cb 0.60 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.94 1k0w h HIS 80 CO 0.05 0.21 0.14 -0.09 0.86 0.00 0.00 177.93 179.10 1k0w h ARG 81 N 0.31 0.29 -0.48 2.45 2.43 -0.89 -1.77 114.38 116.72 1k0w h ARG 81 Ca 0.09 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1k0w h ARG 81 Cb -0.01 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1k0w h ARG 81 CO -0.02 0.19 0.31 1.25 -1.51 0.00 0.00 179.97 180.20 1k0w h LEU 82 N 0.30 0.55 -1.14 3.80 7.12 -1.14 -2.27 115.31 122.53 1k0w h LEU 82 Ca 0.14 -0.02 -0.01 0.00 0.13 0.00 0.00 57.88 58.13 1k0w h LEU 82 Cb 0.08 -0.14 -0.04 0.00 -0.53 0.00 0.00 40.66 40.04 1k0w h LEU 82 CO -0.12 0.40 0.45 -0.07 -0.13 0.00 0.00 178.44 178.97 1k0w h LEU 83 N 0.65 0.92 -0.94 2.25 3.38 -1.05 0.50 115.31 121.01 1k0w h LEU 83 Ca 0.17 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1k0w h LEU 83 Cb -0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1k0w h LEU 83 CO -0.04 0.72 -0.02 1.88 0.09 0.00 0.00 178.44 181.07 1k0w h TYR 84 N 1.05 0.80 -0.16 1.13 0.05 -0.92 0.51 116.97 119.44 1k0w h TYR 84 Ca 0.27 -0.11 -0.20 0.00 0.05 0.00 0.00 58.73 58.74 1k0w h TYR 84 Cb -0.02 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 37.50 1k0w h TYR 84 CO 0.00 0.76 -0.71 1.96 -1.05 0.00 0.00 178.16 179.12 1k0w h GLN 85 N 0.70 0.68 0.08 4.88 4.20 -0.84 -3.33 115.11 121.48 1k0w h GLN 85 Ca 0.14 -0.52 -0.24 0.00 0.06 0.00 0.00 58.65 58.08 1k0w h GLN 85 Cb 0.46 0.10 0.02 0.00 0.30 0.00 0.00 27.48 28.36 1k0w h GLN 85 CO 0.02 1.14 -0.98 0.00 -0.67 0.00 0.00 178.83 178.34 1k0w h ALA 86 N 0.72 0.01 -2.99 3.87 0.00 -0.62 -3.42 119.26 116.83 1k0w h ALA 86 Ca -0.03 -0.70 -0.71 0.00 0.00 0.00 0.00 54.91 53.47 1k0w h ALA 86 Cb 1.31 0.08 -0.33 0.00 0.00 0.00 0.00 17.79 18.86 1k0w h ALA 86 CO 0.14 0.55 -0.37 -0.06 0.00 0.00 0.00 179.25 179.50 1k0w s PHE 87 N -2.99 3.49 0.28 0.00 0.08 0.18 -4.97 117.98 114.05 1k0w s PHE 87 Ca -0.11 -2.36 0.02 0.00 0.12 0.00 0.00 56.93 54.60 1k0w s PHE 87 Cb 0.04 -3.34 0.62 0.00 -0.57 0.00 0.00 43.02 39.77 1k0w s PHE 87 CO 0.89 -0.93 1.79 -1.35 -0.10 0.00 0.00 175.22 175.52 1k0w h PRO 88 N 7.71 0.76 0.00 0.24 0.11 -1.82 -2.90 132.00 136.11 1k0w h PRO 88 Ca -0.08 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.95 1k0w h PRO 88 Cb 1.01 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1k0w h PRO 88 CO 0.75 0.50 -0.14 0.66 -0.21 0.00 0.00 178.00 179.57 1k0w h SER 89 N 0.78 0.00 -3.79 -2.05 4.64 -1.93 -3.45 113.55 107.75 1k0w h SER 89 Ca 0.52 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 61.34 1k0w h SER 89 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1k0w h SER 89 CO -0.34 0.14 0.42 0.27 -0.87 0.00 0.00 176.83 176.44 1k0w s ILE 90 N -3.79 3.75 -0.10 0.95 -4.36 -1.09 -4.78 121.20 111.78 1k0w s ILE 90 Ca -0.00 1.75 0.02 0.00 -0.26 0.00 0.00 60.65 62.16 1k0w s ILE 90 Cb 0.11 -4.10 -0.03 0.00 1.25 0.00 0.00 42.46 39.68 1k0w s ILE 90 CO 0.59 0.40 0.10 0.61 0.24 0.00 0.00 174.94 176.88 1k0w n GLY 91 N 1.27 0.67 3.31 6.27 0.00 0.30 -4.89 105.19 112.12 1k0w n GLY 91 Ca -0.01 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 1k0w n GLY 91 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k0w s GLY 92 N -1.35 -0.27 -0.03 -0.02 0.00 -0.76 -1.24 107.32 103.65 1k0w s GLY 92 Ca 0.01 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.44 1k0w s GLY 92 CO 0.10 0.46 -0.06 -0.42 0.00 0.00 0.00 173.10 173.18 1k0w s ILE 93 N -1.02 0.58 -0.07 0.90 1.01 -0.51 -1.22 121.20 120.87 1k0w s ILE 93 Ca -0.11 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.36 1k0w s ILE 93 Cb -0.04 -0.55 0.00 0.00 0.01 0.00 0.00 42.46 41.88 1k0w s ILE 93 CO 0.05 0.20 -0.20 -0.69 0.00 0.00 0.00 174.94 174.30 1k0w s VAL 94 N 0.43 1.73 -0.11 2.92 1.01 0.14 -1.22 120.40 125.29 1k0w s VAL 94 Ca -0.06 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1k0w s VAL 94 Cb -0.10 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.80 1k0w s VAL 94 CO 0.00 0.49 -0.15 -2.28 0.00 0.00 0.00 175.10 173.16 1k0w s HIS 95 N 0.25 1.96 0.30 5.22 5.04 -0.28 -0.06 115.29 127.72 1k0w s HIS 95 Ca -0.12 -0.95 0.04 0.00 -1.54 0.00 0.00 55.06 52.49 1k0w s HIS 95 Cb -0.15 -1.43 -0.03 0.00 0.04 0.00 0.00 32.58 31.01 1k0w s HIS 95 CO 0.05 -0.50 0.28 0.95 -2.34 0.00 0.00 174.74 173.18 1k0w s THR 96 N 1.09 0.00 -0.32 0.89 -4.23 -1.12 -0.94 115.64 111.02 1k0w s THR 96 Ca -0.04 -1.93 0.09 0.00 -1.18 0.00 0.00 61.69 58.62 1k0w s THR 96 Cb -0.14 -2.51 0.46 0.00 1.34 0.00 0.00 72.50 71.64 1k0w s THR 96 CO -0.03 0.00 1.16 1.41 -0.54 0.00 0.00 174.62 176.61 1k0w n HIS 97 N -0.54 2.67 -1.64 3.99 8.25 -1.25 -3.41 115.22 123.29 1k0w n HIS 97 Ca 0.05 -2.42 -0.48 0.00 -0.26 0.00 0.00 57.72 54.62 1k0w n HIS 97 Cb 0.63 -0.28 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 1k0w n HIS 97 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1k0w n SER 98 N -0.63 2.59 -0.38 0.41 3.41 -1.09 -4.76 113.62 113.17 1k0w n SER 98 Ca 0.38 1.10 -0.04 0.00 -0.26 0.00 0.00 58.87 