#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 -0.27 -2.57 0.00 0.00 -1.26 -4.91 120.51 111.50 1ss8 n ALA 3 Ca 0.00 0.28 -0.23 0.00 0.00 0.00 0.00 53.44 53.48 1ss8 n ALA 3 Cb 0.00 -2.00 -0.07 0.00 0.00 0.00 0.00 19.45 17.38 1ss8 n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ss8 s LYS 4 N -1.78 2.34 -0.16 0.00 -0.14 -1.26 -2.81 119.74 115.93 1ss8 s LYS 4 Ca 0.62 -1.51 -0.04 0.00 -1.36 0.00 0.00 55.97 53.68 1ss8 s LYS 4 Cb -0.62 -2.16 -0.03 0.00 -1.68 0.00 0.00 37.83 33.34 1ss8 s LYS 4 CO 0.58 0.20 -0.03 0.34 -0.76 0.00 0.00 175.35 175.67 1ss8 s ASP 5 N -3.78 4.80 -0.03 2.83 -1.08 0.27 -4.67 116.67 115.00 1ss8 s ASP 5 Ca 0.35 -0.14 0.06 0.00 -0.52 0.00 0.00 52.55 52.30 1ss8 s ASP 5 Cb -0.04 -1.79 -0.01 0.00 -1.46 0.00 0.00 42.92 39.62 1ss8 s ASP 5 CO 0.22 0.15 -0.20 -0.69 0.52 0.00 0.00 175.17 175.17 1ss8 s VAL 6 N 0.46 1.63 0.15 1.11 1.01 -1.26 -2.50 120.40 121.01 1ss8 s VAL 6 Ca -0.03 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.15 1ss8 s VAL 6 Cb -0.14 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 1ss8 s VAL 6 CO 0.03 0.46 -0.14 -0.54 0.00 0.00 0.00 175.10 174.91 1ss8 s LYS 7 N -0.31 1.14 0.12 2.72 1.02 -0.85 -4.97 119.74 118.60 1ss8 s LYS 7 Ca 0.04 -1.39 0.05 0.00 0.02 0.00 0.00 55.97 54.69 1ss8 s LYS 7 Cb -0.10 -0.95 -0.04 0.00 -0.52 0.00 0.00 37.83 36.23 1ss8 s LYS 7 CO 0.01 0.17 -0.12 -0.06 -0.92 0.00 0.00 175.35 174.42 1ss8 s PHE 8 N -2.58 1.29 0.00 3.18 0.08 -1.26 -0.80 117.98 117.89 1ss8 s PHE 8 Ca 0.15 -0.60 0.00 0.00 0.12 0.00 0.00 56.93 56.59 1ss8 s PHE 8 Cb -0.02 -0.68 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 1ss8 s PHE 8 CO 0.04 0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.67 1ss8 n GLY 9 N 0.46 1.49 0.37 4.36 0.00 -0.29 -2.05 105.19 109.52 1ss8 n GLY 9 Ca -0.15 0.10 0.04 0.00 0.00 0.00 0.00 46.02 46.01 1ss8 n GLY 9 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ss8 h ASN 10 N 0.00 0.93 -0.81 1.61 -0.26 -1.95 0.36 115.58 115.46 1ss8 h ASN 10 Ca 0.00 0.01 0.14 0.00 -0.56 0.00 0.00 56.30 55.89 1ss8 h ASN 10 Cb 0.00 -0.19 -0.09 0.00 -1.06 0.00 0.00 38.32 36.98 1ss8 h ASN 10 CO 0.00 0.59 0.39 0.44 -1.06 0.00 0.00 177.43 177.79 1ss8 h ASP 11 N 1.05 0.46 -0.40 5.81 3.32 -1.83 0.47 116.42 125.30 1ss8 h ASP 11 Ca 0.41 0.09 -0.11 0.00 0.02 0.00 0.00 57.03 57.44 1ss8 h ASP 11 Cb 0.22 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1ss8 h ASP 11 CO -0.16 0.20 -0.19 0.00 -1.72 0.00 0.00 179.24 177.37 1ss8 h ALA 12 N 1.54 0.56 0.11 3.45 0.00 -0.82 -2.79 119.26 121.31 1ss8 h ALA 12 Ca 0.44 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ss8 h ALA 12 Cb 0.62 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1ss8 h ALA 12 CO -0.36 0.51 -0.50 0.78 0.00 0.00 0.00 179.25 179.68 1ss8 h GLY 13 N 0.64 -1.05 1.71 0.00 0.00 0.11 -0.56 103.07 103.92 1ss8 h GLY 13 Ca 0.09 0.60 -0.03 0.00 0.00 0.00 0.00 47.33 47.99 1ss8 h GLY 13 CO 0.06 -0.27 0.04 -0.39 0.00 0.00 0.00 176.54 175.98 1ss8 h VAL 14 N -0.72 1.14 -0.26 4.60 -1.51 -0.14 -1.25 116.25 118.11 1ss8 h VAL 14 Ca 0.01 -0.51 -0.14 0.00 -1.23 0.00 0.00 66.70 64.83 1ss8 h VAL 14 Cb 0.74 0.90 -0.00 0.00 -2.13 0.00 0.00 31.29 30.80 1ss8 h VAL 14 CO -0.28 0.18 -0.37 0.11 -1.23 0.00 0.00 177.57 175.97 1ss8 h LYS 15 N 0.37 0.71 -0.73 5.19 1.79 -1.15 -1.80 116.57 120.95 1ss8 h LYS 15 Ca 0.09 -0.42 -0.03 0.00 -2.18 0.00 0.00 60.65 58.12 1ss8 h LYS 15 Cb 0.19 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 1ss8 h LYS 15 CO -0.00 1.04 0.35 0.52 -1.08 0.00 0.00 179.45 180.28 1ss8 h MET 16 N 0.44 1.06 -0.32 3.15 2.86 -0.53 -2.61 114.93 118.98 1ss8 h MET 16 Ca 0.03 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1ss8 h MET 16 Cb 0.96 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 1ss8 h MET 16 CO 0.09 0.83 0.14 1.25 1.06 0.00 0.00 176.91 180.28 1ss8 h LEU 17 N 1.03 0.42 -0.83 1.22 5.85 -1.20 -0.49 115.31 121.32 1ss8 h LEU 17 Ca 0.25 -0.14 0.12 0.00 0.84 0.00 0.00 57.88 58.96 1ss8 h LEU 17 Cb 0.12 -0.11 -0.08 0.00 0.37 0.00 0.00 40.66 40.95 1ss8 h LEU 17 CO -0.03 0.44 0.44 0.03 -0.34 0.00 0.00 178.44 178.98 1ss8 h ARG 18 N 0.37 0.66 -0.04 1.25 3.08 -1.21 0.19 114.38 118.67 1ss8 h ARG 18 Ca 0.11 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1ss8 h ARG 18 Cb 0.14 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 1ss8 h ARG 18 CO -0.01 0.44 0.03 0.78 -1.07 0.00 0.00 179.97 180.13 1ss8 h GLY 19 N 0.68 0.06 0.99 0.04 0.00 -1.05 -1.39 103.07 102.40 1ss8 h GLY 19 Ca 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.73 1ss8 h GLY 19 CO -0.31 0.02 0.32 -2.08 0.00 0.00 0.00 176.54 174.49 1ss8 h VAL 20 N 0.02 1.18 -0.26 4.60 2.07 -0.64 -2.23 116.25 120.99 1ss8 h VAL 20 Ca 0.01 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.04 1ss8 h VAL 20 Cb 0.04 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1ss8 h VAL 20 CO -0.00 0.19 -0.11 0.78 0.02 0.00 0.00 177.57 178.44 1ss8 h ASN 21 N 0.75 0.41 0.09 0.57 2.35 -0.56 0.24 115.58 119.42 1ss8 h ASN 21 Ca 0.20 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1ss8 h ASN 21 Cb 0.02 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.29 1ss8 h ASN 21 CO -0.03 0.56 -0.04 0.58 -1.65 0.00 0.00 177.43 176.84 1ss8 h VAL 22 N 0.40 1.10 -0.04 2.81 2.07 -0.78 0.09 116.25 121.90 1ss8 h VAL 22 Ca 0.08 -0.72 0.02 0.00 0.82 0.00 0.00 66.70 66.90 1ss8 h VAL 22 Cb 0.44 1.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1ss8 h VAL 22 CO 0.02 0.18 -0.46 0.25 0.02 0.00 0.00 177.57 177.58 1ss8 h LEU 23 N -0.45 -1.44 -0.58 2.57 5.85 -1.06 -0.96 115.31 119.25 1ss8 h LEU 23 Ca -0.01 0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1ss8 h LEU 23 Cb 0.38 0.55 -0.02 0.00 0.37 0.00 0.00 40.66 41.94 1ss8 h LEU 23 CO 0.02 -0.44 0.14 0.00 -0.34 0.00 0.00 178.44 177.83 1ss8 h ALA 24 N -0.54 0.76 -0.37 1.25 0.00 -0.54 -1.68 119.26 118.14 1ss8 h ALA 24 Ca 0.02 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1ss8 h ALA 24 Cb 0.61 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ss8 h ALA 24 CO -0.33 0.46 -0.06 -0.44 0.00 0.00 0.00 179.25 178.89 1ss8 h ASP 25 N 0.83 0.58 -0.50 0.00 3.32 -0.83 0.14 116.42 119.97 1ss8 h ASP 25 Ca 0.18 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1ss8 h ASP 25 Cb 0.34 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1ss8 h ASP 25 CO 0.00 0.69 0.13 0.00 -1.72 0.00 0.00 179.24 178.35 1ss8 h ALA 26 N 1.37 0.65 0.08 3.45 0.00 -0.44 -3.28 119.26 121.10 1ss8 h ALA 26 Ca 0.11 -0.20 -0.28 0.00 0.00 0.00 0.00 54.91 54.54 1ss8 h ALA 26 Cb 0.45 -0.19 0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ss8 h ALA 26 CO 0.02 0.33 -1.17 0.28 0.00 0.00 0.00 179.25 178.72 1ss8 h VAL 27 N 0.68 1.32 0.00 0.00 2.07 -0.33 -3.33 116.25 116.66 1ss8 h VAL 27 Ca 0.16 -2.48 0.00 0.00 0.82 0.00 0.00 66.70 65.20 1ss8 h VAL 27 Cb 0.31 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.71 1ss8 h VAL 27 CO -0.00 0.75 0.00 0.07 0.02 0.00 0.00 177.57 178.41 1ss8 h LYS 28 N 0.27 0.00 0.00 1.57 2.10 -0.83 -1.96 116.57 117.72 1ss8 h LYS 28 Ca -0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.49 1ss8 h LYS 28 Cb 1.84 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.17 1ss8 h LYS 28 CO 0.22 0.00 0.14 -0.39 -2.00 0.00 0.00 179.45 177.42 1ss8 h VAL 29 N 0.00 0.00 -0.01 0.07 -1.51 -1.67 -1.78 116.25 111.35 1ss8 h VAL 29 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1ss8 h VAL 29 Cb 0.68 0.63 0.00 0.00 -2.13 0.00 0.00 31.29 30.47 1ss8 h VAL 29 CO 0.00 0.00 -0.04 0.35 -1.23 0.00 0.00 177.57 176.65 1ss8 n THR 30 N -2.59 0.00 -2.69 7.19 -2.24 -0.74 -0.62 114.28 112.59 1ss8 n THR 30 Ca -0.02 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1ss8 n THR 30 Cb 0.18 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.71 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 -2.09 4.42 0.00 3.22 2.96 -0.67 -4.37 118.68 122.15 1ss8 s LEU 31 Ca 0.37 1.75 0.00 0.00 -0.22 0.00 0.00 54.13 56.03 1ss8 s LEU 31 Cb 0.21 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.32 1ss8 s LEU 31 CO 0.37 -0.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.81 1ss8 n GLY 32 N 2.63 -0.96 0.32 7.98 0.00 -1.26 -3.72 105.19 110.17 1ss8 n GLY 32 Ca 0.05 -1.65 0.20 0.00 0.00 0.00 0.00 46.02 44.61 1ss8 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ss8 h PRO 33 N 0.00 0.00 -0.63 1.61 0.13 -1.91 -0.08 132.00 131.13 1ss8 h PRO 33 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.88 1ss8 h PRO 33 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 1ss8 h PRO 33 CO 0.00 0.01 0.23 1.63 -0.23 0.00 0.00 178.00 179.65 1ss8 n LYS 34 N -3.21 2.70 -1.66 0.86 4.01 -1.26 -5.02 118.16 114.58 1ss8 n LYS 34 Ca -0.02 -3.07 -0.39 0.00 -0.51 0.00 0.00 58.31 54.32 1ss8 n LYS 34 Cb 0.14 -2.04 0.03 0.00 -0.51 0.00 0.00 35.03 32.64 1ss8 n LYS 34 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ss8 n GLY 35 N -0.74 0.12 3.93 0.72 0.00 -0.04 -4.59 105.19 104.59 1ss8 n GLY 35 Ca 0.41 0.03 -0.25 0.00 0.00 0.00 0.00 46.02 46.21 1ss8 n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ss8 s ARG 36 N -2.50 3.49 0.51 1.61 1.81 0.21 -4.95 118.95 119.13 1ss8 s ARG 36 Ca 0.69 -0.10 -0.19 0.00 -1.72 0.00 0.00 55.73 54.41 1ss8 s ARG 36 Cb -0.47 -2.53 -0.07 0.00 -0.45 0.00 0.00 34.95 31.43 1ss8 s ARG 36 CO 0.52 -0.03 1.03 -0.80 -0.68 0.00 0.00 175.30 175.34 1ss8 s ASN 37 N -4.08 6.30 -0.06 0.23 0.01 -1.26 -4.26 114.94 111.82 1ss8 s ASN 37 Ca 0.44 1.83 0.05 0.00 -0.71 0.00 0.00 52.86 54.46 1ss8 s ASN 37 Cb -0.10 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 39.00 1ss8 s ASN 37 CO 0.40 -0.81 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.29 1ss8 s VAL 38 N -2.20 2.53 -0.22 1.60 1.01 0.39 -4.94 120.40 118.57 1ss8 s VAL 38 Ca 0.65 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.63 1ss8 s VAL 38 Cb -0.15 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 1ss8 s VAL 38 CO 0.25 0.57 0.13 -0.69 0.00 0.00 0.00 175.10 175.36 1ss8 s VAL 39 N -0.30 5.21 -0.15 2.92 1.01 -1.26 -1.18 120.40 126.66 1ss8 s VAL 39 Ca 0.01 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.14 1ss8 s VAL 39 Cb -0.13 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.86 1ss8 s VAL 39 CO 0.03 0.39 -0.22 -0.76 0.00 0.00 0.00 175.10 174.53 1ss8 s LEU 40 N 0.81 2.11 0.82 3.92 1.43 0.32 -4.95 118.68 123.14 1ss8 s LEU 40 Ca 0.07 -0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 52.45 1ss8 s LEU 40 Cb -0.13 -1.45 0.08 0.00 0.03 0.00 0.00 46.19 44.73 1ss8 s LEU 40 CO 0.02 0.07 1.09 -0.62 0.23 0.00 0.00 176.35 177.14 1ss8 s ASP 41 N 0.89 4.10 0.01 2.29 2.15 -1.26 -1.09 116.67 123.76 1ss8 s ASP 41 Ca -0.05 1.69 -0.01 0.00 0.43 0.00 0.00 52.55 54.61 1ss8 s ASP 41 Cb -0.15 -2.38 -0.01 0.00 -0.30 0.00 0.00 42.92 40.07 1ss8 s ASP 41 CO -0.04 -2.27 -0.00 -0.54 -0.17 0.00 0.00 175.17 172.15 1ss8 s LYS 42 N -4.92 0.30 0.41 4.34 -0.14 -1.26 -4.81 119.74 113.66 1ss8 s LYS 42 Ca 0.62 -0.50 0.22 0.00 -1.36 0.00 0.00 55.97 54.95 1ss8 s LYS 42 Cb -0.17 0.11 0.47 0.00 -1.68 0.00 0.00 37.83 36.56 1ss8 s LYS 42 CO 0.56 -0.05 1.64 0.77 -0.76 0.00 0.00 175.35 177.51 1ss8 h SER 43 N 4.78 0.00 -0.86 2.83 0.02 -1.98 -3.37 113.55 114.98 1ss8 h SER 43 Ca -0.31 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.67 1ss8 h SER 43 Cb 1.21 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.70 1ss8 h SER 43 CO 0.42 0.17 0.56 0.15 -1.14 0.00 0.00 176.83 176.99 1ss8 h PHE 44 N 0.00 1.04 0.00 3.45 3.57 -2.03 -3.48 116.94 119.49 1ss8 h PHE 44 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1ss8 h PHE 44 Cb 1.01 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.40 1ss8 h PHE 44 CO 0.00 0.62 0.00 0.41 -2.23 0.00 0.00 178.31 177.11 1ss8 n GLY 45 N -1.40 -0.68 3.75 2.40 0.00 -1.26 -5.13 105.19 102.87 1ss8 n GLY 45 Ca 0.11 0.54 -0.40 0.00 0.00 0.00 0.00 46.02 46.27 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 3.35 0.94 4.61 0.00 -1.26 -4.76 121.76 123.64 1ss8 s ALA 46 Ca 0.00 0.59 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 1ss8 s ALA 46 Cb 0.00 -3.18 0.15 0.00 0.00 0.00 0.00 23.12 20.10 1ss8 s ALA 46 CO 0.00 0.22 1.10 -0.35 0.00 0.00 0.00 175.76 176.73 1ss8 n PRO 47 N 1.48 -0.60 -4.07 0.00 -0.04 -1.26 -4.77 135.00 125.74 1ss8 n PRO 47 Ca -0.02 -0.11 -0.32 0.00 -0.04 0.00 0.00 63.50 63.00 1ss8 n PRO 47 Cb 0.47 -2.34 -0.07 0.00 -0.04 0.00 0.00 33.50 31.53 1ss8 n PRO 47 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ss8 s THR 48 N -2.61 4.76 -0.15 0.52 -4.23 -0.25 -4.91 115.64 108.77 1ss8 s THR 48 Ca 0.67 -0.48 0.00 0.00 -1.18 0.00 0.00 61.69 60.70 1ss8 s THR 48 Cb -0.23 -3.21 -0.00 0.00 1.34 0.00 0.00 72.50 70.39 1ss8 s THR 48 CO 0.59 0.28 -0.15 -0.63 -0.54 0.00 0.00 174.62 174.17 1ss8 s ILE 49 N -1.26 2.73 0.01 2.99 1.01 -1.26 -0.53 121.20 124.89 1ss8 s ILE 49 Ca 0.25 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 1ss8 s ILE 49 Cb -0.12 -2.15 0.02 0.00 0.01 0.00 0.00 42.46 40.22 1ss8 s ILE 49 CO 0.17 0.52 0.26 0.28 0.00 0.00 0.00 174.94 176.17 1ss8 s THR 50 N 0.69 0.08 -0.83 2.92 -1.32 -0.32 -4.94 115.64 111.91 1ss8 s THR 50 Ca -0.07 -0.62 0.08 0.00 -1.21 0.00 0.00 61.69 59.87 1ss8 s THR 50 Cb -0.16 -0.70 0.15 0.00 -1.51 0.00 0.00 72.50 70.28 1ss8 s THR 50 CO 0.02 -0.34 1.00 0.29 -2.21 0.00 0.00 174.62 173.37 1ss8 n LYS 51 N 1.05 1.68 -2.86 7.08 5.02 -1.26 -0.47 118.16 128.40 1ss8 n LYS 51 Ca -0.21 -1.50 -0.43 0.00 -2.02 0.00 0.00 58.31 54.15 1ss8 n LYS 51 Cb 0.57 -1.18 -0.04 0.00 -0.02 0.00 0.00 35.03 34.36 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 -0.86 6.41 0.37 4.39 -1.08 -1.26 -4.82 116.67 119.82 1ss8 s ASP 52 Ca 0.14 -0.14 0.19 0.00 -0.52 0.00 0.00 52.55 52.23 1ss8 s ASP 52 Cb 0.08 -2.43 0.54 0.00 -1.46 0.00 0.00 42.92 39.65 1ss8 s ASP 52 CO 0.11 -1.09 1.66 1.23 0.52 0.00 0.00 175.17 177.60 1ss8 h GLY 53 N 10.62 0.00 0.93 2.66 0.00 -1.92 -2.07 103.07 113.30 1ss8 h GLY 53 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 1ss8 h GLY 53 CO 1.04 0.00 -0.07 -2.08 0.00 0.00 0.00 176.54 175.42 1ss8 h VAL 54 N 0.00 0.84 -0.99 4.60 2.07 -1.95 -1.05 116.25 119.76 1ss8 h VAL 54 Ca -0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.70 1ss8 h VAL 54 Cb 1.02 0.84 -0.10 0.00 -1.52 0.00 0.00 31.29 31.53 1ss8 h VAL 54 CO 0.05 0.00 0.61 0.28 0.02 0.00 0.00 177.57 178.53 1ss8 h SER 55 N -0.18 0.75 -0.09 0.57 0.02 -1.80 -2.24 113.55 110.57 1ss8 h SER 55 Ca -0.00 0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1ss8 h SER 55 Cb 0.16 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 1ss8 h SER 55 CO -0.00 0.29 -0.16 0.58 -1.14 0.00 0.00 176.83 176.40 1ss8 h VAL 56 N 0.74 1.39 -0.88 2.27 2.07 -1.12 -2.69 116.25 118.03 1ss8 h VAL 56 Ca 0.55 -1.42 0.19 0.00 0.82 0.00 0.00 66.70 66.84 1ss8 h VAL 56 Cb 0.89 2.11 -0.11 0.00 -1.52 0.00 0.00 31.29 32.66 1ss8 h VAL 56 CO -0.33 0.40 0.41 0.00 0.02 0.00 0.00 177.57 178.07 1ss8 h ALA 57 N 0.52 1.38 -0.08 1.67 0.00 -0.87 -1.47 119.26 120.39 1ss8 h ALA 57 Ca 0.01 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1ss8 h ALA 57 Cb 0.73 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1ss8 h ALA 57 CO 0.04 -0.24 -0.13 -0.09 0.00 0.00 0.00 179.25 178.82 1ss8 h ARG 58 N 0.49 0.13 0.00 0.00 2.43 -1.07 -0.79 114.38 115.57 1ss8 h ARG 58 Ca 0.52 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.67 1ss8 h ARG 58 Cb 0.90 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 1ss8 h ARG 58 CO -0.46 0.27 0.00 0.39 -1.51 0.00 0.00 179.97 178.66 1ss8 n GLU 59 N -4.32 0.24 -2.64 0.20 -0.58 -0.56 -4.89 120.64 108.10 1ss8 n GLU 59 Ca -0.01 0.24 -0.43 0.00 -0.42 0.00 0.00 57.16 56.53 1ss8 n GLU 59 Cb 0.24 -1.80 -0.02 0.00 -0.57 0.00 0.00 31.44 29.29 1ss8 n GLU 59 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1ss8 s ILE 60 N -3.13 4.65 -0.09 -3.67 -1.09 -0.30 -5.00 121.20 112.56 1ss8 s ILE 60 Ca 0.10 1.99 -0.06 0.00 -2.23 0.00 0.00 60.65 60.45 1ss8 s ILE 60 Cb 0.12 -4.28 0.04 0.00 -1.58 0.00 0.00 42.46 36.76 1ss8 s ILE 60 CO 0.56 -0.17 0.23 -0.70 -1.23 0.00 0.00 174.94 173.63 1ss8 s GLU 61 N 3.18 0.21 0.12 2.79 2.12 -1.26 -4.91 118.70 120.94 1ss8 s GLU 61 Ca 0.45 0.44 0.08 0.00 0.36 0.00 0.00 54.97 56.31 1ss8 s GLU 61 Cb -0.16 -0.05 -0.04 0.00 0.26 0.00 0.00 34.13 34.14 1ss8 s GLU 61 CO 0.07 -0.12 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.02 1ss8 s LEU 62 N 0.89 2.87 0.07 2.70 1.43 -1.26 -5.03 118.68 120.35 1ss8 s LEU 62 Ca -0.06 -0.49 -0.18 0.00 -1.03 0.00 0.00 54.13 52.37 1ss8 s LEU 62 Cb -0.08 -1.68 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 1ss8 s LEU 62 CO -0.05 0.17 1.43 -0.08 0.23 0.00 0.00 176.35 178.04 1ss8 h GLU 63 N 3.60 0.50 -6.42 1.70 4.81 -2.00 -3.42 114.58 113.35 1ss8 h GLU 63 Ca -0.49 -0.23 -0.54 0.00 -0.13 0.00 0.00 59.36 57.97 1ss8 h GLU 63 Cb 1.17 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.55 1ss8 h GLU 63 CO 0.49 0.78 0.88 0.34 -0.73 0.00 0.00 179.01 180.77 1ss8 s ASP 64 N -6.20 6.76 0.42 1.04 -1.08 -1.26 -4.91 116.67 111.45 1ss8 s ASP 64 Ca -0.13 2.26 0.16 0.00 -0.52 0.00 0.00 52.55 54.31 1ss8 s ASP 64 Cb 0.07 -2.56 0.92 0.00 -1.46 0.00 0.00 42.92 39.89 1ss8 s ASP 64 CO 0.77 -0.77 1.92 0.11 0.52 0.00 0.00 175.17 177.72 1ss8 h LYS 65 N 7.88 0.00 -0.16 4.34 1.79 -1.95 0.26 116.57 128.73 1ss8 h LYS 65 Ca -0.40 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 57.94 1ss8 h LYS 65 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1ss8 h LYS 65 CO 0.91 0.27 -0.43 0.74 -1.08 0.00 0.00 179.45 179.85 1ss8 h PHE 66 N 0.00 0.75 -0.61 -1.35 0.04 -1.93 -2.02 116.94 111.83 1ss8 h PHE 66 Ca -0.00 -0.29 -0.00 0.00 2.80 0.00 0.00 57.97 60.47 1ss8 h PHE 66 Cb 0.50 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.49 1ss8 h PHE 66 CO 0.00 1.05 0.36 0.93 -0.60 0.00 0.00 178.31 180.06 1ss8 h GLU 67 N 0.24 0.83 -0.55 1.51 5.08 -1.57 -0.60 114.58 119.51 1ss8 h GLU 67 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1ss8 h GLU 67 Cb 1.05 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.10 