#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss8 n ALA 3 N 0.00 -0.23 -2.46 0.00 0.00 -1.26 -4.92 120.51 111.64 1ss8 n ALA 3 Ca 0.00 0.25 -0.23 0.00 0.00 0.00 0.00 53.44 53.46 1ss8 n ALA 3 Cb 0.00 -2.01 -0.06 0.00 0.00 0.00 0.00 19.45 17.38 1ss8 n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ss8 s LYS 4 N -1.86 2.41 -0.12 0.00 -0.14 -1.26 -3.02 119.74 115.75 1ss8 s LYS 4 Ca 0.63 -1.57 0.02 0.00 -1.36 0.00 0.00 55.97 53.68 1ss8 s LYS 4 Cb -0.59 -2.20 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 1ss8 s LYS 4 CO 0.57 0.03 -0.18 0.34 -0.76 0.00 0.00 175.35 175.35 1ss8 s ASP 5 N -3.91 3.59 -0.04 2.83 -1.08 0.12 -4.71 116.67 113.47 1ss8 s ASP 5 Ca 0.40 -0.44 0.07 0.00 -0.52 0.00 0.00 52.55 52.06 1ss8 s ASP 5 Cb -0.02 -1.52 -0.02 0.00 -1.46 0.00 0.00 42.92 39.90 1ss8 s ASP 5 CO 0.24 0.16 -0.24 -0.69 0.52 0.00 0.00 175.17 175.15 1ss8 s VAL 6 N 0.39 2.16 0.06 1.11 1.01 -1.26 -2.53 120.40 121.35 1ss8 s VAL 6 Ca -0.14 -1.05 0.05 0.00 0.00 0.00 0.00 61.98 60.85 1ss8 s VAL 6 Cb -0.17 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1ss8 s VAL 6 CO 0.07 0.58 -0.15 -0.54 0.00 0.00 0.00 175.10 175.05 1ss8 s LYS 7 N -0.39 0.88 0.17 2.72 1.02 -0.44 -4.98 119.74 118.72 1ss8 s LYS 7 Ca 0.03 -0.92 0.07 0.00 0.02 0.00 0.00 55.97 55.18 1ss8 s LYS 7 Cb -0.12 -0.92 -0.04 0.00 -0.52 0.00 0.00 37.83 36.23 1ss8 s LYS 7 CO 0.01 0.21 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.45 1ss8 s PHE 8 N -1.14 1.62 0.00 3.18 0.08 -1.26 -0.23 117.98 120.22 1ss8 s PHE 8 Ca -0.00 -0.56 0.00 0.00 0.12 0.00 0.00 56.93 56.49 1ss8 s PHE 8 Cb -0.09 -0.79 0.00 0.00 -0.57 0.00 0.00 43.02 41.56 1ss8 s PHE 8 CO 0.02 0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.82 1ss8 n GLY 9 N 0.06 2.07 0.37 4.36 0.00 -0.59 -2.30 105.19 109.15 1ss8 n GLY 9 Ca -0.12 0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1ss8 n GLY 9 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ss8 h ASN 10 N 0.00 0.72 -0.72 1.61 -0.26 -1.95 0.25 115.58 115.22 1ss8 h ASN 10 Ca 0.00 0.05 0.01 0.00 -0.56 0.00 0.00 56.30 55.80 1ss8 h ASN 10 Cb 0.00 -0.09 -0.04 0.00 -1.06 0.00 0.00 38.32 37.14 1ss8 h ASN 10 CO 0.00 0.34 0.48 0.44 -1.06 0.00 0.00 177.43 177.63 1ss8 h ASP 11 N 0.74 0.82 -0.60 5.81 3.32 -1.87 0.11 116.42 124.75 1ss8 h ASP 11 Ca 0.49 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.48 1ss8 h ASP 11 Cb 0.75 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1ss8 h ASP 11 CO -0.25 0.59 0.24 0.00 -1.72 0.00 0.00 179.24 178.11 1ss8 h ALA 12 N 1.27 0.78 -0.17 3.45 0.00 -0.83 -2.70 119.26 121.06 1ss8 h ALA 12 Ca 0.27 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 12 Cb -0.10 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.39 1ss8 h ALA 12 CO -0.06 0.39 -0.25 0.78 0.00 0.00 0.00 179.25 180.11 1ss8 h GLY 13 N 0.83 -0.23 1.84 0.00 0.00 0.55 -1.38 103.07 104.68 1ss8 h GLY 13 Ca 0.20 0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.75 1ss8 h GLY 13 CO -0.02 -0.20 -0.29 -0.39 0.00 0.00 0.00 176.54 175.64 1ss8 h VAL 14 N -0.29 1.25 -0.36 4.60 -1.51 -0.80 -0.89 116.25 118.25 1ss8 h VAL 14 Ca 0.11 -1.18 -0.15 0.00 -1.23 0.00 0.00 66.70 64.25 1ss8 h VAL 14 Cb 0.46 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 31.11 1ss8 h VAL 14 CO -0.34 0.35 -0.37 0.11 -1.23 0.00 0.00 177.57 176.09 1ss8 h LYS 15 N 0.17 0.86 -0.04 5.19 1.79 -1.09 -1.91 116.57 121.53 1ss8 h LYS 15 Ca 0.02 -0.44 -0.16 0.00 -2.18 0.00 0.00 60.65 57.89 1ss8 h LYS 15 Cb 0.61 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 1ss8 h LYS 15 CO 0.04 1.08 -0.70 0.52 -1.08 0.00 0.00 179.45 179.31 1ss8 h MET 16 N 0.70 0.20 -0.37 3.15 2.86 -0.44 -2.69 114.93 118.34 1ss8 h MET 16 Ca 0.06 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.44 1ss8 h MET 16 Cb 0.94 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 1ss8 h MET 16 CO 0.09 0.82 -0.15 1.25 1.06 0.00 0.00 176.91 179.98 1ss8 h LEU 17 N 0.14 0.67 -0.58 1.22 5.85 -1.10 -0.24 115.31 121.26 1ss8 h LEU 17 Ca -0.02 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.43 1ss8 h LEU 17 Cb 1.25 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 1ss8 h LEU 17 CO 0.11 0.83 0.10 0.03 -0.34 0.00 0.00 178.44 179.18 1ss8 h ARG 18 N 0.61 0.96 -0.36 1.25 3.08 -1.14 -0.76 114.38 118.01 1ss8 h ARG 18 Ca 0.10 -0.25 0.04 0.00 0.07 0.00 0.00 59.98 59.94 1ss8 h ARG 18 Cb 0.60 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 1ss8 h ARG 18 CO 0.04 0.91 0.12 0.78 -1.07 0.00 0.00 179.97 180.75 1ss8 h GLY 19 N 0.86 0.46 1.61 0.04 0.00 -1.23 -1.17 103.07 103.65 1ss8 h GLY 19 Ca 0.18 -0.07 -0.14 0.00 0.00 0.00 0.00 47.33 47.30 1ss8 h GLY 19 CO 0.01 0.03 -0.49 -2.08 0.00 0.00 0.00 176.54 174.01 1ss8 h VAL 20 N 0.28 1.33 -0.31 4.60 2.07 -0.73 -2.72 116.25 120.76 1ss8 h VAL 20 Ca 0.16 -1.71 -0.11 0.00 0.82 0.00 0.00 66.70 65.86 1ss8 h VAL 20 Cb 0.14 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1ss8 h VAL 20 CO -0.17 0.52 -0.26 0.78 0.02 0.00 0.00 177.57 178.46 1ss8 h ASN 21 N 0.33 0.64 -0.44 0.57 2.35 -0.37 0.20 115.58 118.87 1ss8 h ASN 21 Ca 0.02 -0.23 -0.14 0.00 -0.55 0.00 0.00 56.30 55.39 1ss8 h ASN 21 Cb 0.98 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.17 1ss8 h ASN 21 CO 0.09 0.88 -0.29 0.58 -1.65 0.00 0.00 177.43 177.04 1ss8 h VAL 22 N 0.55 1.27 0.24 2.81 2.07 -1.09 0.22 116.25 122.31 1ss8 h VAL 22 Ca 0.07 -1.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1ss8 h VAL 22 Cb 0.74 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1ss8 h VAL 22 CO 0.06 0.50 -0.12 0.25 0.02 0.00 0.00 177.57 178.28 1ss8 h LEU 23 N 0.80 -0.27 -0.27 2.57 5.85 -1.15 -1.87 115.31 120.98 1ss8 h LEU 23 Ca 0.09 -0.09 -0.18 0.00 0.84 0.00 0.00 57.88 58.53 1ss8 h LEU 23 Cb 0.87 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.98 1ss8 h LEU 23 CO 0.08 -0.07 -0.54 0.00 -0.34 0.00 0.00 178.44 177.56 1ss8 h ALA 24 N 0.27 0.43 -0.53 1.25 0.00 -0.47 -2.21 119.26 117.99 1ss8 h ALA 24 Ca -0.03 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1ss8 h ALA 24 Cb 0.35 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1ss8 h ALA 24 CO 0.05 0.64 0.33 -0.44 0.00 0.00 0.00 179.25 179.84 1ss8 h ASP 25 N 0.61 0.62 -0.11 0.00 3.32 -0.54 0.17 116.42 120.50 1ss8 h ASP 25 Ca 0.01 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1ss8 h ASP 25 Cb 1.15 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.55 1ss8 h ASP 25 CO 0.12 0.46 -0.13 0.00 -1.72 0.00 0.00 179.24 177.97 1ss8 h ALA 26 N 1.65 0.16 -0.37 3.45 0.00 -0.80 -3.28 119.26 120.08 1ss8 h ALA 26 Ca 0.19 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1ss8 h ALA 26 Cb -0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1ss8 h ALA 26 CO -0.04 0.04 -0.26 0.28 0.00 0.00 0.00 179.25 179.27 1ss8 h VAL 27 N -0.13 1.27 0.00 0.00 2.07 -1.18 -3.29 116.25 114.99 1ss8 h VAL 27 Ca 0.01 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.16 1ss8 h VAL 27 Cb 0.67 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1ss8 h VAL 27 CO 0.03 0.45 0.00 0.07 0.02 0.00 0.00 177.57 178.15 1ss8 h LYS 28 N 0.65 0.00 -0.14 1.57 2.10 -1.02 -2.71 116.57 117.02 1ss8 h LYS 28 Ca 0.08 0.00 0.04 0.00 -2.00 0.00 0.00 60.65 58.77 1ss8 h LYS 28 Cb 0.77 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.09 1ss8 h LYS 28 CO 0.06 0.00 0.27 -0.39 -2.00 0.00 0.00 179.45 177.39 1ss8 h VAL 29 N 0.00 0.21 -0.00 0.07 -1.51 -1.64 -1.44 116.25 111.94 1ss8 h VAL 29 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1ss8 h VAL 29 Cb 0.77 0.76 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1ss8 h VAL 29 CO 0.00 0.00 -0.04 0.35 -1.23 0.00 0.00 177.57 176.65 1ss8 n THR 30 N -3.35 0.00 -2.71 7.19 -2.24 -1.02 -0.16 114.28 111.99 1ss8 n THR 30 Ca 0.01 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 1ss8 n THR 30 Cb 0.37 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 1ss8 n THR 30 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ss8 s LEU 31 N -2.37 4.31 0.00 3.22 2.96 -0.55 -4.27 118.68 121.99 1ss8 s LEU 31 Ca 0.34 1.60 0.00 0.00 -0.22 0.00 0.00 54.13 55.84 1ss8 s LEU 31 Cb 0.21 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.34 1ss8 s LEU 31 CO 0.44 -0.34 0.00 0.61 -1.32 0.00 0.00 176.35 175.74 1ss8 n GLY 32 N 2.99 -0.39 0.31 7.98 0.00 -1.26 -3.70 105.19 111.13 1ss8 n GLY 32 Ca 0.07 -1.81 0.19 0.00 0.00 0.00 0.00 46.02 44.46 1ss8 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ss8 h PRO 33 N 0.00 0.00 -0.54 1.61 0.13 -1.91 -1.49 132.00 129.80 1ss8 h PRO 33 Ca 0.00 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.89 1ss8 h PRO 33 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 1ss8 h PRO 33 CO 0.00 0.02 0.14 1.63 -0.23 0.00 0.00 178.00 179.57 1ss8 n LYS 34 N -3.36 2.28 -1.65 0.86 4.01 -1.26 -5.02 118.16 114.02 1ss8 n LYS 34 Ca -0.02 -3.09 -0.37 0.00 -0.51 0.00 0.00 58.31 54.32 1ss8 n LYS 34 Cb 0.13 -1.95 0.07 0.00 -0.51 0.00 0.00 35.03 32.77 1ss8 n LYS 34 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ss8 n GLY 35 N -0.95 0.40 3.95 0.72 0.00 -0.57 -4.51 105.19 104.23 1ss8 n GLY 35 Ca 0.39 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 1ss8 n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ss8 s ARG 36 N -3.39 3.40 0.44 1.61 1.81 0.78 -4.92 118.95 118.68 1ss8 s ARG 36 Ca 0.81 -0.71 -0.23 0.00 -1.72 0.00 0.00 55.73 53.88 1ss8 s ARG 36 Cb -0.37 -2.90 -0.08 0.00 -0.45 0.00 0.00 34.95 31.15 1ss8 s ARG 36 CO 0.42 0.47 1.10 -0.80 -0.68 0.00 0.00 175.30 175.81 1ss8 s ASN 37 N -3.65 6.41 -0.07 0.23 0.01 -1.26 -3.99 114.94 112.62 1ss8 s ASN 37 Ca 0.34 2.15 0.04 0.00 -0.71 0.00 0.00 52.86 54.68 1ss8 s ASN 37 Cb -0.10 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 38.96 1ss8 s ASN 37 CO 0.28 -0.74 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.24 1ss8 s VAL 38 N -1.65 2.42 -0.26 1.60 1.01 -0.06 -4.95 120.40 118.50 1ss8 s VAL 38 Ca 0.62 -0.93 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 1ss8 s VAL 38 Cb -0.24 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1ss8 s VAL 38 CO 0.30 0.57 0.36 -0.69 0.00 0.00 0.00 175.10 175.63 1ss8 s VAL 39 N -0.14 5.19 -0.19 2.92 1.01 -1.26 -1.44 120.40 126.49 1ss8 s VAL 39 Ca -0.03 0.56 -0.04 0.00 0.00 0.00 0.00 61.98 62.47 1ss8 s VAL 39 Cb -0.14 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1ss8 s VAL 39 CO 0.04 0.17 -0.04 -0.76 0.00 0.00 0.00 175.10 174.52 1ss8 s LEU 40 N 1.96 3.07 0.68 3.92 1.43 -0.48 -4.96 118.68 124.31 1ss8 s LEU 40 Ca 0.15 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.87 1ss8 s LEU 40 Cb -0.16 -1.76 -0.00 0.00 0.03 0.00 0.00 46.19 44.30 1ss8 s LEU 40 CO 0.10 0.07 1.06 -0.62 0.23 0.00 0.00 176.35 177.18 1ss8 s ASP 41 N 0.95 5.50 0.02 2.29 -1.08 -1.26 -0.94 116.67 122.15 1ss8 s ASP 41 Ca 0.00 1.63 0.00 0.00 -0.52 0.00 0.00 52.55 53.66 1ss8 s ASP 41 Cb -0.15 -2.50 -0.02 0.00 -1.46 0.00 0.00 42.92 38.80 1ss8 s ASP 41 CO 0.01 -1.36 -0.03 -0.54 0.52 0.00 0.00 175.17 173.77 1ss8 s LYS 42 N -4.92 0.28 0.40 4.34 -0.14 -1.26 -4.85 119.74 113.60 1ss8 s LYS 42 Ca 0.59 -0.52 0.21 0.00 -1.36 0.00 0.00 55.97 54.89 1ss8 s LYS 42 Cb -0.14 0.05 0.28 0.00 -1.68 0.00 0.00 37.83 36.34 1ss8 s LYS 42 CO 0.52 -0.03 1.57 0.77 -0.76 0.00 0.00 175.35 177.42 1ss8 h SER 43 N 4.90 0.00 -0.88 2.83 0.02 -1.98 -3.38 113.55 115.07 1ss8 h SER 43 Ca -0.31 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.66 1ss8 h SER 43 Cb 1.21 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.70 1ss8 h SER 43 CO 0.43 0.10 0.58 0.15 -1.14 0.00 0.00 176.83 176.94 1ss8 h PHE 44 N 0.00 1.09 0.00 3.45 3.57 -2.03 -3.48 116.94 119.54 1ss8 h PHE 44 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1ss8 h PHE 44 Cb 1.07 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.45 1ss8 h PHE 44 CO 0.00 0.67 0.00 0.41 -2.23 0.00 0.00 178.31 177.16 1ss8 n GLY 45 N -1.40 -0.68 3.83 2.40 0.00 -1.26 -5.13 105.19 102.95 1ss8 n GLY 45 Ca 0.11 0.61 -0.36 0.00 0.00 0.00 0.00 46.02 46.37 1ss8 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss8 s ALA 46 N -1.00 3.51 0.94 4.61 0.00 -1.26 -4.76 121.76 123.80 1ss8 s ALA 46 Ca 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 1ss8 s ALA 46 Cb 0.00 -2.66 0.16 0.00 0.00 0.00 0.00 23.12 20.62 1ss8 s ALA 46 CO 0.00 0.40 1.11 -1.25 0.00 0.00 0.00 175.76 176.01 1ss8 s PRO 47 N -1.91 0.82 -0.07 0.00 0.04 -1.26 -4.77 135.00 127.85 1ss8 s PRO 47 Ca 0.39 1.24 -0.03 0.00 0.04 0.00 0.00 61.00 62.64 1ss8 s PRO 47 Cb -0.16 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1ss8 s PRO 47 CO 0.20 -2.66 0.07 0.95 0.04 0.00 0.00 177.00 175.60 1ss8 s THR 48 N -2.69 4.83 -0.21 1.26 -4.23 -0.11 -4.93 115.64 109.55 1ss8 s THR 48 Ca 0.66 -0.14 -0.04 0.00 -1.18 0.00 0.00 61.69 60.99 1ss8 s THR 48 Cb -0.22 -3.11 -0.01 0.00 1.34 0.00 0.00 72.50 70.51 1ss8 s THR 48 CO 0.59 0.54 -0.04 -0.63 -0.54 0.00 0.00 174.62 174.54 1ss8 s ILE 49 N -1.02 3.45 0.03 2.99 1.01 -1.26 -1.38 121.20 125.02 1ss8 s ILE 49 Ca 0.17 -0.47 -0.00 0.00 0.00 0.00 0.00 60.65 60.34 1ss8 s ILE 49 Cb -0.12 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 1ss8 s ILE 49 CO 0.06 0.43 -0.03 0.28 0.00 0.00 0.00 174.94 175.68 1ss8 s THR 50 N 1.37 0.15 -0.71 2.92 -1.32 -0.52 -4.96 115.64 112.57 1ss8 s THR 50 Ca 0.04 -1.19 0.08 0.00 -1.21 0.00 0.00 61.69 59.41 1ss8 s THR 50 Cb -0.14 -0.66 0.20 0.00 -1.51 0.00 0.00 72.50 70.39 1ss8 s THR 50 CO -0.02 -0.65 1.13 0.29 -2.21 0.00 0.00 174.62 173.16 1ss8 n LYS 51 N 1.14 2.57 -2.87 7.08 5.02 -1.26 -0.88 118.16 128.96 1ss8 n LYS 51 Ca -0.21 -1.79 -0.43 0.00 -2.02 0.00 0.00 58.31 53.86 1ss8 n LYS 51 Cb 0.57 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 34.35 1ss8 n LYS 51 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ss8 s ASP 52 N -0.96 6.27 0.50 4.39 -1.08 -1.26 -4.80 116.67 119.72 1ss8 s ASP 52 Ca 0.16 -0.62 0.25 0.00 -0.52 0.00 0.00 52.55 51.81 1ss8 s ASP 52 Cb 0.08 -2.42 1.32 0.00 -1.46 0.00 0.00 42.92 40.45 1ss8 s ASP 52 CO 0.11 -1.28 2.03 1.23 0.52 0.00 0.00 175.17 177.79 1ss8 h GLY 53 N 11.01 0.00 0.97 2.66 0.00 -1.93 -1.63 103.07 114.15 1ss8 h GLY 53 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1ss8 h GLY 53 CO 1.11 0.00 0.08 -2.08 0.00 0.00 0.00 176.54 175.65 1ss8 h VAL 54 N 0.00 1.06 -0.72 4.60 2.07 -1.95 -1.84 116.25 119.47 1ss8 h VAL 54 Ca -0.00 -0.16 0.08 0.00 0.82 0.00 0.00 66.70 67.44 1ss8 h VAL 54 Cb 0.37 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 1ss8 h VAL 54 CO 0.02 0.06 0.38 0.28 0.02 0.00 0.00 177.57 178.33 1ss8 h SER 55 N 0.15 0.53 0.23 0.57 0.02 -1.74 -2.27 113.55 111.04 1ss8 h SER 55 Ca 0.05 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1ss8 h SER 55 Cb 0.02 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1ss8 h SER 55 CO -0.01 0.32 -0.11 0.58 -1.14 0.00 0.00 176.83 176.47 1ss8 h VAL 56 N 0.67 0.83 -0.89 2.27 2.07 -1.21 -2.79 116.25 117.20 1ss8 h VAL 56 Ca 0.34 -0.36 0.24 0.00 0.82 0.00 0.00 66.70 67.75 1ss8 h VAL 56 Cb 0.31 1.04 -0.15 0.00 -1.52 0.00 0.00 31.29 30.97 1ss8 h VAL 56 CO -0.24 0.08 0.16 0.00 0.02 0.00 0.00 177.57 177.60 1ss8 h ALA 57 N 0.24 1.21 0.00 1.67 0.00 -1.17 -0.46 119.26 120.76 1ss8 h ALA 57 Ca -0.03 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1ss8 h ALA 57 Cb 0.37 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ss8 h ALA 57 CO 0.05 -0.51 -0.10 -0.09 0.00 0.00 0.00 179.25 178.60 1ss8 h ARG 58 N 0.14 0.00 0.00 0.00 2.43 -1.13 0.14 114.38 115.96 1ss8 h ARG 58 Ca 0.55 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.72 1ss8 h ARG 58 Cb 1.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1ss8 h ARG 58 CO -0.73 0.10 -0.45 0.39 -1.51 0.00 0.00 179.97 177.77 1ss8 n GLU 59 N -3.65 0.24 -2.56 0.20 -0.58 -0.19 -4.88 120.64 109.21 1ss8 n GLU 59 Ca -0.02 0.10 -0.43 0.00 -0.42 0.00 0.00 57.16 56.39 1ss8 n GLU 59 Cb 0.22 -1.68 -0.02 0.00 -0.57 0.00 0.00 31.44 29.39 1ss8 n GLU 59 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1ss8 s ILE 60 N -3.13 4.44 -0.02 -3.67 -1.09 0.48 -4.99 121.20 113.23 1ss8 s ILE 60 Ca 0.08 1.70 -0.00 0.00 -2.23 0.00 0.00 60.65 60.20 1ss8 s ILE 60 Cb 0.14 -4.25 0.02 0.00 -1.58 0.00 0.00 42.46 36.79 1ss8 s ILE 60 CO 0.68 -0.32 0.03 -0.70 -1.23 0.00 0.00 174.94 173.41 1ss8 s GLU 61 N 3.58 -0.00 0.10 2.79 2.12 -1.26 -4.91 118.70 121.11 1ss8 s GLU 61 Ca 0.49 0.12 0.05 0.00 0.36 0.00 0.00 54.97 55.99 1ss8 s GLU 61 Cb -0.16 -0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.08 1ss8 s GLU 61 CO 0.14 -0.08 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.24 1ss8 s LEU 62 N 0.54 3.37 0.00 2.70 1.43 -1.26 -5.05 118.68 120.41 1ss8 s LEU 62 Ca -0.04 -0.24 -0.24 0.00 -1.03 0.00 0.00 54.13 52.58 1ss8 s LEU 62 Cb -0.06 -2.11 -0.18 0.00 0.03 0.00 0.00 46.19 43.87 1ss8 s LEU 62 CO -0.02 0.17 1.29 -0.08 0.23 0.00 0.00 176.35 177.94 1ss8 h GLU 63 N 3.42 0.15 -6.46 1.70 4.81 -2.01 -3.42 114.58 112.78 1ss8 h GLU 63 Ca -0.48 -0.08 -0.53 0.00 -0.13 0.00 0.00 59.36 58.13 1ss8 h GLU 63 Cb 1.17 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.57 1ss8 h GLU 63 CO 0.58 0.61 0.93 0.34 -0.73 0.00 0.00 179.01 180.74 1ss8 s ASP 64 N -5.90 6.67 0.36 1.04 -1.08 -1.26 -4.91 116.67 111.59 1ss8 s ASP 64 Ca -0.15 2.41 0.06 0.00 -0.52 0.00 0.00 52.55 54.35 1ss8 s ASP 64 Cb 0.03 -2.57 0.74 0.00 -1.46 0.00 0.00 42.92 39.67 1ss8 s ASP 64 CO 0.71 -0.83 1.94 0.11 0.52 0.00 0.00 175.17 177.62 1ss8 h LYS 65 N 7.93 0.74 -0.10 4.34 1.79 -1.95 -0.68 116.57 128.64 1ss8 h LYS 65 Ca -0.42 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 57.98 1ss8 h LYS 65 Cb 1.20 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1ss8 h LYS 65 CO 0.92 0.49 -0.06 0.74 -1.08 0.00 0.00 179.45 180.45 1ss8 h PHE 66 N 0.76 0.25 -0.22 -1.35 0.04 -1.93 -1.76 116.94 112.73 1ss8 h PHE 66 Ca 0.34 -0.07 0.04 0.00 2.80 0.00 0.00 57.97 61.09 1ss8 h PHE 66 Cb 0.34 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.39 1ss8 h PHE 66 CO -0.00 0.59 -0.06 0.93 -0.60 0.00 0.00 178.31 179.17 1ss8 h GLU 67 N -0.16 -0.00 -0.48 1.51 5.08 -1.59 -0.38 114.58 118.57 1ss8 h GLU 67 Ca 0.02 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1ss8 h GLU 67 Cb 0.53 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1ss8 h GLU 67 CO 0.02 -0.00 0.33 -0.97 -1.00 0.00 0.00 179.01 177.38 1ss8 h ASN 68 N -0.00 0.22 -0.50 1.42 -0.73 -1.09 0.40 115.58 115.30 1ss8 h ASN 68 Ca 0.11 