60.04 1k0w n SER 98 Cb 0.88 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 1k0w n SER 98 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1k0w h ARG 99 N 5.44 -0.01 0.01 4.33 3.08 -1.88 -0.98 114.38 124.37 1k0w h ARG 99 Ca -0.46 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.38 1k0w h ARG 99 Cb 1.28 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 1k0w h ARG 99 CO 0.85 -0.01 -0.92 0.45 -1.07 0.00 0.00 179.97 179.27 1k0w h HIS 100 N -0.01 0.38 -0.27 3.04 3.86 -1.89 -0.46 115.15 119.80 1k0w h HIS 100 Ca 0.29 -0.21 -0.12 0.00 -1.16 0.00 0.00 60.37 59.16 1k0w h HIS 100 Cb 0.55 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1k0w h HIS 100 CO -0.90 1.04 -0.35 0.00 0.86 0.00 0.00 177.93 178.58 1k0w h ALA 101 N 0.89 0.89 -0.09 2.45 0.00 -1.78 -2.54 119.26 119.08 1k0w h ALA 101 Ca -0.06 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 1k0w h ALA 101 Cb 1.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1k0w h ALA 101 CO 0.15 0.63 -0.58 1.15 0.00 0.00 0.00 179.25 180.59 1k0w h THR 102 N 0.50 1.37 -0.49 0.00 2.02 -1.10 -1.17 112.91 114.04 1k0w h THR 102 Ca 0.05 -1.92 -0.00 0.00 0.77 0.00 0.00 66.41 65.31 1k0w h THR 102 Cb 0.84 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 1k0w h THR 102 CO 0.07 0.57 0.30 0.40 0.37 0.00 0.00 175.52 177.23 1k0w h ILE 103 N 0.21 1.15 -0.64 3.11 2.04 -0.80 0.22 117.51 122.79 1k0w h ILE 103 Ca -0.00 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 1k0w h ILE 103 Cb 1.08 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1k0w h ILE 103 CO 0.09 0.15 0.18 -0.50 0.00 0.00 0.00 178.15 178.07 1k0w h TRP 104 N 0.66 1.05 -0.55 1.37 4.06 -1.22 -0.85 115.95 120.46 1k0w h TRP 104 Ca 0.18 -0.11 0.01 0.00 2.06 0.00 0.00 58.89 61.02 1k0w h TRP 104 Cb -0.02 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 27.82 1k0w h TRP 104 CO -0.03 0.86 0.35 0.00 -3.56 0.00 0.00 178.44 176.06 1k0w h ALA 105 N 1.06 0.70 -0.11 1.49 0.00 -0.61 -0.81 119.26 120.98 1k0w h ALA 105 Ca 0.20 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1k0w h ALA 105 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1k0w h ALA 105 CO -0.00 0.10 -0.34 1.96 0.00 0.00 0.00 179.25 180.97 1k0w h GLN 106 N 0.71 0.22 0.00 0.00 4.20 -0.32 0.39 115.11 120.31 1k0w h GLN 106 Ca 0.21 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1k0w h GLN 106 Cb -0.05 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1k0w h GLN 106 CO -0.06 0.54 0.00 0.00 -0.67 0.00 0.00 178.83 178.64 1k0w n ALA 107 N -2.48 1.97 -2.22 3.87 0.00 -0.35 -4.54 120.51 116.77 1k0w n ALA 107 Ca -0.01 0.03 -0.10 0.00 0.00 0.00 0.00 53.44 53.36 1k0w n ALA 107 Cb 0.42 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.44 1k0w n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k0w n GLY 108 N 0.66 -0.02 3.31 0.00 0.00 -0.38 -5.03 105.19 103.73 1k0w n GLY 108 Ca 0.04 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1k0w n GLY 108 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k0w s GLN 109 N -4.53 1.69 0.36 1.61 -0.21 -0.94 -4.95 119.66 112.68 1k0w s GLN 109 Ca 0.01 -1.02 -0.22 0.00 0.02 0.00 0.00 55.36 54.15 1k0w s GLN 109 Cb -0.00 -1.82 -0.10 0.00 1.00 0.00 0.00 33.01 32.08 1k0w s GLN 109 CO 0.01 0.47 0.91 -1.12 -2.12 0.00 0.00 175.29 173.44 1k0w s SER 110 N -1.13 7.08 -0.38 5.90 0.01 -1.26 -4.55 113.70 119.36 1k0w s SER 110 Ca 0.10 1.68 -0.22 0.00 1.31 0.00 0.00 55.95 58.81 1k0w s SER 110 Cb -0.10 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.62 1k0w s SER 110 CO 0.02 -0.20 0.73 -0.63 0.41 0.00 0.00 173.24 173.56 1k0w s ILE 111 N -1.90 4.77 0.50 1.44 1.01 -0.47 -4.92 121.20 121.63 1k0w s ILE 111 Ca 0.55 0.67 -0.19 0.00 0.00 0.00 0.00 60.65 61.69 1k0w s ILE 111 Cb -0.13 -4.19 -0.08 0.00 0.01 0.00 0.00 42.46 38.07 1k0w s ILE 111 CO 0.18 -0.46 1.02 -2.16 0.00 0.00 0.00 174.94 173.52 1k0w s PRO 112 N 3.00 3.78 -0.43 2.79 0.04 -1.26 -1.18 135.00 141.74 1k0w s PRO 112 Ca 0.29 1.24 -0.28 0.00 0.04 0.00 0.00 61.00 62.28 1k0w s PRO 112 Cb -0.13 -2.10 0.03 0.00 0.04 0.00 0.00 34.50 32.33 1k0w s PRO 112 CO 0.17 -0.43 1.09 0.00 0.04 0.00 0.00 177.00 177.87 1k0w s ALA 113 N -2.20 3.26 0.00 8.56 0.00 -1.26 -4.84 121.76 125.28 1k0w s ALA 113 Ca 0.65 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1k0w s ALA 113 Cb -0.14 -3.80 0.00 0.00 0.00 0.00 0.00 23.12 19.18 1k0w s ALA 113 CO 0.24 -2.02 0.80 0.25 0.00 0.00 0.00 175.76 175.03 1k0w n THR 114 N 6.53 0.64 -3.64 0.00 -2.24 -1.26 -0.73 114.28 113.58 1k0w n THR 114 Ca 0.11 -0.71 -0.10 0.00 -2.27 0.00 0.00 64.05 61.08 1k0w n THR 114 Cb 0.48 0.72 -0.04 0.00 -2.10 0.00 0.00 70.33 69.39 1k0w n THR 114 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1k0w s GLY 115 N -0.64 -0.25 0.51 3.38 0.00 -1.26 -4.76 107.32 104.30 1k0w s GLY 115 Ca 0.00 -0.04 0.29 0.00 0.00 0.00 0.00 44.72 44.97 1k0w s GLY 115 CO 0.00 -0.24 1.99 -0.91 0.00 0.00 0.00 173.10 173.94 1k0w h THR 116 N 2.26 0.38 0.24 0.90 1.35 -1.98 -2.17 112.91 