#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u5h n ASN 2 N 0.00 5.32 -0.13 7.83 2.85 -1.26 -4.86 115.26 125.01 1u5h n ASN 2 Ca 0.00 -3.04 -0.07 0.00 -0.11 0.00 0.00 54.58 51.36 1u5h n ASN 2 Cb 0.00 -1.51 0.01 0.00 1.24 0.00 0.00 39.78 39.52 1u5h n ASN 2 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1u5h h LEU 3 N 8.63 0.43 -0.95 1.20 3.38 -1.93 -2.46 115.31 123.61 1u5h h LEU 3 Ca 0.30 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.21 1u5h h LEU 3 Cb 0.81 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1u5h h LEU 3 CO 1.29 0.31 0.07 -0.09 0.09 0.00 0.00 178.44 180.11 1u5h h ARG 4 N 0.52 0.84 0.00 1.13 1.12 -1.95 -2.45 114.38 113.58 1u5h h ARG 4 Ca 0.16 -0.20 -0.05 0.00 -1.11 0.00 0.00 59.98 58.78 1u5h h ARG 4 Cb -0.02 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 29.82 1u5h h ARG 4 CO -0.06 0.79 -0.21 0.00 -3.11 0.00 0.00 179.97 177.38 1u5h h ALA 5 N 1.28 1.61 -2.32 2.80 0.00 -1.86 -3.41 119.26 117.36 1u5h h ALA 5 Ca 0.17 -0.20 -0.47 0.00 0.00 0.00 0.00 54.91 54.41 1u5h h ALA 5 Cb 0.37 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.16 1u5h h ALA 5 CO 0.01 0.27 0.38 0.00 0.00 0.00 0.00 179.25 179.91 1u5h s ALA 6 N -4.52 2.87 1.10 0.00 0.00 -0.92 -5.04 121.76 115.25 1u5h s ALA 6 Ca -0.04 0.58 -0.11 0.00 0.00 0.00 0.00 51.96 52.39 1u5h s ALA 6 Cb 0.15 -3.25 0.16 0.00 0.00 0.00 0.00 23.12 20.18 1u5h s ALA 6 CO 0.69 -0.35 0.65 0.41 0.00 0.00 0.00 175.76 177.17 1u5h n GLY 7 N -0.35 -2.25 0.04 0.00 0.00 -1.26 -4.96 105.19 96.41 1u5h n GLY 7 Ca 0.09 -1.54 0.13 0.00 0.00 0.00 0.00 46.02 44.70 1u5h n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1u5h n PRO 8 N -3.14 0.13 -3.11 1.61 -0.04 -1.26 -4.73 135.00 124.46 1u5h n PRO 8 Ca 0.09 0.08 -0.45 0.00 -0.04 0.00 0.00 63.50 63.18 1u5h n PRO 8 Cb 0.33 -1.63 -0.04 0.00 -0.04 0.00 0.00 33.50 32.12 1u5h n PRO 8 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1u5h s GLY 9 N -3.30 1.78 -0.02 0.55 0.00 -1.26 -2.03 107.32 103.04 1u5h s GLY 9 Ca 0.11 -2.25 -0.02 0.00 0.00 0.00 0.00 44.72 42.56 1u5h s GLY 9 CO 0.62 1.59 0.11 -0.98 0.00 0.00 0.00 173.10 174.44 1u5h s TRP 10 N 2.67 3.37 -0.07 1.90 0.52 -1.22 -0.88 118.94 125.23 1u5h s TRP 10 Ca 0.12 0.27 -0.02 0.00 0.02 0.00 0.00 56.10 56.49 1u5h s TRP 10 Cb -0.24 -1.78 0.03 0.00 -1.15 0.00 0.00 33.47 30.34 1u5h s TRP 10 CO 0.06 0.59 0.01 -1.17 0.02 0.00 0.00 176.95 176.46 1u5h s LEU 11 N -1.69 0.53 0.28 2.99 2.96 -0.09 0.23 118.68 123.89 1u5h s LEU 11 Ca 0.23 -0.08 -0.29 0.00 -0.22 0.00 0.00 54.13 53.76 1u5h s LEU 11 Cb -0.12 -0.39 -0.10 0.00 0.50 0.00 0.00 46.19 46.08 1u5h s LEU 11 CO 0.14 -0.21 1.37 -0.36 -1.32 0.00 0.00 176.35 175.97 1u5h s PHE 12 N 2.00 3.04 -0.12 5.38 0.08 -0.44 -0.75 117.98 127.17 1u5h s PHE 12 Ca 0.05 1.21 -0.02 0.00 0.12 0.00 0.00 56.93 58.28 1u5h s PHE 12 Cb -0.12 -3.75 0.04 0.00 -0.57 0.00 0.00 43.02 38.62 1u5h s PHE 12 CO -0.05 -2.27 0.03 0.00 -0.10 0.00 0.00 175.22 172.83 1u5h n PRO 14 N 5.14 2.32 0.01 0.00 -0.02 -1.26 -1.13 135.00 140.07 1u5h n PRO 14 Ca -0.07 0.83 0.11 0.00 -2.02 0.00 0.00 63.50 62.34 1u5h n PRO 14 Cb 0.49 -2.56 0.48 0.00 -0.02 0.00 0.00 33.50 31.89 1u5h n PRO 14 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u5h n ALA 15 N 2.35 2.03 0.69 3.55 0.00 -0.21 -2.75 120.51 126.16 1u5h n ALA 15 Ca 0.12 -0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.51 1u5h n ALA 15 Cb 0.33 -1.37 0.12 0.00 0.00 0.00 0.00 19.45 18.53 1u5h n ALA 15 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1u5h n ASP 16 N -1.56 2.06 -3.19 0.00 5.75 -1.26 -4.35 116.55 114.00 1u5h n ASP 16 Ca 0.05 -2.19 -0.22 0.00 -0.01 0.00 0.00 54.79 52.41 1u5h n ASP 16 Cb 0.27 -0.43 -0.05 0.00 -1.03 0.00 0.00 41.12 39.88 1u5h n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u5h n ALA 17 N 0.18 2.69 0.30 2.12 0.00 -1.11 -4.89 120.51 119.80 1u5h n ALA 17 Ca 0.08 -3.69 0.17 0.00 0.00 0.00 0.00 53.44 50.00 1u5h n ALA 17 Cb 0.43 -0.86 0.96 0.00 0.00 0.00 0.00 19.45 19.98 1u5h n ALA 17 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1u5h h PRO 18 N 3.55 0.00 0.00 0.00 0.13 -1.83 -0.96 132.00 132.88 1u5h h PRO 18 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1u5h h PRO 18 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1u5h h PRO 18 CO 0.56 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.50 1u5h n GLU 19 N -3.50 0.17 0.00 0.86 0.00 -1.26 -2.06 120.64 114.84 1u5h n GLU 19 Ca -0.02 0.52 0.09 0.00 0.00 0.00 0.00 57.16 57.74 1u5h n GLU 19 Cb 0.13 -1.91 -0.04 0.00 0.00 0.00 0.00 31.44 29.63 1u5h n GLU 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1u5h n ALA 20 N -1.77 3.65 -0.11 -1.84 0.00 -0.37 -4.66 120.51 115.41 1u5h n ALA 20 Ca 0.00 -0.55 -0.09 0.00 0.00 0.00 0.00 53.44 52.81 1u5h n ALA 20 Cb 0.14 -0.64 -0.01 0.00 0.00 0.00 0.00 19.45 18.93 1u5h n ALA 20 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1u5h h PHE 21 N 1.31 0.52 -0.45 0.00 -1.00 -1.47 -1.22 116.94 114.63 1u5h h PHE 21 Ca 0.00 -0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.67 1u5h h PHE 21 Cb 0.55 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.93 1u5h h PHE 21 CO 0.00 0.46 -0.03 0.00 -1.61 0.00 0.00 178.31 177.13 1u5h h ALA 22 N 1.01 1.10 -0.27 2.45 0.00 -1.83 -1.74 119.26 119.97 1u5h h ALA 22 Ca 0.12 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1u5h h ALA 22 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1u5h h ALA 22 CO -0.01 0.57 -0.10 0.00 0.00 0.00 0.00 179.25 179.70 1u5h h ALA 23 N 1.26 0.38 -0.24 0.00 0.00 -1.75 -2.16 119.26 116.76 1u5h h ALA 23 Ca 0.13 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1u5h h ALA 23 Cb 0.48 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1u5h h ALA 23 CO 0.02 0.22 -0.07 0.00 0.00 0.00 0.00 179.25 179.43 1u5h h ALA 24 N 0.76 0.15 -0.59 0.00 0.00 -1.10 -1.95 119.26 116.52 1u5h h ALA 24 Ca 0.06 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1u5h h ALA 24 Cb 0.59 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1u5h h ALA 24 CO 0.03 -0.48 0.39 0.00 0.00 0.00 0.00 179.25 179.20 1u5h h ALA 25 N 1.22 1.71 0.00 0.00 0.00 -1.23 -1.01 119.26 119.96 1u5h h ALA 25 Ca 0.12 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 1u5h h ALA 25 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1u5h h ALA 25 CO -0.25 0.22 -0.67 0.00 0.00 0.00 0.00 179.25 178.55 1u5h h ALA 26 N 1.66 0.68 0.02 0.00 0.00 -0.98 -3.27 119.26 117.36 1u5h h ALA 26 Ca 0.24 -0.61 -0.24 0.00 0.00 0.00 0.00 54.91 54.30 1u5h h ALA 26 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1u5h h ALA 26 CO -0.07 0.83 -1.21 0.00 0.00 0.00 0.00 179.25 178.80 1u5h h ALA 27 N 1.33 0.41 -2.38 0.00 0.00 -0.70 -3.48 119.26 114.44 1u5h h ALA 27 Ca -0.01 -1.04 -0.57 0.00 0.00 0.00 0.00 54.91 53.30 1u5h h ALA 27 Cb 1.37 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 19.09 1u5h h ALA 27 CO 0.09 1.29 -0.64 0.00 0.00 0.00 0.00 179.25 179.99 1u5h s ALA 28 N -2.67 3.20 0.03 0.00 0.00 -0.44 -4.91 121.76 116.96 1u5h s ALA 28 Ca -0.01 -1.56 -0.20 0.00 0.00 0.00 0.00 51.96 50.18 1u5h s ALA 28 Cb 0.09 -0.87 -0.16 0.00 0.00 0.00 0.00 23.12 22.18 1u5h s ALA 28 CO 0.83 0.32 1.28 -0.44 0.00 0.00 0.00 175.76 177.74 1u5h h ASP 29 N 2.06 0.42 -3.78 0.00 3.32 -1.31 -3.46 116.42 113.68 1u5h h ASP 29 Ca -0.45 -0.55 -0.35 0.00 0.02 0.00 0.00 57.03 55.70 1u5h h ASP 29 Cb 1.24 -0.12 -0.30 0.00 0.22 0.00 0.00 39.33 40.37 1u5h h ASP 29 CO 0.60 0.89 -0.76 -0.69 -1.72 0.00 0.00 179.24 177.56 1u5h s VAL 30 N -4.01 0.42 -0.15 -1.35 1.01 -1.15 -4.79 120.40 110.39 1u5h s VAL 30 Ca -0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1u5h s VAL 30 Cb 0.05 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 1u5h s