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 58.21 1ss8 h ASN 68 Cb 0.17 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 38.70 1ss8 h ASN 68 CO -0.23 0.14 0.04 0.24 -0.37 0.00 0.00 177.43 177.24 1ss8 h MET 69 N 0.25 0.85 0.11 6.67 2.86 -0.14 -0.57 114.93 124.96 1ss8 h MET 69 Ca 0.22 -0.25 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1ss8 h MET 69 Cb 0.55 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 1ss8 h MET 69 CO -0.04 0.87 -0.19 0.78 1.06 0.00 0.00 176.91 179.39 1ss8 h GLY 70 N 0.72 -0.35 0.60 8.32 0.00 -0.49 -1.10 103.07 110.77 1ss8 h GLY 70 Ca 0.15 0.22 0.06 0.00 0.00 0.00 0.00 47.33 47.75 1ss8 h GLY 70 CO 0.02 -0.18 0.20 0.00 0.00 0.00 0.00 176.54 176.57 1ss8 h ALA 71 N 0.45 0.60 -0.27 3.60 0.00 -1.12 -2.35 119.26 120.17 1ss8 h ALA 71 Ca 0.02 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 71 Cb 0.38 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ss8 h ALA 71 CO -0.10 -0.19 -0.11 1.96 0.00 0.00 0.00 179.25 180.82 1ss8 h GLN 72 N 0.39 0.44 -0.00 0.00 1.08 -0.86 -1.20 115.11 114.95 1ss8 h GLN 72 Ca 0.23 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1ss8 h GLN 72 Cb 0.21 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1ss8 h GLN 72 CO -0.21 0.55 0.00 0.52 -0.95 0.00 0.00 178.83 178.75 1ss8 h MET 73 N 0.41 0.01 -0.65 1.46 2.86 -0.74 -0.22 114.93 118.06 1ss8 h MET 73 Ca 0.08 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 1ss8 h MET 73 Cb 0.44 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1ss8 h MET 73 CO 0.02 0.02 0.18 0.28 1.06 0.00 0.00 176.91 178.47 1ss8 h VAL 74 N -0.01 1.25 -0.91 -2.22 2.07 -1.23 -2.72 116.25 112.49 1ss8 h VAL 74 Ca 0.00 -0.90 0.02 0.00 0.82 0.00 0.00 66.70 66.65 1ss8 h VAL 74 Cb 0.01 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 1ss8 h VAL 74 CO -0.00 0.34 0.60 0.11 0.02 0.00 0.00 177.57 178.64 1ss8 h LYS 75 N 0.94 1.14 -0.40 1.57 1.57 -0.89 -0.39 116.57 120.12 1ss8 h LYS 75 Ca 0.21 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 1ss8 h LYS 75 Cb 0.33 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1ss8 h LYS 75 CO -0.00 0.76 -0.12 1.49 -0.57 0.00 0.00 179.45 181.01 1ss8 h GLU 76 N 1.18 0.78 0.22 3.15 4.81 -0.77 -2.47 114.58 121.48 1ss8 h GLU 76 Ca 0.35 -0.31 -0.32 0.00 -0.13 0.00 0.00 59.36 58.94 1ss8 h GLU 76 Cb -0.06 -0.04 0.03 0.00 0.63 0.00 0.00 28.75 29.31 1ss8 h GLU 76 CO -0.09 0.93 -1.49 0.28 -0.73 0.00 0.00 179.01 177.91 1ss8 h VAL 77 N 0.59 1.19 -0.75 0.32 2.07 -1.12 -3.09 116.25 115.46 1ss8 h VAL 77 Ca 0.10 -2.61 0.03 0.00 0.82 0.00 0.00 66.70 65.04 1ss8 h VAL 77 Cb 0.65 2.97 -0.04 0.00 -1.52 0.00 0.00 31.29 33.35 1ss8 h VAL 77 CO 0.04 0.81 0.50 0.00 0.02 0.00 0.00 177.57 178.94 1ss8 h ALA 78 N 0.12 1.55 0.00 1.67 0.00 -1.13 0.20 119.26 121.67 1ss8 h ALA 78 Ca -0.27 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ss8 h ALA 78 Cb 2.08 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1ss8 h ALA 78 CO 0.23 0.38 0.00 -1.13 0.00 0.00 0.00 179.25 178.73 1ss8 n SER 79 N -4.45 0.15 0.20 0.00 3.41 -0.93 -0.99 113.62 111.01 1ss8 n SER 79 Ca 0.09 0.53 0.05 0.00 -0.26 0.00 0.00 58.87 59.28 1ss8 n SER 79 Cb 0.11 -0.56 0.41 0.00 -0.26 0.00 0.00 64.21 63.90 1ss8 n SER 79 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ss8 h LYS 80 N 0.00 0.00 0.77 4.33 1.57 -0.54 -2.54 116.57 120.15 1ss8 h LYS 80 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1ss8 h LYS 80 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1ss8 h LYS 80 CO 0.00 0.34 -0.49 0.00 -0.57 0.00 0.00 179.45 178.73 1ss8 h ALA 81 N 1.66 -1.27 -0.89 3.86 0.00 -1.15 0.10 119.26 121.57 1ss8 h ALA 81 Ca -0.00 -0.25 0.23 0.00 0.00 0.00 0.00 54.91 54.89 1ss8 h ALA 81 Cb 0.69 0.62 -0.13 0.00 0.00 0.00 0.00 17.79 18.97 1ss8 h ALA 81 CO 0.04 -1.23 0.37 -0.91 0.00 0.00 0.00 179.25 177.52 1ss8 h ASN 82 N -1.19 0.27 0.38 0.00 4.21 -1.52 0.14 115.58 117.87 1ss8 h ASN 82 Ca -0.10 0.16 -0.02 0.00 1.21 0.00 0.00 56.30 57.55 1ss8 h ASN 82 Cb 0.96 0.16 0.00 0.00 -1.12 0.00 0.00 38.32 38.32 1ss8 h ASN 82 CO 0.09 -0.04 -0.18 0.44 -1.29 0.00 0.00 177.43 176.45 1ss8 h ASP 83 N 0.36 -0.43 -0.93 5.81 3.32 -1.04 0.15 116.42 123.67 1ss8 h ASP 83 Ca 0.56 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.59 1ss8 h ASP 83 Cb 1.09 0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.70 1ss8 h ASP 83 CO -0.55 -0.24 0.62 0.00 -1.72 0.00 0.00 179.24 177.34 1ss8 h ALA 84 N 0.02 1.34 0.00 3.45 0.00 0.20 -3.37 119.26 120.90 1ss8 h ALA 84 Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ss8 h ALA 84 Cb 0.43 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ss8 h ALA 84 CO 0.08 0.61 -0.07 0.00 0.00 0.00 0.00 179.25 179.87 1ss8 n ALA 85 N -2.39 1.43 -0.66 0.00 0.00 0.39 -4.99 120.51 114.28 1ss8 n ALA 85 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1ss8 n ALA 85 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1ss8 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 86 N 0.82 0.74 3.83 0.00 0.00 0.54 -4.82 105.19 106.30 1ss8 n GLY 86 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1ss8 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss8 s ASP 87 N -2.43 -0.05 0.00 1.61 2.15 -1.25 -4.94 116.67 111.76 1ss8 s ASP 87 Ca 0.00 -0.57 0.00 0.00 0.43 0.00 0.00 52.55 52.41 1ss8 s ASP 87 Cb 0.00 0.48 0.00 0.00 -0.30 0.00 0.00 42.92 43.10 1ss8 s ASP 87 CO 0.00 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 174.68 1ss8 n GLY 88 N -0.62 1.20 0.06 2.66 0.00 -1.26 -2.65 105.19 104.57 1ss8 n GLY 88 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 1ss8 n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ss8 h THR 89 N 0.00 1.23 -0.77 2.61 2.02 -1.91 0.16 112.91 116.25 1ss8 h THR 89 Ca 0.00 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.46 1ss8 h THR 89 Cb 0.00 1.67 -0.04 0.00 -1.74 0.00 0.00 68.15 68.04 1ss8 h THR 89 CO 0.00 0.18 0.38 0.74 0.37 0.00 0.00 175.52 177.19 1ss8 h THR 90 N -0.26 1.24 -0.21 3.16 2.02 -1.91 -1.09 112.91 115.87 1ss8 h THR 90 Ca 0.00 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.52 1ss8 h THR 90 Cb 0.30 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1ss8 h THR 90 CO 0.00 0.28 0.11 0.74 0.37 0.00 0.00 175.52 177.03 1ss8 h THR 91 N 1.09 1.11 -1.00 3.16 2.02 -1.90 -0.09 112.91 117.31 1ss8 h THR 91 Ca 0.27 -0.31 0.21 0.00 0.77 0.00 0.00 66.41 67.34 1ss8 h THR 91 Cb 0.09 0.94 -0.10 0.00 -1.74 0.00 0.00 68.15 67.34 1ss8 h THR 91 CO -0.04 0.11 0.61 0.00 0.37 0.00 0.00 175.52 176.58 1ss8 h ALA 92 N 1.00 1.80 -0.44 6.16 0.00 -0.37 0.22 119.26 127.62 1ss8 h ALA 92 Ca 0.07 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 92 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ss8 h ALA 92 CO -0.01 -0.18 -0.20 1.15 0.00 0.00 0.00 179.25 180.01 1ss8 h THR 93 N 0.67 1.27 -0.34 0.00 2.02 0.18 0.31 112.91 117.03 1ss8 h THR 93 Ca 0.58 -1.35 -0.10 0.00 0.77 0.00 0.00 66.41 66.31 1ss8 h THR 93 Cb 1.02 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.63 1ss8 h THR 93 CO -0.36 0.46 -0.18 0.58 0.37 0.00 0.00 175.52 176.39 1ss8 h VAL 94 N 0.74 1.29 0.03 3.16 2.07 -0.09 -1.16 116.25 122.29 1ss8 h VAL 94 Ca 0.10 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.34 1ss8 h VAL 94 Cb 0.77 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.92 1ss8 h VAL 94 CO 0.06 0.42 -0.14 -0.07 0.02 0.00 0.00 177.57 177.86 1ss8 h LEU 95 N 0.49 -0.41 -0.64 2.57 3.38 -0.30 -2.49 115.31 117.91 1ss8 h LEU 95 Ca 0.07 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.19 1ss8 h LEU 95 Cb 0.72 0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.57 1ss8 h LEU 95 CO 0.05 -0.20 0.26 0.00 0.09 0.00 0.00 178.44 178.64 1ss8 h ALA 96 N 0.67 0.85 -0.13 1.53 0.00 -0.26 0.29 119.26 122.21 1ss8 h ALA 96 Ca 0.04 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 96 Cb 0.30 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1ss8 h ALA 96 CO -0.12 -0.15 0.09 0.37 0.00 0.00 0.00 179.25 179.44 1ss8 h GLN 97 N 0.46 0.10 0.17 0.00 4.15 -0.83 0.13 115.11 119.28 1ss8 h GLN 97 Ca 0.32 -0.01 -0.31 0.00 0.77 0.00 0.00 58.65 59.43 1ss8 h GLN 97 Cb 0.39 -0.02 0.01 0.00 0.21 0.00 0.00 27.48 28.06 1ss8 h GLN 97 CO -0.30 0.07 -1.44 0.00 -1.93 0.00 0.00 178.83 175.23 1ss8 h ALA 98 N 1.92 0.07 -0.00 3.38 0.00 -0.06 -0.15 119.26 124.42 1ss8 h ALA 98 Ca 0.06 -0.96 -0.18 0.00 0.00 0.00 0.00 54.91 53.83 1ss8 h ALA 98 Cb 0.09 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ss8 h ALA 98 CO -0.01 0.94 -0.69 0.82 0.00 0.00 0.00 179.25 180.32 1ss8 h ILE 99 N 0.10 1.40 0.02 0.00 2.04 -0.60 -2.59 117.51 117.87 1ss8 h ILE 99 Ca -0.22 -2.11 -0.00 0.00 1.00 0.00 0.00 64.86 63.53 1ss8 h ILE 99 Cb 2.06 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 40.69 1ss8 h ILE 99 CO 0.21 0.62 -0.01 0.40 0.00 0.00 0.00 178.15 179.37 1ss8 h ILE 100 N -0.00 1.05 -0.44 -0.67 2.04 -1.02 0.64 117.51 119.11 1ss8 h ILE 100 Ca -0.09 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.63 1ss8 h ILE 100 Cb 1.39 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.60 1ss8 h ILE 100 CO 0.14 0.06 0.03 0.74 0.00 0.00 0.00 178.15 179.11 1ss8 h THR 101 N -0.12 0.70 0.00 -0.27 2.02 -0.98 0.19 112.91 114.45 1ss8 h THR 101 Ca -0.00 -0.05 -0.16 0.00 0.77 0.00 0.00 66.41 66.97 1ss8 h THR 101 Cb 0.11 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1ss8 h THR 101 CO 0.00 0.03 -0.86 -0.33 0.37 0.00 0.00 175.52 174.73 1ss8 h GLU 102 N 0.15 0.00 0.17 6.66 4.39 -0.98 -2.82 114.58 122.14 1ss8 h GLU 102 Ca 0.22 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.91 1ss8 h GLU 102 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1ss8 h GLU 102 CO -0.33 0.65 -0.08 0.78 -1.16 0.00 0.00 179.01 178.87 1ss8 h GLY 103 N 3.35 -0.24 2.00 -3.84 0.00 0.66 -1.84 103.07 103.16 1ss8 h GLY 103 Ca -0.04 0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.32 1ss8 h GLY 103 CO 0.09 -0.09 -0.27 1.41 0.00 0.00 0.00 176.54 177.68 1ss8 h LEU 104 N -0.26 0.00 -0.75 3.11 3.38 -0.65 -0.71 115.31 119.42 1ss8 h LEU 104 Ca -0.02 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1ss8 h LEU 104 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1ss8 h LEU 104 CO 0.04 0.27 0.49 0.50 0.09 0.00 0.00 178.44 179.83 1ss8 h LYS 105 N 0.00 0.97 0.00 1.13 3.64 -1.30 -0.58 116.57 120.43 1ss8 h LYS 105 Ca -0.00 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.21 1ss8 h LYS 105 Cb 0.52 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1ss8 h LYS 105 CO 0.03 0.64 -0.51 0.00 -2.27 0.00 0.00 179.45 177.35 1ss8 h ALA 106 N 1.29 1.00 -0.24 5.00 0.00 -0.36 -1.76 119.26 124.19 1ss8 h ALA 106 Ca 0.28 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1ss8 h ALA 106 Cb -0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ss8 h ALA 106 CO -0.07 0.64 -0.09 0.28 0.00 0.00 0.00 179.25 180.01 1ss8 h VAL 107 N 0.00 1.29 0.00 0.00 2.07 -0.53 -1.58 116.25 117.50 1ss8 h VAL 107 Ca -0.01 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 1ss8 h VAL 107 Cb 1.00 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1ss8 h VAL 107 CO 0.07 0.35 -0.02 0.00 0.02 0.00 0.00 177.57 177.98 1ss8 h ALA 108 N 0.73 1.16 -0.03 1.67 0.00 -0.80 0.19 119.26 122.18 1ss8 h ALA 108 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 108 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ss8 h ALA 108 CO 0.03 0.03 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1ss8 n ALA 109 N -2.17 2.61 -0.37 0.00 0.00 -0.69 -4.91 120.51 114.97 1ss8 n ALA 109 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1ss8 n ALA 109 Cb 0.14 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1ss8 n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 110 N 1.05 0.81 3.86 0.00 0.00 0.67 -5.07 105.19 106.51 1ss8 n GLY 110 Ca 0.19 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1ss8 n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ss8 s MET 111 N -0.64 3.87 -0.07 1.61 -1.94 -0.62 -4.96 119.30 116.55 1ss8 s MET 111 Ca 0.00 0.69 -0.30 0.00 -1.71 0.00 0.00 55.69 54.38 1ss8 s MET 111 Cb 0.00 -2.28 -0.05 0.00 2.01 0.00 0.00 34.83 34.51 1ss8 s MET 111 CO 0.00 -0.12 1.63 1.21 -0.01 0.00 0.00 175.02 177.73 1ss8 s ASN 112 N -3.05 6.66 0.30 3.03 3.84 -1.26 -4.57 114.94 119.89 1ss8 s ASN 112 Ca 0.55 2.16 0.02 0.00 0.21 0.00 0.00 52.86 55.80 1ss8 s ASN 112 Cb -0.10 -2.53 0.56 0.00 -0.55 0.00 0.00 41.25 38.62 1ss8 s ASN 112 CO 0.30 -0.94 1.88 -0.65 -2.79 0.00 0.00 177.10 174.91 1ss8 h PRO 113 N 9.55 0.97 -0.43 0.43 0.11 -1.93 -0.75 132.00 139.95 1ss8 h PRO 113 Ca -0.38 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.58 1ss8 h PRO 113 Cb 1.17 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1ss8 h PRO 113 CO 0.96 0.64 -0.10 0.52 -0.21 0.00 0.00 178.00 179.81 1ss8 h MET 114 N 1.00 0.82 -0.21 1.05 2.86 -1.90 -0.87 114.93 117.67 1ss8 h MET 114 Ca 0.43 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1ss8 h MET 114 Cb 0.34 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1ss8 h MET 114 CO -0.19 0.93 0.06 -0.44 1.06 0.00 0.00 176.91 178.33 1ss8 h ASP 115 N 0.64 0.31 -0.76 1.22 3.32 -1.73 -0.12 116.42 119.30 1ss8 h ASP 115 Ca 0.11 -0.21 0.17 0.00 0.02 0.00 0.00 57.03 57.11 1ss8 h ASP 115 Cb 0.63 -0.08 -0.11 0.00 0.22 0.00 0.00 39.33 39.98 1ss8 h ASP 115 CO 0.04 0.44 0.21 -0.07 -1.72 0.00 0.00 179.24 178.14 1ss8 h LEU 116 N 0.16 0.06 -0.55 1.55 4.07 -0.96 -1.87 115.31 117.77 1ss8 h LEU 116 Ca 0.07 0.15 -0.13 0.00 0.08 0.00 0.00 57.88 58.04 1ss8 h LEU 116 Cb 0.25 0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 1ss8 h LEU 116 CO -0.00 -0.03 -0.21 0.50 -1.08 0.00 0.00 178.44 177.62 1ss8 h LYS 117 N 0.29 0.95 -0.82 1.13 3.64 -0.40 -1.51 116.57 119.85 1ss8 h LYS 117 Ca 0.43 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1ss8 h LYS 117 Cb 0.74 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.49 1ss8 h LYS 117 CO -0.51 1.06 0.50 -0.09 -2.27 0.00 0.00 179.45 178.15 1ss8 h ARG 118 N 0.82 1.10 -0.08 1.90 2.43 -0.28 -0.99 114.38 119.27 1ss8 h ARG 118 Ca 0.11 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1ss8 h ARG 118 Cb 0.77 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1ss8 h ARG 118 CO 0.06 0.76 0.03 0.78 -1.51 0.00 0.00 179.97 180.10 1ss8 h GLY 119 N 1.14 0.14 0.89 2.80 0.00 -1.18 -0.28 103.07 106.58 1ss8 h GLY 119 Ca 0.30 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.57 1ss8 h GLY 119 CO -0.06 0.07 0.37 -2.22 0.00 0.00 0.00 176.54 174.70 1ss8 h ILE 120 N -0.03 1.08 -0.36 2.60 2.04 -0.88 -1.13 117.51 120.83 1ss8 h ILE 120 Ca 0.03 -0.25 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 1ss8 h ILE 120 Cb 0.17 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 1ss8 h ILE 120 CO -0.00 0.13 -0.12 0.44 0.00 0.00 0.00 178.15 178.61 1ss8 h ASP 121 N 0.73 0.61 -0.17 1.72 3.32 -0.91 -0.29 116.42 121.43 1ss8 h ASP 121 Ca 0.24 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 1ss8 h ASP 121 Cb 0.01 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1ss8 h ASP 121 CO -0.10 0.76 -0.20 0.50 -1.72 0.00 0.00 179.24 178.49 1ss8 h LYS 122 N 0.57 0.43 -0.74 3.56 3.64 -0.76 0.12 116.57 123.40 1ss8 h LYS 122 Ca 0.10 -0.24 0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1ss8 h LYS 122 Cb 0.54 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 1ss8 h LYS 122 CO 0.03 0.82 0.46 0.00 -2.27 0.00 0.00 179.45 178.49 1ss8 h ALA 123 N 0.61 0.97 -0.42 5.00 0.00 -0.96 -1.88 119.26 122.58 1ss8 h ALA 123 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ss8 h ALA 123 Cb 0.75 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1ss8 h ALA 123 CO 0.05 0.25 0.27 0.28 0.00 0.00 0.00 179.25 180.10 1ss8 h VAL 124 N 0.91 1.12 -0.09 0.00 2.07 -0.86 -0.44 116.25 118.95 1ss8 h VAL 124 Ca 0.30 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.59 1ss8 h VAL 124 Cb 0.02 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1ss8 h VAL 124 CO -0.11 0.12 -0.07 0.74 0.02 0.00 0.00 177.57 178.27 1ss8 h THR 125 N 0.56 0.79 -0.70 2.57 2.02 -0.12 -0.22 112.91 117.82 1ss8 h THR 125 Ca 0.15 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.32 1ss8 h THR 125 Cb -0.03 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 1ss8 h THR 125 CO -0.03 0.00 0.38 0.58 0.37 0.00 0.00 175.52 176.81 1ss8 h VAL 126 N -0.08 1.22 -0.25 3.16 2.07 -1.30 -1.88 116.25 119.19 1ss8 h VAL 126 Ca 0.06 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 1ss8 h VAL 126 Cb 0.17 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 1ss8 h VAL 126 CO -0.14 0.24 -0.07 0.00 0.02 0.00 0.00 177.57 177.62 1ss8 h ALA 127 N 1.19 1.43 -0.22 1.67 0.00 -0.58 0.19 119.26 122.94 1ss8 h ALA 127 Ca 0.24 -0.20 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1ss8 h ALA 127 Cb 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1ss8 h ALA 127 CO -0.04 0.40 -0.61 0.28 0.00 0.00 0.00 179.25 179.28 1ss8 h VAL 128 N 0.37 1.29 -0.78 0.00 2.07 -0.49 0.25 116.25 118.96 1ss8 h VAL 128 Ca 0.08 -1.82 0.06 0.00 0.82 0.00 0.00 66.70 65.83 1ss8 h VAL 128 Cb 0.36 1.77 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 1ss8 h VAL 128 CO 0.02 0.58 0.51 -0.33 0.02 0.00 0.00 177.57 178.37 1ss8 h GLU 129 N 0.56 0.85 -0.23 1.57 5.08 -0.51 -2.19 114.58 119.70 1ss8 h GLU 129 Ca -0.00 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 1ss8 h GLU 129 Cb 1.20 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1ss8 h GLU 129 CO 0.13 0.56 -0.45 0.93 -1.00 0.00 0.00 179.01 179.17 1ss8 h GLU 130 N 0.87 0.59 -0.97 2.33 4.39 0.44 -2.50 114.58 119.74 1ss8 h GLU 130 Ca 0.33 -0.33 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1ss8 h GLU 130 Cb 0.18 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.80 1ss8 h GLU 130 CO -0.11 0.93 0.64 -0.07 -1.16 0.00 0.00 179.01 179.24 1ss8 h LEU 131 N 0.48 1.11 -0.89 1.33 3.38 0.02 -0.91 115.31 119.82 1ss8 h LEU 131 Ca 0.03 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1ss8 h LEU 131 Cb 0.98 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1ss8 h LEU 131 CO 0.09 0.80 -0.10 0.50 0.09 0.00 0.00 178.44 179.82 1ss8 h LYS 132 N 1.31 0.71 0.00 1.13 3.64 -1.20 -2.39 116.57 119.77 1ss8 h LYS 132 Ca 0.36 -0.22 -0.16 0.00 -1.27 0.00 0.00 60.65 59.35 1ss8 h LYS 132 Cb -0.14 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 1ss8 h LYS 132 CO -0.08 0.79 -0.78 0.00 -2.27 0.00 0.00 179.45 177.11 1ss8 h ALA 