113.90 1k0w h THR 116 Ca -0.32 -0.70 -0.01 0.00 -0.55 0.00 0.00 66.41 64.83 1k0w h THR 116 Cb 1.27 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1k0w h THR 116 CO 0.43 0.12 -0.12 0.74 -0.25 0.00 0.00 175.52 176.44 1k0w h THR 117 N 0.00 0.77 -0.31 6.82 2.02 -2.00 -1.74 112.91 118.46 1k0w h THR 117 Ca -0.00 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 1k0w h THR 117 Cb 0.50 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 1k0w h THR 117 CO 0.02 0.01 0.18 -0.74 0.37 0.00 0.00 175.52 175.36 1k0w h HIS 118 N -0.35 0.41 -0.02 3.16 6.17 -1.89 -2.96 115.15 119.68 1k0w h HIS 118 Ca -0.03 -0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.05 1k0w h HIS 118 Cb 0.27 -0.13 -0.00 0.00 2.52 0.00 0.00 27.41 30.06 1k0w h HIS 118 CO -0.05 0.31 0.01 0.00 0.71 0.00 0.00 177.93 178.92 1k0w h ALA 119 N 1.06 1.84 0.00 5.26 0.00 -1.21 0.26 119.26 126.46 1k0w h ALA 119 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1k0w h ALA 119 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1k0w h ALA 119 CO -0.02 -0.02 0.00 -0.91 0.00 0.00 0.00 179.25 178.30 1k0w h ASN 120 N 0.00 0.00 0.00 0.00 2.35 -1.14 -3.02 115.58 113.77 1k0w h ASN 120 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1k0w h ASN 120 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1k0w h ASN 120 CO -0.00 0.00 -0.82 -1.22 -1.65 0.00 0.00 177.43 173.74 1k0w n TYR 121 N -2.87 0.00 -3.87 1.19 4.02 -0.68 -4.81 117.16 110.14 1k0w n TYR 121 Ca 0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.65 1k0w n TYR 121 Cb 0.32 0.00 -0.17 0.00 -0.02 0.00 0.00 39.34 39.47 1k0w n TYR 121 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1k0w s PHE 122 N -1.69 1.31 -1.38 -0.72 0.08 -0.01 -4.55 117.98 111.03 1k0w s PHE 122 Ca 0.00 -0.62 -0.14 0.00 0.12 0.00 0.00 56.93 56.29 1k0w s PHE 122 Cb 0.00 -1.14 -0.02 0.00 -0.57 0.00 0.00 43.02 41.29 1k0w s PHE 122 CO 0.00 -0.48 2.34 0.98 -0.10 0.00 0.00 175.22 177.97 1k0w n TYR 123 N 4.99 2.96 0.00 0.36 9.36 -0.34 -4.27 117.16 130.22 1k0w n TYR 123 Ca -0.11 -2.80 0.00 0.00 3.32 0.00 0.00 57.90 58.31 1k0w n TYR 123 Cb 0.50 -2.39 0.00 0.00 -0.63 0.00 0.00 39.34 36.82 1k0w n TYR 123 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1k0w n GLY 124 N 4.03 0.22 3.72 2.98 0.00 -1.26 -4.92 105.19 109.95 1k0w n GLY 124 Ca 0.57 -2.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1k0w n GLY 124 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1k0w n THR 125 N 0.00 0.12 -2.79 2.61 -1.04 -1.26 -4.52 114.28 107.39 1k0w n THR 125 Ca 0.00 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.55 1k0w n THR 125 Cb 0.00 -1.93 -0.04 0.00 -1.82 0.00 0.00 70.33 66.54 1k0w n THR 125 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1k0w s ILE 126 N 1.00 4.48 0.42 12.58 1.01 -0.33 -4.94 121.20 135.44 1k0w s ILE 126 Ca 0.74 0.94 -0.25 0.00 0.00 0.00 0.00 60.65 62.09 1k0w s ILE 126 Cb -0.52 -4.42 -0.08 0.00 0.01 0.00 0.00 42.46 37.45 1k0w s ILE 126 CO 0.35 -0.75 1.21 -2.16 0.00 0.00 0.00 174.94 173.59 1k0w s PRO 127 N 3.73 3.93 -0.11 2.79 0.04 -1.26 -1.37 135.00 142.75 1k0w s PRO 127 Ca 0.38 1.93 -0.01 0.00 0.04 0.00 0.00 61.00 63.34 1k0w s PRO 127 Cb -0.10 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 31.78 1k0w s PRO 127 CO 0.24 -0.45 -0.05 0.00 0.04 0.00 0.00 177.00 176.78 1k0w s THR 129 N -0.32 2.77 0.83 0.00 -4.23 0.11 -4.86 115.64 109.94 1k0w s THR 129 Ca 0.05 0.25 -0.12 0.00 -1.18 0.00 0.00 61.69 60.69 1k0w s THR 129 Cb -0.12 -3.02 0.09 0.00 1.34 0.00 0.00 72.50 70.79 1k0w s THR 129 CO 0.02 -0.33 1.16 0.00 -0.54 0.00 0.00 174.62 174.93 1k0w s ARG 130 N -5.21 1.83 0.69 3.99 1.70 -1.26 -4.02 118.95 116.66 1k0w s ARG 130 Ca 0.61 0.22 -0.15 0.00 -0.47 0.00 0.00 55.73 55.94 1k0w s ARG 130 Cb -0.14 -1.93 0.02 0.00 -0.57 0.00 0.00 34.95 32.33 1k0w s ARG 130 CO 0.54 -1.71 1.17 0.15 -1.08 0.00 0.00 175.30 174.37 1k0w s LYS 131 N -5.46 2.48 0.35 3.89 1.02 -1.26 -4.54 119.74 116.21 1k0w s LYS 131 Ca 0.62 1.64 -0.09 0.00 0.02 0.00 0.00 55.97 58.16 1k0w s LYS 131 Cb -0.12 -1.89 -0.06 0.00 -0.52 0.00 0.00 37.83 35.24 1k0w s LYS 131 CO 0.51 -1.55 0.68 -1.64 -0.92 0.00 0.00 175.35 172.43 1k0w s MET 132 N -3.90 3.75 0.64 1.68 -1.94 -1.26 -5.08 119.30 113.19 1k0w s MET 132 Ca 0.72 0.31 -0.09 0.00 -1.71 0.00 0.00 55.69 54.92 1k0w s MET 132 Cb -0.26 -2.50 0.00 0.00 2.01 0.00 0.00 34.83 34.08 1k0w s MET 132 CO 0.42 0.09 0.99 0.95 -0.01 0.00 0.00 175.02 177.46 1k0w s THR 133 N -2.20 3.77 0.23 2.05 -4.23 -1.26 -4.87 115.64 109.14 1k0w s THR 133 Ca 0.49 0.31 -0.08 0.00 -1.18 0.00 0.00 61.69 61.23 1k0w s THR 133 Cb -0.10 -3.53 0.22 0.00 1.34 0.00 0.00 72.50 70.42 1k0w s THR 133 CO 0.29 -0.63 1.91 0.44 -0.54 0.00 0.00 174.62 176.09 1k0w h ASP 134 N -0.37 1.04 -0.92 3.99 3.32 -1.98 0.35 116.42 121.86 1k0w h ASP 134 Ca -0.45 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 1k0w h ASP 134 Cb 1.24 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 1k0w h ASP 134 CO 0.62 0.76 