#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r8b n THR 45 N 0.00 0.52 0.20 3.45 5.66 -1.26 -4.53 114.28 118.33 2r8b n THR 45 Ca 0.00 -0.61 0.11 0.00 -3.05 0.00 0.00 64.05 60.51 2r8b n THR 45 Cb 0.00 -0.18 0.14 0.00 -1.55 0.00 0.00 70.33 68.75 2r8b n THR 45 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 2r8b h LYS 46 N 0.00 0.00 -0.71 1.09 5.09 -1.89 -2.80 116.57 117.34 2r8b h LYS 46 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.53 2r8b h LYS 46 Cb 1.44 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.77 2r8b h LYS 46 CO 0.01 0.02 0.00 -0.25 -2.09 0.00 0.00 179.45 177.15 2r8b n ASP 47 N -3.06 3.89 -0.30 7.07 8.00 -1.26 -4.53 116.55 126.36 2r8b n ASP 47 Ca 0.03 -2.54 0.01 0.00 0.71 0.00 0.00 54.79 53.00 2r8b n ASP 47 Cb 0.54 -0.59 0.05 0.00 -0.02 0.00 0.00 41.12 41.10 2r8b n ASP 47 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2r8b n SER 48 N 0.44 -0.45 -4.74 -2.24 2.88 -1.06 -4.19 113.62 104.26 2r8b n SER 48 Ca 0.17 1.36 -0.30 0.00 -1.33 0.00 0.00 58.87 58.78 2r8b n SER 48 Cb 0.81 -0.34 -0.07 0.00 -0.75 0.00 0.00 64.21 63.87 2r8b n SER 48 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2r8b s TYR 49 N -5.80 3.08 0.19 0.66 2.02 -1.26 -5.09 117.35 111.15 2r8b s TYR 49 Ca -0.11 0.01 -0.31 0.00 -0.37 0.00 0.00 57.07 56.29 2r8b s TYR 49 Cb 0.17 -1.56 -0.10 0.00 -0.40 0.00 0.00 41.96 40.07 2r8b s TYR 49 CO 0.57 0.50 1.58 0.12 -1.57 0.00 0.00 175.55 176.75 2r8b s PHE 50 N -1.42 3.01 0.06 2.71 5.36 -1.26 -5.00 117.98 121.43 2r8b s PHE 50 Ca 0.28 0.65 -0.18 0.00 -0.96 0.00 0.00 56.93 56.72 2r8b s PHE 50 Cb -0.12 -3.96 0.04 0.00 -0.34 0.00 0.00 43.02 38.65 2r8b s PHE 50 CO 0.20 -3.47 0.43 -3.38 -1.46 0.00 0.00 175.22 167.55 2r8b s HIS 51 N 0.91 -0.28 0.54 10.12 -3.43 -1.26 -2.45 115.29 119.43 2r8b s HIS 51 Ca 0.69 0.21 -0.07 0.00 -0.80 0.00 0.00 55.06 55.08 2r8b s HIS 51 Cb -0.45 0.24 -0.03 0.00 -1.43 0.00 0.00 32.58 30.91 2r8b s HIS 51 CO 0.34 -0.60 0.89 0.15 -2.00 0.00 0.00 174.74 173.52 2r8b s LYS 52 N -2.67 3.49 -0.27 -0.38 1.02 0.12 -4.92 119.74 116.14 2r8b s LYS 52 Ca -0.04 0.37 -0.09 0.00 0.02 0.00 0.00 55.97 56.24 2r8b s LYS 52 Cb -0.00 -2.26 0.12 0.00 -0.52 0.00 0.00 37.83 35.17 2r8b s LYS 52 CO -0.04 -0.39 0.58 0.45 -0.92 0.00 0.00 175.35 175.03 2r8b s SER 53 N -4.15 -0.89 -0.18 2.83 0.15 -1.26 -0.53 113.70 109.67 2r8b s SER 53 Ca 0.51 1.36 0.01 0.00 0.70 0.00 0.00 55.95 58.52 2r8b s SER 53 Cb -0.11 2.02 0.03 0.00 -1.71 0.00 0.00 66.02 66.26 2r8b s SER 53 CO 0.48 -0.23 -0.13 -0.60 1.20 0.00 0.00 173.24 173.97 2r8b s ARG 54 N 2.81 2.23 -0.08 5.44 3.52 -0.28 -4.98 118.95 127.61 2r8b s ARG 54 