133 N 1.24 0.57 0.00 5.00 0.00 -0.92 -3.02 119.26 122.12 1ss8 h ALA 133 Ca 0.11 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1ss8 h ALA 133 Cb 0.55 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ss8 h ALA 133 CO 0.03 0.98 0.00 1.25 0.00 0.00 0.00 179.25 181.51 1ss8 h LEU 134 N 0.00 0.00 -9.92 0.00 5.85 -0.84 -3.47 115.31 106.93 1ss8 h LEU 134 Ca -0.01 0.00 -0.48 0.00 0.84 0.00 0.00 57.88 58.23 1ss8 h LEU 134 Cb 1.51 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.55 1ss8 h LEU 134 CO 0.10 0.00 0.40 -0.55 -0.34 0.00 0.00 178.44 178.05 1ss8 s SER 135 N -5.29 6.97 -0.16 1.25 0.15 -0.93 -4.89 113.70 110.81 1ss8 s SER 135 Ca 0.06 2.01 -0.05 0.00 0.70 0.00 0.00 55.95 58.67 1ss8 s SER 135 Cb 0.09 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.77 1ss8 s SER 135 CO 0.57 -0.34 0.02 -0.69 1.20 0.00 0.00 173.24 174.00 1ss8 s VAL 136 N -1.59 4.38 0.59 4.45 1.01 -0.66 -4.90 120.40 123.69 1ss8 s VAL 136 Ca 0.54 -0.19 -0.19 0.00 0.00 0.00 0.00 61.98 62.14 1ss8 s VAL 136 Cb -0.22 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 1ss8 s VAL 136 CO 0.28 0.50 1.26 -2.16 0.00 0.00 0.00 175.10 174.98 1ss8 s PRO 137 N 0.17 2.92 -0.48 2.72 0.04 -1.26 -2.04 135.00 137.07 1ss8 s PRO 137 Ca 0.02 1.97 0.03 0.00 0.04 0.00 0.00 61.00 63.06 1ss8 s PRO 137 Cb -0.13 -1.99 0.13 0.00 0.04 0.00 0.00 34.50 32.55 1ss8 s PRO 137 CO 0.02 -1.28 0.25 0.00 0.04 0.00 0.00 177.00 176.02 1ss8 n SER 139 N 3.34 0.08 -4.61 0.00 3.41 -1.26 -4.14 113.62 110.44 1ss8 n SER 139 Ca 0.06 -1.03 -0.24 0.00 -0.26 0.00 0.00 58.87 57.40 1ss8 n SER 139 Cb 0.33 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.20 1ss8 n SER 139 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1ss8 s ASP 140 N -0.03 4.13 0.30 4.04 -4.77 -1.26 -5.01 116.67 114.07 1ss8 s ASP 140 Ca 0.00 -0.97 0.03 0.00 -3.30 0.00 0.00 52.55 48.31 1ss8 s ASP 140 Cb 0.00 -0.53 0.63 0.00 -1.09 0.00 0.00 42.92 41.93 1ss8 s ASP 140 CO 0.00 -0.18 1.82 0.28 0.70 0.00 0.00 175.17 177.79 1ss8 h SER 141 N 1.88 0.86 -0.02 2.11 0.02 -1.98 -1.14 113.55 115.29 1ss8 h SER 141 Ca -0.43 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1ss8 h SER 141 Cb 1.25 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 63.68 1ss8 h SER 141 CO 0.66 0.42 0.01 0.11 -1.14 0.00 0.00 176.83 176.88 1ss8 h LYS 142 N 0.90 0.02 -0.80 3.45 6.56 -1.99 -1.67 116.57 123.04 1ss8 h LYS 142 Ca 0.52 -0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 60.10 1ss8 h LYS 142 Cb 0.63 -0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.25 1ss8 h LYS 142 CO -0.29 0.14 0.49 0.00 -2.06 0.00 0.00 179.45 177.73 1ss8 h ALA 143 N 0.88 1.37 -0.24 3.86 0.00 -1.87 -0.86 119.26 122.40 1ss8 h ALA 143 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ss8 h ALA 143 Cb 0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ss8 h ALA 143 CO -0.00 0.56 0.12 0.82 0.00 0.00 0.00 179.25 180.75 1ss8 h ILE 144 N 1.09 1.13 -0.64 0.00 2.04 -0.97 -1.53 117.51 118.63 1ss8 h ILE 144 Ca 0.29 -0.35 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1ss8 h ILE 144 Cb -0.06 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1ss8 h ILE 144 CO -0.06 0.12 0.42 0.00 0.00 0.00 0.00 178.15 178.64 1ss8 h ALA 145 N 1.00 0.82 0.04 1.87 0.00 -0.98 -0.81 119.26 121.19 1ss8 h ALA 145 Ca 0.08 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ss8 h ALA 145 Cb 0.09 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ss8 h ALA 145 CO -0.01 0.22 -0.03 1.96 0.00 0.00 0.00 179.25 181.39 1ss8 h GLN 146 N 0.85 -0.07 -0.63 0.00 4.20 -0.81 0.18 115.11 118.83 1ss8 h GLN 146 Ca 0.24 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.90 1ss8 h GLN 146 Cb -0.07 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1ss8 h GLN 146 CO -0.06 -0.04 0.19 0.28 -0.67 0.00 0.00 178.83 178.52 1ss8 h VAL 147 N -0.07 1.25 -0.84 -0.54 2.07 -1.10 -0.34 116.25 116.69 1ss8 h VAL 147 Ca -0.00 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 1ss8 h VAL 147 Cb 0.06 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 1ss8 h VAL 147 CO 0.00 0.33 0.46 1.23 0.02 0.00 0.00 177.57 179.62 1ss8 h GLY 148 N 0.91 1.25 2.00 2.17 0.00 -0.87 -0.68 103.07 107.85 1ss8 h GLY 148 Ca 0.20 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 1ss8 h GLY 148 CO -0.00 0.54 -0.61 -0.91 0.00 0.00 0.00 176.54 175.56 1ss8 h THR 149 N 1.17 1.17 -0.29 4.70 1.35 -0.58 -1.72 112.91 118.71 1ss8 h THR 149 Ca 0.30 -2.32 -0.05 0.00 -0.55 0.00 0.00 66.41 63.79 1ss8 h THR 149 Cb 0.03 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.79 1ss8 h THR 149 CO -0.05 0.60 -0.00 0.40 -0.25 0.00 0.00 175.52 176.22 1ss8 h ILE 150 N 0.00 1.26 0.00 6.82 2.04 -0.55 0.16 117.51 127.23 1ss8 h ILE 150 Ca -0.01 -0.94 -0.06 0.00 1.00 0.00 0.00 64.86 64.85 1ss8 h ILE 150 Cb 1.31 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 1ss8 h ILE 150 CO 0.08 0.30 -0.28 0.28 0.00 0.00 0.00 178.15 178.53 1ss8 h SER 151 N 0.31 0.00 -0.70 1.72 0.02 -1.05 -2.68 113.55 111.17 1ss8 h SER 151 Ca 0.08 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.68 1ss8 h SER 151 Cb 0.44 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.77 1ss8 h SER 151 CO 0.02 0.28 0.44 0.00 -1.14 0.00 0.00 176.83 176.43 1ss8 n ALA 152 N -2.33 4.66 -3.25 3.77 0.00 -0.66 -4.60 120.51 118.10 1ss8 n ALA 152 Ca -0.01 -2.04 -0.16 0.00 0.00 0.00 0.00 53.44 51.23 1ss8 n ALA 152 Cb 0.39 -1.31 0.06 0.00 0.00 0.00 0.00 19.45 18.59 1ss8 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ss8 n ASN 153 N -0.62 -4.11 -0.92 0.00 2.85 -1.01 -2.92 115.26 108.53 1ss8 n ASN 153 Ca 0.42 -0.44 -0.11 0.00 -0.11 0.00 0.00 54.58 54.34 1ss8 n ASN 153 Cb 1.32 -4.02 -0.04 0.00 1.24 0.00 0.00 39.78 38.28 1ss8 n ASN 153 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1ss8 n SER 154 N -2.23 -4.17 -4.45 1.20 7.64 0.55 -4.98 113.62 107.18 1ss8 n SER 154 Ca -0.08 0.22 -0.44 0.00 1.01 0.00 0.00 58.87 59.58 1ss8 n SER 154 Cb 0.58 -2.79 -0.03 0.00 -1.01 0.00 0.00 64.21 60.96 1ss8 n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ss8 s ASP 155 N -2.81 6.43 0.62 6.43 -1.08 -1.15 -4.91 116.67 120.20 1ss8 s ASP 155 Ca 0.00 -1.61 0.30 0.00 -0.52 0.00 0.00 52.55 50.71 1ss8 s ASP 155 Cb 0.00 -2.40 1.60 0.00 -1.46 0.00 0.00 42.92 40.66 1ss8 s ASP 155 CO 0.00 -1.21 1.96 1.05 0.52 0.00 0.00 175.17 177.49 1ss8 h GLU 156 N 9.13 0.00 -0.12 4.34 4.11 -1.92 -2.22 114.58 127.90 1ss8 h GLU 156 Ca -0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.37 1ss8 h GLU 156 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 1ss8 h GLU 156 CO 1.14 0.00 -0.00 1.15 0.07 0.00 0.00 179.01 181.36 1ss8 h THR 157 N 0.00 1.26 -0.70 -1.06 2.02 -1.98 -2.10 112.91 110.35 1ss8 h THR 157 Ca 0.10 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.38 1ss8 h THR 157 Cb 0.81 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 1ss8 h THR 157 CO -0.00 0.24 0.18 0.58 0.37 0.00 0.00 175.52 176.89 1ss8 h VAL 158 N -0.05 1.26 0.29 3.16 2.07 -1.76 -0.31 116.25 120.91 1ss8 h VAL 158 Ca 0.03 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.61 1ss8 h VAL 158 Cb 0.37 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 1ss8 h VAL 158 CO 0.01 0.37 -0.41 1.23 0.02 0.00 0.00 177.57 178.79 1ss8 h GLY 159 N 1.05 -0.91 -0.62 2.17 0.00 -1.50 -1.63 103.07 101.62 1ss8 h GLY 159 Ca 0.22 0.48 0.15 0.00 0.00 0.00 0.00 47.33 48.18 1ss8 h GLY 159 CO 0.00 -0.30 -0.23 0.50 0.00 0.00 0.00 176.54 176.51 1ss8 h LYS 160 N -0.75 -0.02 0.27 4.80 1.57 -1.10 -1.98 116.57 119.35 1ss8 h LYS 160 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1ss8 h LYS 160 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1ss8 h LYS 160 CO -0.13 -0.01 -0.13 -0.07 -0.57 0.00 0.00 179.45 178.53 1ss8 h LEU 161 N -0.02 -0.31 -0.63 2.94 3.38 -0.17 -0.60 115.31 119.91 1ss8 h LEU 161 Ca 0.37 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.44 1ss8 h LEU 161 Cb 0.59 0.08 -0.11 0.00 0.09 0.00 0.00 40.66 41.30 1ss8 h LEU 161 CO -0.83 -0.18 -0.08 0.40 0.09 0.00 0.00 178.44 177.84 1ss8 h ILE 162 N -0.41 0.42 -0.65 1.22 1.08 -1.06 -0.54 117.51 117.56 1ss8 h ILE 162 Ca -0.04 -0.02 -0.08 0.00 -0.39 0.00 0.00 64.86 64.33 1ss8 h ILE 162 Cb 0.31 0.36 -0.03 0.00 -3.07 0.00 0.00 36.82 34.40 1ss8 h ILE 162 CO 0.06 0.01 0.09 0.00 -0.69 0.00 0.00 178.15 177.62 1ss8 h ALA 163 N 1.61 0.91 -0.32 1.87 0.00 -0.66 -0.35 119.26 122.32 1ss8 h ALA 163 Ca 0.32 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 163 Cb 0.51 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ss8 h ALA 163 CO -0.60 0.67 0.10 0.93 0.00 0.00 0.00 179.25 180.34 1ss8 h GLU 164 N 1.02 0.50 -0.16 0.00 5.08 -0.60 0.07 114.58 120.49 1ss8 h GLU 164 Ca 0.20 -0.11 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1ss8 h GLU 164 Cb 0.46 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.59 1ss8 h GLU 164 CO 0.02 0.54 -0.18 0.00 -1.00 0.00 0.00 179.01 178.39 1ss8 h ALA 165 N 0.93 -0.09 0.00 3.43 0.00 -0.56 -0.26 119.26 122.71 1ss8 h ALA 165 Ca 0.10 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1ss8 h ALA 165 Cb 0.26 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ss8 h ALA 165 CO -0.00 -0.63 -0.33 0.52 0.00 0.00 0.00 179.25 178.81 1ss8 h MET 166 N -0.22 0.00 -0.23 0.00 2.86 -0.97 -0.98 114.93 115.40 1ss8 h MET 166 Ca 0.11 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.57 1ss8 h MET 166 Cb 0.37 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 1ss8 h MET 166 CO -0.29 0.33 -0.55 0.22 1.06 0.00 0.00 176.91 177.69 1ss8 h ASP 167 N 0.00 0.87 0.41 1.22 3.58 -0.74 0.28 116.42 122.04 1ss8 h ASP 167 Ca -0.00 -0.56 -0.04 0.00 0.42 0.00 0.00 57.03 56.85 1ss8 h ASP 167 Cb 0.59 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1ss8 h ASP 167 CO 0.04 1.28 -0.18 0.50 -2.88 0.00 0.00 179.24 178.01 1ss8 h LYS 168 N 0.51 0.00 0.00 0.28 1.63 0.23 -3.37 116.57 115.85 1ss8 h LYS 168 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1ss8 h LYS 168 Cb 1.16 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 1ss8 h LYS 168 CO 0.12 0.18 0.00 1.55 -3.45 0.00 0.00 179.45 177.85 1ss8 n VAL 169 N -3.76 0.00 0.00 2.00 3.14 -0.64 -5.09 118.33 113.98 1ss8 n VAL 169 Ca -0.02 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 1ss8 n VAL 169 Cb 0.28 1.24 0.00 0.00 -1.06 0.00 0.00 33.84 34.31 1ss8 n VAL 169 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ss8 n GLY 170 N 0.00 0.32 0.24 7.55 0.00 0.98 -3.77 105.19 110.51 1ss8 n GLY 170 Ca 0.00 -1.62 -0.01 0.00 0.00 0.00 0.00 46.02 44.39 1ss8 n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ss8 h LYS 171 N 0.00 0.39 -0.01 1.61 1.57 -1.95 -1.40 116.57 116.78 1ss8 h LYS 171 Ca 0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1ss8 h LYS 171 Cb 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1ss8 h LYS 171 CO 0.00 0.57 -0.08 0.39 -0.57 0.00 0.00 179.45 179.76 1ss8 n GLU 172 N -4.18 1.23 -1.19 3.15 -0.58 -1.26 -4.96 120.64 112.84 1ss8 n GLU 172 Ca -0.00 -0.62 -0.29 0.00 -0.42 0.00 0.00 57.16 55.83 1ss8 n GLU 172 Cb 0.35 -1.49 0.18 0.00 -0.57 0.00 0.00 31.44 29.91 1ss8 n GLU 172 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1ss8 s GLY 173 N -2.20 1.56 -0.24 0.62 0.00 -0.53 -5.01 107.32 101.52 1ss8 s GLY 173 Ca 0.34 -0.42 -0.12 0.00 0.00 0.00 0.00 44.72 44.52 1ss8 s GLY 173 CO 0.41 0.21 0.25 0.54 0.00 0.00 0.00 173.10 174.50 1ss8 s VAL 174 N -3.00 5.29 -0.07 1.40 0.11 -1.26 -4.99 120.40 117.88 1ss8 s VAL 174 Ca 0.66 0.35 0.03 0.00 -2.93 0.00 0.00 61.98 60.09 1ss8 s VAL 174 Cb -0.18 -3.58 0.01 0.00 -1.53 0.00 0.00 36.38 31.09 1ss8 s VAL 174 CO 0.57 0.29 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.83 1ss8 s ILE 175 N 1.34 1.47 0.45 7.04 1.01 -1.26 -0.75 121.20 130.50 1ss8 s ILE 175 Ca 0.11 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1ss8 s ILE 175 Cb -0.14 -1.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 1ss8 s ILE 175 CO 0.07 0.43 0.03 0.42 0.00 0.00 0.00 174.94 175.89 1ss8 s THR 176 N 0.42 1.73 -0.03 2.92 -4.23 -0.09 -4.96 115.64 111.40 1ss8 s THR 176 Ca -0.13 -1.96 0.03 0.00 -1.18 0.00 0.00 61.69 58.45 1ss8 s THR 176 Cb -0.15 -2.69 -0.00 0.00 1.34 0.00 0.00 72.50 70.99 1ss8 s THR 176 CO 0.05 0.00 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.31 1ss8 s VAL 177 N -2.76 1.09 0.22 2.29 1.01 -1.26 -0.99 120.40 120.01 1ss8 s VAL 177 Ca 0.25 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.72 1ss8 s VAL 177 Cb 0.06 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 1ss8 s VAL 177 CO 0.13 0.32 0.04 -1.61 0.00 0.00 0.00 175.10 173.99 1ss8 s GLU 178 N 0.08 1.27 0.48 2.72 2.02 0.03 -4.94 118.70 120.36 1ss8 s GLU 178 Ca -0.03 -1.65 -0.24 0.00 0.02 0.00 0.00 54.97 53.08 1ss8 s GLU 178 Cb -0.10 -0.34 -0.08 0.00 0.10 0.00 0.00 34.13 33.72 1ss8 s GLU 178 CO 0.01 -0.19 1.29 -0.25 0.02 0.00 0.00 175.26 176.15 1ss8 n ASP 179 N -0.37 2.53 -4.04 -0.19 9.92 -1.26 -2.19 116.55 120.96 1ss8 n ASP 179 Ca -0.04 1.04 -0.30 0.00 -0.53 0.00 0.00 54.79 54.97 1ss8 n ASP 179 Cb 0.65 -1.53 0.20 0.00 -0.64 0.00 0.00 41.12 39.79 1ss8 n ASP 179 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1ss8 s GLY 180 N -0.71 1.81 -0.00 0.44 0.00 -0.41 -4.44 107.32 104.00 1ss8 s GLY 180 Ca 0.66 -1.32 0.04 0.00 0.00 0.00 0.00 44.72 44.10 1ss8 s GLY 180 CO 0.54 -0.51 0.14 -1.30 0.00 0.00 0.00 173.10 171.97 1ss8 n THR 181 N -3.80 0.00 -0.54 0.90 -2.24 -1.26 -4.94 114.28 102.39 1ss8 n THR 181 Ca 0.16 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1ss8 n THR 181 Cb 0.59 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 1ss8 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ss8 n GLY 182 N 1.54 3.57 0.16 3.38 0.00 -1.26 -5.03 105.19 107.56 1ss8 n GLY 182 Ca 0.00 -0.33 -0.19 0.00 0.00 0.00 0.00 46.02 45.51 1ss8 n GLY 182 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ss8 h LEU 183 N 0.00 0.73 -9.96 0.99 5.85 -1.93 -3.04 115.31 107.95 1ss8 h LEU 183 Ca 0.00 -0.66 -0.47 0.00 0.84 0.00 0.00 57.88 57.59 1ss8 h LEU 183 Cb 0.00 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1ss8 h LEU 183 CO 0.00 1.47 0.39 -1.10 -0.34 0.00 0.00 178.44 178.86 1ss8 s GLN 184 N -3.03 4.25 0.42 1.25 -1.52 -1.26 -2.70 119.66 117.07 1ss8 s GLN 184 Ca -0.08 1.41 -0.22 0.00 -1.95 0.00 0.00 55.36 54.53 1ss8 s GLN 184 Cb 0.07 -2.53 -0.11 0.00 -0.22 0.00 0.00 33.01 30.22 1ss8 s GLN 184 CO 0.91 -0.04 0.95 -0.51 -0.25 0.00 0.00 175.29 176.35 1ss8 s ASP 185 N -1.68 6.97 0.10 5.90 1.01 -1.26 -3.56 116.67 124.14 1ss8 s ASP 185 Ca 0.57 1.72 0.05 0.00 0.71 0.00 0.00 52.55 55.60 1ss8 s ASP 185 Cb -0.19 -2.55 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 1ss8 s ASP 185 CO 0.24 -0.34 -0.13 -1.61 0.21 0.00 0.00 175.17 173.54 1ss8 s GLU 186 N -3.02 0.90 -0.05 8.23 2.02 0.01 -4.93 118.70 121.86 1ss8 s GLU 186 Ca 0.61 -1.11 -0.02 0.00 0.02 0.00 0.00 54.97 54.47 1ss8 s GLU 186 Cb -0.11 -0.79 0.03 0.00 0.10 0.00 0.00 34.13 33.37 1ss8 s GLU 186 CO 0.15 0.16 0.03 -1.17 0.02 0.00 0.00 175.26 174.45 1ss8 s LEU 187 N -2.17 0.36 0.05 1.80 2.96 -1.26 -0.50 118.68 119.92 1ss8 s LEU 187 Ca 0.04 0.00 -0.02 0.00 -0.22 0.00 0.00 54.13 53.93 1ss8 s LEU 187 Cb -0.06 -0.28 -0.04 0.00 0.50 0.00 0.00 46.19 46.31 1ss8 s LEU 187 CO 0.02 -0.22 -0.01 1.51 -1.32 0.00 0.00 176.35 176.33 1ss8 s ASP 188 N 2.07 0.45 -0.11 3.68 -4.77 -0.91 -4.98 116.67 112.10 1ss8 s ASP 188 Ca 0.05 -0.95 -0.05 0.00 -3.30 0.00 0.00 52.55 48.31 1ss8 s ASP 188 Cb -0.12 0.21 -0.04 0.00 -1.09 0.00 0.00 42.92 41.88 1ss8 s ASP 188 CO -0.04 -0.60 0.07 -0.69 0.70 0.00 0.00 175.17 174.62 1ss8 s VAL 189 N -3.80 4.94 0.06 2.11 1.01 -1.26 -0.07 120.40 123.39 1ss8 s VAL 189 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.01 1ss8 s VAL 189 Cb 0.07 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 1ss8 s VAL 189 CO -0.10 0.61 -0.00 0.54 0.00 0.00 0.00 175.10 176.15 1ss8 s VAL 190 N -0.93 0.20 0.13 2.92 0.11 -0.81 -4.96 120.40 117.06 1ss8 s VAL 190 Ca 0.14 -1.78 -0.31 0.00 -2.93 0.00 0.00 61.98 57.10 1ss8 s VAL 190 Cb -0.12 -1.57 -0.09 0.00 -1.53 0.00 0.00 36.38 33.07 1ss8 s VAL 190 CO 0.03 -0.91 1.49 -1.61 -3.33 0.00 0.00 175.10 170.77 1ss8 s GLU 191 N -3.93 4.26 -0.02 1.54 0.41 -1.26 -2.21 118.70 117.48 1ss8 s GLU 191 Ca 0.09 2.22 -0.07 0.00 -0.41 0.00 0.00 54.97 56.79 1ss8 s GLU 191 Cb 0.08 -3.24 0.02 0.00 -1.78 0.00 0.00 34.13 29.21 1ss8 s GLU 191 CO -0.09 -0.54 0.33 0.41 -0.49 0.00 0.00 175.26 174.88 1ss8 n GLY 192 N 3.65 0.33 3.60 -1.39 0.00 -1.26 -1.29 105.19 108.83 1ss8 n GLY 192 Ca 0.13 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 1ss8 n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ss8 s MET 193 N -2.00 0.54 -0.06 1.61 1.75 -0.62 -4.05 119.30 116.47 1ss8 s MET 193 Ca 0.08 0.26 0.03 0.00 -1.25 0.00 0.00 55.69 54.82 1ss8 s MET 193 Cb -0.00 0.26 0.01 0.00 2.84 0.00 0.00 34.83 37.93 1ss8 s MET 193 CO -0.01 -0.14 -0.15 -1.14 -0.65 0.00 0.00 175.02 172.93 1ss8 s GLN 194 N -0.71 1.88 0.19 4.11 0.74 -1.26 -0.82 119.66 123.79 1ss8 s GLN 194 Ca 0.00 -0.54 0.08 0.00 0.05 0.00 0.00 55.36 54.94 1ss8 s GLN 194 Cb -0.02 -1.56 -0.04 0.00 1.10 0.00 0.00 33.01 32.49 1ss8 s GLN 194 CO -0.01 0.13 -0.15 -0.59 -0.55 0.00 0.00 175.29 174.12 1ss8 s PHE 195 N 0.38 1.70 -1.16 1.67 -0.71 -0.56 -5.01 117.98 114.27 1ss8 s PHE 195 Ca -0.11 -0.55 -0.06 0.00 -1.04 0.00 0.00 56.93 55.16 1ss8 s PHE 195 Cb -0.14 -0.81 0.02 0.00 -1.21 0.00 0.00 43.02 40.88 1ss8 s PHE 195 CO 0.04 0.33 2.71 -0.25 -1.34 0.00 0.00 175.22 176.71 1ss8 n ASP 196 N -0.18 7.78 -3.91 1.98 8.00 -1.26 -1.47 116.55 127.50 1ss8 n ASP 196 Ca -0.10 -2.94 -0.22 0.00 0.71 0.00 0.00 54.79 52.24 1ss8 n ASP 196 Cb 0.59 -1.40 -0.17 0.00 -0.02 0.00 0.00 41.12 40.13 1ss8 n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1ss8 s ARG 197 N -0.15 1.08 0.71 -1.24 1.81 -1.24 -4.74 118.95 115.17 1ss8 s ARG 197 Ca 0.60 -0.16 -0.02 0.00 -1.72 0.00 0.00 55.73 54.43 1ss8 s ARG 197 Cb 0.22 -1.07 0.14 0.00 -0.45 0.00 0.00 34.95 33.79 1ss8 s ARG 197 CO -0.10 -0.11 0.97 0.41 -0.68 0.00 0.00 175.30 175.79 1ss8 n GLY 198 N 4.26 0.45 3.73 -3.53 0.00 -1.25 -1.85 105.19 107.00 1ss8 n GLY 198 Ca -0.20 -2.00 -0.36 0.00 0.00 0.00 0.00 46.02 43.46 1ss8 n GLY 198 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ss8 s TYR 199 N -2.98 2.10 -0.37 1.61 -0.85 -0.57 -4.32 117.35 111.96 1ss8 s TYR 199 Ca 0.63 1.51 0.23 0.00 -0.52 0.00 0.00 57.07 58.93 1ss8 s TYR 199 Cb -0.03 -3.62 0.23 0.00 0.38 0.00 0.00 41.96 38.91 1ss8 s TYR 199 CO 0.42 -2.78 1.41 -0.07 -1.52 0.00 0.00 175.55 173.01 1ss8 h LEU 200 N 0.39 0.00 -7.91 -3.49 3.38 -1.46 -3.45 115.31 102.78 1ss8 h LEU 200 Ca -0.50 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.28 1ss8 h LEU 200 Cb 1.32 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.84 1ss8 h LEU 200 CO 0.52 0.00 -0.70 -0.94 0.09 0.00 0.00 178.44 177.41 1ss8 s SER 201 N -5.89 0.17 0.26 -0.43 1.04 -1.26 -5.02 113.70 102.57 1ss8 s SER 201 Ca 0.04 -0.36 0.13 0.00 0.48 0.00 0.00 55.95 56.25 1ss8 s SER 201 Cb 0.07 0.08 0.73 0.00 0.10 0.00 0.00 66.02 67.00 1ss8 s SER 201 CO 0.71 -0.22 1.34 -2.65 0.98 0.00 0.00 173.24 173.40 1ss8 n PRO 202 N 2.00 0.09 0.20 4.02 -0.02 -1.26 -3.20 135.00 136.83 1ss8 n PRO 202 Ca -0.21 0.56 0.10 0.00 -2.02 0.00 0.00 63.50 61.93 1ss8 n PRO 202 Cb 0.56 -1.95 0.13 0.00 -0.02 0.00 0.00 33.50 32.22 1ss8 n PRO 202 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1ss8 h TYR 203 N 0.00 0.00 0.00 6.00 0.05 -1.98 -3.11 116.97 117.93 1ss8 h TYR 203 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ss8 h TYR 203 Cb 0.32 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1ss8 h TYR 203 CO 0.00 0.13 0.00 0.74 -1.05 0.00 0.00 178.16 177.98 1ss8 h PHE 204 N 0.00 0.00 -1.33 4.88 0.04 -1.88 -3.43 116.94 115.22 1ss8 h PHE 204 Ca -0.00 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.22 1ss8 h PHE 204 Cb 1.