0.56 0.00 -1.72 0.00 0.00 179.24 179.46 1k0w h ALA 135 N 1.33 1.17 -0.11 3.45 0.00 -1.96 0.52 119.26 123.65 1k0w h ALA 135 Ca 0.33 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1k0w h ALA 135 Cb -0.14 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.28 1k0w h ALA 135 CO -0.07 0.62 -0.02 0.93 0.00 0.00 0.00 179.25 180.70 1k0w h GLU 136 N 1.26 0.21 -0.54 0.00 5.08 -1.72 -0.42 114.58 118.45 1k0w h GLU 136 Ca 0.33 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 1k0w h GLU 136 Cb -0.06 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1k0w h GLU 136 CO -0.06 0.51 -0.00 0.82 -1.00 0.00 0.00 179.01 179.28 1k0w h ILE 137 N -0.10 1.26 -0.00 3.13 2.04 -0.63 -2.81 117.51 120.40 1k0w h ILE 137 Ca 0.03 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1k0w h ILE 137 Cb 0.43 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1k0w h ILE 137 CO 0.01 0.39 -0.17 0.59 0.00 0.00 0.00 178.15 178.96 1k0w n ASN 138 N -4.19 0.26 0.00 1.72 3.02 0.18 -4.39 115.26 111.86 1k0w n ASN 138 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1k0w n ASN 138 Cb 0.32 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1k0w n ASN 138 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k0w n GLY 139 N 1.44 0.79 3.41 7.41 0.00 -0.17 -4.86 105.19 113.21 1k0w n GLY 139 Ca 0.09 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1k0w n GLY 139 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k0w n GLU 140 N 0.00 3.33 -0.03 1.61 -0.58 -1.26 -4.90 120.64 118.80 1k0w n GLU 140 Ca 0.00 -3.62 -0.01 0.00 -0.42 0.00 0.00 57.16 53.11 1k0w n GLU 140 Cb 0.00 -3.17 -0.01 0.00 -0.57 0.00 0.00 31.44 27.70 1k0w n GLU 140 CO 0.00 0.00 0.00 -0.92 -0.48 0.00 0.00 177.13 175.73 1k0w h TYR 141 N 7.08 -0.15 -0.94 -0.32 3.20 -1.77 0.21 116.97 124.28 1k0w h TYR 141 Ca 0.37 0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.37 1k0w h TYR 141 Cb 0.84 0.07 -0.08 0.00 1.54 0.00 0.00 36.73 39.10 1k0w h TYR 141 CO 1.22 -0.03 0.57 0.93 -1.64 0.00 0.00 178.16 179.21 1k0w h GLU 142 N -0.00 0.87 -0.35 1.82 3.07 -1.90 0.12 114.58 118.21 1k0w h GLU 142 Ca 0.01 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1k0w h GLU 142 Cb 0.03 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.73 1k0w h GLU 142 CO -0.07 0.58 0.11 2.35 -1.40 0.00 0.00 179.01 180.57 1k0w h TRP 143 N 0.90 0.56 -0.37 4.33 2.91 -1.67 -2.71 115.95 119.90 1k0w h TRP 143 Ca 0.47 -0.06 -0.03 0.00 1.13 0.00 0.00 58.89 60.40 1k0w h TRP 143 Cb 0.48 -0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 1k0w h TRP 143 CO -0.03 0.55 0.10 1.49 -1.03 0.00 0.00 178.44 179.53 1k0w h GLU 144 N 0.41 0.53 -0.96 2.65 4.57 0.57 -0.98 114.58 121.37 1k0w h GLU 144 Ca 0.11 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1k0w h GLU 144 Cb 0.26 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.71 1k0w h GLU 144 CO -0.00 0.48 0.59 1.15 -1.18 0.00 0.00 179.01 180.05 1k0w h THR 145 N 0.53 1.26 -0.55 0.32 2.02 -0.52 0.10 112.91 116.07 1k0w h THR 145 Ca 0.13 -0.55 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1k0w h THR 145 Cb 0.18 -0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.46 1k0w h THR 145 CO -0.01 0.27 0.20 1.23 0.37 0.00 0.00 175.52 177.58 1k0w h GLY 146 N 1.32 0.89 0.97 2.16 0.00 -0.95 -1.77 103.07 105.70 1k0w h GLY 146 Ca 0.35 -0.50 0.01 0.00 0.00 0.00 0.00 47.33 47.19 1k0w h GLY 146 CO -0.07 0.47 0.45 3.43 0.00 0.00 0.00 176.54 180.82 1k0w h ASN 147 N 0.75 0.76 -0.32 0.19 2.35 -0.39 -1.11 115.58 117.81 1k0w h ASN 147 Ca 0.18 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1k0w h ASN 147 Cb 0.23 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1k0w h ASN 147 CO -0.01 0.55 -0.01 0.58 -1.65 0.00 0.00 177.43 176.89 1k0w h VAL 148 N 0.90 1.23 -0.22 2.81 2.07 -0.77 0.14 116.25 122.41 1k0w h VAL 148 Ca 0.26 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1k0w h VAL 148 Cb -0.07 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1k0w h VAL 148 CO -0.07 0.33 0.03 0.40 0.02 0.00 0.00 177.57 178.28 1k0w h ILE 149 N 0.64 1.23 -0.34 4.57 2.04 -0.75 -1.10 117.51 123.80 1k0w h ILE 149 Ca 0.13 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 1k0w h ILE 149 Cb 0.42 1.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1k0w h ILE 149 CO 0.02 0.24 0.19 0.58 0.00 0.00 0.00 178.15 179.17 1k0w h VAL 150 N 0.17 1.14 -0.91 1.67 2.07 -0.86 -2.40 116.25 117.13 1k0w h VAL 150 Ca 0.07 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.27 1k0w h VAL 150 Cb 0.33 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 1k0w h VAL 150 CO 0.01 0.14 0.59 -0.08 0.02 0.00 0.00 177.57 178.25 1k0w h GLU 151 N 0.43 1.05 -0.63 1.57 4.81 -0.60 -1.49 114.58 119.72 1k0w h GLU 151 Ca 0.12 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1k0w h GLU 151 Cb 0.06 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 1k0w h GLU 151 CO -0.02 0.70 0.40 1.15 -0.73 0.00 0.00 179.01 180.50 1k0w h THR 152 N 1.09 1.17 -0.06 0.32 2.02 -0.72 -0.38 