VAL 30 CO 0.77 0.14 0.11 -0.69 0.00 0.00 0.00 175.10 175.43 1u5h s VAL 31 N 0.20 5.21 -0.49 2.92 1.01 -0.70 -0.91 120.40 127.64 1u5h s VAL 31 Ca -0.02 0.11 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 1u5h s VAL 31 Cb -0.06 -3.30 0.11 0.00 0.00 0.00 0.00 36.38 33.13 1u5h s VAL 31 CO -0.00 0.54 0.40 -0.63 0.00 0.00 0.00 175.10 175.41 1u5h s ILE 32 N -0.41 4.82 -0.09 2.22 1.01 0.07 -1.17 121.20 127.64 1u5h s ILE 32 Ca 0.11 -1.46 -0.30 0.00 0.00 0.00 0.00 60.65 59.00 1u5h s ILE 32 Cb -0.12 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 1u5h s ILE 32 CO 0.02 -0.73 1.42 -0.76 0.00 0.00 0.00 174.94 174.89 1u5h s LEU 33 N 1.52 4.26 -0.24 2.97 1.43 0.09 -0.85 118.68 127.86 1u5h s LEU 33 Ca 0.04 1.96 -0.09 0.00 -1.03 0.00 0.00 54.13 55.01 1u5h s LEU 33 Cb -0.27 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.37 1u5h s LEU 33 CO 0.03 -0.81 0.11 -0.62 0.23 0.00 0.00 176.35 175.29 1u5h s ASP 34 N 2.42 5.59 0.00 2.29 3.68 -0.28 -0.91 116.67 129.46 1u5h s ASP 34 Ca 0.63 -0.06 0.20 0.00 2.13 0.00 0.00 52.55 55.45 1u5h s ASP 34 Cb -0.28 -2.01 -0.02 0.00 -1.45 0.00 0.00 42.92 39.17 1u5h s ASP 34 CO 0.22 0.01 0.99 0.18 0.13 0.00 0.00 175.17 176.71 1u5h n LEU 35 N 4.62 1.83 0.00 -1.34 4.32 0.01 -1.05 117.00 125.39 1u5h n LEU 35 Ca -0.15 -0.75 0.00 0.00 -0.02 0.00 0.00 56.01 55.09 1u5h n LEU 35 Cb 0.52 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1u5h n LEU 35 CO 0.33 0.35 0.00 -1.84 -1.22 0.00 0.00 177.39 175.01 1u5h n GLU 36 N -0.14 0.00 0.32 3.23 -0.00 -1.25 -4.77 120.64 118.04 1u5h n GLU 36 Ca 0.08 0.00 0.21 0.00 -0.00 0.00 0.00 57.16 57.45 1u5h n GLU 36 Cb 0.42 0.00 1.11 0.00 -0.00 0.00 0.00 31.44 32.97 1u5h n GLU 36 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1u5h h ASP 37 N 0.00 0.00 0.13 -1.84 3.45 -1.93 -0.52 116.42 115.71 1u5h h ASP 37 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1u5h h ASP 37 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 1u5h h ASP 37 CO 0.00 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.28 1u5h n GLY 38 N -1.07 -0.87 3.00 2.75 0.00 -1.26 -4.61 105.19 103.14 1u5h n GLY 38 Ca -0.03 0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1u5h n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u5h s VAL 39 N -3.40 1.30 0.67 1.61 1.01 -0.20 -4.78 120.40 116.61 1u5h s VAL 39 Ca -0.01 -0.51 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 1u5h s VAL 39 Cb 0.06 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.22 1u5h s VAL 39 CO 0.19 0.40 1.27 0.00 0.00 0.00 0.00 175.10 176.97 1u5h s ALA 40 N 1.19 2.29 0.26 5.51 0.00 -1.26 -4.80 121.76 124.95 1u5h s ALA 40 Ca -0.03 1.13 -0.04 0.00 0.00 0.00 0.00 51.96 53.01 1u5h s ALA 40 Cb -0.14 -3.53 0.52 0.00 0.00 0.00 0.00 23.12 19.96 1u5h s ALA 40 CO -0.04 -1.69 1.65 1.49 0.00 0.00 0.00 175.76 177.18 1u5h h GLU 41 N 0.30 0.18 0.00 0.00 4.57 -1.97 -1.28 114.58 116.38 1u5h h GLU 41 Ca -0.50 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 57.61 1u5h h GLU 41 Cb 1.33 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.87 1u5h h GLU 41 CO 0.52 0.12 -0.26 0.00 -1.18 0.00 0.00 179.01 178.21 1u5h h ALA 42 N 1.70 1.14 -0.32 2.92 0.00 -2.05 -2.73 119.26 119.92 1u5h h ALA 42 Ca 0.45 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1u5h h ALA 42 Cb 0.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1u5h h ALA 42 CO -0.62 0.33 0.00 1.04 0.00 0.00 0.00 179.25 180.00 1u5h n GLN 43 N -3.60 2.34 -0.09 0.00 1.13 -0.52 -4.48 117.38 112.16 1u5h n GLN 43 Ca -0.01 -2.02 -0.09 0.00 -1.94 0.00 0.00 57.00 52.94 1u5h n GLN 43 Cb 0.40 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.24 1u5h n GLN 43 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 1u5h h LYS 44 N 4.02 0.40 -0.95 -1.09 1.57 -1.13 -0.22 116.57 119.17 1u5h h LYS 44 Ca 0.00 -0.04 0.13 0.00 -1.87 0.00 0.00 60.65 58.88 1u5h h LYS 44 Cb 0.88 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 33.02 1u5h h LYS 44 CO 0.00 0.31 0.57 -1.35 -0.57 0.00 0.00 179.45 178.40 1u5h h PRO 45 N 0.38 0.83 -0.28 3.15 0.10 -1.79 -0.29 132.00 134.10 1u5h h PRO 45 Ca 0.11 -0.05 -0.10 0.00 0.10 0.00 0.00 66.00 66.06 1u5h h PRO 45 Cb 0.01 -0.19 -0.01 0.00 0.10 0.00 0.00 31.00 30.90 1u5h h PRO 45 CO -0.02 0.55 -0.25 0.00 0.10 0.00 0.00 178.00 178.38 1u5h h ALA 46 N 1.54 1.05 -0.42 -0.75 0.00 -1.73 -2.33 119.26 116.61 1u5h h ALA 46 Ca 0.49 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1u5h h ALA 46 Cb 0.56 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1u5h h ALA 46 CO -0.30 0.58 0.17 0.00 0.00 0.00 0.00 179.25 179.71 1u5h h ALA 47 N 1.25 0.55 -0.28 0.00 0.00 -0.03 -0.62 119.26 120.13 1u5h h ALA 47 Ca 0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1u5h h ALA 47 Cb 0.69 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1u5h h ALA 47 CO 0.05 0.15 -0.09 0.00 0.00 0.00 0.00 179.25 179.36 1u5h h ARG 48 N 0.54 0.45 -0.29 0.00 3.08 -0.88 0.57 114.38 117.85 1u5h h ARG 48 Ca 0.14 -0.11 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1u5h h ARG 48 Cb 0.18 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1u5h h ARG 48 CO -0.01 0.54 -0.20 -0.91 -1.07 0.00 0.00 179.97 178.32 1u5h h ASN 49 N 0.42 0.68 -0.94 7.04 2.35 -1.07 -2.78 115.58 121.29 1u5h h ASN 49 Ca 0.08 -0.44 -0.01 0.00 -0.55 0.00 0.00 56.30 55.39 1u5h h ASN 49 Cb 0.42 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.55 1u5h h ASN 49 CO 0.02 0.98 0.56 0.00 -1.65 0.00 0.00 177.43 177.34 1u5h h ALA 50 N 0.73 1.23 -0.92 -0.83 0.00 -0.66 -0.73 119.26 118.07 1u5h h ALA 50 Ca 0.06 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.96 1u5h h ALA 50 Cb 0.75 -0.38 -0.08 0.00 0.00 0.00 0.00 17.79 18.08 1u5h h ALA 50 CO 0.05 0.66 0.56 1.25 0.00 0.00 0.00 179.25 181.78 1u5h h LEU 51 N 1.29 0.83 -0.02 0.00 5.85 -0.76 -1.15 115.31 121.36 1u5h h LEU 51 Ca 0.34 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 59.08 1u5h h LEU 51 Cb -0.05 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1u5h h LEU 51 CO -0.06 0.47 -0.06 0.03 -0.34 0.00 0.00 178.44 178.48 1u5h h ARG 52 N 0.93 0.08 0.00 1.25 3.08 -1.05 -3.38 114.38 115.29 1u5h h ARG 52 Ca 0.44 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1u5h h ARG 52 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1u5h h ARG 52 CO -0.24 0.67 -0.63 -0.40 -1.07 0.00 0.00 179.97 178.30 1u5h n ASP 53 N -4.72 0.59 -3.86 7.04 5.68 -0.37 -4.45 116.55 116.47 1u5h n ASP 53 Ca -0.09 -0.32 -0.28 0.00 -0.50 0.00 0.00 54.79 53.60 1u5h n ASP 53 Cb 0.34 0.40 -0.12 0.00 -1.14 0.00 0.00 41.12 40.60 1u5h n ASP 53 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1u5h s THR 54 N -3.03 2.63 0.51 2.12 2.01 -0.45 -5.08 115.64 114.35 1u5h s THR 54 Ca 0.10 -4.05 -0.20 0.00 0.31 0.00 0.00 61.69 57.85 1u5h s THR 54 Cb 0.17 -2.74 -0.07 0.00 0.01 0.00 0.00 72.50 69.87 1u5h s THR 54 CO 0.73 -1.01 1.05 -2.16 -0.69 0.00 0.00 174.62 172.55 1u5h s PRO 55 N -1.22 3.67 0.37 4.92 0.04 -1.26 -4.78 135.00 136.74 1u5h s PRO 55 Ca 0.25 1.38 0.07 0.00 0.04 0.00 0.00 61.00 62.74 1u5h s PRO 55 Cb -0.06 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1u5h s PRO 55 CO -0.15 -0.54 -0.02 -0.51 0.04 0.00 0.00 177.00 175.81 1u5h s LEU 56 N -3.66 2.75 -0.03 -3.56 1.02 -1.26 -5.02 118.68 108.92 1u5h s LEU 56 Ca 0.68 -1.31 -0.30 0.00 0.02 0.00 0.00 54.13 53.22 1u5h s LEU 56 Cb -0.17 -0.87 -0.08 0.00 0.02 0.00 0.00 46.19 45.09 1u5h s LEU 56 CO 0.23 -0.38 1.96 -0.62 0.02 0.00 0.00 176.35 177.55 1u5h s ASP 57 N -3.64 6.31 0.01 2.29 3.68 -1.26 -4.85 116.67 119.20 1u5h s ASP 57 Ca 0.34 2.44 0.17 0.00 2.13 0.00 0.00 52.55 57.63 1u5h s ASP 57 Cb 0.07 -2.53 0.72 0.00 -1.45 0.00 0.00 42.92 39.74 1u5h s ASP 57 CO 0.17 -1.20 1.54 -0.81 0.13 