1ss8 h GLU 67 CO 0.09 0.60 0.35 -0.97 -1.00 0.00 0.00 179.01 178.09 1ss8 h ASN 68 N 0.82 0.64 -0.52 1.42 -0.73 -0.84 -1.62 115.58 114.75 1ss8 h ASN 68 Ca 0.22 -0.02 -0.12 0.00 1.87 0.00 0.00 56.30 58.25 1ss8 h ASN 68 Cb -0.01 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.40 1ss8 h ASN 68 CO -0.04 0.47 -0.13 0.24 -0.37 0.00 0.00 177.43 177.61 1ss8 h MET 69 N 0.75 1.02 -0.40 6.67 2.86 -0.37 -0.34 114.93 125.12 1ss8 h MET 69 Ca 0.20 -0.39 0.07 0.00 -2.06 0.00 0.00 59.70 57.53 1ss8 h MET 69 Cb -0.07 -0.06 -0.09 0.00 0.06 0.00 0.00 31.60 31.44 1ss8 h MET 69 CO -0.04 1.07 -0.39 0.78 1.06 0.00 0.00 176.91 179.39 1ss8 h GLY 70 N 0.93 -0.44 0.99 8.32 0.00 -0.56 -1.20 103.07 111.10 1ss8 h GLY 70 Ca 0.14 0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.97 1ss8 h GLY 70 CO 0.05 -0.19 0.16 0.00 0.00 0.00 0.00 176.54 176.56 1ss8 h ALA 71 N 0.55 0.32 -0.41 3.60 0.00 -1.10 -2.64 119.26 119.58 1ss8 h ALA 71 Ca 0.15 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1ss8 h ALA 71 Cb 0.57 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1ss8 h ALA 71 CO -0.56 -0.19 -0.06 1.96 0.00 0.00 0.00 179.25 180.40 1ss8 h GLN 72 N 0.33 0.70 0.22 0.00 1.08 -0.71 -0.19 115.11 116.54 1ss8 h GLN 72 Ca 0.09 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1ss8 h GLN 72 Cb -0.01 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1ss8 h GLN 72 CO -0.02 0.75 -0.20 0.52 -0.95 0.00 0.00 178.83 178.93 1ss8 h MET 73 N 0.64 -0.43 -0.77 1.46 2.86 -1.12 0.96 114.93 118.53 1ss8 h MET 73 Ca 0.12 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1ss8 h MET 73 Cb 0.49 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 1ss8 h MET 73 CO 0.03 -0.29 0.43 0.28 1.06 0.00 0.00 176.91 178.41 1ss8 h VAL 74 N -0.45 1.23 -0.38 -2.22 2.07 -1.30 -2.27 116.25 112.93 1ss8 h VAL 74 Ca -0.00 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1ss8 h VAL 74 Cb 0.41 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1ss8 h VAL 74 CO -0.04 0.25 0.23 0.11 0.02 0.00 0.00 177.57 178.15 1ss8 h LYS 75 N 1.06 0.46 -0.42 1.57 1.57 -0.88 -0.93 116.57 119.00 1ss8 h LYS 75 Ca 0.27 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 59.06 1ss8 h LYS 75 Cb 0.03 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1ss8 h LYS 75 CO -0.04 0.31 0.20 1.49 -0.57 0.00 0.00 179.45 180.83 1ss8 h GLU 76 N 0.48 0.39 -0.05 3.15 4.81 -0.50 -1.88 114.58 120.98 1ss8 h GLU 76 Ca 0.15 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 1ss8 h GLU 76 Cb -0.02 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.28 1ss8 h GLU 76 CO -0.05 0.26 -0.30 0.28 -0.73 0.00 0.00 179.01 178.47 1ss8 h VAL 77 N 0.40 1.45 -0.32 0.32 2.07 -1.08 -2.88 116.25 116.22 1ss8 h VAL 77 Ca 0.19 -1.77 0.09 0.00 0.82 0.00 0.00 66.70 66.03 1ss8 h VAL 77 Cb 0.11 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1ss8 h VAL 77 CO -0.14 0.50 0.25 0.00 0.02 0.00 0.00 177.57 178.19 1ss8 h ALA 78 N 0.38 2.22 0.00 1.67 0.00 -1.16 0.15 119.26 122.52 1ss8 h ALA 78 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 78 Cb 0.97 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1ss8 h ALA 78 CO 0.06 -0.41 0.00 -1.13 0.00 0.00 0.00 179.25 177.77 1ss8 n SER 79 N -4.29 0.00 0.06 0.00 3.41 -0.71 -1.74 113.62 110.36 1ss8 n SER 79 Ca 0.05 -0.41 -0.06 0.00 -0.26 0.00 0.00 58.87 58.19 1ss8 n SER 79 Cb 0.41 -0.16 -0.10 0.00 -0.26 0.00 0.00 64.21 64.10 1ss8 n SER 79 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ss8 h LYS 80 N 0.00 0.00 0.27 4.33 1.57 -0.74 -2.15 116.57 119.84 1ss8 h LYS 80 Ca 0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ss8 h LYS 80 Cb 0.13 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1ss8 h LYS 80 CO 0.00 0.89 -0.37 0.00 -0.57 0.00 0.00 179.45 179.40 1ss8 h ALA 81 N 1.07 -0.73 -0.96 3.86 0.00 -1.41 0.28 119.26 121.37 1ss8 h ALA 81 Ca -0.03 -0.10 0.16 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 81 Cb 1.74 0.56 -0.10 0.00 0.00 0.00 0.00 17.79 19.99 1ss8 h ALA 81 CO 0.12 -0.96 0.56 -0.91 0.00 0.00 0.00 179.25 178.06 1ss8 h ASN 82 N -0.69 0.73 -0.25 0.00 4.21 -1.61 0.24 115.58 118.21 1ss8 h ASN 82 Ca -0.01 0.09 0.01 0.00 1.21 0.00 0.00 56.30 57.60 1ss8 h ASN 82 Cb 0.66 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.80 1ss8 h ASN 82 CO -0.12 0.30 0.15 0.44 -1.29 0.00 0.00 177.43 176.90 1ss8 h ASP 83 N 0.76 0.24 -0.12 5.81 3.32 -0.82 0.17 116.42 125.79 1ss8 h ASP 83 Ca 0.53 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.44 1ss8 h ASP 83 Cb 0.75 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.25 1ss8 h ASP 83 CO -0.36 0.18 -0.47 0.00 -1.72 0.00 0.00 179.24 176.87 1ss8 h ALA 84 N 1.11 0.22 -0.00 3.45 0.00 0.11 -3.40 119.26 120.74 1ss8 h ALA 84 Ca 0.10 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ss8 h ALA 84 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ss8 h ALA 84 CO -0.04 0.38 -0.05 0.00 0.00 0.00 0.00 179.25 179.53 1ss8 n ALA 85 N -2.54 2.18 -0.26 0.00 0.00 0.69 -5.00 120.51 115.58 1ss8 n ALA 85 Ca -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1ss8 n ALA 85 Cb 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1ss8 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 86 N 0.95 0.64 3.72 0.00 0.00 0.58 -4.75 105.19 106.33 1ss8 n GLY 86 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.97 -0.07 0.00 1.61 -1.08 -1.25 -4.90 116.67 108.02 1ss8 s ASP 87 Ca 0.00 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 51.79 1ss8 s ASP 87 Cb 0.00 0.25 0.00 0.00 -1.46 0.00 0.00 42.92 41.71 1ss8 s ASP 87 CO 0.00 -0.47 0.00 0.61 0.52 0.00 0.00 175.17 175.83 1ss8 n GLY 88 N -0.56 0.35 0.18 2.66 0.00 -1.26 -3.15 105.19 103.41 1ss8 n GLY 88 Ca -0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.87 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 0.62 -0.69 2.61 2.02 -1.89 0.13 112.91 115.71 1ss8 h THR 89 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1ss8 h THR 89 Cb 0.00 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1ss8 h THR 89 CO 0.00 0.00 0.46 0.74 0.37 0.00 0.00 175.52 177.09 1ss8 h THR 90 N -0.17 1.13 -0.38 3.16 2.02 -1.92 -1.93 112.91 114.83 1ss8 h THR 90 Ca 0.09 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 66.88 1ss8 h THR 90 Cb 0.30 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1ss8 h THR 90 CO -0.23 0.16 -0.11 0.74 0.37 0.00 0.00 175.52 176.44 1ss8 h THR 91 N 0.87 1.28 -0.93 3.16 2.02 -1.61 -0.92 112.91 116.78 1ss8 h THR 91 Ca 0.27 -1.21 0.09 0.00 0.77 0.00 0.00 66.41 66.33 1ss8 h THR 91 Cb -0.00 1.27 -0.07 0.00 -1.74 0.00 0.00 68.15 67.62 1ss8 h THR 91 CO -0.07 0.40 0.60 0.00 0.37 0.00 0.00 175.52 176.82 1ss8 h ALA 92 N 0.82 1.57 -0.33 6.16 0.00 -0.58 0.70 119.26 127.61 1ss8 h ALA 92 Ca 0.09 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1ss8 h ALA 92 Cb 0.64 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ss8 h ALA 92 CO 0.04 0.24 -0.13 1.15 0.00 0.00 0.00 179.25 180.55 1ss8 h THR 93 N 0.96 1.29 -0.35 0.00 2.02 -0.46 -0.36 112.91 116.00 1ss8 h THR 93 Ca 0.43 -1.22 -0.00 0.00 0.77 0.00 0.00 66.41 66.38 1ss8 h THR 93 Cb 0.37 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1ss8 h THR 93 CO -0.19 0.40 0.21 0.58 0.37 0.00 0.00 175.52 176.89 1ss8 h VAL 94 N 0.45 1.12 0.15 3.16 2.07 -0.64 -1.19 116.25 121.37 1ss8 h VAL 94 Ca 0.08 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1ss8 h VAL 94 Cb 0.65 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1ss8 h VAL 94 CO 0.04 0.12 -0.23 -0.07 0.02 0.00 0.00 177.57 177.46 1ss8 h LEU 95 N 0.46 -0.62 -0.33 2.57 3.38 -0.63 -2.36 115.31 117.77 1ss8 h LEU 95 Ca 0.13 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.22 1ss8 h LEU 95 Cb 0.01 0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1ss8 h LEU 95 CO -0.02 -0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.19 1ss8 h ALA 96 N 0.32 0.30 -0.56 1.53 0.00 -0.99 0.24 119.26 120.09 1ss8 h ALA 96 Ca 0.02 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.14 1ss8 h ALA 96 Cb 0.44 0.16 -0.10 0.00 0.00 0.00 0.00 17.79 18.30 1ss8 h ALA 96 CO -0.10 -0.40 -0.05 0.37 0.00 0.00 0.00 179.25 179.07 1ss8 h GLN 97 N 0.10 0.07 -0.21 0.00 4.15 -1.02 0.33 115.11 118.53 1ss8 h GLN 97 Ca 0.16 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.53 1ss8 h GLN 97 Cb 0.22 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 1ss8 h GLN 97 CO -0.27 0.05 -0.06 0.00 -1.93 0.00 0.00 178.83 176.61 1ss8 h ALA 98 N 1.52 0.29 -0.22 3.38 0.00 -0.48 -0.00 119.26 123.74 1ss8 h ALA 98 Ca 0.28 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 98 Cb 0.44 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ss8 h ALA 98 CO -0.51 0.08 0.12 0.82 0.00 0.00 0.00 179.25 179.76 1ss8 h ILE 99 N 0.12 1.12 -0.60 0.00 2.04 -0.22 -2.64 117.51 117.34 1ss8 h ILE 99 Ca 0.05 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.59 1ss8 h ILE 99 Cb 0.52 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1ss8 h ILE 99 CO 0.02 0.12 0.39 0.40 0.00 0.00 0.00 178.15 179.08 1ss8 h ILE 100 N 0.24 1.13 -0.14 -0.67 2.04 -0.30 0.28 117.51 120.08 1ss8 h ILE 100 Ca 0.08 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 65.70 1ss8 h ILE 100 Cb 0.08 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 36.40 1ss8 h ILE 100 CO -0.01 0.14 -0.08 0.74 0.00 0.00 0.00 178.15 178.94 1ss8 h THR 101 N 0.79 0.74 0.09 -0.27 2.02 -0.89 -0.47 112.91 114.92 1ss8 h THR 101 Ca 0.23 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 67.15 1ss8 h THR 101 Cb -0.06 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1ss8 h THR 101 CO -0.07 0.00 -1.21 -0.33 0.37 0.00 0.00 175.52 174.28 1ss8 h GLU 102 N -0.08 0.19 -0.05 6.66 4.39 -1.22 -2.90 114.58 121.58 1ss8 h GLU 102 Ca 0.08 -0.33 0.04 0.00 0.34 0.00 0.00 59.36 59.49 1ss8 h GLU 102 Cb 0.20 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 1ss8 h GLU 102 CO -0.19 1.14 -0.30 0.78 -1.16 0.00 0.00 179.01 179.28 1ss8 h GLY 103 N 2.00 -0.44 1.68 -3.84 0.00 -0.33 -2.03 103.07 100.11 1ss8 h GLY 103 Ca -0.11 0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.56 1ss8 h GLY 103 CO 0.18 -0.22 0.13 1.41 0.00 0.00 0.00 176.54 178.03 1ss8 h LEU 104 N -0.42 0.38 -0.64 3.11 3.38 -1.14 0.11 115.31 120.10 1ss8 h LEU 104 Ca 0.08 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1ss8 h LEU 104 Cb 0.53 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1ss8 h LEU 104 CO -0.28 0.35 0.21 0.50 0.09 0.00 0.00 178.44 179.30 1ss8 h LYS 105 N 0.43 0.99 -0.02 1.13 3.64 -1.26 -0.78 116.57 120.70 1ss8 h LYS 105 Ca 0.11 -0.21 -0.12 0.00 -1.27 0.00 0.00 60.65 59.16 1ss8 h LYS 105 Cb 0.08 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1ss8 h LYS 105 CO -0.01 0.86 -0.54 0.00 -2.27 0.00 0.00 179.45 177.49 1ss8 h ALA 106 N 1.08 1.07 -0.06 5.00 0.00 -0.46 -2.46 119.26 123.43 1ss8 h ALA 106 Ca 0.21 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ss8 h ALA 106 Cb 0.28 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ss8 h ALA 106 CO -0.01 0.68 0.03 0.28 0.00 0.00 0.00 179.25 180.23 1ss8 h VAL 107 N 0.04 1.12 0.00 0.00 2.07 -0.25 -1.43 116.25 117.80 1ss8 h VAL 107 Ca -0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1ss8 h VAL 107 Cb 0.97 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1ss8 h VAL 107 CO 0.07 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.76 1ss8 h ALA 108 N 0.89 1.00 -0.15 1.67 0.00 -1.03 0.46 119.26 122.09 1ss8 h ALA 108 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ss8 h ALA 108 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ss8 h ALA 108 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1ss8 n ALA 109 N -1.92 2.50 -0.24 0.00 0.00 -0.63 -4.91 120.51 115.31 1ss8 n ALA 109 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1ss8 n ALA 109 Cb 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1ss8 n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 110 N 1.27 0.78 3.82 0.00 0.00 0.16 -5.05 105.19 106.17 1ss8 n GLY 110 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.76 3.71 -0.30 1.61 -1.94 -0.69 -4.97 119.30 115.97 1ss8 s MET 111 Ca 0.00 1.11 -0.29 0.00 -1.71 0.00 0.00 55.69 54.80 1ss8 s MET 111 Cb 0.00 -2.09 -0.01 0.00 2.01 0.00 0.00 34.83 34.74 1ss8 s MET 111 CO 0.00 -0.48 1.51 1.21 -0.01 0.00 0.00 175.02 177.24 1ss8 s ASN 112 N -2.76 6.39 0.42 3.03 3.84 -1.26 -4.56 114.94 120.04 1ss8 s ASN 112 Ca 0.62 1.29 0.12 0.00 0.21 0.00 0.00 52.86 55.09 1ss8 s ASN 112 Cb -0.13 -2.54 0.96 0.00 -0.55 0.00 0.00 41.25 39.00 1ss8 s ASN 112 CO 0.31 -1.30 1.99 -0.65 -2.79 0.00 0.00 177.10 174.65 1ss8 h PRO 113 N 10.59 0.47 -0.44 0.43 0.11 -1.93 -0.79 132.00 140.44 1ss8 h PRO 113 Ca -0.30 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 1ss8 h PRO 113 Cb 1.13 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1ss8 h PRO 113 CO 1.03 0.31 0.16 0.52 -0.21 0.00 0.00 178.00 179.82 1ss8 h MET 114 N 0.48 0.66 -0.45 1.05 2.86 -1.91 -1.54 114.93 116.08 1ss8 h MET 114 Ca 0.26 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.70 1ss8 h MET 114 Cb 0.40 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1ss8 h MET 114 CO -0.08 0.62 0.00 -0.44 1.06 0.00 0.00 176.91 178.08 1ss8 h ASP 115 N 0.56 0.78 -0.66 1.22 3.32 -1.55 -1.59 116.42 118.51 1ss8 h ASP 115 Ca 0.14 -0.31 0.08 0.00 0.02 0.00 0.00 57.03 56.97 1ss8 h ASP 115 Cb 0.21 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.49 1ss8 h ASP 115 CO -0.01 0.90 0.32 -0.07 -1.72 0.00 0.00 179.24 178.66 1ss8 h LEU 116 N 0.64 0.43 -0.28 1.55 4.07 -1.15 -1.43 115.31 119.15 1ss8 h LEU 116 Ca 0.13 0.05 -0.06 0.00 0.08 0.00 0.00 57.88 58.09 1ss8 h LEU 116 Cb 0.49 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 1ss8 h LEU 116 CO 0.02 0.26 -0.04 0.50 -1.08 0.00 0.00 178.44 178.10 1ss8 h LYS 117 N 0.57 0.52 -0.85 1.13 3.64 -0.78 -1.28 116.57 119.52 1ss8 h LYS 117 Ca 0.31 -0.19 0.09 0.00 -1.27 0.00 0.00 60.65 59.60 1ss8 h LYS 117 Cb 0.30 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.01 1ss8 h LYS 117 CO -0.24 0.71 0.51 -0.09 -2.27 0.00 0.00 179.45 178.06 1ss8 h ARG 118 N 0.28 0.84 0.20 1.90 2.43 -0.96 0.25 114.38 119.33 1ss8 h ARG 118 Ca 0.07 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1ss8 h ARG 118 Cb 0.50 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1ss8 h ARG 118 CO 0.02 0.55 -0.10 0.78 -1.51 0.00 0.00 179.97 179.72 1ss8 h GLY 119 N 0.86 -0.29 0.23 2.80 0.00 -1.00 -0.48 103.07 105.19 1ss8 h GLY 119 Ca 0.40 0.11 0.13 0.00 0.00 0.00 0.00 47.33 47.97 1ss8 h GLY 119 CO -0.23 -0.10 0.34 -2.22 0.00 0.00 0.00 176.54 174.33 1ss8 h ILE 120 N -0.31 0.71 -0.57 2.60 2.04 -0.83 -0.81 117.51 120.35 1ss8 h ILE 120 Ca -0.03 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.59 1ss8 h ILE 120 Cb 0.24 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 1ss8 h ILE 120 CO 0.05 0.09 0.09 0.44 0.00 0.00 0.00 178.15 178.82 1ss8 h ASP 121 N 0.52 0.86 -0.15 1.72 3.32 -0.22 -1.93 116.42 120.53 1ss8 h ASP 121 Ca 0.41 -0.19 -0.13 0.00 0.02 0.00 0.00 57.03 57.15 1ss8 h ASP 121 Cb 0.58 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1ss8 h ASP 121 CO -0.37 0.87 -0.41 0.50 -1.72 0.00 0.00 179.24 178.11 1ss8 h LYS 122 N 0.86 0.55 -0.98 3.56 3.64 -0.51 -1.19 116.57 122.50 1ss8 h LYS 122 Ca 0.18 -0.39 0.11 0.00 -1.27 0.00 0.00 60.65 59.28 1ss8 h LYS 122 Cb 0.39 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.19 1ss8 h LYS 122 CO 0.01 1.00 0.62 0.00 -2.27 0.00 0.00 179.45 178.81 1ss8 h ALA 123 N 0.54 1.54 -0.20 5.00 0.00 -1.10 -1.36 119.26 123.69 1ss8 h ALA 123 Ca -0.01 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1ss8 h ALA 123 Cb 1.03 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ss8 h ALA 123 CO 0.09 0.24 -0.24 0.28 0.00 0.00 0.00 179.25 179.62 1ss8 h VAL 124 N 0.99 1.33 -0.66 0.00 2.07 -1.11 0.23 116.25 119.10 1ss8 h VAL 124 Ca 0.47 -1.42 0.12 0.00 0.82 0.00 0.00 66.70 66.68 1ss8 h VAL 124 Cb 0.43 1.79 -0.08 0.00 -1.52 0.00 0.00 31.29 31.90 1ss8 h VAL 124 CO -0.23 0.43 0.22 0.74 0.02 0.00 0.00 177.57 178.75 1ss8 h THR 125 N 0.19 0.69 0.03 2.57 2.02 -0.85 0.21 112.91 117.77 1ss8 h THR 125 Ca 0.03 -0.13 -0.25 0.00 0.77 0.00 0.00 66.41 66.84 1ss8 h THR 125 Cb 0.80 0.29 0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1ss8 h THR 125 CO 0.06 0.07 -0.98 0.58 0.37 0.00 0.00 175.52 175.62 1ss8 h VAL 126 N 0.37 1.32 -0.75 3.16 2.07 -1.11 -2.62 116.25 118.69 1ss8 h VAL 126 Ca 0.35 -2.26 0.05 0.00 0.82 0.00 0.00 66.70 65.66 1ss8 h VAL 126 Cb 0.49 2.52 -0.05 0.00 -1.52 0.00 0.00 31.29 32.73 1ss8 h VAL 126 CO -0.37 0.69 0.46 0.00 0.02 0.00 0.00 177.57 178.36 1ss8 h ALA 127 N 0.35 1.01 -0.50 1.67 0.00 -0.09 -1.29 119.26 120.40 1ss8 h ALA 127 Ca -0.13 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ss8 h ALA 127 Cb 1.65 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 1ss8 h ALA 127 CO 0.19 0.21 0.27 0.28 0.00 0.00 0.00 179.25 180.19 1ss8 h VAL 128 N 0.87 0.98 -0.75 0.00 2.07 -0.48 0.31 116.25 119.25 1ss8 h VAL 128 Ca 0.32 -0.18 0.12 0.00 0.82 0.00 0.00 66.70 67.78 1ss8 h VAL 128 Cb 0.11 0.42 -0.08 0.00 -1.52 0.00 0.00 31.29 30.21 1ss8 h VAL 128 CO -0.15 0.10 0.34 -0.33 0.02 0.00 0.00 177.57 177.55 1ss8 h GLU 129 N 0.52 0.51 -0.62 1.57 5.08 -1.05 -1.29 114.58 119.31 1ss8 h GLU 129 Ca 0.21 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1ss8 h GLU 129 Cb 0.10 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1ss8 h GLU 129 CO -0.14 0.34 0.03 0.93 -1.00 0.00 0.00 179.01 179.17 1ss8 h GLU 130 N 0.53 1.06 -0.82 2.33 4.39 0.05 -1.67 114.58 120.46 1ss8 h GLU 130 Ca 0.39 -0.32 0.13 0.00 0.34 0.00 0.00 59.36 59.90 1ss8 h GLU 130 Cb 0.52 -0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 28.98 1ss8 h GLU 130 CO -0.34 1.02 0.42 -0.07 -1.16 0.00 0.00 179.01 178.87 1ss8 h LEU 131 N 0.98 0.52 -0.98 1.33 3.38 0.46 0.19 115.31 121.19 1ss8 h LEU 131 Ca 0.18 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 1ss8 h LEU 131 Cb 0.52 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1ss8 h LEU 131 CO 0.03 0.24 0.24 0.50 0.09 0.00 0.00 178.44 179.54 1ss8 h LYS 132 N 0.63 0.98 0.01 1.13 3.64 -0.47 -2.09 116.57 120.41 1ss8 h LYS 132 Ca 0.43 -0.17 -0.20 0.00 -1.27 0.00 0.00 60.65 59.44 1ss8 h LYS 132 Cb 0.56 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1ss8 h LYS 132 CO -0.33 0.81 -0.91 0.00 -2.27 0.00 0.00 179.45 176.75 1ss8 h ALA 133 N 1.31 0.49 0.00 5.00 0.00 -0.70 -3.15 119.26 122.21 1ss8 h ALA 133 Ca 0.22 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1ss8 h ALA 133 Cb 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ss8 h ALA 133 CO -0.02 0.99 0.00 1.25 0.00 0.00 0.00 179.25 181.47 1ss8 h LEU 134 N 0.07 0.00 -9.88 0.00 5.85 -0.32 -3.46 115.31 107.57 1ss8 h LEU 134 Ca -0.04 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.16 1ss8 h LEU 134 Cb 1.56 0.00 0.07 0.00 0.37 0.00 0.00 40.66 42.66 1ss8 h LEU 134 CO 0.13 0.00 0.65 -0.55 -0.34 0.00 0.00 178.44 178.33 1ss8 s SER 135 N -4.93 6.76 -0.15 1.25 0.15 -0.91 -4.88 113.70 110.99 1ss8 s SER 135 Ca 0.06 2.70 -0.06 0.00 0.70 0.00 0.00 55.95 59.34 1ss8 s SER 135 Cb 0.09 -2.65 -0.04 0.00 -1.71 0.00 0.00 66.02 61.72 1ss8 s SER 135 CO 0.52 -0.55 0.06 -0.69 1.20 0.00 0.00 173.24 173.78 1ss8 s VAL 136 N -1.09 4.78 0.73 4.45 1.01 -0.78 -4.90 120.40 124.61 1ss8 s VAL 136 Ca 0.49 -0.