112.91 116.35 1k0w h THR 152 Ca 0.38 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1k0w h THR 152 Cb 0.11 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1k0w h THR 152 CO -0.13 0.17 -0.02 -0.26 0.37 0.00 0.00 175.52 175.65 1k0w h PHE 153 N 0.85 0.14 0.04 3.16 -1.00 -0.98 -2.65 116.94 116.50 1k0w h PHE 153 Ca 0.23 -0.03 -0.00 0.00 2.81 0.00 0.00 57.97 60.97 1k0w h PHE 153 Cb -0.06 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.47 1k0w h PHE 153 CO -0.02 0.48 -0.02 0.93 -1.61 0.00 0.00 178.31 178.07 1k0w h GLU 154 N -0.24 -0.06 -0.44 1.51 5.08 -1.20 0.33 114.58 119.55 1k0w h GLU 154 Ca 0.01 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1k0w h GLU 154 Cb 0.44 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1k0w h GLU 154 CO 0.01 -0.04 0.30 0.87 -1.00 0.00 0.00 179.01 179.14 1k0w h LYS 155 N -0.06 0.44 -0.37 2.33 1.79 -1.14 -1.94 116.57 117.61 1k0w h LYS 155 Ca -0.01 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1k0w h LYS 155 Cb 0.05 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1k0w h LYS 155 CO 0.01 0.29 0.00 1.04 -1.08 0.00 0.00 179.45 179.71 1k0w n GLN 156 N -4.48 2.45 -3.51 3.15 6.02 -1.00 -4.97 117.38 115.04 1k0w n GLN 156 Ca 0.05 -2.19 -0.19 0.00 -0.01 0.00 0.00 57.00 54.65 1k0w n GLN 156 Cb 0.18 -1.51 0.08 0.00 1.02 0.00 0.00 30.24 30.01 1k0w n GLN 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k0w n GLY 157 N 1.48 -0.40 3.47 1.08 0.00 -0.20 -5.00 105.19 105.62 1k0w n GLY 157 Ca 0.19 0.14 -0.33 0.00 0.00 0.00 0.00 46.02 46.03 1k0w n GLY 157 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1k0w s ILE 158 N -3.38 3.21 -0.23 -0.61 2.07 -0.07 -5.03 121.20 117.16 1k0w s ILE 158 Ca 0.16 -0.65 -0.21 0.00 -1.41 0.00 0.00 60.65 58.54 1k0w s ILE 158 Cb -0.07 -2.30 -0.02 0.00 0.13 0.00 0.00 42.46 40.20 1k0w s ILE 158 CO 0.74 0.57 0.66 -0.62 -1.91 0.00 0.00 174.94 174.39 1k0w s ASP 159 N -0.41 6.67 0.60 4.50 3.68 -1.26 -4.57 116.67 125.88 1k0w s ASP 159 Ca 0.05 0.82 0.31 0.00 2.13 0.00 0.00 52.55 55.86 1k0w s ASP 159 Cb -0.12 -2.36 1.78 0.00 -1.45 0.00 0.00 42.92 40.77 1k0w s ASP 159 CO 0.02 -0.35 2.16 0.00 0.13 0.00 0.00 175.17 177.13 1k0w h ALA 160 N 7.68 1.62 0.00 3.66 0.00 -1.97 0.61 119.26 130.86 1k0w h ALA 160 Ca -0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1k0w h ALA 160 Cb 1.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1k0w h ALA 160 CO 0.79 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1k0w h ALA 161 N 1.83 1.00 0.00 0.00 0.00 -1.98 -3.21 119.26 116.90 1k0w h ALA 161 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1k0w h ALA 161 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1k0w h ALA 161 CO -0.00 0.00 -0.72 1.04 0.00 0.00 0.00 179.25 179.57 1k0w n GLN 162 N -2.69 2.32 -3.60 0.00 6.02 0.10 -4.77 117.38 114.76 1k0w n GLN 162 Ca 0.04 -0.01 -0.28 0.00 -0.01 0.00 0.00 57.00 56.74 1k0w n GLN 162 Cb 0.45 -1.16 -0.11 0.00 1.02 0.00 0.00 30.24 30.44 1k0w n GLN 162 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1k0w s MET 163 N -2.34 1.39 0.00 -1.09 1.75 -0.55 -1.20 119.30 117.25 1k0w s MET 163 Ca 0.04 -2.38 0.00 0.00 -1.25 0.00 0.00 55.69 52.11 1k0w s MET 163 Cb 0.10 -2.14 0.00 0.00 2.84 0.00 0.00 34.83 35.63 1k0w s MET 163 CO 0.56 -1.30 1.35 -0.35 -0.65 0.00 0.00 175.02 174.63 1k0w n PRO 164 N 2.82 0.81 -3.48 4.11 -0.04 -1.25 -4.68 135.00 133.28 1k0w n PRO 164 Ca 0.22 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1k0w n PRO 164 Cb 0.41 -1.10 -0.03 0.00 -0.04 0.00 0.00 33.50 32.75 1k0w n PRO 164 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1k0w s GLY 165 N 1.67 -0.51 -0.13 0.55 0.00 -1.26 -1.81 107.32 105.82 1k0w s GLY 165 Ca 0.00 0.98 -0.29 0.00 0.00 0.00 0.00 44.72 45.41 1k0w s GLY 165 CO 0.00 0.43 0.75 0.54 0.00 0.00 0.00 173.10 174.82 1k0w s VAL 166 N -2.88 0.00 -0.21 1.40 0.11 -0.35 -4.57 120.40 113.90 1k0w s VAL 166 Ca 0.01 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.00 1k0w s VAL 166 Cb -0.01 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1k0w s VAL 166 CO -0.07 0.00 0.02 -0.76 -3.33 0.00 0.00 175.10 170.96 1k0w s LEU 167 N -0.69 3.34 -0.27 2.54 1.43 0.82 -1.28 118.68 124.57 1k0w s LEU 167 Ca -0.06 -0.18 -0.19 0.00 -1.03 0.00 0.00 54.13 52.67 1k0w s LEU 167 Cb -0.02 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 1k0w s LEU 167 CO 0.06 0.05 0.55 -0.69 0.23 0.00 0.00 176.35 176.55 1k0w s VAL 168 N 1.08 5.03 -0.15 -1.59 1.01 -0.19 0.08 120.40 125.66 1k0w s VAL 168 Ca 0.03 0.90 -0.42 0.00 0.00 0.00 0.00 61.98 62.49 1k0w s VAL 168 Cb -0.14 -3.88 -0.19 0.00 0.00 0.00 0.00 36.38 32.16 1k0w s VAL 168 CO 0.02 0.03 1.29 1.57 0.00 0.00 0.00 175.10 178.01 1k0w n HIS 169 N 5.63 1.14 -1.48 5.22 -0.00 -1.26 -0.57 115.22 123.91 1k0w n HIS 169 Ca -0.03 1.02 -0.17 0.00 0.46 0.00 0.00 57.72 59.00 1k0w n HIS 169 Cb 0.49 -2.18 -0.07 0.00 -0.12 0.00 0.00 29.99 28.12 1k0w n HIS 169 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1k0w n SER 170 N 