0.00 0.00 175.17 175.00 1u5h n PRO 58 N 7.70 0.01 0.09 4.34 -0.04 -1.26 -1.64 135.00 144.20 1u5h n PRO 58 Ca 0.21 0.22 0.13 0.00 -0.04 0.00 0.00 63.50 64.02 1u5h n PRO 58 Cb 0.42 -1.52 0.45 0.00 -0.04 0.00 0.00 33.50 32.81 1u5h n PRO 58 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1u5h n GLU 59 N -1.54 0.21 -0.48 0.54 -0.58 -1.26 -3.95 120.64 113.58 1u5h n GLU 59 Ca 0.04 0.21 0.02 0.00 -0.42 0.00 0.00 57.16 57.02 1u5h n GLU 59 Cb 0.20 -1.76 0.03 0.00 -0.57 0.00 0.00 31.44 29.34 1u5h n GLU 59 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1u5h n ARG 60 N -2.12 0.25 -3.78 3.49 5.12 -0.65 -4.61 116.66 114.35 1u5h n ARG 60 Ca 0.05 -1.37 -0.16 0.00 -1.93 0.00 0.00 57.85 54.45 1u5h n ARG 60 Cb 0.38 -0.66 -0.16 0.00 -1.16 0.00 0.00 32.46 30.86 1u5h n ARG 60 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1u5h s THR 61 N -0.55 -0.03 0.22 0.55 2.01 -0.99 -1.72 115.64 115.13 1u5h s THR 61 Ca 0.08 0.21 0.11 0.00 0.31 0.00 0.00 61.69 62.41 1u5h s THR 61 Cb 0.08 -0.11 -0.05 0.00 0.01 0.00 0.00 72.50 72.43 1u5h s THR 61 CO -0.01 0.10 -0.21 0.68 -0.69 0.00 0.00 174.62 174.49 1u5h s VAL 62 N 1.13 2.48 -0.19 3.82 -7.23 -0.31 -4.70 120.40 115.40 1u5h s VAL 62 Ca -0.08 -2.11 -0.01 0.00 -1.81 0.00 0.00 61.98 57.97 1u5h s VAL 62 Cb -0.13 -2.23 0.01 0.00 0.56 0.00 0.00 36.38 34.59 1u5h s VAL 62 CO -0.03 -0.20 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.73 1u5h s VAL 63 N -1.93 2.59 -0.38 1.32 1.01 -0.90 -0.73 120.40 121.37 1u5h s VAL 63 Ca 0.24 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 61.19 1u5h s VAL 63 Cb -0.07 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.20 1u5h s VAL 63 CO 0.12 0.50 0.93 -0.60 0.00 0.00 0.00 175.10 176.04 1u5h s ARG 64 N 1.26 3.82 0.39 2.72 3.52 -0.09 -0.16 118.95 130.41 1u5h s ARG 64 Ca 0.03 0.54 -0.02 0.00 -0.13 0.00 0.00 55.73 56.16 1u5h s ARG 64 Cb -0.14 -3.81 0.08 0.00 -1.56 0.00 0.00 34.95 29.52 1u5h s ARG 64 CO -0.08 -0.97 0.53 0.44 -0.81 0.00 0.00 175.30 174.41 1u5h n ILE 65 N 6.02 0.00 -2.67 4.11 -5.35 -0.75 -0.81 119.36 119.90 1u5h n ILE 65 Ca 0.07 -0.74 -0.21 0.00 -0.27 0.00 0.00 62.75 61.60 1u5h n ILE 65 Cb 0.48 -1.24 0.05 0.00 -1.74 0.00 0.00 39.64 37.19 1u5h n ILE 65 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1u5h s ASN 66 N -3.11 5.07 0.67 7.28 0.01 -1.26 -4.32 114.94 119.28 1u5h s ASN 66 Ca 0.34 -0.17 -0.12 0.00 -0.71 0.00 0.00 52.86 52.20 1u5h s ASN 66 Cb -0.02 -0.59 -0.00 0.00 0.41 0.00 0.00 41.25 41.05 1u5h s ASN 66 CO 0.23 -1.30 1.06 0.00 -1.51 0.00 0.00 177.10 175.58 1u5h s ALA 67 N -2.82 2.68 0.20 0.60 0.00 -1.26 -4.64 121.76 116.52 1u5h s ALA 67 Ca 0.60 0.18 -0.32 0.00 0.00 0.00 0.00 51.96 52.42 1u5h s ALA 67 Cb -0.09 -3.20 -0.15 0.00 0.00 0.00 0.00 23.12 19.68 1u5h s ALA 67 CO 0.39 -1.13 1.15 0.41 0.00 0.00 0.00 175.76 176.58 1u5h n GLY 68 N -1.65 0.03 2.77 0.00 0.00 -1.26 -2.23 105.19 102.85 1u5h n GLY 68 Ca 0.08 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1u5h n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u5h n GLY 69 N 1.87 1.95 3.83 -0.02 0.00 -1.26 -5.00 105.19 106.55 1u5h n GLY 69 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1u5h n GLY 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u5h s THR 70 N -3.34 4.59 0.40 2.61 -4.23 -0.94 -4.96 115.64 109.76 1u5h s THR 70 Ca 0.00 1.14 0.08 0.00 -1.18 0.00 0.00 61.69 61.73 1u5h s THR 70 Cb 0.00 -3.69 0.29 0.00 1.34 0.00 0.00 72.50 70.43 1u5h s THR 70 CO 0.00 -0.09 2.02 0.00 -0.54 0.00 0.00 174.62 176.01 1u5h h ALA 71 N 2.55 1.76 -0.91 3.99 0.00 -1.95 -2.31 119.26 122.40 1u5h h ALA 71 Ca -0.48 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 1u5h h ALA 71 Cb 1.18 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1u5h h ALA 71 CO 0.65 0.17 0.50 -0.44 0.00 0.00 0.00 179.25 180.13 1u5h h ASP 72 N 0.59 1.13 -0.80 0.00 3.32 -1.93 -1.89 116.42 116.85 1u5h h ASP 72 Ca 0.22 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 1u5h h ASP 72 Cb 0.14 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 1u5h h ASP 72 CO -0.06 0.91 0.38 -0.61 -1.72 0.00 0.00 179.24 178.14 1u5h h GLN 73 N 1.27 1.17 -0.55 3.56 4.15 -1.64 0.13 115.11 123.19 1u5h h GLN 73 Ca 0.32 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.49 1u5h h GLN 73 Cb 0.03 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 1u5h h GLN 73 CO -0.05 0.90 0.04 0.00 -1.93 0.00 0.00 178.83 177.79 1u5h h ALA 74 N 1.26 0.74 -0.71 3.38 0.00 -1.32 -0.77 119.26 121.83 1u5h h ALA 74 Ca 0.28 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1u5h h ALA 74 Cb 0.13 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1u5h h ALA 74 CO -0.03 0.53 0.22 0.00 0.00 0.00 0.00 179.25 179.97 1u5h h ARG 75 N 0.83 1.09 -0.76 0.00 2.47 -0.75 -2.16 114.38 115.11 1u5h h ARG 75 Ca 0.16 -0.23 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1u5h h ARG 75 Cb 0.49 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.61 1u5h h ARG 75 CO 0.02 0.93 0.42 -0.44 0.56 0.00 0.00 179.97 181.46 1u5h h ASP 76 N 1.05 0.95 0.22 7.04 3.45 -0.10 -1.85 116.42 127.19 1u5h h ASP 76 Ca 0.23 -0.10 -0.15 0.00 0.43 0.00 0.00 57.03 57.44 1u5h h ASP 76 Cb 0.29 -0.24 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 1u5h h ASP 76 CO -0.01 0.77 -0.59 -0.07 -1.57 0.00 0.00 179.24 177.77 1u5h h LEU 77 N 1.05 0.43 -0.66 1.55 3.38 -0.93 -0.46 115.31 119.65 1u5h h LEU 77 Ca 0.27 -0.24 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1u5h h LEU 77 Cb 0.04 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1u5h h LEU 77 CO -0.04 0.92 0.43 -0.33 0.09 0.00 0.00 178.44 179.51 1u5h h GLU 78 N 0.28 0.84 -0.19 1.13 5.08 -1.18 -2.49 114.58 118.05 1u5h h GLU 78 Ca -0.00 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.19 1u5h h GLU 78 Cb 1.12 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 1u5h h GLU 78 CO 0.10 0.56 -0.38 0.00 -1.00 0.00 0.00 179.01 178.28 1u5h h ALA 79 N 1.26 0.99 0.00 3.43 0.00 -0.90 -2.68 119.26 121.36 1u5h h ALA 79 Ca 0.25 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1u5h h ALA 79 Cb -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1u5h h ALA 79 CO -0.07 0.61 -0.17 1.25 0.00 0.00 0.00 179.25 180.87 1u5h h LEU 80 N 0.35 0.00 -1.40 0.00 5.85 -0.72 -2.70 115.31 116.69 1u5h h LEU 80 Ca 0.04 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.91 1u5h h LEU 80 Cb 0.83 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 1u5h h LEU 80 CO 0.07 0.17 0.55 0.00 -0.34 0.00 0.00 178.44 178.89 1u5h h ALA 81 N 1.83 1.96 -0.33 1.25 0.00 -1.09 -0.57 119.26 122.30 1u5h h ALA 81 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1u5h h ALA 81 Cb 0.43 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1u5h h ALA 81 CO 0.02 -0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.49 1u5h n GLY 82 N -1.47 1.61 3.73 0.00 0.00 -1.02 -4.89 105.19 103.15 1u5h n GLY 82 Ca 0.17 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 1u5h n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1u5h s THR 83 N -1.72 1.28 -2.47 2.61 -4.23 -0.22 -4.89 115.64 106.00 1u5h s THR 83 Ca 0.27 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 59.01 1u5h s THR 83 Cb 0.18 -2.31 0.43 0.00 1.34 0.00 0.00 72.50 72.14 1u5h s THR 83 CO 0.12 0.00 1.42 0.00 -0.54 0.00 0.00 174.62 175.62 1u5h n ALA 84 N -1.20 2.43 -1.76 3.99 0.00 -1.26 -4.99 120.51 117.71 1u5h n ALA 84 Ca -0.16 -0.96 -0.39 0.00 0.00 0.00 0.00 53.44 51.93 1u5h n ALA 84 Cb 0.67 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.19 1u5h n ALA 84 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1u5h s TYR 85 N -1.52 3.44 -0.05 0.00 2.02 -1.26 -4.83 117.35 115.15 1u5h s TYR 85 Ca 0.38 1.66 0.06 0.00 -0.37 0.00 0.00 57.07 