#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 -0.55 -2.70 0.00 0.00 -1.26 -4.90 120.51 111.11 1ss8 n ALA 3 Ca 0.00 0.35 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 1ss8 n ALA 3 Cb 0.00 -1.96 -0.07 0.00 0.00 0.00 0.00 19.45 17.42 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 -1.57 2.50 -0.18 0.00 -0.14 -1.26 -2.79 119.74 116.30 1ss8 s LYS 4 Ca 0.60 -1.22 -0.06 0.00 -1.36 0.00 0.00 55.97 53.93 1ss8 s LYS 4 Cb -0.69 -2.33 -0.04 0.00 -1.68 0.00 0.00 37.83 33.09 1ss8 s LYS 4 CO 0.59 0.40 0.03 0.34 -0.76 0.00 0.00 175.35 175.96 1ss8 s ASP 5 N -3.48 5.36 -0.08 2.83 -1.08 -0.16 -4.72 116.67 115.35 1ss8 s ASP 5 Ca 0.31 0.01 0.04 0.00 -0.52 0.00 0.00 52.55 52.38 1ss8 s ASP 5 Cb -0.08 -1.91 -0.00 0.00 -1.46 0.00 0.00 42.92 39.47 1ss8 s ASP 5 CO 0.21 0.16 -0.22 -0.69 0.52 0.00 0.00 175.17 175.15 1ss8 s VAL 6 N 0.43 1.85 0.10 1.11 1.01 -1.26 -2.58 120.40 121.05 1ss8 s VAL 6 Ca 0.01 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.13 1ss8 s VAL 6 Cb -0.13 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1ss8 s VAL 6 CO 0.01 0.52 -0.16 -0.54 0.00 0.00 0.00 175.10 174.93 1ss8 s LYS 7 N 0.22 0.97 0.18 2.72 1.02 -0.68 -4.97 119.74 119.20 1ss8 s LYS 7 Ca -0.13 -1.10 0.08 0.00 0.02 0.00 0.00 55.97 54.85 1ss8 s LYS 7 Cb -0.16 -1.02 -0.04 0.00 -0.52 0.00 0.00 37.83 36.09 1ss8 s LYS 7 CO 0.06 0.22 -0.17 -0.06 -0.92 0.00 0.00 175.35 174.49 1ss8 s PHE 8 N -1.48 1.78 0.00 3.18 0.08 -1.26 -0.72 117.98 119.56 1ss8 s PHE 8 Ca 0.03 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.58 1ss8 s PHE 8 Cb -0.09 -0.86 0.00 0.00 -0.57 0.00 0.00 43.02 41.51 1ss8 s PHE 8 CO 0.03 0.35 0.00 0.41 -0.10 0.00 0.00 175.22 175.91 1ss8 n GLY 9 N 0.00 2.82 0.36 4.36 0.00 -0.66 -2.02 105.19 110.05 1ss8 n GLY 9 Ca -0.11 -0.07 0.01 0.00 0.00 0.00 0.00 46.02 45.84 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 0.64 0.91 -0.87 1.61 -0.26 -1.96 0.96 115.58 116.61 1ss8 h ASN 10 Ca 0.00 -0.02 0.06 0.00 -0.56 0.00 0.00 56.30 55.78 1ss8 h ASN 10 Cb 0.00 -0.22 -0.06 0.00 -1.06 0.00 0.00 38.32 36.98 1ss8 h ASN 10 CO 0.00 0.65 0.55 0.44 -1.06 0.00 0.00 177.43 178.01 1ss8 h ASP 11 N 1.06 0.88 -0.07 5.81 3.32 -1.93 0.52 116.42 126.01 1ss8 h ASP 11 Ca 0.30 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.20 1ss8 h ASP 11 Cb -0.09 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1ss8 h ASP 11 CO -0.07 0.57 -0.50 0.00 -1.72 0.00 0.00 179.24 177.52 1ss8 h ALA 12 N 1.40 0.69 -0.13 3.45 0.00 -0.71 -2.96 119.26 120.99 1ss8 h ALA 12 Ca 0.37 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1ss8 h ALA 12 Cb 0.14 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 1ss8 h ALA 12 CO -0.16 0.68 -0.20 0.78 0.00 0.00 0.00 179.25 180.35 1ss8 h GLY 13 N 0.98 -0.16 2.00 0.00 0.00 0.86 -1.63 103.07 105.12 1ss8 h GLY 13 Ca 0.02 0.24 -0.07 0.00 0.00 0.00 0.00 47.33 47.52 1ss8 h GLY 13 CO 0.10 -0.18 -0.33 -0.39 0.00 0.00 0.00 176.54 175.74 1ss8 h VAL 14 N -0.25 0.97 -0.07 4.60 -1.51 0.05 -0.73 116.25 119.31 1ss8 h VAL 14 Ca 0.10 -1.25 -0.02 0.00 -1.23 0.00 0.00 66.70 64.30 1ss8 h VAL 14 Cb 0.39 1.73 -0.00 0.00 -2.13 0.00 0.00 31.29 31.28 1ss8 h VAL 14 CO -0.28 0.32 -0.02 0.11 -1.23 0.00 0.00 177.57 176.48 1ss8 h LYS 15 N 0.00 0.13 -0.90 5.19 1.79 -1.32 -1.24 116.57 120.22 1ss8 h LYS 15 Ca -0.00 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 1ss8 h LYS 15 Cb 0.70 -0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.31 1ss8 h LYS 15 CO 0.04 0.47 0.49 0.52 -1.08 0.00 0.00 179.45 179.89 1ss8 h MET 16 N -0.22 1.25 -0.07 3.15 2.86 -0.67 -1.86 114.93 119.38 1ss8 h MET 16 Ca 0.02 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1ss8 h MET 16 Cb 0.42 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 1ss8 h MET 16 CO 0.01 0.92 0.03 1.25 1.06 0.00 0.00 176.91 180.18 1ss8 h LEU 17 N 1.26 0.09 -0.60 1.22 5.85 -1.03 0.39 115.31 122.47 1ss8 h LEU 17 Ca 0.32 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 59.02 1ss8 h LEU 17 Cb 0.03 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 40.96 1ss8 h LEU 17 CO -0.05 0.18 0.18 0.03 -0.34 0.00 0.00 178.44 178.44 1ss8 h ARG 18 N -0.01 0.32 -0.40 1.25 3.08 -0.93 0.16 114.38 117.85 1ss8 h ARG 18 Ca 0.02 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1ss8 h ARG 18 Cb 0.12 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 1ss8 h ARG 18 CO -0.00 0.21 0.16 0.78 -1.07 0.00 0.00 179.97 180.05 1ss8 h GLY 19 N 0.33 0.52 0.96 0.04 0.00 -0.97 -2.01 103.07 101.94 1ss8 h GLY 19 Ca 0.31 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.50 1ss8 h GLY 19 CO -0.35 0.06 0.15 -2.08 0.00 0.00 0.00 176.54 174.32 1ss8 h VAL 20 N 0.34 1.22 -0.85 4.60 2.07 0.46 -2.30 116.25 121.79 1ss8 h VAL 20 Ca 0.18 -0.73 0.10 0.00 0.82 0.00 0.00 66.70 67.07 1ss8 h VAL 20 Cb 0.13 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 1ss8 h VAL 20 CO -0.16 0.26 0.55 0.78 0.02 0.00 0.00 177.57 179.03 1ss8 h ASN 21 N 0.61 0.72 -0.16 0.57 2.35 -0.40 0.17 115.58 119.45 1ss8 h ASN 21 Ca 0.15 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1ss8 h ASN 21 Cb 0.25 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1ss8 h ASN 21 CO -0.01 0.41 -0.19 0.58 -1.65 0.00 0.00 177.43 176.58 1ss8 h VAL 22 N 0.79 1.35 0.57 2.81 2.07 -0.82 0.12 116.25 123.14 1ss8 h VAL 22 Ca 0.40 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1ss8 h VAL 22 Cb 0.48 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1ss8 h VAL 22 CO -0.17 0.41 -0.38 0.25 0.02 0.00 0.00 177.57 177.70 1ss8 h LEU 23 N 0.05 -0.97 -0.39 2.57 5.85 -1.15 -1.21 115.31 120.06 1ss8 h LEU 23 Ca 0.02 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 1ss8 h LEU 23 Cb 0.74 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1ss8 h LEU 23 CO 0.05 -0.58 0.07 0.00 -0.34 0.00 0.00 178.44 177.63 1ss8 h ALA 24 N -0.60 0.52 -0.99 1.25 0.00 -0.64 -1.54 119.26 117.26 1ss8 h ALA 24 Ca -0.07 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ss8 h ALA 24 Cb 0.75 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1ss8 h ALA 24 CO 0.05 0.23 0.65 -0.44 0.00 0.00 0.00 179.25 179.74 1ss8 h ASP 25 N 0.50 1.12 -0.37 0.00 3.32 -0.76 0.16 116.42 120.38 1ss8 h ASP 25 Ca 0.12 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1ss8 h ASP 25 Cb 0.36 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1ss8 h ASP 25 CO 0.01 0.79 0.20 0.00 -1.72 0.00 0.00 179.24 178.51 1ss8 h ALA 26 N 1.38 0.48 -0.02 3.45 0.00 -0.69 -3.20 119.26 120.67 1ss8 h ALA 26 Ca 0.38 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 55.02 1ss8 h ALA 26 Cb -0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1ss8 h ALA 26 CO -0.10 0.01 -0.80 0.28 0.00 0.00 0.00 179.25 178.65 1ss8 h VAL 27 N 0.47 1.46 0.00 0.00 2.07 -0.88 -3.33 116.25 116.05 1ss8 h VAL 27 Ca 0.13 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.21 1ss8 h VAL 27 Cb 0.07 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1ss8 h VAL 27 CO -0.02 0.71 -0.07 2.29 0.02 0.00 0.00 177.57 180.50 1ss8 n LYS 28 N -3.72 0.11 0.32 1.57 2.85 0.54 -2.52 118.16 117.31 1ss8 n LYS 28 Ca -0.03 0.08 0.20 0.00 -1.05 0.00 0.00 58.31 57.51 1ss8 n LYS 28 Cb 0.75 -1.62 1.09 0.00 -0.65 0.00 0.00 35.03 34.61 1ss8 n LYS 28 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 177.40 176.96 1ss8 h VAL 29 N 0.00 0.16 -0.00 0.58 -1.51 -1.67 -1.98 116.25 111.82 1ss8 h VAL 29 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1ss8 h VAL 29 Cb 0.60 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 1ss8 h VAL 29 CO 0.00 0.01 -0.18 0.35 -1.23 0.00 0.00 177.57 176.51 1ss8 n THR 30 N -3.29 0.00 -2.57 7.19 -2.24 -1.05 0.33 114.28 112.66 1ss8 n THR 30 Ca -0.03 -0.07 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 1ss8 n THR 30 Cb 0.10 0.04 -0.04 0.00 -2.10 0.00 0.00 70.33 68.33 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 -2.58 4.52 0.03 3.22 2.96 -0.75 -4.31 118.68 121.77 1ss8 s LEU 31 Ca 0.25 2.06 0.00 0.00 -0.22 0.00 0.00 54.13 56.22 1ss8 s LEU 31 Cb 0.19 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.28 1ss8 s LEU 31 CO 0.52 -0.14 0.00 0.61 -1.32 0.00 0.00 176.35 176.01 1ss8 n GLY 32 N 1.88 -1.66 0.24 7.98 0.00 -1.26 -3.81 105.19 108.56 1ss8 n GLY 32 Ca 0.02 -1.49 0.15 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.11 0.00 -0.93 1.61 0.13 -1.90 -0.29 132.00 130.51 1ss8 h PRO 33 Ca -0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.56 1ss8 h PRO 33 Cb 0.11 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 30.95 1ss8 h PRO 33 CO 0.00 0.00 0.61 1.63 -0.23 0.00 0.00 178.00 180.02 1ss8 n LYS 34 N -2.97 2.48 -1.96 0.86 4.01 -1.26 -5.01 118.16 114.31 1ss8 n LYS 34 Ca 0.02 -3.21 -0.37 0.00 -0.51 0.00 0.00 58.31 54.24 1ss8 n LYS 34 Cb 0.37 -2.20 0.03 0.00 -0.51 0.00 0.00 35.03 32.72 1ss8 n LYS 34 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1ss8 s GLY 35 N -1.76 2.80 0.24 0.72 0.00 -0.12 -4.50 107.32 104.69 1ss8 s GLY 35 Ca 0.59 1.10 0.05 0.00 0.00 0.00 0.00 44.72 46.47 1ss8 s GLY 35 CO 0.04 1.54 0.36 0.50 0.00 0.00 0.00 173.10 175.55 1ss8 s ARG 36 N -3.14 3.44 0.37 2.90 1.81 0.15 -4.92 118.95 119.56 1ss8 s ARG 36 Ca 0.75 -0.75 -0.25 0.00 -1.72 0.00 0.00 55.73 53.76 1ss8 s ARG 36 Cb -0.33 -2.89 -0.09 0.00 -0.45 0.00 0.00 34.95 31.18 1ss8 s ARG 36 CO 0.38 0.43 1.01 -0.80 -0.68 0.00 0.00 175.30 175.63 1ss8 s ASN 37 N -3.97 6.99 -0.04 0.23 0.01 -1.26 -4.11 114.94 112.78 1ss8 s ASN 37 Ca 0.34 1.94 0.05 0.00 -0.71 0.00 0.00 52.86 54.49 1ss8 s ASN 37 Cb -0.09 -2.58 -0.02 0.00 0.41 0.00 0.00 41.25 38.97 1ss8 s ASN 37 CO 0.29 -0.32 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.67 1ss8 s VAL 38 N -1.67 2.59 -0.19 1.60 1.01 0.08 -4.95 120.40 118.87 1ss8 s VAL 38 Ca 0.55 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 61.54 1ss8 s VAL 38 Cb -0.20 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 1ss8 s VAL 38 CO 0.25 0.58 0.10 -0.69 0.00 0.00 0.00 175.10 175.35 1ss8 s VAL 39 N -0.56 5.17 -0.15 2.92 1.01 -1.26 -1.18 120.40 126.34 1ss8 s VAL 39 Ca 0.08 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1ss8 s VAL 39 Cb -0.11 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.94 1ss8 s VAL 39 CO 0.01 0.45 -0.18 -0.76 0.00 0.00 0.00 175.10 174.61 1ss8 s LEU 40 N 0.35 1.96 0.75 3.92 1.43 -0.41 -4.97 118.68 121.72 1ss8 s LEU 40 Ca 0.06 -0.57 -0.11 0.00 -1.03 0.00 0.00 54.13 52.48 1ss8 s LEU 40 Cb -0.12 -1.35 0.04 0.00 0.03 0.00 0.00 46.19 44.80 1ss8 s LEU 40 CO -0.01 0.01 1.08 -0.62 0.23 0.00 0.00 176.35 177.04 1ss8 s ASP 41 N 1.18 4.89 -0.01 2.29 2.15 -1.26 -1.30 116.67 124.60 1ss8 s ASP 41 Ca 0.00 1.47 -0.03 0.00 0.43 0.00 0.00 52.55 54.42 1ss8 s ASP 41 Cb -0.14 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1ss8 s ASP 41 CO -0.08 -1.74 0.07 -0.54 -0.17 0.00 0.00 175.17 172.71 1ss8 s LYS 42 N -5.09 0.23 0.46 4.34 -0.14 -1.26 -4.84 119.74 113.43 1ss8 s LYS 42 Ca 0.60 -0.15 0.26 0.00 -1.36 0.00 0.00 55.97 55.32 1ss8 s LYS 42 Cb -0.14 0.10 0.84 0.00 -1.68 0.00 0.00 37.83 36.94 1ss8 s LYS 42 CO 0.55 -0.04 1.79 0.77 -0.76 0.00 0.00 175.35 177.65 1ss8 h SER 43 N 5.35 0.00 -0.92 2.83 0.02 -1.98 -3.34 113.55 115.50 1ss8 h SER 43 Ca -0.28 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 60.75 1ss8 h SER 43 Cb 1.20 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.67 1ss8 h SER 43 CO 0.43 0.15 0.58 0.15 -1.14 0.00 0.00 176.83 177.00 1ss8 h PHE 44 N 0.00 1.07 0.00 3.45 3.57 -2.03 -3.48 116.94 119.52 1ss8 h PHE 44 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ss8 h PHE 44 Cb 0.80 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1ss8 h PHE 44 CO 0.00 0.52 0.00 0.41 -2.23 0.00 0.00 178.31 177.01 1ss8 n GLY 45 N -1.34 -0.55 3.76 2.40 0.00 -1.26 -5.13 105.19 103.08 1ss8 n GLY 45 Ca 0.14 0.41 -0.39 0.00 0.00 0.00 0.00 46.02 46.19 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 3.33 1.00 4.61 0.00 -1.26 -4.73 121.76 123.71 1ss8 s ALA 46 Ca 0.00 0.80 -0.11 0.00 0.00 0.00 0.00 51.96 52.65 1ss8 s ALA 46 Cb 0.00 -3.29 0.20 0.00 0.00 0.00 0.00 23.12 20.02 1ss8 s ALA 46 CO 0.00 -0.10 1.10 -1.25 0.00 0.00 0.00 175.76 175.51 1ss8 s PRO 47 N -1.63 0.32 0.00 0.00 0.04 -1.26 -4.76 135.00 127.71 1ss8 s PRO 47 Ca 0.47 1.31 0.02 0.00 0.04 0.00 0.00 61.00 62.85 1ss8 s PRO 47 Cb -0.29 -1.66 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 1ss8 s PRO 47 CO 0.36 -3.03 -0.04 0.95 0.04 0.00 0.00 177.00 175.29 1ss8 s THR 48 N -2.58 3.86 -0.16 1.26 -4.23 -0.42 -4.93 115.64 108.45 1ss8 s THR 48 Ca 0.67 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 1ss8 s THR 48 Cb -0.24 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.91 1ss8 s THR 48 CO 0.60 0.39 -0.16 -0.63 -0.54 0.00 0.00 174.62 174.28 1ss8 s ILE 49 N -1.03 2.57 0.04 2.99 1.01 -1.26 -1.29 121.20 124.23 1ss8 s ILE 49 Ca 0.18 -0.80 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 1ss8 s ILE 49 Cb -0.11 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.28 1ss8 s ILE 49 CO 0.09 0.52 0.21 0.28 0.00 0.00 0.00 174.94 176.03 1ss8 s THR 50 N 0.88 0.10 -0.52 2.92 -1.32 -0.33 -4.96 115.64 112.41 1ss8 s THR 50 Ca -0.04 -0.85 0.06 0.00 -1.21 0.00 0.00 61.69 59.65 1ss8 s THR 50 Cb -0.15 -0.90 0.17 0.00 -1.51 0.00 0.00 72.50 70.11 1ss8 s THR 50 CO -0.01 -0.47 1.13 0.29 -2.21 0.00 0.00 174.62 173.34 1ss8 n LYS 51 N 0.70 2.82 -2.93 7.08 5.02 -1.26 -0.74 118.16 128.85 1ss8 n LYS 51 Ca -0.19 -1.77 -0.43 0.00 -2.02 0.00 0.00 58.31 53.90 1ss8 n LYS 51 Cb 0.59 -1.15 -0.05 0.00 -0.02 0.00 0.00 35.03 34.40 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 -0.98 6.39 0.41 4.39 -1.08 -1.26 -4.83 116.67 119.70 1ss8 s ASP 52 Ca 0.13 -0.22 0.19 0.00 -0.52 0.00 0.00 52.55 52.13 1ss8 s ASP 52 Cb 0.07 -2.40 0.89 0.00 -1.46 0.00 0.00 42.92 40.02 1ss8 s ASP 52 CO 0.09 -1.01 1.85 1.23 0.52 0.00 0.00 175.17 177.85 1ss8 h GLY 53 N 10.36 0.00 0.93 2.66 0.00 -1.94 -0.88 103.07 114.20 1ss8 h GLY 53 Ca -0.25 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 1ss8 h GLY 53 CO 1.00 0.00 0.06 -2.08 0.00 0.00 0.00 176.54 175.52 1ss8 h VAL 54 N 0.00 1.24 -0.99 4.60 2.07 -1.95 -1.17 116.25 120.05 1ss8 h VAL 54 Ca -0.00 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 66.71 1ss8 h VAL 54 Cb 0.67 1.08 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 1ss8 h VAL 54 CO 0.04 0.29 0.65 0.28 0.02 0.00 0.00 177.57 178.85 1ss8 h SER 55 N 0.47 1.04 -0.09 0.57 0.02 -1.59 -2.48 113.55 111.50 1ss8 h SER 55 Ca 0.11 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 1ss8 h SER 55 Cb 0.37 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1ss8 h SER 55 CO 0.01 0.68 -0.00 0.58 -1.14 0.00 0.00 176.83 176.96 1ss8 h VAL 56 N 1.19 1.26 -0.93 2.27 2.07 -1.16 -2.70 116.25 118.25 1ss8 h VAL 56 Ca 0.42 -0.83 0.24 0.00 0.82 0.00 0.00 66.70 67.34 1ss8 h VAL 56 Cb 0.12 1.64 -0.13 0.00 -1.52 0.00 0.00 31.29 31.40 1ss8 h VAL 56 CO -0.15 0.23 0.45 0.00 0.02 0.00 0.00 177.57 178.12 1ss8 h ALA 57 N 0.72 1.56 0.00 1.67 0.00 -1.05 -0.91 119.26 121.25 1ss8 h ALA 57 Ca 0.02 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 57 Cb 0.37 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ss8 h ALA 57 CO 0.01 -0.35 -0.25 -0.09 0.00 0.00 0.00 179.25 178.57 1ss8 h ARG 58 N 0.43 0.00 -0.01 0.00 2.43 -1.11 -1.54 114.38 114.59 1ss8 h ARG 58 Ca 0.59 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.76 1ss8 h ARG 58 Cb 1.