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.29 1ss8 s VAL 136 Cb -0.40 -3.11 0.04 0.00 0.00 0.00 0.00 36.38 32.91 1ss8 s VAL 136 CO 0.53 0.52 1.15 -2.16 0.00 0.00 0.00 175.10 175.14 1ss8 s PRO 137 N -0.18 2.30 -0.47 2.72 0.04 -1.26 -2.12 135.00 136.02 1ss8 s PRO 137 Ca 0.07 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.66 1ss8 s PRO 137 Cb -0.12 -1.88 0.15 0.00 0.04 0.00 0.00 34.50 32.69 1ss8 s PRO 137 CO 0.01 -1.66 0.31 0.00 0.04 0.00 0.00 177.00 175.70 1ss8 n SER 139 N 3.10 0.22 -4.65 0.00 3.41 -1.26 -4.23 113.62 110.22 1ss8 n SER 139 Ca 0.17 -1.02 -0.26 0.00 -0.26 0.00 0.00 58.87 57.50 1ss8 n SER 139 Cb 0.38 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.24 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 -0.02 4.09 0.23 4.04 -4.77 -1.26 -5.02 116.67 113.97 1ss8 s ASP 140 Ca 0.00 -1.16 -0.06 0.00 -3.30 0.00 0.00 52.55 48.03 1ss8 s ASP 140 Cb 0.00 -0.45 0.33 0.00 -1.09 0.00 0.00 42.92 41.71 1ss8 s ASP 140 CO 0.00 -0.38 1.82 0.28 0.70 0.00 0.00 175.17 177.59 1ss8 h SER 141 N 1.72 0.67 0.04 2.11 0.02 -1.97 -2.04 113.55 114.11 1ss8 h SER 141 Ca -0.43 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.57 1ss8 h SER 141 Cb 1.25 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.67 1ss8 h SER 141 CO 0.73 0.41 -0.12 0.11 -1.14 0.00 0.00 176.83 176.82 1ss8 h LYS 142 N 0.80 -0.21 -0.31 3.45 6.56 -1.99 -1.29 116.57 123.58 1ss8 h LYS 142 Ca 0.36 0.01 -0.06 0.00 -1.06 0.00 0.00 60.65 59.90 1ss8 h LYS 142 Cb 0.26 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.95 1ss8 h LYS 142 CO -0.21 -0.14 -0.07 0.00 -2.06 0.00 0.00 179.45 176.97 1ss8 h ALA 143 N 0.71 1.31 -0.15 3.86 0.00 -1.90 -1.23 119.26 121.86 1ss8 h ALA 143 Ca 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ss8 h ALA 143 Cb 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ss8 h ALA 143 CO -0.09 0.46 0.03 0.82 0.00 0.00 0.00 179.25 180.48 1ss8 h ILE 144 N 0.47 1.20 -0.52 0.00 2.04 -0.97 -1.55 117.51 118.18 1ss8 h ILE 144 Ca 0.09 -0.64 0.08 0.00 1.00 0.00 0.00 64.86 65.40 1ss8 h ILE 144 Cb 0.41 1.35 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 1ss8 h ILE 144 CO 0.02 0.19 0.16 0.00 0.00 0.00 0.00 178.15 178.52 1ss8 h ALA 145 N 0.83 0.63 -0.08 1.87 0.00 -1.07 0.09 119.26 121.53 1ss8 h ALA 145 Ca 0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 145 Cb 0.26 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ss8 h ALA 145 CO 0.00 -0.24 0.04 1.96 0.00 0.00 0.00 179.25 181.01 1ss8 h GLN 146 N 0.33 0.09 -0.54 0.00 4.20 -0.85 0.12 115.11 118.46 1ss8 h GLN 146 Ca 0.26 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.88 1ss8 h GLN 146 Cb 0.31 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1ss8 h GLN 146 CO -0.28 0.06 0.01 0.28 -0.67 0.00 0.00 178.83 178.23 1ss8 h VAL 147 N 0.10 1.26 -0.52 -0.54 2.07 -1.11 0.17 116.25 117.67 1ss8 h VAL 147 Ca 0.03 -1.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1ss8 h VAL 147 Cb -0.00 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1ss8 h VAL 147 CO -0.02 0.39 0.31 1.23 0.02 0.00 0.00 177.57 179.50 1ss8 h GLY 148 N 0.83 0.76 2.00 2.17 0.00 -0.65 -1.35 103.07 106.84 1ss8 h GLY 148 Ca 0.16 -0.32 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 1ss8 h GLY 148 CO 0.03 0.31 -0.62 -0.91 0.00 0.00 0.00 176.54 175.35 1ss8 h THR 149 N 0.70 1.32 -0.08 4.70 1.35 -0.37 -0.82 112.91 119.71 1ss8 h THR 149 Ca 0.19 -2.22 -0.00 0.00 -0.55 0.00 0.00 66.41 63.83 1ss8 h THR 149 Cb -0.00 2.24 -0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1ss8 h THR 149 CO -0.03 0.61 0.03 0.40 -0.25 0.00 0.00 175.52 176.27 1ss8 h ILE 150 N 0.00 1.15 0.00 6.82 2.04 -0.67 0.04 117.51 126.88 1ss8 h ILE 150 Ca -0.01 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1ss8 h ILE 150 Cb 1.19 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1ss8 h ILE 150 CO 0.08 0.12 0.00 -1.20 0.00 0.00 0.00 178.15 177.16 1ss8 n SER 151 N -4.94 0.33 -2.10 1.72 7.64 -0.53 -2.15 113.62 113.58 1ss8 n SER 151 Ca -0.06 0.58 -0.23 0.00 1.01 0.00 0.00 58.87 60.17 1ss8 n SER 151 Cb 0.11 -0.65 0.17 0.00 -1.01 0.00 0.00 64.21 62.83 1ss8 n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ss8 n ALA 152 N -1.63 5.52 -3.27 -0.43 0.00 -0.33 -4.41 120.51 115.96 1ss8 n ALA 152 Ca 0.03 -3.00 -0.16 0.00 0.00 0.00 0.00 53.44 50.31 1ss8 n ALA 152 Cb 0.22 -1.38 0.07 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.12 -3.21 -1.39 0.00 2.85 -0.92 -3.02 115.26 108.46 1ss8 n ASN 153 Ca 0.57 -0.50 -0.15 0.00 -0.11 0.00 0.00 54.58 54.39 1ss8 n ASN 153 Cb 1.48 -4.35 -0.05 0.00 1.24 0.00 0.00 39.78 38.11 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 -2.62 -4.79 -4.40 1.20 7.64 -0.03 -4.98 113.62 105.64 1ss8 n SER 154 Ca -0.16 0.25 -0.45 0.00 1.01 0.00 0.00 58.87 59.52 1ss8 n SER 154 Cb 0.61 -3.74 -0.03 0.00 -1.01 0.00 0.00 64.21 60.04 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 -2.65 6.44 0.65 6.43 -1.08 -1.17 -4.90 116.67 120.39 1ss8 s ASP 155 Ca 0.00 -1.80 0.37 0.00 -0.52 0.00 0.00 52.55 50.59 1ss8 s ASP 155 Cb 0.00 -2.34 2.02 0.00 -1.46 0.00 0.00 42.92 41.14 1ss8 s ASP 155 CO 0.00 -1.05 2.18 1.05 0.52 0.00 0.00 175.17 177.87 1ss8 h GLU 156 N 8.88 0.00 -0.13 4.34 4.11 -1.92 -1.44 114.58 128.41 1ss8 h GLU 156 Ca -0.07 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.35 1ss8 h GLU 156 Cb 1.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1ss8 h GLU 156 CO 1.06 0.00 0.02 1.15 0.07 0.00 0.00 179.01 181.31 1ss8 h THR 157 N 0.00 1.22 -0.65 -1.06 2.02 -1.98 -2.25 112.91 110.21 1ss8 h THR 157 Ca 0.02 -0.69 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 1ss8 h THR 157 Cb 0.30 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 1ss8 h THR 157 CO -0.00 0.20 0.15 0.58 0.37 0.00 0.00 175.52 176.83 1ss8 h VAL 158 N -0.01 1.26 -0.05 3.16 2.07 -1.62 0.15 116.25 121.21 1ss8 h VAL 158 Ca 0.04 -0.95 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1ss8 h VAL 158 Cb 0.30 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1ss8 h VAL 158 CO 0.00 0.36 -0.06 1.23 0.02 0.00 0.00 177.57 179.13 1ss8 h GLY 159 N 0.97 -0.01 -0.30 2.17 0.00 -1.50 -1.44 103.07 102.96 1ss8 h GLY 159 Ca 0.20 0.07 0.13 0.00 0.00 0.00 0.00 47.33 47.73 1ss8 h GLY 159 CO 0.00 -0.07 -0.16 0.50 0.00 0.00 0.00 176.54 176.82 1ss8 h LYS 160 N -0.07 0.00 -0.21 4.80 1.57 -1.03 -1.30 116.57 120.33 1ss8 h LYS 160 Ca 0.04 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1ss8 h LYS 160 Cb 0.13 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1ss8 h LYS 160 CO -0.10 0.00 0.11 -0.07 -0.57 0.00 0.00 179.45 178.83 1ss8 h LEU 161 N 0.00 0.26 -0.11 2.94 3.38 0.02 -1.21 115.31 120.59 1ss8 h LEU 161 Ca 0.31 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.22 1ss8 h LEU 161 Cb 0.48 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1ss8 h LEU 161 CO -0.67 0.27 -0.04 0.40 0.09 0.00 0.00 178.44 178.49 1ss8 h ILE 162 N 0.23 0.85 -0.64 1.22 1.08 -1.00 -0.63 117.51 118.61 1ss8 h ILE 162 Ca 0.07 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.57 1ss8 h ILE 162 Cb 0.07 0.85 -0.04 0.00 -3.07 0.00 0.00 36.82 34.63 1ss8 h ILE 162 CO -0.01 0.00 0.40 0.00 -0.69 0.00 0.00 178.15 177.85 1ss8 h ALA 163 N 1.07 0.83 -0.05 1.87 0.00 -1.01 0.79 119.26 122.76 1ss8 h ALA 163 Ca 0.06 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1ss8 h ALA 163 Cb 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1ss8 h ALA 163 CO -0.13 0.15 -0.09 0.93 0.00 0.00 0.00 179.25 180.11 1ss8 h GLU 164 N 0.78 -0.13 -0.51 0.00 5.08 -0.97 0.22 114.58 119.05 1ss8 h GLU 164 Ca 0.25 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.70 1ss8 h GLU 164 Cb 0.01 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.22 1ss8 h GLU 164 CO -0.10 -0.09 0.14 0.00 -1.00 0.00 0.00 179.01 177.96 1ss8 h ALA 165 N 0.88 0.60 0.00 3.43 0.00 -0.49 -0.69 119.26 123.00 1ss8 h ALA 165 Ca 0.05 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1ss8 h ALA 165 Cb 0.21 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ss8 h ALA 165 CO -0.13 -0.27 -0.38 0.52 0.00 0.00 0.00 179.25 178.99 1ss8 h MET 166 N 0.29 0.00 -0.11 0.00 2.86 -0.38 -1.62 114.93 115.98 1ss8 h MET 166 Ca 0.25 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.67 1ss8 h MET 166 Cb 0.32 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.99 1ss8 h MET 166 CO -0.30 0.38 -0.82 0.22 1.06 0.00 0.00 176.91 177.45 1ss8 h ASP 167 N 0.00 0.83 0.91 1.22 3.58 -0.14 0.16 116.42 122.97 1ss8 h ASP 167 Ca -0.00 -0.57 -0.03 0.00 0.42 0.00 0.00 57.03 56.84 1ss8 h ASP 167 Cb 0.80 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.59 1ss8 h ASP 167 CO 0.05 1.36 -0.16 0.50 -2.88 0.00 0.00 179.24 178.10 1ss8 h LYS 168 N 0.45 0.00 0.00 0.28 1.63 -0.24 -3.37 116.57 115.32 1ss8 h LYS 168 Ca -0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1ss8 h LYS 168 Cb 1.44 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.07 1ss8 h LYS 168 CO 0.16 0.16 0.00 1.55 -3.45 0.00 0.00 179.45 177.87 1ss8 n VAL 169 N -3.34 0.00 0.00 2.00 3.14 -0.71 -5.08 118.33 114.35 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 0.38 0.96 0.00 0.00 -1.06 0.00 0.00 33.84 34.13 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 -0.64 0.29 7.55 0.00 0.55 -3.68 105.19 109.26 1ss8 n GLY 170 Ca 0.00 -1.56 -0.01 0.00 0.00 0.00 0.00 46.02 44.45 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 0.70 -0.00 1.61 1.57 -1.95 -2.45 116.57 116.05 1ss8 h LYS 171 Ca 0.00 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1ss8 h LYS 171 Cb 0.00 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1ss8 h LYS 171 CO 0.00 0.65 -0.33 0.39 -0.57 0.00 0.00 179.45 179.60 1ss8 n GLU 172 N -4.29 0.47 -1.17 3.15 -0.58 -1.26 -4.96 120.64 112.00 1ss8 n GLU 172 Ca 0.03 -0.26 -0.29 0.00 -0.42 0.00 0.00 57.16 56.22 1ss8 n GLU 172 Cb 0.22 -1.49 0.21 0.00 -0.57 0.00 0.00 31.44 29.80 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 -2.71 1.58 -0.22 0.62 0.00 -0.92 -5.00 107.32 100.66 1ss8 s GLY 173 Ca 0.19 -0.70 -0.13 0.00 0.00 0.00 0.00 44.72 44.08 1ss8 s GLY 173 CO 0.59 0.05 0.28 0.54 0.00 0.00 0.00 173.10 174.55 1ss8 s VAL 174 N -3.04 5.29 -0.07 1.40 0.11 -1.26 -4.98 120.40 117.84 1ss8 s VAL 174 Ca 0.68 0.44 0.02 0.00 -2.93 0.00 0.00 61.98 60.19 1ss8 s VAL 174 Cb -0.13 -3.61 0.01 0.00 -1.53 0.00 0.00 36.38 31.12 1ss8 s VAL 174 CO 0.56 0.31 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.89 1ss8 s ILE 175 N 1.11 1.14 0.35 7.04 1.01 -1.26 -0.94 121.20 129.66 1ss8 s ILE 175 Ca 0.13 -0.47 0.09 0.00 0.00 0.00 0.00 60.65 60.41 1ss8 s ILE 175 Cb -0.14 -1.06 -0.06 0.00 0.01 0.00 0.00 42.46 41.21 1ss8 s ILE 175 CO 0.06 0.36 -0.04 0.42 0.00 0.00 0.00 174.94 175.74 1ss8 s THR 176 N 0.82 2.32 -0.06 2.92 -4.23 0.08 -4.96 115.64 112.53 1ss8 s THR 176 Ca -0.12 -2.09 0.05 0.00 -1.18 0.00 0.00 61.69 58.35 1ss8 s THR 176 Cb -0.15 -2.75 -0.00 0.00 1.34 0.00 0.00 72.50 70.93 1ss8 s THR 176 CO 0.02 -0.17 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.04 1ss8 s VAL 177 N -2.60 1.72 0.29 2.29 1.01 -1.26 -0.78 120.40 121.08 1ss8 s VAL 177 Ca 0.34 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1ss8 s VAL 177 Cb 0.03 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 1ss8 s VAL 177 CO 0.18 0.49 0.13 -1.61 0.00 0.00 0.00 175.10 174.28 1ss8 s GLU 178 N 0.07 1.54 0.52 2.72 2.02 -0.26 -4.96 118.70 120.35 1ss8 s GLU 178 Ca -0.07 -1.87 -0.22 0.00 0.02 0.00 0.00 54.97 52.84 1ss8 s GLU 178 Cb -0.14 -0.23 -0.06 0.00 0.10 0.00 0.00 34.13 33.81 1ss8 s GLU 178 CO 0.04 -0.38 1.25 -0.51 0.02 0.00 0.00 175.26 175.68 1ss8 s ASP 179 N -3.37 5.62 0.90 -0.19 1.01 -1.26 -2.35 116.67 117.03 1ss8 s ASP 179 Ca 0.36 2.50 -0.13 0.00 0.71 0.00 0.00 52.55 55.98 1ss8 s ASP 179 Cb 0.06 -2.61 0.17 0.00 1.01 0.00 0.00 42.92 41.55 1ss8 s ASP 179 CO 0.16 -1.31 1.25 -0.83 0.21 0.00 0.00 175.17 174.65 1ss8 s GLY 180 N -1.26 1.75 0.00 0.21 0.00 -0.28 -4.41 107.32 103.34 1ss8 s GLY 180 Ca 0.70 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 44.27 1ss8 s GLY 180 CO 0.39 -0.50 0.18 -1.30 0.00 0.00 0.00 173.10 171.87 1ss8 n THR 181 N -3.55 0.00 -0.30 0.90 -2.24 -1.26 -4.95 114.28 102.87 1ss8 n THR 181 Ca 0.14 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 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 1.08 3.21 0.18 3.38 0.00 -1.26 -5.02 105.19 106.76 1ss8 n GLY 182 Ca 0.01 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 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 0.90 -9.88 0.99 5.85 -1.92 -2.99 115.31 108.26 1ss8 h LEU 183 Ca 0.00 -0.79 -0.50 0.00 0.84 0.00 0.00 57.88 57.43 1ss8 h LEU 183 Cb 0.00 -0.28 0.03 0.00 0.37 0.00 0.00 40.66 40.78 1ss8 h LEU 183 CO 0.00 1.59 0.47 -1.10 -0.34 0.00 0.00 178.44 179.07 1ss8 s GLN 184 N -3.10 4.38 0.44 1.25 -1.52 -1.26 -2.70 119.66 117.15 1ss8 s GLN 184 Ca -0.10 1.76 -0.22 0.00 -1.95 0.00 0.00 55.36 54.85 1ss8 s GLN 184 Cb 0.06 -2.91 -0.09 0.00 -0.22 0.00 0.00 33.01 29.85 1ss8 s GLN 184 CO 0.93 -0.01 1.03 -0.51 -0.25 0.00 0.00 175.29 176.48 1ss8 s ASP 185 N -1.09 6.61 0.11 5.90 1.01 -1.26 -3.59 116.67 124.35 1ss8 s ASP 185 Ca 0.51 1.93 0.06 0.00 0.71 0.00 0.00 52.55 55.75 1ss8 s ASP 185 Cb -0.29 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.03 1ss8 s ASP 185 CO 0.38 -0.60 -0.14 -1.61 0.21 0.00 0.00 175.17 173.41 1ss8 s GLU 186 N -2.92 0.97 -0.06 8.23 2.02 0.17 -4.93 118.70 122.17 1ss8 s GLU 186 Ca 0.63 -1.15 -0.02 0.00 0.02 0.00 0.00 54.97 54.44 1ss8 s GLU 186 Cb -0.17 -0.91 0.03 0.00 0.10 0.00 0.00 34.13 33.18 1ss8 s GLU 186 CO 0.22 0.18 0.05 -1.17 0.02 0.00 0.00 175.26 174.56 1ss8 s LEU 187 N -2.21 0.26 0.08 1.80 2.96 -1.26 0.06 118.68 120.37 1ss8 s LEU 187 Ca 0.06 -0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 53.92 1ss8 s LEU 187 Cb -0.07 -0.21 -0.04 0.00 0.50 0.00 0.00 46.19 46.37 1ss8 s LEU 187 CO 0.03 -0.25 0.00 1.51 -1.32 0.00 0.00 176.35 176.32 1ss8 s ASP 188 N 2.13 0.42 -0.11 3.68 -4.77 -0.99 -4.98 116.67 112.05 1ss8 s ASP 188 Ca 0.05 -1.06 -0.03 0.00 -3.30 0.00 0.00 52.55 48.20 1ss8 s ASP 188 Cb -0.13 0.23 -0.03 0.00 -1.09 0.00 0.00 42.92 41.91 1ss8 s ASP 188 CO -0.04 -0.65 0.01 -0.69 0.70 0.00 0.00 175.17 174.50 1ss8 s VAL 189 N -3.96 4.36 0.06 2.11 1.01 -1.26 -0.01 120.40 122.70 1ss8 s VAL 189 Ca 0.13 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1ss8 s VAL 189 Cb 0.08 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 1ss8 s VAL 189 CO -0.06 0.57 -0.05 0.54 0.00 0.00 0.00 175.10 176.10 1ss8 s VAL 190 N -0.56 0.44 0.20 2.92 0.11 -0.60 -4.96 120.40 117.95 1ss8 s VAL 190 Ca 0.10 -1.52 -0.31 0.00 -2.93 0.00 0.00 61.98 57.32 1ss8 s VAL 190 Cb -0.12 -1.13 -0.10 0.00 -1.53 0.00 0.00 36.38 33.50 1ss8 s VAL 190 CO 0.02 -0.72 1.52 -1.61 -3.33 0.00 0.00 175.10 170.99 1ss8 s GLU 191 N -2.88 4.23 0.00 1.54 0.41 -1.26 -2.05 118.70 118.68 1ss8 s GLU 191 Ca 0.00 2.35 0.00 0.00 -0.41 0.00 0.00 54.97 56.92 1ss8 s GLU 191 Cb -0.01 -3.13 0.00 0.00 -1.78 0.00 0.00 34.13 29.22 1ss8 s GLU 191 CO -0.04 -0.54 0.00 0.41 -0.49 0.00 0.00 175.26 174.60 1ss8 n GLY 192 N 3.07 -1.33 3.60 -1.39 0.00 -1.26 -0.87 105.19 107.00 1ss8 n GLY 192 Ca 0.11 -0.96 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 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 -1.10 0.52 -0.04 1.61 1.75 -0.57 -4.08 119.30 117.38 1ss8 s MET 193 Ca 0.00 0.25 0.03 0.00 -1.25 0.00 0.00 55.69 54.72 1ss8 s MET 193 Cb 0.00 0.25 0.00 0.00 2.84 0.00 0.00 34.83 37.92 1ss8 s MET 193 CO 0.00 -0.14 -0.14 -1.14 -0.65 0.00 0.00 175.02 172.95 1ss8 s GLN 194 N -0.71 1.59 0.12 4.11 0.74 -1.26 -0.83 119.66 123.42 1ss8 s GLN 194 Ca 0.01 -0.50 0.03 0.00 0.05 0.00 0.00 55.36 54.95 1ss8 s GLN 194 Cb -0.02 -1.38 -0.04 0.00 1.10 0.00 0.00 33.01 32.67 1ss8 s GLN 194 CO -0.02 0.17 -0.09 -0.59 -0.55 0.00 0.00 175.29 174.21 1ss8 s PHE 195 N 0.21 1.11 -1.25 1.67 -0.71 -0.63 -5.01 117.98 113.36 1ss8 s PHE 195 Ca -0.06 -0.81 -0.06 0.00 -1.04 0.00 0.00 56.93 54.97 1ss8 s PHE 195 Cb -0.12 -0.59 0.17 0.00 -1.21 0.00 0.00 43.02 41.27 1ss8 s PHE 195 CO 0.02 -0.01 2.13 -0.25 -1.34 0.00 0.00 175.22 175.77 1ss8 n ASP 196 N -0.07 7.17 -3.87 1.98 8.00 -1.26 -1.60 116.55 126.90 1ss8 n ASP 196 Ca -0.11 -3.23 -0.17 0.00 0.71 0.00 0.00 54.79 51.98 1ss8 n ASP 196 Cb 0.60 -1.35 -0.16 0.00 -0.02 0.00 0.00 41.12 40.19 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 -1.39 0.41 0.67 -1.24 1.81 -1.23 -4.77 118.95 113.21 1ss8 s ARG 197 Ca 0.47 -0.03 0.05 0.00 -1.72 0.00 0.00 55.73 54.50 1ss8 s ARG 197 Cb 0.16 -0.49 0.12 0.00 -0.45 0.00 0.00 34.95 34.28 1ss8 s ARG 197 CO -0.06 -0.06 0.92 0.20 -0.68 0.00 0.00 175.30 175.62 1ss8 s GLY 198 N 0.66 1.72 0.67 -3.53 0.00 -1.25 -2.01 107.32 103.57 1ss8 s GLY 198 Ca -0.07 -2.05 -0.17 0.00 0.00 0.00 0.00 44.72 42.43 1ss8 s GLY 198 CO -0.01 -1.49 1.26 1.58 0.00 0.00 0.00 173.10 174.44 1ss8 n TYR 199 N -2.58 1.75 0.16 1.90 0.18 -0.60 -4.34 117.16 113.62 1ss8 n TYR 199 Ca 0.17 0.42 0.11 0.00 1.88 0.00 0.00 57.90 60.48 1ss8 n TYR 199 Cb 0.61 -2.23 0.09 0.00 -0.38 0.00 0.00 39.34 37.43 1ss8 n TYR 199 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1ss8 h LEU 200 N 0.29 0.00 -7.80 -3.48 3.38 -1.47 -3.45 115.31 102.78 1ss8 h LEU 200 Ca -0.50 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.29 1ss8 h LEU 200 Cb 1.34 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.85 1ss8 h LEU 200 CO 0.52 0.03 -0.64 -0.94 0.09 0.00 0.00 178.44 177.50 1ss8 s SER 201 N -5.85 0.07 0.28 -0.43 1.04 -1.26 -5.03 113.70 102.52 1ss8 s SER 201 Ca 0.03 -0.18 0.15 0.00 0.48 0.00 0.00 55.95 56.43 1ss8 s SER 201 Cb 0.07 0.13 0.80 0.00 0.10 0.00 0.00 66.02 67.12 1ss8 s SER 201 CO 0.73 -0.20 1.39 -2.65 0.98 0.00 0.00 173.24 173.48 1ss8 n PRO 202 N 2.17 0.10 0.19 4.02 -0.02 -1.26 -3.10 135.00 137.09 1ss8 n PRO 202 Ca -0.19 0.57 0.09 0.00 -2.02 0.00 0.00 63.50 61.96 1ss8 n PRO 202 Cb 0.57 -1.98 0.12 0.00 -0.02 0.00 0.00 33.50 32.19 1ss8 n PRO 202 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1ss8 h TYR 203 N 0.00 0.00 0.00 6.00 0.05 -1.98 -3.09 116.97 117.96 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 0.