Ca -0.03 -0.73 -0.30 0.00 -0.13 0.00 0.00 55.73 54.55 2r8b s ARG 54 Cb -0.12 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.92 2r8b s ARG 54 CO -0.17 -0.33 1.54 0.00 -0.81 0.00 0.00 175.30 175.53 2r8b s ALA 55 N 1.42 3.63 0.60 6.12 0.00 -1.26 -0.37 121.76 131.89 2r8b s ALA 55 Ca 0.02 0.81 0.07 0.00 0.00 0.00 0.00 51.96 52.86 2r8b s ALA 55 Cb -0.15 -3.71 0.09 0.00 0.00 0.00 0.00 23.12 19.36 2r8b s ALA 55 CO -0.10 -1.32 0.82 0.20 0.00 0.00 0.00 175.76 175.36 2r8b s GLY 56 N 2.92 1.75 0.27 0.00 0.00 -1.26 -4.81 107.32 106.20 2r8b s GLY 56 Ca 0.68 -2.03 -0.30 0.00 0.00 0.00 0.00 44.72 43.07 2r8b s GLY 56 CO 0.25 -1.56 1.49 -0.62 0.00 0.00 0.00 173.10 172.66 2r8b n VAL 57 N -2.34 1.05 -1.68 1.40 0.31 -0.83 -4.72 118.33 111.53 2r8b n VAL 57 Ca 0.15 -0.26 -0.47 0.00 -0.01 0.00 0.00 64.34 63.75 2r8b n VAL 57 Cb 0.61 -1.71 -0.04 0.00 -0.91 0.00 0.00 33.84 31.79 2r8b n VAL 57 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2r8b n ALA 58 N 1.91 1.21 0.00 3.52 0.00 -1.26 -1.78 120.51 124.11 2r8b n ALA 58 Ca 0.10 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2r8b n ALA 58 Cb 0.34 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.34 2r8b n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r8b n GLY 59 N 3.99 2.38 3.77 0.00 0.00 -0.62 -5.01 105.19 109.70 2r8b n GLY 59 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2r8b n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r8b s ALA 60 N -2.49 2.23 0.87 4.61 0.00 -0.73 -3.72 121.76 122.52 2r8b s ALA 60 Ca 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 51.96 52.07 2r8b s ALA 60 Cb 0.00 -3.26 0.08 0.00 0.00 0.00 0.00 23.12 19.94 2r8b s ALA 60 CO 0.00 -1.78 0.92 -2.30 0.00 0.00 0.00 175.76 172.59 2r8b n PRO 61 N -3.53 -0.12 -3.68 0.00 -0.02 -1.26 -1.08 135.00 125.32 2r8b n PRO 61 Ca 0.09 0.03 -0.37 0.00 -2.02 0.00 0.00 63.50 61.23 2r8b n PRO 61 Cb 0.53 -2.21 -0.12 0.00 -0.02 0.00 0.00 33.50 31.69 2r8b n PRO 61 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2r8b s LEU 62 N -4.23 3.78 -0.34 2.45 2.96 0.13 -1.70 118.68 121.72 2r8b s LEU 62 Ca 0.67 -0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 54.49 2r8b s LEU 62 Cb -0.26 -2.03 0.08 0.00 0.50 0.00 0.00 46.19 44.48 2r8b s LEU 62 CO 0.58 -0.03 0.07 0.12 -1.32 0.00 0.00 176.35 175.77 2r8b s PHE 63 N 1.61 3.49 -0.20 5.38 5.36 0.30 -0.07 117.98 133.84 2r8b s PHE 63 Ca 0.07 -2.35 -0.09 0.00 -0.96 0.00 0.00 56.93 53.59 2r8b s PHE 63 Cb -0.15 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.84 2r8b s PHE 63 CO 0.07 -0.90 0.10 0.54 -1.46 0.00 0.00 175.22 173.57 2r8b s VAL 64 N 1.12 5.05 -0.02 3.12 0.11 0.05 -0.92 120.40 128.91 2r8b s VAL 64 Ca 0.02 0.06 0.06 0.00 -2.93 0.00 0.00 61.98 59.20 2r8b s VAL 64 Cb -0.21 -3.30 -0.02 0.00 -1.53 0.00 0.00 36.38 31.33 2r8b s VAL 64 CO -0.04 0.43 -0.22 -0.76 -3.33 0.00 0.00 175.10 171.18 2r8b s LEU 65 N 0.52 2.03 -0.20 2.54 1.02 -0.93 -1.27 118.68 122.40 2r8b s LEU 65 Ca 0.05 -0.41 0.00 0.00 0.02 0.00 0.00 54.13 53.80 2r8b s LEU 65 Cb -0.12 -1.14 0.05 0.00 0.02 0.00 0.00 46.19 44.99 2r8b s LEU 65 CO 0.00 0.26 -0.07 -0.76 0.02 0.00 0.00 176.35 175.80 2r8b s LEU 66 N -0.43 2.06 1.11 1.79 1.43 -0.04 -4.10 118.68 120.51 2r8b s LEU 66 Ca 0.06 -0.87 -0.13 0.00 -1.03 0.00 0.00 54.13 52.16 2r8b s LEU 66 Cb -0.09 -1.08 0.25 0.00 0.03 0.00 0.00 46.19 45.30 2r8b s LEU 66 CO -0.00 -0.19 1.05 -1.38 0.23 0.00 0.00 176.35 176.06 2r8b s HIS 67 N 1.50 1.62 0.81 0.29 -3.43 -1.26 -2.31 115.29 112.51 2r8b s HIS 67 Ca -0.02 1.08 -0.09 0.00 -0.80 0.00 0.00 55.06 55.24 2r8b s HIS 67 Cb -0.17 -3.16 0.13 0.00 -1.43 0.00 0.00 32.58 27.95 2r8b s HIS 67 CO -0.08 -3.55 1.13 0.20 -2.00 0.00 0.00 174.74 170.44 2r8b s GLY 68 N -2.88 1.74 0.29 -1.38 0.00 -1.22 -2.45 107.32 101.41 2r8b s GLY 68 Ca 0.67 -1.24 -0.28 0.00 0.00 0.00 0.00 44.72 43.87 2r8b s GLY 68 CO 0.62 -0.66 1.07 2.41 0.00 0.00 0.00 173.10 176.54 2r8b n THR 69 N -3.21 1.93 0.00 0.90 -1.04 -1.26 -2.08 114.28 109.51 2r8b n THR 69 Ca 0.13 -0.48 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 2r8b n THR 69 Cb 0.60 -1.09 0.00 0.00 -1.82 0.00 0.00 70.33 68.02 2r8b n THR 69 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2r8b n GLY 70 N 1.20 2.78 0.00 3.41 0.00 -0.97 -4.93 105.19 106.69 2r8b n GLY 70 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2r8b n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r8b n GLY 71 N -0.55 -2.03 0.00 -0.02 0.00 -0.88 -4.53 105.19 97.18 2r8b n GLY 71 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2r8b n GLY 71 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2r8b n ASP 72 N -1.95 0.00 0.00 1.61 3.85 -1.26 -4.48 116.55 114.32 2r8b n ASP 72 Ca 0.00 -0.60 0.11 0.00 -0.71 0.00 0.00 54.79 53.59 2r8b n ASP 72 Cb 0.00 0.00 0.54 0.00 -1.35 0.00 0.00 41.12 40.31 2r8b n ASP 72 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 2r8b n GLU 73 N 0.00 0.16 0.08 0.11 -0.00 -1.26 -2.39 120.64 117.33 2r8b n GLU 73 Ca 0.00 0.09 0.10 0.00 -0.00 0.00 0.00 57.16 57.34 2r8b n GLU 73 Cb 0.00 -1.50 -0.03 0.00 -0.00 0.00 0.00 31.44 29.91 2r8b n GLU 73 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2r8b n ASN 74 N -1.40 0.74 0.04 -1.84 5.03 -1.26 -4.13 115.26 112.43 2r8b n ASN 74 Ca 0.08 0.29 -0.14 0.00 0.87 0.00 0.00 54.58 