58.80 1u5h s TYR 85 Cb 0.22 -3.29 -0.09 0.00 -0.40 0.00 0.00 41.96 38.41 1u5h s TYR 85 CO 0.31 -0.71 0.15 0.25 -1.57 0.00 0.00 175.55 173.99 1u5h n THR 86 N 0.83 0.00 -4.69 -0.71 -2.24 -1.26 -5.02 114.28 101.18 1u5h n THR 86 Ca 0.01 -0.18 -0.27 0.00 -2.27 0.00 0.00 64.05 61.34 1u5h n THR 86 Cb 0.46 0.47 -0.17 0.00 -2.10 0.00 0.00 70.33 68.99 1u5h n THR 86 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1u5h s THR 87 N -2.27 1.44 0.20 4.28 2.01 -1.26 -1.61 115.64 118.42 1u5h s THR 87 Ca -0.01 -0.64 0.11 0.00 0.31 0.00 0.00 61.69 61.45 1u5h s THR 87 Cb 0.04 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 1u5h s THR 87 CO 0.25 0.42 -0.23 0.68 -0.69 0.00 0.00 174.62 175.06 1u5h s VAL 88 N 0.68 2.28 -0.19 3.82 -7.23 -0.32 -2.12 120.40 117.34 1u5h s VAL 88 Ca -0.13 -2.05 -0.04 0.00 -1.81 0.00 0.00 61.98 57.94 1u5h s VAL 88 Cb -0.16 -2.10 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 1u5h s VAL 88 CO 0.03 -0.18 -0.02 -0.32 -0.31 0.00 0.00 175.10 174.31 1u5h s MET 89 N -2.77 3.61 -0.42 4.82 0.00 0.77 -0.40 119.30 124.92 1u5h s MET 89 Ca 0.21 -0.53 -0.11 0.00 0.00 0.00 0.00 55.69 55.25 1u5h s MET 89 Cb -0.07 -3.01 0.06 0.00 0.00 0.00 0.00 34.83 31.81 1u5h s MET 89 CO 0.10 0.08 0.28 -1.17 0.00 0.00 0.00 175.02 174.31 1u5h s LEU 90 N 0.81 5.16 0.67 4.11 2.96 -0.06 -1.82 118.68 130.51 1u5h s LEU 90 Ca -0.00 -1.31 -0.13 0.00 -0.22 0.00 0.00 54.13 52.47 1u5h s LEU 90 Cb -0.14 -2.05 -0.00 0.00 0.50 0.00 0.00 46.19 44.49 1u5h s LEU 90 CO 0.02 -0.52 1.07 -2.16 -1.32 0.00 0.00 176.35 173.43 1u5h s PRO 91 N 1.52 2.94 -1.54 0.98 0.04 -1.26 -1.11 135.00 136.57 1u5h s PRO 91 Ca 0.03 1.12 -0.14 0.00 0.04 0.00 0.00 61.00 62.05 1u5h s PRO 91 Cb -0.22 -1.98 0.09 0.00 0.04 0.00 0.00 34.50 32.42 1u5h s PRO 91 CO 0.05 -1.11 0.97 1.63 0.04 0.00 0.00 177.00 178.58 1u5h n LYS 92 N -2.74 -5.42 -2.05 4.56 4.01 -0.98 -4.51 118.16 111.03 1u5h n LYS 92 Ca 0.08 0.59 -0.42 0.00 -0.51 0.00 0.00 58.31 58.05 1u5h n LYS 92 Cb 0.53 -5.48 -0.03 0.00 -0.51 0.00 0.00 35.03 29.54 1u5h n LYS 92 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1u5h s ALA 93 N -3.29 3.63 0.00 7.82 0.00 -0.41 -4.83 121.76 124.69 1u5h s ALA 93 Ca 0.67 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.64 1u5h s ALA 93 Cb -0.34 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.10 1u5h s ALA 93 CO 0.82 -1.16 0.03 0.39 0.00 0.00 0.00 175.76 175.84 1u5h n GLU 94 N 6.10 3.83 -3.51 0.00 1.02 -1.26 -4.07 120.64 122.75 1u5h n GLU 94 Ca 0.16 -0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.15 1u5h n GLU 94 Cb 0.42 -0.35 -0.03 0.00 -0.02 0.00 0.00 31.44 31.46 1u5h n GLU 94 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1u5h s SER 95 N -0.56 -0.43 0.26 1.62 1.04 -1.26 -4.43 113.70 109.93 1u5h s SER 95 Ca 0.00 -0.11 -0.03 0.00 0.48 0.00 0.00 55.95 56.29 1u5h s SER 95 Cb 0.00 0.55 0.43 0.00 0.10 0.00 0.00 66.02 67.10 1u5h s SER 95 CO 0.00 -0.91 1.83 0.00 0.98 0.00 0.00 173.24 175.14 1u5h h ALA 96 N 2.18 1.29 -0.94 5.32 0.00 -1.88 -2.75 119.26 122.47 1u5h h ALA 96 Ca -0.34 0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.70 1u5h h ALA 96 Cb 1.28 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.81 1u5h h ALA 96 CO 0.42 0.19 0.57 0.00 0.00 0.00 0.00 179.25 180.42 1u5h h ALA 97 N 1.47 1.39 -0.07 0.00 0.00 -1.94 0.10 119.26 120.21 1u5h h ALA 97 Ca 0.42 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.30 1u5h h ALA 97 Cb 0.35 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1u5h h ALA 97 CO -0.24 0.17 -0.25 1.96 0.00 0.00 0.00 179.25 180.89 1u5h h GLN 98 N 0.91 0.11 0.00 0.00 4.20 -1.89 -1.85 115.11 116.60 1u5h h GLN 98 Ca 0.46 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.13 1u5h h GLN 98 Cb 0.46 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1u5h h GLN 98 CO -0.27 0.36 -0.05 0.28 -0.67 0.00 0.00 178.83 178.48 1u5h h VAL 99 N 0.11 1.66 -0.65 -0.54 2.07 -1.20 -3.33 116.25 114.37 1u5h h VAL 99 Ca 0.02 -2.02 0.10 0.00 0.82 0.00 0.00 66.70 65.62 1u5h h VAL 99 Cb 0.50 3.02 -0.04 0.00 -1.52 0.00 0.00 31.29 33.25 1u5h h VAL 99 CO 0.03 0.53 0.43 0.40 0.02 0.00 0.00 177.57 178.99 1u5h h ILE 100 N -0.80 0.90 0.00 4.57 2.04 -0.73 -1.24 117.51 122.24 1u5h h ILE 100 Ca -0.01 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1u5h h ILE 100 Cb 0.89 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1u5h h ILE 100 CO 0.01 0.09 0.00 -1.84 0.00 0.00 0.00 178.15 176.40 1u5h n GLU 101 N -4.48 0.08 0.00 2.37 0.28 -0.70 -1.81 120.64 116.38 1u5h n GLU 101 Ca 0.11 0.19 0.12 0.00 -0.16 0.00 0.00 57.16 57.41 1u5h n GLU 101 Cb 0.38 -1.50 0.15 0.00 1.43 0.00 0.00 31.44 31.90 1u5h n GLU 101 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1u5h n LEU 102 N -1.43 0.85 -4.62 -1.84 4.77 -0.47 -4.92 117.00 109.33 1u5h n LEU 102 Ca 0.05 -0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.39 1u5h n LEU 102 Cb 0.17 -0.14 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1u5h n LEU 102 CO 0.14 0.19 0.60 0.00 -1.33 0.00 0.00 177.39 177.00 1u5h n ALA 103 N -1.24 0.32 -0.07 -1.18 0.00 -0.75 -1.40 120.51 116.19 1u5h n ALA 103 Ca 0.06 0.16 0.04 0.00 0.00 0.00 0.00 53.44 53.70 1u5h n ALA 103 Cb 0.35 -2.11 0.23 0.00 0.00 0.00 0.00 19.45 17.91 1u5h n ALA 103 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1u5h n PRO 104 N -0.24 3.21 -1.71 0.00 -0.04 -1.26 -5.11 135.00 129.86 1u5h n PRO 104 Ca 0.10 -1.78 -0.31 0.00 -0.04 0.00 0.00 63.50 61.47 1u5h n PRO 104 Cb 0.42 -1.93 0.03 0.00 -0.04 0.00 0.00 33.50 31.98 1u5h n PRO 104 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1u5h s ARG 105 N -2.00 3.16 0.30 0.54 1.70 -0.49 -5.04 118.95 117.13 1u5h s ARG 105 Ca 0.31 0.92 -0.21 0.00 -0.47 0.00 0.00 55.73 56.29 1u5h s ARG 105 Cb 0.24 -2.02 -0.09 0.00 -0.57 0.00 0.00 34.95 32.50 1u5h s ARG 105 CO 0.09 -0.92 0.82 -0.51 -1.08 0.00 0.00 175.30 173.70 1u5h s ASP 106 N -3.79 7.05 -0.05 -2.89 1.01 -0.64 -4.78 116.67 112.58 1u5h s ASP 106 Ca 0.58 1.55 0.02 0.00 0.71 0.00 0.00 52.55 55.40 1u5h s ASP 106 Cb -0.13 -2.47 0.01 0.00 1.01 0.00 0.00 42.92 41.34 1u5h s ASP 106 CO 0.53 -0.11 -0.10 -0.69 0.21 0.00 0.00 175.17 175.00 1u5h s VAL 107 N -1.75 0.96 -0.28 -1.27 1.01 -0.23 -1.17 120.40 117.67 1u5h s VAL 107 Ca 0.50 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 62.00 1u5h s VAL 107 Cb -0.15 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 1u5h s VAL 107 CO 0.20 0.31 0.15 -0.63 0.00 0.00 0.00 175.10 175.12 1u5h s ILE 108 N 0.63 4.82 -0.19 2.22 1.01 0.47 -0.42 121.20 129.75 1u5h s ILE 108 Ca -0.12 -0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.23 1u5h s ILE 108 Cb -0.14 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 1u5h s ILE 108 CO 0.02 0.22 0.52 0.00 0.00 0.00 0.00 174.94 175.70 1u5h s ALA 109 N 1.68 3.53 -0.45 9.38 0.00 -0.34 -0.88 121.76 134.67 1u5h s ALA 109 Ca 0.06 -0.36 -0.13 0.00 0.00 0.00 0.00 51.96 51.53 1u5h s ALA 109 Cb -0.16 -2.80 0.08 0.00 0.00 0.00 0.00 23.12 20.24 1u5h s ALA 109 CO 0.07 -0.39 0.35 -1.17 0.00 0.00 0.00 175.76 174.62 1u5h s LEU 110 N 1.51 5.47 -0.25 0.00 2.96 -0.27 -0.51 118.68 127.59 1u5h s LEU 110 Ca 0.25 -1.44 -0.22 0.00 -0.22 0.00 0.00 54.13 52.50 1u5h s LEU 110 Cb -0.15 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 1u5h s LEU 110 CO 0.10 -0.62 0.69 -0.69 -1.32 0.00 0.00 176.35 174.51 1u5h s VAL 111 N 1.54 4.94 0.00 1.68 1.01 0.05 -1.29 120.40 128.33 1u5h s VAL 111 Ca 0.04 1.26 0.08 0.00 0.00 0.00 0.00 61.98 63.36 1u5h s VAL 111 Cb -0.24 -3.99 0.13 0.00 0.00 0.00 0.00 36.38 32.28 1u5h s VAL 111 CO 0.04 -0.00 1.02 -1.84 0.00 0.00 0.00 175.10 174.32 1u5h n GLU 112 N 5.80 0.00 -3.94 2.72 0.28 -1.26 -1.80 120.64 122.45 1u5h n GLU 112 Ca 0.01 -1.24 -0.08 0.00 -0.16 0.00 0.00 57.16 55.69 1u5h n GLU 112 Cb 0.48 0.28 -0.08 0.00 1.43 0.00 0.00 31.44 33.55 1u5h n GLU 112 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1u5h s THR 113 N 0.00 0.17 0.23 3.84 -4.23 -1.26 -1.51 115.64 112.87 1u5h s THR 113 Ca 0.10 -1.40 -0.07 0.00 -1.18 0.00 0.00 61.69 59.15 1u5h s THR 113 Cb 0.12 -1.41 0.18 0.00 1.34 0.00 0.00 72.50 72.73 1u5h s THR 113 CO -0.05 -0.77 1.79 0.00 -0.54 0.00 0.00 174.62 175.06 1u5h h ALA 114 N 2.88 1.02 -0.72 3.99 0.00 -1.94 -1.28 119.26 123.21 1u5h h ALA 114 Ca -0.34 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1u5h h ALA 114 Cb 1.18 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1u5h h ALA 114 CO 0.60 0.02 0.22 -0.09 0.00 0.00 0.00 179.25 180.00 1u5h h ARG 115 N 0.68 1.12 -0.89 0.00 9.65 -1.94 0.04 114.38 123.03 1u5h h ARG 115 Ca 0.35 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.98 1u5h h ARG 115 Cb 0.33 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.70 1u5h h ARG 115 CO -0.24 0.96 0.50 0.78 2.80 0.00 0.00 179.97 184.76 1u5h h GLY 116 N 1.10 1.33 0.96 2.80 0.00 -1.57 -1.56 103.07 106.13 1u5h h GLY 116 Ca 0.23 -0.59 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1u5h h GLY 116 CO -0.01 0.57 -0.06 0.00 0.00 0.00 0.00 176.54 177.04 1u5h h ALA 117 N 1.30 0.54 -0.22 3.60 0.00 -0.36 -1.42 119.26 122.70 1u5h h ALA 117 Ca 0.32 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1u5h h ALA 117 Cb 0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1u5h h ALA 117 CO -0.05 0.38 -0.15 0.28 0.00 0.00 0.00 179.25 179.71 1u5h h VAL 118 N 0.56 1.22 -0.52 0.00 2.07 -0.84 -2.85 116.25 115.89 1u5h h VAL 118 Ca 0.10 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.66 1u5h h VAL 118 Cb 0.57 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1u5h h VAL 118 CO 0.03 0.31 0.00 0.00 0.02 0.00 0.00 177.57 177.93 1u5h h ALA 120 N 3.44 1.19 -0.66 0.00 0.00 -1.01 -0.80 119.26 121.42 1u5h h ALA 120 Ca 0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1u5h h ALA 120 Cb 1.64 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1u5h h ALA 120 CO 0.33 0.32 0.12 0.00 0.00 0.00 0.00 179.25 180.02 1u5h h ALA 121 N 1.40 0.88 -0.59 0.00 0.00 -1.85 0.14 119.26 119.24 1u5h h ALA 121 Ca 0.37 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1u5h h ALA 121 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1u5h h ALA 121 CO -0.16 0.64 0.04 0.93 0.00 0.00 0.00 179.25 180.70 1u5h h GLU 122 N 1.01 1.00 -0.36 0.00 3.07 -1.68 -0.59 114.58 117.02 1u5h h GLU 122 Ca 0.20 -0.28 -0.04 0.00 -0.50 0.00 0.00 59.36 58.74 1u5h h GLU 122 Cb 0.42 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1u5h h GLU 122 CO 0.01 0.95 0.05 0.82 -1.40 0.00 0.00 179.01 179.45 1u5h h ILE 123 N 0.92 1.24 -0.42 3.13 5.03 -0.90 -2.84 117.51 123.68 1u5h h ILE 123 Ca 0.18 -0.85 -0.08 0.00 -0.12 0.00 0.00 64.86 63.98 1u5h h ILE 123 Cb 0.48 1.10 -0.02 0.00 -3.03 0.00 0.00 36.82 35.35 1u5h h ILE 123 CO 0.02 0.29 -0.07 0.00 -0.68 0.00 0.00 178.15 177.71 1u5h h ALA 124 N 0.90 1.09 0.00 1.87 0.00 -0.71 -2.87 119.26 119.54 1u5h h ALA 124 Ca 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1u5h h ALA 124 Cb 0.37 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1u5h h ALA 124 CO 0.01 0.57 -0.06 0.00 0.00 0.00 0.00 179.25 179.77 1u5h h ALA 125 N 1.25 0.98 -2.49 0.00 0.00 -1.01 -3.45 119.26 114.55 1u5h h ALA 125 Ca 0.12 -0.05 -0.57 0.00 0.00 0.00 0.00 54.91 54.41 1u5h h ALA 125 Cb 0.52 -0.01 0.10 0.00 0.00 0.00 0.00 17.79 18.40 1u5h h ALA 125 CO 0.03 0.07 0.55 0.00 0.00 0.00 0.00 179.25 179.90 1u5h n ALA 126 N -2.12 1.31 -0.30 0.00 0.00 -1.08 -4.90 120.51 113.42 1u5h n ALA 126 Ca 0.02 0.37 0.06 0.00 0.00 0.00 0.00 53.44 53.89 1u5h n ALA 126 Cb 0.43 -2.27 0.21 0.00 0.00 0.00 0.00 19.45 17.83 1u5h n ALA 126 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1u5h h ASP 127 N 3.08 0.61 0.95 0.00 3.58 -1.90 -1.71 116.42 121.03 1u5h h ASP 127 Ca -0.46 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.07 1u5h h ASP 127 Cb 1.28 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.30 1u5h h ASP 127 CO 0.67 0.29 0.00 -0.65 -2.88 0.00 0.00 179.24 176.67 1u5h h PRO 128 N 0.71 0.00 -6.52 0.28 0.11 -1.87 -3.45 132.00 121.25 1u5h h PRO 128 Ca 0.45 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 66.03 1u5h h PRO 128 Cb 0.56 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.70 1u5h h PRO 128 CO -0.32 0.00 0.99 0.99 -0.21 0.00 0.00 178.00 179.45 1u5h s THR 129 N -3.49 2.73 -0.24 -1.15 2.01 -0.65 -1.06 115.64 113.78 1u5h s THR 129 Ca 0.03 0.34 0.04 0.00 0.31 0.00 0.00 61.69 62.41 1u5h s THR 129 Cb 0.09 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.35 1u5h s THR 129 CO 0.49 0.01 0.24 1.33 -0.69 0.00 0.00 174.62 176.00 1u5h n VAL 130 N 4.46 0.00 -3.50 3.82 0.24 0.44 -4.84 118.33 118.95 1u5h n VAL 130 Ca 0.16 -0.42 -0.12 0.00 -2.04 0.00 0.00 64.34 61.92 1u5h n VAL 130 Cb 0.39 1.02 -0.03 0.00 -1.47 0.00 0.00 33.84 33.74 1u5h n VAL 130 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1u5h s GLY 131 N -1.20 -0.49 -0.03 7.63 0.00 -1.17 -1.32 107.32 110.74 1u5h s GLY 131 Ca 0.02 1.16 0.03 0.00 0.00 0.00 0.00 44.72 45.93 1u5h s GLY 131 CO 0.14 0.57 -0.13 1.06 0.00 0.00 0.00 173.10 174.73 1u5h s MET 132 N -2.45 1.39 0.19 2.90 1.00 0.00 -1.20 119.30 121.13 1u5h s MET 132 Ca -0.01 -0.47 0.08 0.00 0.00 0.00 0.00 55.69 55.29 1u5h s MET 132 Cb -0.01 -1.24 -0.05 0.00 0.00 0.00 0.00 34.83 33.53 1u5h s MET 132 CO -0.04 0.19 -0.15 1.41 0.00 0.00 0.00 175.02 176.44 1u5h s MET 133 N 0.09 1.29 0.23 2.03 0.00 0.33 -0.73 119.30 122.55 1u5h s MET 133 Ca -0.03 -1.55 0.08 0.00 0.00 0.00 0.00 55.69 54.19 1u5h s MET 133 Cb -0.10 -1.10 -0.05 0.00 0.00 0.00 0.00 34.83 33.58 1u5h s MET 133 CO 0.01 0.19 -0.12 1.67 0.00 0.00 0.00 175.02 176.77 1u5h s TRP 134 N -2.86 1.83 -0.06 4.11 1.48 -1.23 -0.77 118.94 121.44 1u5h s TRP 134 Ca 0.21 -0.60 -0.03 0.00 -1.06 0.00 0.00 56.10 54.62 1u5h s TRP 134 Cb -0.01 -0.91 0.03 0.00 -1.16 0.00 0.00 33.47 31.42 1u5h s TRP 134 CO 0.06 0.36 0.13 0.20 -4.06 0.00 0.00 176.95 173.65 1u5h s GLY 135 N -3.37 -0.04 -0.01 3.67 0.00 -0.74 -4.08 107.32 102.75 1u5h s GLY 135 Ca 0.25 0.58 0.14 0.00 0.00 0.00 0.00 44.72 45.69 1u5h s GLY 135 CO 0.09 0.81 0.72 0.00 0.00 0.00 0.00 173.10 174.72 1u5h n ALA 136 N 3.91 1.64 0.37 3.20 0.00 -1.26 -3.56 120.51 124.82 1u5h n ALA 136 Ca -0.23 -0.69 -0.18 0.00 0.00 0.00 0.00 53.44 52.35 1u5h n ALA 136 Cb 0.53 -0.89 -0.09 0.00 0.00 0.00 0.00 19.45 19.00 1u5h n ALA 136 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1u5h h GLU 137 N 0.00 -0.90 0.00 0.00 4.39 -1.96 -1.25 114.58 114.85 1u5h h GLU 137 Ca -0.24 0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.47 1u5h h GLU 137 Cb 1.87 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 30.71 1u5h h GLU 137 CO 0.07 -0.58 -0.22 -0.44 -1.16 0.00 0.00 179.01 176.68 1u5h h ASP 138 N -0.99 0.00 0.57 1.42 3.32 -1.80 -1.27 116.42 117.66 1u5h h ASP 138 Ca -0.10 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 1u5h h ASP 138 Cb 0.73 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.28 1u5h h ASP 138 CO 0.16 0.22 -0.27 0.25 -1.72 0.00 0.00 179.24 177.87 1u5h h LEU 139 N 0.00 -0.64 -0.65 1.55 5.85 -0.98 -0.34 115.31 120.10 1u5h h LEU 139 Ca -0.00 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 1u5h h LEU 139 Cb 0.77 0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 1u5h h LEU 139 CO 0.03 -0.45 0.21 0.40 -0.34 0.00 0.00 178.44 178.29 1u5h h ILE 140 N -0.78 1.25 -0.20 4.05 1.08 -1.11 -1.00 117.51 120.80 1u5h h ILE 140 Ca -0.08 -0.84 -0.00 0.00 -0.39 0.00 0.00 64.86 63.55 1u5h h ILE 140 Cb 0.59 