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 1ss8 h PHE 204 CO 0.00 0.00 1.57 -0.89 -0.60 0.00 0.00 178.31 178.39 1ss8 n ILE 205 N -2.33 0.09 1.10 -0.55 5.41 -1.18 -4.73 119.36 117.16 1ss8 n ILE 205 Ca 0.01 -0.48 0.12 0.00 1.00 0.00 0.00 62.75 63.40 1ss8 n ILE 205 Cb 0.21 -2.14 0.14 0.00 -0.71 0.00 0.00 39.64 37.14 1ss8 n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1ss8 n ASN 206 N 12.71 1.64 -3.75 4.38 0.23 -1.11 -4.63 115.26 124.72 1ss8 n ASN 206 Ca 0.41 -1.27 -0.28 0.00 -0.53 0.00 0.00 54.58 52.90 1ss8 n ASN 206 Cb 0.37 0.35 -0.11 0.00 -2.08 0.00 0.00 39.78 38.31 1ss8 n ASN 206 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1ss8 n LYS 207 N -0.28 1.44 0.30 -3.83 5.02 -0.69 -4.99 118.16 115.14 1ss8 n LYS 207 Ca 0.10 -4.16 0.19 0.00 -2.02 0.00 0.00 58.31 52.42 1ss8 n LYS 207 Cb 0.42 -2.12 1.01 0.00 -0.02 0.00 0.00 35.03 34.32 1ss8 n LYS 207 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1ss8 h PRO 208 N 5.37 0.00 -0.08 1.97 0.13 -1.82 -1.05 132.00 136.52 1ss8 h PRO 208 Ca 0.18 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.13 1ss8 h PRO 208 Cb 0.79 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 1ss8 h PRO 208 CO 0.63 0.00 -0.73 0.93 -0.23 0.00 0.00 178.00 178.61 1ss8 h GLU 209 N 0.00 0.43 0.00 0.86 3.07 -1.94 -2.06 114.58 114.94 1ss8 h GLU 209 Ca 0.02 -0.35 0.00 0.00 -0.50 0.00 0.00 59.36 58.53 1ss8 h GLU 209 Cb 0.24 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1ss8 h GLU 209 CO -0.00 0.99 -0.68 2.41 -1.40 0.00 0.00 179.01 180.33 1ss8 n THR 210 N -3.85 0.32 -3.41 1.13 -1.04 -1.04 -4.97 114.28 101.43 1ss8 n THR 210 Ca -0.04 -0.26 -0.21 0.00 -2.04 0.00 0.00 64.05 61.49 1ss8 n THR 210 Cb 0.71 -0.07 0.07 0.00 -1.82 0.00 0.00 70.33 69.21 1ss8 n THR 210 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ss8 n GLY 211 N 1.35 -0.39 3.52 3.41 0.00 -0.45 -5.03 105.19 107.60 1ss8 n GLY 211 Ca 0.03 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1ss8 n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss8 s ALA 212 N -3.26 2.88 -0.19 4.61 0.00 -0.91 -4.62 121.76 120.26 1ss8 s ALA 212 Ca 0.49 -1.88 -0.06 0.00 0.00 0.00 0.00 51.96 50.51 1ss8 s ALA 212 Cb -0.22 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 1ss8 s ALA 212 CO 0.61 0.23 0.03 0.08 0.00 0.00 0.00 175.76 176.71 1ss8 s VAL 213 N -2.50 4.37 -0.14 0.00 1.01 -0.34 -1.70 120.40 121.10 1ss8 s VAL 213 Ca 0.31 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 1ss8 s VAL 213 Cb -0.04 -2.97 0.04 0.00 0.00 0.00 0.00 36.38 33.41 1ss8 s VAL 213 CO 0.16 0.44 -0.03 -0.70 0.00 0.00 0.00 175.10 174.97 1ss8 s GLU 214 N 0.72 1.14 -0.01 2.72 2.12 -1.26 -0.20 118.70 123.93 1ss8 s GLU 214 Ca 0.02 -0.32 0.08 0.00 0.36 0.00 0.00 54.97 55.11 1ss8 s GLU 214 Cb -0.14 -1.72 -0.02 0.00 0.26 0.00 0.00 34.13 32.51 1ss8 s GLU 214 CO 0.02 -0.41 -0.25 -0.51 -0.54 0.00 0.00 175.26 173.58 1ss8 s LEU 215 N 1.76 2.06 -0.18 2.70 1.43 -0.55 -4.96 118.68 120.94 1ss8 s LEU 215 Ca 0.02 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 1ss8 s LEU 215 Cb -0.14 -1.26 -0.02 0.00 0.03 0.00 0.00 46.19 44.79 1ss8 s LEU 215 CO -0.07 0.29 -0.02 -1.61 0.23 0.00 0.00 176.35 175.17 1ss8 s GLU 216 N -0.67 3.62 -1.51 1.70 2.02 -1.26 -2.31 118.70 120.29 1ss8 s GLU 216 Ca 0.10 -0.53 -0.09 0.00 0.02 0.00 0.00 54.97 54.46 1ss8 s GLU 216 Cb -0.10 -3.00 0.07 0.00 0.10 0.00 0.00 34.13 31.21 1ss8 s GLU 216 CO -0.01 0.10 0.76 0.43 0.02 0.00 0.00 175.26 176.56 1ss8 n SER 217 N 3.97 -2.78 -4.80 -0.19 7.64 -0.47 -4.51 113.62 112.48 1ss8 n SER 217 Ca -0.17 -0.89 -0.35 0.00 1.01 0.00 0.00 58.87 58.46 1ss8 n SER 217 Cb 0.52 -3.46 -0.06 0.00 -1.01 0.00 0.00 64.21 60.20 1ss8 n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ss8 s PRO 218 N -6.57 4.35 0.45 1.43 0.04 -1.12 -4.60 135.00 128.98 1ss8 s PRO 218 Ca 0.41 1.27 -0.21 0.00 0.04 0.00 0.00 61.00 62.52 1ss8 s PRO 218 Cb -0.22 -2.49 -0.09 0.00 0.04 0.00 0.00 34.50 31.74 1ss8 s PRO 218 CO 0.86 0.07 1.02 -0.06 0.04 0.00 0.00 177.00 178.93 1ss8 s PHE 219 N -1.86 3.14 -0.15 0.56 0.08 -0.68 -2.96 117.98 116.11 1ss8 s PHE 219 Ca 0.57 1.60 0.00 0.00 0.12 0.00 0.00 56.93 59.22 1ss8 s PHE 219 Cb -0.15 -3.02 0.03 0.00 -0.57 0.00 0.00 43.02 39.31 1ss8 s PHE 219 CO 0.20 -0.58 -0.12 0.42 -0.10 0.00 0.00 175.22 175.03 1ss8 s ILE 220 N -1.96 1.49 -0.26 0.64 1.01 0.22 -0.87 121.20 121.46 1ss8 s ILE 220 Ca 0.64 -0.65 -0.14 0.00 0.00 0.00 0.00 60.65 60.50 1ss8 s ILE 220 Cb -0.16 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 1ss8 s ILE 220 CO 0.20 0.39 0.34 -0.22 0.00 0.00 0.00 174.94 175.64 1ss8 s LEU 221 N 1.51 4.05 -0.31 2.97 2.96 0.33 -1.20 118.68 128.98 1ss8 s LEU 221 Ca 0.04 0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 54.11 1ss8 s LEU 221 Cb -0.13 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.19 1ss8 s LEU 221 CO -0.10 -0.14 0.13 -0.76 -1.32 0.00 0.00 176.35 174.16 1ss8 s LEU 222 N 1.92 4.08 -0.18 -0.68 1.43 -1.26 -1.01 118.68 122.99 1ss8 s LEU 222 Ca 0.14 -0.63 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 1ss8 s LEU 222 Cb -0.16 -1.97 0.05 0.00 0.03 0.00 0.00 46.19 44.15 1ss8 s LEU 222 CO 0.10 -0.21 -0.01 0.00 0.23 0.00 0.00 176.35 176.46 1ss8 s ALA 223 N 1.57 1.26 -1.13 4.21 0.00 -0.62 -1.96 121.76 125.09 1ss8 s ALA 223 Ca 0.04 -0.77 -0.18 0.00 0.00 0.00 0.00 51.96 51.04 1ss8 s ALA 223 Cb -0.17 -1.15 0.11 0.00 0.00 0.00 0.00 23.12 21.91 1ss8 s ALA 223 CO 0.05 -0.97 1.45 0.34 0.00 0.00 0.00 175.76 176.63 1ss8 s ASP 224 N 1.73 6.79 0.00 0.00 2.15 -0.88 -2.81 116.67 123.66 1ss8 s ASP 224 Ca -0.01 -2.32 0.00 0.00 0.43 0.00 0.00 52.55 50.66 1ss8 s ASP 224 Cb -0.16 -2.48 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1ss8 s ASP 224 CO -0.07 -1.09 0.00 2.29 -0.17 0.00 0.00 175.17 176.13 1ss8 n LYS 225 N 7.27 0.00 -2.87 4.34 2.85 -1.26 -4.11 118.16 124.38 1ss8 n LYS 225 Ca 0.37 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 57.22 1ss8 n LYS 225 Cb 0.47 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.81 1ss8 n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1ss8 s LYS 226 N -2.00 4.53 -0.58 -1.58 1.02 -1.26 -2.36 119.74 117.51 1ss8 s LYS 226 Ca 0.00 1.20 -0.14 0.00 0.02 0.00 0.00 55.97 57.05 1ss8 s LYS 226 Cb 0.00 -3.42 0.15 0.00 -0.52 0.00 0.00 37.83 34.03 1ss8 s LYS 226 CO 0.00 0.09 0.51 0.42 -0.92 0.00 0.00 175.35 175.45 1ss8 s ILE 227 N 0.57 5.00 -0.23 2.17 1.01 -0.21 -4.87 121.20 124.64 1ss8 s ILE 227 Ca 0.44 -1.80 -0.15 0.00 0.00 0.00 0.00 60.65 59.15 1ss8 s ILE 227 Cb -0.20 -4.20 -0.17 0.00 0.01 0.00 0.00 42.46 37.89 1ss8 s ILE 227 CO 0.24 -0.88 -0.03 -1.20 0.00 0.00 0.00 174.94 173.07 1ss8 n SER 228 N 4.87 1.94 -4.83 3.58 7.64 -1.26 -2.24 113.62 123.32 1ss8 n SER 228 Ca -0.07 0.31 -0.35 0.00 1.01 0.00 0.00 58.87 59.78 1ss8 n SER 228 Cb 0.41 -0.85 -0.06 0.00 -1.01 0.00 0.00 64.21 62.71 1ss8 n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ss8 s ASN 229 N -7.10 6.90 0.20 6.43 0.01 -1.26 -1.61 114.94 118.51 1ss8 s ASN 229 Ca -0.33 1.23 0.21 0.00 -0.71 0.00 0.00 52.86 53.26 1ss8 s ASN 229 Cb 0.10 -2.35 0.01 0.00 0.41 0.00 0.00 41.25 39.42 1ss8 s ASN 229 CO 0.57 0.03 1.08 -0.29 -1.51 0.00 0.00 177.10 176.98 1ss8 h ILE 230 N 2.63 0.16 -0.90 0.60 2.10 -1.92 -3.36 117.51 116.81 1ss8 h ILE 230 Ca -0.48 -1.29 0.23 0.00 1.08 0.00 0.00 64.86 64.40 1ss8 h ILE 230 Cb 1.19 1.72 -0.13 0.00 -1.09 0.00 0.00 36.82 38.51 1ss8 h ILE 230 CO 0.66 0.09 0.37 0.03 -1.08 0.00 0.00 178.15 178.21 1ss8 h ARG 231 N 0.00 0.33 0.00 2.19 3.08 -2.02 0.12 114.38 118.08 1ss8 h ARG 231 Ca -0.04 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 1ss8 h ARG 231 Cb 1.15 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 1ss8 h ARG 231 CO 0.01 0.22 -0.19 0.93 -1.07 0.00 0.00 179.97 179.88 1ss8 h GLU 232 N 0.34 0.00 0.01 0.04 5.08 -1.96 -3.30 114.58 114.79 1ss8 h GLU 232 Ca 0.57 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.93 1ss8 h GLU 232 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 1ss8 h GLU 232 CO -0.57 0.19 -0.01 0.52 -1.00 0.00 0.00 179.01 178.14 1ss8 h MET 233 N 0.00 -0.01 -0.72 2.33 2.86 -0.97 -3.30 114.93 115.11 1ss8 h MET 233 Ca -0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1ss8 h MET 233 Cb 0.57 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.14 1ss8 h MET 233 CO 0.02 0.79 -0.38 1.28 1.06 0.00 0.00 176.91 179.68 1ss8 n LEU 234 N -4.69 -0.68 -0.35 1.22 4.77 -1.07 -0.75 117.00 115.45 1ss8 n LEU 234 Ca -0.09 1.27 0.12 0.00 -0.03 0.00 0.00 56.01 57.28 1ss8 n LEU 234 Cb 0.39 -0.20 0.31 0.00 -2.33 0.00 0.00 43.42 41.60 1ss8 n LEU 234 CO 0.31 -1.06 1.20 1.55 -1.33 0.00 0.00 177.39 178.06 1ss8 h PRO 235 N 0.00 0.77 0.02 3.23 0.13 -1.83 0.04 132.00 134.36 1ss8 h PRO 235 Ca 0.15 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 65.18 1ss8 h PRO 235 Cb 0.33 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 31.29 1ss8 h PRO 235 CO -0.68 0.51 -0.24 0.28 -0.23 0.00 0.00 178.00 177.64 1ss8 h VAL 236 N 0.79 1.60 -0.83 1.56 2.07 -1.14 -3.17 116.25 117.13 1ss8 h VAL 236 Ca 0.56 -2.09 0.16 0.00 0.82 0.00 0.00 66.70 66.16 1ss8 h VAL 236 Cb 0.84 2.97 -0.06 0.00 -1.52 0.00 0.00 31.29 33.52 1ss8 h VAL 236 CO -0.36 0.57 0.55 -0.07 0.02 0.00 0.00 177.57 178.28 1ss8 h LEU 237 N -0.62 0.46 -0.04 2.57 3.38 -0.16 -1.03 115.31 119.87 1ss8 h LEU 237 Ca -0.03 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1ss8 h LEU 237 Cb 1.06 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1ss8 h LEU 237 CO 0.05 0.22 -0.25 -0.33 0.09 0.00 0.00 178.44 178.22 1ss8 h GLU 238 N 0.48 0.23 -0.32 1.13 5.08 -1.16 -2.62 114.58 117.39 1ss8 h GLU 238 Ca 0.42 -0.20 0.08 0.00 -1.00 0.00 0.00 59.36 58.66 1ss8 h GLU 238 Cb 0.91 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1ss8 h GLU 238 CO -0.16 0.87 0.23 0.00 -1.00 0.00 0.00 179.01 178.95 1ss8 h ALA 239 N 0.37 2.21 -0.02 3.43 0.00 -1.27 -0.37 119.26 123.60 1ss8 h ALA 239 Ca -0.02 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1ss8 h ALA 239 Cb 0.93 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1ss8 h ALA 239 CO 0.05 -0.29 -0.68 0.28 0.00 0.00 0.00 179.25 178.61 1ss8 h VAL 240 N 0.08 1.38 0.00 0.00 2.07 -1.28 -3.13 116.25 115.37 1ss8 h VAL 240 Ca 0.15 -2.07 -0.03 0.00 0.82 0.00 0.00 66.70 65.57 1ss8 h VAL 240 Cb 0.50 2.46 -0.00 0.00 -1.52 0.00 0.00 31.29 32.73 1ss8 h VAL 240 CO -0.01 0.62 -0.13 0.00 0.02 0.00 0.00 177.57 178.06 1ss8 h ALA 241 N 0.37 1.54 -0.04 1.67 0.00 -0.91 -2.54 119.26 119.35 1ss8 h ALA 241 Ca -0.08 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 1ss8 h ALA 241 Cb 1.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1ss8 h ALA 241 CO 0.14 0.16 -0.59 0.87 0.00 0.00 0.00 179.25 179.83 1ss8 h LYS 242 N 0.00 0.12 -0.00 0.00 1.57 -1.06 -2.73 116.57 114.46 1ss8 h LYS 242 Ca -0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1ss8 h LYS 242 Cb 0.27 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1ss8 h LYS 242 CO 0.02 0.67 -0.18 0.00 -0.57 0.00 0.00 179.45 179.39 1ss8 n ALA 243 N -2.45 2.88 -0.94 3.86 0.00 -0.98 -4.94 120.51 117.94 1ss8 n ALA 243 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1ss8 n ALA 243 Cb 0.60 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1ss8 n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 244 N 1.33 0.35 3.94 0.00 0.00 -1.03 -5.00 105.19 104.77 1ss8 n GLY 244 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 1ss8 n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ss8 s LYS 245 N -0.79 3.51 1.03 1.61 1.02 -1.24 -5.05 119.74 119.84 1ss8 s LYS 245 Ca 0.00 -0.36 -0.17 0.00 0.02 0.00 0.00 55.97 55.46 1ss8 s LYS 245 Cb 0.00 -2.77 0.22 0.00 -0.52 0.00 0.00 37.83 34.76 1ss8 s LYS 245 CO 0.00 0.31 1.23 -1.25 -0.92 0.00 0.00 175.35 174.72 1ss8 s PRO 246 N -3.75 0.11 -0.02 -1.68 0.04 -1.26 -4.64 135.00 123.80 1ss8 s PRO 246 Ca 0.39 -0.22 -0.00 0.00 0.04 0.00 0.00 61.00 61.20 1ss8 s PRO 246 Cb -0.10 -1.77 0.03 0.00 0.04 0.00 0.00 34.50 32.70 1ss8 s PRO 246 CO 0.31 -2.80 0.03 -1.17 0.04 0.00 0.00 177.00 173.41 1ss8 s LEU 247 N -6.24 1.14 -0.21 -3.56 2.96 -0.11 -1.68 118.68 110.98 1ss8 s LEU 247 Ca 0.72 0.05 -0.09 0.00 -0.22 0.00 0.00 54.13 54.59 1ss8 s LEU 247 Cb -0.07 -0.05 -0.04 0.00 0.50 0.00 0.00 46.19 46.53 1ss8 s LEU 247 CO 0.54 -0.12 0.10 -0.22 -1.32 0.00 0.00 176.35 175.33 1ss8 s LEU 248 N 0.99 3.96 -0.29 -0.68 2.96 -0.05 -1.45 118.68 124.12 1ss8 s LEU 248 Ca -0.08 0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.83 1ss8 s LEU 248 Cb -0.12 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1ss8 s LEU 248 CO -0.03 0.13 0.15 -0.63 -1.32 0.00 0.00 176.35 174.65 1ss8 s ILE 249 N 0.64 4.78 -0.35 6.68 -1.09 0.91 -0.51 121.20 132.25 1ss8 s ILE 249 Ca 0.06 -0.19 -0.04 0.00 -2.23 0.00 0.00 60.65 58.25 1ss8 s ILE 249 Cb -0.13 -3.35 0.07 0.00 -1.58 0.00 0.00 42.46 37.47 1ss8 s ILE 249 CO 0.01 0.17 0.11 -0.63 -1.23 0.00 0.00 174.94 173.38 1ss8 s ILE 250 N 1.66 3.39 0.29 2.92 1.01 -0.18 -0.68 121.20 129.62 1ss8 s ILE 250 Ca 0.06 -1.54 0.02 0.00 0.00 0.00 0.00 60.65 59.19 1ss8 s ILE 250 Cb -0.16 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 1ss8 s ILE 250 CO 0.07 -0.35 0.11 0.00 0.00 0.00 0.00 174.94 174.77 1ss8 s ALA 251 N 1.27 1.93 0.21 9.38 0.00 -1.15 -1.59 121.76 131.82 1ss8 s ALA 251 Ca 0.01 -1.83 -0.10 0.00 0.00 0.00 0.00 51.96 50.04 1ss8 s ALA 251 Cb -0.21 1.00 0.27 0.00 0.00 0.00 0.00 23.12 24.18 1ss8 s ALA 251 CO -0.01 -0.44 1.75 1.49 0.00 0.00 0.00 175.76 178.55 1ss8 h GLU 252 N 2.28 0.42 -2.60 0.00 4.81 -1.30 0.41 114.58 118.60 1ss8 h GLU 252 Ca -0.37 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 58.86 1ss8 h GLU 252 Cb 1.25 -0.09 -0.14 0.00 0.63 0.00 0.00 28.75 30.39 1ss8 h GLU 252 CO 0.60 0.28 0.32 0.34 -0.73 0.00 0.00 179.01 179.82 1ss8 s ASP 253 N -5.41 -0.50 -0.19 1.04 2.15 -1.25 -4.14 116.67 108.38 1ss8 s ASP 253 Ca -0.13 0.08 -0.01 0.00 0.43 0.00 0.00 52.55 52.92 1ss8 s ASP 253 Cb 0.17 0.51 0.05 0.00 -0.30 0.00 0.00 42.92 43.35 1ss8 s ASP 253 CO 0.75 -0.79 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.24 1ss8 s VAL 254 N -3.19 1.02 0.31 1.11 1.01 -1.26 -1.05 120.40 118.36 1ss8 s VAL 254 Ca 0.01 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.34 1ss8 s VAL 254 Cb -0.01 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1ss8 s VAL 254 CO -0.09 -0.02 0.19 -1.61 0.00 0.00 0.00 175.10 173.57 1ss8 s GLU 255 N 1.65 2.59 0.00 2.72 2.02 -0.95 -4.73 118.70 122.01 1ss8 s GLU 255 Ca -0.01 -1.35 0.00 0.00 0.02 0.00 0.00 54.97 53.63 1ss8 s GLU 255 Cb -0.17 -2.36 0.00 0.00 0.10 0.00 0.00 34.13 31.71 1ss8 s GLU 255 CO -0.07 0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.80 1ss8 n GLY 256 N -1.21 0.00 0.00 -1.39 0.00 -1.26 -2.60 105.19 98.73 1ss8 n GLY 256 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ss8 n GLY 256 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ss8 n GLU 257 N 0.00 0.00 0.24 1.61 0.00 -1.26 -1.80 120.64 119.42 1ss8 n GLU 257 Ca 0.00 0.36 0.09 0.00 0.00 0.00 0.00 57.16 57.60 1ss8 n GLU 257 Cb 0.00 -1.28 0.58 0.00 0.00 0.00 0.00 31.44 30.74 1ss8 n GLU 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ss8 h ALA 258 N -1.91 1.40 0.79 4.31 0.00 -1.18 -2.50 119.26 120.16 1ss8 h ALA 258 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ss8 h ALA 258 Cb 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ss8 h ALA 258 CO 0.00 0.24 -0.38 1.25 0.00 0.00 0.00 179.25 180.36 1ss8 h LEU 259 N 0.00 -0.90 -1.86 0.00 5.85 -1.57 -1.21 115.31 115.62 1ss8 h LEU 259 Ca -0.00 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.93 1ss8 h LEU 259 Cb 0.41 0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 1ss8 h LEU 259 CO 0.02 -0.59 0.51 0.00 -0.34 0.00 0.00 178.44 178.04 1ss8 h ALA 260 N -0.99 2.50 -0.06 1.25 0.00 -1.03 -1.29 119.26 119.65 1ss8 h ALA 260 Ca -0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1ss8 h ALA 260 Cb 0.83 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1ss8 h ALA 260 CO 0.18 -0.71 -0.16 1.15 0.00 0.00 0.00 179.25 179.71 1ss8 h THR 261 N 0.12 1.44 -0.21 0.00 2.02 -1.10 -2.36 112.91 112.82 1ss8 h THR 261 Ca 0.35 -1.53 0.03 0.00 0.77 0.00 0.00 66.41 66.03 1ss8 h THR 261 Cb 1.21 2.30 -0.03 0.00 -1.74 0.00 0.00 68.15 69.89 1ss8 h THR 261 CO -0.05 0.43 0.02 -0.07 0.37 0.00 0.00 175.52 176.22 1ss8 h LEU 262 N -0.32 -0.04 -0.74 2.58 3.38 -0.73 0.10 115.31 119.55 1ss8 h LEU 262 Ca -0.00 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.17 1ss8 h LEU 262 Cb 0.77 0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.46 1ss8 h LEU 262 CO 0.03 0.01 0.06 0.58 0.09 0.00 0.00 178.44 179.21 1ss8 h VAL 263 N 0.09 0.40 0.00 1.22 2.07 -1.22 0.13 116.25 118.93 1ss8 h VAL 263 Ca 0.10 -0.05 -0.17 0.00 0.82 0.00 0.00 66.70 67.40 1ss8 h VAL 263 Cb 0.11 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1ss8 