55.68 2r8b n ASN 74 Cb 0.23 0.61 -0.08 0.00 -1.02 0.00 0.00 39.78 39.52 2r8b n ASN 74 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2r8b h GLN 75 N 0.00 -0.57 -0.02 3.52 4.20 -1.87 -3.29 115.11 117.08 2r8b h GLN 75 Ca -0.03 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2r8b h GLN 75 Cb 1.09 0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.00 2r8b h GLN 75 CO 0.01 -0.38 -0.08 1.19 -0.67 0.00 0.00 178.83 178.90 2r8b n PHE 76 N -5.45 0.00 0.19 2.96 3.72 -1.26 -4.59 117.46 113.03 2r8b n PHE 76 Ca -0.06 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.27 2r8b n PHE 76 Cb 0.38 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.88 2r8b n PHE 76 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 2r8b h PHE 77 N 3.68 -0.46 -0.76 1.38 3.57 -1.72 -0.14 116.94 122.50 2r8b h PHE 77 Ca 0.00 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.64 2r8b h PHE 77 Cb 0.82 0.15 -0.10 0.00 2.79 0.00 0.00 35.95 39.61 2r8b h PHE 77 CO 0.00 -0.28 0.26 -0.44 -2.23 0.00 0.00 178.31 175.62 2r8b h ASP 78 N -0.49 0.18 -0.12 0.41 3.45 -1.83 0.13 116.42 118.14 2r8b h ASP 78 Ca -0.05 0.13 0.04 0.00 0.43 0.00 0.00 57.03 57.58 2r8b h ASP 78 Cb 0.38 0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 39.23 2r8b h ASP 78 CO 0.08 0.04 -0.17 0.15 -1.57 0.00 0.00 179.24 177.77 2r8b h PHE 79 N 0.37 -0.45 -0.20 4.55 3.57 -1.76 -2.22 116.94 120.80 2r8b h PHE 79 Ca 0.42 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.93 2r8b h PHE 79 Cb 0.69 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 2r8b h PHE 79 CO -0.20 -0.25 0.04 0.78 -2.23 0.00 0.00 178.31 176.45 2r8b h GLY 80 N -0.22 0.36 0.16 2.40 0.00 -0.51 -3.02 103.07 102.23 2r8b h GLY 80 Ca 0.09 -0.23 0.13 0.00 0.00 0.00 0.00 47.33 47.32 2r8b h GLY 80 CO -0.25 0.21 0.22 0.00 0.00 0.00 0.00 176.54 176.72 2r8b h ALA 81 N 0.85 0.90 -0.02 3.60 0.00 -0.47 0.15 119.26 124.27 2r8b h ALA 81 Ca 0.06 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2r8b h ALA 81 Cb 0.29 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2r8b h ALA 81 CO 0.00 -0.25 0.00 2.89 0.00 0.00 0.00 179.25 181.89 2r8b n ARG 82 N -5.06 1.20 -0.04 0.00 1.85 -0.86 -3.28 116.66 110.47 2r8b n ARG 82 Ca 0.12 -0.30 -0.13 0.00 -1.00 0.00 0.00 57.85 56.53 2r8b n ARG 82 Cb 0.37 -1.44 -0.14 0.00 -1.05 0.00 0.00 32.46 30.20 2r8b n ARG 82 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2r8b n LEU 83 N -0.59 1.43 -3.55 2.89 7.94 0.44 -4.72 117.00 120.84 2r8b n LEU 83 Ca 0.20 0.21 -0.28 0.00 -1.11 0.00 0.00 56.01 55.03 2r8b n LEU 83 Cb 0.17 -0.24 -0.11 0.00 0.53 0.00 0.00 43.42 43.77 2r8b n LEU 83 CO 0.16 0.60 -0.25 -0.76 -1.11 0.00 0.00 177.39 176.03 2r8b s LEU 84 N -6.28 2.23 0.00 -1.96 1.43 -0.72 -4.92 118.68 108.45 2r8b s LEU 84 Ca -0.14 -3.04 0.02 0.00 -1.03 0.00 0.00 54.13 49.94 2r8b s LEU 84 Cb 0.07 -0.76 0.07 0.00 0.03 0.00 0.00 46.19 45.61 2r8b s LEU 84 CO 0.78 -0.19 0.95 -2.65 0.23 0.00 0.00 176.35 175.48 2r8b n PRO 85 N 2.94 0.01 0.00 1.29 -0.02 -1.21 -1.26 135.00 136.75 2r8b n PRO 85 Ca 0.22 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2r8b n PRO 85 Cb 0.42 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 2r8b n PRO 85 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2r8b n GLN 86 N -1.40 4.03 -2.11 -0.52 6.02 -1.26 -5.01 117.38 117.14 2r8b n GLN 86 Ca 0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 2r8b n GLN 86 Cb 0.02 -0.69 0.02 0.00 1.02 0.00 0.00 30.24 30.61 2r8b n GLN 86 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r8b s ALA 87 N -1.36 2.60 0.09 -1.58 0.00 -0.39 -1.96 121.76 119.17 2r8b s ALA 87 Ca 0.00 0.90 -0.31 0.00 0.00 0.00 0.00 51.96 52.55 2r8b s ALA 87 Cb 0.00 -3.40 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 2r8b s ALA 87 CO 0.00 -0.99 1.54 0.99 0.00 0.00 0.00 175.76 177.30 2r8b s THR 88 N -1.72 3.07 -0.20 0.00 2.01 -0.69 -4.03 115.64 114.08 2r8b s THR 88 Ca 0.75 0.65 -0.05 0.00 0.31 0.00 0.00 61.69 63.34 2r8b s THR 88 Cb -0.27 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 2r8b s THR 88 CO 0.31 0.02 0.00 -0.63 -0.69 0.00 0.00 174.62 173.63 2r8b s ILE 89 N 1.90 3.98 -0.15 1.82 -1.09 0.50 -0.54 121.20 127.62 2r8b s ILE 89 Ca 0.70 -0.30 0.02 0.00 -2.23 0.00 0.00 60.65 58.83 2r8b s ILE 89 Cb -0.39 -2.80 0.01 0.00 -1.58 0.00 0.00 42.46 37.70 2r8b s ILE 89 CO 0.31 0.42 -0.21 -0.22 -1.23 0.00 0.00 174.94 174.01 2r8b s LEU 90 N 1.03 2.09 -0.31 2.97 2.96 -0.10 -1.12 118.68 126.19 2r8b s LEU 90 Ca 0.02 -0.61 -0.03 0.00 -0.22 0.00 0.00 54.13 53.29 2r8b s LEU 90 Cb -0.14 -1.44 0.11 0.00 0.50 0.00 0.00 46.19 45.22 2r8b s LEU 90 CO 0.02 0.05 0.16 -0.55 -1.32 0.00 0.00 176.35 174.70 2r8b s SER 91 N 1.00 3.38 0.34 3.68 0.15 0.31 -2.20 113.70 120.36 2r8b s SER 91 Ca -0.03 -1.59 -0.05 0.00 0.70 0.00 0.00 55.95 54.98 2r8b s SER 91 Cb -0.15 -0.39 -0.05 0.00 -1.71 0.00 0.00 66.02 63.73 2r8b s SER 91 CO -0.06 -0.40 0.62 -2.16 1.20 0.00 0.00 173.24 172.45 2r8b s PRO 92 N 1.75 3.62 0.19 5.44 0.04 -1.26 0.16 135.00 144.94 2r8b s PRO 92 Ca 0.12 0.06 -0.25 0.00 0.04 0.00 0.00 61.00 60.97 2r8b s PRO 92 Cb -0.18 -2.57 -0.08 0.00 0.04 0.00 0.00 34.50 31.71 2r8b s PRO 92 CO -0.24 0.10 0.80 0.08 0.04 0.00 0.00 177.00 177.78 2r8b s VAL 93 N -2.26 4.35 0.73 -0.36 1.01 -1.03 -4.21 120.40 118.64 2r8b s VAL 