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 1ss8 h ARG 58 CO -0.53 0.25 -0.22 0.39 -1.51 0.00 0.00 179.97 178.35 1ss8 n GLU 59 N -3.49 0.72 -2.96 0.20 -0.58 -0.35 -4.88 120.64 109.30 1ss8 n GLU 59 Ca -0.00 -0.37 -0.41 0.00 -0.42 0.00 0.00 57.16 55.95 1ss8 n GLU 59 Cb 0.42 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.75 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 -2.54 4.90 -0.13 -3.67 -1.09 -0.58 -5.00 121.20 113.09 1ss8 s ILE 60 Ca 0.25 1.46 -0.08 0.00 -2.23 0.00 0.00 60.65 60.04 1ss8 s ILE 60 Cb 0.19 -4.07 0.05 0.00 -1.58 0.00 0.00 42.46 37.05 1ss8 s ILE 60 CO 0.52 0.00 0.32 -0.70 -1.23 0.00 0.00 174.94 173.85 1ss8 s GLU 61 N 2.44 0.31 0.17 2.79 2.12 -1.26 -4.92 118.70 120.35 1ss8 s GLU 61 Ca 0.33 0.58 0.07 0.00 0.36 0.00 0.00 54.97 56.32 1ss8 s GLU 61 Cb -0.16 0.00 -0.04 0.00 0.26 0.00 0.00 34.13 34.19 1ss8 s GLU 61 CO 0.09 -0.12 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.17 1ss8 s LEU 62 N 0.97 3.29 0.08 2.70 1.43 -1.26 -5.06 118.68 120.82 1ss8 s LEU 62 Ca -0.07 -0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 52.46 1ss8 s LEU 62 Cb -0.07 -1.94 -0.11 0.00 0.03 0.00 0.00 46.19 44.09 1ss8 s LEU 62 CO -0.07 0.09 1.38 -0.08 0.23 0.00 0.00 176.35 177.91 1ss8 h GLU 63 N 2.75 0.59 -6.31 1.70 4.81 -2.01 -3.42 114.58 112.68 1ss8 h GLU 63 Ca -0.47 -0.32 -0.55 0.00 -0.13 0.00 0.00 59.36 57.89 1ss8 h GLU 63 Cb 1.20 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 1ss8 h GLU 63 CO 0.58 0.92 0.98 0.34 -0.73 0.00 0.00 179.01 181.09 1ss8 s ASP 64 N -6.43 6.75 0.34 1.04 -1.08 -1.26 -4.92 116.67 111.11 1ss8 s ASP 64 Ca -0.13 2.17 0.03 0.00 -0.52 0.00 0.00 52.55 54.11 1ss8 s ASP 64 Cb 0.07 -2.55 0.62 0.00 -1.46 0.00 0.00 42.92 39.61 1ss8 s ASP 64 CO 0.81 -0.84 1.93 0.11 0.52 0.00 0.00 175.17 177.70 1ss8 h LYS 65 N 8.68 0.65 -0.25 4.34 1.79 -1.94 -0.33 116.57 129.51 1ss8 h LYS 65 Ca -0.38 -0.09 -0.08 0.00 -2.18 0.00 0.00 60.65 57.91 1ss8 h LYS 65 Cb 1.17 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 1ss8 h LYS 65 CO 0.94 0.55 -0.18 0.74 -1.08 0.00 0.00 179.45 180.42 1ss8 h PHE 66 N 0.65 0.65 -0.81 -1.35 0.04 -1.94 -2.07 116.94 112.11 1ss8 h PHE 66 Ca 0.16 -0.18 0.06 0.00 2.80 0.00 0.00 57.97 60.81 1ss8 h PHE 66 Cb 0.16 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.10 1ss8 h PHE 66 CO 0.01 0.85 0.49 0.93 -0.60 0.00 0.00 178.31 179.99 1ss8 h GLU 67 N 0.27 0.88 -0.36 1.51 5.08 -1.61 -0.39 114.58 119.95 1ss8 h GLU 67 Ca 0.05 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1ss8 h GLU 67 Cb 0.71 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1ss8 h GLU 67 CO 0.05 0.58 -0.02 -0.97 -1.00 0.00 0.00 179.01 177.65 1ss8 h ASN 68 N 0.90 0.54 -0.28 1.42 -0.73 -0.98 -1.37 115.58 115.08 1ss8 h ASN 68 Ca 0.36 -0.11 -0.09 0.00 1.87 0.00 0.00 56.30 58.32 1ss8 h ASN 68 Cb 0.18 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 38.61 1ss8 h ASN 68 CO -0.17 0.63 -0.13 0.24 -0.37 0.00 0.00 177.43 177.62 1ss8 h MET 69 N 0.54 0.71 0.18 6.67 2.86 -0.35 -0.00 114.93 125.54 1ss8 h MET 69 Ca 0.11 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1ss8 h MET 69 Cb 0.38 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 1ss8 h MET 69 CO 0.01 0.81 -0.21 0.78 1.06 0.00 0.00 176.91 179.37 1ss8 h GLY 70 N 0.97 -0.43 0.67 8.32 0.00 -0.72 -1.89 103.07 110.00 1ss8 h GLY 70 Ca 0.11 0.24 0.04 0.00 0.00 0.00 0.00 47.33 47.71 1ss8 h GLY 70 CO 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.39 1ss8 h ALA 71 N 0.31 0.19 -0.02 3.60 0.00 -0.96 -2.27 119.26 120.12 1ss8 h ALA 71 Ca 0.01 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1ss8 h ALA 71 Cb 0.42 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1ss8 h ALA 71 CO -0.07 -0.42 -0.39 1.96 0.00 0.00 0.00 179.25 180.33 1ss8 h GLN 72 N 0.07 0.03 -0.09 0.00 1.08 -0.88 -0.77 115.11 114.56 1ss8 h GLN 72 Ca 0.10 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.28 1ss8 h GLN 72 Cb 0.13 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.55 1ss8 h GLN 72 CO -0.17 0.41 0.02 0.52 -0.95 0.00 0.00 178.83 178.66 1ss8 h MET 73 N 0.03 0.14 -0.18 1.46 2.86 -0.92 0.25 114.93 118.56 1ss8 h MET 73 Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1ss8 h MET 73 Cb 0.70 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1ss8 h MET 73 CO 0.05 0.32 -0.01 0.28 1.06 0.00 0.00 176.91 178.61 1ss8 h VAL 74 N -0.07 1.26 -0.81 -2.22 2.07 -1.14 -2.61 116.25 112.73 1ss8 h VAL 74 Ca 0.03 -0.88 0.16 0.00 0.82 0.00 0.00 66.70 66.83 1ss8 h VAL 74 Cb 0.24 1.48 -0.10 0.00 -1.52 0.00 0.00 31.29 31.39 1ss8 h VAL 74 CO 0.00 0.26 0.35 0.11 0.02 0.00 0.00 177.57 178.31 1ss8 h LYS 75 N 0.07 0.45 -0.26 1.57 1.57 -1.06 0.18 116.57 119.08 1ss8 h LYS 75 Ca 0.05 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 1ss8 h LYS 75 Cb 0.40 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1ss8 h LYS 75 CO 0.01 0.30 -0.25 1.49 -0.57 0.00 0.00 179.45 180.42 1ss8 h GLU 76 N 0.46 0.49 0.13 3.15 4.81 -0.24 -2.15 114.58 121.23 1ss8 h GLU 76 Ca 0.46 -0.19 -0.32 0.00 -0.13 0.00 0.00 59.36 59.19 1ss8 h GLU 76 Cb 0.75 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1ss8 h GLU 76 CO -0.44 0.71 -1.65 0.28 -0.73 0.00 0.00 179.01 177.18 1ss8 h VAL 77 N 0.43 0.89 -0.83 0.32 2.07 -1.02 -3.26 116.25 114.85 1ss8 h VAL 77 Ca 0.06 -2.40 0.12 0.00 0.82 0.00 0.00 66.70 65.31 1ss8 h VAL 77 Cb 0.67 2.64 -0.08 0.00 -1.52 0.00 0.00 31.29 33.00 1ss8 h VAL 77 CO 0.05 0.78 0.44 0.00 0.02 0.00 0.00 177.57 178.86 1ss8 h ALA 78 N -0.00 1.21 0.00 1.67 0.00 -0.71 0.19 119.26 121.62 1ss8 h ALA 78 Ca -0.35 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ss8 h ALA 78 Cb 1.90 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1ss8 h ALA 78 CO 0.08 -0.02 0.00 -1.13 0.00 0.00 0.00 179.25 178.18 1ss8 n SER 79 N -4.82 0.59 0.13 0.00 3.41 -0.81 -0.57 113.62 111.54 1ss8 n SER 79 Ca 0.15 0.71 0.01 0.00 -0.26 0.00 0.00 58.87 59.48 1ss8 n SER 79 Cb 0.36 -0.81 0.34 0.00 -0.26 0.00 0.00 64.21 63.84 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 0.18 0.21 4.33 1.57 -1.03 -2.05 116.57 119.79 1ss8 h LYS 80 Ca 0.00 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1ss8 h LYS 80 Cb 0.17 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ss8 h LYS 80 CO 0.00 0.43 -0.10 0.00 -0.57 0.00 0.00 179.45 179.21 1ss8 h ALA 81 N 1.57 -0.29 -0.48 3.86 0.00 -0.93 0.14 119.26 123.14 1ss8 h ALA 81 Ca 0.03 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.95 1ss8 h ALA 81 Cb 0.55 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 1ss8 h ALA 81 CO 0.04 -0.65 0.03 -0.91 0.00 0.00 0.00 179.25 177.76 1ss8 h ASN 82 N -0.32 -0.14 -0.34 0.00 4.21 -1.45 0.54 115.58 118.08 1ss8 h ASN 82 Ca -0.03 0.11 0.05 0.00 1.21 0.00 0.00 56.30 57.63 1ss8 h ASN 82 Cb 0.25 0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 37.58 1ss8 h ASN 82 CO 0.05 -0.04 0.07 0.44 -1.29 0.00 0.00 177.43 176.66 1ss8 h ASP 83 N 0.15 0.02 -0.12 5.81 3.32 -0.84 0.32 116.42 125.08 1ss8 h ASP 83 Ca 0.24 0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.20 1ss8 h ASP 83 Cb 0.35 0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.98 1ss8 h ASP 83 CO -0.37 0.05 -0.49 0.00 -1.72 0.00 0.00 179.24 176.71 1ss8 h ALA 84 N 1.25 0.23 -0.00 3.45 0.00 0.71 -3.39 119.26 121.51 1ss8 h ALA 84 Ca 0.16 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ss8 h ALA 84 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ss8 h ALA 84 CO -0.21 0.40 -0.25 0.00 0.00 0.00 0.00 179.25 179.19 1ss8 n ALA 85 N -2.54 2.78 -0.20 0.00 0.00 0.18 -4.99 120.51 115.73 1ss8 n ALA 85 Ca -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1ss8 n ALA 85 Cb 0.59 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.80 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 1.02 0.81 3.73 0.00 0.00 0.11 -4.79 105.19 106.07 1ss8 n GLY 86 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.87 -0.15 0.00 1.61 2.15 -1.23 -4.90 116.67 111.27 1ss8 s ASP 87 Ca 0.00 -0.35 0.00 0.00 0.43 0.00 0.00 52.55 52.63 1ss8 s ASP 87 Cb 0.00 0.42 0.00 0.00 -0.30 0.00 0.00 42.92 43.04 1ss8 s ASP 87 CO 0.00 -0.78 0.00 0.61 -0.17 0.00 0.00 175.17 174.83 1ss8 n GLY 88 N -0.47 2.17 0.12 2.66 0.00 -1.26 -3.11 105.19 105.30 1ss8 n GLY 88 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 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 0.78 -0.52 2.61 2.02 -1.90 0.54 112.91 116.44 1ss8 h THR 89 Ca 0.00 -0.01 -0.11 0.00 0.77 0.00 0.00 66.41 67.06 1ss8 h THR 89 Cb 0.00 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1ss8 h THR 89 CO 0.00 0.00 -0.11 0.74 0.37 0.00 0.00 175.52 176.53 1ss8 h THR 90 N 0.02 1.27 -0.67 3.16 2.02 -1.91 -1.63 112.91 115.16 1ss8 h THR 90 Ca 0.12 -1.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1ss8 h THR 90 Cb 0.17 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 1ss8 h THR 90 CO -0.23 0.44 0.41 0.74 0.37 0.00 0.00 175.52 177.25 1ss8 h THR 91 N 0.86 1.19 -0.98 3.16 2.02 -1.70 -1.44 112.91 116.02 1ss8 h THR 91 Ca 0.13 -0.42 0.03 0.00 0.77 0.00 0.00 66.41 66.92 1ss8 h THR 91 Cb 0.67 0.25 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 1ss8 h THR 91 CO 0.05 0.20 0.64 0.00 0.37 0.00 0.00 175.52 176.78 1ss8 h ALA 92 N 1.21 1.34 -0.62 6.16 0.00 0.46 -0.31 119.26 127.50 1ss8 h ALA 92 Ca 0.24 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1ss8 h ALA 92 Cb -0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 1ss8 h ALA 92 CO -0.05 0.58 0.10 1.15 0.00 0.00 0.00 179.25 181.04 1ss8 h THR 93 N 1.27 1.25 -0.28 0.00 2.02 -0.36 -1.22 112.91 115.60 1ss8 h THR 93 Ca 0.38 -0.98 -0.06 0.00 0.77 0.00 0.00 66.41 66.51 1ss8 h THR 93 Cb -0.06 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 1ss8 h THR 93 CO -0.10 0.37 -0.08 0.58 0.37 0.00 0.00 175.52 176.66 1ss8 h VAL 94 N 0.95 1.28 -0.25 3.16 2.07 -0.65 -0.15 116.25 122.65 1ss8 h VAL 94 Ca 0.19 -1.12 0.05 0.00 0.82 0.00 0.00 66.70 66.64 1ss8 h VAL 94 Cb 0.40 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1ss8 h VAL 94 CO 0.01 0.35 -0.04 -0.07 0.02 0.00 0.00 177.57 177.85 1ss8 h LEU 95 N 0.30 -0.18 -0.41 2.57 3.38 -0.87 -1.47 115.31 118.63 1ss8 h LEU 95 Ca 0.07 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1ss8 h LEU 95 Cb 0.56 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1ss8 h LEU 95 CO 0.03 -0.06 0.21 0.00 0.09 0.00 0.00 178.44 178.71 1ss8 h ALA 96 N 1.24 0.53 -0.77 1.53 0.00 -1.11 0.13 119.26 120.82 1ss8 h ALA 96 Ca 0.12 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.02 1ss8 h ALA 96 Cb 0.18 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1ss8 h ALA 96 CO -0.24 0.08 0.50 0.37 0.00 0.00 0.00 179.25 179.96 1ss8 h GLN 97 N 0.53 0.69 -0.05 0.00 4.15 -0.62 0.92 115.11 120.73 1ss8 h GLN 97 Ca 0.14 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.40 1ss8 h GLN 97 Cb 0.10 -0.15 0.01 0.00 0.21 0.00 0.00 27.48 27.64 1ss8 h GLN 97 CO -0.02 0.45 -0.45 0.00 -1.93 0.00 0.00 178.83 176.88 1ss8 h ALA 98 N 1.61 0.12 -0.19 3.38 0.00 0.23 -1.32 119.26 123.08 1ss8 h ALA 98 Ca 0.35 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1ss8 h ALA 98 Cb 0.42 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1ss8 h ALA 98 CO -0.13 0.28 0.07 0.82 0.00 0.00 0.00 179.25 180.29 1ss8 h ILE 99 N -0.11 1.17 -0.76 0.00 2.04 -0.83 -2.65 117.51 116.37 1ss8 h ILE 99 Ca -0.04 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.32 1ss8 h ILE 99 Cb 1.13 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 1ss8 h ILE 99 CO 0.09 0.16 0.50 0.40 0.00 0.00 0.00 178.15 179.30 1ss8 h ILE 100 N 0.14 1.19 -0.31 -0.67 2.04 -0.84 0.29 117.51 119.34 1ss8 h ILE 100 Ca 0.06 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1ss8 h ILE 100 Cb 0.19 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 1ss8 h ILE 100 CO -0.00 0.19 0.08 0.74 0.00 0.00 0.00 178.15 179.15 1ss8 h THR 101 N 1.02 1.22 0.05 -0.27 2.02 -1.03 -0.57 112.91 115.35 1ss8 h THR 101 Ca 0.28 -0.73 -0.25 0.00 0.77 0.00 0.00 66.41 66.48 1ss8 h THR 101 Cb -0.11 1.10 0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1ss8 h THR 101 CO -0.06 0.24 -1.06 -0.33 0.37 0.00 0.00 175.52 174.68 1ss8 h GLU 102 N 0.35 0.40 -0.26 6.66 4.39 -1.15 -3.00 114.58 121.96 1ss8 h GLU 102 Ca 0.10 -0.50 0.03 0.00 0.34 0.00 0.00 59.36 59.34 1ss8 h GLU 102 Cb 0.29 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 1ss8 h GLU 102 CO 0.00 1.17 0.06 0.78 -1.16 0.00 0.00 179.01 179.86 1ss8 h GLY 103 N 1.21 0.29 2.00 -3.84 0.00 -0.27 -1.51 103.07 100.95 1ss8 h GLY 103 Ca -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1ss8 h GLY 103 CO 0.18 -0.00 -0.17 1.41 0.00 0.00 0.00 176.54 177.96 1ss8 h LEU 104 N 0.16 0.00 -0.29 3.11 3.38 -1.12 0.02 115.31 120.57 1ss8 h LEU 104 Ca 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1ss8 h LEU 104 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1ss8 h LEU 104 CO -0.15 0.17 -0.19 0.50 0.09 0.00 0.00 178.44 178.86 1ss8 h LYS 105 N 0.00 0.64 -0.16 1.13 3.64 -1.26 0.11 116.57 120.66 1ss8 h LYS 105 Ca -0.00 -0.30 -0.08 0.00 -1.27 0.00 0.00 60.65 59.00 1ss8 h LYS 105 Cb 0.33 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1ss8 h LYS 105 CO 0.02 0.89 -0.23 0.00 -2.27 0.00 0.00 179.45 177.86 1ss8 h ALA 106 N 0.74 1.30 -0.02 5.00 0.00 -0.52 -1.15 119.26 124.61 1ss8 h ALA 106 Ca 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1ss8 h ALA 106 Cb 0.73 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ss8 h ALA 106 CO 0.05 0.47 -0.01 0.28 0.00 0.00 0.00 179.25 180.04 1ss8 h VAL 107 N 0.27 1.35 -1.07 0.00 2.07 -0.51 -1.78 116.25 116.58 1ss8 h VAL 107 Ca 0.04 -1.06 0.29 0.00 0.82 0.00 0.00 66.70 66.79 1ss8 h VAL 107 Cb 0.57 2.03 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 1ss8 h VAL 107 CO 0.04 0.28 0.72 0.00 0.02 0.00 0.00 177.57 178.63 1ss8 h ALA 108 N 0.57 2.56 0.00 1.67 0.00 -0.82 0.42 119.26 123.66 1ss8 h ALA 108 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ss8 h ALA 108 Cb 0.46 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ss8 h ALA 108 CO 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 179.25 178.32 1ss8 n ALA 109 N -2.59 2.45 -0.14 0.00 0.00 -0.45 -4.87 120.51 114.91 1ss8 n ALA 109 Ca 0.25 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1ss8 n ALA 109 Cb 1.00 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 0.96 0.75 3.83 0.00 0.00 0.14 -5.07 105.19 105.79 1ss8 n GLY 110 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.86 3.61 -0.22 1.61 -1.94 -0.70 -4.97 119.30 115.83 1ss8 s MET 111 Ca 0.00 1.00 -0.29 0.00 -1.71 0.00 0.00 55.69 54.69 1ss8 s MET 111 Cb 0.00 -2.08 0.00 0.00 2.01 0.00 0.00 34.83 34.76 1ss8 s MET 111 CO 0.00 -0.56 1.13 1.21 -0.01 0.00 0.00 175.02 176.79 1ss8 s ASN 112 N -3.22 7.02 0.48 3.03 3.84 -1.26 -4.53 114.94 120.30 1ss8 s ASN 112 Ca 0.60 1.45 0.15 0.00 0.21 0.00 0.00 52.86 55.28 1ss8 s ASN 112 Cb -0.12 -2.54 1.14 0.00 -0.55 0.00 0.00 41.25 39.18 1ss8 s ASN 112 CO 0.39 -0.73 2.07 -0.65 -2.79 0.00 0.00 177.10 175.38 1ss8 h PRO 113 N 7.82 0.00 -0.14 0.43 0.11 -1.93 -0.97 132.00 137.32 1ss8 h PRO 113 Ca -0.22 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.70 1ss8 h PRO 113 Cb 1.08 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.19 1ss8 h PRO 113 CO 0.98 0.10 -0.65 0.52 -0.21 0.00 0.00 178.00 178.74 1ss8 h MET 114 N 0.00 0.69 -0.57 1.05 2.86 -1.91 -1.57 114.93 115.48 1ss8 h MET 114 Ca -0.00 -0.55 -0.04 0.00 -2.06 0.00 0.00 59.70 57.05 1ss8 h MET 114 Cb 0.17 0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1ss8 h MET 114 CO 0.01 1.17 0.21 -0.44 1.06 0.00 0.00 176.91 178.92 1ss8 h ASP 115 N 0.38 0.79 -0.96 1.22 3.32 -1.65 -1.39 116.42 118.13 1ss8 h ASP 115 Ca -0.04 -0.18 0.14 0.00 0.02 0.00 0.00 57.03 56.97 1ss8 h ASP 115 Cb 1.28 -0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.53 1ss8 h ASP 115 CO 0.13 0.76 0.58 -0.07 -1.72 0.00 0.00 179.24 178.93 1ss8 h LEU 116 N 0.78 0.81 -0.30 1.55 4.07 -1.10 -0.52 115.31 120.59 1ss8 h LEU 116 Ca 0.19 0.07 -0.19 0.00 0.08 0.00 0.00 57.88 58.02 1ss8 h LEU 116 Cb 0.22 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1ss8 h LEU 116 CO -0.01 0.38 -0.64 0.50 -1.08 0.00 0.00 178.44 177.59 1ss8 h LYS 117 N 0.86 0.76 -0.38 1.13 3.64 -0.64 -0.75 116.57 121.18 1ss8 h LYS 117 Ca 0.51 -0.53 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 1ss8 h LYS 117 Cb 0.62 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 1ss8 h LYS 117 CO -0.31 1.16 -0.11 -0.09 -2.27 0.00 0.00 179.45 177.82 1ss8 h ARG 118 N 0.56 0.67 0.76 1.90 2.43 -0.38 0.04 114.38 120.35 1ss8 h ARG 118 Ca -0.01 -0.21 -0.04 0.00 -0.81 0.00 0.00 59.98 58.91 1ss8 h ARG 118 Cb 1.24 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1ss8 h ARG 118 CO 0.13 0.77 -0.36 0.78 -1.51 0.00 0.00 179.97 179.78 1ss8 h GLY 119 N 0.97 -1.06 -0.77 2.80 0.00 -0.91 -0.51 103.07 103.57 1ss8 h GLY 119 Ca 0.11 0.39 0.17 0.00 0.00 0.00 0.00 47.33 48.00 1ss8 h GLY 119 CO 0.03 -0.39 -0.25 -2.22 0.00 0.00 0.00 176.54 173.72 1ss8 h ILE 120 N -1.27 0.10 -0.97 2.60 2.04 -1.02 -0.76 117.51 118.24 1ss8 h ILE 120 Ca -0.10 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1ss8 h ILE 120 Cb 0.78 0.10 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 1ss8 h ILE 120 CO 0.17 0.00 0.64 0.44 0.00 0.00 0.00 178.15 179.40 1ss8 h ASP 121 N -0.01 1.11 -0.19 1.72 3.32 -0.78 -0.10 116.42 121.49 1ss8 h ASP 121 Ca 0.40 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.37 1ss8 h ASP 121 Cb 0.64 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 1ss8 h ASP 121 CO -0.91 0.80 -0.09 0.50 -1.72 0.00 0.00 179.24 177.82 1ss8 h LYS 122 N 1.31 0.40 -0.86 3.56 3.64 0.34 -0.97 116.57 123.98 1ss8 h LYS 122 Ca 0.36 -0.18 0.09 0.00 -1.27 0.00 0.00 60.65 59.66 1ss8 h LYS 122 Cb -0.14 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.59 1ss8 h LYS 122 CO -0.08 0.70 0.51 0.00 -2.27 0.00 0.00 179.45 178.31 1ss8 h ALA 123 N 0.69 1.24 -0.38 5.00 0.00 -1.02 -1.40 119.26 123.39 1ss8 h ALA 123 Ca 0.04 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 123 Cb 0.58 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ss8 h ALA 123 CO 0.03 0.15 0.10 0.28 0.00 0.00 0.00 179.25 179.80 1ss8 h VAL 124 N 0.86 1.22 -0.44 0.00 2.07 -0.49 0.82 116.25 120.29 1ss8 h VAL 124 Ca 0.41 -0.76 0.09 0.00 0.82 0.00 0.00 66.70 67.26 1ss8 h VAL 124 Cb 0.36 1.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.04 1ss8 h VAL 124 CO -0.24 0.26 -0.12 0.74 0.02 0.00 0.00 177.57 178.24 1ss8 h THR 125 N 0.47 0.55 -0.27 2.57 2.02 -0.67 -1.13 112.91 116.44 1ss8 h THR 125 Ca 0.12 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 67.12 1ss8 h THR 125 Cb 0.30 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1ss8 h THR 125 CO 0.00 0.00 -0.54 0.58 0.37 0.00 0.00 175.52 175.93 1ss8 h VAL 126 N -0.01 1.28 -0.89 3.16 2.07 -1.05 -2.55 116.25 118.26 1ss8 h VAL 126 Ca 0.21 -1.73 0.06 0.00 0.82 0.00 0.00 66.70 66.07 1ss8 h VAL 126 Cb 0.33 1.