2.56 -5.18 0.00 0.26 7.64 0.04 -4.77 113.62 114.17 1k0w n SER 170 Ca 0.23 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.53 1k0w n SER 170 Cb 0.05 -4.39 0.00 0.00 -1.01 0.00 0.00 64.21 58.86 1k0w n SER 170 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1k0w n HIS 171 N -2.23 0.00 -0.56 1.43 -0.00 0.26 -4.85 115.22 109.28 1k0w n HIS 171 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.55 1k0w n HIS 171 Cb 0.62 0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.63 1k0w n HIS 171 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1k0w n GLY 172 N 2.96 -1.87 3.84 1.57 0.00 -0.97 -4.87 105.19 105.85 1k0w n GLY 172 Ca 0.00 -1.14 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 1k0w n GLY 172 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1k0w s PRO 173 N -1.83 4.08 -0.04 1.61 0.04 -1.22 -1.03 135.00 136.62 1k0w s PRO 173 Ca 0.00 0.75 0.04 0.00 0.04 0.00 0.00 61.00 61.83 1k0w s PRO 173 Cb 0.00 -2.53 -0.00 0.00 0.04 0.00 0.00 34.50 32.01 1k0w s PRO 173 CO 0.00 0.20 -0.15 -0.06 0.04 0.00 0.00 177.00 177.04 1k0w s PHE 174 N -1.88 1.47 0.09 0.56 0.08 -0.40 -2.80 117.98 115.09 1k0w s PHE 174 Ca 0.52 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 57.18 1k0w s PHE 174 Cb -0.12 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.29 1k0w s PHE 174 CO 0.18 -0.13 -0.04 0.00 -0.10 0.00 0.00 175.22 175.12 1k0w s ALA 175 N 0.05 0.84 0.26 5.36 0.00 0.92 -1.22 121.76 127.97 1k0w s ALA 175 Ca -0.03 -1.32 -0.06 0.00 0.00 0.00 0.00 51.96 50.55 1k0w s ALA 175 Cb -0.10 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 1k0w s ALA 175 CO 0.01 -0.30 0.37 1.67 0.00 0.00 0.00 175.76 177.52 1k0w s TRP 176 N -3.74 0.84 0.00 0.00 -2.14 -0.75 0.26 118.94 113.41 1k0w s TRP 176 Ca 0.11 -1.11 0.00 0.00 2.66 0.00 0.00 56.10 57.76 1k0w s TRP 176 Cb 0.06 -0.14 0.00 0.00 -3.10 0.00 0.00 33.47 30.29 1k0w s TRP 176 CO -0.06 -0.93 0.00 0.41 -2.66 0.00 0.00 176.95 173.72 1k0w n GLY 177 N -0.41 1.77 0.25 3.67 0.00 -0.35 -4.46 105.19 105.65 1k0w n GLY 177 Ca 0.01 -0.96 0.14 0.00 0.00 0.00 0.00 46.02 45.20 1k0w n GLY 177 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k0w h LYS 178 N 0.00 0.00 0.00 1.61 1.57 -1.86 0.11 116.57 118.00 1k0w h LYS 178 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1k0w h LYS 178 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1k0w h LYS 178 CO 0.00 0.11 0.27 0.27 -0.57 0.00 0.00 179.45 179.53 1k0w n ASN 179 N -3.24 -2.04 0.03 0.86 0.23 -1.26 -3.73 115.26 106.11 1k0w n ASN 179 Ca 0.00 -2.38 -0.11 0.00 -0.53 0.00 0.00 54.58 51.56 1k0w n ASN 179 Cb 0.37 3.38 -0.04 0.00 -2.08 0.00 0.00 39.78 41.41 1k0w n ASN 179 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1k0w h ALA 180 N 2.00 -0.32 -0.10 -2.53 0.00 -1.80 -0.97 119.26 115.54 1k0w h ALA 180 Ca -0.30 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1k0w h ALA 180 Cb 1.11 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 1k0w h ALA 180 CO 0.38 -0.75 0.03 1.49 0.00 0.00 0.00 179.25 180.40 1k0w h GLU 181 N -0.37 0.08 -0.89 0.00 4.81 -1.95 -1.82 114.58 114.44 1k0w h GLU 181 Ca 0.08 -0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.40 1k0w h GLU 181 Cb 0.50 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.79 1k0w h GLU 181 CO -0.29 0.05 0.58 0.22 -0.73 0.00 0.00 179.01 178.84 1k0w h ASP 182 N 0.08 0.82 -0.47 1.04 3.58 -1.91 -0.53 116.42 119.04 1k0w h ASP 182 Ca 0.04 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.43 1k0w h ASP 182 Cb 0.02 -0.15 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1k0w h ASP 182 CO -0.04 0.49 -0.02 0.00 -2.88 0.00 0.00 179.24 176.79 1k0w h ALA 183 N 1.55 0.64 -0.80 -0.78 0.00 -0.67 -1.73 119.26 117.46 1k0w h ALA 183 Ca 0.41 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1k0w h ALA 183 Cb 0.37 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1k0w h ALA 183 CO -0.17 0.45 0.36 0.28 0.00 0.00 0.00 179.25 180.17 1k0w h VAL 184 N 0.69 1.26 -0.79 0.00 2.07 -0.48 -1.30 116.25 117.70 1k0w h VAL 184 Ca 0.13 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 1k0w h VAL 184 Cb 0.53 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1k0w h VAL 184 CO 0.03 0.32 0.37 0.45 0.02 0.00 0.00 177.57 178.75 1k0w h HIS 185 N 1.15 1.15 -0.07 1.57 -0.00 -0.83 -1.17 115.15 116.94 1k0w h HIS 185 Ca 0.27 -0.06 -0.12 0.00 -0.00 0.00 0.00 60.37 60.47 1k0w h HIS 185 Cb 0.16 -0.36 -0.01 0.00 -0.00 0.00 0.00 27.41 27.20 1k0w h HIS 185 CO 0.02 0.84 -0.48 -0.91 -0.00 0.00 0.00 177.93 177.40 1k0w h ASN 186 N 1.13 0.20 -0.57 2.45 2.35 -0.95 -2.15 115.58 118.05 1k0w h ASN 186 Ca 0.27 -0.09 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 1k0w h ASN 186 Cb 0.13 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1k0w h ASN 186 CO -0.03 0.65 -0.04 0.00 -1.65 0.00 0.00 177.43 176.35 1k0w h ALA 187 N 1.36 0.77 -0.13 -0.83 0.00 -0.51 0.60 119.26 120.53 1k0w h ALA 187 Ca 0.01 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 1k0w h ALA 