h VAL 263 CO -0.15 0.03 -0.81 0.58 0.02 0.00 0.00 177.57 177.24 1ss8 h VAL 264 N 0.14 1.49 0.00 2.57 2.07 -1.03 -2.81 116.25 118.69 1ss8 h VAL 264 Ca 0.41 -2.86 0.00 0.00 0.82 0.00 0.00 66.70 65.07 1ss8 h VAL 264 Cb 0.72 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.07 1ss8 h VAL 264 CO -0.61 0.79 -0.48 0.59 0.02 0.00 0.00 177.57 177.88 1ss8 n ASN 265 N -3.44 0.64 0.01 0.57 5.03 0.33 -2.38 115.26 116.02 1ss8 n ASN 265 Ca 0.00 0.15 0.03 0.00 0.87 0.00 0.00 54.58 55.63 1ss8 n ASN 265 Cb 0.81 0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 39.48 1ss8 n ASN 265 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1ss8 n THR 266 N -2.00 0.84 -0.33 3.41 -2.24 -0.15 -2.50 114.28 111.30 1ss8 n THR 266 Ca 0.04 -0.65 -0.03 0.00 -2.27 0.00 0.00 64.05 61.14 1ss8 n THR 266 Cb 0.42 -0.45 0.09 0.00 -2.10 0.00 0.00 70.33 68.29 1ss8 n THR 266 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1ss8 h MET 267 N 0.00 1.18 -0.00 -0.78 -1.53 -1.36 -1.97 114.93 110.47 1ss8 h MET 267 Ca -0.16 -0.07 0.00 0.00 -3.44 0.00 0.00 59.70 56.03 1ss8 h MET 267 Cb 1.46 -0.27 0.00 0.00 -0.55 0.00 0.00 31.60 32.24 1ss8 h MET 267 CO 0.02 0.78 -0.02 0.54 0.14 0.00 0.00 176.91 178.38 1ss8 n ARG 268 N -4.46 1.04 -1.18 0.39 1.74 -1.00 -4.92 116.66 108.27 1ss8 n ARG 268 Ca 0.10 -0.26 -0.06 0.00 -0.77 0.00 0.00 57.85 56.86 1ss8 n ARG 268 Cb 0.02 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 1ss8 n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ss8 n GLY 269 N 1.12 0.82 0.05 -0.13 0.00 -0.74 -4.94 105.19 101.37 1ss8 n GLY 269 Ca 0.20 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1ss8 n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ss8 h ILE 270 N 0.00 1.07 -3.29 -0.61 2.04 -1.74 -3.45 117.51 111.53 1ss8 h ILE 270 Ca -0.13 -0.21 -0.17 0.00 1.00 0.00 0.00 64.86 65.36 1ss8 h ILE 270 Cb 0.55 1.16 -0.25 0.00 -0.74 0.00 0.00 36.82 37.55 1ss8 h ILE 270 CO 0.19 0.06 -0.47 -0.69 0.00 0.00 0.00 178.15 177.23 1ss8 s VAL 271 N -5.86 0.02 -0.66 1.67 1.01 -1.04 -5.00 120.40 110.54 1ss8 s VAL 271 Ca -0.13 -0.17 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 1ss8 s VAL 271 Cb 0.06 -0.33 0.05 0.00 0.00 0.00 0.00 36.38 36.16 1ss8 s VAL 271 CO 0.67 -0.09 1.05 -0.54 0.00 0.00 0.00 175.10 176.19 1ss8 s LYS 272 N -0.27 3.18 0.15 2.72 3.01 -1.26 -3.64 119.74 123.63 1ss8 s LYS 272 Ca -0.04 -0.54 0.10 0.00 -1.01 0.00 0.00 55.97 54.48 1ss8 s LYS 272 Cb -0.03 -4.18 -0.04 0.00 -1.01 0.00 0.00 37.83 32.57 1ss8 s LYS 272 CO 0.01 -1.84 -0.21 0.08 0.51 0.00 0.00 175.35 173.90 1ss8 s VAL 273 N 4.51 2.59 0.01 3.17 1.01 -1.26 -0.93 120.40 129.50 1ss8 s VAL 273 Ca 0.28 -1.73 -0.05 0.00 0.00 0.00 0.00 61.98 60.47 1ss8 s VAL 273 Cb -0.14 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 1ss8 s VAL 273 CO 0.14 0.02 0.09 0.00 0.00 0.00 0.00 175.10 175.34 1ss8 s ALA 274 N -1.32 -0.16 -0.03 5.51 0.00 -0.53 -4.87 121.76 120.37 1ss8 s ALA 274 Ca 0.18 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.82 1ss8 s ALA 274 Cb -0.10 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1ss8 s ALA 274 CO 0.09 -0.22 -0.08 0.00 0.00 0.00 0.00 175.76 175.55 1ss8 s ALA 275 N -1.69 0.78 0.07 0.00 0.00 -1.26 -0.06 121.76 119.59 1ss8 s ALA 275 Ca -0.13 -0.28 0.03 0.00 0.00 0.00 0.00 51.96 51.59 1ss8 s ALA 275 Cb -0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 1ss8 s ALA 275 CO -0.00 0.12 -0.10 0.14 0.00 0.00 0.00 175.76 175.91 1ss8 s VAL 276 N 0.25 0.81 0.41 0.00 -7.23 0.15 -1.03 120.40 113.75 1ss8 s VAL 276 Ca -0.04 -1.32 -0.26 0.00 -1.81 0.00 0.00 61.98 58.55 1ss8 s VAL 276 Cb -0.09 -0.98 -0.09 0.00 0.56 0.00 0.00 36.38 35.79 1ss8 s VAL 276 CO 0.00 -0.40 1.36 -0.54 -0.31 0.00 0.00 175.10 175.21 1ss8 s LYS 277 N -2.03 3.93 0.70 4.82 1.02 -1.26 -2.92 119.74 123.99 1ss8 s LYS 277 Ca -0.03 2.29 -0.16 0.00 0.02 0.00 0.00 55.97 58.09 1ss8 s LYS 277 Cb -0.08 -2.77 0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1ss8 s LYS 277 CO 0.01 -0.57 1.20 0.00 -0.92 0.00 0.00 175.35 175.07 1ss8 s ALA 278 N -1.22 2.24 0.39 5.17 0.00 0.14 -4.78 121.76 123.71 1ss8 s ALA 278 Ca 0.57 0.89 -0.20 0.00 0.00 0.00 0.00 51.96 53.22 1ss8 s ALA 278 Cb -0.41 -3.46 -0.10 0.00 0.00 0.00 0.00 23.12 19.15 1ss8 s ALA 278 CO 0.53 -1.68 0.90 -1.25 0.00 0.00 0.00 175.76 174.26 1ss8 s PRO 279 N -3.80 4.22 1.23 0.00 0.04 -1.26 -4.91 135.00 130.52 1ss8 s PRO 279 Ca 0.75 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.84 1ss8 s PRO 279 Cb -0.29 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 31.94 1ss8 s PRO 279 CO 0.43 0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.92 1ss8 n GLY 280 N -0.43 -1.58 3.36 0.56 0.00 -1.26 -4.33 105.19 101.52 1ss8 n GLY 280 Ca 0.06 -1.21 -0.19 0.00 0.00 0.00 0.00 46.02 44.68 1ss8 n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ss8 s PHE 281 N -0.44 1.63 0.00 1.61 -0.71 -1.26 -4.75 117.98 114.07 1ss8 s PHE 281 Ca 0.00 -1.25 0.00 0.00 -1.04 0.00 0.00 56.93 54.64 1ss8 s PHE 281 Cb 0.00 -0.95 0.00 0.00 -1.21 0.00 0.00 43.02 40.86 1ss8 s PHE 281 CO 0.00 -0.37 0.00 0.41 -1.34 0.00 0.00 175.22 173.92 1ss8 n GLY 282 N -0.58 3.23 0.08 1.99 0.00 -1.26 -2.80 105.19 105.84 1ss8 n GLY 282 Ca -0.00 0.17 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 1ss8 n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ss8 h ASP 283 N 0.00 0.09 0.00 1.61 3.32 -2.00 -3.17 116.42 116.26 1ss8 h ASP 283 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 57.03 56.18 1ss8 h ASP 283 Cb 0.00 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1ss8 h ASP 283 CO 0.00 0.95 0.28 -2.11 -1.72 0.00 0.00 179.24 176.63 1ss8 n ARG 284 N -4.59 0.06 -0.08 3.56 1.85 -1.20 -1.94 116.66 114.33 1ss8 n ARG 284 Ca -0.10 0.48 -0.14 0.00 -1.00 0.00 0.00 57.85 57.08 1ss8 n ARG 284 Cb 0.48 -1.97 -0.11 0.00 -1.05 0.00 0.00 32.46 29.80 1ss8 n ARG 284 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1ss8 h ARG 285 N 0.00 0.00 -0.61 2.89 2.43 -1.49 -2.77 114.38 114.83 1ss8 h ARG 285 Ca 0.00 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.28 1ss8 h ARG 285 Cb 0.55 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.02 1ss8 h ARG 285 CO 0.00 0.90 0.18 0.87 -1.51 0.00 0.00 179.97 180.41 1ss8 h LYS 286 N -1.00 0.32 -0.34 0.20 1.57 -1.43 -0.77 116.57 115.12 1ss8 h LYS 286 Ca -0.07 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.63 1ss8 h LYS 286 Cb 0.98 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1ss8 h LYS 286 CO -0.04 0.21 -0.02 0.00 -0.57 0.00 0.00 179.45 179.03 1ss8 h ALA 287 N 1.45 0.46 -0.39 3.86 0.00 -1.61 -2.85 119.26 120.19 1ss8 h ALA 287 Ca 0.31 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1ss8 h ALA 287 Cb 0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1ss8 h ALA 287 CO -0.36 0.24 -0.08 0.52 0.00 0.00 0.00 179.25 179.58 1ss8 h MET 288 N 0.42 0.66 -0.94 0.00 2.86 -1.16 -0.74 114.93 116.02 1ss8 h MET 288 Ca 0.09 -0.19 0.12 0.00 -2.06 0.00 0.00 59.70 57.67 1ss8 h MET 288 Cb 0.49 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 31.99 1ss8 h MET 288 CO 0.02 0.73 0.57 -0.07 1.06 0.00 0.00 176.91 179.22 1ss8 h LEU 289 N 0.61 0.81 -0.77 1.22 3.38 -1.08 -1.18 115.31 118.30 1ss8 h LEU 289 Ca 0.11 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 1ss8 h LEU 289 Cb 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1ss8 h LEU 289 CO 0.03 0.41 -0.47 -0.61 0.09 0.00 0.00 178.44 177.89 1ss8 h GLN 290 N 0.88 0.34 0.00 1.13 5.75 -1.11 -0.84 115.11 121.27 1ss8 h GLN 290 Ca 0.48 -0.18 0.02 0.00 -0.15 0.00 0.00 58.65 58.81 1ss8 h GLN 290 Cb 0.52 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.06 1ss8 h GLN 290 CO -0.28 0.74 -0.09 -0.44 -2.65 0.00 0.00 178.83 176.11 1ss8 h ASP 291 N 0.28 -0.25 -0.78 -0.69 3.32 -0.01 -0.96 116.42 117.31 1ss8 h ASP 291 Ca 0.02 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 1ss8 h ASP 291 Cb 0.93 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.55 1ss8 h ASP 291 CO 0.08 -0.13 0.36 0.40 -1.72 0.00 0.00 179.24 178.22 1ss8 h ILE 292 N -0.15 1.25 0.20 0.35 2.04 -1.15 -1.68 117.51 118.37 1ss8 h ILE 292 Ca 0.03 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1ss8 h ILE 292 Cb 0.20 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1ss8 h ILE 292 CO -0.09 0.31 -0.29 0.00 0.00 0.00 0.00 178.15 178.08 1ss8 h ALA 293 N 1.26 -0.55 -0.97 1.87 0.00 -0.81 -1.17 119.26 118.88 1ss8 h ALA 293 Ca 0.27 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.20 1ss8 h ALA 293 Cb 0.15 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 1ss8 h ALA 293 CO -0.03 -0.85 0.61 1.15 0.00 0.00 0.00 179.25 180.13 1ss8 h THR 294 N -0.56 1.01 -0.69 0.00 2.02 -0.83 0.36 112.91 114.22 1ss8 h THR 294 Ca 0.01 -0.36 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 1ss8 h THR 294 Cb 0.55 -0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 1ss8 h THR 294 CO -0.12 0.19 0.42 0.25 0.37 0.00 0.00 175.52 176.63 1ss8 h LEU 295 N 1.06 0.82 -1.49 2.58 6.46 -0.79 -3.11 115.31 120.84 1ss8 h LEU 295 Ca 0.45 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 58.16 1ss8 h LEU 295 Cb 0.30 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 1ss8 h LEU 295 CO -0.21 0.63 -0.01 0.35 -0.62 0.00 0.00 178.44 178.58 1ss8 n THR 296 N -4.40 0.00 -3.20 1.05 -2.24 -0.49 -1.80 114.28 103.20 1ss8 n THR 296 Ca 0.07 -0.50 -0.16 0.00 -2.27 0.00 0.00 64.05 61.20 1ss8 n THR 296 Cb 0.07 1.27 0.06 0.00 -2.10 0.00 0.00 70.33 69.63 1ss8 n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ss8 n GLY 297 N 0.75 -0.15 3.85 3.38 0.00 0.11 -0.90 105.19 112.22 1ss8 n GLY 297 Ca 0.08 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1ss8 n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ss8 s GLY 298 N -3.55 2.44 -0.03 -0.02 0.00 -0.09 -4.28 107.32 101.80 1ss8 s GLY 298 Ca 0.25 -1.33 0.08 0.00 0.00 0.00 0.00 44.72 43.72 1ss8 s GLY 298 CO 0.54 -1.95 -0.26 -1.59 0.00 0.00 0.00 173.10 169.84 1ss8 s THR 299 N -2.73 2.07 -0.03 0.90 2.01 0.13 -4.53 115.64 113.46 1ss8 s THR 299 Ca 0.32 -1.09 -0.30 0.00 0.31 0.00 0.00 61.69 60.93 1ss8 s THR 299 Cb -0.01 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.76 1ss8 s THR 299 CO 0.19 0.58 1.07 -0.69 -0.69 0.00 0.00 174.62 175.09 1ss8 s VAL 300 N -0.54 4.56 -0.72 3.82 1.01 -1.26 -4.54 120.40 122.73 1ss8 s VAL 300 Ca 0.08 1.84 -0.16 0.00 0.00 0.00 0.00 61.98 63.74 1ss8 s VAL 300 Cb -0.11 -4.18 0.16 0.00 0.00 0.00 0.00 36.38 32.26 1ss8 s VAL 300 CO -0.00 0.08 0.72 -0.63 0.00 0.00 0.00 175.10 175.27 1ss8 s ILE 301 N 1.53 5.27 -0.12 2.22 1.01 -0.83 -4.98 121.20 125.30 1ss8 s ILE 301 Ca 0.53 -1.85 -0.01 0.00 0.00 0.00 0.00 60.65 59.33 1ss8 s ILE 301 Cb -0.23 -4.47 -0.02 0.00 0.01 0.00 0.00 42.46 37.75 1ss8 s ILE 301 CO 0.24 -1.06 -0.08 -0.94 0.00 0.00 0.00 174.94 173.10 1ss8 s SER 302 N 2.98 4.46 0.02 3.58 1.04 -1.26 -2.06 113.70 122.45 1ss8 s SER 302 Ca 0.14 -0.16 0.22 0.00 0.48 0.00 0.00 55.95 56.62 1ss8 s SER 302 Cb -0.17 -1.49 0.91 0.00 0.10 0.00 0.00 66.02 65.36 1ss8 s SER 302 CO -0.03 0.24 1.69 -0.62 0.98 0.00 0.00 173.24 175.49 1ss8 n GLU 303 N 3.07 0.02 0.18 4.02 1.02 -1.26 -2.64 120.64 125.05 1ss8 n GLU 303 Ca -0.18 0.15 0.03 0.00 -0.02 0.00 0.00 57.16 57.14 1ss8 n GLU 303 Cb 0.53 -1.53 0.35 0.00 -0.02 0.00 0.00 31.44 30.77 1ss8 n GLU 303 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ss8 h GLU 304 N 0.00 0.00 -0.10 3.49 5.08 -1.91 -1.63 114.58 119.51 1ss8 h GLU 304 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ss8 h GLU 304 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1ss8 h GLU 304 CO 0.00 0.39 0.00 -0.89 -1.00 0.00 0.00 179.01 177.51 1ss8 n ILE 305 N -3.98 0.13 -1.05 3.13 5.41 -1.08 -4.95 119.36 116.96 1ss8 n ILE 305 Ca -0.02 -0.22 -0.02 0.00 1.00 0.00 0.00 62.75 63.50 1ss8 n ILE 305 Cb 0.43 0.13 -0.01 0.00 -0.71 0.00 0.00 39.64 39.49 1ss8 n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ss8 n GLY 306 N 1.01 0.53 3.81 7.39 0.00 -0.61 -5.04 105.19 112.28 1ss8 n GLY 306 Ca 0.16 -0.82 -0.38 0.00 0.00 0.00 0.00 46.02 44.98 1ss8 n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ss8 s MET 307 N -1.85 4.22 0.19 1.61 -1.94 -1.19 -5.00 119.30 115.34 1ss8 s MET 307 Ca 0.00 0.78 0.08 0.00 -1.71 0.00 0.00 55.69 54.84 1ss8 s MET 307 Cb 0.00 -3.13 -0.04 0.00 2.01 0.00 0.00 34.83 33.67 1ss8 s MET 307 CO 0.00 0.56 -0.02 -1.21 -0.01 0.00 0.00 175.02 174.34 1ss8 s GLU 308 N -1.40 2.32 0.51 2.03 2.02 -1.26 -4.13 118.70 118.78 1ss8 s GLU 308 Ca 0.34 -1.18 0.30 0.00 0.02 0.00 0.00 54.97 54.44 1ss8 s GLU 308 Cb -0.19 -2.29 1.21 0.00 0.10 0.00 0.00 34.13 32.97 1ss8 s GLU 308 CO 0.20 0.44 1.93 -0.07 0.02 0.00 0.00 175.26 177.78 1ss8 h LEU 309 N 2.63 0.00 -0.28 1.80 3.38 -1.95 -3.13 115.31 117.76 1ss8 h LEU 309 Ca -0.47 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.33 1ss8 h LEU 309 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ss8 h LEU 309 CO 0.57 0.08 -0.52 -0.33 0.09 0.00 0.00 178.44 178.33 1ss8 h GLU 310 N 0.00 0.84 -1.81 1.13 3.07 -1.93 -3.23 114.58 112.65 1ss8 h GLU 310 Ca -0.00 -0.54 -0.40 0.00 -0.50 0.00 0.00 59.36 57.92 1ss8 h GLU 310 Cb 0.59 0.06 -0.15 0.00 -0.84 0.00 0.00 28.75 28.41 1ss8 h GLU 310 CO 0.01 1.17 0.34 1.63 -1.40 0.00 0.00 179.01 180.76 1ss8 n LYS 311 N -4.05 2.12 -3.99 2.33 5.02 -1.18 -4.81 118.16 113.59 1ss8 n LYS 311 Ca -0.05 -1.91 -0.28 0.00 -2.02 0.00 0.00 58.31 54.06 1ss8 n LYS 311 Cb 0.61 -1.91 -0.17 0.00 -0.02 0.00 0.00 35.03 33.54 1ss8 n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ss8 s ALA 312 N -1.53 1.49 0.34 7.82 0.00 -1.22 -4.87 121.76 123.78 1ss8 s ALA 312 Ca 0.48 -0.65 0.04 0.00 0.00 0.00 0.00 51.96 51.83 1ss8 s ALA 312 Cb 0.32 -0.93 0.05 0.00 0.00 0.00 0.00 23.12 22.56 1ss8 s ALA 312 CO -0.12 -0.37 0.43 0.25 0.00 0.00 0.00 175.76 175.95 1ss8 n THR 313 N 4.81 0.00 -0.08 0.00 -2.24 -1.26 -4.39 114.28 111.13 1ss8 n THR 313 Ca -0.14 -0.96 -0.00 0.00 -2.27 0.00 0.00 64.05 60.67 1ss8 n THR 313 Cb 0.50 -0.81 0.28 0.00 -2.10 0.00 0.00 70.33 68.20 1ss8 n THR 313 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ss8 h LEU 314 N 0.00 0.63 -1.32 3.22 3.38 -1.94 -2.95 115.31 116.34 1ss8 h LEU 314 Ca -0.14 -0.08 0.23 0.00 0.09 0.00 0.00 57.88 57.97 1ss8 h LEU 314 Cb 0.64 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.14 1ss8 h LEU 314 CO 0.20 0.59 0.63 -0.08 0.09 0.00 0.00 178.44 179.87 1ss8 h GLU 315 N 0.69 0.48 0.00 1.13 4.81 -2.00 -1.09 114.58 118.60 1ss8 h GLU 315 Ca 0.16 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1ss8 h GLU 315 Cb 0.18 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 1ss8 h GLU 315 CO -0.01 0.32 -0.13 -0.44 -0.73 0.00 0.00 179.01 178.02 1ss8 h ASP 316 N 0.49 0.00 -3.45 1.04 3.32 -1.89 -3.45 116.42 112.48 1ss8 h ASP 316 Ca 0.55 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 57.06 1ss8 h ASP 316 Cb 1.24 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.76 1ss8 h ASP 316 CO -0.28 0.13 0.19 -0.76 -1.72 0.00 0.00 179.24 176.79 1ss8 s LEU 317 N -6.59 4.47 0.84 1.55 1.02 -0.42 0.19 118.68 119.75 1ss8 s LEU 317 Ca 0.00 1.51 -0.12 0.00 0.02 0.00 0.00 54.13 55.54 1ss8 s LEU 317 Cb 0.10 -3.28 0.10 0.00 0.02 0.00 0.00 46.19 43.13 1ss8 s LEU 317 CO 0.59 0.02 1.10 -0.83 0.02 0.00 0.00 176.35 177.26 1ss8 s GLY 318 N -0.13 1.61 0.04 -3.19 0.00 -0.34 -4.57 107.32 100.74 1ss8 s GLY 318 Ca 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 44.72 44.84 1ss8 s GLY 318 CO 0.24 0.21 0.01 1.62 0.00 0.00 0.00 173.10 175.18 1ss8 s GLN 319 N -5.14 0.52 0.08 2.90 0.74 -0.08 0.68 119.66 119.36 1ss8 s GLN 319 Ca 0.62 -0.92 -0.18 0.00 0.05 0.00 0.00 55.36 54.93 1ss8 s GLN 319 Cb -0.15 0.19 0.04 0.00 1.10 0.00 0.00 33.01 34.19 1ss8 s GLN 319 CO 0.55 -0.11 0.43 0.00 -0.55 0.00 0.00 175.29 175.61 1ss8 s ALA 320 N -2.87 -1.04 0.31 1.58 0.00 -1.16 -1.24 121.76 117.34 1ss8 s ALA 320 Ca -0.03 0.22 0.14 0.00 0.00 0.00 0.00 51.96 52.30 1ss8 s ALA 320 Cb 0.00 0.50 0.67 0.00 0.00 0.00 0.00 23.12 24.29 1ss8 s ALA 320 CO -0.06 -0.54 1.77 0.87 0.00 0.00 0.00 175.76 177.80 1ss8 h LYS 321 N 2.71 0.00 -1.92 0.00 1.57 -0.81 -2.98 116.57 115.15 1ss8 h LYS 321 Ca -0.32 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.43 1ss8 h LYS 321 Cb 1.23 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.33 1ss8 h LYS 321 CO 0.44 0.42 0.22 0.50 -0.57 0.00 0.00 179.45 180.46 1ss8 s ARG 322 N -3.94 0.86 0.03 3.15 3.52 -0.96 -1.37 118.95 120.24 1ss8 s ARG 322 Ca -0.02 0.63 0.02 0.00 -0.13 0.00 0.00 55.73 56.23 1ss8 s ARG 322 Cb 0.13 0.41 -0.02 0.00 -1.56 0.00 0.00 34.95 33.92 1ss8 s ARG 322 CO 0.72 -0.18 -0.06 0.14 -0.81 0.00 0.00 175.30 175.11 1ss8 s VAL 323 N -0.29 0.40 -0.06 7.11 -7.23 -0.98 -0.51 120.40 118.84 1ss8 s VAL 323 Ca -0.04 -0.83 -0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1ss8 s VAL 323 Cb -0.03 -0.46 0.03 0.00 0.56 0.00 0.00 36.38 36.48 1ss8 s VAL 323 CO 0.03 -0.29 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.84 1ss8 s VAL 324 N -1.08 0.36 -0.03 1.32 1.01 -0.44 -1.48 120.40 120.07 1ss8 s VAL 324 Ca -0.08 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.07 1ss8 s VAL 324 Cb -0.08 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.78 1ss8 s VAL 324 CO 0.00 0.25 -0.25 0.27 0.00 0.00 0.00 175.10 175.37 1ss8 s ILE 325 N 1.80 1.97 0.37 2.22 -0.00 0.72 -1.10 121.20 127.17 1ss8 s ILE 325 Ca 0.02 -1.05 0.06 0.00 -0.00 0.00 0.00 60.65 59.68 1ss8 s ILE 325 Cb -0.13 -1.64 0.06 0.00 -0.00 0.00 0.00 42.46 40.75 1ss8 s ILE 325 CO -0.04 0.55 0.47 0.59 -0.00 0.00 0.00 174.94 176.51 1ss8 n ASN 326 N 2.62 1.48 -0.26 4.36 3.02 0.10 -1.20 115.26 125.39 1ss8 n ASN 326 Ca -0.16 -2.02 0.06 0.00 -0.03 0.00 0.00 54.58 52.42 1ss8 n ASN 326 Cb 0.52 -0.23 0.29 0.00 -0.61 0.00 0.00 39.78 39.75 1ss8 n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ss8 h LYS 327 N 0.00 0.88 -0.17 3.52 3.64 -1.94 -1.51 116.57 120.99 1ss8 h LYS 327 Ca -0.18 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 58.95 1ss8 h LYS 327 Cb 0.80 -0.20 -0.35 0.00 -0.41 0.00 0.00 32.23 32.06 1ss8 h LYS 327 CO 0.26 0.58 -0.95 -0.40 -2.27 0.00 0.00 179.45 176.67 1ss8 n ASP 328 N -4.49 0.88 -3.70 4.20 5.68 -1.26 -3.90 116.55 113.96 1ss8 n ASP 328 Ca 0.13 -2.02 -0.14 0.00 -0.50 0.00 0.00 54.79 52.26 1ss8 n ASP 328 Cb 0.23 -0.25 -0.09 0.00 -1.14 0.00 0.00 41.12 39.88 1ss8 