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.71 1ss8 h VAL 126 CO -0.46 0.56 0.58 0.00 0.02 0.00 0.00 177.57 178.28 1ss8 h ALA 127 N 0.66 1.52 -0.37 1.67 0.00 -0.62 -1.29 119.26 120.84 1ss8 h ALA 127 Ca 0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1ss8 h ALA 127 Cb 1.15 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1ss8 h ALA 127 CO 0.12 0.34 -0.19 0.28 0.00 0.00 0.00 179.25 179.81 1ss8 h VAL 128 N 1.01 1.26 -0.77 0.00 2.07 -0.83 0.44 116.25 119.44 1ss8 h VAL 128 Ca 0.38 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1ss8 h VAL 128 Cb 0.20 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1ss8 h VAL 128 CO -0.14 0.41 0.34 -0.33 0.02 0.00 0.00 177.57 177.87 1ss8 h GLU 129 N 0.61 1.12 -0.31 1.57 5.08 -1.01 -2.41 114.58 119.23 1ss8 h GLU 129 Ca 0.09 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 1ss8 h GLU 129 Cb 0.66 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1ss8 h GLU 129 CO 0.05 0.89 -0.15 0.93 -1.00 0.00 0.00 179.01 179.73 1ss8 h GLU 130 N 1.09 0.66 -0.92 2.33 4.39 0.12 -1.96 114.58 120.29 1ss8 h GLU 130 Ca 0.26 -0.28 0.22 0.00 0.34 0.00 0.00 59.36 59.90 1ss8 h GLU 130 Cb 0.16 -0.02 -0.12 0.00 -0.10 0.00 0.00 28.75 28.67 1ss8 h GLU 130 CO -0.03 0.87 0.45 -0.07 -1.16 0.00 0.00 179.01 179.08 1ss8 h LEU 131 N 0.42 0.44 -0.73 1.33 3.38 -0.12 -0.45 115.31 119.57 1ss8 h LEU 131 Ca 0.07 0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1ss8 h LEU 131 Cb 0.67 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1ss8 h LEU 131 CO 0.05 0.04 0.27 0.50 0.09 0.00 0.00 178.44 179.38 1ss8 h LYS 132 N 0.46 1.10 -0.01 1.13 3.64 -0.98 -1.75 116.57 120.17 1ss8 h LYS 132 Ca 0.58 -0.21 -0.16 0.00 -1.27 0.00 0.00 60.65 59.58 1ss8 h LYS 132 Cb 1.09 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.72 1ss8 h LYS 132 CO -0.51 0.92 -0.75 0.00 -2.27 0.00 0.00 179.45 176.84 1ss8 h ALA 133 N 1.13 0.73 0.00 5.00 0.00 -0.61 -2.95 119.26 122.56 1ss8 h ALA 133 Ca 0.24 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ss8 h ALA 133 Cb 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1ss8 h ALA 133 CO -0.02 0.89 0.00 1.25 0.00 0.00 0.00 179.25 181.38 1ss8 h LEU 134 N 0.05 0.00 -9.65 0.00 5.85 -0.90 -3.47 115.31 107.20 1ss8 h LEU 134 Ca -0.02 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.18 1ss8 h LEU 134 Cb 1.33 0.00 0.05 0.00 0.37 0.00 0.00 40.66 42.41 1ss8 h LEU 134 CO 0.11 0.00 0.94 -0.55 -0.34 0.00 0.00 178.44 178.60 1ss8 s SER 135 N -5.64 6.47 -0.13 1.25 0.15 -0.68 -4.86 113.70 110.26 1ss8 s SER 135 Ca 0.07 2.77 -0.20 0.00 0.70 0.00 0.00 55.95 59.29 1ss8 s SER 135 Cb 0.07 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.75 1ss8 s SER 135 CO 0.63 -0.90 0.55 -0.69 1.20 0.00 0.00 173.24 174.02 1ss8 s VAL 136 N 1.03 5.13 0.55 4.45 1.01 -0.50 -4.90 120.40 127.16 1ss8 s VAL 136 Ca 0.71 1.07 -0.19 0.00 0.00 0.00 0.00 61.98 63.57 1ss8 s VAL 136 Cb -0.47 -3.88 -0.06 0.00 0.00 0.00 0.00 36.38 31.98 1ss8 s VAL 136 CO 0.33 0.26 1.14 -2.16 0.00 0.00 0.00 175.10 174.67 1ss8 s PRO 137 N 1.00 3.33 -0.55 2.72 0.04 -1.26 -1.76 135.00 138.52 1ss8 s PRO 137 Ca 0.28 1.64 0.04 0.00 0.04 0.00 0.00 61.00 63.00 1ss8 s PRO 137 Cb -0.16 -2.01 0.16 0.00 0.04 0.00 0.00 34.50 32.53 1ss8 s PRO 137 CO 0.12 -0.87 0.38 0.00 0.04 0.00 0.00 177.00 176.66 1ss8 n SER 139 N 2.67 0.09 -4.39 0.00 3.41 -1.26 -4.23 113.62 109.91 1ss8 n SER 139 Ca 0.19 -1.74 -0.21 0.00 -0.26 0.00 0.00 58.87 56.85 1ss8 n SER 139 Cb 0.38 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.08 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 -0.76 2.96 0.33 4.04 -4.77 -1.26 -5.03 116.67 112.18 1ss8 s ASP 140 Ca 0.01 -1.01 0.09 0.00 -3.30 0.00 0.00 52.55 48.34 1ss8 s ASP 140 Cb 0.01 -0.20 0.84 0.00 -1.09 0.00 0.00 42.92 42.48 1ss8 s ASP 140 CO 0.00 -0.08 1.78 0.28 0.70 0.00 0.00 175.17 177.85 1ss8 h SER 141 N 2.54 0.69 -0.24 2.11 0.02 -1.97 -1.39 113.55 115.31 1ss8 h SER 141 Ca -0.39 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 60.63 1ss8 h SER 141 Cb 1.23 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 1ss8 h SER 141 CO 0.60 0.22 0.04 0.11 -1.14 0.00 0.00 176.83 176.66 1ss8 h LYS 142 N 0.66 0.40 -0.51 3.45 1.79 -1.99 -1.99 116.57 118.37 1ss8 h LYS 142 Ca 0.58 -0.10 -0.07 0.00 -2.18 0.00 0.00 60.65 58.88 1ss8 h LYS 142 Cb 1.05 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.63 1ss8 h LYS 142 CO -0.37 0.52 0.03 0.00 -1.08 0.00 0.00 179.45 178.56 1ss8 h ALA 143 N 0.86 1.10 -0.14 3.86 0.00 -1.74 -1.76 119.26 121.43 1ss8 h ALA 143 Ca 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1ss8 h ALA 143 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ss8 h ALA 143 CO 0.00 0.58 0.06 0.82 0.00 0.00 0.00 179.25 180.72 1ss8 h ILE 144 N 0.79 0.99 -0.77 0.00 2.04 -1.15 -0.97 117.51 118.43 1ss8 h ILE 144 Ca 0.16 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.99 1ss8 h ILE 144 Cb 0.43 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 1ss8 h ILE 144 CO 0.02 0.03 0.50 0.00 0.00 0.00 0.00 178.15 178.69 1ss8 h ALA 145 N 1.07 1.00 -0.27 1.87 0.00 -1.18 0.27 119.26 122.02 1ss8 h ALA 145 Ca 0.06 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ss8 h ALA 145 Cb 0.01 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1ss8 h ALA 145 CO -0.04 0.35 0.09 1.96 0.00 0.00 0.00 179.25 181.61 1ss8 h GLN 146 N 1.01 0.40 -0.35 0.00 4.20 -0.99 0.73 115.11 120.11 1ss8 h GLN 146 Ca 0.30 -0.08 -0.08 0.00 0.06 0.00 0.00 58.65 58.84 1ss8 h GLN 146 Cb -0.06 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1ss8 h GLN 146 CO -0.08 0.45 -0.09 0.28 -0.67 0.00 0.00 178.83 178.72 1ss8 h VAL 147 N 0.27 1.28 -0.85 -0.54 2.07 -0.80 -1.40 116.25 116.27 1ss8 h VAL 147 Ca 0.09 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 1ss8 h VAL 147 Cb 0.21 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1ss8 h VAL 147 CO -0.01 0.38 0.52 1.23 0.02 0.00 0.00 177.57 179.71 1ss8 h GLY 148 N 0.48 1.23 2.00 2.17 0.00 -0.72 -0.15 103.07 108.09 1ss8 h GLY 148 Ca 0.09 -0.51 -0.13 0.00 0.00 0.00 0.00 47.33 46.78 1ss8 h GLY 148 CO 0.04 0.49 -0.62 -0.91 0.00 0.00 0.00 176.54 175.54 1ss8 h THR 149 N 1.17 1.24 -0.15 4.70 1.35 -0.56 -1.70 112.91 118.97 1ss8 h THR 149 Ca 0.31 -2.27 -0.06 0.00 -0.55 0.00 0.00 66.41 63.84 1ss8 h THR 149 Cb -0.05 2.29 -0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1ss8 h THR 149 CO -0.06 0.60 -0.14 0.40 -0.25 0.00 0.00 175.52 176.07 1ss8 h ILE 150 N 0.00 1.34 0.00 6.82 2.04 -0.60 0.26 117.51 127.37 1ss8 h ILE 150 Ca -0.01 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.55 1ss8 h ILE 150 Cb 1.25 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 39.19 1ss8 h ILE 150 CO 0.08 0.38 -0.03 0.28 0.00 0.00 0.00 178.15 178.86 1ss8 h SER 151 N -0.01 0.00 -0.88 1.72 0.02 -1.00 -2.48 113.55 110.92 1ss8 h SER 151 Ca 0.02 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.53 1ss8 h SER 151 Cb 0.67 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 62.94 1ss8 h SER 151 CO 0.04 0.03 0.57 0.00 -1.14 0.00 0.00 176.83 176.32 1ss8 n ALA 152 N -2.17 5.22 -3.32 3.77 0.00 -0.64 -4.51 120.51 118.85 1ss8 n ALA 152 Ca -0.02 -2.56 -0.19 0.00 0.00 0.00 0.00 53.44 50.66 1ss8 n ALA 152 Cb 0.16 -1.39 0.06 0.00 0.00 0.00 0.00 19.45 18.28 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 -0.91 -5.55 -0.61 0.00 2.85 -0.93 -3.00 115.26 107.10 1ss8 n ASN 153 Ca 0.53 -0.41 -0.07 0.00 -0.11 0.00 0.00 54.58 54.51 1ss8 n ASN 153 Cb 1.54 -4.19 -0.02 0.00 1.24 0.00 0.00 39.78 38.35 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 -2.11 -3.55 -4.44 1.20 7.64 0.89 -4.98 113.62 108.27 1ss8 n SER 154 Ca -0.01 0.13 -0.44 0.00 1.01 0.00 0.00 58.87 59.57 1ss8 n SER 154 Cb 0.56 -1.99 -0.04 0.00 -1.01 0.00 0.00 64.21 61.73 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 -2.86 6.31 0.58 6.43 -1.08 -1.16 -4.89 116.67 119.99 1ss8 s ASP 155 Ca 0.00 -1.39 0.29 0.00 -0.52 0.00 0.00 52.55 50.92 1ss8 s ASP 155 Cb 0.00 -2.39 1.49 0.00 -1.46 0.00 0.00 42.92 40.56 1ss8 s ASP 155 CO 0.00 -1.26 1.93 1.05 0.52 0.00 0.00 175.17 177.40 1ss8 h GLU 156 N 9.27 0.00 -0.45 4.34 4.11 -1.92 -1.53 114.58 128.40 1ss8 h GLU 156 Ca -0.16 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.24 1ss8 h GLU 156 Cb 1.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1ss8 h GLU 156 CO 1.14 0.00 0.16 1.15 0.07 0.00 0.00 179.01 181.53 1ss8 h THR 157 N 0.00 1.21 -0.54 -1.06 2.02 -1.98 -2.18 112.91 110.39 1ss8 h THR 157 Ca 0.22 -0.69 -0.11 0.00 0.77 0.00 0.00 66.41 66.60 1ss8 h THR 157 Cb 1.13 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1ss8 h THR 157 CO -0.00 0.25 -0.09 0.58 0.37 0.00 0.00 175.52 176.63 1ss8 h VAL 158 N 0.58 1.27 0.12 3.16 2.07 -1.63 -1.34 116.25 120.48 1ss8 h VAL 158 Ca 0.15 -1.24 0.01 0.00 0.82 0.00 0.00 66.70 66.44 1ss8 h VAL 158 Cb 0.23 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1ss8 h VAL 158 CO -0.01 0.44 -0.17 1.23 0.02 0.00 0.00 177.57 179.08 1ss8 h GLY 159 N 0.89 -0.33 -0.28 2.17 0.00 -1.47 -1.81 103.07 102.24 1ss8 h GLY 159 Ca 0.14 0.20 0.17 0.00 0.00 0.00 0.00 47.33 47.84 1ss8 h GLY 159 CO 0.04 -0.17 0.05 1.70 0.00 0.00 0.00 176.54 178.17 1ss8 h LYS 160 N -0.35 0.13 -0.48 4.80 3.64 -1.11 -0.77 116.57 122.44 1ss8 h LYS 160 Ca 0.02 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 1ss8 h LYS 160 Cb 0.35 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1ss8 h LYS 160 CO -0.08 0.09 0.12 -0.07 -2.27 0.00 0.00 179.45 177.24 1ss8 h LEU 161 N 0.14 0.73 0.43 5.20 3.38 -0.46 -1.21 115.31 123.52 1ss8 h LEU 161 Ca 0.41 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1ss8 h LEU 161 Cb 0.73 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1ss8 h LEU 161 CO -0.62 0.76 -0.21 0.40 0.09 0.00 0.00 178.44 178.86 1ss8 h ILE 162 N 0.65 0.58 -0.88 1.22 1.08 -0.74 -1.19 117.51 118.23 1ss8 h ILE 162 Ca 0.15 -0.01 0.13 0.00 -0.39 0.00 0.00 64.86 64.75 1ss8 h ILE 162 Cb 0.32 0.58 -0.09 0.00 -3.07 0.00 0.00 36.82 34.56 1ss8 h ILE 162 CO 0.00 0.00 0.49 0.00 -0.69 0.00 0.00 178.15 177.96 1ss8 h ALA 163 N -0.01 1.32 -0.48 1.87 0.00 -0.97 0.39 119.26 121.38 1ss8 h ALA 163 Ca -0.06 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 163 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ss8 h ALA 163 CO 0.10 0.02 0.20 0.93 0.00 0.00 0.00 179.25 180.50 1ss8 h GLU 164 N 0.75 0.71 -0.07 0.00 5.08 -0.99 0.55 114.58 120.60 1ss8 h GLU 164 Ca 0.46 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1ss8 h GLU 164 Cb 0.56 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1ss8 h GLU 164 CO -0.31 0.63 0.03 0.00 -1.00 0.00 0.00 179.01 178.36 1ss8 h ALA 165 N 1.04 0.09 0.00 3.43 0.00 0.05 -0.73 119.26 123.14 1ss8 h ALA 165 Ca 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1ss8 h ALA 165 Cb 0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ss8 h ALA 165 CO -0.01 -0.34 -0.19 0.52 0.00 0.00 0.00 179.25 179.23 1ss8 h MET 166 N -0.03 0.00 -0.14 0.00 2.86 -0.80 -0.08 114.93 116.75 1ss8 h MET 166 Ca 0.02 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.51 1ss8 h MET 166 Cb 0.14 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.81 1ss8 h MET 166 CO -0.00 0.19 -0.51 0.22 1.06 0.00 0.00 176.91 177.86 1ss8 h ASP 167 N 0.00 0.69 0.95 1.22 3.58 -0.70 0.18 116.42 122.33 1ss8 h ASP 167 Ca -0.00 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 56.83 1ss8 h ASP 167 Cb 0.51 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.36 1ss8 h ASP 167 CO 0.02 1.19 0.00 0.50 -2.88 0.00 0.00 179.24 178.07 1ss8 h LYS 168 N 0.23 0.00 0.00 0.28 1.63 0.53 -3.35 116.57 115.89 1ss8 h LYS 168 Ca -0.03 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1ss8 h LYS 168 Cb 1.15 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 1ss8 h LYS 168 CO 0.11 0.00 0.00 1.55 -3.45 0.00 0.00 179.45 177.66 1ss8 n VAL 169 N -3.05 0.00 0.00 2.00 3.14 -0.86 -5.08 118.33 114.49 1ss8 n VAL 169 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1ss8 n VAL 169 Cb 0.29 0.86 0.00 0.00 -1.06 0.00 0.00 33.84 33.93 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 0.14 0.29 7.55 0.00 0.62 -3.62 105.19 110.16 1ss8 n GLY 170 Ca 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 0.76 0.00 1.61 1.57 -1.94 -1.66 116.57 116.91 1ss8 h LYS 171 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ss8 h LYS 171 Cb 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.14 1ss8 h LYS 171 CO 0.00 0.50 0.00 0.39 -0.57 0.00 0.00 179.45 179.77 1ss8 n GLU 172 N -4.73 0.14 -0.77 3.15 -0.58 -1.26 -4.94 120.64 111.65 1ss8 n GLU 172 Ca 0.11 0.03 -0.29 0.00 -0.42 0.00 0.00 57.16 56.59 1ss8 n GLU 172 Cb 0.20 -1.50 0.24 0.00 -0.57 0.00 0.00 31.44 29.81 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 -2.85 1.53 -0.21 0.62 0.00 -0.62 -5.00 107.32 100.78 1ss8 s GLY 173 Ca 0.18 -0.48 -0.12 0.00 0.00 0.00 0.00 44.72 44.30 1ss8 s GLY 173 CO 0.47 0.31 0.22 0.54 0.00 0.00 0.00 173.10 174.64 1ss8 s VAL 174 N -2.65 5.33 -0.08 1.40 0.11 -1.26 -4.99 120.40 118.25 1ss8 s VAL 174 Ca 0.68 0.35 0.01 0.00 -2.93 0.00 0.00 61.98 60.09 1ss8 s VAL 174 Cb -0.19 -3.56 0.02 0.00 -1.53 0.00 0.00 36.38 31.12 1ss8 s VAL 174 CO 0.60 0.35 -0.09 -0.63 -3.33 0.00 0.00 175.10 172.00 1ss8 s ILE 175 N 0.88 1.00 0.37 7.04 1.01 -1.26 -1.19 121.20 129.05 1ss8 s ILE 175 Ca 0.11 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.51 1ss8 s ILE 175 Cb -0.13 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.31 1ss8 s ILE 175 CO 0.04 0.34 0.08 0.42 0.00 0.00 0.00 174.94 175.83 1ss8 s THR 176 N 1.20 2.50 -0.08 2.92 -4.23 -0.11 -4.96 115.64 112.87 1ss8 s THR 176 Ca -0.05 -1.85 0.04 0.00 -1.18 0.00 0.00 61.69 58.66 1ss8 s THR 176 Cb -0.14 -2.91 -0.01 0.00 1.34 0.00 0.00 72.50 70.78 1ss8 s THR 176 CO -0.02 -0.11 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.03 1ss8 s VAL 177 N -2.56 2.23 0.32 2.29 1.01 -1.26 -0.93 120.40 121.50 1ss8 s VAL 177 Ca 0.37 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1ss8 s VAL 177 Cb 0.02 -1.85 -0.06 0.00 0.00 0.00 0.00 36.38 34.49 1ss8 s VAL 177 CO 0.21 0.56 0.04 -1.61 0.00 0.00 0.00 175.10 174.30 1ss8 s GLU 178 N 0.08 1.63 0.57 2.72 2.02 -0.04 -4.96 118.70 120.73 1ss8 s GLU 178 Ca -0.10 -1.89 -0.21 0.00 0.02 0.00 0.00 54.97 52.79 1ss8 s GLU 178 Cb -0.16 -0.89 -0.04 0.00 0.10 0.00 0.00 34.13 33.14 1ss8 s GLU 178 CO 0.06 -0.16 1.30 -0.25 0.02 0.00 0.00 175.26 176.23 1ss8 n ASP 179 N -0.67 2.35 -4.30 -0.19 8.00 -1.26 -2.28 116.55 118.20 1ss8 n ASP 179 Ca -0.03 0.93 -0.27 0.00 0.71 0.00 0.00 54.79 56.14 1ss8 n ASP 179 Cb 0.66 -1.55 0.16 0.00 -0.02 0.00 0.00 41.12 40.37 1ss8 n ASP 179 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ss8 n GLY 180 N 0.85 -0.34 0.00 0.44 0.00 -0.39 -4.37 105.19 101.37 1ss8 n GLY 180 Ca 0.12 -1.89 0.01 0.00 0.00 0.00 0.00 46.02 44.27 1ss8 n GLY 180 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ss8 n THR 181 N -3.34 0.00 -0.88 2.61 -2.24 -1.26 -4.93 114.28 104.24 1ss8 n THR 181 Ca 0.17 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1ss8 n THR 181 Cb 0.60 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 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 1.06 2.99 0.17 3.38 0.00 -1.26 -5.03 105.19 106.50 1ss8 n GLY 182 Ca 0.01 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 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 0.66-10.01 0.99 5.85 -1.93 -2.95 115.31 107.93 1ss8 h LEU 183 Ca 0.00 -0.53 -0.46 0.00 0.84 0.00 0.00 57.88 57.73 1ss8 h LEU 183 Cb 0.00 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 1ss8 h LEU 183 CO 0.00 1.34 0.36 -1.10 -0.34 0.00 0.00 178.44 178.70 1ss8 s GLN 184 N -3.27 4.21 0.45 1.25 -1.52 -1.26 -2.41 119.66 117.10 1ss8 s GLN 184 Ca -0.07 1.28 -0.16 0.00 -1.95 0.00 0.00 55.36 54.46 1ss8 s GLN 184 Cb 0.08 -2.36 -0.08 0.00 -0.22 0.00 0.00 33.01 30.43 1ss8 s GLN 184 CO 0.89 -0.06 0.90 -0.51 -0.25 0.00 0.00 175.29 176.25 1ss8 s ASP 185 N -1.91 6.68 0.09 5.90 1.01 -1.26 -3.43 116.67 123.75 1ss8 s ASP 185 Ca 0.60 1.46 0.04 0.00 0.71 0.00 0.00 52.55 55.36 1ss8 s ASP 185 Cb -0.15 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 1ss8 s ASP 185 CO 0.19 -0.45 -0.11 -1.61 0.21 0.00 0.00 175.17 173.40 1ss8 s GLU 186 N -3.70 0.84 -0.08 8.23 2.02 0.38 -4.91 118.70 121.48 1ss8 s GLU 186 Ca 0.57 -1.11 -0.03 0.00 0.02 0.00 0.00 54.97 54.42 1ss8 s GLU 186 Cb -0.10 -0.59 0.04 0.00 0.10 0.00 0.00 34.13 33.58 1ss8 s GLU 186 CO 0.26 0.10 0.08 -1.17 0.02 0.00 0.00 175.26 174.55 1ss8 s LEU 187 N -2.28 0.16 0.06 1.80 2.96 -1.26 -0.61 118.68 119.51 1ss8 s LEU 187 Ca 0.04 -0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 53.85 1ss8 s LEU 187 Cb -0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 46.19 46.50 1ss8 s LEU 187 CO 0.01 -0.28 -0.01 1.51 -1.32 0.00 0.00 176.35 176.26 1ss8 s ASP 188 N 2.18 0.45 -0.11 3.68 -4.77 -1.00 -4.99 116.67 112.11 1ss8 s ASP 188 Ca 0.04 -1.00 -0.04 0.00 -3.30 0.00 0.00 52.55 48.25 1ss8 s ASP 188 Cb -0.13 0.22 -0.04 0.00 -1.09 0.00 0.00 42.92 41.88 1ss8 s ASP 188 CO -0.05 -0.62 0.04 -0.69 0.70 0.00 0.00 175.17 174.55 1ss8 s VAL 189 N -3.93 4.67 0.03 2.11 1.01 -1.26 -0.01 120.40 123.02 1ss8 s VAL 189 Ca 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 1ss8 s VAL 189 Cb 0.08 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 1ss8 s VAL 189 CO -0.09 0.58 -0.03 0.54 0.00 0.00 0.00 175.10 176.10 1ss8 s VAL 190 N -0.64 0.16 0.30 2.92 0.11 -0.63 -4.96 120.40 117.66 1ss8 s VAL 190 Ca 0.11 -1.19 -0.30 0.00 -2.93 0.00 0.00 61.98 57.67 1ss8 s VAL 190 Cb -0.12 -0.65 -0.11 0.00 -1.53 0.00 0.00 36.38 33.97 1ss8 s VAL 190 CO 0.02 -0.64 1.58 -1.61 -3.33 0.00 0.00 175.10 171.12 1ss8 s GLU 191 N -2.20 4.13 0.00 1.54 0.41 -1.26 -1.39 118.70 119.92 1ss8 s GLU 191 Ca -0.09 2.57 0.00 0.00 -0.41 0.00 0.00 54.97 57.04 1ss8 s GLU 191 Cb -0.05 -3.02 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 1ss8 s GLU 191 CO -0.04 -0.62 0.00 0.41 -0.49 0.00 0.00 175.26 174.52 1ss8 n GLY 192 N 2.07 -1.42 3.59 -1.39 0.00 -1.26 -0.72 105.19 106.05 1ss8 n GLY 192 Ca 0.08 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.27 0.59 -0.05 1.61 1.75 -0.58 -4.07 119.30 117.28 1ss8 s MET 193 Ca 0.00 0.24 0.04 0.00 -1.25 0.00 0.00 55.69 54.72 1ss8 s MET 193 Cb 0.00 0.28 -0.00 0.00 2.84 0.00 0.00 34.83 37.95 1ss8 s MET 193 CO 0.00 -0.17 -0.18 -1.14 -0.65 0.00 0.00 175.02 172.88 1ss8 s GLN 194 N -0.85 1.97 0.22 4.11 0.74 -1.26 -0.99 119.66 123.59 1ss8 s GLN 194 Ca -0.01 -0.64 0.06 0.00 0.05 0.00 0.00 55.36 54.81 1ss8 s GLN 194 Cb -0.01 -1.67 -0.05 0.00 1.10 0.00 0.00 33.01 32.38 1ss8 s GLN 194 CO 0.00 0.23 -0.09 -0.59 -0.55 0.00 0.00 175.29 174.30 1ss8 s PHE 195 N 0.11 1.64 -1.29 1.67 -0.71 -0.42 -5.00 117.98 113.97 1ss8 s PHE 195 Ca -0.06 -0.71 -0.06 0.00 -1.04 0.00 0.00 56.93 55.05 1ss8 s PHE 195 Cb -0.13 -0.86 0.15 0.00 -1.21 0.00 0.00 43.02 40.97 1ss8 s PHE 195 CO 0.03 0.20 2.21 -0.25 -1.34 0.00 0.00 175.22 176.07 1ss8 n ASP 196 N -0.40 7.28 -3.75 1.98 8.00 -1.26 -1.77 116.55 126.64 1ss8 n ASP 196 Ca -0.07 -3.17 -0.17 0.00 0.71 0.00 0.00 54.79 52.09 1ss8 n ASP 196 Cb 0.62 -1.38 -0.17 0.00 -0.02 0.00 0.00 41.12 40.18 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 -0.99 -0.02 0.52 -1.24 1.81 -1.23 -4.78 118.95 113.03 1ss8 s ARG 197 Ca 0.49 0.23 -0.03 0.00 -1.72 0.00 0.00 55.73 54.71 1ss8 s ARG 