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.90 1u5h h ILE 140 CO 0.13 0.32 0.12 0.00 -0.69 0.00 0.00 178.15 178.03 1u5h h ALA 141 N 1.08 0.25 0.00 1.87 0.00 -1.13 -0.61 119.26 120.72 1u5h h ALA 141 Ca 0.21 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1u5h h ALA 141 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1u5h h ALA 141 CO -0.01 -0.24 -0.37 0.00 0.00 0.00 0.00 179.25 178.63 1u5h h THR 142 N 0.24 0.96 0.00 0.00 1.03 -0.93 -2.00 112.91 112.22 1u5h h THR 142 Ca 0.07 -1.43 0.00 0.00 -0.01 0.00 0.00 66.41 65.05 1u5h h THR 142 Cb 0.02 1.84 0.00 0.00 -1.07 0.00 0.00 68.15 68.94 1u5h h THR 142 CO -0.01 0.36 0.00 -0.07 -0.01 0.00 0.00 175.52 175.79 1u5h h LEU 143 N 0.00 0.00 0.00 0.00 3.38 -0.89 -3.47 115.31 114.33 1u5h h LEU 143 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u5h h LEU 143 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1u5h h LEU 143 CO 0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.19 1u5h n GLY 144 N -0.45 0.90 0.00 0.83 0.00 -0.75 -5.09 105.19 100.63 1u5h n GLY 144 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1u5h n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u5h n GLY 145 N -2.18 0.97 0.00 -0.02 0.00 -0.27 -5.02 105.19 98.67 1u5h n GLY 145 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1u5h n GLY 145 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u5h n SER 146 N -2.72 2.73 -3.69 1.61 3.41 -1.26 -4.50 113.62 109.22 1u5h n SER 146 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 1u5h n SER 146 Cb 0.00 0.54 -0.10 0.00 -0.26 0.00 0.00 64.21 64.39 1u5h n SER 146 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1u5h s SER 147 N -1.11 -0.49 0.26 4.04 0.15 -1.26 -5.02 113.70 110.27 1u5h s SER 147 Ca 0.00 0.94 0.25 0.00 0.70 0.00 0.00 55.95 57.83 1u5h s SER 147 Cb 0.00 0.90 0.59 0.00 -1.71 0.00 0.00 66.02 65.80 1u5h s SER 147 CO 0.00 -0.20 1.64 0.77 1.20 0.00 0.00 173.24 176.65 1u5h h SER 148 N 7.31 0.00 -4.11 5.45 4.64 -1.93 -3.46 113.55 121.45 1u5h h SER 148 Ca -0.33 -0.03 -0.65 0.00 -0.47 0.00 0.00 61.79 60.31 1u5h h SER 148 Cb 1.17 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.03 1u5h h SER 148 CO 0.26 0.01 -0.86 -0.13 -0.87 0.00 0.00 176.83 175.24 1u5h s ARG 149 N -3.15 1.45 0.24 4.77 0.52 -1.26 -0.91 118.95 120.60 1u5h s ARG 149 Ca 0.09 -1.20 -0.03 0.00 -0.52 0.00 0.00 55.73 54.07 1u5h s ARG 149 Cb 0.10 -1.78 0.05 0.00 0.52 0.00 0.00 34.95 33.85 1u5h s ARG 149 CO 0.64 0.43 0.33 2.89 0.02 0.00 0.00 175.30 179.61 1u5h n ARG 150 N 1.28 -0.02 0.09 3.54 1.85 -0.04 -4.84 116.66 118.52 1u5h n ARG 150 Ca -0.18 -0.64 -0.03 0.00 -1.00 0.00 0.00 57.85 56.00 1u5h n ARG 150 Cb 0.53 -0.29 0.20 0.00 -1.05 0.00 0.00 32.46 31.84 1u5h n ARG 150 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1u5h h ALA 151 N -1.31 1.04 0.00 2.89 0.00 -2.01 -1.61 119.26 118.26 1u5h h ALA 151 Ca -0.11 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1u5h h ALA 151 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1u5h h ALA 151 CO 0.09 0.63 0.00 -0.40 0.00 0.00 0.00 179.25 179.57 1u5h n ASP 152 N -3.99 0.00 0.00 0.00 5.75 -1.26 -4.88 116.55 112.17 1u5h n ASP 152 Ca -0.02 -1.24 0.00 0.00 -0.01 0.00 0.00 54.79 53.52 1u5h n ASP 152 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1u5h n ASP 152 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1u5h n GLY 153 N 0.85 0.76 3.77 6.12 0.00 -0.60 -5.05 105.19 111.04 1u5h n GLY 153 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 1u5h n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u5h s ALA 154 N -2.28 3.02 0.45 4.61 0.00 -1.26 -4.68 121.76 121.61 1u5h s ALA 154 Ca 0.00 0.85 -0.26 0.00 0.00 0.00 0.00 51.96 52.56 1u5h s ALA 154 Cb 0.00 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1u5h s ALA 154 CO 0.00 -0.50 1.45 0.71 0.00 0.00 0.00 175.76 177.42 1u5h s TYR 155 N -1.58 2.44 0.87 0.00 2.02 -1.26 -0.86 117.35 118.96 1u5h s TYR 155 Ca 0.61 1.24 -0.10 0.00 -0.37 0.00 0.00 57.07 58.44 1u5h s TYR 155 Cb -0.26 -3.96 0.12 0.00 -0.40 0.00 0.00 41.96 37.45 1u5h s TYR 155 CO 0.32 -3.03 1.11 1.03 -1.57 0.00 0.00 175.55 173.41 1u5h s ARG 156 N -2.43 1.44 0.27 -0.62 0.52 -0.09 -4.76 118.95 113.29 1u5h s ARG 156 Ca 0.60 1.30 -0.01 0.00 -0.52 0.00 0.00 55.73 57.10 1u5h s ARG 156 Cb -0.45 -1.79 0.47 0.00 0.52 0.00 0.00 34.95 33.70 1u5h s ARG 156 CO 0.58 -2.25 1.85 -0.44 0.02 0.00 0.00 175.30 175.05 1u5h h ASP 157 N -1.58 0.91 -0.26 0.23 5.19 -1.94 -1.97 116.42 117.01 1u5h h ASP 157 Ca -0.45 0.04 -0.08 0.00 -0.62 0.00 0.00 57.03 55.92 1u5h h ASP 157 Cb 1.26 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.60 1u5h h ASP 157 CO 0.47 0.53 -0.10 1.62 -3.12 0.00 0.00 179.24 178.64 1u5h h VAL 158 N 1.01 1.24 -0.30 -1.35 3.04 -1.95 0.15 116.25 118.09 1u5h h VAL 158 Ca 0.46 -1.07 -0.03 0.00 -1.01 0.00 0.00 66.70 65.04 1u5h h VAL 158 Cb 0.36 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.68 1u5h h VAL 158 CO -0.23 0.36 0.05 0.00 -1.01 0.00 0.00 177.57 176.74 1u5h h ALA 159 N 1.30 0.40 -0.97 3.17 0.00 -1.71 -1.23 119.26 120.23 1u5h h ALA 159 Ca 0.11 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1u5h h ALA 159 Cb 0.52 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1u5h h ALA 159 CO 0.03 0.08 0.63 0.00 0.00 0.00 0.00 179.25 179.99 1u5h h ARG 160 N 0.32 1.16 -0.02 0.00 3.08 -0.86 -0.51 114.38 117.55 1u5h h ARG 160 Ca 0.09 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1u5h h ARG 160 Cb 0.33 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1u5h h ARG 160 CO 0.00 0.77 0.01 1.25 -1.07 0.00 0.00 179.97 180.93 1u5h h HIS 161 N 1.20 0.03 -0.70 3.04 2.76 -0.48 -2.59 115.15 118.40 1u5h h HIS 161 Ca 0.39 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.50 1u5h h HIS 161 Cb 0.04 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 1u5h h HIS 161 CO -0.01 0.11 0.20 0.28 -1.30 0.00 0.00 177.93 177.21 1u5h h VAL 162 N -0.07 1.25 -0.33 5.26 2.07 -0.94 -1.09 116.25 122.41 1u5h h VAL 162 Ca 0.01 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.68 1u5h h VAL 162 Cb 0.09 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 1u5h h VAL 162 CO -0.00 0.35 0.03 -0.09 0.02 0.00 0.00 177.57 177.88 1u5h h ARG 163 N 1.04 0.13 -0.53 1.57 2.43 -0.98 -0.67 114.38 117.36 1u5h h ARG 163 Ca 0.22 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1u5h h ARG 163 Cb 0.32 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1u5h h ARG 163 CO -0.00 0.09 -0.08 0.77 -1.51 0.00 0.00 179.97 179.24 1u5h h SER 164 N 0.14 0.96 -0.27 -3.80 0.02 -1.27 -1.79 113.55 107.53 1u5h h SER 164 Ca 0.16 -0.29 0.05 0.00 -0.84 0.00 0.00 61.79 60.86 1u5h h SER 164 Cb 0.19 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 1u5h h SER 164 CO -0.23 1.06 -0.00 0.74 -1.14 0.00 0.00 176.83 177.25 1u5h h THR 165 N 0.87 0.80 -0.26 -2.27 2.02 -0.66 -0.73 112.91 112.68 1u5h h THR 165 Ca 0.14 -0.03 -0.16 0.00 0.77 0.00 0.00 66.41 67.14 1u5h h THR 165 Cb 0.62 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1u5h h THR 165 CO 0.04 0.01 -0.47 0.16 0.37 0.00 0.00 175.52 175.63 1u5h h ILE 166 N 0.08 1.30 -0.38 3.11 -0.00 -0.99 -1.16 117.51 119.46 1u5h h ILE 166 Ca 0.13 -1.67 0.02 0.00 -0.00 0.00 0.00 64.86 63.34 1u5h h ILE 166 Cb 0.17 1.61 -0.03 0.00 -0.00 0.00 0.00 36.82 38.57 1u5h h ILE 166 CO -0.22 0.53 0.21 0.25 -0.00 0.00 0.00 178.15 178.92 1u5h h LEU 167 N 0.54 0.33 -0.21 0.16 6.46 -1.06 -0.48 115.31 121.06 1u5h h LEU 167 Ca 0.03 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 1u5h h LEU 167 Cb 1.02 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.89 1u5h h LEU 167 CO 0.10 0.24 -0.02 -0.07 -0.62 0.00 0.00 178.44 178.06 1u5h h LEU 168 N 0.43 0.38 -0.48 2.25 3.38 -1.06 -1.23 115.31 118.97 1u5h h LEU 168 Ca 0.16 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.79 1u5h h LEU 168 Cb 0.