187 Cb 0.90 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1k0w h ALA 187 CO 0.07 0.64 -0.61 -0.84 0.00 0.00 0.00 179.25 178.51 1k0w h ILE 188 N 0.92 1.35 -0.51 0.00 -0.00 -1.04 -2.07 117.51 116.15 1k0w h ILE 188 Ca 0.16 -1.92 -0.12 0.00 -0.00 0.00 0.00 64.86 62.98 1k0w h ILE 188 Cb 0.60 1.91 -0.02 0.00 -0.00 0.00 0.00 36.82 39.32 1k0w h ILE 188 CO 0.04 0.59 -0.14 0.58 -0.00 0.00 0.00 178.15 179.21 1k0w h VAL 189 N 0.33 1.27 -0.66 0.16 2.07 -1.19 -1.91 116.25 116.32 1k0w h VAL 189 Ca -0.01 -1.30 0.06 0.00 0.82 0.00 0.00 66.70 66.28 1k0w h VAL 189 Cb 1.15 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 1k0w h VAL 189 CO 0.11 0.45 0.35 0.25 0.02 0.00 0.00 177.57 178.76 1k0w h LEU 190 N 0.86 0.51 -0.86 2.57 5.85 -0.75 -0.82 115.31 122.68 1k0w h LEU 190 Ca 0.13 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 1k0w h LEU 190 Cb 0.71 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 1k0w h LEU 190 CO 0.05 0.33 0.25 -0.08 -0.34 0.00 0.00 178.44 178.65 1k0w h GLU 191 N 0.65 1.09 0.03 1.25 4.57 -1.11 -1.54 114.58 119.52 1k0w h GLU 191 Ca 0.30 -0.21 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1k0w h GLU 191 Cb 0.21 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 1k0w h GLU 191 CO -0.20 0.91 -0.01 0.93 -1.18 0.00 0.00 179.01 179.46 1k0w h GLU 192 N 1.05 -0.04 0.00 1.92 4.39 -0.47 -1.67 114.58 119.77 1k0w h GLU 192 Ca 0.24 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.88 1k0w h GLU 192 Cb 0.26 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1k0w h GLU 192 CO -0.01 0.17 -0.27 -0.39 -1.16 0.00 0.00 179.01 177.34 1k0w h VAL 193 N -0.23 0.85 -0.38 3.13 -1.51 -1.13 -1.38 116.25 115.59 1k0w h VAL 193 Ca -0.00 -1.07 -0.11 0.00 -1.23 0.00 0.00 66.70 64.28 1k0w h VAL 193 Cb 0.22 1.64 -0.01 0.00 -2.13 0.00 0.00 31.29 31.01 1k0w h VAL 193 CO 0.01 0.27 -0.19 0.00 -1.23 0.00 0.00 177.57 176.43 1k0w h ALA 194 N 1.73 0.54 0.10 5.19 0.00 -1.11 0.13 119.26 125.84 1k0w h ALA 194 Ca -0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1k0w h ALA 194 Cb 0.62 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1k0w h ALA 194 CO 0.04 0.48 -0.05 -0.92 0.00 0.00 0.00 179.25 178.80 1k0w h TYR 195 N 0.60 -0.13 0.00 0.00 5.03 -0.85 -2.71 116.97 118.91 1k0w h TYR 195 Ca 0.08 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.33 1k0w h TYR 195 Cb 0.74 0.04 -0.01 0.00 1.55 0.00 0.00 36.73 39.05 1k0w h TYR 195 CO 0.06 0.12 -0.31 0.52 -1.32 0.00 0.00 178.16 177.23 1k0w h MET 196 N -0.36 0.00 -0.39 1.82 2.86 -1.27 -2.72 114.93 114.87 1k0w h MET 196 Ca -0.01 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 1k0w h MET 196 Cb 0.30 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1k0w h MET 196 CO 0.02 0.31 -0.10 0.78 1.06 0.00 0.00 176.91 178.98 1k0w h GLY 197 N 0.98 0.74 0.92 8.32 0.00 -0.57 0.07 103.07 113.54 1k0w h GLY 197 Ca -0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1k0w h GLY 197 CO 0.04 0.49 0.08 -2.22 0.00 0.00 0.00 176.54 174.93 1k0w h ILE 198 N 0.62 1.11 0.01 2.60 2.04 -1.16 -2.70 117.51 120.03 1k0w h ILE 198 Ca 0.11 -0.31 -0.22 0.00 1.00 0.00 0.00 64.86 65.44 1k0w h ILE 198 Cb 0.54 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1k0w h ILE 198 CO 0.03 0.10 -1.08 -0.26 0.00 0.00 0.00 178.15 176.94 1k0w h PHE 199 N 0.13 0.04 0.00 1.37 0.04 -1.52 -2.63 116.94 114.37 1k0w h PHE 199 Ca 0.05 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 1k0w h PHE 199 Cb 0.09 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 1k0w h PHE 199 CO -0.04 1.03 -0.29 0.00 -0.60 0.00 0.00 178.31 178.41 1k0w h ARG 201 N 0.00 0.80 -0.79 0.00 2.43 -1.45 0.13 114.38 115.51 1k0w h ARG 201 Ca -0.00 -0.44 0.04 0.00 -0.81 0.00 0.00 59.98 58.77 1k0w h ARG 201 Cb 0.80 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.33 1k0w h ARG 201 CO 0.04 1.07 0.49 0.37 -1.51 0.00 0.00 179.97 180.43 1k0w h GLN 202 N 0.57 0.92 -0.37 0.20 4.15 -0.99 0.28 115.11 119.87 1k0w h GLN 202 Ca 0.04 -0.06 -0.16 0.00 0.77 0.00 0.00 58.65 59.25 1k0w h GLN 202 Cb 0.95 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.43 1k0w h GLN 202 CO 0.09 0.61 -0.40 -0.07 -1.93 0.00 0.00 178.83 177.12 1k0w h LEU 203 N 0.95 0.99 -6.56 -2.39 3.38 -0.98 -3.39 115.31 107.31 1k0w h LEU 203 Ca 0.32 -0.46 -0.59 0.00 0.09 0.00 0.00 57.88 57.24 1k0w h LEU 203 Cb 0.06 -0.28 -0.39 0.00 0.09 0.00 0.00 40.66 40.14 1k0w h LEU 203 CO -0.13 1.26 -0.88 0.00 0.09 0.00 0.00 178.44 178.78 1k0w s ALA 204 N -4.36 1.73 0.64 1.53 0.00 0.02 -4.99 121.76 116.32 1k0w s ALA 204 Ca -0.11 -2.56 0.38 0.00 0.00 0.00 0.00 51.96 49.67 1k0w s ALA 204 Cb 0.11 -1.70 2.12 0.00 0.00 0.00 0.00 23.12 23.65 1k0w s ALA 204 CO 0.88 -2.02 2.28 -1.00 0.00 0.00 0.00 175.76 175.90 1k0w h PRO 205 N 5.93 0.00 -0.44 0.00 0.13 -1.16 -1.39 132.00 135.08 1k0w h PRO 205 Ca 0.19 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.25 1k0w h PRO 205 Cb 0.90 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.99 1k0w h PRO 205 CO 