197 Cb 0.16 -0.35 0.11 0.00 -0.45 0.00 0.00 34.95 34.42 1ss8 s ARG 197 CO -0.07 -0.21 0.71 0.41 -0.68 0.00 0.00 175.30 175.46 1ss8 n GLY 198 N 4.51 0.14 3.73 -3.53 0.00 -1.25 -2.25 105.19 106.53 1ss8 n GLY 198 Ca -0.21 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.52 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 -2.20 2.09 -0.22 1.61 -0.85 -0.75 -4.35 117.35 112.68 1ss8 s TYR 199 Ca 0.45 1.50 0.19 0.00 -0.52 0.00 0.00 57.07 58.68 1ss8 s TYR 199 Cb -0.02 -3.67 0.04 0.00 0.38 0.00 0.00 41.96 38.69 1ss8 s TYR 199 CO 0.30 -2.87 1.21 -0.07 -1.52 0.00 0.00 175.55 172.61 1ss8 h LEU 200 N 0.49 0.00 -7.95 -3.49 3.38 -1.58 -3.45 115.31 102.71 1ss8 h LEU 200 Ca -0.51 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.25 1ss8 h LEU 200 Cb 1.33 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.85 1ss8 h LEU 200 CO 0.53 0.32 -0.72 -0.94 0.09 0.00 0.00 178.44 177.73 1ss8 s SER 201 N -5.98 0.33 0.37 -0.43 1.04 -1.26 -5.02 113.70 102.74 1ss8 s SER 201 Ca 0.02 -0.35 0.17 0.00 0.48 0.00 0.00 55.95 56.26 1ss8 s SER 201 Cb 0.08 0.05 0.90 0.00 0.10 0.00 0.00 66.02 67.15 1ss8 s SER 201 CO 0.76 -0.17 1.43 -0.65 0.98 0.00 0.00 173.24 175.59 1ss8 h PRO 202 N 5.12 0.00 0.00 4.02 0.11 -2.01 -3.05 132.00 136.19 1ss8 h PRO 202 Ca -0.30 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 1ss8 h PRO 202 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ss8 h PRO 202 CO 0.44 0.00 -0.10 1.88 -0.21 0.00 0.00 178.00 180.02 1ss8 h TYR 203 N 0.00 0.00 0.00 0.65 0.05 -1.98 -3.03 116.97 112.66 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 0.52 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.26 1ss8 h TYR 203 CO 0.00 0.05 0.00 0.74 -1.05 0.00 0.00 178.16 177.90 1ss8 h PHE 204 N 0.00 0.00 -1.16 4.88 0.04 -1.87 -3.43 116.94 115.40 1ss8 h PHE 204 Ca -0.00 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.25 1ss8 h PHE 204 Cb 1.04 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.17 1ss8 h PHE 204 CO 0.00 0.00 1.62 -0.89 -0.60 0.00 0.00 178.31 178.44 1ss8 n ILE 205 N -2.52 0.01 1.11 -0.55 5.41 -1.15 -4.74 119.36 116.93 1ss8 n ILE 205 Ca 0.01 -0.49 0.12 0.00 1.00 0.00 0.00 62.75 63.39 1ss8 n ILE 205 Cb 0.23 -2.04 0.16 0.00 -0.71 0.00 0.00 39.64 37.29 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 13.29 1.94 -3.73 4.38 0.23 -1.12 -4.60 115.26 125.66 1ss8 n ASN 206 Ca 0.44 -1.47 -0.28 0.00 -0.53 0.00 0.00 54.58 52.75 1ss8 n ASN 206 Cb 0.36 0.25 -0.11 0.00 -2.08 0.00 0.00 39.78 38.20 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 0.13 1.58 0.24 -3.83 5.02 -0.41 -4.99 118.16 115.90 1ss8 n LYS 207 Ca 0.12 -4.23 0.18 0.00 -2.02 0.00 0.00 58.31 52.36 1ss8 n LYS 207 Cb 0.46 -2.14 0.88 0.00 -0.02 0.00 0.00 35.03 34.20 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 5.24 0.00 -0.12 1.97 0.13 -1.81 -1.26 132.00 136.15 1ss8 h PRO 208 Ca 0.18 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.13 1ss8 h PRO 208 Cb 0.77 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 1ss8 h PRO 208 CO 0.66 0.00 -0.66 0.93 -0.23 0.00 0.00 178.00 178.70 1ss8 h GLU 209 N 0.00 0.46 0.00 0.86 3.07 -1.94 -2.09 114.58 114.93 1ss8 h GLU 209 Ca 0.07 -0.34 0.00 0.00 -0.50 0.00 0.00 59.36 58.59 1ss8 h GLU 209 Cb 0.50 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1ss8 h GLU 209 CO -0.00 0.96 -0.64 1.15 -1.40 0.00 0.00 179.01 179.08 1ss8 h THR 210 N 0.33 0.00 -5.07 1.13 2.02 -1.93 -3.48 112.91 105.91 1ss8 h THR 210 Ca -0.02 -0.58 -0.35 0.00 0.77 0.00 0.00 66.41 66.23 1ss8 h THR 210 Cb 1.22 1.18 0.11 0.00 -1.74 0.00 0.00 68.15 68.92 1ss8 h THR 210 CO 0.12 0.00 -0.59 0.61 0.37 0.00 0.00 175.52 176.03 1ss8 n GLY 211 N 1.30 -0.36 3.54 2.16 0.00 -0.52 -5.03 105.19 106.29 1ss8 n GLY 211 Ca 0.03 0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 2.95 -0.20 4.61 0.00 -0.96 -4.64 121.76 120.27 1ss8 s ALA 212 Ca 0.48 -2.00 -0.05 0.00 0.00 0.00 0.00 51.96 50.40 1ss8 s ALA 212 Cb -0.21 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 1ss8 s ALA 212 CO 0.60 0.14 -0.01 0.08 0.00 0.00 0.00 175.76 176.56 1ss8 s VAL 213 N -2.56 3.84 -0.14 0.00 1.01 -0.51 -1.28 120.40 120.76 1ss8 s VAL 213 Ca 0.32 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 1ss8 s VAL 213 Cb -0.00 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.68 1ss8 s VAL 213 CO 0.17 0.44 -0.04 -0.70 0.00 0.00 0.00 175.10 174.96 1ss8 s GLU 214 N 0.99 1.24 -0.02 2.72 2.12 -1.26 0.13 118.70 124.62 1ss8 s GLU 214 Ca 0.01 -0.32 0.08 0.00 0.36 0.00 0.00 54.97 55.10 1ss8 s GLU 214 Cb -0.14 -1.71 -0.02 0.00 0.26 0.00 0.00 34.13 32.52 1ss8 s GLU 214 CO 0.01 -0.38 -0.25 -0.51 -0.54 0.00 0.00 175.26 173.59 1ss8 s LEU 215 N 1.74 2.05 -0.17 2.70 1.43 -0.15 -4.96 118.68 121.32 1ss8 s LEU 215 Ca 0.03 -0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 52.62 1ss8 s LEU 215 Cb -0.14 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 1ss8 s LEU 215 CO -0.07 0.31 -0.01 -1.61 0.23 0.00 0.00 176.35 175.20 1ss8 s GLU 216 N -0.62 3.74 -1.58 1.70 2.02 -1.26 -2.01 118.70 120.68 1ss8 s GLU 216 Ca 0.10 -0.48 -0.10 0.00 0.02 0.00 0.00 54.97 54.51 1ss8 s GLU 216 Cb -0.10 -3.02 0.08 0.00 0.10 0.00 0.00 34.13 31.20 1ss8 s GLU 216 CO -0.01 0.21 0.59 0.43 0.02 0.00 0.00 175.26 176.50 1ss8 n SER 217 N 3.66 -1.84 -4.82 -0.19 7.64 -0.51 -4.49 113.62 113.07 1ss8 n SER 217 Ca -0.17 -1.03 -0.33 0.00 1.01 0.00 0.00 58.87 58.36 1ss8 n SER 217 Cb 0.52 -2.81 -0.02 0.00 -1.01 0.00 0.00 64.21 60.90 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 -6.81 3.70 0.43 1.43 0.04 -1.17 -4.58 135.00 128.04 1ss8 s PRO 218 Ca 0.40 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.41 1ss8 s PRO 218 Cb -0.22 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.15 1ss8 s PRO 218 CO 0.92 -0.49 0.88 -0.06 0.04 0.00 0.00 177.00 178.29 1ss8 s PHE 219 N -2.41 3.40 -0.13 0.56 0.08 -0.25 -3.02 117.98 116.21 1ss8 s PHE 219 Ca 0.62 1.37 0.00 0.00 0.12 0.00 0.00 56.93 59.04 1ss8 s PHE 219 Cb -0.13 -2.68 0.02 0.00 -0.57 0.00 0.00 43.02 39.66 1ss8 s PHE 219 CO 0.30 -0.15 -0.11 0.42 -0.10 0.00 0.00 175.22 175.57 1ss8 s ILE 220 N -2.33 1.35 -0.24 0.64 1.01 0.15 -0.88 121.20 120.91 1ss8 s ILE 220 Ca 0.57 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 60.57 1ss8 s ILE 220 Cb -0.10 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1ss8 s ILE 220 CO 0.24 0.42 0.42 -0.22 0.00 0.00 0.00 174.94 175.79 1ss8 s LEU 221 N 1.58 4.09 -0.33 2.97 2.96 0.16 -1.70 118.68 128.41 1ss8 s LEU 221 Ca 0.05 0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 54.30 1ss8 s LEU 221 Cb -0.13 -2.52 0.01 0.00 0.50 0.00 0.00 46.19 44.05 1ss8 s LEU 221 CO -0.10 -0.16 0.16 -0.76 -1.32 0.00 0.00 176.35 174.18 1ss8 s LEU 222 N 1.80 4.30 -0.19 -0.68 1.43 -1.26 -1.16 118.68 122.92 1ss8 s LEU 222 Ca 0.18 -0.71 -0.00 0.00 -1.03 0.00 0.00 54.13 52.57 1ss8 s LEU 222 Cb -0.15 -2.00 0.05 0.00 0.03 0.00 0.00 46.19 44.12 1ss8 s LEU 222 CO 0.09 -0.26 -0.04 0.00 0.23 0.00 0.00 176.35 176.36 1ss8 s ALA 223 N 1.58 1.56 -1.06 4.21 0.00 -0.64 -2.23 121.76 125.18 1ss8 s ALA 223 Ca 0.03 -0.96 -0.19 0.00 0.00 0.00 0.00 51.96 50.84 1ss8 s ALA 223 Cb -0.18 -1.21 0.10 0.00 0.00 0.00 0.00 23.12 21.83 1ss8 s ALA 223 CO 0.06 -0.94 1.38 0.34 0.00 0.00 0.00 175.76 176.60 1ss8 s ASP 224 N 1.59 6.69 0.00 0.00 2.15 -0.90 -2.71 116.67 123.49 1ss8 s ASP 224 Ca -0.01 -2.05 0.00 0.00 0.43 0.00 0.00 52.55 50.92 1ss8 s ASP 224 Cb -0.16 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1ss8 s ASP 224 CO -0.07 -1.18 0.00 2.29 -0.17 0.00 0.00 175.17 176.03 1ss8 n LYS 225 N 7.51 0.00 -2.89 4.34 2.85 -1.26 -4.14 118.16 124.57 1ss8 n LYS 225 Ca 0.33 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 57.18 1ss8 n LYS 225 Cb 0.48 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.82 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 4.54 -0.51 -1.58 1.02 -1.26 -2.34 119.74 117.60 1ss8 s LYS 226 Ca 0.00 1.18 -0.12 0.00 0.02 0.00 0.00 55.97 57.05 1ss8 s LYS 226 Cb 0.00 -3.40 0.13 0.00 -0.52 0.00 0.00 37.83 34.04 1ss8 s LYS 226 CO 0.00 0.16 0.43 0.42 -0.92 0.00 0.00 175.35 175.43 1ss8 s ILE 227 N 0.34 4.66 -0.24 2.17 1.01 -0.16 -4.87 121.20 124.11 1ss8 s ILE 227 Ca 0.43 -1.72 -0.17 0.00 0.00 0.00 0.00 60.65 59.19 1ss8 s ILE 227 Cb -0.21 -4.02 -0.15 0.00 0.01 0.00 0.00 42.46 38.09 1ss8 s ILE 227 CO 0.24 -0.83 -0.10 -1.20 0.00 0.00 0.00 174.94 173.06 1ss8 n SER 228 N 4.99 1.91 -4.84 3.58 7.64 -1.26 -1.66 113.62 123.98 1ss8 n SER 228 Ca -0.09 0.38 -0.35 0.00 1.01 0.00 0.00 58.87 59.82 1ss8 n SER 228 Cb 0.41 -0.89 -0.06 0.00 -1.01 0.00 0.00 64.21 62.66 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 -7.17 6.88 0.18 6.43 0.01 -1.26 -1.37 114.94 118.65 1ss8 s ASN 229 Ca -0.34 1.24 0.23 0.00 -0.71 0.00 0.00 52.86 53.28 1ss8 s ASN 229 Cb 0.11 -2.35 0.09 0.00 0.41 0.00 0.00 41.25 39.50 1ss8 s ASN 229 CO 0.53 -0.01 1.12 -0.29 -1.51 0.00 0.00 177.10 176.94 1ss8 h ILE 230 N 2.50 0.00 -0.76 0.60 2.10 -1.92 -3.36 117.51 116.66 1ss8 h ILE 230 Ca -0.48 -0.86 0.17 0.00 1.08 0.00 0.00 64.86 64.77 1ss8 h ILE 230 Cb 1.19 1.38 -0.11 0.00 -1.09 0.00 0.00 36.82 38.18 1ss8 h ILE 230 CO 0.66 0.00 0.22 0.03 -1.08 0.00 0.00 178.15 177.98 1ss8 h ARG 231 N 0.00 0.30 0.00 2.19 3.08 -2.02 0.62 114.38 118.55 1ss8 h ARG 231 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ss8 h ARG 231 Cb 0.93 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.91 1ss8 h ARG 231 CO 0.00 0.20 -0.07 0.93 -1.07 0.00 0.00 179.97 179.96 1ss8 h GLU 232 N 0.31 0.00 0.02 0.04 5.08 -1.96 -3.25 114.58 114.81 1ss8 h GLU 232 Ca 0.44 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.77 1ss8 h GLU 232 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1ss8 h GLU 232 CO -0.50 0.07 -0.11 0.52 -1.00 0.00 0.00 179.01 177.99 1ss8 h MET 233 N 0.00 0.04 -0.80 2.33 2.86 -1.10 -3.31 114.93 114.95 1ss8 h MET 233 Ca -0.00 -0.07 0.09 0.00 -2.06 0.00 0.00 59.70 57.66 1ss8 h MET 233 Cb 0.38 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 31.96 1ss8 h MET 233 CO 0.01 1.02 -0.41 1.28 1.06 0.00 0.00 176.91 179.87 1ss8 n LEU 234 N -4.55 -0.73 -0.35 1.22 4.77 -1.07 -0.73 117.00 115.57 1ss8 n LEU 234 Ca -0.10 1.42 0.11 0.00 -0.03 0.00 0.00 56.01 57.40 1ss8 n LEU 234 Cb 0.52 -0.24 0.30 0.00 -2.33 0.00 0.00 43.42 41.67 1ss8 n LEU 234 CO 0.36 -1.20 1.22 1.55 -1.33 0.00 0.00 177.39 177.98 1ss8 h PRO 235 N 0.00 0.83 -0.00 3.23 0.13 -1.82 0.89 132.00 135.26 1ss8 h PRO 235 Ca 0.19 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.22 1ss8 h PRO 235 Cb 0.39 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.34 1ss8 h PRO 235 CO -0.77 0.55 -0.20 0.28 -0.23 0.00 0.00 178.00 177.63 1ss8 h VAL 236 N 0.85 1.56 -0.76 1.56 2.07 -1.13 -3.15 116.25 117.25 1ss8 h VAL 236 Ca 0.53 -1.91 0.13 0.00 0.82 0.00 0.00 66.70 66.27 1ss8 h VAL 236 Cb 0.72 2.77 -0.05 0.00 -1.52 0.00 0.00 31.29 33.21 1ss8 h VAL 236 CO -0.31 0.52 0.50 -0.07 0.02 0.00 0.00 177.57 178.23 1ss8 h LEU 237 N -0.55 0.48 -0.04 2.57 3.38 -0.12 -0.56 115.31 120.46 1ss8 h LEU 237 Ca -0.02 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1ss8 h LEU 237 Cb 0.95 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1ss8 h LEU 237 CO 0.04 0.26 -0.14 -0.33 0.09 0.00 0.00 178.44 178.36 1ss8 h GLU 238 N 0.51 0.16 -0.27 1.13 5.08 -1.00 -2.64 114.58 117.55 1ss8 h GLU 238 Ca 0.37 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.68 1ss8 h GLU 238 Cb 0.71 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1ss8 h GLU 238 CO -0.13 0.76 0.20 0.00 -1.00 0.00 0.00 179.01 178.84 1ss8 h ALA 239 N 0.40 2.25 -0.09 3.43 0.00 -1.24 -0.80 119.26 123.20 1ss8 h ALA 239 Ca -0.01 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1ss8 h ALA 239 Cb 0.78 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1ss8 h ALA 239 CO 0.03 -0.32 -0.75 0.28 0.00 0.00 0.00 179.25 178.49 1ss8 h VAL 240 N 0.01 1.31 -0.03 0.00 2.07 -1.19 -3.17 116.25 115.26 1ss8 h VAL 240 Ca 0.13 -2.00 -0.03 0.00 0.82 0.00 0.00 66.70 65.62 1ss8 h VAL 240 Cb 0.51 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.45 1ss8 h VAL 240 CO -0.00 0.62 -0.12 0.00 0.02 0.00 0.00 177.57 178.08 1ss8 h ALA 241 N 0.47 1.74 0.00 1.67 0.00 -0.90 -2.68 119.26 119.57 1ss8 h ALA 241 Ca -0.07 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 1ss8 h ALA 241 Cb 1.39 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1ss8 h ALA 241 CO 0.15 0.20 -0.37 0.87 0.00 0.00 0.00 179.25 180.10 1ss8 h LYS 242 N 0.05 0.00 -0.00 0.00 1.57 -1.16 -2.63 116.57 114.40 1ss8 h LYS 242 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ss8 h LYS 242 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1ss8 h LYS 242 CO 0.02 0.37 -0.40 0.00 -0.57 0.00 0.00 179.45 178.87 1ss8 n ALA 243 N -2.36 3.31 -0.95 3.86 0.00 -1.02 -4.95 120.51 118.39 1ss8 n ALA 243 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1ss8 n ALA 243 Cb 0.46 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 1.48 0.45 3.94 0.00 0.00 -0.99 -5.01 105.19 105.06 1ss8 n GLY 244 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.52 3.50 0.90 1.61 1.02 -1.24 -5.05 119.74 119.96 1ss8 s LYS 245 Ca 0.00 -0.42 -0.14 0.00 0.02 0.00 0.00 55.97 55.43 1ss8 s LYS 245 Cb 0.00 -2.81 0.16 0.00 -0.52 0.00 0.00 37.83 34.66 1ss8 s LYS 245 CO 0.00 0.35 1.26 -1.25 -0.92 0.00 0.00 175.35 174.79 1ss8 s PRO 246 N -3.65 1.07 -0.02 -1.68 0.04 -1.26 -4.65 135.00 124.85 1ss8 s PRO 246 Ca 0.38 -0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.09 1ss8 s PRO 246 Cb -0.10 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1ss8 s PRO 246 CO 0.30 -2.12 0.02 -1.17 0.04 0.00 0.00 177.00 174.07 1ss8 s LEU 247 N -5.75 1.33 -0.20 -3.56 2.96 -0.26 -1.09 118.68 112.10 1ss8 s LEU 247 Ca 0.70 0.02 -0.08 0.00 -0.22 0.00 0.00 54.13 54.55 1ss8 s LEU 247 Cb -0.06 -0.07 -0.04 0.00 0.50 0.00 0.00 46.19 46.52 1ss8 s LEU 247 CO 0.51 -0.09 0.09 -0.22 -1.32 0.00 0.00 176.35 175.32 1ss8 s LEU 248 N 0.78 3.91 -0.26 -0.68 2.96 -0.06 -1.72 118.68 123.61 1ss8 s LEU 248 Ca -0.07 0.09 -0.10 0.00 -0.22 0.00 0.00 54.13 53.84 1ss8 s LEU 248 Cb -0.10 -2.01 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 1ss8 s LEU 248 CO -0.02 0.14 0.15 -0.63 -1.32 0.00 0.00 176.35 174.67 1ss8 s ILE 249 N 0.57 5.08 -0.37 6.68 -1.09 0.81 -0.66 121.20 132.23 1ss8 s ILE 249 Ca 0.05 0.09 -0.02 0.00 -2.23 0.00 0.00 60.65 58.54 1ss8 s ILE 249 Cb -0.12 -3.39 0.09 0.00 -1.58 0.00 0.00 42.46 37.45 1ss8 s ILE 249 CO 0.01 0.30 0.12 -0.63 -1.23 0.00 0.00 174.94 173.51 1ss8 s ILE 250 N 1.49 3.09 0.35 2.92 1.01 -0.31 -0.49 121.20 129.25 1ss8 s ILE 250 Ca 0.07 -1.87 0.04 0.00 0.00 0.00 0.00 60.65 58.89 1ss8 s ILE 250 Cb -0.15 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1ss8 s ILE 250 CO 0.07 -0.49 0.07 0.00 0.00 0.00 0.00 174.94 174.59 1ss8 s ALA 251 N 1.15 2.58 0.22 9.38 0.00 -1.05 -1.62 121.76 132.42 1ss8 s ALA 251 Ca 0.04 -1.80 -0.08 0.00 0.00 0.00 0.00 51.96 50.12 1ss8 s ALA 251 Cb -0.21 0.65 0.33 0.00 0.00 0.00 0.00 23.12 23.89 1ss8 s ALA 251 CO -0.04 -0.30 1.72 1.49 0.00 0.00 0.00 175.76 178.63 1ss8 h GLU 252 N 2.00 0.33 -2.80 0.00 4.81 -1.25 0.33 114.58 118.00 1ss8 h GLU 252 Ca -0.40 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1ss8 h GLU 252 Cb 1.25 -0.07 -0.13 0.00 0.63 0.00 0.00 28.75 30.43 1ss8 h GLU 252 CO 0.67 0.22 0.26 0.34 -0.73 0.00 0.00 179.01 179.77 1ss8 s ASP 253 N -5.33 -0.54 -0.20 1.04 2.15 -1.25 -4.17 116.67 108.37 1ss8 s ASP 253 Ca -0.13 0.05 0.00 0.00 0.43 0.00 0.00 52.55 52.90 1ss8 s ASP 253 Cb 0.18 0.56 0.05 0.00 -0.30 0.00 0.00 42.92 43.41 1ss8 s ASP 253 CO 0.75 -0.88 -0.05 -0.69 -0.17 0.00 0.00 175.17 174.12 1ss8 s VAL 254 N -3.45 1.33 0.25 1.11 1.01 -1.26 -0.99 120.40 118.41 1ss8 s VAL 254 Ca 0.01 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.12 1ss8 s VAL 254 Cb -0.01 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 1ss8 s VAL 254 CO -0.11 0.01 0.18 -1.61 0.00 0.00 0.00 175.10 173.57 1ss8 s GLU 255 N 1.51 2.86 0.00 2.72 2.02 -0.67 -4.69 118.70 122.46 1ss8 s GLU 255 Ca -0.03 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.87 1ss8 s GLU 255 Cb -0.17 -2.52 0.00 0.00 0.10 0.00 0.00 34.13 31.53 1ss8 s GLU 255 CO -0.07 0.39 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1ss8 n GLY 256 N -1.16 0.00 0.00 -1.39 0.00 -1.26 -2.45 105.19 98.93 1ss8 n GLY 256 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.22 1.61 0.00 -1.26 -1.58 120.64 119.63 1ss8 n GLU 257 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 57.16 57.58 1ss8 n GLU 257 Cb 0.00 -1.31 0.52 0.00 0.00 0.00 0.00 31.44 30.65 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 -1.95 1.45 0.53 4.31 0.00 -1.04 -2.42 119.26 120.15 1ss8 h ALA 258 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1ss8 h ALA 258 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ss8 h ALA 258 CO 0.00 0.29 -0.26 1.25 0.00 0.00 0.00 179.25 180.53 1ss8 h LEU 259 N 0.00 -0.61 -1.99 0.00 5.85 -1.53 -1.65 115.31 115.37 1ss8 h LEU 259 Ca -0.00 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1ss8 h LEU 259 Cb 0.45 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1ss8 h LEU 259 CO 0.03 -0.44 0.15 0.00 -0.34 0.00 0.00 178.44 177.84 1ss8 h ALA 260 N -0.25 2.19 -0.03 1.25 0.00 -0.83 -1.34 119.26 120.26 1ss8 h ALA 260 Ca -0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1ss8 h ALA 260 Cb 0.55 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ss8 h ALA 260 CO 0.12 -0.25 -0.04 1.15 0.00 0.00 0.00 179.25 180.23 1ss8 h THR 261 N 0.01 1.42 -0.27 0.00 2.02 -1.28 -2.44 112.91 112.37 1ss8 h THR 261 Ca 0.10 -1.32 0.04 0.00 0.77 0.00 0.00 66.41 66.00 1ss8 h THR 261 Cb 0.39 2.25 -0.03 0.00 -1.74 0.00 0.00 68.15 69.01 1ss8 h THR 261 CO -0.00 0.35 0.05 -0.07 0.37 0.00 0.00 175.52 176.22 1ss8 h LEU 262 N -0.44 0.01 -0.68 2.58 3.38 -0.85 0.13 115.31 119.44 1ss8 h LEU 262 Ca 0.00 0.04 0.15 