93 Ca 0.45 1.69 -0.14 0.00 0.00 0.00 0.00 61.98 63.98 2r8b s VAL 93 Cb -0.10 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.21 2r8b s VAL 93 CO 0.33 0.45 1.15 -0.83 0.00 0.00 0.00 175.10 176.20 2r8b s GLY 94 N -1.26 2.12 0.00 4.51 0.00 -1.26 -4.63 107.32 106.80 2r8b s GLY 94 Ca 0.38 0.65 0.19 0.00 0.00 0.00 0.00 44.72 45.94 2r8b s GLY 94 CO 0.26 1.03 1.43 2.09 0.00 0.00 0.00 173.10 177.91 2r8b n ASP 95 N -2.88 2.77 -4.54 1.64 3.85 -1.07 -4.47 116.55 111.84 2r8b n ASP 95 Ca 0.12 -1.93 -0.32 0.00 -0.71 0.00 0.00 54.79 51.94 2r8b n ASP 95 Cb 0.51 -0.28 -0.12 0.00 -1.35 0.00 0.00 41.12 39.89 2r8b n ASP 95 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 2r8b s VAL 96 N -1.45 3.40 -0.54 2.12 1.01 -0.58 -4.99 120.40 119.37 2r8b s VAL 96 Ca 0.36 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.62 2r8b s VAL 96 Cb 0.20 -2.42 0.17 0.00 0.00 0.00 0.00 36.38 34.32 2r8b s VAL 96 CO 0.27 0.48 0.41 -0.55 0.00 0.00 0.00 175.10 175.70 2r8b s SER 97 N -1.13 2.98 -0.32 3.32 0.15 -1.26 0.30 113.70 117.75 2r8b s SER 97 Ca 0.14 -3.41 -0.28 0.00 0.70 0.00 0.00 55.95 53.11 2r8b s SER 97 Cb -0.11 -0.98 0.01 0.00 -1.71 0.00 0.00 66.02 63.24 2r8b s SER 97 CO 0.04 -0.13 1.01 -1.83 1.20 0.00 0.00 173.24 173.53 2r8b s GLU 98 N -0.61 4.04 -0.01 5.44 -1.05 -0.14 -4.19 118.70 122.18 2r8b s GLU 98 Ca 0.29 0.97 -0.01 0.00 -0.15 0.00 0.00 54.97 56.07 2r8b s GLU 98 Cb -0.00 -3.73 0.00 0.00 -0.44 0.00 0.00 34.13 29.95 2r8b s GLU 98 CO -0.18 -0.85 0.02 1.58 0.95 0.00 0.00 175.26 176.78 2r8b n HIS 99 N 6.71 -0.08 0.00 4.83 -0.00 -1.26 -1.88 115.22 123.55 2r8b n HIS 99 Ca 0.10 0.03 0.00 0.00 0.46 0.00 0.00 57.72 58.31 2r8b n HIS 99 Cb 0.47 -0.12 0.00 0.00 -0.12 0.00 0.00 29.99 30.22 2r8b n HIS 99 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2r8b n GLY 100 N 0.41 0.58 3.73 1.57 0.00 -1.26 -4.96 105.19 105.26 2r8b n GLY 100 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2r8b n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r8b s ALA 101 N 0.00 3.47 0.08 4.61 0.00 -0.79 -4.96 121.76 124.17 2r8b s ALA 101 Ca 0.00 0.99 -0.21 0.00 0.00 0.00 0.00 51.96 52.73 2r8b s ALA 101 Cb 0.00 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.60 2r8b s ALA 101 CO 0.00 -0.46 0.64 0.00 0.00 0.00 0.00 175.76 175.94 2r8b s ALA 102 N 0.38 3.52 0.14 0.00 0.00 -1.26 -0.97 121.76 123.56 2r8b s ALA 102 Ca 0.57 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.66 2r8b s ALA 102 Cb -0.33 -2.