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.05 1ss8 h TYR 203 CO 0.00 0.15 0.00 1.19 -1.05 0.00 0.00 178.16 178.45 1ss8 n PHE 204 N -3.11 0.79 -1.54 4.88 3.72 -1.18 -4.69 117.46 116.32 1ss8 n PHE 204 Ca 0.03 0.33 -0.41 0.00 -0.05 0.00 0.00 57.45 57.35 1ss8 n PHE 204 Cb 0.59 -1.03 -0.05 0.00 -0.94 0.00 0.00 39.48 38.06 1ss8 n PHE 204 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1ss8 n ILE 205 N -2.24 0.10 1.09 4.37 5.41 -1.17 -4.70 119.36 122.21 1ss8 n ILE 205 Ca 0.01 -0.54 0.12 0.00 1.00 0.00 0.00 62.75 63.34 1ss8 n ILE 205 Cb 0.19 -2.36 0.13 0.00 -0.71 0.00 0.00 39.64 36.90 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 13.20 1.49 -3.77 4.38 0.23 -1.10 -4.60 115.26 125.10 1ss8 n ASN 206 Ca 0.38 -1.18 -0.28 0.00 -0.53 0.00 0.00 54.58 52.97 1ss8 n ASN 206 Cb 0.42 0.40 -0.12 0.00 -2.08 0.00 0.00 39.78 38.41 1ss8 n ASN 206 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1ss8 s LYS 207 N -2.57 2.03 0.65 -3.83 1.02 -0.52 -4.99 119.74 111.53 1ss8 s LYS 207 Ca 0.19 -2.98 0.39 0.00 0.02 0.00 0.00 55.97 53.60 1ss8 s LYS 207 Cb 0.18 -2.89 2.16 0.00 -0.52 0.00 0.00 37.83 36.76 1ss8 s LYS 207 CO 0.59 -1.30 2.25 -1.00 -0.92 0.00 0.00 175.35 174.97 1ss8 h PRO 208 N 5.54 0.00 -0.13 -1.68 0.13 -1.81 -1.05 132.00 133.00 1ss8 h PRO 208 Ca 0.16 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.12 1ss8 h PRO 208 Cb 0.80 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 1ss8 h PRO 208 CO 0.62 0.00 -0.64 0.93 -0.23 0.00 0.00 178.00 178.68 1ss8 h GLU 209 N 0.00 0.48 0.00 0.86 3.07 -1.94 -2.48 114.58 114.57 1ss8 h GLU 209 Ca 0.01 -0.35 0.00 0.00 -0.50 0.00 0.00 59.36 58.52 1ss8 h GLU 209 Cb 0.18 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1ss8 h GLU 209 CO -0.00 0.96 -0.86 2.41 -1.40 0.00 0.00 179.01 180.13 1ss8 n THR 210 N -3.90 0.35 -3.16 1.13 -1.04 -1.10 -4.96 114.28 101.60 1ss8 n THR 210 Ca -0.04 -0.33 -0.19 0.00 -2.04 0.00 0.00 64.05 61.46 1ss8 n THR 210 Cb 0.65 -0.07 0.05 0.00 -1.82 0.00 0.00 70.33 69.14 1ss8 n THR 210 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ss8 n GLY 211 N 1.31 -0.27 3.58 3.41 0.00 -0.48 -5.04 105.19 107.71 1ss8 n GLY 211 Ca 0.02 0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.17 3.05 -0.19 4.61 0.00 -0.72 -4.62 121.76 120.71 1ss8 s ALA 212 Ca 0.37 -1.83 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 1ss8 s ALA 212 Cb -0.16 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 1ss8 s ALA 212 CO 0.46 0.20 0.02 0.08 0.00 0.00 0.00 175.76 176.52 1ss8 s VAL 213 N -2.45 4.22 -0.12 0.00 1.01 -0.54 -1.43 120.40 121.08 1ss8 s VAL 213 Ca 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1ss8 s VAL 213 Cb -0.04 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.47 1ss8 s VAL 213 CO 0.18 0.43 -0.02 -0.70 0.00 0.00 0.00 175.10 174.99 1ss8 s GLU 214 N 0.81 1.02 -0.02 2.72 2.12 -1.26 -0.36 118.70 123.72 1ss8 s GLU 214 Ca 0.01 -0.21 0.07 0.00 0.36 0.00 0.00 54.97 55.21 1ss8 s GLU 214 Cb -0.14 -1.55 -0.02 0.00 0.26 0.00 0.00 34.13 32.68 1ss8 s GLU 214 CO 0.02 -0.38 -0.25 -0.51 -0.54 0.00 0.00 175.26 173.60 1ss8 s LEU 215 N 1.81 2.05 -0.16 2.70 1.43 -0.43 -4.97 118.68 121.11 1ss8 s LEU 215 Ca 0.03 -0.45 -0.04 0.00 -1.03 0.00 0.00 54.13 52.64 1ss8 s LEU 215 Cb -0.14 -1.27 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 1ss8 s LEU 215 CO -0.07 0.30 -0.04 -1.61 0.23 0.00 0.00 176.35 175.16 1ss8 s GLU 216 N -0.53 3.65 -1.60 1.70 2.02 -1.26 -2.03 118.70 120.64 1ss8 s GLU 216 Ca 0.08 -0.53 -0.13 0.00 0.02 0.00 0.00 54.97 54.41 1ss8 s GLU 216 Cb -0.10 -2.93 0.11 0.00 0.10 0.00 0.00 34.13 31.31 1ss8 s GLU 216 CO -0.01 0.20 0.77 0.43 0.02 0.00 0.00 175.26 176.67 1ss8 n SER 217 N 3.66 -3.08 -4.82 -0.19 7.64 -0.64 -4.53 113.62 111.67 1ss8 n SER 217 Ca -0.17 -0.95 -0.33 0.00 1.01 0.00 0.00 58.87 58.43 1ss8 n SER 217 Cb 0.52 -3.13 -0.02 0.00 -1.01 0.00 0.00 64.21 60.57 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 -6.76 3.73 0.35 1.43 0.04 -1.14 -4.61 135.00 128.04 1ss8 s PRO 218 Ca 0.57 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 62.56 1ss8 s PRO 218 Cb -0.30 -2.10 -0.10 0.00 0.04 0.00 0.00 34.50 32.05 1ss8 s PRO 218 CO 0.89 -0.46 0.80 -0.06 0.04 0.00 0.00 177.00 178.21 1ss8 s PHE 219 N -2.42 3.36 -0.17 0.56 0.08 -0.21 -2.95 117.98 116.23 1ss8 s PHE 219 Ca 0.62 1.34 0.01 0.00 0.12 0.00 0.00 56.93 59.01 1ss8 s PHE 219 Cb -0.13 -2.63 0.03 0.00 -0.57 0.00 0.00 43.02 39.72 1ss8 s PHE 219 CO 0.30 0.04 -0.12 0.42 -0.10 0.00 0.00 175.22 175.75 1ss8 s ILE 220 N -2.03 1.59 -0.26 0.64 1.01 0.11 -0.71 121.20 121.55 1ss8 s ILE 220 Ca 0.56 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 60.25 1ss8 s ILE 220 Cb -0.10 -1.56 -0.02 0.00 0.01 0.00 0.00 42.46 40.78 1ss8 s ILE 220 CO 0.16 0.34 0.55 -0.22 0.00 0.00 0.00 174.94 175.78 1ss8 s LEU 221 N 1.46 4.06 -0.31 2.97 2.96 0.16 -1.78 118.68 128.19 1ss8 s LEU 221 Ca 0.03 0.59 -0.09 0.00 -0.22 0.00 0.00 54.13 54.44 1ss8 s LEU 221 Cb -0.14 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 43.82 1ss8 s LEU 221 CO -0.10 -0.31 0.13 -0.76 -1.32 0.00 0.00 176.35 173.99 1ss8 s LEU 222 N 2.36 4.04 -0.19 -0.68 1.43 -1.26 -1.16 118.68 123.21 1ss8 s LEU 222 Ca 0.23 -0.62 -0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1ss8 s LEU 222 Cb -0.16 -1.96 0.06 0.00 0.03 0.00 0.00 46.19 44.16 1ss8 s LEU 222 CO 0.09 -0.20 -0.00 0.00 0.23 0.00 0.00 176.35 176.46 1ss8 s ALA 223 N 1.57 1.29 -1.13 4.21 0.00 -0.57 -2.42 121.76 124.70 1ss8 s ALA 223 Ca 0.04 -0.85 -0.19 0.00 0.00 0.00 0.00 51.96 50.95 1ss8 s ALA 223 Cb -0.17 -1.22 0.09 0.00 0.00 0.00 0.00 23.12 21.82 1ss8 s ALA 223 CO 0.05 -1.09 1.50 0.34 0.00 0.00 0.00 175.76 176.56 1ss8 s ASP 224 N 1.72 6.72 0.00 0.00 2.15 -1.02 -2.70 116.67 123.53 1ss8 s ASP 224 Ca -0.02 -2.11 0.00 0.00 0.43 0.00 0.00 52.55 50.86 1ss8 s ASP 224 Cb -0.17 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 1ss8 s ASP 224 CO -0.07 -1.22 0.00 2.29 -0.17 0.00 0.00 175.17 176.00 1ss8 n LYS 225 N 7.92 0.00 -2.92 4.34 2.85 -1.26 -4.11 118.16 124.98 1ss8 n LYS 225 Ca 0.38 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 57.23 1ss8 n LYS 225 Cb 0.48 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.81 1ss8 n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1ss8 s LYS 226 N -2.00 4.50 -0.56 -1.58 1.02 -1.26 -2.04 119.74 117.82 1ss8 s LYS 226 Ca 0.00 1.11 -0.13 0.00 0.02 0.00 0.00 55.97 56.97 1ss8 s LYS 226 Cb 0.00 -3.42 0.14 0.00 -0.52 0.00 0.00 37.83 34.03 1ss8 s LYS 226 CO 0.00 0.11 0.48 0.42 -0.92 0.00 0.00 175.35 175.44 1ss8 s ILE 227 N 0.55 4.89 -0.23 2.17 1.01 -0.14 -4.87 121.20 124.57 1ss8 s ILE 227 Ca 0.42 -1.77 -0.17 0.00 0.00 0.00 0.00 60.65 59.13 1ss8 s ILE 227 Cb -0.20 -4.14 -0.17 0.00 0.01 0.00 0.00 42.46 37.96 1ss8 s ILE 227 CO 0.23 -0.86 -0.01 -1.20 0.00 0.00 0.00 174.94 173.10 1ss8 n SER 228 N 4.91 1.92 -4.82 3.58 7.64 -1.26 -1.89 113.62 123.70 1ss8 n SER 228 Ca -0.08 0.35 -0.36 0.00 1.01 0.00 0.00 58.87 59.80 1ss8 n SER 228 Cb 0.41 -0.88 -0.06 0.00 -1.01 0.00 0.00 64.21 62.67 1ss8 n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ss8 s ASN 229 N -7.10 6.99 0.23 6.43 0.01 -1.26 -1.58 114.94 118.66 1ss8 s ASN 229 Ca -0.33 1.35 0.23 0.00 -0.71 0.00 0.00 52.86 53.40 1ss8 s ASN 229 Cb 0.09 -2.39 0.07 0.00 0.41 0.00 0.00 41.25 39.43 1ss8 s ASN 229 CO 0.56 0.02 1.14 -0.29 -1.51 0.00 0.00 177.10 177.03 1ss8 h ILE 230 N 2.67 0.00 -0.88 0.60 2.10 -1.92 -3.36 117.51 116.72 1ss8 h ILE 230 Ca -0.48 -0.97 0.20 0.00 1.08 0.00 0.00 64.86 64.69 1ss8 h ILE 230 Cb 1.19 1.54 -0.12 0.00 -1.09 0.00 0.00 36.82 38.35 1ss8 h ILE 230 CO 0.65 0.00 0.40 0.03 -1.08 0.00 0.00 178.15 178.16 1ss8 h ARG 231 N 0.00 0.44 0.00 2.19 3.08 -2.02 -0.52 114.38 117.56 1ss8 h ARG 231 Ca 0.00 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1ss8 h ARG 231 Cb 0.98 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 1ss8 h ARG 231 CO 0.00 0.29 -0.22 0.93 -1.07 0.00 0.00 179.97 179.91 1ss8 h GLU 232 N 0.46 0.00 0.05 0.04 5.08 -1.96 -3.30 114.58 114.94 1ss8 h GLU 232 Ca 0.53 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.89 1ss8 h GLU 232 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1ss8 h GLU 232 CO -0.48 0.22 -0.02 0.52 -1.00 0.00 0.00 179.01 178.24 1ss8 h MET 233 N 0.00 -0.06 -0.64 2.33 2.86 -1.31 -3.29 114.93 114.82 1ss8 h MET 233 Ca -0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1ss8 h MET 233 Cb 0.57 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.15 1ss8 h MET 233 CO 0.03 0.55 -0.31 1.28 1.06 0.00 0.00 176.91 179.52 1ss8 n LEU 234 N -4.76 -0.54 -0.34 1.22 4.77 -1.08 -0.60 117.00 115.67 1ss8 n LEU 234 Ca -0.07 1.12 0.08 0.00 -0.03 0.00 0.00 56.01 57.11 1ss8 n LEU 234 Cb 0.31 -0.20 0.25 0.00 -2.33 0.00 0.00 43.42 41.45 1ss8 n LEU 234 CO 0.26 -0.96 1.20 1.55 -1.33 0.00 0.00 177.39 178.10 1ss8 h PRO 235 N 0.00 0.84 -0.00 3.23 0.13 -1.83 0.74 132.00 135.11 1ss8 h PRO 235 Ca 0.16 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.20 1ss8 h PRO 235 Cb 0.32 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1ss8 h PRO 235 CO -0.61 0.56 -0.15 0.28 -0.23 0.00 0.00 178.00 177.84 1ss8 h VAL 236 N 0.87 1.58 -0.85 1.56 2.07 -1.06 -3.14 116.25 117.28 1ss8 h VAL 236 Ca 0.51 -1.91 0.18 0.00 0.82 0.00 0.00 66.70 66.29 1ss8 h VAL 236 Cb 0.61 2.82 -0.06 0.00 -1.52 0.00 0.00 31.29 33.14 1ss8 h VAL 236 CO -0.31 0.51 0.56 -0.07 0.02 0.00 0.00 177.57 178.28 1ss8 h LEU 237 N -0.62 0.44 -0.04 2.57 3.38 -0.33 -1.20 115.31 119.50 1ss8 h LEU 237 Ca -0.02 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1ss8 h LEU 237 Cb 0.92 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.63 1ss8 h LEU 237 CO 0.03 0.20 -0.35 -0.33 0.09 0.00 0.00 178.44 178.08 1ss8 h GLU 238 N 0.45 0.31 -0.20 1.13 5.08 -1.01 -2.60 114.58 117.74 1ss8 h GLU 238 Ca 0.43 -0.28 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 1ss8 h GLU 238 Cb 0.99 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1ss8 h GLU 238 CO -0.16 0.94 0.15 0.00 -1.00 0.00 0.00 179.01 178.94 1ss8 h ALA 239 N 0.38 2.15 0.09 3.43 0.00 -1.26 -0.74 119.26 123.32 1ss8 h ALA 239 Ca -0.03 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.65 1ss8 h ALA 239 Cb 1.03 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.86 1ss8 h ALA 239 CO 0.07 -0.26 -0.93 0.28 0.00 0.00 0.00 179.25 178.41 1ss8 h VAL 240 N 0.00 1.40 -0.14 0.00 2.07 -1.30 -3.19 116.25 115.09 1ss8 h VAL 240 Ca 0.10 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.24 1ss8 h VAL 240 Cb 0.40 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.99 1ss8 h VAL 240 CO -0.00 0.70 0.05 0.00 0.02 0.00 0.00 177.57 178.34 1ss8 h ALA 241 N 0.23 1.84 0.00 1.67 0.00 -1.00 -2.54 119.26 119.45 1ss8 h ALA 241 Ca -0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1ss8 h ALA 241 Cb 1.66 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 1ss8 h ALA 241 CO 0.18 0.14 -0.36 0.87 0.00 0.00 0.00 179.25 180.07 1ss8 h LYS 242 N 0.19 0.00 -0.00 0.00 1.57 -1.15 -2.58 116.57 114.60 1ss8 h LYS 242 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1ss8 h LYS 242 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ss8 h LYS 242 CO -0.01 0.36 -0.36 0.00 -0.57 0.00 0.00 179.45 178.88 1ss8 n ALA 243 N -2.40 3.23 -0.95 3.86 0.00 -0.98 -4.95 120.51 118.31 1ss8 n ALA 243 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1ss8 n ALA 243 Cb 0.43 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 0.47 3.93 0.00 0.00 -0.97 -5.01 105.19 105.09 1ss8 n GLY 244 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.49 3.52 0.98 1.61 1.02 -1.24 -5.05 119.74 120.10 1ss8 s LYS 245 Ca 0.00 -0.34 -0.16 0.00 0.02 0.00 0.00 55.97 55.50 1ss8 s LYS 245 Cb 0.00 -2.81 0.20 0.00 -0.52 0.00 0.00 37.83 34.69 1ss8 s LYS 245 CO 0.00 0.37 1.25 -1.25 -0.92 0.00 0.00 175.35 174.80 1ss8 s PRO 246 N -3.45 0.50 -0.03 -1.68 0.04 -1.26 -4.63 135.00 124.49 1ss8 s PRO 246 Ca 0.39 -0.22 -0.01 0.00 0.04 0.00 0.00 61.00 61.20 1ss8 s PRO 246 Cb -0.11 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.65 1ss8 s PRO 246 CO 0.30 -2.54 0.06 -1.17 0.04 0.00 0.00 177.00 173.69 1ss8 s LEU 247 N -6.06 1.09 -0.22 -3.56 2.96 -0.24 -1.05 118.68 111.61 1ss8 s LEU 247 Ca 0.71 0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 54.62 1ss8 s LEU 247 Cb -0.07 0.06 -0.05 0.00 0.50 0.00 0.00 46.19 46.63 1ss8 s LEU 247 CO 0.53 -0.12 0.15 -0.22 -1.32 0.00 0.00 176.35 175.37 1ss8 s LEU 248 N 0.96 4.16 -0.29 -0.68 2.96 0.11 -1.47 118.68 124.43 1ss8 s LEU 248 Ca -0.08 0.16 -0.12 0.00 -0.22 0.00 0.00 54.13 53.88 1ss8 s LEU 248 Cb -0.11 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 1ss8 s LEU 248 CO -0.03 0.11 0.21 -0.63 -1.32 0.00 0.00 176.35 174.69 1ss8 s ILE 249 N 0.76 5.30 -0.34 6.68 -1.09 0.16 -0.67 121.20 132.00 1ss8 s ILE 249 Ca 0.08 0.11 -0.01 0.00 -2.23 0.00 0.00 60.65 58.60 1ss8 s ILE 249 Cb -0.12 -3.58 0.07 0.00 -1.58 0.00 0.00 42.46 37.25 1ss8 s ILE 249 CO 0.02 0.19 0.06 -0.63 -1.23 0.00 0.00 174.94 173.35 1ss8 s ILE 250 N 1.77 2.98 0.31 2.92 1.01 -0.31 -0.70 121.20 129.19 1ss8 s ILE 250 Ca 0.07 -1.70 0.03 0.00 0.00 0.00 0.00 60.65 59.05 1ss8 s ILE 250 Cb -0.16 -2.87 -0.05 0.00 0.01 0.00 0.00 42.46 39.40 1ss8 s ILE 250 CO 0.11 -0.33 0.11 0.00 0.00 0.00 0.00 174.94 174.83 1ss8 s ALA 251 N 1.18 2.09 0.23 9.38 0.00 -1.13 -1.51 121.76 131.99 1ss8 s ALA 251 Ca 0.00 -1.79 -0.06 0.00 0.00 0.00 0.00 51.96 50.12 1ss8 s ALA 251 Cb -0.21 0.96 0.36 0.00 0.00 0.00 0.00 23.12 24.23 1ss8 s ALA 251 CO -0.03 -0.43 1.80 1.49 0.00 0.00 0.00 175.76 178.60 1ss8 h GLU 252 N 2.20 0.70 -2.27 0.00 4.81 -1.20 0.33 114.58 119.16 1ss8 h GLU 252 Ca -0.37 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 58.87 1ss8 h GLU 252 Cb 1.25 -0.16 -0.17 0.00 0.63 0.00 0.00 28.75 30.31 1ss8 h GLU 252 CO 0.60 0.46 0.39 0.34 -0.73 0.00 0.00 179.01 180.07 1ss8 s ASP 253 N -5.57 -0.46 -0.20 1.04 2.15 -1.25 -4.17 116.67 108.21 1ss8 s ASP 253 Ca -0.12 0.18 0.00 0.00 0.43 0.00 0.00 52.55 53.04 1ss8 s ASP 253 Cb 0.18 0.44 0.05 0.00 -0.30 0.00 0.00 42.92 43.29 1ss8 s ASP 253 CO 0.77 -0.65 -0.06 -0.69 -0.17 0.00 0.00 175.17 174.38 1ss8 s VAL 254 N -2.60 1.36 0.32 1.11 1.01 -1.26 -0.97 120.40 119.38 1ss8 s VAL 254 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.13 1ss8 s VAL 254 Cb -0.01 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1ss8 s VAL 254 CO -0.05 0.04 0.25 -1.61 0.00 0.00 0.00 175.10 173.73 1ss8 s GLU 255 N 1.50 2.69 0.00 2.72 2.02 -0.79 -4.72 118.70 122.12 1ss8 s GLU 255 Ca -0.02 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.67 1ss8 s GLU 255 Cb -0.17 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.63 1ss8 s GLU 255 CO -0.07 0.15 0.00 0.41 0.02 0.00 0.00 175.26 175.77 1ss8 n GLY 256 N -1.29 0.00 0.00 -1.39 0.00 -1.26 -2.32 105.19 98.93 1ss8 n GLY 256 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1ss8 n GLY 256 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ss8 n GLU 257 N 0.00 0.00 0.24 1.61 0.00 -1.26 -1.64 120.64 119.59 1ss8 n GLU 257 Ca 0.00 0.41 0.09 0.00 0.00 0.00 0.00 57.16 57.66 1ss8 n GLU 257 Cb 0.00 -1.33 0.60 0.00 0.00 0.00 0.00 31.44 30.71 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 -1.90 1.39 0.85 4.31 0.00 -1.19 -2.65 119.26 120.08 1ss8 h ALA 258 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1ss8 h ALA 258 Cb 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ss8 h ALA 258 CO 0.00 0.22 -0.41 1.25 0.00 0.00 0.00 179.25 180.32 1ss8 h LEU 259 N 0.00 -0.97 -1.95 0.00 5.85 -1.49 -1.82 115.31 114.94 1ss8 h LEU 259 Ca -0.00 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.88 1ss8 h LEU 259 Cb 0.40 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1ss8 h LEU 259 CO 0.02 -0.68 0.35 0.00 -0.34 0.00 0.00 178.44 177.80 1ss8 h ALA 260 N -1.02 2.39 -0.01 1.25 0.00 -1.09 -1.60 119.26 119.20 1ss8 h ALA 260 Ca -0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ss8 h ALA 260 Cb 0.88 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ss8 h ALA 260 CO 0.19 -0.53 -0.01 1.15 0.00 0.00 0.00 179.25 180.05 1ss8 h THR 261 N 0.05 1.43 -0.18 0.00 2.02 -1.31 -2.40 112.91 112.52 1ss8 h THR 261 Ca 0.24 -1.28 0.05 0.00 0.77 0.00 0.00 66.41 66.18 1ss8 h THR 261 Cb 0.87 2.28 -0.05 0.00 -1.74 0.00 0.00 68.15 69.51 1ss8 h THR 261 CO -0.01 0.34 -0.11 -0.07 0.37 0.00 0.00 175.52 176.03 1ss8 h LEU 262 N -0.51 -0.35 -0.69 2.58 3.38 -1.01 0.72 115.31 119.44 1ss8 h LEU 262 Ca 0.00 0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.19 1ss8 h LEU 262 Cb 0.56 0.19 -0.13 0.00 0.09 0.00 0.00 40.66 41.37 1ss8 h LEU 262 CO 0.00 -0.14 -0.12 0.58 0.09 0.00 0.00 178.44 178.85 1ss8 h VAL 263 N -0.10 0.34 0.00 1.22 2.07 -1.33 0.57 116.25 119.03 1ss8 h VAL 263 Ca 0.11 -0.01 -0.13 0.00 0.82 0.00 0.00 66.70 67.49 1ss8 h VAL 263 Cb 0.25 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1ss8 h VAL 263 CO -0.25 0.01 -0.60 0.58 0.02 0.00 0.00 177.57 177.33 1ss8 h VAL 264 N 0.03 1.17 0.00 2.57 2.07 -1.00 -2.69 116.25 118.39 1ss8 h VAL 264 Ca 0.34 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1ss8 h VAL 264 Cb 0.55 2.