n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ss8 s THR 329 N -1.54 0.01 -0.06 2.12 2.01 -1.17 -3.65 115.64 113.36 1ss8 s THR 329 Ca 0.26 -0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1ss8 s THR 329 Cb 0.33 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 72.16 1ss8 s THR 329 CO -0.10 -0.06 -0.09 -0.89 -0.69 0.00 0.00 174.62 172.78 1ss8 s THR 330 N -0.34 0.93 -0.07 -0.82 2.01 -0.54 0.03 115.64 116.83 1ss8 s THR 330 Ca -0.05 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1ss8 s THR 330 Cb -0.03 -0.88 0.02 0.00 0.01 0.00 0.00 72.50 71.62 1ss8 s THR 330 CO 0.03 0.31 -0.09 0.28 -0.69 0.00 0.00 174.62 174.46 1ss8 s THR 331 N 0.82 0.96 -0.27 -0.82 -1.32 -0.26 -1.50 115.64 113.25 1ss8 s THR 331 Ca -0.12 -0.34 -0.08 0.00 -1.21 0.00 0.00 61.69 59.94 1ss8 s THR 331 Cb -0.15 -0.92 -0.02 0.00 -1.51 0.00 0.00 72.50 69.89 1ss8 s THR 331 CO 0.02 0.33 0.10 -0.63 -2.21 0.00 0.00 174.62 172.22 1ss8 s ILE 332 N 1.01 4.41 -0.17 5.08 1.01 0.00 -1.32 121.20 131.22 1ss8 s ILE 332 Ca -0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 60.65 60.31 1ss8 s ILE 332 Cb -0.15 -3.12 -0.00 0.00 0.01 0.00 0.00 42.46 39.20 1ss8 s ILE 332 CO -0.00 0.25 -0.13 -0.63 0.00 0.00 0.00 174.94 174.43 1ss8 s ILE 333 N 1.61 2.84 -0.38 2.92 1.01 0.33 -1.58 121.20 127.95 1ss8 s ILE 333 Ca 0.06 -0.70 -0.13 0.00 0.00 0.00 0.00 60.65 59.87 1ss8 s ILE 333 Cb -0.16 -2.22 0.02 0.00 0.01 0.00 0.00 42.46 40.11 1ss8 s ILE 333 CO 0.05 0.50 0.52 -0.67 0.00 0.00 0.00 174.94 175.33 1ss8 n ASP 334 N 4.15 -7.08 -4.76 3.58 -0.08 -0.41 -2.24 116.55 109.71 1ss8 n ASP 334 Ca -0.19 0.43 -0.39 0.00 -1.51 0.00 0.00 54.79 53.13 1ss8 n ASP 334 Cb 0.52 -4.75 -0.05 0.00 2.34 0.00 0.00 41.12 39.17 1ss8 n ASP 334 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1ss8 s GLY 335 N -2.39 2.69 0.56 0.27 0.00 -1.01 -1.52 107.32 105.92 1ss8 s GLY 335 Ca 0.20 0.13 0.27 0.00 0.00 0.00 0.00 44.72 45.32 1ss8 s GLY 335 CO 0.65 0.84 2.20 -2.08 0.00 0.00 0.00 173.10 174.71 1ss8 h VAL 336 N 4.03 0.61 -1.07 1.40 2.07 -1.26 -3.45 116.25 118.57 1ss8 h VAL 336 Ca -0.45 -0.14 -0.59 0.00 0.82 0.00 0.00 66.70 66.34 1ss8 h VAL 336 Cb 1.20 1.09 0.11 0.00 -1.52 0.00 0.00 31.29 32.17 1ss8 h VAL 336 CO 0.69 0.03 -0.58 0.61 0.02 0.00 0.00 177.57 178.34 1ss8 n GLY 337 N -1.20 -1.83 3.79 2.17 0.00 -0.74 -4.80 105.19 102.58 1ss8 n GLY 337 Ca -0.03 0.22 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1ss8 n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ss8 s GLU 338 N -0.90 4.48 0.38 1.61 2.02 -1.26 -4.89 118.70 120.14 1ss8 s GLU 338 Ca 0.56 1.29 0.07 0.00 0.02 0.00 0.00 54.97 56.92 1ss8 s GLU 338 Cb -0.76 -2.65 0.81 0.00 0.10 0.00 0.00 34.13 31.63 1ss8 s GLU 338 CO 0.52 0.19 1.98 0.93 0.02 0.00 0.00 175.26 178.90 1ss8 h GLU 339 N 2.85 0.65 -0.07 1.61 4.39 -1.96 -1.48 114.58 120.56 1ss8 h GLU 339 Ca -0.47 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.18 1ss8 h GLU 339 Cb 1.19 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.69 1ss8 h GLU 339 CO 0.64 0.43 0.01 0.00 -1.16 0.00 0.00 179.01 178.92 1ss8 h ALA 340 N 1.64 0.10 -0.70 3.43 0.00 -1.99 -1.07 119.26 120.68 1ss8 h ALA 340 Ca 0.28 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 340 Cb 0.26 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ss8 h ALA 340 CO -0.09 -0.25 0.45 0.00 0.00 0.00 0.00 179.25 179.37 1ss8 h ALA 341 N 0.76 0.89 -0.55 0.00 0.00 -1.77 -0.40 119.26 118.18 1ss8 h ALA 341 Ca 0.02 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1ss8 h ALA 341 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ss8 h ALA 341 CO 0.00 0.32 0.03 0.82 0.00 0.00 0.00 179.25 180.42 1ss8 h ILE 342 N 0.95 1.26 -0.63 0.00 2.04 -1.34 -1.79 117.51 118.00 1ss8 h ILE 342 Ca 0.25 -1.07 -0.06 0.00 1.00 0.00 0.00 64.86 64.99 1ss8 h ILE 342 Cb -0.09 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1ss8 h ILE 342 CO -0.05 0.38 0.18 1.56 0.00 0.00 0.00 178.15 180.22 1ss8 h GLN 343 N 0.83 0.99 -0.44 2.37 1.08 -0.77 -1.99 115.11 117.18 1ss8 h GLN 343 Ca 0.16 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1ss8 h GLN 343 Cb 0.50 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.77 1ss8 h GLN 343 CO 0.02 0.89 0.25 0.78 -0.95 0.00 0.00 178.83 179.82 1ss8 h GLY 344 N 0.91 0.64 1.27 3.46 0.00 -0.96 -1.27 103.07 107.12 1ss8 h GLY 344 Ca 0.20 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.26 1ss8 h GLY 344 CO -0.00 0.27 0.49 -0.09 0.00 0.00 0.00 176.54 177.20 1ss8 h ARG 345 N 0.58 0.98 -0.15 4.80 9.65 -1.15 -0.46 114.38 128.63 1ss8 h ARG 345 Ca 0.16 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.95 1ss8 h ARG 345 Cb 0.02 -0.22 -0.00 0.00 -1.39 0.00 0.00 29.97 28.38 1ss8 h ARG 345 CO -0.03 0.65 -0.02 0.28 2.80 0.00 0.00 179.97 183.65 1ss8 h VAL 346 N 1.00 1.27 -0.13 0.20 2.07 -0.80 -1.81 116.25 118.06 1ss8 h VAL 346 Ca 0.27 -0.92 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1ss8 h VAL 346 Cb -0.11 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1ss8 h VAL 346 CO -0.06 0.27 0.03 0.00 0.02 0.00 0.00 177.57 177.83 1ss8 h ALA 347 N 0.73 1.81 0.11 1.67 0.00 -1.00 0.68 119.26 123.25 1ss8 h ALA 347 Ca 0.04 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1ss8 h ALA 347 Cb 0.42 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ss8 h ALA 347 CO 0.01 0.15 -0.05 0.37 0.00 0.00 0.00 179.25 179.73 1ss8 h GLN 348 N 0.18 -0.14 -0.48 0.00 4.15 -0.64 -2.54 115.11 115.63 1ss8 h GLN 348 Ca 0.05 0.01 -0.08 0.00 0.77 0.00 0.00 58.65 59.39 1ss8 h GLN 348 Cb 0.08 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 1ss8 h GLN 348 CO -0.00 0.11 -0.03 0.82 -1.93 0.00 0.00 178.83 177.80 1ss8 h ILE 349 N -0.38 1.27 0.00 2.39 2.04 -0.93 -1.87 117.51 120.02 1ss8 h ILE 349 Ca -0.01 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.73 1ss8 h ILE 349 Cb 0.32 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1ss8 h ILE 349 CO 0.02 0.39 0.03 -0.09 0.00 0.00 0.00 178.15 178.50 1ss8 h ARG 350 N 0.73 0.00 0.03 2.37 2.43 -0.81 0.13 114.38 119.26 1ss8 h ARG 350 Ca 0.13 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.99 1ss8 h ARG 350 Cb 0.55 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 1ss8 h ARG 350 CO 0.03 0.00 -1.78 1.04 -1.51 0.00 0.00 179.97 177.75 1ss8 n GLN 351 N -2.64 0.66 0.15 0.20 1.13 -0.75 -3.38 117.38 112.76 1ss8 n GLN 351 Ca -0.02 0.29 0.00 0.00 -1.94 0.00 0.00 57.00 55.33 1ss8 n GLN 351 Cb 0.08 -1.77 0.25 0.00 0.11 0.00 0.00 30.24 28.90 1ss8 n GLN 351 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 1ss8 h GLN 352 N 0.02 0.03 -0.74 -1.09 4.20 -0.26 -1.45 115.11 115.81 1ss8 h GLN 352 Ca -0.32 -0.02 0.11 0.00 0.06 0.00 0.00 58.65 58.48 1ss8 h GLN 352 Cb 2.02 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.75 1ss8 h GLN 352 CO 0.08 0.52 0.49 0.82 -0.67 0.00 0.00 178.83 180.07 1ss8 h ILE 353 N 0.02 0.90 0.00 2.54 2.04 -1.26 0.14 117.51 121.89 1ss8 h ILE 353 Ca -0.00 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 1ss8 h ILE 353 Cb 0.89 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1ss8 h ILE 353 CO 0.07 0.11 -0.24 -0.33 0.00 0.00 0.00 178.15 177.75 1ss8 h GLU 354 N 0.59 0.00 -0.01 2.37 4.39 -1.27 -3.30 114.58 117.34 1ss8 h GLU 354 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1ss8 h GLU 354 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1ss8 h GLU 354 CO -0.12 0.24 0.00 0.39 -1.16 0.00 0.00 179.01 178.36 1ss8 n GLU 355 N -3.95 1.17 -1.70 2.33 1.02 -0.66 -4.99 120.64 113.87 1ss8 n GLU 355 Ca -0.02 -1.08 -0.44 0.00 -0.02 0.00 0.00 57.16 55.61 1ss8 n GLU 355 Cb 0.32 -1.02 -0.03 0.00 -0.02 0.00 0.00 31.44 30.70 1ss8 n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ss8 n ALA 356 N -0.21 1.88 -0.74 0.62 0.00 0.39 -4.86 120.51 117.60 1ss8 n ALA 356 Ca 0.01 0.41 0.08 0.00 0.00 0.00 0.00 53.44 53.93 1ss8 n ALA 356 Cb 0.15 -2.39 0.27 0.00 0.00 0.00 0.00 19.45 17.48 1ss8 n ALA 356 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ss8 n THR 357 N 2.65 1.98 -3.87 0.00 -2.24 -1.26 -4.96 114.28 106.58 1ss8 n THR 357 Ca 0.13 -1.52 -0.12 0.00 -2.27 0.00 0.00 64.05 60.27 1ss8 n THR 357 Cb 0.33 -0.02 -0.13 0.00 -2.10 0.00 0.00 70.33 68.41 1ss8 n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ss8 s SER 358 N -1.43 -0.02 0.15 3.42 0.15 -1.26 -5.05 113.70 109.66 1ss8 s SER 358 Ca 0.41 0.01 -0.25 0.00 0.70 0.00 0.00 55.95 56.82 1ss8 s SER 358 Cb 0.30 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 1ss8 s SER 358 CO 0.14 -0.10 1.61 0.44 1.20 0.00 0.00 173.24 176.53 1ss8 h ASP 359 N 5.67 -1.03 -0.38 5.45 3.32 -1.99 -2.51 116.42 124.95 1ss8 h ASP 359 Ca -0.26 0.16 0.05 0.00 0.02 0.00 0.00 57.03 57.00 1ss8 h ASP 359 Cb 1.20 0.45 -0.05 0.00 0.22 0.00 0.00 39.33 41.16 1ss8 h ASP 359 CO 0.45 -0.34 0.10 0.22 -1.72 0.00 0.00 179.24 177.95 1ss8 h TYR 360 N -0.34 0.17 -0.82 4.55 3.20 -2.00 -1.24 116.97 120.49 1ss8 h TYR 360 Ca 0.12 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1ss8 h TYR 360 Cb 0.54 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 1ss8 h TYR 360 CO -0.45 0.04 0.47 -0.44 -1.64 0.00 0.00 178.16 176.14 1ss8 h ASP 361 N 0.23 1.00 0.40 -2.11 5.19 -1.95 -1.69 116.42 117.48 1ss8 h ASP 361 Ca 0.18 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1ss8 h ASP 361 Cb 0.19 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.43 1ss8 h ASP 361 CO -0.22 0.79 -0.38 -0.09 -3.12 0.00 0.00 179.24 176.22 1ss8 h ARG 362 N 1.12 -0.76 -0.74 3.56 2.43 -0.98 -2.22 114.38 116.78 1ss8 h ARG 362 Ca 0.29 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.56 1ss8 h ARG 362 Cb -0.01 0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 1ss8 h ARG 362 CO -0.05 -0.51 0.46 0.93 -1.51 0.00 0.00 179.97 179.29 1ss8 h GLU 363 N -0.79 0.84 -0.43 0.20 5.08 -0.99 -0.22 114.58 118.27 1ss8 h GLU 363 Ca -0.03 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ss8 h GLU 363 Cb 0.70 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1ss8 h GLU 363 CO -0.05 0.56 0.28 0.87 -1.00 0.00 0.00 179.01 179.66 1ss8 h LYS 364 N 0.87 0.57 0.01 2.33 1.79 -1.25 -1.37 116.57 119.51 1ss8 h LYS 364 Ca 0.31 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1ss8 h LYS 364 Cb 0.08 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 1ss8 h LYS 364 CO -0.14 0.38 -0.00 -0.07 -1.08 0.00 0.00 179.45 178.54 1ss8 h LEU 365 N 0.58 -0.01 -1.47 2.94 3.38 -0.74 -3.13 115.31 116.87 1ss8 h LEU 365 Ca 0.16 -0.81 0.28 0.00 0.09 0.00 0.00 57.88 57.59 1ss8 h LEU 365 Cb -0.06 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.61 1ss8 h LEU 365 CO -0.03 0.82 0.69 1.56 0.09 0.00 0.00 178.44 181.56 1ss8 h GLN 366 N -0.84 0.32 -0.07 1.13 4.20 -0.77 0.12 115.11 119.20 1ss8 h GLN 366 Ca -0.00 -0.02 -0.14 0.00 0.06 0.00 0.00 58.65 58.55 1ss8 h GLN 366 Cb 0.81 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1ss8 h GLN 366 CO 0.00 0.21 -0.56 0.93 -0.67 0.00 0.00 178.83 178.74 1ss8 h GLU 367 N 0.33 0.21 -0.09 1.46 5.08 -1.31 -1.29 114.58 118.97 1ss8 h GLU 367 Ca 0.58 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.70 1ss8 h GLU 367 Cb 1.61 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.88 1ss8 h GLU 367 CO -0.25 0.72 -0.38 0.00 -1.00 0.00 0.00 179.01 178.10 1ss8 h ARG 368 N 0.16 0.41 -0.79 2.33 3.08 -0.74 -3.04 114.38 115.79 1ss8 h ARG 368 Ca -0.00 -0.33 -0.05 0.00 0.07 0.00 0.00 59.98 59.67 1ss8 h ARG 368 Cb 1.04 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.12 1ss8 h ARG 368 CO 0.09 0.96 0.31 -0.39 -1.07 0.00 0.00 179.97 179.86 1ss8 h VAL 369 N -0.04 1.26 -0.94 2.04 -1.51 -1.30 -2.03 116.25 113.75 1ss8 h VAL 369 Ca -0.02 -0.84 0.16 0.00 -1.23 0.00 0.00 66.70 64.76 1ss8 h VAL 369 Cb 1.02 0.33 -0.10 0.00 -2.13 0.00 0.00 31.29 30.41 1ss8 h VAL 369 CO 0.08 0.34 0.54 0.00 -1.23 0.00 0.00 177.57 177.30 1ss8 h ALA 370 N 1.16 1.48 0.20 5.19 0.00 -1.24 0.16 119.26 126.21 1ss8 h ALA 370 Ca 0.26 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1ss8 h ALA 370 Cb 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ss8 h ALA 370 CO -0.02 -0.02 -0.10 0.87 0.00 0.00 0.00 179.25 179.99 1ss8 h LYS 371 N 0.74 -0.26 0.01 0.00 1.57 -1.32 -1.42 116.57 115.89 1ss8 h LYS 371 Ca 0.52 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.32 1ss8 h LYS 371 Cb 0.72 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 1ss8 h LYS 371 CO -0.35 -0.01 -0.06 1.25 -0.57 0.00 0.00 179.45 179.71 1ss8 h LEU 372 N -1.02 -0.17 -0.57 2.94 5.85 -1.27 -2.80 115.31 118.28 1ss8 h LEU 372 Ca -0.03 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ss8 h LEU 372 Cb 0.37 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1ss8 h LEU 372 CO 0.04 -0.09 0.00 0.00 -0.34 0.00 0.00 178.44 178.06 1ss8 n ALA 373 N -2.25 2.57 -0.01 1.25 0.00 0.56 -4.06 120.51 118.58 1ss8 n ALA 373 Ca -0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 53.44 53.04 1ss8 n ALA 373 Cb 0.10 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.23 1ss8 n ALA 373 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 374 N 0.98 -1.11 7.00 0.00 0.00 -0.53 -5.00 105.19 106.52 1ss8 n GLY 374 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1ss8 n GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 375 N 1.46 -0.09 2.87 -0.02 0.00 -1.24 -4.89 105.19 103.29 1ss8 n GLY 375 Ca -0.15 -0.84 -0.18 0.00 0.00 0.00 0.00 46.02 44.85 1ss8 n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ss8 s VAL 376 N 0.00 0.38 -0.04 1.61 1.01 -0.94 -4.49 120.40 117.93 1ss8 s VAL 376 Ca 0.00 -0.05 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 1ss8 s VAL 376 Cb 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1ss8 s VAL 376 CO 0.00 0.18 0.76 0.00 0.00 0.00 0.00 175.10 176.04 1ss8 s ALA 377 N 0.83 3.31 -0.29 5.51 0.00 0.07 -1.92 121.76 129.26 1ss8 s ALA 377 Ca -0.10 0.23 -0.07 0.00 0.00 0.00 0.00 51.96 52.02 1ss8 s ALA 377 Cb -0.13 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1ss8 s ALA 377 CO -0.01 -0.10 0.08 0.08 0.00 0.00 0.00 175.76 175.81 1ss8 s VAL 378 N 0.71 4.01 -0.25 0.00 1.01 0.90 -0.92 120.40 125.87 1ss8 s VAL 378 Ca 0.40 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.57 1ss8 s VAL 378 Cb -0.19 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1ss8 s VAL 378 CO 0.21 0.12 0.63 -0.63 0.00 0.00 0.00 175.10 175.43 1ss8 s ILE 379 N 1.52 4.99 -0.23 2.22 1.01 -0.16 -2.14 121.20 128.40 1ss8 s ILE 379 Ca 0.03 1.14 -0.06 0.00 0.00 0.00 0.00 60.65 61.76 1ss8 s ILE 379 Cb -0.17 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 1ss8 s ILE 379 CO 0.03 0.04 0.04 -0.54 0.00 0.00 0.00 174.94 174.50 1ss8 s LYS 380 N 2.44 3.65 -0.24 2.79 -0.14 0.35 -0.79 119.74 127.80 1ss8 s LYS 380 Ca 0.27 -0.49 -0.22 0.00 -1.36 0.00 0.00 55.97 54.17 1ss8 s LYS 380 Cb -0.16 -3.23 -0.01 0.00 -1.68 0.00 0.00 37.83 32.75 1ss8 s LYS 380 CO 0.09 -0.10 0.70 0.08 -0.76 0.00 0.00 175.35 175.35 1ss8 s VAL 381 N 1.36 4.94 0.15 3.17 1.01 -0.93 -0.81 120.40 129.28 1ss8 s VAL 381 Ca 0.05 1.29 0.03 0.00 0.00 0.00 0.00 61.98 63.35 1ss8 s VAL 381 Cb -0.15 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1ss8 s VAL 381 CO 0.02 0.00 0.25 -0.83 0.00 0.00 0.00 175.10 174.55 1ss8 s GLY 382 N 1.39 1.72 0.14 4.51 0.00 -1.23 -1.29 107.32 112.56 1ss8 s GLY 382 Ca 0.30 -1.07 -0.06 0.00 0.00 0.00 0.00 44.72 43.89 1ss8 s GLY 382 CO 0.08 -1.08 0.29 0.00 0.00 0.00 0.00 173.10 172.40 1ss8 n ALA 383 N -0.49 -0.67 0.01 3.20 0.00 -1.10 -4.75 120.51 116.71 1ss8 n ALA 383 Ca -0.07 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 52.78 1ss8 n ALA 383 Cb 0.54 0.36 -0.14 0.00 0.00 0.00 0.00 19.45 20.22 1ss8 n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ss8 h ALA 384 N 2.00 0.58 -2.24 0.00 0.00 -1.87 -3.33 119.26 114.40 1ss8 h ALA 384 Ca -0.12 -1.35 -0.33 0.00 0.00 0.00 0.00 54.91 53.11 1ss8 h ALA 384 Cb 0.45 0.45 -0.15 0.00 0.00 0.00 0.00 17.79 18.55 1ss8 h ALA 384 CO 0.16 1.43 -0.67 0.95 0.00 0.00 0.00 179.25 181.11 1ss8 s THR 385 N -2.60 0.91 0.21 0.00 -4.23 -1.26 -5.05 115.64 103.62 1ss8 s THR 385 Ca -0.09 -2.02 -0.09 0.00 -1.18 0.00 0.00 61.69 58.31 1ss8 s THR 385 Cb 0.08 -2.12 0.14 0.00 1.34 0.00 0.00 72.50 71.93 1ss8 s THR 385 CO 0.82 -0.49 1.77 -0.08 -0.54 0.00 0.00 174.62 176.10 1ss8 h GLU 386 N 2.64 0.52 -0.47 3.99 4.81 -1.99 -1.96 114.58 122.12 1ss8 h GLU 386 Ca -0.37 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 58.88 1ss8 h GLU 386 Cb 1.21 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.42 1ss8 h GLU 386 CO 0.64 0.34 0.21 0.28 -0.73 0.00 0.00 179.01 179.75 1ss8 h VAL 387 N 0.53 0.92 -0.44 0.32 2.07 -2.00 -1.56 116.25 116.10 1ss8 h VAL 387 Ca 0.30 -0.14 -0.12 0.00 0.82 0.00 0.00 66.70 67.56 1ss8 h VAL 387 Cb 0.29 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1ss8 h VAL 387 CO -0.24 0.08 -0.21 -0.33 0.02 0.00 0.00 177.57 176.88 1ss8 h GLU 388 N 0.42 0.88 0.27 1.57 5.08 -1.91 -2.73 114.58 118.15 1ss8 h GLU 388 Ca 0.21 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1ss8 h GLU 388 Cb 0.16 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1ss8 h GLU 388 CO -0.18 1.00 -0.19 1.98 -1.00 0.00 0.00 179.01 180.63 1ss8 h MET 389 N 0.76 -0.44 -0.21 2.33 4.05 -1.00 -0.63 114.93 119.79 1ss8 h MET 389 Ca 0.10 0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.52 1ss8 h MET 389 Cb 0.75 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.64 1ss8 h MET 389 CO 0.06 -0.29 -0.04 0.87 0.23 0.00 0.00 176.91 177.74 1ss8 h LYS 390 N -0.46 0.31 -0.13 0.39 1.79 -1.25 0.94 116.57 118.17 1ss8 h LYS 390 Ca -0.02 -0.06 -0.22 0.00 -2.18 0.00 0.00 60.65 58.18 1ss8 h LYS 390 Cb 0.40 -0.05 0.01 0.00 -1.58 0.00 0.00 32.23 31.00 1ss8 h LYS 390 CO 0.00 0.37 -0.79 0.93 -1.08 0.00 0.00 179.45 178.89 1ss8 h GLU 391 N 0.30 0.70 -0.53 3.15 5.08 -1.36 -2.50 114.58 119.42 1ss8 h GLU 391 Ca 0.07 -0.59 -0.11 0.00 -1.00 0.00 0.00 59.36 57.73 1ss8 h GLU 391 Cb 0.27 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1ss8 h GLU 391 CO 0.01 1.20 -0.10 -0.22 -1.00 0.00 0.00 179.01 178.90 1ss8 h LYS 392 N 0.47 0.99 -0.33 2.33 3.64 -0.38 -1.67 116.57 121.62 1ss8 h LYS 392 Ca -0.05 -0.35 0.03 0.00 -1.27 0.00 0.00 60.65 59.01 1ss8 h LYS 392 Cb 1.41 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 1ss8 h LYS 392 CO 0.16 1.03 0.13 -0.22 -2.27 0.00 0.00 179.45 178.27 1ss8 h LYS 393 N 0.88 0.27 -0.98 1.90 3.64 -0.82 0.27 116.57 121.74 1ss8 h LYS 393 Ca 0.14 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1ss8 h LYS 393 Cb 0.65 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.36 1ss8 h LYS 393 CO 0.04 0.18 0.65 0.00 -2.27 0.00 0.00 179.45 178.05 1ss8 h ALA 394 N 1.20 1.25 -0.08 5.00 0.00 -1.30 -0.51 119.26 124.82 1ss8 h ALA 394 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ss8 h ALA 394 Cb 0.10 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1ss8 h ALA 394 CO -0.14 0.62 0.03 0.00 0.00 0.00 0.00 179.25 179.77 1ss8 h ARG 395 N 1.32 0.11 -0.31 0.00 3.08 -0.26 -1.34 114.38 116.98 1ss8 h ARG 395 Ca 0.36 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.45 1ss8 h ARG 395 Cb -0.14 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.84 1ss8 h ARG 395 CO -0.08 0.23 -0.02 0.28 -1.07 0.00 0.00 179.97 179.31 1ss8 h VAL 396 N -0.03 0.74 -0.39 2.04 2.07 -0.27 0.13 116.25 120.55 1ss8 h VAL 396 Ca 0.03 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.59 1ss8 h VAL 396 Cb 0.16 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1ss8 h VAL 396 CO -0.00 0.01 0.03 -0.33 0.02 0.00 0.00 177.57 177.30 1ss8 h GLU 397 N 0.06 0.13 0.56 1.57 5.08 -0.84 0.34 114.58 121.48 1ss8 h GLU 397 Ca 0.15 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 1ss8 h GLU 397 Cb 0.