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 2r8b s ALA 102 CO 0.34 0.29 0.01 1.03 0.00 0.00 0.00 175.76 177.44 2r8b s ARG 103 N -0.83 0.96 0.12 0.00 0.52 0.15 -2.28 118.95 117.59 2r8b s ARG 103 Ca 0.32 -1.45 0.25 0.00 -0.52 0.00 0.00 55.73 54.33 2r8b s ARG 103 Cb -0.20 -0.03 0.43 0.00 0.52 0.00 0.00 34.95 35.68 2r8b s ARG 103 CO 0.21 -0.17 1.40 1.19 0.02 0.00 0.00 175.30 177.95 2r8b n PHE 104 N -0.13 0.54 -3.52 -0.53 3.72 -1.26 -1.53 117.46 114.74 2r8b n PHE 104 Ca -0.07 0.16 -0.13 0.00 -0.05 0.00 0.00 57.45 57.35 2r8b n PHE 104 Cb 0.63 -0.65 -0.04 0.00 -0.94 0.00 0.00 39.48 38.47 2r8b n PHE 104 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 2r8b s PHE 105 N -3.14 -0.49 0.44 1.38 -0.71 -1.26 -4.71 117.98 109.49 2r8b s PHE 105 Ca 0.07 0.69 -0.23 0.00 -1.04 0.00 0.00 56.93 56.42 2r8b s PHE 105 Cb 0.14 0.47 -0.08 0.00 -1.21 0.00 0.00 43.02 42.34 2r8b s PHE 105 CO 0.70 -0.54 1.13 1.03 -1.34 0.00 0.00 175.22 176.19 2r8b s ARG 106 N -1.86 3.88 0.01 1.99 3.00 -1.26 -4.97 118.95 119.73 2r8b s ARG 106 Ca -0.03 1.68 0.04 0.00 0.00 0.00 0.00 55.73 57.41 2r8b s ARG 106 Cb -0.00 -2.43 -0.01 0.00 0.00 0.00 0.00 34.95 32.50 2r8b s ARG 106 CO 0.01 -0.43 -0.12 -0.98 0.00 0.00 0.00 175.30 173.78 2r8b s ARG 107 N -2.67 0.86 1.08 3.54 1.70 -1.26 -1.43 118.95 120.77 2r8b s ARG 107 Ca 0.62 -0.54 -0.14 0.00 -0.47 0.00 0.00 55.73 55.20 2r8b s ARG 107 Cb -0.26 -0.83 0.23 0.00 -0.57 0.00 0.00 34.95 33.52 2r8b s ARG 107 CO 0.32 0.22 1.08 0.95 -1.08 0.00 0.00 175.30 176.79 2r8b s THR 108 N -0.54 1.91 0.27 4.99 -4.23 0.02 -4.79 115.64 113.27 2r8b s THR 108 Ca 0.02 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.48 2r8b s THR 108 Cb -0.06 -2.42 0.38 0.00 1.34 0.00 0.00 72.50 71.74 2r8b s THR 108 CO 0.00 0.00 1.59 1.23 -0.54 0.00 0.00 174.62 176.90 2r8b h GLY 109 N -2.20 0.89 0.84 3.99 0.00 -2.02 0.49 103.07 105.05 2r8b h GLY 109 Ca -0.54 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2r8b h GLY 109 CO 0.52 -0.39 0.00 1.18 0.00 0.00 0.00 176.54 177.85 2r8b n GLU 110 N -5.50 0.72 -0.78 4.80 -0.58 -1.26 -4.87 120.64 113.16 2r8b n GLU 110 Ca 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 2r8b n GLU 110 Cb 0.56 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.01 2r8b n GLU 110 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2r8b n GLY 111 N 0.40 0.56 3.80 0.62 0.00 0.17 -5.06 105.19 105.68 2r8b n GLY 111 Ca 0.14 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 2r8b n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r8b s VAL 112 N -2.00 4.60 0.15 1.61 0.11 -1.25 -4.75 120.40 118.87 2r8b s VAL 112 Ca 0.00 1.40 -0.31 0.00 -2.93 0.00 0.00 61.98 60.14 2r8b s VAL 112 Cb 0.00 -3.99 -0.11 0.00 -1.53 0.00 0.00 36.38 30.75 2r8b s VAL 112 CO 0.00 0.54 1.79 -0.31 -3.33 0.00 0.00 175.10 