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1ss8 h VAL 264 CO -0.67 0.58 -0.68 0.59 0.02 0.00 0.00 177.57 177.41 1ss8 n ASN 265 N -3.45 0.64 0.03 0.57 5.03 0.21 -2.35 115.26 115.94 1ss8 n ASN 265 Ca 0.00 -0.02 0.06 0.00 0.87 0.00 0.00 54.58 55.49 1ss8 n ASN 265 Cb 0.69 0.30 -0.09 0.00 -1.02 0.00 0.00 39.78 39.66 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 -1.96 0.70 -0.29 3.41 -2.24 0.06 -2.52 114.28 111.43 1ss8 n THR 266 Ca 0.03 -0.61 -0.04 0.00 -2.27 0.00 0.00 64.05 61.17 1ss8 n THR 266 Cb 0.42 -0.38 0.07 0.00 -2.10 0.00 0.00 70.33 68.34 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 1.06 -0.01 -0.78 -1.53 -1.36 -2.52 114.93 109.78 1ss8 h MET 267 Ca -0.10 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.09 1ss8 h MET 267 Cb 1.30 -0.24 0.00 0.00 -0.55 0.00 0.00 31.60 32.11 1ss8 h MET 267 CO 0.02 0.70 0.00 0.54 0.14 0.00 0.00 176.91 178.31 1ss8 n ARG 268 N -4.53 1.29 -1.19 0.39 1.74 -0.99 -4.92 116.66 108.46 1ss8 n ARG 268 Ca 0.08 -0.42 -0.07 0.00 -0.77 0.00 0.00 57.85 56.67 1ss8 n ARG 268 Cb 0.02 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 29.95 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 1.06 0.86 0.09 -0.13 0.00 -0.95 -4.95 105.19 101.17 1ss8 n GLY 269 Ca 0.21 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 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 1.20 -3.39 -0.61 2.04 -1.74 -3.45 117.51 111.56 1ss8 h ILE 270 Ca -0.13 -0.61 -0.19 0.00 1.00 0.00 0.00 64.86 64.93 1ss8 h ILE 270 Cb 0.55 1.38 -0.26 0.00 -0.74 0.00 0.00 36.82 37.75 1ss8 h ILE 270 CO 0.20 0.18 -0.54 -0.69 0.00 0.00 0.00 178.15 177.29 1ss8 s VAL 271 N -5.29 0.01 -0.65 1.67 1.01 -1.06 -5.00 120.40 111.09 1ss8 s VAL 271 Ca -0.14 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.52 1ss8 s VAL 271 Cb 0.06 -0.23 0.05 0.00 0.00 0.00 0.00 36.38 36.25 1ss8 s VAL 271 CO 0.70 -0.04 1.08 -0.54 0.00 0.00 0.00 175.10 176.30 1ss8 s LYS 272 N -0.07 3.23 0.17 2.72 3.01 -1.26 -3.70 119.74 123.85 1ss8 s LYS 272 Ca -0.01 -0.40 0.11 0.00 -1.01 0.00 0.00 55.97 54.66 1ss8 s LYS 272 Cb -0.02 -4.15 -0.04 0.00 -1.01 0.00 0.00 37.83 32.61 1ss8 s LYS 272 CO 0.00 -1.83 -0.23 0.08 0.51 0.00 0.00 175.35 173.89 1ss8 s VAL 273 N 4.65 2.43 0.02 3.17 1.01 -1.26 -1.07 120.40 129.34 1ss8 s VAL 273 Ca 0.30 -1.91 -0.07 0.00 0.00 0.00 0.00 61.98 60.30 1ss8 s VAL 273 Cb -0.12 -2.15 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 1ss8 s VAL 273 CO 0.15 -0.06 0.13 0.00 0.00 0.00 0.00 175.10 175.33 1ss8 s ALA 274 N -1.50 -0.25 -0.01 5.51 0.00 -0.54 -4.88 121.76 120.09 1ss8 s ALA 274 Ca 0.19 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1ss8 s ALA 274 Cb -0.09 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1ss8 s ALA 274 CO 0.09 -0.27 -0.05 0.00 0.00 0.00 0.00 175.76 175.53 1ss8 s ALA 275 N -1.99 0.52 0.08 0.00 0.00 -1.26 0.40 121.76 119.50 1ss8 s ALA 275 Ca -0.10 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 51.69 1ss8 s ALA 275 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 1ss8 s ALA 275 CO -0.01 0.09 -0.08 0.14 0.00 0.00 0.00 175.76 175.89 1ss8 s VAL 276 N 0.10 0.72 0.41 0.00 -7.23 0.13 -1.07 120.40 113.46 1ss8 s VAL 276 Ca -0.01 -1.50 -0.26 0.00 -1.81 0.00 0.00 61.98 58.40 1ss8 s VAL 276 Cb -0.05 -1.16 -0.09 0.00 0.56 0.00 0.00 36.38 35.64 1ss8 s VAL 276 CO -0.00 -0.57 1.34 -0.54 -0.31 0.00 0.00 175.10 175.01 1ss8 s LYS 277 N -2.60 3.93 0.58 4.82 1.02 -1.26 -2.84 119.74 123.39 1ss8 s LYS 277 Ca 0.01 2.23 -0.19 0.00 0.02 0.00 0.00 55.97 58.04 1ss8 s LYS 277 Cb -0.03 -2.76 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 1ss8 s LYS 277 CO -0.01 -0.55 1.24 0.00 -0.92 0.00 0.00 175.35 175.11 1ss8 s ALA 278 N -1.24 2.59 0.45 5.17 0.00 0.12 -4.77 121.76 124.08 1ss8 s ALA 278 Ca 0.57 1.08 -0.20 0.00 0.00 0.00 0.00 51.96 53.41 1ss8 s ALA 278 Cb -0.40 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.14 1ss8 s ALA 278 CO 0.51 -1.22 0.96 -1.25 0.00 0.00 0.00 175.76 174.76 1ss8 s PRO 279 N -3.22 4.17 1.02 0.00 0.04 -1.26 -4.89 135.00 130.86 1ss8 s PRO 279 Ca 0.76 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1ss8 s PRO 279 Cb -0.33 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.04 1ss8 s PRO 279 CO 0.36 -0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.73 1ss8 n GLY 280 N -0.83 -1.74 3.26 0.56 0.00 -1.26 -4.40 105.19 100.78 1ss8 n GLY 280 Ca 0.07 -1.27 -0.14 0.00 0.00 0.00 0.00 46.02 44.68 1ss8 n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ss8 s PHE 281 N -0.54 1.30 0.00 1.61 -0.71 -1.26 -4.75 117.98 113.62 1ss8 s PHE 281 Ca 0.00 -1.10 0.00 0.00 -1.04 0.00 0.00 56.93 54.79 1ss8 s PHE 281 Cb 0.00 -0.74 0.00 0.00 -1.21 0.00 0.00 43.02 41.07 1ss8 s PHE 281 CO 0.00 -0.29 0.00 0.41 -1.34 0.00 0.00 175.22 174.00 1ss8 n GLY 282 N -0.31 3.64 0.08 1.99 0.00 -1.26 -2.62 105.19 106.72 1ss8 n GLY 282 Ca -0.04 0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 0.00 1.61 3.32 -2.00 -2.99 116.42 116.31 1ss8 h ASP 283 Ca 0.00 -0.63 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1ss8 h ASP 283 Cb 0.00 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1ss8 h ASP 283 CO 0.00 0.66 0.34 0.08 -1.72 0.00 0.00 179.24 178.60 1ss8 h ARG 284 N -0.81 0.00 0.02 3.56 0.11 -1.96 -1.74 114.38 113.56 1ss8 h ARG 284 Ca -0.01 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.04 1ss8 h ARG 284 Cb 0.68 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.76 1ss8 h ARG 284 CO 0.01 0.00 -0.18 -0.09 0.10 0.00 0.00 179.97 179.81 1ss8 h ARG 285 N 0.00 0.04 -0.42 0.08 2.43 -1.36 -2.82 114.38 112.33 1ss8 h ARG 285 Ca 0.00 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1ss8 h ARG 285 Cb 0.68 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.20 1ss8 h ARG 285 CO 0.00 1.03 0.13 0.87 -1.51 0.00 0.00 179.97 180.49 1ss8 h LYS 286 N -0.92 0.28 -0.24 0.20 1.57 -1.27 -1.17 116.57 115.02 1ss8 h LYS 286 Ca -0.04 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ss8 h LYS 286 Cb 1.10 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 1ss8 h LYS 286 CO 0.01 0.18 0.16 0.00 -0.57 0.00 0.00 179.45 179.23 1ss8 h ALA 287 N 1.28 0.31 -0.34 3.86 0.00 -1.61 -2.96 119.26 119.81 1ss8 h ALA 287 Ca 0.20 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1ss8 h ALA 287 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ss8 h ALA 287 CO -0.22 -0.22 -0.02 0.52 0.00 0.00 0.00 179.25 179.31 1ss8 h MET 288 N 0.33 0.54 -0.92 0.00 2.86 -1.19 -0.95 114.93 115.59 1ss8 h MET 288 Ca 0.09 -0.12 0.04 0.00 -2.06 0.00 0.00 59.70 57.65 1ss8 h MET 288 Cb -0.03 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.50 1ss8 h MET 288 CO -0.02 0.58 0.61 -0.07 1.06 0.00 0.00 176.91 179.07 1ss8 h LEU 289 N 0.51 0.99 -0.78 1.22 3.38 -1.12 -1.07 115.31 118.43 1ss8 h LEU 289 Ca 0.11 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1ss8 h LEU 289 Cb 0.37 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ss8 h LEU 289 CO 0.01 0.67 -0.21 -0.61 0.09 0.00 0.00 178.44 178.39 1ss8 h GLN 290 N 1.14 0.68 0.24 1.13 5.75 -1.12 -0.03 115.11 122.91 1ss8 h GLN 290 Ca 0.37 -0.26 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1ss8 h GLN 290 Cb 0.05 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1ss8 h GLN 290 CO -0.12 0.85 -0.24 -0.44 -2.65 0.00 0.00 178.83 176.23 1ss8 h ASP 291 N 0.60 -0.63 -0.94 -0.69 3.32 -0.01 -0.50 116.42 117.56 1ss8 h ASP 291 Ca 0.09 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1ss8 h ASP 291 Cb 0.69 0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.41 1ss8 h ASP 291 CO 0.05 -0.35 0.61 0.40 -1.72 0.00 0.00 179.24 178.23 1ss8 h ILE 292 N -0.51 1.17 0.03 0.35 2.04 -1.16 -1.54 117.51 117.88 1ss8 h ILE 292 Ca -0.01 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.47 1ss8 h ILE 292 Cb 0.47 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.38 1ss8 h ILE 292 CO -0.05 0.22 -0.25 0.00 0.00 0.00 0.00 178.15 178.07 1ss8 h ALA 293 N 1.38 -0.35 -0.76 1.87 0.00 -0.50 -1.82 119.26 119.09 1ss8 h ALA 293 Ca 0.37 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.34 1ss8 h ALA 293 Cb -0.01 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1ss8 h ALA 293 CO -0.12 -0.75 0.44 1.15 0.00 0.00 0.00 179.25 179.97 1ss8 h THR 294 N -0.40 0.97 -0.86 0.00 2.02 -0.68 0.22 112.91 114.18 1ss8 h THR 294 Ca 0.05 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 67.01 1ss8 h THR 294 Cb 0.47 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.94 1ss8 h THR 294 CO -0.20 0.14 0.56 0.25 0.37 0.00 0.00 175.52 176.65 1ss8 h LEU 295 N 0.78 0.90 -1.83 2.58 6.46 -0.89 -3.14 115.31 120.16 1ss8 h LEU 295 Ca 0.35 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.10 1ss8 h LEU 295 Cb 0.24 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 1ss8 h LEU 295 CO -0.20 0.61 0.00 0.35 -0.62 0.00 0.00 178.44 178.58 1ss8 n THR 296 N -4.46 0.27 -3.30 1.05 -2.24 -0.72 -1.85 114.28 103.03 1ss8 n THR 296 Ca 0.12 -0.63 -0.17 0.00 -2.27 0.00 0.00 64.05 61.09 1ss8 n THR 296 Cb 0.14 1.05 0.06 0.00 -2.10 0.00 0.00 70.33 69.47 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 0.64 -0.15 3.86 3.38 0.00 0.42 -0.37 105.19 112.98 1ss8 n GLY 297 Ca 0.08 0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.25 2.13 -0.05 -0.02 0.00 0.50 -4.21 107.32 102.42 1ss8 s GLY 298 Ca 0.42 -1.90 0.05 0.00 0.00 0.00 0.00 44.72 43.30 1ss8 s GLY 298 CO 0.53 -1.71 -0.20 -1.59 0.00 0.00 0.00 173.10 170.13 1ss8 s THR 299 N -2.47 2.57 -0.00 0.90 2.01 0.46 -4.43 115.64 114.67 1ss8 s THR 299 Ca 0.47 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 1ss8 s THR 299 Cb -0.03 -1.97 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 1ss8 s THR 299 CO 0.27 0.58 1.01 -0.69 -0.69 0.00 0.00 174.62 175.10 1ss8 s VAL 300 N -0.48 4.75 -0.79 3.82 1.01 -1.26 -4.56 120.40 122.89 1ss8 s VAL 300 Ca 0.06 1.97 -0.15 0.00 0.00 0.00 0.00 61.98 63.86 1ss8 s VAL 300 Cb -0.12 -4.27 0.19 0.00 0.00 0.00 0.00 36.38 32.19 1ss8 s VAL 300 CO 0.01 0.14 0.76 -0.63 0.00 0.00 0.00 175.10 175.38 1ss8 s ILE 301 N 1.11 5.44 -0.12 2.22 1.01 -1.02 -4.99 121.20 124.85 1ss8 s ILE 301 Ca 0.53 -2.18 -0.02 0.00 0.00 0.00 0.00 60.65 58.97 1ss8 s ILE 301 Cb -0.22 -4.48 -0.03 0.00 0.01 0.00 0.00 42.46 37.74 1ss8 s ILE 301 CO 0.27 -1.06 -0.04 -0.94 0.00 0.00 0.00 174.94 173.18 1ss8 s SER 302 N 2.58 4.82 0.03 3.58 1.04 -1.26 -2.45 113.70 122.04 1ss8 s SER 302 Ca 0.17 -0.06 0.21 0.00 0.48 0.00 0.00 55.95 56.74 1ss8 s SER 302 Cb -0.13 -1.59 0.87 0.00 0.10 0.00 0.00 66.02 65.27 1ss8 s SER 302 CO -0.07 0.25 1.66 -0.62 0.98 0.00 0.00 173.24 175.44 1ss8 n GLU 303 N 3.00 0.02 0.19 4.02 1.02 -1.26 -2.68 120.64 124.95 1ss8 n GLU 303 Ca -0.18 0.17 0.03 0.00 -0.02 0.00 0.00 57.16 57.16 1ss8 n GLU 303 Cb 0.53 -1.54 0.38 0.00 -0.02 0.00 0.00 31.44 30.79 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 0.01 -0.13 3.49 5.08 -1.91 -1.33 114.58 119.79 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 0.36 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1ss8 h GLU 304 CO 0.00 0.35 0.00 -0.89 -1.00 0.00 0.00 179.01 177.47 1ss8 n ILE 305 N -4.14 0.17 -1.13 3.13 5.41 -1.09 -4.95 119.36 116.75 1ss8 n ILE 305 Ca -0.02 -0.30 -0.03 0.00 1.00 0.00 0.00 62.75 63.40 1ss8 n ILE 305 Cb 0.38 0.30 -0.01 0.00 -0.71 0.00 0.00 39.64 39.60 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 1.09 0.59 3.82 7.39 0.00 -0.50 -5.04 105.19 112.54 1ss8 n GLY 306 Ca 0.16 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.35 4.14 0.19 1.61 -1.94 -1.20 -5.00 119.30 114.75 1ss8 s MET 307 Ca 0.00 0.69 0.09 0.00 -1.71 0.00 0.00 55.69 54.76 1ss8 s MET 307 Cb 0.00 -3.01 -0.04 0.00 2.01 0.00 0.00 34.83 33.79 1ss8 s MET 307 CO 0.00 0.50 -0.08 -1.21 -0.01 0.00 0.00 175.02 174.22 1ss8 s GLU 308 N -1.71 2.11 0.48 2.03 2.02 -1.26 -4.17 118.70 118.21 1ss8 s GLU 308 Ca 0.37 -1.27 0.27 0.00 0.02 0.00 0.00 54.97 54.36 1ss8 s GLU 308 Cb -0.17 -2.18 1.11 0.00 0.10 0.00 0.00 34.13 32.99 1ss8 s GLU 308 CO 0.20 0.43 1.90 -0.07 0.02 0.00 0.00 175.26 177.74 1ss8 h LEU 309 N 2.81 0.00 -0.25 1.80 3.38 -1.95 -3.06 115.31 118.05 1ss8 h LEU 309 Ca -0.46 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 1ss8 h LEU 309 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1ss8 h LEU 309 CO 0.55 0.15 -0.13 -0.33 0.09 0.00 0.00 178.44 178.77 1ss8 h GLU 310 N 0.00 0.53 -1.93 1.13 3.07 -1.93 -3.19 114.58 112.26 1ss8 h GLU 310 Ca -0.00 -0.24 -0.31 0.00 -0.50 0.00 0.00 59.36 58.32 1ss8 h GLU 310 Cb 0.63 -0.01 -0.11 0.00 -0.84 0.00 0.00 28.75 28.42 1ss8 h GLU 310 CO 0.02 0.79 0.07 1.63 -1.40 0.00 0.00 179.01 180.13 1ss8 n LYS 311 N -4.47 2.01 -3.97 2.33 5.02 -1.15 -4.80 118.16 113.12 1ss8 n LYS 311 Ca -0.04 -1.48 -0.28 0.00 -2.02 0.00 0.00 58.31 54.49 1ss8 n LYS 311 Cb 0.36 -1.88 -0.17 0.00 -0.02 0.00 0.00 35.03 33.32 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 -0.58 1.49 0.32 7.82 0.00 -1.21 -4.85 121.76 124.76 1ss8 s ALA 312 Ca 0.51 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.85 1ss8 s ALA 312 Cb 0.30 -0.94 0.05 0.00 0.00 0.00 0.00 23.12 22.52 1ss8 s ALA 312 CO -0.08 -0.38 0.40 0.25 0.00 0.00 0.00 175.76 175.94 1ss8 n THR 313 N 4.85 0.00 0.05 0.00 -2.24 -1.26 -4.38 114.28 111.29 1ss8 n THR 313 Ca -0.14 -0.91 0.01 0.00 -2.27 0.00 0.00 64.05 60.74 1ss8 n THR 313 Cb 0.50 -0.82 0.34 0.00 -2.10 0.00 0.00 70.33 68.25 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 0.38 -1.36 3.22 3.38 -1.94 -2.96 115.31 116.03 1ss8 h LEU 314 Ca -0.14 -0.07 0.19 0.00 0.09 0.00 0.00 57.88 57.96 1ss8 h LEU 314 Cb 0.60 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1ss8 h LEU 314 CO 0.19 0.48 0.60 -0.08 0.09 0.00 0.00 178.44 179.72 1ss8 h GLU 315 N 0.39 0.51 0.00 1.13 4.81 -1.99 -1.05 114.58 118.38 1ss8 h GLU 315 Ca 0.08 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1ss8 h GLU 315 Cb 0.33 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1ss8 h GLU 315 CO 0.01 0.34 -0.08 -0.44 -0.73 0.00 0.00 179.01 178.12 1ss8 h ASP 316 N 0.53 0.00 -3.43 1.04 3.32 -1.89 -3.45 116.42 112.54 1ss8 h ASP 316 Ca 0.49 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 57.00 1ss8 h ASP 316 Cb 1.06 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.57 1ss8 h ASP 316 CO -0.23 0.08 0.17 -0.76 -1.72 0.00 0.00 179.24 176.78 1ss8 s LEU 317 N -6.41 4.44 0.79 1.55 1.02 -0.40 -0.40 118.68 119.27 1ss8 s LEU 317 Ca 0.01 1.45 -0.12 0.00 0.02 0.00 0.00 54.13 55.49 1ss8 s LEU 317 Cb 0.09 -3.24 0.06 0.00 0.02 0.00 0.00 46.19 43.12 1ss8 s LEU 317 CO 0.58 -0.00 1.10 -0.83 0.02 0.00 0.00 176.35 177.22 1ss8 s GLY 318 N 0.03 1.62 0.04 -3.19 0.00 -0.73 -4.55 107.32 100.54 1ss8 s GLY 318 Ca 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 44.72 44.84 1ss8 s GLY 318 CO 0.23 0.16 -0.02 1.62 0.00 0.00 0.00 173.10 175.09 1ss8 s GLN 319 N -5.21 0.49 0.07 2.90 0.74 0.50 0.10 119.66 119.25 1ss8 s GLN 319 Ca 0.61 -0.95 -0.17 0.00 0.05 0.00 0.00 55.36 54.90 1ss8 s GLN 319 Cb -0.14 0.17 0.03 0.00 1.10 0.00 0.00 33.01 34.18 1ss8 s GLN 319 CO 0.54 -0.09 0.39 0.00 -0.55 0.00 0.00 175.29 175.57 1ss8 s ALA 320 N -2.86 -0.91 0.26 1.58 0.00 -1.15 -1.62 121.76 117.05 1ss8 s ALA 320 Ca -0.03 0.12 0.20 0.00 0.00 0.00 0.00 51.96 52.25 1ss8 s ALA 320 Cb 0.00 0.46 0.88 0.00 0.00 0.00 0.00 23.12 24.46 1ss8 s ALA 320 CO -0.06 -0.52 1.83 0.87 0.00 0.00 0.00 175.76 177.89 1ss8 h LYS 321 N 2.81 0.00 -1.75 0.00 1.57 -0.91 -3.02 116.57 115.27 1ss8 h LYS 321 Ca -0.32 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.48 1ss8 h LYS 321 Cb 1.22 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.29 1ss8 h LYS 321 CO 0.45 0.31 0.33 0.50 -0.57 0.00 0.00 179.45 180.47 1ss8 s ARG 322 N -3.86 0.63 0.03 3.15 3.52 -1.01 -1.62 118.95 119.80 1ss8 s ARG 322 Ca -0.01 0.75 0.04 0.00 -0.13 0.00 0.00 55.73 56.38 1ss8 s ARG 322 Cb 0.12 0.31 -0.02 0.00 -1.56 0.00 0.00 34.95 33.80 1ss8 s ARG 322 CO 0.67 -0.08 -0.11 0.14 -0.81 0.00 0.00 175.30 175.11 1ss8 s VAL 323 N 0.30 0.85 -0.09 7.11 -7.23 -0.86 -0.30 120.40 120.18 1ss8 s VAL 323 Ca 0.02 -0.89 -0.01 0.00 -1.81 0.00 0.00 61.98 59.29 1ss8 s VAL 323 Cb -0.05 -0.80 0.03 0.00 0.56 0.00 0.00 36.38 36.11 1ss8 s VAL 323 CO -0.04 -0.07 -0.04 -0.69 -0.31 0.00 0.00 175.10 173.95 1ss8 s VAL 324 N -0.86 0.74 -0.03 1.32 1.01 -0.28 -1.32 120.40 120.98 1ss8 s VAL 324 Ca -0.01 -0.12 0.07 0.00 0.00 0.00 0.00 61.98 61.92 1ss8 s VAL 324 Cb -0.07 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1ss8 s VAL 324 CO 0.01 0.32 -0.24 0.27 0.00 0.00 0.00 175.10 175.46 1ss8 s ILE 325 N 1.74 2.23 0.46 2.22 -0.00 0.51 -1.03 121.20 127.33 1ss8 s ILE 325 Ca 0.04 -1.04 0.07 0.00 -0.00 0.00 0.00 60.65 59.71 1ss8 s ILE 325 Cb -0.13 -1.79 0.07 0.00 -0.00 0.00 0.00 42.46 40.61 1ss8 s ILE 325 CO -0.06 0.58 0.55 0.59 -0.00 0.00 0.00 174.94 176.60 1ss8 n ASN 326 N 2.45 1.94 -0.29 4.36 3.02 0.75 -1.47 115.26 126.02 1ss8 n ASN 326 Ca -0.16 -2.34 0.07 0.00 -0.03 0.00 0.00 54.58 52.12 1ss8 n ASN 326 Cb 0.51 -0.25 0.29 0.00 -0.61 0.00 0.00 39.78 39.73 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 0.87 -0.22 3.52 3.64 -1.94 -1.60 116.57 120.84 1ss8 h LYS 327 Ca -0.24 -0.05 -0.21 0.00 -1.27 0.00 0.00 60.65 58.88 1ss8 h LYS 327 Cb 1.02 -0.20 -0.38 0.00 -0.41 0.00 0.00 32.23 32.26 1ss8 h LYS 327 CO 0.36 0.57 -1.04 -0.40 -2.27 0.00 0.00 179.45 176.67 1ss8 n ASP 328 N -4.54 1.16 -3.72 4.20 5.68 -1.26 -3.94 