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1ss8 h GLU 397 CO -0.28 0.09 -0.27 -0.44 -1.00 0.00 0.00 179.01 177.11 1ss8 h ASP 398 N 0.14 -0.64 -1.00 1.42 3.32 -0.97 -2.30 116.42 116.38 1ss8 h ASP 398 Ca 0.19 0.02 0.16 0.00 0.02 0.00 0.00 57.03 57.43 1ss8 h ASP 398 Cb 0.25 0.17 -0.10 0.00 0.22 0.00 0.00 39.33 39.88 1ss8 h ASP 398 CO -0.29 -0.46 0.62 0.00 -1.72 0.00 0.00 179.24 177.39 1ss8 h ALA 399 N -0.30 1.65 -0.15 3.45 0.00 -0.69 -1.46 119.26 121.76 1ss8 h ALA 399 Ca -0.08 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 399 Cb 0.58 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1ss8 h ALA 399 CO 0.12 0.03 0.05 1.25 0.00 0.00 0.00 179.25 180.70 1ss8 h LEU 400 N 0.83 0.22 -0.41 0.00 5.85 -0.07 -0.40 115.31 121.34 1ss8 h LEU 400 Ca 0.54 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 59.09 1ss8 h LEU 400 Cb 0.76 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1ss8 h LEU 400 CO -0.33 0.37 0.18 0.45 -0.34 0.00 0.00 178.44 178.78 1ss8 h HIS 401 N 0.07 0.34 -0.83 1.25 3.86 -0.84 0.19 115.15 119.18 1ss8 h HIS 401 Ca 0.05 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.31 1ss8 h HIS 401 Cb 0.23 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.55 1ss8 h HIS 401 CO -0.00 0.16 0.53 0.00 0.86 0.00 0.00 177.93 179.49 1ss8 h ALA 402 N 1.23 1.09 -0.03 2.45 0.00 -1.16 -2.25 119.26 120.59 1ss8 h ALA 402 Ca 0.18 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 1ss8 h ALA 402 Cb 0.11 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ss8 h ALA 402 CO -0.14 0.37 -0.93 1.15 0.00 0.00 0.00 179.25 179.69 1ss8 h THR 403 N 1.04 1.35 -0.56 0.00 2.02 -0.58 0.05 112.91 116.22 1ss8 h THR 403 Ca 0.33 -2.30 0.10 0.00 0.77 0.00 0.00 66.41 65.31 1ss8 h THR 403 Cb 0.00 2.32 -0.08 0.00 -1.74 0.00 0.00 68.15 68.65 1ss8 h THR 403 CO -0.11 0.70 0.11 -0.09 0.37 0.00 0.00 175.52 176.50 1ss8 h ARG 404 N 0.32 0.24 -0.41 6.66 1.12 -0.84 -0.73 114.38 120.73 1ss8 h ARG 404 Ca -0.09 -0.01 -0.12 0.00 -1.11 0.00 0.00 59.98 58.65 1ss8 h ARG 404 Cb 1.57 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 31.46 1ss8 h ARG 404 CO 0.17 0.16 -0.23 0.00 -3.11 0.00 0.00 179.97 176.96 1ss8 h ALA 405 N 1.45 0.81 -0.20 2.80 0.00 -1.09 -2.65 119.26 120.39 1ss8 h ALA 405 Ca 0.29 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1ss8 h ALA 405 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1ss8 h ALA 405 CO -0.38 0.65 -0.26 0.00 0.00 0.00 0.00 179.25 179.26 1ss8 h ALA 406 N 1.01 1.20 0.00 0.00 0.00 -0.27 -2.08 119.26 119.12 1ss8 h ALA 406 Ca 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1ss8 h ALA 406 Cb 0.76 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1ss8 h ALA 406 CO 0.06 0.52 -0.05 -0.39 0.00 0.00 0.00 179.25 179.39 1ss8 h VAL 407 N 0.33 0.11 -0.05 0.00 -1.51 -0.81 -1.30 116.25 113.01 1ss8 h VAL 407 Ca 0.05 -0.87 -0.08 0.00 -1.23 0.00 0.00 66.70 64.57 1ss8 h VAL 407 Cb 0.63 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.58 1ss8 h VAL 407 CO 0.05 0.05 -0.28 -0.33 -1.23 0.00 0.00 177.57 175.82 1ss8 h GLU 408 N 0.00 0.28 0.00 5.19 5.08 -1.12 -3.42 114.58 120.59 1ss8 h GLU 408 Ca -0.00 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1ss8 h GLU 408 Cb 0.78 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1ss8 h GLU 408 CO 0.01 0.89 0.00 0.39 -1.00 0.00 0.00 179.01 179.30 1ss8 n GLU 409 N -4.47 0.00 0.00 2.33 1.02 -1.11 -5.10 120.64 113.32 1ss8 n GLU 409 Ca -0.09 -0.23 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 1ss8 n GLU 409 Cb 0.49 -0.38 0.00 0.00 -0.02 0.00 0.00 31.44 31.53 1ss8 n GLU 409 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ss8 n GLY 410 N 0.00 -1.84 3.17 0.62 0.00 -0.49 -4.52 105.19 102.12 1ss8 n GLY 410 Ca 0.00 -1.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.12 1ss8 n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ss8 s VAL 411 N 0.00 1.15 0.08 1.61 0.11 -0.87 -0.12 120.40 122.36 1ss8 s VAL 411 Ca 0.00 -1.18 -0.02 0.00 -2.93 0.00 0.00 61.98 57.85 1ss8 s VAL 411 Cb 0.00 -1.07 -0.03 0.00 -1.53 0.00 0.00 36.38 33.74 1ss8 s VAL 411 CO 0.00 -0.10 0.02 0.68 -3.33 0.00 0.00 175.10 172.37 1ss8 s VAL 412 N -1.07 0.18 -0.00 2.04 -7.23 -0.26 -1.65 120.40 112.41 1ss8 s VAL 412 Ca 0.00 -1.75 -0.38 0.00 -1.81 0.00 0.00 61.98 58.05 1ss8 s VAL 412 Cb -0.09 -1.63 -0.17 0.00 0.56 0.00 0.00 36.38 35.06 1ss8 s VAL 412 CO 0.02 -0.82 1.42 0.00 -0.31 0.00 0.00 175.10 175.41 1ss8 n ALA 413 N 0.03 -0.90 -1.24 1.32 0.00 -1.26 -1.66 120.51 116.80 1ss8 n ALA 413 Ca -0.12 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1ss8 n ALA 413 Cb 0.62 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1ss8 n ALA 413 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 414 N 2.86 -0.04 3.28 0.00 0.00 0.69 -2.20 105.19 109.78 1ss8 n GLY 414 Ca 0.20 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.27 1ss8 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 415 N 5.00 -0.50 2.54 -0.02 0.00 -1.26 -0.73 105.19 110.21 1ss8 n GLY 415 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ss8 n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 416 N -1.32 2.52 0.17 -0.02 0.00 -1.26 -4.58 105.19 100.69 1ss8 n GLY 416 Ca -0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 1ss8 n GLY 416 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ss8 h VAL 417 N 0.00 1.34 -0.76 1.61 2.07 -1.09 -2.96 116.25 116.46 1ss8 h VAL 417 Ca 0.00 -1.54 0.14 0.00 0.82 0.00 0.00 66.70 66.12 1ss8 h VAL 417 Cb 0.00 1.90 -0.09 0.00 -1.52 0.00 0.00 31.29 31.57 1ss8 h VAL 417 CO 0.00 0.47 0.30 0.00 0.02 0.00 0.00 177.57 178.36 1ss8 h ALA 418 N 0.59 1.06 -0.25 1.67 0.00 -1.63 0.28 119.26 120.98 1ss8 h ALA 418 Ca 0.01 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ss8 h ALA 418 Cb 0.89 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1ss8 h ALA 418 CO 0.07 -0.21 0.09 -0.07 0.00 0.00 0.00 179.25 179.13 1ss8 h LEU 419 N 0.45 0.36 -0.98 0.00 3.38 -1.83 -0.44 115.31 116.24 1ss8 h LEU 419 Ca 0.41 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 58.10 1ss8 h LEU 419 Cb 0.63 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1ss8 h LEU 419 CO -0.40 0.44 -0.50 -0.29 0.09 0.00 0.00 178.44 177.78 1ss8 h ILE 420 N 0.25 1.34 0.22 1.22 2.10 -1.28 -2.33 117.51 119.03 1ss8 h ILE 420 Ca 0.08 -1.74 -0.01 0.00 1.08 0.00 0.00 64.86 64.27 1ss8 h ILE 420 Cb 0.20 1.94 0.00 0.00 -1.09 0.00 0.00 36.82 37.88 1ss8 h ILE 420 CO -0.01 0.49 -0.11 -0.09 -1.08 0.00 0.00 178.15 177.36 1ss8 h ARG 421 N 0.00 -0.29 -0.18 2.19 9.65 0.53 -1.26 114.38 125.03 1ss8 h ARG 421 Ca -0.01 0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.85 1ss8 h ARG 421 Cb 0.90 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.54 1ss8 h ARG 421 CO 0.07 -0.03 -0.08 -0.39 2.80 0.00 0.00 179.97 182.33 1ss8 h VAL 422 N -0.52 1.16 -0.70 0.20 -1.51 -1.06 -2.23 116.25 111.59 1ss8 h VAL 422 Ca -0.03 -0.70 -0.05 0.00 -1.23 0.00 0.00 66.70 64.69 1ss8 h VAL 422 Cb 0.39 1.13 -0.03 0.00 -2.13 0.00 0.00 31.29 30.64 1ss8 h VAL 422 CO 0.05 0.22 0.26 0.00 -1.23 0.00 0.00 177.57 176.87 1ss8 h ALA 423 N 1.66 0.92 0.00 5.19 0.00 -1.16 -2.46 119.26 123.40 1ss8 h ALA 423 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ss8 h ALA 423 Cb 0.32 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ss8 h ALA 423 CO 0.02 0.56 0.00 -1.13 0.00 0.00 0.00 179.25 178.69 1ss8 n SER 424 N -4.34 0.36 0.10 0.00 3.41 -0.50 -1.59 113.62 111.05 1ss8 n SER 424 Ca 0.05 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 1ss8 n SER 424 Cb 0.19 -0.66 0.20 0.00 -0.26 0.00 0.00 64.21 63.68 1ss8 n SER 424 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ss8 h LYS 425 N 0.00 0.00 -0.91 4.33 1.57 -1.29 -3.37 116.57 116.90 1ss8 h LYS 425 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 60.65 58.35 1ss8 h LYS 425 Cb 0.35 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 32.40 1ss8 h LYS 425 CO 0.00 0.00 0.54 1.28 -0.57 0.00 0.00 179.45 180.70 1ss8 n LEU 426 N -2.39 6.48 0.19 2.94 4.77 -0.62 -4.62 117.00 123.75 1ss8 n LEU 426 Ca 0.03 -3.53 0.05 0.00 -0.03 0.00 0.00 56.01 52.53 1ss8 n LEU 426 Cb 0.47 -0.81 0.48 0.00 -2.33 0.00 0.00 43.42 41.23 1ss8 n LEU 426 CO 0.35 1.01 0.92 0.00 -1.33 0.00 0.00 177.39 178.34 1ss8 h ALA 427 N 1.39 1.68 -0.02 -1.18 0.00 -1.74 -1.34 119.26 118.04 1ss8 h ALA 427 Ca 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1ss8 h ALA 427 Cb 2.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 20.44 1ss8 h ALA 427 CO 0.99 0.24 0.00 -0.25 0.00 0.00 0.00 179.25 180.23 1ss8 n ASP 428 N -4.34 0.61 -4.72 0.00 8.00 -1.26 -4.94 116.55 109.91 1ss8 n ASP 428 Ca -0.02 -1.27 -0.42 0.00 0.71 0.00 0.00 54.79 53.79 1ss8 n ASP 428 Cb 0.23 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.29 1ss8 n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ss8 s LEU 429 N -1.91 4.37 0.42 0.64 2.96 -0.51 -5.02 118.68 119.64 1ss8 s LEU 429 Ca 0.41 2.70 0.04 0.00 -0.22 0.00 0.00 54.13 57.06 1ss8 s LEU 429 Cb 0.20 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.25 1ss8 s LEU 429 CO 0.33 -0.89 0.04 -0.13 -1.32 0.00 0.00 176.35 174.38 1ss8 s ARG 430 N 1.30 1.96 0.03 1.98 1.81 -1.26 -4.96 118.95 119.81 1ss8 s ARG 430 Ca 0.72 -2.17 0.00 0.00 -1.72 0.00 0.00 55.73 52.56 1ss8 s ARG 430 Cb -0.46 -1.25 -0.00 0.00 -0.45 0.00 0.00 34.95 32.79 1ss8 s ARG 430 CO 0.32 -0.26 0.00 0.41 -0.68 0.00 0.00 175.30 175.09 1ss8 n GLY 431 N -0.99 4.12 0.15 -3.53 0.00 -1.26 -5.00 105.19 98.67 1ss8 n GLY 431 Ca -0.09 -2.10 0.13 0.00 0.00 0.00 0.00 46.02 43.96 1ss8 n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ss8 h GLN 432 N 0.00 0.00 0.00 1.61 4.20 -1.99 -3.47 115.11 115.46 1ss8 h GLN 432 Ca -0.02 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.74 1ss8 h GLN 432 Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1ss8 h GLN 432 CO 0.04 0.00 0.21 0.27 -0.67 0.00 0.00 178.83 178.67 1ss8 n ASN 433 N -2.37 -0.64 0.08 1.46 0.23 -1.26 -5.04 115.26 107.72 1ss8 n ASN 433 Ca 0.02 -1.34 -0.07 0.00 -0.53 0.00 0.00 54.58 52.66 1ss8 n ASN 433 Cb 0.26 1.04 0.07 0.00 -2.08 0.00 0.00 39.78 39.07 1ss8 n ASN 433 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1ss8 h GLU 434 N 0.00 0.25 -0.14 -3.83 4.57 -1.99 -0.92 114.58 112.51 1ss8 h GLU 434 Ca -0.10 -0.20 -0.16 0.00 -1.18 0.00 0.00 59.36 57.72 1ss8 h GLU 434 Cb 0.43 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 1ss8 h GLU 434 CO 0.13 0.85 -0.60 -0.44 -1.18 0.00 0.00 179.01 177.78 1ss8 h ASP 435 N 0.17 0.53 -0.22 1.04 3.32 -1.96 -2.07 116.42 117.24 1ss8 h ASP 435 Ca -0.02 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 56.69 1ss8 h ASP 435 Cb 1.25 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.63 1ss8 h ASP 435 CO 0.11 1.01 0.02 1.56 -1.72 0.00 0.00 179.24 180.22 1ss8 h GLN 436 N 0.35 0.49 -0.10 3.56 4.20 -1.44 -0.59 115.11 121.58 1ss8 h GLN 436 Ca -0.00 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 1ss8 h GLN 436 Cb 1.14 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1ss8 h GLN 436 CO 0.11 0.50 0.00 -0.91 -0.67 0.00 0.00 178.83 177.86 1ss8 h ASN 437 N 0.47 0.17 -0.37 1.46 -0.26 -0.69 0.11 115.58 116.47 1ss8 h ASN 437 Ca 0.11 -0.30 0.01 0.00 -0.56 0.00 0.00 56.30 55.55 1ss8 h ASN 437 Cb 0.28 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.47 1ss8 h ASN 437 CO 0.01 0.44 0.25 -0.37 -1.06 0.00 0.00 177.43 176.69 1ss8 h VAL 438 N -0.09 1.09 -0.48 2.81 -1.51 -1.00 -1.10 116.25 115.97 1ss8 h VAL 438 Ca 0.03 -0.17 0.07 0.00 -1.23 0.00 0.00 66.70 65.40 1ss8 h VAL 438 Cb 0.35 0.55 -0.10 0.00 -2.13 0.00 0.00 31.29 29.96 1ss8 h VAL 438 CO 0.00 0.09 -0.45 1.23 -1.23 0.00 0.00 177.57 177.21 1ss8 h GLY 439 N 0.49 -0.60 0.18 5.19 0.00 -0.38 0.36 103.07 108.32 1ss8 h GLY 439 Ca 0.14 0.58 0.04 0.00 0.00 0.00 0.00 47.33 48.09 1ss8 h GLY 439 CO -0.03 -0.16 -0.35 -2.22 0.00 0.00 0.00 176.54 173.78 1ss8 h ILE 440 N -0.30 0.25 -1.00 2.60 2.04 -0.08 -2.03 117.51 118.99 1ss8 h ILE 440 Ca 0.14 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.13 1ss8 h ILE 440 Cb 0.58 0.25 -0.09 0.00 -0.74 0.00 0.00 36.82 36.83 1ss8 h ILE 440 CO -0.63 0.00 0.63 0.11 0.00 0.00 0.00 178.15 178.27 1ss8 h LYS 441 N -0.46 0.95 -0.25 2.37 1.79 -0.59 -0.81 116.57 119.57 1ss8 h LYS 441 Ca 0.08 -0.06 0.06 0.00 -2.18 0.00 0.00 60.65 58.54 1ss8 h LYS 441 Cb 0.58 -0.21 -0.05 0.00 -1.58 0.00 0.00 32.23 30.96 1ss8 h LYS 441 CO -0.33 0.63 -0.11 0.28 -1.08 0.00 0.00 179.45 178.84 1ss8 h VAL 442 N 0.98 0.65 -0.00 0.50 2.07 0.25 -1.67 116.25 119.03 1ss8 h VAL 442 Ca 0.50 0.00 0.01 0.00 0.82 0.00 0.00 66.70 68.03 1ss8 h VAL 442 Cb 0.51 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1ss8 h VAL 442 CO -0.27 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.27 1ss8 h ALA 443 N 1.15 -0.05 -0.96 1.67 0.00 -0.67 0.12 119.26 120.52 1ss8 h ALA 443 Ca 0.13 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 443 Cb 0.27 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1ss8 h ALA 443 CO -0.30 -0.55 0.64 -0.07 0.00 0.00 0.00 179.25 178.97 1ss8 h LEU 444 N -0.10 1.09 -0.43 0.00 3.38 -0.95 -0.46 115.31 117.85 1ss8 h LEU 444 Ca 0.02 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1ss8 h LEU 444 Cb 0.13 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1ss8 h LEU 444 CO -0.06 0.78 -0.58 -0.09 0.09 0.00 0.00 178.44 178.58 1ss8 h ARG 445 N 1.29 0.64 -0.24 1.13 2.43 -1.17 -2.57 114.38 115.89 1ss8 h ARG 445 Ca 0.36 -0.42 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1ss8 h ARG 445 Cb -0.12 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1ss8 h ARG 445 CO -0.09 1.04 0.17 0.00 -1.51 0.00 0.00 179.97 179.58 1ss8 h ALA 446 N 0.87 2.10 0.00 2.80 0.00 0.75 -2.09 119.26 123.68 1ss8 h ALA 446 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ss8 h ALA 446 Cb 1.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1ss8 h ALA 446 CO 0.11 -0.15 0.00 0.52 0.00 0.00 0.00 179.25 179.73 1ss8 h MET 447 N 0.10 0.00 0.00 0.00 2.86 -0.72 -1.31 114.93 115.86 1ss8 h MET 447 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1ss8 h MET 447 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1ss8 h MET 447 CO -0.01 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.35 1ss8 n GLU 448 N -2.67 0.11 0.11 1.72 1.02 -0.79 -3.69 120.64 116.46 1ss8 n GLU 448 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.00 1ss8 n GLU 448 Cb 0.12 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.96 1ss8 n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ss8 h ALA 449 N 3.11 -0.22 -0.29 0.62 0.00 -1.37 -0.91 119.26 120.20 1ss8 h ALA 449 Ca 0.00 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1ss8 h ALA 449 Cb 0.44 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1ss8 h ALA 449 CO 0.00 -0.60 -0.11 -1.35 0.00 0.00 0.00 179.25 177.19 1ss8 h PRO 450 N -0.27 -0.06 -0.57 0.00 0.11 -1.79 0.34 132.00 129.76 1ss8 h PRO 450 Ca -0.02 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 1ss8 h PRO 450 Cb 0.21 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 1ss8 h PRO 450 CO 0.04 -0.04 0.26 1.25 -0.21 0.00 0.00 178.00 179.30 1ss8 h LEU 451 N -0.06 0.75 -0.50 2.35 5.85 -1.73 -0.05 115.31 121.93 1ss8 h LEU 451 Ca 0.15 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1ss8 h LEU 451 Cb 0.28 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1ss8 h LEU 451 CO -0.34 0.68 0.31 0.03 -0.34 0.00 0.00 178.44 178.79 1ss8 h ARG 452 N 0.77 0.67 -0.59 1.25 3.08 -0.14 -0.78 114.38 118.65 1ss8 h ARG 452 Ca 0.19 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.22 1ss8 h ARG 452 Cb 0.14 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1ss8 h ARG 452 CO -0.02 0.48 0.35 0.37 -1.07 0.00 0.00 179.97 180.07 1ss8 h GLN 453 N 0.67 0.65 -0.77 0.04 5.75 0.05 -0.35 115.11 121.14 1ss8 h GLN 453 Ca 0.18 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1ss8 h GLN 453 Cb -0.03 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 1ss8 h GLN 453 CO -0.04 0.43 0.36 0.82 -2.65 0.00 0.00 178.83 177.76 1ss8 h ILE 454 N 0.67 1.25 0.00 2.39 2.04 -0.25 -0.13 117.51 123.48 1ss8 h ILE 454 Ca 0.24 -0.71 -0.11 0.00 1.00 0.00 0.00 64.86 65.29 1ss8 h ILE 454 Cb 0.06 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1ss8 h ILE 454 CO -0.12 0.30 -0.50 0.58 0.00 0.00 0.00 178.15 178.41 1ss8 h VAL 455 N 1.09 1.18 -0.33 1.67 2.07 -0.74 -2.51 116.25 118.68 1ss8 h VAL 455 Ca 0.26 -1.84 -0.18 0.00 0.82 0.00 0.00 66.70 65.77 1ss8 h VAL 455 Cb 0.14 2.