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1u5h h LEU 168 CO -0.09 0.63 0.32 0.00 0.09 0.00 0.00 178.44 179.38 1u5h h ALA 169 N 0.77 0.61 -0.15 1.53 0.00 -1.08 0.42 119.26 121.35 1u5h h ALA 169 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1u5h h ALA 169 Cb 0.45 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1u5h h ALA 169 CO 0.02 0.05 0.06 0.00 0.00 0.00 0.00 179.25 179.38 1u5h h ALA 170 N 1.18 0.19 -0.31 0.00 0.00 -0.98 -2.94 119.26 116.40 1u5h h ALA 170 Ca 0.18 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1u5h h ALA 170 Cb -0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1u5h h ALA 170 CO -0.04 -0.23 -0.23 1.03 0.00 0.00 0.00 179.25 179.78 1u5h h SER 171 N 0.10 0.60 0.09 0.00 0.87 -1.06 0.17 113.55 114.32 1u5h h SER 171 Ca 0.05 -0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 1u5h h SER 171 Cb 0.15 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1u5h h SER 171 CO -0.01 0.82 -0.06 0.00 -0.53 0.00 0.00 176.83 177.06 1u5h h ALA 172 N 1.22 1.71 -0.19 6.23 0.00 -0.74 -2.07 119.26 125.42 1u5h h ALA 172 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1u5h h ALA 172 Cb 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1u5h h ALA 172 CO 0.05 0.08 0.00 1.19 0.00 0.00 0.00 179.25 180.57 1u5h n PHE 173 N -4.19 0.44 -2.10 0.00 3.72 -1.00 -4.99 117.46 109.33 1u5h n PHE 173 Ca -0.03 -0.71 -0.10 0.00 -0.05 0.00 0.00 57.45 56.56 1u5h n PHE 173 Cb 0.15 -0.14 -0.01 0.00 -0.94 0.00 0.00 39.48 38.54 1u5h n PHE 173 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u5h n GLY 174 N -0.36 0.07 3.93 1.37 0.00 -0.70 -4.99 105.19 104.51 1u5h n GLY 174 Ca 0.13 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.40 1u5h n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u5h s ARG 175 N -4.34 3.50 0.41 1.61 1.81 0.50 -5.00 118.95 117.44 1u5h s ARG 175 Ca 0.00 -0.39 -0.27 0.00 -1.72 0.00 0.00 55.73 53.35 1u5h s ARG 175 Cb 0.00 -2.89 -0.10 0.00 -0.45 0.00 0.00 34.95 31.52 1u5h s ARG 175 CO 0.00 0.45 1.45 -1.17 -0.68 0.00 0.00 175.30 175.35 1u5h s LEU 176 N -3.18 4.22 -0.17 2.53 2.96 -0.44 -4.27 118.68 120.33 1u5h s LEU 176 Ca 0.37 2.97 -0.01 0.00 -0.22 0.00 0.00 54.13 57.24 1u5h s LEU 176 Cb -0.11 -3.80 -0.01 0.00 0.50 0.00 0.00 46.19 42.77 1u5h s LEU 176 CO 0.28 -1.01 -0.11 0.00 -1.32 0.00 0.00 176.35 174.20 1u5h s ALA 177 N -1.16 2.64 -0.16 5.97 0.00 -1.26 -0.82 121.76 126.97 1u5h s ALA 177 Ca 0.57 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.47 1u5h s ALA 177 Cb -0.45 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 1u5h s ALA 177 CO 0.59 -0.11 -0.12 -0.51 0.00 0.00 0.00 175.76 175.62 1u5h s LEU 178 N 0.93 2.65 0.34 0.00 1.43 0.09 -0.66 118.68 123.47 1u5h s LEU 178 Ca -0.02 -0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 52.56 1u5h s LEU 178 Cb -0.15 -1.62 -0.07 0.00 0.03 0.00 0.00 46.19 44.38 1u5h s LEU 178 CO -0.01 0.08 0.69 -0.62 0.23 0.00 0.00 176.35 176.73 1u5h s ASP 179 N 0.85 6.60 0.69 2.29 3.68 -0.06 -3.51 116.67 127.21 1u5h s ASP 179 Ca -0.04 1.09 -0.15 0.00 2.13 0.00 0.00 52.55 55.58 1u5h s ASP 179 Cb -0.15 -2.30 0.02 0.00 -1.45 0.00 0.00 42.92 39.04 1u5h s ASP 179 CO 0.00 -0.26 1.13 0.00 0.13 0.00 0.00 175.17 176.17 1u5h s ALA 180 N -2.13 2.34 0.49 3.66 0.00 -1.26 -2.34 121.76 122.53 1u5h s ALA 180 Ca 0.51 0.62 -0.23 0.00 0.00 0.00 0.00 51.96 52.85 1u5h s ALA 180 Cb -0.10 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1u5h s ALA 180 CO 0.25 -1.49 1.33 0.08 0.00 0.00 0.00 175.76 175.93 1u5h s VAL 181 N -2.28 2.34 -0.52 0.00 1.01 -1.25 -4.57 120.40 115.12 1u5h s VAL 181 Ca 0.69 0.27 -0.20 0.00 0.00 0.00 0.00 61.98 62.74 1u5h s VAL 181 Cb -0.23 -3.15 0.06 0.00 0.00 0.00 0.00 36.38 33.07 1u5h s VAL 181 CO 0.43 0.01 0.68 -2.28 0.00 0.00 0.00 175.10 173.94 1u5h s HIS 182 N -1.32 3.01 0.21 5.22 2.46 -1.26 -4.95 115.29 118.65 1u5h s HIS 182 Ca 0.66 -0.49 0.15 0.00 0.47 0.00 0.00 55.06 55.85 1u5h s HIS 182 Cb -0.39 -3.65 0.54 0.00 -0.13 0.00 0.00 32.58 28.96 1u5h s HIS 182 CO 0.47 -1.10 1.68 -0.07 -2.47 0.00 0.00 174.74 173.26 1u5h h LEU 183 N 9.92 0.00 -8.02 8.88 4.07 -1.97 -3.37 115.31 124.82 1u5h h LEU 183 Ca -0.27 0.00 -0.65 0.00 0.08 0.00 0.00 57.88 57.04 1u5h h LEU 183 Cb 1.09 0.00 -0.13 0.00 1.08 0.00 0.00 40.66 42.70 1u5h h LEU 183 CO 0.99 0.48 1.29 -0.62 -1.08 0.00 0.00 178.44 179.50 1u5h s ASP 184 N -6.62 6.61 0.19 -0.43 -1.08 -1.26 -4.87 116.67 109.21 1u5h s ASP 184 Ca -0.01 -1.84 -0.12 0.00 -0.52 0.00 0.00 52.55 50.07 1u5h s ASP 184 Cb 0.12 -2.50 0.20 0.00 -1.46 0.00 0.00 42.92 39.28 1u5h s ASP 184 CO 0.72 -1.27 1.74 0.40 0.52 0.00 0.00 175.17 177.28 1u5h h ILE 185 N 6.22 0.80 0.00 4.11 1.08 -2.03 -0.56 117.51 127.13 1u5h h ILE 185 Ca 0.21 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.56 1u5h h ILE 185 Cb 1.00 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 35.17 1u5h h ILE 185 CO 1.30 0.06 0.00 0.18 -0.69 0.00 0.00 178.15 179.00 1u5h n LEU 186 N -5.02 0.00 -4.09 1.44 4.77 -1.26 -4.15 117.00 108.70 1u5h n LEU 186 Ca 0.06 0.43 -0.43 0.00 -0.03 0.00 0.00 56.01 56.04 1u5h n LEU 186 Cb 0.22 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1u5h n LEU 186 CO 0.23 -0.14 2.06 -0.67 -1.33 0.00 0.00 177.39 177.55 1u5h n ASP 187 N -1.43 4.73 0.21 -1.43 2.03 -0.22 -4.72 116.55 115.72 1u5h n ASP 187 Ca 0.06 -2.97 0.08 0.00 0.52 0.00 0.00 54.79 52.48 1u5h n ASP 187 Cb 0.21 -1.60 0.41 0.00 -0.72 0.00 0.00 41.12 39.42 1u5h n ASP 187 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 1u5h h VAL 188 N 4.35 0.75 0.00 5.18 -1.51 -1.81 -2.15 116.25 121.06 1u5h h VAL 188 Ca 0.44 -1.28 -0.00 0.00 -1.23 0.00 0.00 66.70 64.63 1u5h h VAL 188 Cb 0.73 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1u5h h VAL 188 CO 1.59 0.29 -0.00 -0.08 -1.23 0.00 0.00 177.57 178.15 1u5h h GLU 189 N 0.00 -0.00 -0.56 5.19 4.81 -1.96 -0.05 114.58 122.00 1u5h h GLU 189 Ca -0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1u5h h GLU 189 Cb 0.78 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1u5h h GLU 189 CO 0.04 0.10 0.13 0.78 -0.73 0.00 0.00 179.01 179.33 1u5h h GLY 190 N -0.11 0.98 0.99 1.92 0.00 -1.94 -1.34 103.07 103.58 1u5h h GLY 190 Ca -0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 1u5h h GLY 190 CO 0.00 0.58 0.31 -2.00 0.00 0.00 0.00 176.54 175.43 1u5h h LEU 191 N 0.81 0.75 -0.64 3.11 5.85 -1.27 -0.10 115.31 123.82 1u5h h LEU 191 Ca 0.18 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1u5h h LEU 191 Cb 0.36 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1u5h h LEU 191 CO 0.00 0.64 0.38 -0.61 -0.34 0.00 0.00 178.44 178.51 1u5h h GLN 192 N 0.80 0.88 -0.41 1.25 4.15 -0.73 0.20 115.11 121.25 1u5h h GLN 192 Ca 0.21 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1u5h h GLN 192 Cb 0.07 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.56 1u5h h GLN 192 CO -0.03 0.64 0.26 0.93 -1.93 0.00 0.00 178.83 178.70 1u5h h GLU 193 N 0.87 0.55 -0.26 1.69 5.08 -0.77 0.05 114.58 121.80 1u5h h GLU 193 Ca 0.23 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1u5h h GLU 193 Cb -0.00 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1u5h h GLU 193 CO -0.04 0.39 -0.05 0.93 -1.00 0.00 0.00 179.01 179.24 1u5h h GLU 194 N 0.55 0.49 -0.13 2.33 5.08 -0.60 -2.47 114.58 119.83 1u5h h GLU 194 Ca 0.15 -0.18 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 1u5h h GLU 194 Cb -0.03 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1u5h h GLU 194 CO -0.03 0.70 -0.54 0.00 -1.00 0.00 0.00 179.01 178.14 1u5h h ALA 195 N 0.77 0.84 -0.53 3.43 0.00 -0.48 0.26 119.26 123.55 