116.55 114.14 1ss8 n ASP 328 Ca 0.16 -2.02 -0.14 0.00 -0.50 0.00 0.00 54.79 52.29 1ss8 n ASP 328 Cb 0.32 -0.34 -0.08 0.00 -1.14 0.00 0.00 41.12 39.87 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 -1.95 0.04 -0.04 2.12 2.01 -1.15 -3.54 115.64 113.13 1ss8 s THR 329 Ca 0.29 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 61.97 1ss8 s THR 329 Cb 0.35 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 72.21 1ss8 s THR 329 CO -0.10 -0.18 -0.03 -0.89 -0.69 0.00 0.00 174.62 172.73 1ss8 s THR 330 N -1.09 0.43 -0.07 -0.82 2.01 -0.63 -0.18 115.64 115.29 1ss8 s THR 330 Ca -0.11 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 61.84 1ss8 s THR 330 Cb -0.04 -0.47 0.02 0.00 0.01 0.00 0.00 72.50 72.02 1ss8 s THR 330 CO 0.05 0.20 -0.09 0.28 -0.69 0.00 0.00 174.62 174.37 1ss8 s THR 331 N 0.92 0.95 -0.28 -0.82 -1.32 -0.19 -1.61 115.64 113.28 1ss8 s THR 331 Ca -0.11 -0.33 -0.09 0.00 -1.21 0.00 0.00 61.69 59.95 1ss8 s THR 331 Cb -0.14 -0.92 -0.03 0.00 -1.51 0.00 0.00 72.50 69.91 1ss8 s THR 331 CO -0.00 0.33 0.13 -0.63 -2.21 0.00 0.00 174.62 172.23 1ss8 s ILE 332 N 1.02 4.67 -0.17 5.08 1.01 -0.01 -1.13 121.20 131.67 1ss8 s ILE 332 Ca -0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.38 1ss8 s ILE 332 Cb -0.15 -3.26 -0.00 0.00 0.01 0.00 0.00 42.46 39.06 1ss8 s ILE 332 CO -0.00 0.22 -0.13 -0.63 0.00 0.00 0.00 174.94 174.40 1ss8 s ILE 333 N 1.65 2.83 -0.44 2.92 1.01 0.59 -1.52 121.20 128.23 1ss8 s ILE 333 Ca 0.06 -0.70 -0.11 0.00 0.00 0.00 0.00 60.65 59.90 1ss8 s ILE 333 Cb -0.16 -2.22 0.01 0.00 0.01 0.00 0.00 42.46 40.10 1ss8 s ILE 333 CO 0.06 0.50 0.55 -0.67 0.00 0.00 0.00 174.94 175.38 1ss8 n ASP 334 N 4.25 -7.28 -4.77 3.58 -0.08 -0.05 -2.29 116.55 109.90 1ss8 n ASP 334 Ca -0.19 0.36 -0.39 0.00 -1.51 0.00 0.00 54.79 53.05 1ss8 n ASP 334 Cb 0.51 -4.90 -0.06 0.00 2.34 0.00 0.00 41.12 39.01 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 -2.53 2.90 0.51 0.27 0.00 -0.97 -1.74 107.32 105.76 1ss8 s GLY 335 Ca 0.17 0.35 0.23 0.00 0.00 0.00 0.00 44.72 45.48 1ss8 s GLY 335 CO 0.68 0.91 2.09 -2.08 0.00 0.00 0.00 173.10 174.71 1ss8 h VAL 336 N 3.46 0.75 -0.96 1.40 2.07 -1.39 -3.46 116.25 118.13 1ss8 h VAL 336 Ca -0.46 -0.42 -0.63 0.00 0.82 0.00 0.00 66.70 66.01 1ss8 h VAL 336 Cb 1.21 1.25 0.10 0.00 -1.52 0.00 0.00 31.29 32.33 1ss8 h VAL 336 CO 0.67 0.11 -0.51 0.61 0.02 0.00 0.00 177.57 178.46 1ss8 n GLY 337 N -0.97 -1.67 3.79 2.17 0.00 -0.77 -4.80 105.19 102.94 1ss8 n GLY 337 Ca -0.02 0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.94 4.41 0.40 1.61 2.02 -1.26 -4.89 118.70 120.06 1ss8 s GLU 338 Ca 0.60 1.30 0.07 0.00 0.02 0.00 0.00 54.97 56.96 1ss8 s GLU 338 Cb -0.86 -2.58 0.85 0.00 0.10 0.00 0.00 34.13 31.64 1ss8 s GLU 338 CO 0.53 0.12 2.03 0.93 0.02 0.00 0.00 175.26 178.89 1ss8 h GLU 339 N 2.70 0.57 0.12 1.61 4.39 -1.97 -1.18 114.58 120.82 1ss8 h GLU 339 Ca -0.48 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.18 1ss8 h GLU 339 Cb 1.19 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1ss8 h GLU 339 CO 0.63 0.38 -0.06 0.00 -1.16 0.00 0.00 179.01 178.80 1ss8 h ALA 340 N 1.71 -0.16 -0.57 3.43 0.00 -1.99 -1.59 119.26 120.08 1ss8 h ALA 340 Ca 0.20 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ss8 h ALA 340 Cb 0.06 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1ss8 h ALA 340 CO -0.05 -0.47 0.36 0.00 0.00 0.00 0.00 179.25 179.10 1ss8 h ALA 341 N 0.42 0.74 -0.53 0.00 0.00 -1.74 -1.04 119.26 117.11 1ss8 h ALA 341 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1ss8 h ALA 341 Cb 0.34 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1ss8 h ALA 341 CO 0.03 0.10 0.21 0.82 0.00 0.00 0.00 179.25 180.41 1ss8 h ILE 342 N 0.72 1.22 -0.85 0.00 2.04 -1.32 -2.38 117.51 116.93 1ss8 h ILE 342 Ca 0.22 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1ss8 h ILE 342 Cb -0.01 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 1ss8 h ILE 342 CO -0.08 0.25 0.41 1.56 0.00 0.00 0.00 178.15 180.29 1ss8 h GLN 343 N 0.71 1.23 -0.48 2.37 1.08 -0.81 -1.80 115.11 117.41 1ss8 h GLN 343 Ca 0.18 -0.18 -0.10 0.00 -1.45 0.00 0.00 58.65 57.10 1ss8 h GLN 343 Cb 0.19 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 1ss8 h GLN 343 CO -0.01 0.94 -0.09 0.78 -0.95 0.00 0.00 178.83 179.49 1ss8 h GLY 344 N 1.22 0.94 1.43 3.46 0.00 -1.12 -1.40 103.07 107.61 1ss8 h GLY 344 Ca 0.29 -0.72 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 1ss8 h GLY 344 CO -0.04 0.66 -0.02 -0.09 0.00 0.00 0.00 176.54 177.05 1ss8 h ARG 345 N 0.79 0.69 0.02 4.80 9.65 -1.23 -1.40 114.38 127.70 1ss8 h ARG 345 Ca 0.13 -0.18 -0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1ss8 h ARG 345 Cb 0.60 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1ss8 h ARG 345 CO 0.04 0.72 -0.01 0.28 2.80 0.00 0.00 179.97 183.81 1ss8 h VAL 346 N 0.65 1.27 -0.69 0.20 2.07 -1.03 -2.21 116.25 116.51 1ss8 h VAL 346 Ca 0.13 -0.88 0.06 0.00 0.82 0.00 0.00 66.70 66.83 1ss8 h VAL 346 Cb 0.44 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 1ss8 h VAL 346 CO 0.02 0.23 0.46 0.00 0.02 0.00 0.00 177.57 178.29 1ss8 h ALA 347 N 0.57 1.74 0.23 1.67 0.00 -1.26 0.06 119.26 122.27 1ss8 h ALA 347 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 347 Cb 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ss8 h ALA 347 CO 0.00 0.15 -0.11 1.96 0.00 0.00 0.00 179.25 181.26 1ss8 h GLN 348 N 0.71 -0.29 -0.48 0.00 4.20 -1.17 -2.63 115.11 115.44 1ss8 h GLN 348 Ca 0.30 0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.92 1ss8 h GLN 348 Cb 0.27 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1ss8 h GLN 348 CO -0.10 -0.17 -0.12 0.82 -0.67 0.00 0.00 178.83 178.59 1ss8 h ILE 349 N -0.34 1.27 0.00 2.54 2.04 -1.04 -2.33 117.51 119.66 1ss8 h ILE 349 Ca -0.03 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.58 1ss8 h ILE 349 Cb 0.26 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1ss8 h ILE 349 CO 0.05 0.43 0.01 -0.09 0.00 0.00 0.00 178.15 178.56 1ss8 h ARG 350 N 0.79 0.00 0.05 2.37 2.43 -0.98 0.51 114.38 119.55 1ss8 h ARG 350 Ca 0.12 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.98 1ss8 h ARG 350 Cb 0.67 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1ss8 h ARG 350 CO 0.05 0.00 -1.72 1.96 -1.51 0.00 0.00 179.97 178.75 1ss8 h GLN 351 N 0.00 0.11 -0.02 0.20 1.08 -1.04 -3.20 115.11 112.23 1ss8 h GLN 351 Ca 0.00 -0.19 -0.10 0.00 -1.45 0.00 0.00 58.65 56.91 1ss8 h GLN 351 Cb 0.02 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 1ss8 h GLN 351 CO 0.00 0.81 -0.44 1.96 -0.95 0.00 0.00 178.83 180.21 1ss8 h GLN 352 N 0.03 0.04 -0.58 1.46 4.20 -0.49 -1.65 115.11 118.12 1ss8 h GLN 352 Ca -0.30 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.46 1ss8 h GLN 352 Cb 2.01 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.75 1ss8 h GLN 352 CO 0.10 0.48 0.39 0.82 -0.67 0.00 0.00 178.83 179.94 1ss8 h ILE 353 N 0.04 0.95 0.00 2.54 2.04 -1.25 0.39 117.51 122.22 1ss8 h ILE 353 Ca -0.00 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 1ss8 h ILE 353 Cb 0.80 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1ss8 h ILE 353 CO 0.06 0.09 -0.26 -0.33 0.00 0.00 0.00 178.15 177.71 1ss8 h GLU 354 N 0.48 0.00 -0.01 2.37 4.39 -1.29 -3.32 114.58 117.20 1ss8 h GLU 354 Ca 0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1ss8 h GLU 354 Cb 0.39 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1ss8 h GLU 354 CO -0.07 0.26 0.00 0.39 -1.16 0.00 0.00 179.01 178.43 1ss8 n GLU 355 N -3.93 0.69 -1.67 2.33 1.02 -0.81 -5.00 120.64 113.28 1ss8 n GLU 355 Ca -0.02 -0.94 -0.47 0.00 -0.02 0.00 0.00 57.16 55.71 1ss8 n GLU 355 Cb 0.34 -1.01 -0.04 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 -0.17 1.13 -0.70 0.62 0.00 0.06 -4.88 120.51 116.58 1ss8 n ALA 356 Ca 0.00 0.43 0.08 0.00 0.00 0.00 0.00 53.44 53.95 1ss8 n ALA 356 Cb 0.11 -2.35 0.28 0.00 0.00 0.00 0.00 19.45 17.50 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 3.60 1.93 -3.85 0.00 -2.24 -1.26 -4.96 114.28 107.50 1ss8 n THR 357 Ca 0.18 -1.43 -0.12 0.00 -2.27 0.00 0.00 64.05 60.41 1ss8 n THR 357 Cb 0.28 0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.41 1ss8 n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ss8 s SER 358 N -1.30 -0.06 0.17 3.42 0.15 -1.26 -5.06 113.70 109.77 1ss8 s SER 358 Ca 0.42 0.07 -0.19 0.00 0.70 0.00 0.00 55.95 56.95 1ss8 s SER 358 Cb 0.30 0.23 0.09 0.00 -1.71 0.00 0.00 66.02 64.93 1ss8 s SER 358 CO 0.16 -0.15 1.63 0.44 1.20 0.00 0.00 173.24 176.52 1ss8 h ASP 359 N 5.39 -0.69 -0.19 5.45 3.32 -2.00 -2.79 116.42 124.91 1ss8 h ASP 359 Ca -0.27 0.15 0.03 0.00 0.02 0.00 0.00 57.03 56.96 1ss8 h ASP 359 Cb 1.20 0.37 -0.02 0.00 0.22 0.00 0.00 39.33 41.09 1ss8 h ASP 359 CO 0.42 -0.24 0.03 0.22 -1.72 0.00 0.00 179.24 177.95 1ss8 h TYR 360 N -0.14 0.05 -0.80 4.55 3.20 -2.00 -1.84 116.97 119.99 1ss8 h TYR 360 Ca 0.19 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.14 1ss8 h TYR 360 Cb 0.43 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.65 1ss8 h TYR 360 CO -0.44 0.01 0.48 -0.44 -1.64 0.00 0.00 178.16 176.13 1ss8 h ASP 361 N 0.10 0.73 0.58 -2.11 5.19 -1.96 -1.90 116.42 117.05 1ss8 h ASP 361 Ca 0.08 0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 1ss8 h ASP 361 Cb 0.08 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1ss8 h ASP 361 CO -0.12 0.46 -0.51 -0.09 -3.12 0.00 0.00 179.24 175.86 1ss8 h ARG 362 N 0.86 -1.03 -0.74 3.56 2.43 -1.22 -1.93 114.38 116.32 1ss8 h ARG 362 Ca 0.36 0.07 0.09 0.00 -0.81 0.00 0.00 59.98 59.69 1ss8 h ARG 362 Cb 0.22 0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 29.93 1ss8 h ARG 362 CO -0.19 -0.68 0.38 0.93 -1.51 0.00 0.00 179.97 178.90 1ss8 h GLU 363 N -1.07 0.63 -0.27 0.20 5.08 -1.05 -0.04 114.58 118.06 1ss8 h GLU 363 Ca -0.07 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1ss8 h GLU 363 Cb 0.91 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1ss8 h GLU 363 CO -0.02 0.42 -0.09 0.87 -1.00 0.00 0.00 179.01 179.18 1ss8 h LYS 364 N 0.65 0.45 0.02 2.33 1.79 -1.26 -0.83 116.57 119.71 1ss8 h LYS 364 Ca 0.36 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.72 1ss8 h LYS 364 Cb 0.36 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1ss8 h LYS 364 CO -0.26 0.55 -0.01 -0.07 -1.08 0.00 0.00 179.45 178.58 1ss8 h LEU 365 N 0.42 -0.02 -1.74 2.94 3.38 -0.82 -3.10 115.31 116.37 1ss8 h LEU 365 Ca 0.08 -0.62 0.23 0.00 0.09 0.00 0.00 57.88 57.66 1ss8 h LEU 365 Cb 0.43 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 1ss8 h LEU 365 CO 0.02 0.63 0.61 1.56 0.09 0.00 0.00 178.44 181.35 1ss8 h GLN 366 N -0.68 0.20 -0.18 1.13 4.20 -0.75 0.61 115.11 119.64 1ss8 h GLN 366 Ca -0.00 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.55 1ss8 h GLN 366 Cb 0.64 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 1ss8 h GLN 366 CO 0.00 0.13 -0.51 0.93 -0.67 0.00 0.00 178.83 178.72 1ss8 h GLU 367 N 0.21 0.50 -0.13 1.46 5.08 -1.21 -2.38 114.58 118.11 1ss8 h GLU 367 Ca 0.45 -0.30 -0.18 0.00 -1.00 0.00 0.00 59.36 58.33 1ss8 h GLU 367 Cb 1.41 0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.70 1ss8 h GLU 367 CO -0.10 0.89 -0.62 0.00 -1.00 0.00 0.00 179.01 178.19 1ss8 h ARG 368 N 0.40 0.65 -0.38 2.33 3.08 -0.83 -2.80 114.38 116.83 1ss8 h ARG 368 Ca 0.02 -0.52 -0.01 0.00 0.07 0.00 0.00 59.98 59.53 1ss8 h ARG 368 Cb 1.03 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.17 1ss8 h ARG 368 CO 0.09 1.14 0.19 -0.39 -1.07 0.00 0.00 179.97 179.93 1ss8 h VAL 369 N 0.32 1.16 -0.75 2.04 -1.51 -1.38 -2.32 116.25 113.81 1ss8 h VAL 369 Ca -0.04 -0.46 0.12 0.00 -1.23 0.00 0.00 66.70 65.09 1ss8 h VAL 369 Cb 1.25 0.78 -0.08 0.00 -2.13 0.00 0.00 31.29 31.11 1ss8 h VAL 369 CO 0.13 0.17 0.35 0.00 -1.23 0.00 0.00 177.57 176.99 1ss8 h ALA 370 N 1.04 1.06 0.68 5.19 0.00 -1.43 0.41 119.26 126.21 1ss8 h ALA 370 Ca 0.13 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1ss8 h ALA 370 Cb 0.11 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ss8 h ALA 370 CO -0.02 -0.11 -0.33 0.87 0.00 0.00 0.00 179.25 179.67 1ss8 h LYS 371 N 0.56 -0.88 0.12 0.00 1.57 -1.27 -0.80 116.57 115.87 1ss8 h LYS 371 Ca 0.39 0.06 0.01 0.00 -1.87 0.00 0.00 60.65 59.24 1ss8 h LYS 371 Cb 0.50 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 1ss8 h LYS 371 CO -0.33 -0.56 -0.14 1.25 -0.57 0.00 0.00 179.45 179.11 1ss8 h LEU 372 N -1.17 -0.37 -0.45 2.94 5.85 -1.12 -2.89 115.31 118.11 1ss8 h LEU 372 Ca -0.09 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1ss8 h LEU 372 Cb 0.73 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.89 1ss8 h LEU 372 CO 0.15 -0.21 -0.00 0.00 -0.34 0.00 0.00 178.44 178.04 1ss8 n ALA 373 N -2.36 2.64 0.02 1.25 0.00 0.14 -3.99 120.51 118.21 1ss8 n ALA 373 Ca -0.07 -0.31 -0.05 0.00 0.00 0.00 0.00 53.44 53.00 1ss8 n ALA 373 Cb 0.18 -1.35 -0.11 0.00 0.00 0.00 0.00 19.45 18.17 1ss8 n ALA 373 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ss8 h GLY 374 N 4.93 0.00 0.00 0.00 0.00 -0.91 -3.49 103.07 103.60 1ss8 h GLY 374 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ss8 h GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1ss8 n GLY 375 N 1.46 0.04 2.83 4.60 0.00 -1.23 -4.89 105.19 108.00 1ss8 n GLY 375 Ca -0.11 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.82 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 0.15 -0.04 1.61 1.01 -0.87 -4.43 120.40 117.83 1ss8 s VAL 376 Ca 0.00 0.07 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 1ss8 s VAL 376 Cb 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.12 1ss8 s VAL 376 CO 0.00 0.13 0.89 0.00 0.00 0.00 0.00 175.10 176.12 1ss8 s ALA 377 N 0.87 3.27 -0.38 5.51 0.00 -0.12 -1.56 121.76 129.34 1ss8 s ALA 377 Ca -0.09 0.37 -0.08 0.00 0.00 0.00 0.00 51.96 52.16 1ss8 s ALA 377 Cb -0.12 -3.24 0.06 0.00 0.00 0.00 0.00 23.12 19.83 1ss8 s ALA 377 CO -0.02 -0.27 0.19 0.08 0.00 0.00 0.00 175.76 175.74 1ss8 s VAL 378 N 1.17 4.02 -0.35 0.00 1.01 0.98 -0.74 120.40 126.48 1ss8 s VAL 378 Ca 0.46 -1.30 -0.26 0.00 0.00 0.00 0.00 61.98 60.88 1ss8 s VAL 378 Cb -0.19 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.80 1ss8 s VAL 378 CO 0.23 -0.38 0.92 -0.63 0.00 0.00 0.00 175.10 175.25 1ss8 s ILE 379 N 1.41 4.60 -0.29 2.22 1.01 0.04 -2.35 121.20 127.84 1ss8 s ILE 379 Ca 0.02 1.25 -0.10 0.00 0.00 0.00 0.00 60.65 61.82 1ss8 s ILE 379 Cb -0.21 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 37.92 1ss8 s ILE 379 CO 0.02 -0.49 0.15 -0.54 0.00 0.00 0.00 174.94 174.08 1ss8 s LYS 380 N 3.42 3.57 -0.18 2.79 -0.14 0.11 -1.10 119.74 128.20 1ss8 s LYS 380 Ca 0.38 -0.56 -0.23 0.00 -1.36 0.00 0.00 55.97 54.19 1ss8 s LYS 380 Cb -0.12 -3.57 -0.02 0.00 -1.68 0.00 0.00 37.83 32.44 1ss8 s LYS 380 CO 0.17 -0.32 0.74 0.08 -0.76 0.00 0.00 175.35 175.27 1ss8 s VAL 381 N 1.66 4.94 0.13 3.17 1.01 -0.99 -0.66 120.40 129.66 1ss8 s VAL 381 Ca 0.06 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.51 1ss8 s VAL 381 Cb -0.16 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1ss8 s VAL 381 CO 0.07 0.06 0.14 -0.83 0.00 0.00 0.00 175.10 174.54 1ss8 s GLY 382 N 1.18 1.84 0.10 4.51 0.00 -1.24 -1.13 107.32 112.59 1ss8 s GLY 382 Ca 0.34 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.92 1ss8 s GLY 382 CO 0.11 -1.10 0.19 0.00 0.00 0.00 0.00 173.10 172.30 1ss8 n ALA 383 N -0.09 -0.41 -0.00 3.20 0.00 -1.10 -4.72 120.51 117.40 1ss8 n ALA 383 Ca -0.08 -0.34 -0.15 0.00 0.00 0.00 0.00 53.44 52.87 1ss8 n ALA 383 Cb 0.53 0.27 -0.14 0.00 0.00 0.00 0.00 19.45 20.12 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 1.94 0.59 -2.20 0.00 0.00 -1.87 -3.33 119.26 114.39 1ss8 h ALA 384 Ca -0.08 -1.42 -0.38 0.00 0.00 0.00 0.00 54.91 53.03 1ss8 h ALA 384 Cb 0.32 0.59 -0.14 0.00 0.00 0.00 0.00 17.79 18.55 1ss8 h ALA 384 CO 0.11 1.44 -0.65 0.95 0.00 0.00 0.00 179.25 181.10 1ss8 s THR 385 N -2.58 0.98 0.20 0.00 -4.23 -1.26 -5.03 115.64 103.72 1ss8 s THR 385 Ca -0.13 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.25 1ss8 s THR 385 Cb 0.07 -2.42 0.13 0.00 1.34 0.00 0.00 72.50 71.63 1ss8 s THR 385 CO 0.80 -0.26 1.82 -0.08 -0.54 0.00 0.00 174.62 176.37 1ss8 h GLU 386 N 2.43 0.72 -0.41 3.99 4.81 -1.99 -1.85 114.58 122.27 1ss8 h GLU 386 Ca -0.38 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1ss8 h GLU 386 Cb 1.23 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1ss8 h GLU 386 CO 0.65 0.48 0.24 0.28 -0.73 0.00 0.00 179.01 179.92 1ss8 h VAL 387 N 0.74 1.03 -0.54 0.32 2.07 -1.99 -0.96 116.25 116.92 1ss8 h VAL 387 Ca 0.28 -0.16 -0.12 0.00 0.82 0.00 0.00 66.70 67.52 1ss8 h VAL 387 Cb 0.10 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1ss8 h VAL 387 CO -0.14 0.09 -0.11 -0.33 0.02 0.00 0.00 177.57 177.09 1ss8 h GLU 388 N 0.48 1.03 0.02 1.57 5.08 -1.91 -2.53 114.58 118.32 1ss8 h GLU 388 Ca 0.17 -0.39 0.02 0.00 -1.00 0.00 0.00 59.36 58.16 1ss8 h GLU 388 Cb 0.03 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1ss8 h GLU 388 CO -0.09 1.08 -0.12 1.98 -1.00 0.00 0.00 179.01 180.86 1ss8 h MET 389 N 0.91 -0.20 -0.03 2.33 4.05 -1.02 -1.48 114.93 119.49 1ss8 h MET 389 Ca 0.14 0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 59.53 1ss8 h MET 389 Cb 0.69 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1ss8 h MET 389 CO 0.05 -0.13 -0.20 0.87 0.23 0.00 0.00 176.91 177.72 1ss8 h LYS 390 N -0.21 0.05 -0.09 0.39 1.79 -1.06 0.12 116.57 117.56 1ss8 h LYS 390 Ca 0.04 -0.01 -0.19 0.00 -2.18 0.00 0.00 60.65 58.31 1ss8 h LYS 390 Cb 0.25 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 30.91 1ss8 h LYS 390 CO -0.11 0.26 -0.67 0.93 -1.08 0.00 0.00 179.45 178.78 1ss8 h GLU 391 N 0.05 0.61 -0.74 3.15 5.08 -1.27 -2.89 114.58 118.57 1ss8 h GLU 391 Ca 0.01 -0.54 -0.02 0.00 -1.00 0.00 0.00 59.36 57.81 1ss8 h GLU 391 Cb 0.39 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 1ss8 h GLU 391 CO 0.03 1.16 0.40 -0.22 -1.00 0.00 0.00 179.01 179.37 1ss8 h LYS 392 N 0.24 1.03 -0.26 2.33 3.64 -0.94 -0.97 