0.00 0.09 0.00 0.00 57.88 58.16 1ss8 h LEU 262 Cb 0.59 0.06 -0.11 0.00 0.09 0.00 0.00 40.66 41.29 1ss8 h LEU 262 CO 0.01 0.04 0.10 0.58 0.09 0.00 0.00 178.44 179.26 1ss8 h VAL 263 N 0.16 0.51 0.00 1.22 2.07 -1.28 -0.24 116.25 118.69 1ss8 h VAL 263 Ca 0.12 -0.07 -0.13 0.00 0.82 0.00 0.00 66.70 67.45 1ss8 h VAL 263 Cb 0.13 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1ss8 h VAL 263 CO -0.16 0.04 -0.60 0.58 0.02 0.00 0.00 177.57 177.44 1ss8 h VAL 264 N 0.20 1.10 0.00 2.57 2.07 -1.00 -2.91 116.25 118.28 1ss8 h VAL 264 Ca 0.37 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.53 1ss8 h VAL 264 Cb 0.62 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1ss8 h VAL 264 CO -0.52 0.59 -0.60 0.59 0.02 0.00 0.00 177.57 177.66 1ss8 n ASN 265 N -3.35 0.66 0.04 0.57 5.03 0.41 -2.41 115.26 116.20 1ss8 n ASN 265 Ca 0.01 0.08 0.08 0.00 0.87 0.00 0.00 54.58 55.62 1ss8 n ASN 265 Cb 0.73 0.16 -0.09 0.00 -1.02 0.00 0.00 39.78 39.56 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 -2.01 0.53 -0.28 3.41 -2.24 -0.32 -2.37 114.28 111.01 1ss8 n THR 266 Ca 0.04 -0.58 -0.06 0.00 -2.27 0.00 0.00 64.05 61.18 1ss8 n THR 266 Cb 0.42 -0.28 0.06 0.00 -2.10 0.00 0.00 70.33 68.43 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 1.09 -0.01 -0.78 -1.53 -1.38 -2.48 114.93 109.83 1ss8 h MET 267 Ca -0.07 -0.16 0.00 0.00 -3.44 0.00 0.00 59.70 56.04 1ss8 h MET 267 Cb 1.18 -0.20 0.00 0.00 -0.55 0.00 0.00 31.60 32.03 1ss8 h MET 267 CO 0.01 0.85 0.00 0.54 0.14 0.00 0.00 176.91 178.45 1ss8 n ARG 268 N -4.39 1.24 -1.20 0.39 1.74 -1.01 -4.92 116.66 108.51 1ss8 n ARG 268 Ca 0.07 -0.35 -0.07 0.00 -0.77 0.00 0.00 57.85 56.73 1ss8 n ARG 268 Cb 0.13 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.07 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 1.04 0.88 0.12 -0.13 0.00 -0.94 -4.94 105.19 101.22 1ss8 n GLY 269 Ca 0.21 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 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 1.19 -3.17 -0.61 2.04 -1.72 -3.44 117.51 111.80 1ss8 h ILE 270 Ca -0.14 -0.61 -0.16 0.00 1.00 0.00 0.00 64.86 64.94 1ss8 h ILE 270 Cb 0.63 1.21 -0.25 0.00 -0.74 0.00 0.00 36.82 37.68 1ss8 h ILE 270 CO 0.21 0.19 -0.43 -0.69 0.00 0.00 0.00 178.15 177.44 1ss8 s VAL 271 N -5.37 0.01 -0.63 1.67 1.01 -1.02 -5.00 120.40 111.08 1ss8 s VAL 271 Ca -0.14 -0.10 -0.24 0.00 0.00 0.00 0.00 61.98 61.51 1ss8 s VAL 271 Cb 0.07 -0.37 0.05 0.00 0.00 0.00 0.00 36.38 36.13 1ss8 s VAL 271 CO 0.72 -0.05 1.00 -0.54 0.00 0.00 0.00 175.10 176.23 1ss8 s LYS 272 N -0.11 3.21 0.14 2.72 3.01 -1.26 -3.60 119.74 123.85 1ss8 s LYS 272 Ca -0.02 -0.52 0.11 0.00 -1.01 0.00 0.00 55.97 54.53 1ss8 s LYS 272 Cb -0.02 -4.15 -0.04 0.00 -1.01 0.00 0.00 37.83 32.60 1ss8 s LYS 272 CO 0.01 -1.73 -0.26 0.08 0.51 0.00 0.00 175.35 173.95 1ss8 s VAL 273 N 4.27 2.23 0.02 3.17 1.01 -1.26 -1.11 120.40 128.73 1ss8 s VAL 273 Ca 0.27 -1.78 -0.06 0.00 0.00 0.00 0.00 61.98 60.41 1ss8 s VAL 273 Cb -0.14 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 1ss8 s VAL 273 CO 0.15 0.05 0.12 0.00 0.00 0.00 0.00 175.10 175.41 1ss8 s ALA 274 N -1.16 -0.19 -0.00 5.51 0.00 -0.70 -4.87 121.76 120.34 1ss8 s ALA 274 Ca 0.14 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1ss8 s ALA 274 Cb -0.10 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 1ss8 s ALA 274 CO 0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 175.76 175.51 1ss8 s ALA 275 N -2.07 0.33 0.04 0.00 0.00 -1.26 -0.13 121.76 118.67 1ss8 s ALA 275 Ca -0.09 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.71 1ss8 s ALA 275 Cb -0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 1ss8 s ALA 275 CO -0.02 0.08 -0.06 0.14 0.00 0.00 0.00 175.76 175.90 1ss8 s VAL 276 N -0.07 0.43 0.39 0.00 -7.23 0.35 -1.32 120.40 112.94 1ss8 s VAL 276 Ca 0.01 -1.20 -0.27 0.00 -1.81 0.00 0.00 61.98 58.71 1ss8 s VAL 276 Cb -0.02 -0.73 -0.10 0.00 0.56 0.00 0.00 36.38 36.10 1ss8 s VAL 276 CO -0.00 -0.52 1.37 -0.54 -0.31 0.00 0.00 175.10 175.09 1ss8 s LYS 277 N -2.01 4.05 0.66 4.82 1.02 -1.26 -2.53 119.74 124.48 1ss8 s LYS 277 Ca -0.07 2.31 -0.17 0.00 0.02 0.00 0.00 55.97 58.05 1ss8 s LYS 277 Cb -0.07 -2.87 -0.00 0.00 -0.52 0.00 0.00 37.83 34.37 1ss8 s LYS 277 CO -0.01 -0.48 1.26 0.00 -0.92 0.00 0.00 175.35 175.20 1ss8 s ALA 278 N -1.19 2.34 0.45 5.17 0.00 0.12 -4.78 121.76 123.87 1ss8 s ALA 278 Ca 0.55 1.12 -0.20 0.00 0.00 0.00 0.00 51.96 53.42 1ss8 s ALA 278 Cb -0.41 -3.52 -0.10 0.00 0.00 0.00 0.00 23.12 19.08 1ss8 s ALA 278 CO 0.54 -1.60 0.97 -1.25 0.00 0.00 0.00 175.76 174.42 1ss8 s PRO 279 N -3.49 4.10 1.21 0.00 0.04 -1.26 -4.90 135.00 130.71 1ss8 s PRO 279 Ca 0.80 1.16 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1ss8 s PRO 279 Cb -0.35 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.04 1ss8 s PRO 279 CO 0.40 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.70 1ss8 n GLY 280 N -0.63 -1.73 3.18 0.56 0.00 -1.26 -4.33 105.19 100.98 1ss8 n GLY 280 Ca 0.07 -1.28 -0.11 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.19 1.04 0.00 1.61 -0.71 -1.26 -4.75 117.98 113.72 1ss8 s PHE 281 Ca 0.00 -1.28 0.00 0.00 -1.04 0.00 0.00 56.93 54.61 1ss8 s PHE 281 Cb 0.00 -0.55 0.00 0.00 -1.21 0.00 0.00 43.02 41.26 1ss8 s PHE 281 CO 0.00 -0.54 0.00 0.41 -1.34 0.00 0.00 175.22 173.75 1ss8 n GLY 282 N -0.19 3.50 0.06 1.99 0.00 -1.26 -2.78 105.19 106.51 1ss8 n GLY 282 Ca -0.02 0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.00 -0.07 1.61 3.32 -2.00 -3.13 116.42 116.14 1ss8 h ASP 283 Ca 0.00 -0.75 0.02 0.00 0.02 0.00 0.00 57.03 56.32 1ss8 h ASP 283 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ss8 h ASP 283 CO 0.00 0.75 0.49 0.08 -1.72 0.00 0.00 179.24 178.83 1ss8 h ARG 284 N -0.76 0.00 0.03 3.56 0.11 -1.96 -1.97 114.38 113.39 1ss8 h ARG 284 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ss8 h ARG 284 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 1ss8 h ARG 284 CO 0.00 0.00 -0.01 -0.09 0.10 0.00 0.00 179.97 179.97 1ss8 h ARG 285 N 0.00 -0.04 -0.37 0.08 2.43 -1.46 -2.21 114.38 112.81 1ss8 h ARG 285 Ca 0.03 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1ss8 h ARG 285 Cb 1.00 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.52 1ss8 h ARG 285 CO -0.00 0.66 0.11 0.87 -1.51 0.00 0.00 179.97 180.09 1ss8 h LYS 286 N -0.82 0.24 -0.26 0.20 1.57 -1.37 -0.81 116.57 115.32 1ss8 h LYS 286 Ca -0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1ss8 h LYS 286 Cb 0.71 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1ss8 h LYS 286 CO 0.01 0.16 0.12 0.00 -0.57 0.00 0.00 179.45 179.16 1ss8 h ALA 287 N 1.25 0.34 -0.28 3.86 0.00 -1.53 -2.74 119.26 120.16 1ss8 h ALA 287 Ca 0.17 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 287 Cb 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ss8 h ALA 287 CO -0.20 -0.09 -0.06 0.52 0.00 0.00 0.00 179.25 179.42 1ss8 h MET 288 N 0.28 0.45 -0.92 0.00 2.86 -0.88 -1.24 114.93 115.49 1ss8 h MET 288 Ca 0.09 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1ss8 h MET 288 Cb 0.14 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.69 1ss8 h MET 288 CO -0.01 0.53 0.61 -0.07 1.06 0.00 0.00 176.91 179.03 1ss8 h LEU 289 N 0.43 1.05 -0.87 1.22 3.38 -0.91 -0.11 115.31 119.50 1ss8 h LEU 289 Ca 0.09 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1ss8 h LEU 289 Cb 0.38 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1ss8 h LEU 289 CO 0.02 0.75 -0.14 -0.61 0.09 0.00 0.00 178.44 178.55 1ss8 h GLN 290 N 1.23 0.69 0.37 1.13 5.75 -1.06 0.16 115.11 123.38 1ss8 h GLN 290 Ca 0.34 -0.23 -0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1ss8 h GLN 290 Cb -0.12 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.36 1ss8 h GLN 290 CO -0.08 0.80 -0.28 -0.44 -2.65 0.00 0.00 178.83 176.18 1ss8 h ASP 291 N 0.62 -0.72 -0.96 -0.69 3.32 0.06 0.12 116.42 118.17 1ss8 h ASP 291 Ca 0.10 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.29 1ss8 h ASP 291 Cb 0.59 0.23 -0.07 0.00 0.22 0.00 0.00 39.33 40.30 1ss8 h ASP 291 CO 0.04 -0.42 0.61 0.40 -1.72 0.00 0.00 179.24 178.14 1ss8 h ILE 292 N -0.65 1.01 0.03 0.35 2.04 -1.05 -1.41 117.51 117.84 1ss8 h ILE 292 Ca -0.03 -0.36 0.03 0.00 1.00 0.00 0.00 64.86 65.50 1ss8 h ILE 292 Cb 0.56 -0.13 -0.05 0.00 -0.74 0.00 0.00 36.82 36.46 1ss8 h ILE 292 CO 0.00 0.19 -0.34 0.00 0.00 0.00 0.00 178.15 178.00 1ss8 h ALA 293 N 1.47 -0.54 -0.87 1.87 0.00 0.16 -1.05 119.26 120.31 1ss8 h ALA 293 Ca 0.44 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.38 1ss8 h ALA 293 Cb 0.28 0.60 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 1ss8 h ALA 293 CO -0.21 -0.87 0.54 1.15 0.00 0.00 0.00 179.25 179.86 1ss8 h THR 294 N -0.52 1.05 -1.00 0.00 2.02 -0.54 0.23 112.91 114.14 1ss8 h THR 294 Ca 0.05 -0.34 0.02 0.00 0.77 0.00 0.00 66.41 66.91 1ss8 h THR 294 Cb 0.59 -0.03 -0.05 0.00 -1.74 0.00 0.00 68.15 66.92 1ss8 h THR 294 CO -0.26 0.18 0.66 0.25 0.37 0.00 0.00 175.52 176.73 1ss8 h LEU 295 N 0.99 1.13 -2.37 2.58 6.46 -0.67 -3.15 115.31 120.28 1ss8 h LEU 295 Ca 0.38 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.12 1ss8 h LEU 295 Cb 0.17 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 39.83 1ss8 h LEU 295 CO -0.17 0.79 0.00 0.35 -0.62 0.00 0.00 178.44 178.79 1ss8 n THR 296 N -4.41 0.64 -3.40 1.05 -2.24 -0.45 -1.34 114.28 104.12 1ss8 n THR 296 Ca 0.13 -0.82 -0.21 0.00 -2.27 0.00 0.00 64.05 60.88 1ss8 n THR 296 Cb 0.05 0.77 0.07 0.00 -2.10 0.00 0.00 70.33 69.12 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 0.66 -0.34 3.86 3.38 0.00 0.54 -0.18 105.19 113.12 1ss8 n GLY 297 Ca 0.11 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.23 2.22 -0.08 -0.02 0.00 0.28 -4.22 107.32 102.27 1ss8 s GLY 298 Ca 0.49 -1.78 0.02 0.00 0.00 0.00 0.00 44.72 43.44 1ss8 s GLY 298 CO 0.60 -1.80 -0.14 -1.59 0.00 0.00 0.00 173.10 170.17 1ss8 s THR 299 N -2.58 3.03 -0.03 0.90 2.01 0.77 -4.46 115.64 115.28 1ss8 s THR 299 Ca 0.44 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.43 1ss8 s THR 299 Cb -0.02 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 1ss8 s THR 299 CO 0.26 0.56 1.11 -0.69 -0.69 0.00 0.00 174.62 175.17 1ss8 s VAL 300 N -0.26 4.44 -0.75 3.82 1.01 -1.26 -4.55 120.40 122.86 1ss8 s VAL 300 Ca 0.01 1.75 -0.17 0.00 0.00 0.00 0.00 61.98 63.57 1ss8 s VAL 300 Cb -0.13 -4.12 0.15 0.00 0.00 0.00 0.00 36.38 32.27 1ss8 s VAL 300 CO 0.03 0.06 0.83 -0.63 0.00 0.00 0.00 175.10 175.38 1ss8 s ILE 301 N 1.65 5.04 -0.12 2.22 1.01 -0.95 -4.98 121.20 125.07 1ss8 s ILE 301 Ca 0.54 -1.59 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1ss8 s ILE 301 Cb -0.24 -4.55 -0.02 0.00 0.01 0.00 0.00 42.46 37.66 1ss8 s ILE 301 CO 0.24 -1.19 -0.13 -0.94 0.00 0.00 0.00 174.94 172.92 1ss8 s SER 302 N 3.20 4.00 0.00 3.58 1.04 -1.26 -2.12 113.70 122.15 1ss8 s SER 302 Ca 0.19 -0.32 0.20 0.00 0.48 0.00 0.00 55.95 56.50 1ss8 s SER 302 Cb -0.15 -1.53 0.87 0.00 0.10 0.00 0.00 66.02 65.31 1ss8 s SER 302 CO -0.02 0.18 1.66 -0.62 0.98 0.00 0.00 173.24 175.42 1ss8 n GLU 303 N 3.40 0.00 0.22 4.02 1.02 -1.26 -2.50 120.64 125.55 1ss8 n GLU 303 Ca -0.18 0.15 0.07 0.00 -0.02 0.00 0.00 57.16 57.18 1ss8 n GLU 303 Cb 0.53 -1.51 0.51 0.00 -0.02 0.00 0.00 31.44 30.95 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 -0.18 3.49 5.08 -1.90 -1.40 114.58 119.67 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 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1ss8 h GLU 304 CO 0.00 0.25 0.00 -0.89 -1.00 0.00 0.00 179.01 177.37 1ss8 n ILE 305 N -3.83 0.23 -1.30 3.13 5.41 -1.04 -4.96 119.36 117.00 1ss8 n ILE 305 Ca -0.02 -0.37 -0.03 0.00 1.00 0.00 0.00 62.75 63.34 1ss8 n ILE 305 Cb 0.35 0.40 -0.01 0.00 -0.71 0.00 0.00 39.64 39.67 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 1.15 0.52 3.81 7.39 0.00 -0.53 -5.04 105.19 112.48 1ss8 n GLY 306 Ca 0.16 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.66 4.22 0.16 1.61 -1.94 -1.20 -4.99 119.30 114.49 1ss8 s MET 307 Ca 0.00 0.76 0.07 0.00 -1.71 0.00 0.00 55.69 54.81 1ss8 s MET 307 Cb 0.00 -3.17 -0.04 0.00 2.01 0.00 0.00 34.83 33.63 1ss8 s MET 307 CO 0.00 0.59 -0.02 -1.21 -0.01 0.00 0.00 175.02 174.37 1ss8 s GLU 308 N -1.30 2.37 0.55 2.03 2.02 -1.26 -4.13 118.70 118.98 1ss8 s GLU 308 Ca 0.32 -1.07 0.32 0.00 0.02 0.00 0.00 54.97 54.56 1ss8 s GLU 308 Cb -0.19 -2.36 1.54 0.00 0.10 0.00 0.00 34.13 33.22 1ss8 s GLU 308 CO 0.20 0.47 2.07 -0.07 0.02 0.00 0.00 175.26 177.95 1ss8 h LEU 309 N 2.91 0.00 -0.27 1.80 3.38 -1.95 -3.08 115.31 118.10 1ss8 h LEU 309 Ca -0.47 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.33 1ss8 h LEU 309 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1ss8 h LEU 309 CO 0.57 0.08 -0.49 -0.33 0.09 0.00 0.00 178.44 178.36 1ss8 h GLU 310 N 0.00 0.82 -1.77 1.13 3.07 -1.93 -3.20 114.58 112.69 1ss8 h GLU 310 Ca -0.00 -0.51 -0.33 0.00 -0.50 0.00 0.00 59.36 58.02 1ss8 h GLU 310 Cb 0.38 0.06 -0.13 0.00 -0.84 0.00 0.00 28.75 28.22 1ss8 h GLU 310 CO 0.01 1.14 0.27 1.63 -1.40 0.00 0.00 179.01 180.67 1ss8 n LYS 311 N -4.08 1.92 -4.10 2.33 5.02 -1.16 -4.81 118.16 113.28 1ss8 n LYS 311 Ca -0.05 -1.57 -0.29 0.00 -2.02 0.00 0.00 58.31 54.39 1ss8 n LYS 311 Cb 0.60 -1.75 -0.17 0.00 -0.02 0.00 0.00 35.03 33.69 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 -1.28 1.67 0.40 7.82 0.00 -1.21 -4.89 121.76 124.28 1ss8 s ALA 312 Ca 0.40 -0.76 0.06 0.00 0.00 0.00 0.00 51.96 51.66 1ss8 s ALA 312 Cb 0.27 -0.96 0.06 0.00 0.00 0.00 0.00 23.12 22.49 1ss8 s ALA 312 CO -0.07 -0.31 0.48 0.25 0.00 0.00 0.00 175.76 176.11 1ss8 n THR 313 N 4.66 0.00 0.23 0.00 -2.24 -1.26 -4.37 114.28 111.29 1ss8 n THR 313 Ca -0.17 -1.41 0.06 0.00 -2.27 0.00 0.00 64.05 60.27 1ss8 n THR 313 Cb 0.50 -0.51 0.55 0.00 -2.10 0.00 0.00 70.33 68.77 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 0.02 -1.84 3.22 3.38 -1.94 -2.68 115.31 115.47 1ss8 h LEU 314 Ca -0.21 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.81 1ss8 h LEU 314 Cb 0.88 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1ss8 h LEU 314 CO 0.30 0.13 0.22 -0.08 0.09 0.00 0.00 178.44 179.10 1ss8 h GLU 315 N 0.02 0.20 0.00 1.13 4.81 -2.00 -1.70 114.58 117.04 1ss8 h GLU 315 Ca 0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1ss8 h GLU 315 Cb 0.19 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1ss8 h GLU 315 CO 0.01 0.13 -0.15 -0.44 -0.73 0.00 0.00 179.01 177.83 1ss8 h ASP 316 N 0.20 0.00 -3.54 1.04 3.32 -1.84 -3.45 116.42 112.15 1ss8 h ASP 316 Ca 0.14 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.67 1ss8 h ASP 316 Cb 0.30 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1ss8 h ASP 316 CO -0.02 0.15 0.22 -0.76 -1.72 0.00 0.00 179.24 177.11 1ss8 s LEU 317 N -6.45 4.56 0.79 1.55 1.02 -0.64 -0.16 118.68 119.34 1ss8 s LEU 317 Ca 0.03 1.67 -0.12 0.00 0.02 0.00 0.00 54.13 55.73 1ss8 s LEU 317 Cb 0.08 -3.36 0.07 0.00 0.02 0.00 0.00 46.19 43.00 1ss8 s LEU 317 CO 0.63 0.13 1.16 -0.83 0.02 0.00 0.00 176.35 177.46 1ss8 s GLY 318 N -0.81 1.60 0.05 -3.19 0.00 -0.69 -4.51 107.32 99.77 1ss8 s GLY 318 Ca 0.38 -0.62 -0.01 0.00 0.00 0.00 0.00 44.72 44.48 1ss8 s GLY 318 CO 0.27 -0.15 -0.03 1.62 0.00 0.00 0.00 173.10 174.80 1ss8 s GLN 319 N -5.52 0.57 0.05 2.90 0.74 0.75 0.34 119.66 119.49 1ss8 s GLN 319 Ca 0.61 -1.11 -0.21 0.00 0.05 0.00 0.00 55.36 54.70 1ss8 s GLN 319 Cb -0.11 0.15 0.05 0.00 1.10 0.00 0.00 33.01 34.20 1ss8 s GLN 319 CO 0.49 -0.09 0.49 0.00 -0.55 0.00 0.00 175.29 175.63 1ss8 s ALA 320 N -3.41 -1.23 0.31 1.58 0.00 -1.17 -1.58 121.76 116.27 1ss8 s ALA 320 Ca 0.03 0.50 0.19 0.00 0.00 0.00 0.00 51.96 52.68 1ss8 s ALA 320 Cb 0.04 0.38 0.92 0.00 0.00 0.00 0.00 23.12 24.47 1ss8 s ALA 320 CO -0.08 -0.50 1.87 0.87 0.00 0.00 0.00 175.76 177.93 1ss8 h LYS 321 N 2.83 0.00 -1.82 0.00 1.57 -0.87 -3.09 116.57 115.20 1ss8 h LYS 321 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1ss8 h LYS 321 Cb 1.21 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.29 1ss8 h LYS 321 CO 0.42 0.29 0.29 0.50 -0.57 0.00 0.00 179.45 180.38 1ss8 s ARG 322 N -4.00 0.71 0.04 3.15 3.52 -1.03 -1.42 118.95 119.93 1ss8 s ARG 322 Ca -0.02 0.73 0.04 0.00 -0.13 0.00 0.00 55.73 56.35 1ss8 s ARG 322 Cb 0.13 0.35 -0.02 0.00 -1.56 0.00 0.00 34.95 33.84 1ss8 s ARG 322 CO 0.67 -0.11 -0.11 0.14 -0.81 0.00 0.00 175.30 175.08 1ss8 s VAL 323 N 0.09 0.87 -0.08 7.11 -7.23 -0.85 -0.43 120.40 119.87 1ss8 s VAL 323 Ca 0.00 -1.04 -0.01 0.00 -1.81 0.00 0.00 61.98 59.13 1ss8 s VAL 323 Cb -0.04 -0.84 0.03 0.00 0.56 0.00 0.00 36.38 36.08 1ss8 s VAL 323 CO -0.01 -0.17 -0.03 -0.69 -0.31 0.00 0.00 175.10 173.89 1ss8 s VAL 324 N -1.06 0.63 -0.01 1.32 1.01 -0.61 -0.98 120.40 120.70 1ss8 s VAL 324 Ca -0.03 -0.06 0.08 0.00 0.00 0.00 0.00 61.98 61.97 1ss8 s VAL 324 Cb -0.09 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1ss8 s VAL 324 CO 0.01 0.29 -0.25 0.27 0.00 0.00 0.00 175.10 175.42 1ss8 s ILE 325 N 1.71 2.02 0.44 2.22 -0.00 0.12 -1.23 121.20 126.48 1ss8 s ILE 325 Ca 0.02 -1.12 0.06 0.00 -0.00 0.00 0.00 60.65 59.61 1ss8 s ILE 325 Cb -0.13 -1.68 0.06 0.00 -0.00 0.00 0.00 42.46 40.71 1ss8 s ILE 325 CO -0.05 0.54 0.48 0.59 -0.00 0.00 0.00 174.94 176.50 1ss8 n ASN 326 N 2.37 1.99 -0.34 4.36 3.02 0.59 -1.42 115.26 125.83 1ss8 n ASN 326 Ca -0.16 -2.33 0.05 0.00 -0.03 0.00 0.00 54.58 52.11 1ss8 n ASN 326 Cb 0.51 -0.19 0.20 0.00 -0.61 0.00 0.00 39.78 39.70 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 0.94 -0.15 3.52 3.64 -1.94 -2.00 116.57 120.58 1ss8 h LYS 327 Ca -0.24 -0.06 -0.20 0.00 -1.27 0.00 0.00 60.65 58.88 1ss8 h LYS 327 Cb 0.98 -0.21 -0.38 0.00 -0.41 0.00 0.00 32.23 32.21 1ss8 h LYS 327 CO 0.36 0.62 -1.04 -0.40 -2.27 0.00 0.00 179.45 176.72 1ss8 n ASP 328 N -4.64 1.27 -3.75 4.20 5.68 -1.26 -3.83 116.55 114.22 1ss8 n ASP 328 Ca 0.17 -2.10 -0.13 0.00 -0.50 0.00 0.00 54.79 52.23 1ss8 n ASP 328 Cb 0.30 -0.37 -0.10 