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1ss8 h VAL 455 CO -0.03 0.49 -0.49 0.25 0.02 0.00 0.00 177.57 177.82 1ss8 h LEU 456 N 0.00 1.00 -1.99 2.57 5.85 0.22 -2.19 115.31 120.77 1ss8 h LEU 456 Ca -0.01 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 1ss8 h LEU 456 Cb 1.00 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 1ss8 h LEU 456 CO 0.07 1.31 -0.06 0.78 -0.34 0.00 0.00 178.44 180.20 1ss8 h ASN 457 N 0.72 0.00 0.80 1.25 2.35 -0.63 0.11 115.58 120.17 1ss8 h ASN 457 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1ss8 h ASN 457 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1ss8 h ASN 457 CO 0.11 0.06 0.00 0.00 -1.65 0.00 0.00 177.43 175.95 1ss8 n GLY 459 N 0.30 0.59 4.02 0.00 0.00 0.37 -5.05 105.19 105.42 1ss8 n GLY 459 Ca 0.03 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 45.09 1ss8 n GLY 459 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ss8 s GLU 460 N -1.94 2.63 -0.50 1.61 0.41 -0.92 -5.04 118.70 114.95 1ss8 s GLU 460 Ca 0.00 -1.40 -0.26 0.00 -0.41 0.00 0.00 54.97 52.90 1ss8 s GLU 460 Cb 0.00 -2.71 0.03 0.00 -1.78 0.00 0.00 34.13 29.68 1ss8 s GLU 460 CO 0.00 -0.49 0.99 -1.21 -0.49 0.00 0.00 175.26 174.06 1ss8 s GLU 461 N -4.46 3.51 0.20 1.61 2.02 -1.26 -4.37 118.70 115.95 1ss8 s GLU 461 Ca 0.57 0.12 -0.10 0.00 0.02 0.00 0.00 54.97 55.58 1ss8 s GLU 461 Cb -0.08 -3.96 0.14 0.00 0.10 0.00 0.00 34.13 30.32 1ss8 s GLU 461 CO 0.35 -1.36 1.82 -1.00 0.02 0.00 0.00 175.26 175.09 1ss8 h PRO 462 N 9.21 1.02 0.00 0.39 0.13 -1.86 -2.41 132.00 138.48 1ss8 h PRO 462 Ca -0.24 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 64.75 1ss8 h PRO 462 Cb 1.07 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.00 1ss8 h PRO 462 CO 1.07 0.75 -0.11 0.66 -0.23 0.00 0.00 178.00 180.14 1ss8 h SER 463 N 1.01 0.00 0.08 1.44 4.64 -1.94 0.13 113.55 118.91 1ss8 h SER 463 Ca 0.26 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.39 1ss8 h SER 463 Cb 0.02 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.13 1ss8 h SER 463 CO -0.04 0.11 -0.77 0.58 -0.87 0.00 0.00 176.83 175.84 1ss8 h VAL 464 N 0.00 1.45 -0.52 0.95 2.07 -1.86 -1.95 116.25 116.38 1ss8 h VAL 464 Ca -0.00 -2.32 -0.04 0.00 0.82 0.00 0.00 66.70 65.16 1ss8 h VAL 464 Cb 0.40 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.02 1ss8 h VAL 464 CO 0.01 0.67 0.18 0.58 0.02 0.00 0.00 177.57 179.04 1ss8 h VAL 465 N -0.18 1.23 -0.82 2.57 2.07 -1.15 0.26 116.25 120.23 1ss8 h VAL 465 Ca -0.12 -0.74 0.04 0.00 0.82 0.00 0.00 66.70 66.71 1ss8 h VAL 465 Cb 1.53 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 1ss8 h VAL 465 CO 0.15 0.28 0.52 0.00 0.02 0.00 0.00 177.57 178.53 1ss8 h ALA 466 N 1.04 1.09 -0.20 1.67 0.00 -0.80 -0.94 119.26 121.12 1ss8 h ALA 466 Ca 0.17 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1ss8 h ALA 466 Cb 0.24 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ss8 h ALA 466 CO -0.01 0.31 -0.15 -0.97 0.00 0.00 0.00 179.25 178.44 1ss8 h ASN 467 N 0.99 0.47 -0.20 0.00 -1.24 -0.95 -0.01 115.58 114.64 1ss8 h ASN 467 Ca 0.34 -0.45 -0.00 0.00 0.71 0.00 0.00 56.30 56.90 1ss8 h ASN 467 Cb 0.06 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 1ss8 h ASN 467 CO -0.13 0.82 0.11 0.74 -1.29 0.00 0.00 177.43 177.68 1ss8 h THR 468 N 0.12 1.09 -0.23 -3.57 2.02 -0.64 -2.19 112.91 109.52 1ss8 h THR 468 Ca 0.04 -0.24 0.03 0.00 0.77 0.00 0.00 66.41 67.00 1ss8 h THR 468 Cb 0.67 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 1ss8 h THR 468 CO 0.04 0.09 0.06 0.58 0.37 0.00 0.00 175.52 176.66 1ss8 h VAL 469 N 0.23 0.92 -0.74 3.16 2.07 -1.00 -1.94 116.25 118.94 1ss8 h VAL 469 Ca 0.07 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1ss8 h VAL 469 Cb 0.05 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1ss8 h VAL 469 CO -0.01 0.03 0.49 0.11 0.02 0.00 0.00 177.57 178.21 1ss8 h LYS 470 N 0.16 0.85 0.00 1.57 1.57 -0.92 -1.81 116.57 117.99 1ss8 h LYS 470 Ca 0.10 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1ss8 h LYS 470 Cb 0.08 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 1ss8 h LYS 470 CO -0.12 0.56 -0.02 0.78 -0.57 0.00 0.00 179.45 180.08 1ss8 h GLY 471 N 0.87 0.00 -0.86 3.86 0.00 -0.69 -3.45 103.07 102.81 1ss8 h GLY 471 Ca 0.30 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.32 1ss8 h GLY 471 CO -0.09 0.00 0.11 0.61 0.00 0.00 0.00 176.54 177.17 1ss8 n GLY 472 N -0.61 0.35 3.36 4.60 0.00 -0.68 -5.11 105.19 107.10 1ss8 n GLY 472 Ca -0.01 -1.96 -0.21 0.00 0.00 0.00 0.00 46.02 43.84 1ss8 n GLY 472 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss8 s ASP 473 N -3.86 2.77 0.81 1.61 2.15 -1.26 -4.99 116.67 113.91 1ss8 s ASP 473 Ca 0.46 -0.95 0.00 0.00 0.43 0.00 0.00 52.55 52.49 1ss8 s ASP 473 Cb -0.02 -0.17 0.00 0.00 -0.30 0.00 0.00 42.92 42.43 1ss8 s ASP 473 CO 0.31 -0.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.84 1ss8 n GLY 474 N -0.10 1.93 0.66 2.66 0.00 -1.26 -2.57 105.19 106.50 1ss8 n GLY 474 Ca -0.10 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1ss8 n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ss8 n ASN 475 N 0.27 1.56 -4.74 1.61 3.02 -1.26 -4.88 115.26 110.84 1ss8 n ASN 475 Ca 0.00 -2.05 -0.42 0.00 -0.03 0.00 0.00 54.58 52.08 1ss8 n ASN 475 Cb 0.00 -0.51 -0.02 0.00 -0.61 0.00 0.00 39.78 38.64 1ss8 n ASN 475 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ss8 s TYR 476 N -0.91 2.88 0.00 3.10 5.04 -1.06 -0.05 117.35 126.35 1ss8 s TYR 476 Ca 0.03 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 1ss8 s TYR 476 Cb 0.02 -4.04 0.00 0.00 0.35 0.00 0.00 41.96 38.29 1ss8 s TYR 476 CO 0.01 -3.65 0.00 0.41 -1.34 0.00 0.00 175.55 170.98 1ss8 n GLY 477 N 2.92 1.43 3.59 8.97 0.00 0.16 -4.85 105.19 117.41 1ss8 n GLY 477 Ca 0.11 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 1ss8 n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ss8 s TYR 478 N -4.65 3.16 -0.53 1.61 5.04 -1.26 -1.96 117.35 118.77 1ss8 s TYR 478 Ca 0.00 -0.05 -0.19 0.00 -2.44 0.00 0.00 57.07 54.39 1ss8 s TYR 478 Cb 0.00 -1.99 0.07 0.00 0.35 0.00 0.00 41.96 40.39 1ss8 s TYR 478 CO 0.00 0.13 0.64 1.21 -1.34 0.00 0.00 175.55 176.18 1ss8 s ASN 479 N 0.19 6.21 0.51 4.32 3.84 0.55 -4.90 114.94 125.66 1ss8 s ASN 479 Ca 0.02 -1.07 0.22 0.00 0.21 0.00 0.00 52.86 52.23 1ss8 s ASN 479 Cb -0.13 -2.29 1.34 0.00 -0.55 0.00 0.00 41.25 39.62 1ss8 s ASN 479 CO 0.01 -0.94 2.09 0.00 -2.79 0.00 0.00 177.10 175.47 1ss8 h ALA 480 N 9.03 1.58 -0.15 1.71 0.00 -1.94 0.29 119.26 129.78 1ss8 h ALA 480 Ca -0.28 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ss8 h ALA 480 Cb 1.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1ss8 h ALA 480 CO 1.00 0.13 0.09 0.00 0.00 0.00 0.00 179.25 180.47 1ss8 h ALA 481 N 1.90 0.19 -0.01 0.00 0.00 -1.95 -3.19 119.26 116.19 1ss8 h ALA 481 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ss8 h ALA 481 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ss8 h ALA 481 CO 0.01 -0.29 -0.59 0.25 0.00 0.00 0.00 179.25 178.63 1ss8 n THR 482 N -4.95 0.00 -3.91 0.00 -2.24 -1.15 -5.00 114.28 97.03 1ss8 n THR 482 Ca -0.04 -0.16 -0.25 0.00 -2.27 0.00 0.00 64.05 61.32 1ss8 n THR 482 Cb 0.05 1.04 -0.01 0.00 -2.10 0.00 0.00 70.33 69.31 1ss8 n THR 482 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ss8 n GLU 483 N -0.56 -3.39 -4.04 -0.78 1.02 0.10 -5.01 120.64 107.98 1ss8 n GLU 483 Ca 0.08 0.43 -0.09 0.00 -0.02 0.00 0.00 57.16 57.57 1ss8 n GLU 483 Cb 0.41 -4.58 -0.11 0.00 -0.02 0.00 0.00 31.44 27.14 1ss8 n GLU 483 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1ss8 s GLU 484 N -6.45 0.47 0.39 3.49 0.41 -1.15 -4.98 118.70 110.87 1ss8 s GLU 484 Ca 0.02 -0.89 -0.01 0.00 -0.41 0.00 0.00 54.97 53.68 1ss8 s GLU 484 Cb -0.01 0.10 -0.03 0.00 -1.78 0.00 0.00 34.13 32.41 1ss8 s GLU 484 CO 0.88 -0.06 0.62 0.71 -0.49 0.00 0.00 175.26 176.91 1ss8 s TYR 485 N -2.50 3.52 -3.04 1.61 1.51 -1.26 -0.33 117.35 116.85 1ss8 s TYR 485 Ca -0.05 0.48 0.00 0.00 -1.01 0.00 0.00 57.07 56.49 1ss8 s TYR 485 Cb -0.02 -2.01 0.00 0.00 -0.11 0.00 0.00 41.96 39.81 1ss8 s TYR 485 CO -0.05 0.00 0.00 0.41 -1.11 0.00 0.00 175.55 174.81 1ss8 n GLY 486 N -1.92 -2.06 3.60 0.71 0.00 -0.83 -4.90 105.19 99.79 1ss8 n GLY 486 Ca -0.03 -1.18 -0.43 0.00 0.00 0.00 0.00 46.02 44.38 1ss8 n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ss8 s ASN 487 N -0.71 6.60 0.53 1.61 3.84 -1.26 -0.66 114.94 124.89 1ss8 s ASN 487 Ca 0.00 0.54 0.17 0.00 0.21 0.00 0.00 52.86 53.79 1ss8 s ASN 487 Cb 0.00 -2.55 1.32 0.00 -0.55 0.00 0.00 41.25 39.47 1ss8 s ASN 487 CO 0.00 -1.26 2.15 0.24 -2.79 0.00 0.00 177.10 175.44 1ss8 h MET 488 N 9.39 0.00 -0.02 0.43 2.86 -0.79 -1.97 114.93 124.83 1ss8 h MET 488 Ca -0.24 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.35 1ss8 h MET 488 Cb 1.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.73 1ss8 h MET 488 CO 1.12 0.00 -0.22 0.82 1.06 0.00 0.00 176.91 179.69 1ss8 h ILE 489 N 0.00 1.51 -0.96 -1.22 1.08 -1.80 -0.94 117.51 115.18 1ss8 h ILE 489 Ca 0.01 -1.80 0.13 0.00 -0.39 0.00 0.00 64.86 62.81 1ss8 h ILE 489 Cb 0.02 2.60 -0.08 0.00 -3.07 0.00 0.00 36.82 36.29 1ss8 h ILE 489 CO -0.00 0.49 0.61 0.44 -0.69 0.00 0.00 178.15 179.00 1ss8 h ASP 490 N -0.43 0.83 0.32 1.72 3.32 -1.86 -0.80 116.42 119.51 1ss8 h ASP 490 Ca -0.02 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ss8 h ASP 490 Cb 0.92 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1ss8 h ASP 490 CO 0.04 0.44 0.00 0.23 -1.72 0.00 0.00 179.24 178.23 1ss8 n MET 491 N -4.60 0.52 -2.31 3.56 2.81 -0.77 -4.89 117.12 111.45 1ss8 n MET 491 Ca 0.18 0.03 -0.12 0.00 -1.81 0.00 0.00 57.70 55.98 1ss8 n MET 491 Cb 0.39 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.40 1ss8 n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ss8 n GLY 492 N 0.81 -0.12 3.25 3.03 0.00 -0.31 -5.00 105.19 106.85 1ss8 n GLY 492 Ca 0.15 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1ss8 n GLY 492 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ss8 s ILE 493 N -2.66 4.40 0.06 -0.61 1.01 -0.39 -5.02 121.20 118.00 1ss8 s ILE 493 Ca 0.03 -1.58 -0.12 0.00 0.00 0.00 0.00 60.65 58.98 1ss8 s ILE 493 Cb -0.01 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.67 1ss8 s ILE 493 CO 0.04 -0.69 0.26 -1.48 0.00 0.00 0.00 174.94 173.07 1ss8 s LEU 494 N 1.43 1.09 0.20 2.97 0.05 -1.26 -0.22 118.68 122.93 1ss8 s LEU 494 Ca 0.04 -0.36 0.09 0.00 0.05 0.00 0.00 54.13 53.96 1ss8 s LEU 494 Cb -0.25 1.22 -0.04 0.00 -2.05 0.00 0.00 46.19 45.07 1ss8 s LEU 494 CO 0.01 -0.65 -0.08 -1.81 -0.55 0.00 0.00 176.35 173.26 1ss8 s ASP 495 N -2.33 4.27 0.18 1.48 1.01 -0.66 -4.64 116.67 115.97 1ss8 s ASP 495 Ca -0.02 -0.61 -0.31 0.00 0.71 0.00 0.00 52.55 52.32 1ss8 s ASP 495 Cb 0.01 -0.72 -0.10 0.00 1.01 0.00 0.00 42.92 43.12 1ss8 s ASP 495 CO -0.06 0.08 1.53 -2.84 0.21 0.00 0.00 175.17 174.09 1ss8 s PRO 496 N -2.99 4.23 0.33 8.23 0.02 -1.26 -1.10 135.00 142.46 1ss8 s PRO 496 Ca 0.26 2.34 0.11 0.00 0.02 0.00 0.00 61.00 63.73 1ss8 s PRO 496 Cb -0.08 -3.15 1.02 0.00 0.02 0.00 0.00 34.50 32.31 1ss8 s PRO 496 CO 0.16 -0.56 1.62 1.15 -0.33 0.00 0.00 177.00 179.04 1ss8 h THR 497 N 3.93 0.18 -0.52 0.99 2.02 -0.76 0.12 112.91 118.87 1ss8 h THR 497 Ca -0.43 -0.06 0.06 0.00 0.77 0.00 0.00 66.41 66.75 1ss8 h THR 497 Cb 1.21 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1ss8 h THR 497 CO 0.88 0.03 0.35 0.50 0.37 0.00 0.00 175.52 177.65 1ss8 h LYS 498 N 0.16 0.44 0.06 6.66 3.64 -1.83 -0.14 116.57 125.57 1ss8 h LYS 498 Ca 0.70 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 59.80 1ss8 h LYS 498 Cb 1.62 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 33.35 1ss8 h LYS 498 CO -0.71 0.29 -1.08 -0.39 -2.27 0.00 0.00 179.45 175.29 1ss8 h VAL 499 N 0.45 1.43 -0.50 2.00 -1.51 -1.08 -2.24 116.25 114.80 1ss8 h VAL 499 Ca 0.23 -2.69 -0.12 0.00 -1.23 0.00 0.00 66.70 62.89 1ss8 h VAL 499 Cb 0.32 2.65 -0.02 0.00 -2.13 0.00 0.00 31.29 32.11 1ss8 h VAL 499 CO -0.06 0.80 -0.16 0.74 -1.23 0.00 0.00 177.57 177.65 1ss8 h THR 500 N 0.17 1.27 0.23 7.19 2.02 -1.16 -1.43 112.91 121.19 1ss8 h THR 500 Ca -0.11 -1.32 -0.01 0.00 0.77 0.00 0.00 66.41 65.74 1ss8 h THR 500 Cb 1.76 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.22 1ss8 h THR 500 CO 0.19 0.46 -0.11 -0.09 0.37 0.00 0.00 175.52 176.34 1ss8 h ARG 501 N 0.87 -0.29 -0.81 6.66 2.43 -1.09 -2.31 114.38 119.83 1ss8 h ARG 501 Ca 0.12 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1ss8 h ARG 501 Cb 0.73 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.31 1ss8 h ARG 501 CO 0.06 -0.12 0.51 0.77 -1.51 0.00 0.00 179.97 179.68 1ss8 h SER 502 N -0.41 0.96 0.08 -3.80 0.02 -1.40 -0.76 113.55 108.23 1ss8 h SER 502 Ca -0.03 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1ss8 h SER 502 Cb 0.31 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1ss8 h SER 502 CO 0.05 0.72 -0.06 0.00 -1.14 0.00 0.00 176.83 176.40 1ss8 h ALA 503 N 1.45 -0.13 -0.71 3.77 0.00 -1.10 -0.78 119.26 121.76 1ss8 h ALA 503 Ca 0.30 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1ss8 h ALA 503 Cb -0.08 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1ss8 h ALA 503 CO -0.06 -0.58 0.26 1.25 0.00 0.00 0.00 179.25 180.12 1ss8 h LEU 504 N -0.14 0.98 -0.14 0.00 6.46 -0.97 1.00 115.31 122.50 1ss8 h LEU 504 Ca -0.00 -0.15 -0.17 0.00 -0.12 0.00 0.00 57.88 57.44 1ss8 h LEU 504 Cb 0.13 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1ss8 h LEU 504 CO -0.01 0.88 -0.57 1.56 -0.62 0.00 0.00 178.44 179.69 1ss8 h GLN 505 N 1.03 0.62 -0.10 1.25 4.20 -0.88 -1.02 115.11 120.22 1ss8 h GLN 505 Ca 0.24 -0.49 -0.06 0.00 0.06 0.00 0.00 58.65 58.40 1ss8 h GLN 505 Cb 0.23 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 1ss8 h GLN 505 CO -0.02 1.11 -0.16 1.88 -0.67 0.00 0.00 178.83 180.98 1ss8 h TYR 506 N 0.28 0.35 -0.94 2.96 0.05 -0.94 -0.64 116.97 118.09 1ss8 h TYR 506 Ca -0.03 -0.12 0.18 0.00 0.05 0.00 0.00 58.73 58.81 1ss8 h TYR 506 Cb 1.20 -0.07 -0.08 0.00 1.01 0.00 0.00 36.73 38.79 1ss8 h TYR 506 CO 0.10 0.75 0.60 0.00 -1.05 0.00 0.00 178.16 178.56 1ss8 h ALA 507 N 0.54 1.90 0.00 3.88 0.00 -0.79 -1.75 119.26 123.03 1ss8 h ALA 507 Ca 0.01 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 1ss8 h ALA 507 Cb 0.72 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1ss8 h ALA 507 CO 0.04 -0.19 -0.92 0.00 0.00 0.00 0.00 179.25 178.18 1ss8 h ALA 508 N 1.61 0.48 0.21 0.00 0.00 -0.90 -1.32 119.26 119.34 1ss8 h ALA 508 Ca 0.50 -0.83 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ss8 h ALA 508 Cb 0.91 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1ss8 h ALA 508 CO -0.25 1.14 -0.26 1.03 0.00 0.00 0.00 179.25 180.92 1ss8 h SER 509 N 0.00 -0.73 -0.64 0.00 0.87 -0.21 -1.09 113.55 111.75 1ss8 h SER 509 Ca -0.01 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 1ss8 h SER 509 Cb 1.63 0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 63.81 1ss8 h SER 509 CO 0.12 -0.32 0.24 -0.37 -0.53 0.00 0.00 176.83 175.96 1ss8 h VAL 510 N -0.48 1.24 -0.79 2.23 -1.51 -1.51 -1.58 116.25 113.85 1ss8 h VAL 510 Ca -0.03 -0.79 0.11 0.00 -1.23 0.00 0.00 66.70 64.76 1ss8 h VAL 510 Cb 0.43 0.47 -0.05 0.00 -2.13 0.00 0.00 31.29 30.00 1ss8 h VAL 510 CO -0.06 0.31 0.52 0.00 -1.23 0.00 0.00 177.57 177.11 1ss8 h ALA 511 N 1.28 1.82 -0.32 5.19 0.00 -1.17 0.49 119.26 126.56 1ss8 h ALA 511 Ca 0.22 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1ss8 h ALA 511 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ss8 h ALA 511 CO -0.01 0.00 -0.20 0.78 0.00 0.00 0.00 179.25 179.81 1ss8 h GLY 512 N 0.67 0.76 1.15 0.00 0.00 -0.25 -0.76 103.07 104.64 1ss8 h GLY 512 Ca 0.37 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 1ss8 h GLY 512 CO -0.14 0.65 0.13 1.41 0.00 0.00 0.00 176.54 178.59 1ss8 h LEU 513 N 0.46 0.99 -0.10 3.11 3.38 -0.61 -2.19 115.31 120.35 1ss8 h LEU 513 Ca 0.06 -0.22 -0.16 0.00 0.09 0.00 0.00 57.88 57.66 1ss8 h LEU 513 Cb 0.75 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.25 1ss8 h LEU 513 CO 0.06 0.97 -0.56 -0.03 0.09 0.00 0.00 178.44 178.97 1ss8 h MET 514 N 0.99 0.56 0.00 1.13 4.05 -0.73 -1.97 114.93 118.97 1ss8 h MET 514 Ca 0.20 -0.47 -0.00 0.00 -0.28 0.00 0.00 59.70 59.15 1ss8 h MET 514 Cb 0.38 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.28 1ss8 h MET 514 CO 0.01 1.09 -0.02 0.82 0.23 0.00 0.00 176.91 179.04 1ss8 h ILE 515 N 0.18 0.09 -0.47 1.77 2.04 -1.06 -2.48 117.51 117.58 1ss8 h ILE 515 Ca -0.04 -0.31 -0.20 0.00 1.00 0.00 0.00 64.86 65.31 1ss8 h ILE 515 Cb 1.20 1.28 -0.12 0.00 -0.74 0.00 0.00 36.82 38.45 1ss8 h ILE 515 CO 0.12 0.02 0.09 0.35 0.00 0.00 0.00 178.15 178.73 1ss8 n THR 516 N -3.17 2.64 -3.46 -0.27 -2.24 -0.80 -4.83 114.28 102.15 1ss8 n THR 516 Ca -0.01 -2.32 -0.37 0.00 -2.27 0.00 0.00 64.05 59.08 1ss8 n THR 516 Cb 0.20 -0.33 -0.07 0.00 -2.10 0.00 0.00 70.33 68.02 1ss8 n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1ss8 s THR 517 N -3.14 5.26 -0.27 4.28 2.01 -0.84 -4.98 115.64 117.95 1ss8 s THR 517 Ca 0.47 0.64 0.17 0.00 0.31 0.00 0.00 61.69 63.28 1ss8 s THR 517 Cb 0.41 -3.68 -0.24 0.00 0.01 0.00 0.00 72.50 69.00 1ss8 s THR 517 CO 0.05 0.33 0.48 -0.62 -0.69 0.00 0.00 174.62 174.17 1ss8 n GLU 518 N 3.92 0.85 -3.84 4.92 -0.58 -1.26 -4.76 120.64 119.88 1ss8 n GLU 518 Ca -0.10 -0.10 -0.12 0.00 -0.42 0.00 0.00 57.16 56.41 1ss8 n GLU 518 Cb 0.52 -1.36 -0.13 0.00 -0.57 0.00 0.00 31.44 29.89 1ss8 n GLU 518 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ss8 s MET 520 N 0.08 1.30 -0.05 0.00 -1.94 0.67 -4.99 119.30 114.38 1ss8 s MET 520 Ca -0.00 -0.77 0.04 0.00 -1.71 0.00 0.00 55.69 53.25 1ss8 s MET 520 Cb -0.01 -1.33 0.00 0.00 2.01 0.00 0.00 34.83 35.51 1ss8 s MET 520 CO -0.00 0.35 -0.15 0.08 -0.01 0.00 0.00 175.02 175.28 1ss8 s VAL 521 N -0.64 1.31 0.24 -6.03 1.01 -1.26 -1.32 120.40 113.70 1ss8 s VAL 521 Ca 0.06 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 1ss8 s VAL 521 Cb -0.08 -1.15 0.03 0.00 0.00 0.00 0.00 36.38 35.18 1ss8 s VAL 521 CO 0.01 0.39 0.62 0.28 0.00 0.00 0.00 175.10 176.39 1ss8 s THR 522 N 0.24 0.01 0.52 3.92 -1.32 -1.05 -5.00 115.64 112.96 1ss8 s THR 522 Ca -0.07 -0.87 -0.19 0.00 -1.21 0.00 0.00 61.69 59.34 1ss8 s THR 522 Cb -0.13 -1.79 -0.07 0.00 -1.51 0.00 0.00 72.50 69.00 1ss8 s THR 522 CO 0.03 -0.03 1.08 -1.81 -2.21 0.00 0.00 174.62 171.68 1ss8 s ASP 523 N -2.90 6.02 0.24 8.08 1.11 -1.26 0.14 116.67 128.09 1ss8 s ASP 523 Ca 0.11 2.02 -0.30 0.00 0.18 0.00 0.00 52.55 54.55 1ss8 s ASP 523 Cb -0.03 -2.57 -0.10 0.00 1.07 0.00 0.00 42.92 41.29 1ss8 s ASP 523 CO 0.02 -1.01 1.41 -0.76 1.18 0.00 0.00 175.17 176.02 1ss8 s LEU 524 N -3.74 4.39 0.00 1.23 1.43 -1.17 -4.59 118.68 116.24 1ss8 s LEU 524 Ca 0.69 2.61 0.00 0.00 -1.03 0.00 0.00 54.13 56.40 1ss8 s LEU 524 Cb -0.19 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1ss8 s LEU 524 CO 0.25 -0.66 0.31 -0.81 0.23 0.00 0.00 176.35 175.67