1u5h h ALA 195 Ca 0.07 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1u5h h ALA 195 Cb 0.51 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1u5h h ALA 195 CO 0.02 0.69 0.04 0.00 0.00 0.00 0.00 179.25 180.00 1u5h h ARG 196 N 0.28 0.90 -0.35 0.00 3.08 -1.01 0.09 114.38 117.38 1u5h h ARG 196 Ca 0.01 -0.27 -0.09 0.00 0.07 0.00 0.00 59.98 59.69 1u5h h ARG 196 Cb 1.04 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 1u5h h ARG 196 CO 0.09 0.91 -0.14 0.22 -1.07 0.00 0.00 179.97 179.98 1u5h h ASP 197 N 0.78 0.73 -0.23 7.04 3.58 -1.01 -1.61 116.42 125.70 1u5h h ASP 197 Ca 0.15 -0.39 0.04 0.00 0.42 0.00 0.00 57.03 57.25 1u5h h ASP 197 Cb 0.48 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 41.28 1u5h h ASP 197 CO 0.02 0.96 -0.03 0.00 -2.88 0.00 0.00 179.24 177.31 1u5h h ALA 198 N 0.80 0.17 -0.87 -0.78 0.00 -0.23 -1.19 119.26 117.17 1u5h h ALA 198 Ca 0.08 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.13 1u5h h ALA 198 Cb 0.67 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 1u5h h ALA 198 CO 0.05 -0.45 0.54 0.00 0.00 0.00 0.00 179.25 179.39 1u5h h ALA 199 N 1.22 1.19 -0.11 0.00 0.00 -0.93 -0.36 119.26 120.27 1u5h h ALA 199 Ca 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1u5h h ALA 199 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1u5h h ALA 199 CO -0.22 0.31 -0.23 0.00 0.00 0.00 0.00 179.25 179.11 1u5h h ALA 200 N 1.40 1.42 -0.02 0.00 0.00 -0.45 -2.91 119.26 118.70 1u5h h ALA 200 Ca 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1u5h h ALA 200 Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1u5h h ALA 200 CO -0.16 0.41 -0.26 0.28 0.00 0.00 0.00 179.25 179.51 1u5h n VAL 201 N -4.20 0.00 0.00 0.00 0.31 -0.53 -4.97 118.33 108.94 1u5h n VAL 201 Ca -0.01 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 1u5h n VAL 201 Cb 0.33 1.32 0.00 0.00 -0.91 0.00 0.00 33.84 34.59 1u5h n VAL 201 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u5h n GLY 202 N 1.38 1.14 3.75 2.92 0.00 -0.81 -5.08 105.19 108.49 1u5h n GLY 202 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1u5h n GLY 202 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u5h s PHE 203 N -2.00 2.27 -0.12 1.61 0.08 -0.21 -4.82 117.98 114.79 1u5h s PHE 203 Ca 0.00 1.49 0.20 0.00 0.12 0.00 0.00 56.93 58.74 1u5h s PHE 203 Cb 0.00 -3.59 -0.23 0.00 -0.57 0.00 0.00 43.02 38.63 1u5h s PHE 203 CO 0.00 -2.53 0.52 -0.25 -0.10 0.00 0.00 175.22 172.86 1u5h n ASP 204 N -1.63 0.32 -3.84 1.36 8.00 0.17 -4.48 116.55 116.45 1u5h n ASP 204 Ca 0.14 0.13 -0.12 0.00 0.71 0.00 0.00 54.79 55.66 1u5h n ASP 204 Cb 0.49 1.09 -0.11 0.00 -0.02 0.00 0.00 41.12 42.57 1u5h n ASP 204 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1u5h s VAL 205 N -3.07 0.05 -0.17 2.53 1.01 -1.07 -4.39 120.40 115.29 1u5h s VAL 205 Ca -0.06 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1u5h s VAL 205 Cb 0.10 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 36.10 1u5h s VAL 205 CO 0.85 -0.22 -0.16 0.42 0.00 0.00 0.00 175.10 176.00 1u5h s THR 206 N -0.78 2.56 0.17 3.92 -4.23 -0.86 -0.89 115.64 115.54 1u5h s THR 206 Ca -0.09 -0.79 -0.27 0.00 -1.18 0.00 0.00 61.69 59.36 1u5h s THR 206 Cb -0.05 -2.09 -0.08 0.00 1.34 0.00 0.00 72.50 71.62 1u5h s THR 206 CO 0.01 0.51 0.85 0.54 -0.54 0.00 0.00 174.62 175.99 1u5h s VAL 207 N 1.00 4.32 0.22 2.29 0.11 -0.99 -3.41 120.40 123.94 1u5h s VAL 207 Ca -0.02 1.86 0.12 0.00 -2.93 0.00 0.00 61.98 61.00 1u5h s VAL 207 Cb -0.15 -4.22 -0.05 0.00 -1.53 0.00 0.00 36.38 30.44 1u5h s VAL 207 CO -0.03 0.48 -0.22 0.00 -3.33 0.00 0.00 175.10 171.99 1u5h n ILE 209 N 0.01 0.00 -3.80 0.00 -5.35 -1.26 -1.33 119.36 107.63 1u5h n ILE 209 Ca -0.10 -0.46 -0.13 0.00 -0.27 0.00 0.00 62.75 61.80 1u5h n ILE 209 Cb 0.57 1.09 -0.13 0.00 -1.74 0.00 0.00 39.64 39.43 1u5h n ILE 209 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1u5h s HIS 210 N -0.87 -0.20 0.59 4.28 5.04 -1.26 -4.84 115.29 118.04 1u5h s HIS 210 Ca 0.06 0.48 0.29 0.00 -1.54 0.00 0.00 55.06 54.35 1u5h s HIS 210 Cb 0.05 0.05 1.66 0.00 0.04 0.00 0.00 32.58 34.38 1u5h s HIS 210 CO 0.13 -0.11 2.10 -1.00 -2.34 0.00 0.00 174.74 173.52 1u5h h PRO 211 N 6.09 0.00 0.00 2.88 0.13 -1.94 -0.84 132.00 138.31 1u5h h PRO 211 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1u5h h PRO 211 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1u5h h PRO 211 CO 0.40 0.00 -0.00 0.66 -0.23 0.00 0.00 178.00 178.83 1u5h h SER 212 N 0.00 0.00 1.60 1.44 4.64 -1.98 -2.49 113.55 116.76 1u5h h SER 212 Ca 0.09 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.35 1u5h h SER 212 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 1u5h h SER 212 CO -0.00 0.00 -0.27 1.56 -0.87 0.00 0.00 176.83 177.25 1u5h h GLN 213 N 0.00 0.00 -0.08 4.77 4.20 -1.50 -3.38 115.11 119.13 1u5h h GLN 213 Ca -0.00 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.72 1u5h h GLN 213 Cb 0.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1u5h h GLN 213 CO 0.00 0.27 0.01 0.82 -0.67 0.00 0.00 178.83 179.26 1u5h h ILE 214 N 0.00 0.96 -0.44 2.54 1.08 -1.57 -1.84 117.51 118.24 1u5h h ILE 214 Ca -0.00 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.48 1u5h h ILE 214 Cb 1.14 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 35.78 1u5h h ILE 214 CO 0.03 0.01 0.29 1.55 -0.69 0.00 0.00 178.15 179.34 1u5h h PRO 215 N 0.04 0.47 -0.27 2.37 0.13 -1.76 0.11 132.00 133.09 1u5h h PRO 215 Ca 0.03 -0.03 -0.13 0.00 -0.87 0.00 0.00 66.00 65.00 1u5h h PRO 215 Cb 0.03 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.05 1u5h h PRO 215 CO -0.05 0.31 -0.34 -0.24 -0.23 0.00 0.00 178.00 177.45 1u5h h VAL 216 N 0.48 1.31 -0.01 1.56 3.04 -1.67 -1.62 116.25 119.34 1u5h h VAL 216 Ca 0.18 -1.53 -0.00 0.00 -1.01 0.00 0.00 66.70 64.34 1u5h h VAL 216 Cb 0.11 1.66 -0.00 0.00 -2.01 0.00 0.00 31.29 31.05 1u5h h VAL 216 CO -0.04 0.49 0.00 0.58 -1.01 0.00 0.00 177.57 177.59 1u5h h VAL 217 N 0.43 1.15 -1.01 1.51 2.07 -0.77 -1.85 116.25 117.79 1u5h h VAL 217 Ca 0.03 -0.45 0.09 0.00 0.82 0.00 0.00 66.70 67.20 1u5h h VAL 217 Cb 0.93 1.44 -0.08 0.00 -1.52 0.00 0.00 31.29 32.06 1u5h h VAL 217 CO 0.08 0.12 0.64 0.03 0.02 0.00 0.00 177.57 178.46 1u5h h ARG 218 N -0.18 1.06 -0.36 1.57 3.08 -0.70 -2.12 114.38 116.73 1u5h h ARG 218 Ca 0.00 -0.06 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 1u5h h ARG 218 Cb 0.19 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1u5h h ARG 218 CO -0.00 0.70 -0.28 -0.22 -1.07 0.00 0.00 179.97 179.10 1u5h h LYS 219 N 1.09 0.83 -0.40 0.04 3.64 -1.19 -2.74 116.57 117.84 1u5h h LYS 219 Ca 0.47 -0.41 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1u5h h LYS 219 Cb 0.33 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1u5h h LYS 219 CO -0.22 1.05 0.27 0.00 -2.27 0.00 0.00 179.45 178.27 1u5h h ALA 220 N 0.77 1.79 -0.35 5.00 0.00 -0.74 -2.50 119.26 123.23 1u5h h ALA 220 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1u5h h ALA 220 Cb 0.86 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1u5h h ALA 220 CO 0.07 0.17 0.00 0.66 0.00 0.00 0.00 179.25 180.15 1u5h n TYR 221 N -4.48 0.46 -0.23 0.00 4.02 -0.85 -4.67 117.16 111.41 1u5h n TYR 221 Ca 0.04 -0.23 -0.06 0.00 -0.01 0.00 0.00 57.90 57.64 1u5h n TYR 221 Cb 0.12 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.38 1u5h n TYR 221 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1u5h h ALA 222 N 4.20 -0.31 0.00 -0.72 0.00 -1.15 -3.51 119.26 117.78 1u5h h ALA 222 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1u5h h ALA 222 Cb 0.74 1.20 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1u5h h ALA 222 CO 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 179.25 178.71