0.00 -1.14 0.00 0.00 41.12 39.82 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 -1.40 0.02 -0.05 2.12 2.01 -1.20 -3.50 115.64 113.63 1ss8 s THR 329 Ca 0.32 -0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.19 1ss8 s THR 329 Cb 0.37 -0.55 0.02 0.00 0.01 0.00 0.00 72.50 72.34 1ss8 s THR 329 CO -0.12 -0.08 -0.07 -0.89 -0.69 0.00 0.00 174.62 172.77 1ss8 s THR 330 N -0.31 0.71 -0.08 -0.82 2.01 -0.73 -0.30 115.64 116.13 1ss8 s THR 330 Ca -0.04 -0.23 -0.00 0.00 0.31 0.00 0.00 61.69 61.72 1ss8 s THR 330 Cb -0.03 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.80 1ss8 s THR 330 CO 0.02 0.26 -0.05 0.28 -0.69 0.00 0.00 174.62 174.44 1ss8 s THR 331 N 0.79 0.73 -0.26 -0.82 -1.32 -0.36 -1.31 115.64 113.09 1ss8 s THR 331 Ca -0.12 -0.14 -0.10 0.00 -1.21 0.00 0.00 61.69 60.12 1ss8 s THR 331 Cb -0.15 -0.79 -0.04 0.00 -1.51 0.00 0.00 72.50 70.01 1ss8 s THR 331 CO 0.01 0.31 0.15 -0.63 -2.21 0.00 0.00 174.62 172.25 1ss8 s ILE 332 N 1.55 5.00 -0.17 5.08 1.01 -0.17 -1.57 121.20 131.94 1ss8 s ILE 332 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.70 1ss8 s ILE 332 Cb -0.13 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.97 1ss8 s ILE 332 CO -0.05 0.29 -0.11 -0.63 0.00 0.00 0.00 174.94 174.45 1ss8 s ILE 333 N 1.60 3.04 -0.51 2.92 1.01 0.42 -1.52 121.20 128.15 1ss8 s ILE 333 Ca 0.07 -0.63 -0.08 0.00 0.00 0.00 0.00 60.65 60.00 1ss8 s ILE 333 Cb -0.15 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 40.00 1ss8 s ILE 333 CO 0.08 0.49 0.58 -0.67 0.00 0.00 0.00 174.94 175.42 1ss8 n ASP 334 N 4.18 -7.35 -4.75 3.58 -0.08 0.10 -2.22 116.55 110.01 1ss8 n ASP 334 Ca -0.19 0.24 -0.40 0.00 -1.51 0.00 0.00 54.79 52.94 1ss8 n ASP 334 Cb 0.52 -4.96 -0.05 0.00 2.34 0.00 0.00 41.12 38.96 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 -2.66 2.97 0.57 0.27 0.00 -0.94 -1.76 107.32 105.77 1ss8 s GLY 335 Ca 0.13 0.48 0.25 0.00 0.00 0.00 0.00 44.72 45.58 1ss8 s GLY 335 CO 0.69 1.20 2.19 -2.08 0.00 0.00 0.00 173.10 175.10 1ss8 h VAL 336 N 3.72 0.66 -0.79 1.40 2.07 -1.39 -3.45 116.25 118.48 1ss8 h VAL 336 Ca -0.44 0.00 -0.55 0.00 0.82 0.00 0.00 66.70 66.52 1ss8 h VAL 336 Cb 1.21 0.96 0.07 0.00 -1.52 0.00 0.00 31.29 32.01 1ss8 h VAL 336 CO 0.70 0.00 -0.29 0.61 0.02 0.00 0.00 177.57 178.60 1ss8 n GLY 337 N -1.41 -1.07 3.77 2.17 0.00 -0.45 -4.77 105.19 103.42 1ss8 n GLY 337 Ca -0.02 0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.58 4.36 0.35 1.61 2.02 -1.26 -4.89 118.70 120.31 1ss8 s GLU 338 Ca 0.56 1.65 0.05 0.00 0.02 0.00 0.00 54.97 57.24 1ss8 s GLU 338 Cb -0.80 -2.83 0.69 0.00 0.10 0.00 0.00 34.13 31.29 1ss8 s GLU 338 CO 0.44 0.01 1.94 0.93 0.02 0.00 0.00 175.26 178.60 1ss8 h GLU 339 N 3.07 0.79 -0.25 1.61 4.39 -1.96 -0.90 114.58 121.33 1ss8 h GLU 339 Ca -0.48 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.16 1ss8 h GLU 339 Cb 1.21 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.67 1ss8 h GLU 339 CO 0.64 0.53 0.08 0.00 -1.16 0.00 0.00 179.01 179.09 1ss8 h ALA 340 N 1.58 0.33 -0.51 3.43 0.00 -1.99 -0.48 119.26 121.62 1ss8 h ALA 340 Ca 0.34 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1ss8 h ALA 340 Cb 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1ss8 h ALA 340 CO -0.12 -0.03 0.13 0.00 0.00 0.00 0.00 179.25 179.23 1ss8 h ALA 341 N 0.91 0.68 -0.30 0.00 0.00 -1.61 -1.53 119.26 117.40 1ss8 h ALA 341 Ca 0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1ss8 h ALA 341 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ss8 h ALA 341 CO -0.00 0.37 0.07 0.82 0.00 0.00 0.00 179.25 180.51 1ss8 h ILE 342 N 0.71 1.22 -0.92 0.00 2.04 -1.26 -1.89 117.51 117.41 1ss8 h ILE 342 Ca 0.16 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.34 1ss8 h ILE 342 Cb 0.33 1.12 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 1ss8 h ILE 342 CO 0.00 0.24 0.61 1.56 0.00 0.00 0.00 178.15 180.55 1ss8 h GLN 343 N 0.32 1.13 -0.58 2.37 1.08 -0.77 -1.67 115.11 116.99 1ss8 h GLN 343 Ca 0.09 -0.07 -0.09 0.00 -1.45 0.00 0.00 58.65 57.13 1ss8 h GLN 343 Cb 0.29 -0.26 -0.02 0.00 -0.05 0.00 0.00 27.48 27.44 1ss8 h GLN 343 CO 0.00 0.75 -0.00 0.78 -0.95 0.00 0.00 178.83 179.41 1ss8 h GLY 344 N 1.17 1.11 1.70 3.46 0.00 -1.12 -1.07 103.07 108.32 1ss8 h GLY 344 Ca 0.36 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1ss8 h GLY 344 CO -0.11 0.75 -0.17 -0.09 0.00 0.00 0.00 176.54 176.92 1ss8 h ARG 345 N 0.92 0.36 -0.07 4.80 9.65 -1.01 -0.49 114.38 128.54 1ss8 h ARG 345 Ca 0.16 -0.11 -0.04 0.00 -1.10 0.00 0.00 59.98 58.90 1ss8 h ARG 345 Cb 0.55 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1ss8 h ARG 345 CO 0.03 0.53 -0.10 0.28 2.80 0.00 0.00 179.97 183.51 1ss8 h VAL 346 N 0.34 1.40 -0.38 0.20 2.07 -0.80 -1.98 116.25 117.09 1ss8 h VAL 346 Ca 0.06 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.25 1ss8 h VAL 346 Cb 0.50 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 1ss8 h VAL 346 CO 0.03 0.38 0.25 0.00 0.02 0.00 0.00 177.57 178.25 1ss8 h ALA 347 N 0.51 1.78 0.20 1.67 0.00 -1.08 -0.10 119.26 122.25 1ss8 h ALA 347 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 347 Cb 0.66 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ss8 h ALA 347 CO 0.02 0.19 -0.09 0.37 0.00 0.00 0.00 179.25 179.73 1ss8 h GLN 348 N 0.46 -0.26 -0.62 0.00 4.15 -0.83 -2.51 115.11 115.51 1ss8 h GLN 348 Ca 0.14 0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.49 1ss8 h GLN 348 Cb 0.02 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 1ss8 h GLN 348 CO -0.03 -0.10 0.04 0.82 -1.93 0.00 0.00 178.83 177.63 1ss8 h ILE 349 N -0.36 1.26 0.00 2.39 2.04 -0.88 -1.78 117.51 120.19 1ss8 h ILE 349 Ca -0.03 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 64.73 1ss8 h ILE 349 Cb 0.27 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1ss8 h ILE 349 CO 0.04 0.40 0.00 -0.09 0.00 0.00 0.00 178.15 178.51 1ss8 h ARG 350 N 0.97 0.00 0.08 2.37 2.43 -0.93 -0.73 114.38 118.57 1ss8 h ARG 350 Ca 0.18 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.02 1ss8 h ARG 350 Cb 0.51 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 1ss8 h ARG 350 CO 0.02 0.00 -1.82 1.96 -1.51 0.00 0.00 179.97 178.62 1ss8 h GLN 351 N 0.00 0.18 -0.12 0.20 1.08 -0.89 -3.17 115.11 112.39 1ss8 h GLN 351 Ca 0.00 -0.31 -0.06 0.00 -1.45 0.00 0.00 58.65 56.84 1ss8 h GLN 351 Cb 0.05 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 1ss8 h GLN 351 CO 0.00 0.96 -0.19 1.96 -0.95 0.00 0.00 178.83 180.61 1ss8 h GLN 352 N 0.05 0.19 -0.58 1.46 4.20 -0.65 -0.82 115.11 118.96 1ss8 h GLN 352 Ca -0.35 -0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.41 1ss8 h GLN 352 Cb 2.03 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.75 1ss8 h GLN 352 CO 0.10 0.39 0.39 0.82 -0.67 0.00 0.00 178.83 179.86 1ss8 h ILE 353 N 0.18 0.89 0.00 2.54 2.04 -1.27 0.26 117.51 122.15 1ss8 h ILE 353 Ca 0.03 -0.13 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 1ss8 h ILE 353 Cb 0.45 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1ss8 h ILE 353 CO 0.03 0.07 -0.35 -0.33 0.00 0.00 0.00 178.15 177.57 1ss8 h GLU 354 N 0.38 0.00 -0.02 2.37 4.39 -1.12 -3.32 114.58 117.26 1ss8 h GLU 354 Ca 0.27 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.97 1ss8 h GLU 354 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1ss8 h GLU 354 CO -0.07 0.35 0.00 0.39 -1.16 0.00 0.00 179.01 178.52 1ss8 n GLU 355 N -4.04 0.07 -1.65 2.33 1.02 -0.20 -4.99 120.64 113.18 1ss8 n GLU 355 Ca -0.02 -0.86 -0.48 0.00 -0.02 0.00 0.00 57.16 55.77 1ss8 n GLU 355 Cb 0.40 -1.06 -0.05 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 0.11 0.63 -0.73 0.62 0.00 0.75 -4.88 120.51 117.01 1ss8 n ALA 356 Ca 0.02 0.44 0.08 0.00 0.00 0.00 0.00 53.44 53.98 1ss8 n ALA 356 Cb 0.12 -2.30 0.30 0.00 0.00 0.00 0.00 19.45 17.57 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 3.51 2.03 -3.81 0.00 -2.24 -1.26 -4.95 114.28 107.55 1ss8 n THR 357 Ca 0.19 -1.44 -0.12 0.00 -2.27 0.00 0.00 64.05 60.40 1ss8 n THR 357 Cb 0.26 -0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.35 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 -1.26 -0.18 0.17 3.42 0.15 -1.26 -5.05 113.70 109.68 1ss8 s SER 358 Ca 0.44 0.30 -0.25 0.00 0.70 0.00 0.00 55.95 57.15 1ss8 s SER 358 Cb 0.31 0.39 0.05 0.00 -1.71 0.00 0.00 66.02 65.06 1ss8 s SER 358 CO 0.16 -0.14 1.58 0.44 1.20 0.00 0.00 173.24 176.48 1ss8 h ASP 359 N 5.49 -1.36 -0.68 5.45 3.32 -2.00 -2.65 116.42 123.98 1ss8 h ASP 359 Ca -0.26 0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.05 1ss8 h ASP 359 Cb 1.19 0.62 -0.05 0.00 0.22 0.00 0.00 39.33 41.32 1ss8 h ASP 359 CO 0.38 -0.34 0.42 0.22 -1.72 0.00 0.00 179.24 178.20 1ss8 h TYR 360 N -0.24 0.78 -0.93 4.55 3.20 -2.00 -1.65 116.97 120.68 1ss8 h TYR 360 Ca 0.18 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 1ss8 h TYR 360 Cb 0.56 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.54 1ss8 h TYR 360 CO -0.65 0.43 0.57 -0.44 -1.64 0.00 0.00 178.16 176.42 1ss8 h ASP 361 N 0.80 1.11 0.90 -2.11 5.19 -1.93 -2.23 116.42 118.16 1ss8 h ASP 361 Ca 0.28 -0.06 -0.04 0.00 -0.62 0.00 0.00 57.03 56.59 1ss8 h ASP 361 Cb 0.06 -0.28 0.01 0.00 0.18 0.00 0.00 39.33 39.30 1ss8 h ASP 361 CO -0.13 0.85 -0.46 -0.09 -3.12 0.00 0.00 179.24 176.29 1ss8 h ARG 362 N 1.28 -1.20 -0.81 3.56 2.43 -1.01 -2.15 114.38 116.48 1ss8 h ARG 362 Ca 0.33 0.08 0.14 0.00 -0.81 0.00 0.00 59.98 59.72 1ss8 h ARG 362 Cb -0.06 0.27 -0.09 0.00 -0.42 0.00 0.00 29.97 29.67 1ss8 h ARG 362 CO -0.06 -0.80 0.40 0.93 -1.51 0.00 0.00 179.97 178.92 1ss8 h GLU 363 N -1.25 0.57 -0.23 0.20 5.08 -1.21 -0.29 114.58 117.45 1ss8 h GLU 363 Ca -0.12 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 1ss8 h GLU 363 Cb 0.97 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1ss8 h GLU 363 CO 0.18 0.38 -0.14 0.87 -1.00 0.00 0.00 179.01 179.30 1ss8 h LYS 364 N 0.59 0.39 -0.00 2.33 1.79 -1.27 -1.29 116.57 119.11 1ss8 h LYS 364 Ca 0.43 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.79 1ss8 h LYS 364 Cb 0.59 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 1ss8 h LYS 364 CO -0.35 0.53 -0.01 -0.07 -1.08 0.00 0.00 179.45 178.48 1ss8 h LEU 365 N 0.36 0.00 -1.94 2.94 3.38 -0.74 -3.00 115.31 116.31 1ss8 h LEU 365 Ca 0.07 -0.79 0.26 0.00 0.09 0.00 0.00 57.88 57.51 1ss8 h LEU 365 Cb 0.47 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1ss8 h LEU 365 CO 0.03 0.79 0.66 1.56 0.09 0.00 0.00 178.44 181.57 1ss8 h GLN 366 N -0.78 0.05 -0.07 1.13 4.20 -0.85 0.36 115.11 119.14 1ss8 h GLN 366 Ca -0.00 -0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.50 1ss8 h GLN 366 Cb 0.79 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 1ss8 h GLN 366 CO 0.00 0.03 -0.79 0.93 -0.67 0.00 0.00 178.83 178.33 1ss8 h GLU 367 N 0.05 0.47 -0.35 1.46 5.08 -1.27 -2.24 114.58 117.77 1ss8 h GLU 367 Ca 0.45 -0.41 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 1ss8 h GLU 367 Cb 1.71 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 31.06 1ss8 h GLU 367 CO -0.03 1.05 -0.44 0.00 -1.00 0.00 0.00 179.01 178.59 1ss8 h ARG 368 N 0.31 0.91 -0.45 2.33 3.08 -0.84 -2.93 114.38 116.79 1ss8 h ARG 368 Ca -0.05 -0.52 -0.08 0.00 0.07 0.00 0.00 59.98 59.41 1ss8 h ARG 368 Cb 1.39 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.46 1ss8 h ARG 368 CO 0.14 1.16 -0.02 -0.39 -1.07 0.00 0.00 179.97 179.79 1ss8 h VAL 369 N 0.72 1.26 -0.95 2.04 -1.51 -1.24 -2.64 116.25 113.94 1ss8 h VAL 369 Ca 0.04 -1.09 0.11 0.00 -1.23 0.00 0.00 66.70 64.54 1ss8 h VAL 369 Cb 1.04 1.07 -0.08 0.00 -2.13 0.00 0.00 31.29 31.19 1ss8 h VAL 369 CO 0.10 0.37 0.58 0.00 -1.23 0.00 0.00 177.57 177.40 1ss8 h ALA 370 N 0.90 1.41 0.34 5.19 0.00 -1.43 0.34 119.26 126.01 1ss8 h ALA 370 Ca 0.12 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ss8 h ALA 370 Cb 0.53 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ss8 h ALA 370 CO 0.03 0.18 -0.16 0.87 0.00 0.00 0.00 179.25 180.16 1ss8 h LYS 371 N 0.92 -0.44 -0.30 0.00 1.57 -1.38 -2.47 116.57 114.47 1ss8 h LYS 371 Ca 0.47 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 59.26 1ss8 h LYS 371 Cb 0.46 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1ss8 h LYS 371 CO -0.27 -0.14 0.12 1.25 -0.57 0.00 0.00 179.45 179.85 1ss8 h LEU 372 N -0.99 0.41 -0.79 2.94 5.85 -1.10 -2.73 115.31 118.90 1ss8 h LEU 372 Ca -0.05 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1ss8 h LEU 372 Cb 0.50 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1ss8 h LEU 372 CO 0.08 0.46 0.00 0.00 -0.34 0.00 0.00 178.44 178.64 1ss8 n ALA 373 N -2.27 2.55 -0.00 1.25 0.00 0.12 -4.10 120.51 118.06 1ss8 n ALA 373 Ca -0.02 -0.41 0.03 0.00 0.00 0.00 0.00 53.44 53.04 1ss8 n ALA 373 Cb 0.13 -1.16 -0.12 0.00 0.00 0.00 0.00 19.45 18.30 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 1.05 -1.12 7.00 0.00 0.00 -0.93 -5.00 105.19 106.19 1ss8 n GLY 374 Ca 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 1.41 -0.35 2.89 -0.02 0.00 -1.24 -4.89 105.19 103.00 1ss8 n GLY 375 Ca -0.12 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.73 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 0.49 -0.08 1.61 1.01 -0.49 -4.49 120.40 118.45 1ss8 s VAL 376 Ca 0.00 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.60 1ss8 s VAL 376 Cb 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1ss8 s VAL 376 CO 0.00 0.21 0.84 0.00 0.00 0.00 0.00 175.10 176.14 1ss8 s ALA 377 N 0.80 3.35 -0.31 5.51 0.00 -0.34 -1.60 121.76 129.17 1ss8 s ALA 377 Ca -0.10 0.23 -0.08 0.00 0.00 0.00 0.00 51.96 52.01 1ss8 s ALA 377 Cb -0.13 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1ss8 s ALA 377 CO 0.00 -0.34 0.12 0.08 0.00 0.00 0.00 175.76 175.63 1ss8 s VAL 378 N 1.35 4.33 -0.39 0.00 1.01 0.98 -0.93 120.40 126.75 1ss8 s VAL 378 Ca 0.42 -0.55 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 1ss8 s VAL 378 Cb -0.18 -3.23 0.01 0.00 0.00 0.00 0.00 36.38 32.98 1ss8 s VAL 378 CO 0.19 0.06 0.69 -0.63 0.00 0.00 0.00 175.10 175.41 1ss8 s ILE 379 N 1.56 4.81 -0.30 2.22 1.01 -0.11 -2.37 121.20 128.02 1ss8 s ILE 379 Ca 0.04 0.53 -0.12 0.00 0.00 0.00 0.00 60.65 61.10 1ss8 s ILE 379 Cb -0.17 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 1ss8 s ILE 379 CO 0.05 -0.45 0.21 -0.54 0.00 0.00 0.00 174.94 174.20 1ss8 s LYS 380 N 2.89 3.79 -0.20 2.79 -0.14 0.23 -0.86 119.74 128.24 1ss8 s LYS 380 Ca 0.26 -0.43 -0.22 0.00 -1.36 0.00 0.00 55.97 54.22 1ss8 s LYS 380 Cb -0.14 -3.71 -0.02 0.00 -1.68 0.00 0.00 37.83 32.28 1ss8 s LYS 380 CO 0.17 -0.27 0.70 0.08 -0.76 0.00 0.00 175.35 175.26 1ss8 s VAL 381 N 1.75 4.97 0.17 3.17 1.01 -0.97 -0.47 120.40 130.04 1ss8 s VAL 381 Ca 0.07 1.32 0.04 0.00 0.00 0.00 0.00 61.98 63.41 1ss8 s VAL 381 Cb -0.16 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1ss8 s VAL 381 CO 0.11 0.07 0.24 -0.83 0.00 0.00 0.00 175.10 174.68 1ss8 s GLY 382 N 1.22 1.63 0.12 4.51 0.00 -1.22 -1.27 107.32 112.32 1ss8 s GLY 382 Ca 0.31 -1.15 -0.09 0.00 0.00 0.00 0.00 44.72 43.80 1ss8 s GLY 382 CO 0.10 -1.15 0.43 0.00 0.00 0.00 0.00 173.10 172.48 1ss8 n ALA 383 N -0.63 -1.06 0.02 3.20 0.00 -1.01 -4.75 120.51 116.28 1ss8 n ALA 383 Ca -0.08 -0.52 -0.17 0.00 0.00 0.00 0.00 53.44 52.67 1ss8 n ALA 383 Cb 0.55 0.35 -0.14 0.00 0.00 0.00 0.00 19.45 20.20 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 0.45 -2.19 0.00 0.00 -1.86 -3.31 119.26 114.34 1ss8 h ALA 384 Ca -0.14 -1.31 -0.39 0.00 0.00 0.00 0.00 54.91 53.07 1ss8 h ALA 384 Cb 0.56 0.52 -0.14 0.00 0.00 0.00 0.00 17.79 18.72 1ss8 h ALA 384 CO 0.18 1.31 -0.68 0.95 0.00 0.00 0.00 179.25 181.01 1ss8 s THR 385 N -2.59 1.20 0.22 0.00 -4.23 -1.26 -5.03 115.64 103.96 1ss8 s THR 385 Ca -0.14 -2.07 -0.08 0.00 -1.18 0.00 0.00 61.69 58.23 1ss8 s THR 385 Cb 0.07 -2.23 0.17 0.00 1.34 0.00 0.00 72.50 71.84 1ss8 s THR 385 CO 0.81 -0.43 1.80 -0.08 -0.54 0.00 0.00 174.62 176.18 1ss8 h GLU 386 N 2.52 0.66 -0.78 3.99 4.81 -1.99 -1.74 114.58 122.05 1ss8 h GLU 386 Ca -0.38 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1ss8 h GLU 386 Cb 1.22 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 1ss8 h GLU 386 CO 0.65 0.44 0.47 0.28 -0.73 0.00 0.00 179.01 180.12 1ss8 h VAL 387 N 0.68 1.22 -0.22 0.32 2.07 -2.00 -0.77 116.25 117.55 1ss8 h VAL 387 Ca 0.33 -0.48 -0.18 0.00 0.82 0.00 0.00 66.70 67.20 1ss8 h VAL 387 Cb 0.27 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1ss8 h VAL 387 CO -0.22 0.23 -0.57 -0.33 0.02 0.00 0.00 177.57 176.70 1ss8 h GLU 388 N 1.06 0.70 0.04 1.57 5.08 -1.88 -2.68 114.58 118.47 1ss8 h GLU 388 Ca 0.28 -0.45 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1ss8 h GLU 388 Cb -0.04 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1ss8 h GLU 388 CO -0.05 1.07 -0.11 1.98 -1.00 0.00 0.00 179.01 180.90 1ss8 h MET 389 N 0.53 -0.20 -0.39 2.33 4.05 -0.89 -1.95 114.93 118.42 1ss8 h MET 389 Ca 0.01 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 1ss8 h MET 389 Cb 1.15 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.97 1ss8 h MET 389 CO 0.12 -0.13 0.12 0.87 0.23 0.00 0.00 176.91 178.11 1ss8 h LYS 390 N -0.20 0.56 -0.20 0.39 1.79 -1.09 -0.38 116.57 117.44 1ss8 h LYS 390 Ca 0.03 -0.09 -0.18 0.00 -2.18 0.00 0.00 60.65 58.23 1ss8 h LYS 390 Cb 0.23 -0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 30.78 1ss8 h LYS 390 CO -0.08 0.50 -0.62 0.93 -1.08 0.00 0.00 179.45 179.11 1ss8 h GLU 391 N 0.56 0.68 -0.24 3.15 5.08 -1.35 -2.77 114.58 119.69 1ss8 h GLU 391 Ca 0.13 -0.47 -0.16 0.00 -1.00 0.00 0.00 59.36 57.86 1ss8 h GLU 391 Cb 0.18 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1ss8 h GLU 391 CO -0.01 1.09 -0.51 -0.22 -1.00 0.00 0.00 179.01 178.36 1ss8 h LYS 392 N 0.50 0.67 -0.31 2.33 3.64 -0.90 -1.18 116.57 121.32 1ss8 h LYS 392 Ca -0.01 -0.40 0.06 0.00 -1.27 0.00 0.00 60.65 59.03 1ss8 h LYS 392 Cb 1.20 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 33.01 1ss8 h LYS 392 