116.57 121.64 1ss8 h LYS 392 Ca -0.06 -0.12 0.02 0.00 -1.27 0.00 0.00 60.65 59.22 1ss8 h LYS 392 Cb 1.32 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 1ss8 h LYS 392 CO 0.14 0.76 0.12 -0.22 -2.27 0.00 0.00 179.45 177.98 1ss8 h LYS 393 N 1.04 0.25 -0.67 1.90 3.64 -0.96 0.19 116.57 121.96 1ss8 h LYS 393 Ca 0.26 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1ss8 h LYS 393 Cb 0.04 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1ss8 h LYS 393 CO -0.04 0.17 0.19 0.00 -2.27 0.00 0.00 179.45 177.50 1ss8 h ALA 394 N 1.14 0.88 -0.63 5.00 0.00 -1.27 0.21 119.26 124.58 1ss8 h ALA 394 Ca 0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ss8 h ALA 394 Cb 0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1ss8 h ALA 394 CO -0.08 0.57 0.37 0.00 0.00 0.00 0.00 179.25 180.11 1ss8 h ARG 395 N 0.98 0.86 -0.57 0.00 3.08 -0.69 -0.23 114.38 117.81 1ss8 h ARG 395 Ca 0.21 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 1ss8 h ARG 395 Cb 0.33 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1ss8 h ARG 395 CO -0.00 0.62 0.23 0.28 -1.07 0.00 0.00 179.97 180.02 1ss8 h VAL 396 N 0.85 1.22 -0.74 2.04 2.07 -0.19 0.50 116.25 122.01 1ss8 h VAL 396 Ca 0.22 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 1ss8 h VAL 396 Cb -0.01 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 1ss8 h VAL 396 CO -0.04 0.27 0.46 -0.33 0.02 0.00 0.00 177.57 177.95 1ss8 h GLU 397 N 0.78 1.00 0.28 1.57 5.08 0.04 0.25 114.58 123.58 1ss8 h GLU 397 Ca 0.19 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1ss8 h GLU 397 Cb 0.20 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ss8 h GLU 397 CO -0.02 0.70 -0.13 -0.44 -1.00 0.00 0.00 179.01 178.12 1ss8 h ASP 398 N 1.01 -0.31 -0.87 1.42 3.32 -0.86 -2.67 116.42 117.46 1ss8 h ASP 398 Ca 0.27 -0.14 0.08 0.00 0.02 0.00 0.00 57.03 57.26 1ss8 h ASP 398 Cb -0.05 0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.52 1ss8 h ASP 398 CO -0.05 -0.03 0.57 0.00 -1.72 0.00 0.00 179.24 178.01 1ss8 h ALA 399 N 0.04 1.61 -0.41 3.45 0.00 -0.46 -0.39 119.26 123.11 1ss8 h ALA 399 Ca -0.04 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ss8 h ALA 399 Cb 0.44 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1ss8 h ALA 399 CO 0.06 0.23 0.27 1.25 0.00 0.00 0.00 179.25 181.06 1ss8 h LEU 400 N 0.91 0.46 -0.64 0.00 5.85 -0.43 0.53 115.31 121.98 1ss8 h LEU 400 Ca 0.39 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 59.03 1ss8 h LEU 400 Cb 0.33 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1ss8 h LEU 400 CO -0.16 0.33 0.12 0.45 -0.34 0.00 0.00 178.44 178.85 1ss8 h HIS 401 N 0.55 1.12 -0.42 1.25 3.86 -0.77 0.83 115.15 121.57 1ss8 h HIS 401 Ca 0.15 -0.15 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1ss8 h HIS 401 Cb -0.06 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.08 1ss8 h HIS 401 CO -0.05 0.94 0.23 0.00 0.86 0.00 0.00 177.93 179.91 1ss8 h ALA 402 N 1.04 0.54 0.06 2.45 0.00 -1.02 -1.35 119.26 120.98 1ss8 h ALA 402 Ca 0.20 -0.09 -0.27 0.00 0.00 0.00 0.00 54.91 54.75 1ss8 h ALA 402 Cb 0.41 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1ss8 h ALA 402 CO 0.01 0.06 -1.12 1.15 0.00 0.00 0.00 179.25 179.36 1ss8 h THR 403 N 0.54 1.34 -0.56 0.00 2.02 -0.35 0.20 112.91 116.10 1ss8 h THR 403 Ca 0.15 -2.49 0.11 0.00 0.77 0.00 0.00 66.41 64.95 1ss8 h THR 403 Cb 0.06 2.58 -0.11 0.00 -1.74 0.00 0.00 68.15 68.94 1ss8 h THR 403 CO -0.02 0.75 -0.27 -0.09 0.37 0.00 0.00 175.52 176.26 1ss8 h ARG 404 N 0.26 -0.12 -0.63 6.66 1.12 -0.79 -0.11 114.38 120.76 1ss8 h ARG 404 Ca -0.14 0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.69 1ss8 h ARG 404 Cb 1.78 0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 31.74 1ss8 h ARG 404 CO 0.21 -0.08 0.19 0.00 -3.11 0.00 0.00 179.97 177.17 1ss8 h ALA 405 N 1.16 1.14 -0.09 2.80 0.00 -0.64 -2.65 119.26 120.99 1ss8 h ALA 405 Ca 0.24 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1ss8 h ALA 405 Cb 0.52 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ss8 h ALA 405 CO -0.64 0.59 -0.39 0.00 0.00 0.00 0.00 179.25 178.81 1ss8 h ALA 406 N 1.27 1.18 0.00 0.00 0.00 0.54 -2.12 119.26 120.14 1ss8 h ALA 406 Ca 0.21 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1ss8 h ALA 406 Cb 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ss8 h ALA 406 CO -0.01 0.56 0.00 -0.39 0.00 0.00 0.00 179.25 179.41 1ss8 h VAL 407 N 0.17 0.00 0.04 0.00 -1.51 -0.71 -1.21 116.25 113.03 1ss8 h VAL 407 Ca 0.02 -0.57 -0.12 0.00 -1.23 0.00 0.00 66.70 64.80 1ss8 h VAL 407 Cb 0.76 1.51 0.01 0.00 -2.13 0.00 0.00 31.29 31.45 1ss8 h VAL 407 CO 0.06 0.00 -0.48 -0.33 -1.23 0.00 0.00 177.57 175.59 1ss8 h GLU 408 N 0.00 0.25 0.00 5.19 5.08 -1.22 -3.42 114.58 120.46 1ss8 h GLU 408 Ca 0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1ss8 h GLU 408 Cb 0.66 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1ss8 h GLU 408 CO 0.00 1.07 0.00 0.39 -1.00 0.00 0.00 179.01 179.47 1ss8 n GLU 409 N -4.33 -0.01 0.00 2.33 1.02 -1.10 -5.09 120.64 113.46 1ss8 n GLU 409 Ca -0.11 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 1ss8 n GLU 409 Cb 0.64 -0.54 0.00 0.00 -0.02 0.00 0.00 31.44 31.52 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 -0.01 -1.77 3.12 0.62 0.00 -0.46 -4.59 105.19 102.11 1ss8 n GLY 410 Ca 0.00 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.17 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 0.63 0.16 1.61 0.11 -0.90 -0.19 120.40 121.82 1ss8 s VAL 411 Ca 0.00 -1.56 -0.16 0.00 -2.93 0.00 0.00 61.98 57.33 1ss8 s VAL 411 Cb 0.00 -1.22 0.03 0.00 -1.53 0.00 0.00 36.38 33.66 1ss8 s VAL 411 CO 0.00 -0.66 0.44 0.68 -3.33 0.00 0.00 175.10 172.24 1ss8 s VAL 412 N -2.63 0.05 -0.06 2.04 -7.23 -0.47 -1.86 120.40 110.23 1ss8 s VAL 412 Ca 0.02 -0.77 -0.36 0.00 -1.81 0.00 0.00 61.98 59.06 1ss8 s VAL 412 Cb -0.01 -1.43 -0.14 0.00 0.56 0.00 0.00 36.38 35.35 1ss8 s VAL 412 CO -0.02 -0.23 1.68 0.00 -0.31 0.00 0.00 175.10 176.22 1ss8 n ALA 413 N -0.28 0.31 -1.14 1.32 0.00 -1.26 -1.42 120.51 118.04 1ss8 n ALA 413 Ca -0.12 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1ss8 n ALA 413 Cb 0.63 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 3.80 -0.48 3.26 0.00 0.00 0.12 -1.74 105.19 110.14 1ss8 n GLY 414 Ca 0.22 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.52 2.64 -0.02 0.00 -1.26 -0.29 105.19 110.75 1ss8 n GLY 415 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1ss8 n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 416 N -1.51 2.60 0.05 -0.02 0.00 -1.26 -4.57 105.19 100.48 1ss8 n GLY 416 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 1.17 -0.59 1.61 2.07 -0.81 -2.96 116.25 116.75 1ss8 h VAL 417 Ca 0.00 -0.50 0.12 0.00 0.82 0.00 0.00 66.70 67.13 1ss8 h VAL 417 Cb 0.00 1.49 -0.11 0.00 -1.52 0.00 0.00 31.29 31.15 1ss8 h VAL 417 CO 0.00 0.13 -0.15 0.00 0.02 0.00 0.00 177.57 177.57 1ss8 h ALA 418 N 0.79 0.38 -0.74 1.67 0.00 -1.52 -0.19 119.26 119.66 1ss8 h ALA 418 Ca 0.00 0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1ss8 h ALA 418 Cb 0.21 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1ss8 h ALA 418 CO -0.00 -0.43 0.32 -0.07 0.00 0.00 0.00 179.25 179.07 1ss8 h LEU 419 N -0.00 1.00 -0.37 0.00 3.38 -1.84 -0.66 115.31 116.81 1ss8 h LEU 419 Ca 0.28 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1ss8 h LEU 419 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1ss8 h LEU 419 CO -0.61 0.88 -0.48 -0.29 0.09 0.00 0.00 178.44 178.03 1ss8 h ILE 420 N 1.05 0.92 -0.11 1.22 2.10 -1.22 -1.91 117.51 119.57 1ss8 h ILE 420 Ca 0.25 -2.02 -0.06 0.00 1.08 0.00 0.00 64.86 64.11 1ss8 h ILE 420 Cb 0.17 2.26 -0.00 0.00 -1.09 0.00 0.00 36.82 38.16 1ss8 h ILE 420 CO -0.03 0.47 -0.18 -0.09 -1.08 0.00 0.00 178.15 177.25 1ss8 h ARG 421 N 0.00 0.31 -0.39 2.19 9.65 -0.21 -1.44 114.38 124.49 1ss8 h ARG 421 Ca -0.00 -0.19 -0.10 0.00 -1.10 0.00 0.00 59.98 58.58 1ss8 h ARG 421 Cb 1.22 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.80 1ss8 h ARG 421 CO 0.06 0.78 -0.17 -0.39 2.80 0.00 0.00 179.97 183.04 1ss8 h VAL 422 N -0.12 1.26 -0.34 0.20 -1.51 -1.14 -2.87 116.25 111.73 1ss8 h VAL 422 Ca 0.01 -1.25 0.04 0.00 -1.23 0.00 0.00 66.70 64.27 1ss8 h VAL 422 Cb 0.75 1.15 -0.04 0.00 -2.13 0.00 0.00 31.29 31.02 1ss8 h VAL 422 CO 0.04 0.42 0.11 0.00 -1.23 0.00 0.00 177.57 176.91 1ss8 h ALA 423 N 1.14 0.39 0.00 5.19 0.00 -1.19 -2.28 119.26 122.52 1ss8 h ALA 423 Ca 0.10 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 423 Cb 0.66 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ss8 h ALA 423 CO 0.05 -0.29 -0.01 0.66 0.00 0.00 0.00 179.25 179.66 1ss8 h SER 424 N 0.25 0.00 1.18 0.00 4.64 -1.05 0.29 113.55 118.85 1ss8 h SER 424 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1ss8 h SER 424 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1ss8 h SER 424 CO -0.17 0.01 0.00 0.29 -0.87 0.00 0.00 176.83 176.09 1ss8 n LYS 425 N -3.22 0.11 -0.70 4.77 5.02 -0.86 -4.04 118.16 119.24 1ss8 n LYS 425 Ca -0.02 0.11 0.09 0.00 -2.02 0.00 0.00 58.31 56.46 1ss8 n LYS 425 Cb 0.12 -1.63 0.37 0.00 -0.02 0.00 0.00 35.03 33.87 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 -1.83 5.06 0.28 -0.35 4.77 0.10 -4.61 117.00 120.42 1ss8 n LEU 426 Ca 0.06 -2.61 0.13 0.00 -0.03 0.00 0.00 56.01 53.56 1ss8 n LEU 426 Cb 0.37 -0.61 0.81 0.00 -2.33 0.00 0.00 43.42 41.66 1ss8 n LEU 426 CO 0.28 0.76 1.10 0.00 -1.33 0.00 0.00 177.39 178.19 1ss8 h ALA 427 N 4.03 1.67 -0.01 -1.18 0.00 -1.70 0.13 119.26 122.20 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 1.62 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1ss8 h ALA 427 CO 0.31 0.01 -0.12 -0.25 0.00 0.00 0.00 179.25 179.20 1ss8 n ASP 428 N -4.07 0.78 -4.74 0.00 8.00 -1.26 -4.95 116.55 110.31 1ss8 n ASP 428 Ca -0.03 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.20 1ss8 n ASP 428 Cb 0.10 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 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 -2.36 4.36 0.28 0.64 2.96 0.03 -5.02 118.68 119.56 1ss8 s LEU 429 Ca 0.31 2.88 0.04 0.00 -0.22 0.00 0.00 54.13 57.14 1ss8 s LEU 429 Cb 0.20 -3.62 -0.06 0.00 0.50 0.00 0.00 46.19 43.22 1ss8 s LEU 429 CO 0.46 -0.93 0.01 -0.13 -1.32 0.00 0.00 176.35 174.44 1ss8 s ARG 430 N 0.32 1.51 0.00 1.98 1.81 -1.26 -4.98 118.95 118.33 1ss8 s ARG 430 Ca 0.68 -1.80 0.00 0.00 -1.72 0.00 0.00 55.73 52.90 1ss8 s ARG 430 Cb -0.48 -0.84 0.00 0.00 -0.45 0.00 0.00 34.95 33.18 1ss8 s ARG 430 CO 0.40 -0.10 0.00 0.41 -0.68 0.00 0.00 175.30 175.33 1ss8 n GLY 431 N -0.56 6.63 0.21 -3.53 0.00 -1.26 -5.02 105.19 101.65 1ss8 n GLY 431 Ca -0.04 -1.94 0.07 0.00 0.00 0.00 0.00 46.02 44.11 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 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ss8 h GLN 432 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1ss8 h GLN 432 CO 0.00 0.30 0.00 0.27 -0.67 0.00 0.00 178.83 178.73 1ss8 n ASN 433 N -3.63 0.00 0.01 1.46 0.23 -1.26 -5.05 115.26 107.02 1ss8 n ASN 433 Ca -0.01 -0.74 -0.15 0.00 -0.53 0.00 0.00 54.58 53.15 1ss8 n ASN 433 Cb 0.43 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.08 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 0.67 -0.19 -3.83 4.57 -1.99 -1.43 114.58 112.37 1ss8 h GLU 434 Ca 0.00 -0.57 -0.08 0.00 -1.18 0.00 0.00 59.36 57.53 1ss8 h GLU 434 Cb 0.00 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1ss8 h GLU 434 CO 0.00 1.18 -0.24 -0.44 -1.18 0.00 0.00 179.01 178.33 1ss8 h ASP 435 N 0.44 0.34 0.03 1.04 3.32 -1.96 -1.38 116.42 118.25 1ss8 h ASP 435 Ca -0.06 -0.10 -0.12 0.00 0.02 0.00 0.00 57.03 56.77 1ss8 h ASP 435 Cb 1.42 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.87 1ss8 h ASP 435 CO 0.16 0.59 -0.37 1.56 -1.72 0.00 0.00 179.24 179.46 1ss8 h GLN 436 N 0.31 0.46 -0.62 3.56 4.20 -1.64 -0.97 115.11 120.41 1ss8 h GLN 436 Ca 0.05 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.50 1ss8 h GLN 436 Cb 0.60 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 1ss8 h GLN 436 CO 0.04 0.76 0.22 -0.91 -0.67 0.00 0.00 178.83 178.28 1ss8 h ASN 437 N 0.39 0.87 0.22 1.46 -0.26 -0.25 -1.35 115.58 116.66 1ss8 h ASN 437 Ca 0.04 -0.19 -0.12 0.00 -0.56 0.00 0.00 56.30 55.48 1ss8 h ASN 437 Cb 0.83 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.85 1ss8 h ASN 437 CO 0.07 0.83 -0.44 -0.37 -1.06 0.00 0.00 177.43 176.46 1ss8 h VAL 438 N 0.87 1.32 -0.53 2.81 -1.51 -1.14 -1.78 116.25 116.30 1ss8 h VAL 438 Ca 0.20 -1.59 0.09 0.00 -1.23 0.00 0.00 66.70 64.17 1ss8 h VAL 438 Cb 0.24 1.71 -0.11 0.00 -2.13 0.00 0.00 31.29 31.01 1ss8 h VAL 438 CO -0.01 0.48 -0.35 1.23 -1.23 0.00 0.00 177.57 177.68 1ss8 h GLY 439 N 1.24 -0.22 0.35 5.19 0.00 -0.80 0.12 103.07 108.95 1ss8 h GLY 439 Ca 0.02 0.45 0.06 0.00 0.00 0.00 0.00 47.33 47.86 1ss8 h GLY 439 CO 0.07 -0.20 -0.11 -2.22 0.00 0.00 0.00 176.54 174.08 1ss8 h ILE 440 N -0.21 0.63 -0.58 2.60 2.04 -0.72 -1.60 117.51 119.66 1ss8 h ILE 440 Ca 0.20 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.11 1ss8 h ILE 440 Cb 0.55 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1ss8 h ILE 440 CO -0.64 0.00 0.39 0.11 0.00 0.00 0.00 178.15 178.01 1ss8 h LYS 441 N -0.06 0.60 -0.18 2.37 1.79 -0.75 -1.35 116.57 118.98 1ss8 h LYS 441 Ca 0.14 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.57 1ss8 h LYS 441 Cb 0.28 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1ss8 h LYS 441 CO -0.32 0.39 0.08 0.28 -1.08 0.00 0.00 179.45 178.81 1ss8 h VAL 442 N 0.61 1.13 -0.11 0.50 2.07 0.19 -0.29 116.25 120.36 1ss8 h VAL 442 Ca 0.24 -0.39 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1ss8 h VAL 442 Cb 0.20 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1ss8 h VAL 442 CO -0.07 0.13 -0.00 0.00 0.02 0.00 0.00 177.57 177.64 1ss8 h ALA 443 N 0.95 0.09 -0.87 1.67 0.00 -1.13 -1.45 119.26 118.52 1ss8 h ALA 443 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ss8 h ALA 443 Cb 0.12 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1ss8 h ALA 443 CO -0.01 -0.46 0.53 -0.07 0.00 0.00 0.00 179.25 179.24 1ss8 h LEU 444 N 0.04 1.05 -0.47 0.00 3.38 -0.95 -1.59 115.31 116.76 1ss8 h LEU 444 Ca 0.05 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1ss8 h LEU 444 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1ss8 h LEU 444 CO -0.09 0.80 -0.75 -0.09 0.09 0.00 0.00 178.44 178.40 1ss8 h ARG 445 N 1.20 0.14 0.00 1.13 2.43 -0.96 -2.72 114.38 115.61 1ss8 h ARG 445 Ca 0.31 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 59.29 1ss8 h ARG 445 Cb -0.05 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1ss8 h ARG 445 CO -0.06 0.83 -0.31 0.00 -1.51 0.00 0.00 179.97 178.92 1ss8 h ALA 446 N 1.13 1.48 0.00 2.80 0.00 -0.71 -1.81 119.26 122.15 1ss8 h ALA 446 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ss8 h ALA 446 Cb 1.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ss8 h ALA 446 CO 0.11 0.38 0.00 0.52 0.00 0.00 0.00 179.25 180.26 1ss8 h MET 447 N 0.00 0.00 0.00 0.00 2.86 -0.97 0.85 114.93 117.68 1ss8 h MET 447 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1ss8 h MET 447 Cb 0.55 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.21 1ss8 h MET 447 CO 0.04 0.00 0.00 0.93 1.06 0.00 0.00 176.91 178.94 1ss8 h GLU 448 N 0.00 0.00 -0.28 1.72 5.08 -1.43 -3.36 114.58 116.30 1ss8 h GLU 448 Ca 0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1ss8 h GLU 448 Cb 0.18 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 1ss8 h GLU 448 CO 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 179.01 177.92 1ss8 h ALA 449 N 2.22 0.16 -0.03 3.43 0.00 -0.94 -1.20 119.26 122.90 1ss8 h ALA 449 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1ss8 h ALA 449 Cb 0.83 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1ss8 h ALA 449 CO 0.00 -0.48 -0.31 -1.35 0.00 0.00 0.00 179.25 177.11 1ss8 h PRO 450 N -0.03 -0.43 -0.35 0.00 0.11 -1.79 0.29 132.00 129.81 1ss8 h PRO 450 Ca 0.14 0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.29 1ss8 h PRO 450 Cb 0.24 0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 1ss8 h PRO 450 CO -0.31 -0.28 0.20 1.25 -0.21 0.00 0.00 178.00 178.65 1ss8 h LEU 451 N -0.44 0.33 -0.62 2.35 5.85 -1.71 -0.27 115.31 120.80 1ss8 h LEU 451 Ca 0.07 0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.89 1ss8 h LEU 451 Cb 0.54 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.43 1ss8 h LEU 451 CO -0.28 0.24 0.21 0.03 -0.34 0.00 0.00 178.44 178.30 1ss8 h ARG 452 N 0.42 0.36 0.04 1.25 3.08 -0.82 -0.42 114.38 118.29 1ss8 h ARG 452 Ca 0.14 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1ss8 h ARG 452 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1ss8 h ARG 452 CO -0.07 0.24 -0.02 0.37 -1.07 0.00 0.00 179.97 179.42 1ss8 h GLN 453 N 0.37 -0.06 -0.84 0.04 5.75 0.30 0.16 115.11 120.84 1ss8 h GLN 453 Ca 0.32 0.00 0.14 0.00 -0.15 0.00 0.00 58.65 58.96 1ss8 h GLN 453 Cb 0.42 0.01 -0.09 0.00 1.07 0.00 0.00 27.48 28.89 1ss8 h GLN 453 CO -0.33 0.05 0.44 0.82 -2.65 0.00 0.00 178.83 177.15 1ss8 h ILE 454 N -0.15 0.75 -0.23 2.39 2.04 -0.39 -0.24 117.51 121.68 1ss8 h ILE 454 Ca -0.01 -0.22 -0.16 0.00 1.00 0.00 0.00 64.86 65.48 1ss8 h ILE 454 Cb 0.14 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 1ss8 h ILE 454 CO 0.01 0.12 -0.50 0.58 0.00 0.00 0.00 178.15 178.36 1ss8 h VAL 455 N 0.64 1.31 -0.75 1.67 2.07 -0.29 -2.41 116.25 118.50 1ss8 h VAL 455 Ca 0.45 -1.71 -0.05 0.00 0.82 0.00 0.00 66.70 66.20 1ss8 h VAL 455 Cb 0.61 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1ss8 h VAL 455 CO -0.35 0.54 0.26 0.25 0.02 0.00 0.00 177.57 178.29 1ss8 h LEU 456 N 0.49 1.07 -2.16 2.57 5.85 0.36 -0.88 115.31 122.60 1ss8 h LEU 456 Ca 0.02 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1ss8 h LEU 456 Cb 1.04 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.79 1ss8 h LEU 456 CO 0.10 0.98 -0.05 0.78 -0.34 0.00 0.00 178.44 179.91 1ss8 h ASN 457 N 1.10 0.00 0.78 1.25 2.35 -0.69 -0.08 115.58 120.28 