0.41 0.00 0.06 1.04 -0.23 0.00 0.00 178.00 179.28 1k0w n GLN 206 N -3.38 3.34 -1.78 0.86 3.00 -1.26 -5.00 117.38 113.16 1k0w n GLN 206 Ca -0.02 -3.00 -0.42 0.00 -0.01 0.00 0.00 57.00 53.54 1k0w n GLN 206 Cb 0.12 -2.01 -0.03 0.00 0.00 0.00 0.00 30.24 28.32 1k0w n GLN 206 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1k0w s LEU 207 N -2.91 4.40 0.69 1.08 0.20 -0.52 -4.98 118.68 116.63 1k0w s LEU 207 Ca 0.48 2.57 -0.11 0.00 0.69 0.00 0.00 54.13 57.75 1k0w s LEU 207 Cb 0.39 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.61 1k0w s LEU 207 CO 0.10 -1.00 1.06 -2.16 -0.29 0.00 0.00 176.35 174.06 1k0w s PRO 208 N 3.95 2.99 0.89 0.98 0.04 -1.26 -4.99 135.00 137.60 1k0w s PRO 208 Ca 0.83 0.96 -0.11 0.00 0.04 0.00 0.00 61.00 62.72 1k0w s PRO 208 Cb -0.41 -2.00 0.13 0.00 0.04 0.00 0.00 34.50 32.27 1k0w s PRO 208 CO 0.37 -1.05 1.16 -0.51 0.04 0.00 0.00 177.00 177.01 1k0w s ASP 209 N -3.75 3.09 0.78 6.66 -0.00 -1.26 -4.94 116.67 117.25 1k0w s ASP 209 Ca 0.58 2.23 -0.13 0.00 -0.00 0.00 0.00 52.55 55.23 1k0w s ASP 209 Cb -0.14 -2.57 0.07 0.00 -0.00 0.00 0.00 42.92 40.28 1k0w s ASP 209 CO 0.54 -3.00 1.18 0.00 -0.00 0.00 0.00 175.17 173.90 1k0w s MET 210 N -4.53 1.84 0.25 8.23 0.23 0.09 -4.92 119.30 120.49 1k0w s MET 210 Ca 0.68 1.67 -0.31 0.00 -1.03 0.00 0.00 55.69 56.71 1k0w s MET 210 Cb -0.24 -1.81 -0.14 0.00 -1.53 0.00 0.00 34.83 31.12 1k0w s MET 210 CO 0.56 -2.05 1.32 1.04 -2.03 0.00 0.00 175.02 173.87 1k0w n GLN 211 N -3.18 1.86 -0.27 3.16 6.02 -1.26 -4.86 117.38 118.85 1k0w n GLN 211 Ca 0.13 0.66 -0.03 0.00 -0.01 0.00 0.00 57.00 57.74 1k0w n GLN 211 Cb 0.51 -2.26 0.13 0.00 1.02 0.00 0.00 30.24 29.64 1k0w n GLN 211 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 1k0w h GLN 212 N 3.65 1.12 -0.45 -1.09 5.75 -1.99 -1.05 115.11 121.05 1k0w h GLN 212 Ca -0.44 -0.16 0.03 0.00 -0.15 0.00 0.00 58.65 57.93 1k0w h GLN 212 Cb 1.29 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 29.60 1k0w h GLN 212 CO 0.72 0.86 0.25 1.15 -2.65 0.00 0.00 178.83 179.16 1k0w h THR 213 N 1.12 1.01 -0.58 2.39 2.02 -2.00 0.07 112.91 116.95 1k0w h THR 213 Ca 0.27 -0.17 -0.08 0.00 0.77 0.00 0.00 66.41 67.19 1k0w h THR 213 Cb 0.11 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1k0w h THR 213 CO -0.04 0.09 0.02 0.25 0.37 0.00 0.00 175.52 176.22 1k0w h LEU 214 N 0.50 0.95 -0.04 2.58 5.85 -1.82 -0.71 115.31 122.62 1k0w h LEU 214 Ca 0.19 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1k0w h LEU 214 Cb 0.05 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 1k0w h LEU 214 CO -0.11 0.99 0.02 0.25 -0.34 0.00 0.00 178.44 179.26 1k0w h LEU 215 N 0.91 0.03 -0.09 2.25 6.46 -0.45 -2.41 115.31 122.00 1k0w h LEU 215 Ca 0.17 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.93 1k0w h LEU 215 Cb 0.50 -0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1k0w h LEU 215 CO 0.02 0.02 0.05 0.78 -0.62 0.00 0.00 178.44 178.69 1k0w h ASN 216 N 0.04 0.12 -0.44 1.25 2.35 -0.86 -0.80 115.58 117.23 1k0w h ASN 216 Ca 0.02 -0.11 0.07 0.00 -0.55 0.00 0.00 56.30 55.73 1k0w h ASN 216 Cb 0.00 -0.03 -0.09 0.00 0.05 0.00 0.00 38.32 38.25 1k0w h ASN 216 CO -0.01 0.19 -0.46 0.50 -1.65 0.00 0.00 177.43 175.99 1k0w h LYS 217 N 0.03 -0.31 -0.32 0.81 3.11 -0.97 0.29 116.57 119.21 1k0w h LYS 217 Ca 0.03 0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.75 1k0w h LYS 217 Cb 0.10 0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.40 1k0w h LYS 217 CO -0.00 -0.21 -0.37 0.45 -2.81 0.00 0.00 179.45 176.51 1k0w h HIS 218 N -0.33 0.98 0.06 1.91 3.86 -1.40 -2.52 115.15 117.72 1k0w h HIS 218 Ca 0.13 -0.31 -0.15 0.00 -1.16 0.00 0.00 60.37 58.88 1k0w h HIS 218 Cb 0.58 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 28.87 1k0w h HIS 218 CO -0.67 1.10 -0.62 -0.92 0.86 0.00 0.00 177.93 177.68 1k0w h TYR 219 N 0.58 0.51 -0.55 2.45 5.03 -0.87 -3.34 116.97 120.79 1k0w h TYR 219 Ca 0.04 -0.32 -0.09 0.00 2.58 0.00 0.00 58.73 60.94 1k0w h TYR 219 Cb 0.96 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 39.18 1k0w h TYR 219 CO 0.07 1.19 -0.02 -0.07 -1.32 0.00 0.00 178.16 178.00 1k0w h LEU 220 N -0.31 0.93 -0.72 2.82 4.07 -0.57 -3.13 115.31 118.42 1k0w h LEU 220 Ca -0.09 -0.26 0.14 0.00 0.08 0.00 0.00 57.88 57.75 1k0w h LEU 220 Cb 1.40 -0.25 -0.14 0.00 1.08 0.00 0.00 40.66 42.76 1k0w h LEU 220 CO 0.12 1.00 -0.19 -0.09 -1.08 0.00 0.00 178.44 178.20 1k0w h ARG 221 N 0.87 -0.01 -6.70 1.13 2.43 -1.55 -3.39 114.38 107.16 1k0w h ARG 221 Ca 0.16 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.85 1k0w h ARG 221 Cb 0.54 0.00 0.04 0.00 -0.42 0.00 0.00 29.97 30.13 1k0w h ARG 221 CO 0.03 -0.01 -0.08 -1.59 -1.51 0.00 0.00 179.97 176.82 1k0w s LYS 222 N -6.23 2.24 0.00 0.20 -2.85 -1.18 -5.13 119.74 106.80 1k0w s LYS 222 Ca -0.14 -1.54 0.00 0.00 -1.00 0.00 0.00 55.97 53.29 1k0w s LYS 222 Cb 0.21 -2.61 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 1k0w s LYS 222 CO 0.74 -0.92 0.00 0.72 0.10 0.00 0.00 175.35 176.00