CO 0.12 1.02 -0.02 -0.22 -2.27 0.00 0.00 179.45 178.09 1ss8 h LYS 393 N 0.53 0.07 -0.82 1.90 3.64 -1.08 0.37 116.57 121.18 1ss8 h LYS 393 Ca 0.02 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1ss8 h LYS 393 Cb 1.07 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 1ss8 h LYS 393 CO 0.10 0.05 0.50 0.00 -2.27 0.00 0.00 179.45 177.83 1ss8 h ALA 394 N 1.28 1.05 -0.15 5.00 0.00 -1.22 0.21 119.26 125.42 1ss8 h ALA 394 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ss8 h ALA 394 Cb 0.21 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ss8 h ALA 394 CO -0.27 0.51 0.06 0.00 0.00 0.00 0.00 179.25 179.55 1ss8 h ARG 395 N 1.13 0.23 -0.64 0.00 3.08 -0.58 0.03 114.38 117.64 1ss8 h ARG 395 Ca 0.29 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.34 1ss8 h ARG 395 Cb -0.05 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 1ss8 h ARG 395 CO -0.06 0.32 0.38 0.28 -1.07 0.00 0.00 179.97 179.83 1ss8 h VAL 396 N 0.09 1.06 -0.40 2.04 2.07 0.12 0.08 116.25 121.31 1ss8 h VAL 396 Ca 0.05 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1ss8 h VAL 396 Cb 0.17 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1ss8 h VAL 396 CO -0.00 0.14 0.24 -0.33 0.02 0.00 0.00 177.57 177.64 1ss8 h GLU 397 N 0.75 0.48 0.22 1.57 5.08 -0.10 0.31 114.58 122.90 1ss8 h GLU 397 Ca 0.26 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1ss8 h GLU 397 Cb 0.05 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1ss8 h GLU 397 CO -0.12 0.32 -0.11 -0.44 -1.00 0.00 0.00 179.01 177.66 1ss8 h ASP 398 N 0.50 -0.25 -0.79 1.42 3.32 -0.64 -2.69 116.42 117.28 1ss8 h ASP 398 Ca 0.16 -0.05 0.13 0.00 0.02 0.00 0.00 57.03 57.29 1ss8 h ASP 398 Cb -0.01 0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 1ss8 h ASP 398 CO -0.06 -0.12 0.52 0.00 -1.72 0.00 0.00 179.24 177.87 1ss8 h ALA 399 N 0.39 1.95 -0.32 3.45 0.00 -0.82 -1.57 119.26 122.35 1ss8 h ALA 399 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1ss8 h ALA 399 Cb 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ss8 h ALA 399 CO 0.05 -0.16 -0.15 1.25 0.00 0.00 0.00 179.25 180.24 1ss8 h LEU 400 N 0.56 0.68 -0.46 0.00 5.85 -0.63 -0.21 115.31 121.11 1ss8 h LEU 400 Ca 0.39 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 1ss8 h LEU 400 Cb 0.71 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1ss8 h LEU 400 CO -0.15 0.94 0.13 0.45 -0.34 0.00 0.00 178.44 179.48 1ss8 h HIS 401 N 0.43 0.74 -0.71 1.25 3.86 -1.09 -0.71 115.15 118.92 1ss8 h HIS 401 Ca 0.07 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1ss8 h HIS 401 Cb 0.68 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.90 1ss8 h HIS 401 CO 0.06 0.67 0.32 0.00 0.86 0.00 0.00 177.93 179.84 1ss8 h ALA 402 N 0.99 0.91 -0.05 2.45 0.00 -1.23 -1.55 119.26 120.78 1ss8 h ALA 402 Ca 0.15 -0.16 -0.20 0.00 0.00 0.00 0.00 54.91 54.70 1ss8 h ALA 402 Cb 0.28 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ss8 h ALA 402 CO -0.00 0.49 -0.80 1.15 0.00 0.00 0.00 179.25 180.09 1ss8 h THR 403 N 0.99 1.39 0.04 0.00 2.02 -0.71 0.51 112.91 117.16 1ss8 h THR 403 Ca 0.24 -2.26 0.02 0.00 0.77 0.00 0.00 66.41 65.18 1ss8 h THR 403 Cb 0.15 2.22 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 1ss8 h THR 403 CO -0.03 0.68 -0.15 -0.09 0.37 0.00 0.00 175.52 176.30 1ss8 h ARG 404 N 0.25 -0.26 -0.86 6.66 1.12 -1.04 -0.59 114.38 119.66 1ss8 h ARG 404 Ca -0.04 0.02 0.06 0.00 -1.11 0.00 0.00 59.98 58.90 1ss8 h ARG 404 Cb 1.39 0.06 -0.06 0.00 -0.01 0.00 0.00 29.97 31.35 1ss8 h ARG 404 CO 0.14 -0.17 0.53 0.00 -3.11 0.00 0.00 179.97 177.36 1ss8 h ALA 405 N 0.64 1.17 -0.11 2.80 0.00 -1.00 -2.13 119.26 120.63 1ss8 h ALA 405 Ca 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1ss8 h ALA 405 Cb 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ss8 h ALA 405 CO -0.12 0.30 -0.31 0.00 0.00 0.00 0.00 179.25 179.12 1ss8 h ALA 406 N 1.39 1.28 0.00 0.00 0.00 -0.37 -2.61 119.26 118.96 1ss8 h ALA 406 Ca 0.37 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 406 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ss8 h ALA 406 CO -0.16 0.49 -0.33 -0.39 0.00 0.00 0.00 179.25 178.86 1ss8 h VAL 407 N 0.18 0.65 -0.16 0.00 -1.51 -0.46 -0.97 116.25 113.98 1ss8 h VAL 407 Ca 0.03 -1.62 -0.08 0.00 -1.23 0.00 0.00 66.70 63.79 1ss8 h VAL 407 Cb 0.64 2.09 -0.00 0.00 -2.13 0.00 0.00 31.29 31.89 1ss8 h VAL 407 CO 0.05 0.33 -0.23 -0.33 -1.23 0.00 0.00 177.57 176.15 1ss8 h GLU 408 N 0.00 0.44 0.00 5.19 5.08 -1.10 -3.40 114.58 120.79 1ss8 h GLU 408 Ca -0.00 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1ss8 h GLU 408 Cb 1.07 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1ss8 h GLU 408 CO 0.04 0.84 0.00 0.39 -1.00 0.00 0.00 179.01 179.29 1ss8 n GLU 409 N -4.45 0.00 0.00 2.33 1.02 -1.17 -5.09 120.64 113.28 1ss8 n GLU 409 Ca -0.06 -0.37 0.00 0.00 -0.02 0.00 0.00 57.16 56.71 1ss8 n GLU 409 Cb 0.43 -0.50 0.00 0.00 -0.02 0.00 0.00 31.44 31.35 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 -1.27 2.95 0.62 0.00 -0.37 -4.43 105.19 102.69 1ss8 n GLY 410 Ca 0.00 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.57 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 0.17 0.13 1.61 0.11 -0.72 -0.45 120.40 121.24 1ss8 s VAL 411 Ca 0.00 -0.57 -0.04 0.00 -2.93 0.00 0.00 61.98 58.43 1ss8 s VAL 411 Cb 0.00 -0.24 -0.03 0.00 -1.53 0.00 0.00 36.38 34.58 1ss8 s VAL 411 CO 0.00 -0.26 0.13 0.68 -3.33 0.00 0.00 175.10 172.32 1ss8 s VAL 412 N -0.85 0.10 0.14 2.04 -7.23 0.11 -1.41 120.40 113.31 1ss8 s VAL 412 Ca -0.08 -1.67 -0.34 0.00 -1.81 0.00 0.00 61.98 58.07 1ss8 s VAL 412 Cb -0.06 -1.87 -0.15 0.00 0.56 0.00 0.00 36.38 34.86 1ss8 s VAL 412 CO -0.00 -0.48 1.47 0.00 -0.31 0.00 0.00 175.10 175.78 1ss8 n ALA 413 N -0.11 0.54 -1.06 1.32 0.00 -1.26 -1.06 120.51 118.87 1ss8 n ALA 413 Ca -0.08 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1ss8 n ALA 413 Cb 0.63 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.83 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 2.98 -0.82 2.50 0.00 0.00 0.27 -2.33 105.19 107.79 1ss8 n GLY 414 Ca 0.17 -1.67 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 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 1.91 -0.02 0.00 -1.26 -0.39 105.19 109.93 1ss8 n GLY 415 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.88 1.49 0.15 -0.02 0.00 -1.26 -4.43 105.19 100.24 1ss8 n GLY 416 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.71 1.61 2.07 -0.89 -2.98 116.25 116.69 1ss8 h VAL 417 Ca 0.00 -1.32 0.14 0.00 0.82 0.00 0.00 66.70 66.34 1ss8 h VAL 417 Cb 0.00 1.82 -0.10 0.00 -1.52 0.00 0.00 31.29 31.50 1ss8 h VAL 417 CO 0.00 0.39 0.22 0.00 0.02 0.00 0.00 177.57 178.21 1ss8 h ALA 418 N 0.63 0.95 0.16 1.67 0.00 -1.65 0.54 119.26 121.56 1ss8 h ALA 418 Ca 0.03 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 418 Cb 0.70 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1ss8 h ALA 418 CO 0.04 -0.27 -0.08 -0.07 0.00 0.00 0.00 179.25 178.87 1ss8 h LEU 419 N 0.35 -0.18 -1.83 0.00 3.38 -1.84 -0.32 115.31 114.87 1ss8 h LEU 419 Ca 0.39 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.30 1ss8 h LEU 419 Cb 0.62 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1ss8 h LEU 419 CO -0.44 -0.09 -0.14 -0.29 0.09 0.00 0.00 178.44 177.58 1ss8 h ILE 420 N -0.25 0.62 0.06 1.22 2.10 -1.32 -2.16 117.51 117.77 1ss8 h ILE 420 Ca -0.02 -0.59 -0.00 0.00 1.08 0.00 0.00 64.86 65.32 1ss8 h ILE 420 Cb 0.20 1.38 0.00 0.00 -1.09 0.00 0.00 36.82 37.31 1ss8 h ILE 420 CO 0.04 0.13 -0.03 -0.09 -1.08 0.00 0.00 178.15 177.12 1ss8 h ARG 421 N 0.00 -0.07 -0.31 2.19 9.65 0.11 -1.74 114.38 124.21 1ss8 h ARG 421 Ca -0.00 0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1ss8 h ARG 421 Cb 0.37 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.95 1ss8 h ARG 421 CO 0.02 0.41 0.07 -0.39 2.80 0.00 0.00 179.97 182.88 1ss8 h VAL 422 N -0.60 1.15 -0.34 0.20 -1.51 -0.99 -2.74 116.25 111.42 1ss8 h VAL 422 Ca -0.01 -0.55 -0.03 0.00 -1.23 0.00 0.00 66.70 64.89 1ss8 h VAL 422 Cb 0.52 0.85 -0.01 0.00 -2.13 0.00 0.00 31.29 30.51 1ss8 h VAL 422 CO 0.01 0.19 0.09 0.00 -1.23 0.00 0.00 177.57 176.64 1ss8 h ALA 423 N 1.63 0.45 0.00 5.19 0.00 -1.34 -2.36 119.26 122.83 1ss8 h ALA 423 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ss8 h ALA 423 Cb 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ss8 h ALA 423 CO -0.00 0.10 0.00 0.66 0.00 0.00 0.00 179.25 180.01 1ss8 h SER 424 N 0.39 0.00 0.57 0.00 4.64 -1.02 -1.00 113.55 117.13 1ss8 h SER 424 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1ss8 h SER 424 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1ss8 h SER 424 CO -0.00 0.00 -0.13 0.29 -0.87 0.00 0.00 176.83 176.12 1ss8 n LYS 425 N -2.50 0.37 -0.48 4.77 5.02 -0.89 -4.22 118.16 120.24 1ss8 n LYS 425 Ca -0.01 -0.11 0.08 0.00 -2.02 0.00 0.00 58.31 56.26 1ss8 n LYS 425 Cb 0.10 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 33.89 1ss8 n LYS 425 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ss8 n LEU 426 N -1.22 4.02 0.14 -0.35 4.77 -0.38 -4.67 117.00 119.31 1ss8 n LEU 426 Ca 0.11 -2.93 0.07 0.00 -0.03 0.00 0.00 56.01 53.23 1ss8 n LEU 426 Cb 0.30 -0.54 0.55 0.00 -2.33 0.00 0.00 43.42 41.40 1ss8 n LEU 426 CO 0.26 0.68 1.11 0.00 -1.33 0.00 0.00 177.39 178.11 1ss8 h ALA 427 N 2.08 1.89 -0.22 -1.18 0.00 -1.73 0.67 119.26 120.76 1ss8 h ALA 427 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ss8 h ALA 427 Cb 1.45 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1ss8 h ALA 427 CO 0.23 0.10 0.00 -0.25 0.00 0.00 0.00 179.25 179.33 1ss8 n ASP 428 N -4.51 1.27 -4.73 0.00 8.00 -1.26 -4.95 116.55 110.36 1ss8 n ASP 428 Ca 0.00 -1.92 -0.41 0.00 0.71 0.00 0.00 54.79 53.16 1ss8 n ASP 428 Cb 0.09 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 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 -1.12 4.41 0.30 0.64 2.96 0.22 -5.03 118.68 121.07 1ss8 s LEU 429 Ca 0.19 2.29 0.03 0.00 -0.22 0.00 0.00 54.13 56.41 1ss8 s LEU 429 Cb 0.10 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.13 1ss8 s LEU 429 CO 0.14 -0.49 0.09 -0.13 -1.32 0.00 0.00 176.35 174.63 1ss8 s ARG 430 N 0.20 1.56 0.00 1.98 1.81 -1.26 -4.96 118.95 118.28 1ss8 s ARG 430 Ca 0.57 -1.87 0.00 0.00 -1.72 0.00 0.00 55.73 52.71 1ss8 s ARG 430 Cb -0.34 -0.54 0.00 0.00 -0.45 0.00 0.00 34.95 33.61 1ss8 s ARG 430 CO 0.35 -0.27 0.00 0.41 -0.68 0.00 0.00 175.30 175.11 1ss8 n GLY 431 N -0.60 4.88 0.24 -3.53 0.00 -1.26 -5.02 105.19 99.89 1ss8 n GLY 431 Ca -0.01 -1.94 0.10 0.00 0.00 0.00 0.00 46.02 44.17 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 -3.47 115.11 115.45 1ss8 h GLN 432 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1ss8 h GLN 432 Cb 0.00 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.79 1ss8 h GLN 432 CO 0.00 0.20 0.21 0.27 -0.67 0.00 0.00 178.83 178.84 1ss8 n ASN 433 N -3.55 -1.67 -0.07 1.46 0.23 -1.26 -5.05 115.26 105.34 1ss8 n ASN 433 Ca -0.01 -2.15 -0.07 0.00 -0.53 0.00 0.00 54.58 51.82 1ss8 n ASN 433 Cb 0.35 2.78 0.10 0.00 -2.08 0.00 0.00 39.78 40.92 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 0.74 -0.56 -3.83 4.57 -1.99 -1.51 114.58 111.99 1ss8 h GLU 434 Ca -0.24 -0.30 -0.08 0.00 -1.18 0.00 0.00 59.36 57.55 1ss8 h GLU 434 Cb 0.90 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.44 1ss8 h GLU 434 CO 0.31 0.91 0.01 -0.44 -1.18 0.00 0.00 179.01 178.62 1ss8 h ASP 435 N 0.64 0.93 -0.06 1.04 3.32 -1.96 -1.20 116.42 119.13 1ss8 h ASP 435 Ca 0.09 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 56.80 1ss8 h ASP 435 Cb 0.75 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1ss8 h ASP 435 CO 0.06 0.98 -0.23 1.56 -1.72 0.00 0.00 179.24 179.89 1ss8 h GLN 436 N 0.89 0.47 -0.39 3.56 4.20 -1.56 -1.89 115.11 120.39 1ss8 h GLN 436 Ca 0.17 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1ss8 h GLN 436 Cb 0.50 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1ss8 h GLN 436 CO 0.02 0.67 -0.04 -0.91 -0.67 0.00 0.00 178.83 177.91 1ss8 h ASN 437 N 0.42 0.61 0.51 1.46 -0.26 -0.28 -1.24 115.58 116.79 1ss8 h ASN 437 Ca 0.07 -0.14 -0.12 0.00 -0.56 0.00 0.00 56.30 55.55 1ss8 h ASN 437 Cb 0.63 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.71 1ss8 h ASN 437 CO 0.05 0.70 -0.54 -0.37 -1.06 0.00 0.00 177.43 176.21 1ss8 h VAL 438 N 0.60 1.38 -0.07 2.81 -1.51 -0.47 -1.38 116.25 117.61 1ss8 h VAL 438 Ca 0.12 -1.85 0.04 0.00 -1.23 0.00 0.00 66.70 63.78 1ss8 h VAL 438 Cb 0.43 1.98 -0.05 0.00 -2.13 0.00 0.00 31.29 31.53 1ss8 h VAL 438 CO 0.02 0.53 -0.23 1.23 -1.23 0.00 0.00 177.57 177.89 1ss8 h GLY 439 N 1.58 -0.27 0.02 5.19 0.00 -0.87 0.33 103.07 109.05 1ss8 h GLY 439 Ca -0.00 0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.63 1ss8 h GLY 439 CO 0.07 -0.19 -0.46 -2.22 0.00 0.00 0.00 176.54 173.73 1ss8 h ILE 440 N -0.32 0.09 -0.44 2.60 2.04 -0.75 -1.12 117.51 119.61 1ss8 h ILE 440 Ca 0.08 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 1ss8 h ILE 440 Cb 0.44 0.09 -0.06 0.00 -0.74 0.00 0.00 36.82 36.54 1ss8 h ILE 440 CO -0.25 0.00 0.08 0.11 0.00 0.00 0.00 178.15 178.08 1ss8 h LYS 441 N -0.57 0.20 -0.45 2.37 1.79 -0.80 -1.01 116.57 118.10 1ss8 h LYS 441 Ca 0.05 -0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.58 1ss8 h LYS 441 Cb 0.67 -0.04 -0.10 0.00 -1.58 0.00 0.00 32.23 31.18 1ss8 h LYS 441 CO -0.37 0.13 -0.40 0.28 -1.08 0.00 0.00 179.45 178.00 1ss8 h VAL 442 N 0.20 0.13 -0.69 0.50 2.07 -0.02 -0.98 116.25 117.46 1ss8 h VAL 442 Ca 0.22 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.78 1ss8 h VAL 442 Cb 0.28 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 1ss8 h VAL 442 CO -0.30 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.70 1ss8 h ALA 443 N 0.56 0.91 -0.49 1.67 0.00 -0.22 -0.72 119.26 120.97 1ss8 h ALA 443 Ca 0.16 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 443 Cb 0.57 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ss8 h ALA 443 CO -0.60 0.13 0.20 -0.07 0.00 0.00 0.00 179.25 178.91 1ss8 h LEU 444 N 0.77 0.63 0.02 0.00 3.38 -0.74 -1.20 115.31 118.17 1ss8 h LEU 444 Ca 0.29 -0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.96 1ss8 h LEU 444 Cb 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1ss8 h LEU 444 CO -0.15 0.57 -1.15 -0.09 0.09 0.00 0.00 178.44 177.72 1ss8 h ARG 445 N 0.69 0.04 -0.20 1.13 2.43 -0.73 -3.10 114.38 114.64 1ss8 h ARG 445 Ca 0.17 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 1ss8 h ARG 445 Cb 0.14 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1ss8 h ARG 445 CO -0.02 0.96 -0.38 0.00 -1.51 0.00 0.00 179.97 179.02 1ss8 h ALA 446 N 0.93 0.99 0.00 2.80 0.00 -0.37 -2.06 119.26 121.55 1ss8 h ALA 446 Ca -0.07 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ss8 h ALA 446 Cb 1.84 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1ss8 h ALA 446 CO 0.13 0.61 0.09 -1.33 0.00 0.00 0.00 179.25 178.75 1ss8 n MET 447 N -4.04 0.13 0.18 0.00 2.81 -0.53 -1.28 117.12 114.38 1ss8 n MET 447 Ca -0.01 0.62 0.12 0.00 -1.81 0.00 0.00 57.70 56.62 1ss8 n MET 447 Cb 0.48 -2.01 0.16 0.00 -0.71 0.00 0.00 33.22 31.14 1ss8 n MET 447 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1ss8 h GLU 448 N 0.00 0.00 -0.47 0.03 5.08 -1.51 -3.32 114.58 114.39 1ss8 h GLU 448 Ca 0.00 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1ss8 h GLU 448 Cb 0.17 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.34 1ss8 h GLU 448 CO 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 179.01 177.99 1ss8 h ALA 449 N 2.08 0.42 0.22 3.43 0.00 -1.32 -0.09 119.26 124.00 1ss8 h ALA 449 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 449 Cb 0.96 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1ss8 h ALA 449 CO 0.00 -0.40 -0.25 -1.35 0.00 0.00 0.00 179.25 177.25 1ss8 h PRO 450 N 0.09 -0.50 -0.63 0.00 0.11 -1.80 0.19 132.00 129.47 1ss8 h PRO 450 Ca 0.23 0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.41 1ss8 h PRO 450 Cb 0.35 0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.53 1ss8 h PRO 450 CO -0.41 -0.33 0.37 1.25 -0.21 0.00 0.00 178.00 178.67 1ss8 h LEU 451 N -0.51 0.60 -1.01 2.35 5.85 -1.70 -0.32 115.31 120.56 1ss8 h LEU 451 Ca 0.00 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1ss8 h LEU 451 Cb 0.49 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 1ss8 h LEU 451 CO -0.08 0.41 0.66 0.03 -0.34 0.00 0.00 178.44 179.12 1ss8 h ARG 452 N 0.73 1.21 -0.34 1.25 3.08 -0.46 -0.66 114.38 119.20 1ss8 h ARG 452 Ca 0.26 -0.07 -0.15 0.00 0.07 0.00 0.00 59.98 60.09 1ss8 h ARG 452 Cb 0.06 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1ss8 h ARG 452 CO -0.12 0.80 -0.38 0.37 -1.07 0.00 0.00 179.97 179.57 1ss8 h GLN 453 N 1.25 0.80 -0.43 0.04 5.75 0.17 -0.99 115.11 121.70 1ss8 h GLN 453 Ca 0.41 -0.41 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1ss8 h GLN 453 Cb 0.04 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 1ss8 h GLN 453 CO -0.14 1.04 0.24 0.82 -2.65 0.00 0.00 178.83 178.14 1ss8 h ILE 454 N 0.66 1.16 0.00 2.39 2.04 0.21 -0.72 117.51 123.24 1ss8 h ILE 454 Ca 0.06 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.45 1ss8 h ILE 454 Cb 0.94 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1ss8 h ILE 454 CO 0.09 0.16 -0.31 0.58 0.00 0.00 0.00 178.15 178.67 1ss8 h VAL 455 N 0.56 0.91 -0.20 1.67 2.07 -1.07 -2.37 116.25 117.82 1ss8 h VAL 455 Ca 0.15 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 1ss8 h VAL 455 Cb 0.05 1.