1ss8 h ASN 457 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 1ss8 h ASN 457 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1ss8 h ASN 457 CO -0.01 0.05 0.00 0.00 -1.65 0.00 0.00 177.43 175.81 1ss8 n GLY 459 N 0.81 0.56 4.00 0.00 0.00 -0.04 -5.05 105.19 105.46 1ss8 n GLY 459 Ca 0.05 -0.83 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.89 2.88 -0.57 1.61 0.41 -0.91 -5.04 118.70 114.18 1ss8 s GLU 460 Ca 0.00 -1.20 -0.28 0.00 -0.41 0.00 0.00 54.97 53.07 1ss8 s GLU 460 Cb 0.00 -2.76 0.03 0.00 -1.78 0.00 0.00 34.13 29.62 1ss8 s GLU 460 CO 0.00 -0.20 1.19 -1.21 -0.49 0.00 0.00 175.26 174.55 1ss8 s GLU 461 N -4.31 3.53 0.27 1.61 2.02 -1.26 -4.32 118.70 116.24 1ss8 s GLU 461 Ca 0.53 0.28 -0.04 0.00 0.02 0.00 0.00 54.97 55.76 1ss8 s GLU 461 Cb -0.10 -4.01 0.34 0.00 0.10 0.00 0.00 34.13 30.47 1ss8 s GLU 461 CO 0.32 -1.66 1.94 -1.00 0.02 0.00 0.00 175.26 174.88 1ss8 h PRO 462 N 9.54 1.22 0.00 0.39 0.13 -1.86 -2.38 132.00 139.04 1ss8 h PRO 462 Ca -0.25 -0.07 -0.07 0.00 -0.87 0.00 0.00 66.00 64.74 1ss8 h PRO 462 Cb 1.06 -0.28 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 1ss8 h PRO 462 CO 1.18 0.81 -0.32 0.66 -0.23 0.00 0.00 178.00 180.10 1ss8 h SER 463 N 1.26 0.00 -0.09 1.44 4.64 -1.94 -0.43 113.55 118.43 1ss8 h SER 463 Ca 0.35 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.63 1ss8 h SER 463 Cb -0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1ss8 h SER 463 CO -0.09 0.32 -0.11 0.58 -0.87 0.00 0.00 176.83 176.67 1ss8 h VAL 464 N 0.00 1.37 -0.59 0.95 2.07 -1.86 -1.61 116.25 116.59 1ss8 h VAL 464 Ca -0.00 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.23 1ss8 h VAL 464 Cb 0.88 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.65 1ss8 h VAL 464 CO 0.04 0.37 0.37 0.58 0.02 0.00 0.00 177.57 178.95 1ss8 h VAL 465 N -0.20 1.10 -0.63 2.57 2.07 -1.32 -0.66 116.25 119.18 1ss8 h VAL 465 Ca 0.01 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 1ss8 h VAL 465 Cb 0.64 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1ss8 h VAL 465 CO 0.03 0.14 0.31 0.00 0.02 0.00 0.00 177.57 178.06 1ss8 h ALA 466 N 1.24 0.81 -0.48 1.67 0.00 -1.08 0.10 119.26 121.52 1ss8 h ALA 466 Ca 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1ss8 h ALA 466 Cb -0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1ss8 h ALA 466 CO -0.08 0.36 0.18 -0.97 0.00 0.00 0.00 179.25 178.75 1ss8 h ASN 467 N 0.86 0.67 -0.16 0.00 -1.24 -0.90 0.35 115.58 115.16 1ss8 h ASN 467 Ca 0.22 -0.18 -0.03 0.00 0.71 0.00 0.00 56.30 57.02 1ss8 h ASN 467 Cb 0.10 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 1ss8 h ASN 467 CO -0.03 0.66 -0.02 0.74 -1.29 0.00 0.00 177.43 177.49 1ss8 h THR 468 N 0.64 1.28 0.10 -3.57 2.02 -0.72 -2.03 112.91 110.62 1ss8 h THR 468 Ca 0.16 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.39 1ss8 h THR 468 Cb 0.21 1.57 -0.00 0.00 -1.74 0.00 0.00 68.15 68.19 1ss8 h THR 468 CO -0.01 0.28 -0.07 0.58 0.37 0.00 0.00 175.52 176.67 1ss8 h VAL 469 N 0.02 0.85 -0.79 3.16 2.07 -0.72 -1.62 116.25 119.23 1ss8 h VAL 469 Ca 0.04 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.72 1ss8 h VAL 469 Cb 0.44 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1ss8 h VAL 469 CO 0.01 0.00 0.52 0.11 0.02 0.00 0.00 177.57 178.24 1ss8 h LYS 470 N -0.17 0.43 0.00 1.57 1.57 -0.26 -1.46 116.57 118.25 1ss8 h LYS 470 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ss8 h LYS 470 Cb 0.15 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ss8 h LYS 470 CO -0.00 0.28 0.00 0.78 -0.57 0.00 0.00 179.45 179.94 1ss8 h GLY 471 N 0.44 0.00 -0.74 3.86 0.00 -0.53 -3.45 103.07 102.65 1ss8 h GLY 471 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.43 1ss8 h GLY 471 CO -0.13 0.00 0.16 0.61 0.00 0.00 0.00 176.54 177.18 1ss8 n GLY 472 N 0.73 -0.21 3.25 4.60 0.00 -0.55 -5.10 105.19 107.91 1ss8 n GLY 472 Ca 0.04 -1.87 -0.19 0.00 0.00 0.00 0.00 46.02 43.99 1ss8 n GLY 472 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss8 s ASP 473 N -3.90 2.13 0.68 1.61 2.15 -1.26 -5.01 116.67 113.07 1ss8 s ASP 473 Ca 0.46 -0.78 0.00 0.00 0.43 0.00 0.00 52.55 52.67 1ss8 s ASP 473 Cb -0.02 -0.09 0.00 0.00 -0.30 0.00 0.00 42.92 42.51 1ss8 s ASP 473 CO 0.31 -0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.83 1ss8 n GLY 474 N 0.67 1.76 0.15 2.66 0.00 -1.26 -2.88 105.19 106.29 1ss8 n GLY 474 Ca -0.16 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 1.01 0.28 -4.69 1.61 3.02 -1.26 -4.89 115.26 110.34 1ss8 n ASN 475 Ca 0.00 -1.90 -0.44 0.00 -0.03 0.00 0.00 54.58 52.21 1ss8 n ASN 475 Cb 0.00 -0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 38.99 1ss8 n ASN 475 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ss8 n TYR 476 N -0.34 2.51 -2.95 3.10 9.36 -1.14 -1.00 117.16 126.70 1ss8 n TYR 476 Ca 0.00 0.13 0.00 0.00 3.32 0.00 0.00 57.90 61.35 1ss8 n TYR 476 Cb 0.07 -2.62 0.00 0.00 -0.63 0.00 0.00 39.34 36.16 1ss8 n TYR 476 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ss8 n GLY 477 N 3.73 1.74 3.50 2.98 0.00 -0.10 -4.83 105.19 112.23 1ss8 n GLY 477 Ca 0.17 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 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 -5.04 3.06 -0.53 1.61 5.04 -1.26 -1.94 117.35 118.30 1ss8 s TYR 478 Ca 0.00 -0.28 -0.24 0.00 -2.44 0.00 0.00 57.07 54.11 1ss8 s TYR 478 Cb 0.00 -2.01 0.04 0.00 0.35 0.00 0.00 41.96 40.34 1ss8 s TYR 478 CO 0.00 -0.06 0.91 1.21 -1.34 0.00 0.00 175.55 176.26 1ss8 s ASN 479 N 0.55 6.35 0.38 4.32 3.84 0.50 -4.91 114.94 125.97 1ss8 s ASN 479 Ca -0.01 -0.32 0.20 0.00 0.21 0.00 0.00 52.86 52.93 1ss8 s ASN 479 Cb -0.14 -2.42 0.65 0.00 -0.55 0.00 0.00 41.25 38.78 1ss8 s ASN 479 CO 0.02 -1.16 1.71 0.00 -2.79 0.00 0.00 177.10 174.88 1ss8 h ALA 480 N 9.24 0.95 -0.02 1.71 0.00 -1.94 0.48 119.26 129.68 1ss8 h ALA 480 Ca -0.26 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.35 1ss8 h ALA 480 Cb 1.08 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1ss8 h ALA 480 CO 1.06 0.44 -0.11 0.00 0.00 0.00 0.00 179.25 180.64 1ss8 h ALA 481 N 1.65 -0.11 -0.02 0.00 0.00 -1.95 -3.27 119.26 115.56 1ss8 h ALA 481 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 481 Cb 0.93 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ss8 h ALA 481 CO 0.05 -0.60 -0.30 0.25 0.00 0.00 0.00 179.25 178.65 1ss8 n THR 482 N -5.24 0.00 -3.90 0.00 -2.24 -1.00 -4.97 114.28 96.93 1ss8 n THR 482 Ca -0.05 -0.35 -0.26 0.00 -2.27 0.00 0.00 64.05 61.12 1ss8 n THR 482 Cb 0.17 1.30 -0.00 0.00 -2.10 0.00 0.00 70.33 69.70 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 0.35 -3.99 -4.09 -0.78 1.02 0.16 -5.01 120.64 108.30 1ss8 n GLU 483 Ca 0.10 0.48 -0.10 0.00 -0.02 0.00 0.00 57.16 57.62 1ss8 n GLU 483 Cb 0.46 -4.87 -0.10 0.00 -0.02 0.00 0.00 31.44 26.91 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 -6.43 0.61 0.42 3.49 0.41 -1.17 -4.99 118.70 111.05 1ss8 s GLU 484 Ca 0.14 -1.05 -0.02 0.00 -0.41 0.00 0.00 54.97 53.63 1ss8 s GLU 484 Cb -0.07 -0.05 -0.03 0.00 -1.78 0.00 0.00 34.13 32.20 1ss8 s GLU 484 CO 0.86 -0.04 0.67 0.71 -0.49 0.00 0.00 175.26 176.98 1ss8 s TYR 485 N -2.84 3.49 -2.81 1.61 1.51 -1.26 -0.37 117.35 116.67 1ss8 s TYR 485 Ca 0.01 0.54 0.00 0.00 -1.01 0.00 0.00 57.07 56.61 1ss8 s TYR 485 Cb 0.00 -2.14 0.00 0.00 -0.11 0.00 0.00 41.96 39.71 1ss8 s TYR 485 CO -0.04 -0.13 0.00 0.41 -1.11 0.00 0.00 175.55 174.68 1ss8 n GLY 486 N -2.04 -1.40 3.61 0.71 0.00 -0.82 -4.86 105.19 100.39 1ss8 n GLY 486 Ca -0.02 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.52 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 -3.61 6.73 0.40 1.61 3.84 -1.26 -0.92 114.94 121.73 1ss8 s ASN 487 Ca 0.00 0.67 0.13 0.00 0.21 0.00 0.00 52.86 53.86 1ss8 s ASN 487 Cb 0.00 -2.51 0.84 0.00 -0.55 0.00 0.00 41.25 39.03 1ss8 s ASN 487 CO 0.00 -0.97 1.90 0.24 -2.79 0.00 0.00 177.10 175.48 1ss8 h MET 488 N 8.58 0.04 0.09 0.43 2.86 -1.40 0.04 114.93 125.57 1ss8 h MET 488 Ca -0.22 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1ss8 h MET 488 Cb 1.07 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 1ss8 h MET 488 CO 1.04 0.30 -0.04 0.82 1.06 0.00 0.00 176.91 180.08 1ss8 h ILE 489 N 0.04 1.13 -0.80 -1.22 1.08 -1.81 -0.28 117.51 115.65 1ss8 h ILE 489 Ca 0.00 -1.34 0.18 0.00 -0.39 0.00 0.00 64.86 63.31 1ss8 h ILE 489 Cb 0.48 1.92 -0.12 0.00 -3.07 0.00 0.00 36.82 36.04 1ss8 h ILE 489 CO 0.03 0.30 0.25 0.44 -0.69 0.00 0.00 178.15 178.48 1ss8 h ASP 490 N -0.80 0.11 0.00 1.72 3.32 -1.89 -1.47 116.42 117.42 1ss8 h ASP 490 Ca -0.01 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1ss8 h ASP 490 Cb 0.59 0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1ss8 h ASP 490 CO 0.02 -0.03 0.00 0.23 -1.72 0.00 0.00 179.24 177.74 1ss8 n MET 491 N -5.12 0.91 -1.38 3.56 2.81 -0.02 -4.86 117.12 113.01 1ss8 n MET 491 Ca 0.17 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 56.02 1ss8 n MET 491 Cb 0.53 -1.45 -0.01 0.00 -0.71 0.00 0.00 33.22 31.57 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 0.78 0.54 3.21 3.03 0.00 -0.55 -5.01 105.19 107.19 1ss8 n GLY 492 Ca 0.20 -0.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.15 4.28 0.11 -0.61 1.01 -0.15 -5.00 121.20 118.69 1ss8 s ILE 493 Ca 0.00 -2.02 -0.04 0.00 0.00 0.00 0.00 60.65 58.59 1ss8 s ILE 493 Cb 0.00 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 1ss8 s ILE 493 CO 0.00 -0.82 0.09 -1.48 0.00 0.00 0.00 174.94 172.74 1ss8 s LEU 494 N 1.04 1.76 0.10 2.97 0.05 -1.26 0.12 118.68 123.45 1ss8 s LEU 494 Ca 0.09 -1.02 0.08 0.00 0.05 0.00 0.00 54.13 53.33 1ss8 s LEU 494 Cb -0.24 0.54 -0.03 0.00 -2.05 0.00 0.00 46.19 44.41 1ss8 s LEU 494 CO -0.02 -0.73 -0.22 -1.81 -0.55 0.00 0.00 176.35 173.03 1ss8 s ASP 495 N -2.98 2.63 0.31 1.48 1.01 -0.51 -4.65 116.67 113.97 1ss8 s ASP 495 Ca 0.16 -0.68 -0.29 0.00 0.71 0.00 0.00 52.55 52.45 1ss8 s ASP 495 Cb 0.06 -0.16 -0.11 0.00 1.01 0.00 0.00 42.92 43.73 1ss8 s ASP 495 CO -0.03 0.08 1.45 -2.84 0.21 0.00 0.00 175.17 174.05 1ss8 s PRO 496 N -1.85 4.21 0.45 8.23 0.02 -1.26 -1.36 135.00 143.43 1ss8 s PRO 496 Ca 0.07 2.42 0.23 0.00 0.02 0.00 0.00 61.00 63.74 1ss8 s PRO 496 Cb -0.10 -3.04 1.22 0.00 0.02 0.00 0.00 34.50 32.60 1ss8 s PRO 496 CO 0.04 -0.44 1.82 1.15 -0.33 0.00 0.00 177.00 179.24 1ss8 h THR 497 N 3.24 0.57 -0.12 0.99 2.02 -0.83 -0.59 112.91 118.20 1ss8 h THR 497 Ca -0.48 -0.10 -0.05 0.00 0.77 0.00 0.00 66.41 66.55 1ss8 h THR 497 Cb 1.23 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1ss8 h THR 497 CO 0.71 0.05 -0.16 0.50 0.37 0.00 0.00 175.52 177.00 1ss8 h LYS 498 N 0.28 0.18 0.07 6.66 3.64 -1.84 0.60 116.57 126.16 1ss8 h LYS 498 Ca 0.52 -0.04 -0.28 0.00 -1.27 0.00 0.00 60.65 59.57 1ss8 h LYS 498 Cb 1.53 -0.02 0.02 0.00 -0.41 0.00 0.00 32.23 33.34 1ss8 h LYS 498 CO -0.17 0.35 -1.15 -0.39 -2.27 0.00 0.00 179.45 175.81 1ss8 h VAL 499 N 0.17 1.30 -0.47 2.00 -1.51 -1.41 -1.75 116.25 114.58 1ss8 h VAL 499 Ca 0.03 -2.41 -0.11 0.00 -1.23 0.00 0.00 66.70 62.98 1ss8 h VAL 499 Cb 0.39 2.57 -0.01 0.00 -2.13 0.00 0.00 31.29 32.11 1ss8 h VAL 499 CO 0.02 0.74 -0.13 0.74 -1.23 0.00 0.00 177.57 177.71 1ss8 h THR 500 N 0.31 1.27 -0.09 7.19 2.02 -1.41 0.01 112.91 122.21 1ss8 h THR 500 Ca -0.16 -1.26 -0.00 0.00 0.77 0.00 0.00 66.41 65.76 1ss8 h THR 500 Cb 1.82 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 69.34 1ss8 h THR 500 CO 0.22 0.43 0.04 -0.09 0.37 0.00 0.00 175.52 176.49 1ss8 h ARG 501 N 0.75 0.13 -0.34 6.66 2.43 -0.93 -2.51 114.38 120.57 1ss8 h ARG 501 Ca 0.12 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1ss8 h ARG 501 Cb 0.68 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1ss8 h ARG 501 CO 0.05 0.23 0.21 0.77 -1.51 0.00 0.00 179.97 179.72 1ss8 h SER 502 N 0.01 0.41 -0.93 -3.80 0.02 -1.11 -0.58 113.55 107.56 1ss8 h SER 502 Ca 0.03 -0.04 0.09 0.00 -0.84 0.00 0.00 61.79 61.03 1ss8 h SER 502 Cb 0.15 -0.10 -0.07 0.00 0.14 0.00 0.00 62.40 62.51 1ss8 h SER 502 CO -0.00 0.33 0.58 0.00 -1.14 0.00 0.00 176.83 176.60 1ss8 h ALA 503 N 1.09 1.34 -0.26 3.77 0.00 -0.92 -0.55 119.26 123.73 1ss8 h ALA 503 Ca 0.12 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1ss8 h ALA 503 Cb -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ss8 h ALA 503 CO -0.02 0.26 -0.59 1.25 0.00 0.00 0.00 179.25 180.14 1ss8 h LEU 504 N 0.98 0.97 0.12 0.00 6.46 -0.94 -1.41 115.31 121.50 1ss8 h LEU 504 Ca 0.44 -0.55 -0.01 0.00 -0.12 0.00 0.00 57.88 57.64 1ss8 h LEU 504 Cb 0.32 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 1ss8 h LEU 504 CO -0.22 1.35 -0.06 1.56 -0.62 0.00 0.00 178.44 180.45 1ss8 h GLN 505 N 0.64 -0.15 -0.69 1.25 4.20 -0.51 -1.68 115.11 118.17 1ss8 h GLN 505 Ca 0.00 0.01 0.13 0.00 0.06 0.00 0.00 58.65 58.85 1ss8 h GLN 505 Cb 1.21 0.03 -0.09 0.00 0.30 0.00 0.00 27.48 28.93 1ss8 h GLN 505 CO 0.13 0.31 0.23 1.88 -0.67 0.00 0.00 178.83 180.71 1ss8 h TYR 506 N -0.70 0.39 -0.95 2.96 0.05 -1.22 0.86 116.97 118.36 1ss8 h TYR 506 Ca -0.02 0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.81 1ss8 h TYR 506 Cb 0.53 -0.07 -0.05 0.00 1.01 0.00 0.00 36.73 38.15 1ss8 h TYR 506 CO 0.09 0.03 0.63 0.00 -1.05 0.00 0.00 178.16 177.86 1ss8 h ALA 507 N 1.51 1.21 0.00 3.88 0.00 -1.17 -0.72 119.26 123.96 1ss8 h ALA 507 Ca 0.37 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1ss8 h ALA 507 Cb 0.54 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1ss8 h ALA 507 CO -0.39 0.61 -0.53 0.00 0.00 0.00 0.00 179.25 178.94 1ss8 h ALA 508 N 1.35 0.93 0.69 0.00 0.00 -0.71 -0.78 119.26 120.74 1ss8 h ALA 508 Ca 0.35 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1ss8 h ALA 508 Cb -0.14 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.57 1ss8 h ALA 508 CO -0.07 0.66 -0.33 1.03 0.00 0.00 0.00 179.25 180.53 1ss8 h SER 509 N 0.00 -0.79 -0.81 0.00 0.87 0.68 -1.60 113.55 111.90 1ss8 h SER 509 Ca -0.01 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1ss8 h SER 509 Cb 1.07 0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 63.19 1ss8 h SER 509 CO 0.07 -0.53 0.41 -0.37 -0.53 0.00 0.00 176.83 175.88 1ss8 h VAL 510 N -0.99 1.25 -0.67 2.23 -1.51 -1.44 -1.83 116.25 113.28 1ss8 h VAL 510 Ca -0.09 -0.68 0.11 0.00 -1.23 0.00 0.00 66.70 64.81 1ss8 h VAL 510 Cb 0.71 0.20 -0.08 0.00 -2.13 0.00 0.00 31.29 29.99 1ss8 h VAL 510 CO 0.16 0.29 0.27 0.00 -1.23 0.00 0.00 177.57 177.06 1ss8 h ALA 511 N 1.22 0.90 -0.23 5.19 0.00 -1.15 -0.46 119.26 124.72 1ss8 h ALA 511 Ca 0.28 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1ss8 h ALA 511 Cb 0.09 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1ss8 h ALA 511 CO -0.04 -0.17 0.08 0.78 0.00 0.00 0.00 179.25 179.90 1ss8 h GLY 512 N 0.45 0.39 0.88 0.00 0.00 -0.54 0.22 103.07 104.46 1ss8 h GLY 512 Ca 0.35 -0.22 0.06 0.00 0.00 0.00 0.00 47.33 47.51 1ss8 h GLY 512 CO -0.33 0.21 0.60 1.41 0.00 0.00 0.00 176.54 178.43 1ss8 h LEU 513 N 0.21 0.95 -0.04 3.11 3.38 -0.96 -1.22 115.31 120.73 1ss8 h LEU 513 Ca 0.08 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 1ss8 h LEU 513 Cb 0.22 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.78 1ss8 h LEU 513 CO -0.00 0.62 -0.59 -0.03 0.09 0.00 0.00 178.44 178.53 1ss8 h MET 514 N 1.08 0.48 -0.18 1.13 4.05 -0.70 -2.54 114.93 118.25 1ss8 h MET 514 Ca 0.39 -0.45 0.05 0.00 -0.28 0.00 0.00 59.70 59.40 1ss8 h MET 514 Cb 0.14 0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 1ss8 h MET 514 CO -0.14 1.10 0.15 0.82 0.23 0.00 0.00 176.91 179.07 1ss8 h ILE 515 N 0.02 0.70 -0.70 1.77 2.04 -0.80 -2.47 117.51 118.08 1ss8 h ILE 515 Ca -0.06 0.00 -0.32 0.00 1.00 0.00 0.00 64.86 65.48 1ss8 h ILE 515 Cb 1.27 0.89 -0.19 0.00 -0.74 0.00 0.00 36.82 38.04 1ss8 h ILE 515 CO 0.12 0.00 0.31 0.35 0.00 0.00 0.00 178.15 178.93 1ss8 n THR 516 N -4.17 2.90 -3.59 -0.27 -2.24 -0.48 -4.85 114.28 101.58 1ss8 n THR 516 Ca 0.01 -2.12 -0.36 0.00 -2.27 0.00 0.00 64.05 59.31 1ss8 n THR 516 Cb 0.28 -0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 68.05 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 -3.19 5.33 -0.38 4.28 2.01 -0.93 -4.99 115.64 117.76 1ss8 s THR 517 Ca 0.52 0.39 0.20 0.00 0.31 0.00 0.00 61.69 63.11 1ss8 s THR 517 Cb 0.44 -3.57 -0.28 0.00 0.01 0.00 0.00 72.50 69.10 1ss8 s THR 517 CO 0.08 0.36 0.61 -0.62 -0.69 0.00 0.00 174.62 174.36 1ss8 n GLU 518 N 3.92 0.53 -3.75 4.92 -0.58 -1.26 -4.74 120.64 119.68 1ss8 n GLU 518 Ca -0.13 -0.12 -0.13 0.00 -0.42 0.00 0.00 57.16 56.37 1ss8 n GLU 518 Cb 0.52 -1.47 -0.13 0.00 -0.57 0.00 0.00 31.44 29.78 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 0.96 2.66 -0.10 0.00 -1.94 0.02 -4.97 119.30 115.93 1ss8 s MET 520 Ca -0.07 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.11 1ss8 s MET 520 Cb -0.08 -2.12 0.00 0.00 2.01 0.00 0.00 34.83 34.64 1ss8 s MET 520 CO -0.06 0.25 -0.22 0.08 -0.01 0.00 0.00 175.02 175.06 1ss8 s VAL 521 N 0.14 1.93 0.21 -6.03 1.01 -1.26 -2.01 120.40 114.39 1ss8 s VAL 521 Ca -0.11 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 60.79 1ss8 s VAL 521 Cb -0.16 -1.68 0.01 0.00 0.00 0.00 0.00 36.38 34.55 1ss8 s VAL 521 CO 0.06 0.53 0.45 0.28 0.00 0.00 0.00 175.10 176.42 1ss8 s THR 522 N 0.44 0.03 0.55 3.92 -1.32 -1.04 -5.02 115.64 113.19 1ss8 s THR 522 Ca -0.17 -1.19 -0.19 0.00 -1.21 0.00 0.00 61.69 58.94 1ss8 s THR 522 Cb -0.17 -1.89 -0.06 0.00 -1.51 0.00 0.00 72.50 68.87 1ss8 s THR 522 CO 0.07 -0.12 1.10 -1.81 -2.21 0.00 0.00 174.62 171.65 1ss8 s ASP 523 N -2.95 5.81 0.18 8.08 1.01 -1.26 -0.56 116.67 126.97 1ss8 s ASP 523 Ca 0.16 2.06 -0.31 0.00 0.71 0.00 0.00 52.55 55.17 1ss8 s ASP 523 Cb 0.00 -2.57 -0.09 0.00 1.01 0.00 0.00 42.92 41.27 1ss8 s ASP 523 CO 0.03 -1.16 1.40 -0.76 0.21 0.00 0.00 175.17 174.89 1ss8 s LEU 524 N -3.92 4.39 0.00 1.23 1.43 -1.12 -4.52 118.68 116.16 1ss8 s LEU 524 Ca 0.70 2.47 0.00 0.00 -1.03 0.00 0.00 54.13 56.27 1ss8 s LEU 524 Cb -0.21 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1ss8 s LEU 524 CO 0.28 -0.65 0.20 -0.81 0.23 0.00 0.00 176.35 175.60