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1ss8 h VAL 455 CO -0.02 0.31 -0.15 0.25 0.02 0.00 0.00 177.57 177.97 1ss8 h LEU 456 N 0.00 0.48 -2.20 2.57 5.85 0.23 -2.17 115.31 120.07 1ss8 h LEU 456 Ca -0.00 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 1ss8 h LEU 456 Cb 0.69 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1ss8 h LEU 456 CO 0.04 0.82 -0.05 0.78 -0.34 0.00 0.00 178.44 179.69 1ss8 h ASN 457 N 0.14 0.00 0.69 1.25 2.35 -0.94 0.26 115.58 119.33 1ss8 h ASN 457 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1ss8 h ASN 457 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1ss8 h ASN 457 CO 0.04 0.05 0.00 0.00 -1.65 0.00 0.00 177.43 175.87 1ss8 n GLY 459 N 0.71 0.50 4.03 0.00 0.00 0.90 -5.05 105.19 106.28 1ss8 n GLY 459 Ca 0.06 -0.72 -0.20 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.59 2.32 -0.54 1.61 0.41 -0.85 -5.05 118.70 115.01 1ss8 s GLU 460 Ca 0.00 -1.64 -0.22 0.00 -0.41 0.00 0.00 54.97 52.71 1ss8 s GLU 460 Cb 0.00 -2.65 0.05 0.00 -1.78 0.00 0.00 34.13 29.76 1ss8 s GLU 460 CO 0.00 -0.84 0.80 -1.21 -0.49 0.00 0.00 175.26 173.51 1ss8 s GLU 461 N -4.66 3.20 0.33 1.61 2.02 -1.26 -4.47 118.70 115.48 1ss8 s GLU 461 Ca 0.61 -0.64 0.04 0.00 0.02 0.00 0.00 54.97 55.00 1ss8 s GLU 461 Cb -0.06 -4.10 0.65 0.00 0.10 0.00 0.00 34.13 30.73 1ss8 s GLU 461 CO 0.39 -1.41 1.91 -1.00 0.02 0.00 0.00 175.26 175.17 1ss8 h PRO 462 N 9.19 0.85 0.00 0.39 0.13 -1.85 -1.97 132.00 138.74 1ss8 h PRO 462 Ca -0.27 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1ss8 h PRO 462 Cb 1.08 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 32.02 1ss8 h PRO 462 CO 1.04 0.56 -0.02 0.66 -0.23 0.00 0.00 178.00 180.02 1ss8 h SER 463 N 0.88 0.00 -0.01 1.44 4.64 -1.94 -0.55 113.55 118.01 1ss8 h SER 463 Ca 0.38 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.56 1ss8 h SER 463 Cb 0.34 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1ss8 h SER 463 CO -0.15 0.02 -0.56 0.58 -0.87 0.00 0.00 176.83 175.85 1ss8 h VAL 464 N 0.00 1.43 -0.48 0.95 2.07 -1.79 -1.61 116.25 116.83 1ss8 h VAL 464 Ca -0.00 -2.04 -0.07 0.00 0.82 0.00 0.00 66.70 65.40 1ss8 h VAL 464 Cb 0.87 2.58 -0.02 0.00 -1.52 0.00 0.00 31.29 33.20 1ss8 h VAL 464 CO 0.00 0.59 0.01 0.58 0.02 0.00 0.00 177.57 178.78 1ss8 h VAL 465 N -0.13 1.26 -0.76 2.57 2.07 -1.37 -1.44 116.25 118.45 1ss8 h VAL 465 Ca -0.07 -1.04 0.07 0.00 0.82 0.00 0.00 66.70 66.48 1ss8 h VAL 465 Cb 1.27 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.97 1ss8 h VAL 465 CO 0.11 0.36 0.44 0.00 0.02 0.00 0.00 177.57 178.51 1ss8 h ALA 466 N 0.93 1.05 -0.19 1.67 0.00 -1.11 -0.65 119.26 120.95 1ss8 h ALA 466 Ca 0.14 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 466 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1ss8 h ALA 466 CO 0.02 0.13 0.05 -0.97 0.00 0.00 0.00 179.25 178.48 1ss8 h ASN 467 N 0.80 0.29 0.51 0.00 -1.24 -1.06 0.19 115.58 115.07 1ss8 h ASN 467 Ca 0.35 -0.23 -0.03 0.00 0.71 0.00 0.00 56.30 57.10 1ss8 h ASN 467 Cb 0.22 -0.08 0.01 0.00 0.73 0.00 0.00 38.32 39.20 1ss8 h ASN 467 CO -0.20 0.45 -0.25 0.74 -1.29 0.00 0.00 177.43 176.88 1ss8 h THR 468 N 0.13 0.49 -0.56 -3.57 2.02 -0.85 -1.45 112.91 109.11 1ss8 h THR 468 Ca 0.06 -0.09 0.08 0.00 0.77 0.00 0.00 66.41 67.23 1ss8 h THR 468 Cb 0.27 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 67.14 1ss8 h THR 468 CO 0.00 0.02 0.20 0.58 0.37 0.00 0.00 175.52 176.68 1ss8 h VAL 469 N -0.75 0.78 -1.00 3.16 2.07 -1.06 -1.09 116.25 118.37 1ss8 h VAL 469 Ca -0.07 -0.13 0.12 0.00 0.82 0.00 0.00 66.70 67.44 1ss8 h VAL 469 Cb 0.56 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.62 1ss8 h VAL 469 CO 0.12 0.07 0.63 0.11 0.02 0.00 0.00 177.57 178.52 1ss8 h LYS 470 N 0.37 0.96 0.00 1.57 1.57 -0.44 -2.55 116.57 118.05 1ss8 h LYS 470 Ca 0.28 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1ss8 h LYS 470 Cb 0.33 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1ss8 h LYS 470 CO -0.29 0.64 0.00 0.41 -0.57 0.00 0.00 179.45 179.64 1ss8 n GLY 471 N -1.35 -1.02 3.63 3.86 0.00 -0.42 -4.78 105.19 105.11 1ss8 n GLY 471 Ca 0.19 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 1ss8 n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 472 N 0.52 1.50 3.37 -0.02 0.00 -0.96 -5.09 105.19 104.50 1ss8 n GLY 472 Ca 0.09 -2.15 -0.28 0.00 0.00 0.00 0.00 46.02 43.68 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 -4.50 3.18 1.08 1.61 2.15 -1.26 -4.99 116.67 113.93 1ss8 s ASP 473 Ca 0.58 -0.75 0.00 0.00 0.43 0.00 0.00 52.55 52.82 1ss8 s ASP 473 Cb -0.04 -0.21 0.00 0.00 -0.30 0.00 0.00 42.92 42.37 1ss8 s ASP 473 CO 0.38 0.15 0.00 0.61 -0.17 0.00 0.00 175.17 176.14 1ss8 n GLY 474 N 0.89 3.05 0.51 2.66 0.00 -1.26 -2.34 105.19 108.70 1ss8 n GLY 474 Ca -0.18 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.51 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 1.33 1.13 -4.73 1.61 3.02 -1.26 -4.88 115.26 111.48 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 -0.44 -0.03 0.00 -0.61 0.00 0.00 39.78 38.71 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 -1.23 2.88 0.00 3.10 5.04 -0.99 -0.57 117.35 125.58 1ss8 s TYR 476 Ca 0.03 0.53 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 1ss8 s TYR 476 Cb 0.02 -4.09 0.00 0.00 0.35 0.00 0.00 41.96 38.24 1ss8 s TYR 476 CO 0.01 -3.96 0.00 0.41 -1.34 0.00 0.00 175.55 170.67 1ss8 n GLY 477 N 3.34 2.12 3.52 8.97 0.00 0.12 -4.86 105.19 118.41 1ss8 n GLY 477 Ca 0.13 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 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 -4.66 3.10 -0.64 1.61 5.04 -1.26 -1.98 117.35 118.57 1ss8 s TYR 478 Ca 0.00 -0.23 -0.21 0.00 -2.44 0.00 0.00 57.07 54.19 1ss8 s TYR 478 Cb 0.00 -2.04 0.08 0.00 0.35 0.00 0.00 41.96 40.35 1ss8 s TYR 478 CO 0.00 -0.05 0.86 1.21 -1.34 0.00 0.00 175.55 176.23 1ss8 s ASN 479 N 0.60 6.18 0.44 4.32 3.84 0.51 -4.90 114.94 125.92 1ss8 s ASN 479 Ca -0.00 -1.19 0.21 0.00 0.21 0.00 0.00 52.86 52.09 1ss8 s ASN 479 Cb -0.14 -2.37 1.00 0.00 -0.55 0.00 0.00 41.25 39.19 1ss8 s ASN 479 CO 0.02 -1.31 1.89 0.00 -2.79 0.00 0.00 177.10 174.92 1ss8 h ALA 480 N 9.40 1.21 0.13 1.71 0.00 -1.95 0.76 119.26 130.52 1ss8 h ALA 480 Ca -0.28 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.40 1ss8 h ALA 480 Cb 1.08 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1ss8 h ALA 480 CO 1.15 0.33 -0.20 0.00 0.00 0.00 0.00 179.25 180.53 1ss8 h ALA 481 N 1.74 -0.34 -0.01 0.00 0.00 -1.95 -3.18 119.26 115.52 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 0.61 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ss8 h ALA 481 CO 0.03 -0.73 -0.48 0.25 0.00 0.00 0.00 179.25 178.33 1ss8 n THR 482 N -5.32 0.00 -3.85 0.00 -2.24 -1.10 -4.99 114.28 96.79 1ss8 n THR 482 Ca -0.07 -0.12 -0.25 0.00 -2.27 0.00 0.00 64.05 61.34 1ss8 n THR 482 Cb 0.24 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 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 -0.74 -3.40 -4.09 -0.78 1.02 0.26 -5.01 120.64 107.89 1ss8 n GLU 483 Ca 0.09 0.47 -0.11 0.00 -0.02 0.00 0.00 57.16 57.58 1ss8 n GLU 483 Cb 0.38 -4.63 -0.11 0.00 -0.02 0.00 0.00 31.44 27.06 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 -6.32 0.62 0.45 3.49 0.41 -1.16 -4.97 118.70 111.22 1ss8 s GLU 484 Ca 0.07 -0.98 -0.02 0.00 -0.41 0.00 0.00 54.97 53.63 1ss8 s GLU 484 Cb -0.02 -0.17 -0.02 0.00 -1.78 0.00 0.00 34.13 32.14 1ss8 s GLU 484 CO 0.86 0.00 0.70 0.71 -0.49 0.00 0.00 175.26 177.05 1ss8 s TYR 485 N -2.40 3.39 0.00 1.61 1.51 -1.26 -0.36 117.35 119.84 1ss8 s TYR 485 Ca -0.02 0.48 0.00 0.00 -1.01 0.00 0.00 57.07 56.52 1ss8 s TYR 485 Cb -0.03 -2.26 0.00 0.00 -0.11 0.00 0.00 41.96 39.56 1ss8 s TYR 485 CO -0.03 -0.28 0.00 0.41 -1.11 0.00 0.00 175.55 174.55 1ss8 n GLY 486 N -2.12 -0.82 3.63 0.71 0.00 -0.84 -4.88 105.19 100.87 1ss8 n GLY 486 Ca -0.00 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 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 0.00 6.86 0.37 1.61 3.84 -1.26 -0.70 114.94 125.66 1ss8 s ASN 487 Ca 0.00 0.93 0.05 0.00 0.21 0.00 0.00 52.86 54.05 1ss8 s ASN 487 Cb 0.00 -2.52 0.73 0.00 -0.55 0.00 0.00 41.25 38.91 1ss8 s ASN 487 CO 0.00 -0.87 1.99 0.24 -2.79 0.00 0.00 177.10 175.67 1ss8 h MET 488 N 8.19 0.59 0.06 0.43 2.86 -1.17 -0.83 114.93 125.08 1ss8 h MET 488 Ca -0.21 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1ss8 h MET 488 Cb 1.07 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1ss8 h MET 488 CO 1.02 0.46 -0.03 0.82 1.06 0.00 0.00 176.91 180.24 1ss8 h ILE 489 N 0.60 1.22 -0.46 -1.22 1.08 -1.80 -1.76 117.51 115.17 1ss8 h ILE 489 Ca 0.15 -1.06 0.02 0.00 -0.39 0.00 0.00 64.86 63.59 1ss8 h ILE 489 Cb 0.06 1.90 -0.02 0.00 -3.07 0.00 0.00 36.82 35.69 1ss8 h ILE 489 CO -0.02 0.26 0.31 0.44 -0.69 0.00 0.00 178.15 178.45 1ss8 h ASP 490 N -0.57 0.47 0.00 1.72 3.32 -1.84 -0.16 116.42 119.36 1ss8 h ASP 490 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1ss8 h ASP 490 Cb 0.49 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1ss8 h ASP 490 CO 0.01 0.33 0.00 0.23 -1.72 0.00 0.00 179.24 178.09 1ss8 n MET 491 N -4.47 0.87 -2.43 3.56 2.81 -0.36 -4.90 117.12 112.21 1ss8 n MET 491 Ca 0.05 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.77 1ss8 n MET 491 Cb 0.12 -1.45 -0.00 0.00 -0.71 0.00 0.00 33.22 31.17 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 0.71 -0.32 3.26 3.03 0.00 -0.07 -5.02 105.19 106.77 1ss8 n GLY 492 Ca 0.19 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.89 4.22 0.08 -0.61 1.01 -0.68 -5.03 121.20 117.30 1ss8 s ILE 493 Ca 0.05 -1.46 -0.12 0.00 0.00 0.00 0.00 60.65 59.12 1ss8 s ILE 493 Cb -0.02 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.85 1ss8 s ILE 493 CO 0.06 -0.55 0.29 -1.48 0.00 0.00 0.00 174.94 173.26 1ss8 s LEU 494 N 1.41 0.96 0.16 2.97 0.05 -1.26 -0.56 118.68 122.41 1ss8 s LEU 494 Ca 0.03 -0.38 0.10 0.00 0.05 0.00 0.00 54.13 53.93 1ss8 s LEU 494 Cb -0.23 1.36 -0.04 0.00 -2.05 0.00 0.00 46.19 45.22 1ss8 s LEU 494 CO 0.02 -0.71 -0.21 -1.81 -0.55 0.00 0.00 176.35 173.08 1ss8 s ASP 495 N -2.53 2.95 0.24 1.48 1.01 -0.22 -4.64 116.67 114.96 1ss8 s ASP 495 Ca 0.00 -0.83 -0.30 0.00 0.71 0.00 0.00 52.55 52.14 1ss8 s ASP 495 Cb 0.02 -0.19 -0.10 0.00 1.01 0.00 0.00 42.92 43.66 1ss8 s ASP 495 CO -0.08 0.05 1.43 -2.84 0.21 0.00 0.00 175.17 173.94 1ss8 s PRO 496 N -2.55 4.28 0.36 8.23 0.02 -1.26 -0.71 135.00 143.36 1ss8 s PRO 496 Ca 0.16 2.27 0.12 0.00 0.02 0.00 0.00 61.00 63.58 1ss8 s PRO 496 Cb -0.07 -3.12 0.94 0.00 0.02 0.00 0.00 34.50 32.26 1ss8 s PRO 496 CO 0.07 -0.41 1.78 1.15 -0.33 0.00 0.00 177.00 179.27 1ss8 h THR 497 N 3.59 0.62 -0.83 0.99 2.02 -0.97 0.66 112.91 118.99 1ss8 h THR 497 Ca -0.46 -0.19 0.12 0.00 0.77 0.00 0.00 66.41 66.65 1ss8 h THR 497 Cb 1.22 0.02 -0.06 0.00 -1.74 0.00 0.00 68.15 67.58 1ss8 h THR 497 CO 0.78 0.10 0.54 0.50 0.37 0.00 0.00 175.52 177.82 1ss8 h LYS 498 N 0.56 0.67 0.12 6.66 3.64 -1.82 -0.20 116.57 126.19 1ss8 h LYS 498 Ca 0.57 -0.04 -0.28 0.00 -1.27 0.00 0.00 60.65 59.63 1ss8 h LYS 498 Cb 1.18 -0.15 0.02 0.00 -0.41 0.00 0.00 32.23 32.86 1ss8 h LYS 498 CO -0.33 0.44 -1.21 -0.39 -2.27 0.00 0.00 179.45 175.70 1ss8 h VAL 499 N 0.69 1.39 -0.75 2.00 -1.51 -1.17 -1.80 116.25 115.10 1ss8 h VAL 499 Ca 0.40 -2.73 0.00 0.00 -1.23 0.00 0.00 66.70 63.14 1ss8 h VAL 499 Cb 0.59 2.78 -0.04 0.00 -2.13 0.00 0.00 31.29 32.50 1ss8 h VAL 499 CO -0.17 0.81 0.48 0.74 -1.23 0.00 0.00 177.57 178.20 1ss8 h THR 500 N 0.17 1.20 -0.17 7.19 2.02 -1.32 -1.04 112.91 120.96 1ss8 h THR 500 Ca -0.15 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 1ss8 h THR 500 Cb 1.90 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1ss8 h THR 500 CO 0.21 0.20 0.04 -0.09 0.37 0.00 0.00 175.52 176.26 1ss8 h ARG 501 N 1.03 0.27 -0.53 6.66 2.43 -1.03 -2.34 114.38 120.86 1ss8 h ARG 501 Ca 0.27 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.32 1ss8 h ARG 501 Cb -0.08 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 1ss8 h ARG 501 CO -0.06 0.41 0.08 0.77 -1.51 0.00 0.00 179.97 179.66 1ss8 h SER 502 N 0.08 0.85 -0.48 -3.80 0.02 -1.15 -0.15 113.55 108.92 1ss8 h SER 502 Ca 0.05 -0.26 0.02 0.00 -0.84 0.00 0.00 61.79 60.76 1ss8 h SER 502 Cb 0.26 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1ss8 h SER 502 CO 0.00 0.90 0.29 0.00 -1.14 0.00 0.00 176.83 176.87 1ss8 h ALA 503 N 0.98 0.61 -0.61 3.77 0.00 -1.08 -1.34 119.26 121.60 1ss8 h ALA 503 Ca 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1ss8 h ALA 503 Cb 0.41 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1ss8 h ALA 503 CO 0.01 -0.02 0.33 1.25 0.00 0.00 0.00 179.25 180.82 1ss8 h LEU 504 N 0.57 0.76 -0.07 0.00 6.46 -0.96 -0.42 115.31 121.66 1ss8 h LEU 504 Ca 0.19 -0.10 -0.24 0.00 -0.12 0.00 0.00 57.88 57.61 1ss8 h LEU 504 Cb 0.01 -0.19 0.02 0.00 -0.73 0.00 0.00 40.66 39.76 1ss8 h LEU 504 CO -0.08 0.64 -0.91 1.56 -0.62 0.00 0.00 178.44 179.03 1ss8 h GLN 505 N 0.83 0.74 -0.04 1.25 4.20 -0.65 -0.73 115.11 120.71 1ss8 h GLN 505 Ca 0.21 -0.70 -0.00 0.00 0.06 0.00 0.00 58.65 58.22 1ss8 h GLN 505 Cb 0.05 0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1ss8 h GLN 505 CO -0.03 1.29 0.01 1.88 -0.67 0.00 0.00 178.83 181.31 1ss8 h TYR 506 N 0.45 0.07 -0.81 2.96 0.05 -1.27 -1.95 116.97 116.47 1ss8 h TYR 506 Ca -0.09 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 58.82 1ss8 h TYR 506 Cb 1.55 -0.02 -0.09 0.00 1.01 0.00 0.00 36.73 39.18 1ss8 h TYR 506 CO 0.10 0.25 0.39 0.00 -1.05 0.00 0.00 178.16 177.85 1ss8 h ALA 507 N 0.81 1.19 0.00 3.88 0.00 -0.98 -0.50 119.26 123.65 1ss8 h ALA 507 Ca 0.01 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ss8 h ALA 507 Cb 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1ss8 h ALA 507 CO -0.00 -0.12 -0.24 0.00 0.00 0.00 0.00 179.25 178.89 1ss8 h ALA 508 N 1.54 0.97 0.32 0.00 0.00 -0.94 -1.06 119.26 120.10 1ss8 h ALA 508 Ca 0.44 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1ss8 h ALA 508 Cb 0.62 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1ss8 h ALA 508 CO -0.37 0.30 -0.16 1.03 0.00 0.00 0.00 179.25 180.06 1ss8 h SER 509 N 0.00 -0.37 -0.61 0.00 0.87 -0.30 -1.18 113.55 111.95 1ss8 h SER 509 Ca -0.00 -0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 60.35 1ss8 h SER 509 Cb 0.84 0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.87 1ss8 h SER 509 CO 0.03 0.09 0.15 -0.37 -0.53 0.00 0.00 176.83 176.20 1ss8 h VAL 510 N -0.98 1.25 -0.53 2.23 -1.51 -1.44 -1.67 116.25 113.60 1ss8 h VAL 510 Ca -0.04 -0.92 0.15 0.00 -1.23 0.00 0.00 66.70 64.65 1ss8 h VAL 510 Cb 0.49 0.68 -0.02 0.00 -2.13 0.00 0.00 31.29 30.31 1ss8 h VAL 510 CO 0.07 0.34 0.38 0.00 -1.23 0.00 0.00 177.57 177.13 1ss8 h ALA 511 N 1.04 2.46 0.07 5.19 0.00 -1.19 0.25 119.26 127.09 1ss8 h ALA 511 Ca 0.19 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 511 Cb 0.36 0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.19 1ss8 h ALA 511 CO 0.00 -0.61 -0.63 0.78 0.00 0.00 0.00 179.25 178.80 1ss8 h GLY 512 N 0.03 0.33 1.01 0.00 0.00 -0.55 0.18 103.07 104.07 1ss8 h GLY 512 Ca 0.25 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1ss8 h GLY 512 CO -0.01 0.64 0.56 1.41 0.00 0.00 0.00 176.54 179.14 1ss8 h LEU 513 N -0.36 1.07 -0.26 3.11 3.38 -0.43 -2.42 115.31 119.40 1ss8 h LEU 513 Ca -0.10 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.68 1ss8 h LEU 513 Cb 1.43 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1ss8 h LEU 513 CO 0.12 0.80 -0.36 -0.03 0.09 0.00 0.00 178.44 179.07 1ss8 h MET 514 N 1.23 0.70 -0.08 1.13 4.05 -0.47 -2.52 114.93 118.98 1ss8 h MET 514 Ca 0.33 -0.41 0.02 0.00 -0.28 0.00 0.00 59.70 59.36 1ss8 h MET 514 Cb -0.08 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.75 1ss8 h MET 514 CO -0.06 1.03 0.12 0.82 0.23 0.00 0.00 176.91 179.04 1ss8 h ILE 515 N 0.43 0.36 -0.46 1.77 2.04 -0.76 -2.29 117.51 118.60 1ss8 h ILE 515 Ca 0.03 0.00 -0.26 0.00 1.00 0.00 0.00 64.86 65.63 1ss8 h ILE 515 Cb 0.94 0.90 -0.15 0.00 -0.74 0.00 0.00 36.82 37.77 1ss8 h ILE 515 CO 0.08 0.00 -0.04 0.35 0.00 0.00 0.00 178.15 178.55 1ss8 n THR 516 N -3.60 2.66 -4.01 -0.27 -2.24 -0.93 -4.86 114.28 101.02 1ss8 n THR 516 Ca -0.01 -2.82 -0.35 0.00 -2.27 0.00 0.00 64.05 58.61 1ss8 n THR 516 Cb 0.21 -0.42 -0.09 0.00 -2.10 0.00 0.00 70.33 67.92 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 -3.42 4.82 -0.36 4.28 2.01 -0.87 -4.99 115.64 117.11 1ss8 s THR 517 Ca 0.47 -0.03 0.15 0.00 0.31 0.00 0.00 61.69 62.59 1ss8 s THR 517 Cb 0.42 -3.16 -0.19 0.00 0.01 0.00 0.00 72.50 69.58 1ss8 s THR 517 CO 0.01 0.48 0.48 -0.62 -0.69 0.00 0.00 174.62 174.27 1ss8 n GLU 518 N 3.36 1.36 -3.77 4.92 -0.58 -1.26 -4.75 120.64 119.92 1ss8 n GLU 518 Ca -0.17 -0.07 -0.13 0.00 -0.42 0.00 0.00 57.16 56.38 1ss8 n GLU 518 Cb 0.52 -1.27 -0.12 0.00 -0.57 0.00 0.00 31.44 30.00 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 0.53 2.23 -0.10 0.00 -1.94 0.10 -4.99 119.30 115.14 1ss8 s MET 520 Ca -0.03 -0.61 0.04 0.00 -1.71 0.00 0.00 55.69 53.37 1ss8 s MET 520 Cb -0.05 -1.77 -0.01 0.00 2.01 0.00 0.00 34.83 35.02 1ss8 s MET 520 CO -0.03 0.10 -0.22 0.08 -0.01 0.00 0.00 175.02 174.94 1ss8 s VAL 521 N 0.49 2.27 0.37 -6.03 1.01 -1.26 -1.68 120.40 115.57 1ss8 s VAL 521 Ca -0.16 -0.95 -0.10 0.00 0.00 0.00 0.00 61.98 60.77 1ss8 s VAL 521 Cb -0.16 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.37 1ss8 s VAL 521 CO 0.06 0.56 0.67 0.28 0.00 0.00 0.00 175.10 176.66 1ss8 s THR 522 N 0.21 0.00 0.41 3.92 -1.32 -1.07 -5.01 115.64 112.78 1ss8 s THR 522 Ca -0.14 -1.24 -0.18 0.00 -1.21 0.00 0.00 61.69 58.92 1ss8 s THR 522 Cb -0.17 -2.81 -0.10 0.00 -1.51 0.00 0.00 72.50 67.92 1ss8 s THR 522 CO 0.07 0.00 0.88 -1.81 -2.21 0.00 0.00 174.62 171.55 1ss8 s ASP 523 N -3.15 6.83 0.19 8.08 1.01 -1.26 -0.99 116.67 127.38 1ss8 s ASP 523 Ca 0.22 1.52 -0.31 0.00 0.71 0.00 0.00 52.55 54.69 1ss8 s ASP 523 Cb -0.03 -2.47 -0.09 0.00 1.01 0.00 0.00 42.92 41.33 1ss8 s ASP 523 CO 0.15 -0.34 1.42 -0.76 0.21 0.00 0.00 175.17 175.85 1ss8 s LEU 524 N -3.26 4.39 0.00 1.23 1.43 -1.12 -4.52 118.68 116.82 1ss8 s LEU 524 Ca 0.59 2.51 0.00 0.00 -1.03 0.00 0.00 54.13 56.20 1ss8 s LEU 524 Cb -0.10 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.52 1ss8 s LEU 524 CO 0.17 -0.67 0.33 -0.81 0.23 0.00 0.00 176.35 175.60