173.79 2r8b s TYR 113 N -1.10 2.42 0.90 1.54 4.12 -1.26 -0.80 117.35 123.16 2r8b s TYR 113 Ca 0.32 0.11 -0.12 0.00 0.02 0.00 0.00 57.07 57.39 2r8b s TYR 113 Cb -0.21 -4.17 0.13 0.00 -1.52 0.00 0.00 41.96 36.19 2r8b s TYR 113 CO 0.22 -4.68 1.13 0.34 0.02 0.00 0.00 175.55 172.57 2r8b s ASP 114 N 2.16 3.63 0.00 2.29 -1.08 -0.52 -4.87 116.67 118.29 2r8b s ASP 114 Ca 0.79 1.06 0.00 0.00 -0.52 0.00 0.00 52.55 53.87 2r8b s ASP 114 Cb -0.47 -1.67 0.00 0.00 -1.46 0.00 0.00 42.92 39.31 2r8b s ASP 114 CO 0.35 -2.48 0.00 0.52 0.52 0.00 0.00 175.17 174.07 2r8b n VAL 116 N -3.73 0.00 -0.04 1.11 0.31 -1.26 -0.94 118.33 113.77 2r8b n VAL 116 Ca 0.06 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.36 2r8b n VAL 116 Cb 0.58 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 33.71 2r8b n VAL 116 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2r8b h ASP 117 N 0.00 0.61 -0.74 4.52 1.82 -1.97 -1.74 116.42 118.91 2r8b h ASP 117 Ca 0.00 -0.17 -0.01 0.00 -0.39 0.00 0.00 57.03 56.47 2r8b h ASP 117 Cb 0.00 -0.16 -0.04 0.00 0.68 0.00 0.00 39.33 39.81 2r8b h ASP 117 CO 0.00 0.75 0.44 0.25 -1.61 0.00 0.00 179.24 179.07 2r8b h LEU 118 N 0.57 0.90 -0.56 2.28 6.46 -1.35 0.73 115.31 124.35 2r8b h LEU 118 Ca 0.10 -0.07 -0.08 0.00 -0.12 0.00 0.00 57.88 57.71 2r8b h LEU 118 Cb 0.53 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 40.21 2r8b h LEU 118 CO 0.03 0.71 0.04 -0.08 -0.62 0.00 0.00 178.44 178.52 2r8b h GLU 119 N 1.02 0.96 -0.14 1.25 4.81 -1.76 -0.48 114.58 120.24 2r8b h GLU 119 Ca 0.26 -0.29 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 2r8b h GLU 119 Cb -0.01 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 2r8b h GLU 119 CO -0.05 0.95 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.99 2r8b h ARG 120 N 0.84 -0.10 0.00 1.92 2.43 -0.91 -2.54 114.38 116.02 2r8b h ARG 120 Ca 0.16 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.27 2r8b h ARG 120 Cb 0.49 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 2r8b h ARG 120 CO 0.02 -0.07 -0.32 0.00 -1.51 0.00 0.00 179.97 178.09 2r8b h ALA 121 N 1.00 1.06 -0.05 2.80 0.00 -0.63 -1.71 119.26 121.72 2r8b h ALA 121 Ca 0.09 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2r8b h ALA 121 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2r8b h ALA 121 CO -0.20 0.40 -0.56 1.15 0.00 0.00 0.00 179.25 180.03 2r8b h THR 122 N 0.00 1.38 -0.08 0.00 2.02 -0.93 -3.07 112.91 112.24 2r8b h THR 122 Ca -0.00 -1.91 -0.19 0.00 0.77 0.00 0.00 66.41 65.08 2r8b h THR 122 Cb 0.79 1.98 -0.00 0.00 -1.74 0.00 0.00 68.15 69.18 2r8b h THR 122 CO 0.04 0.56 -0.75 1.23 0.37 0.00 0.00 175.52 176.96 2r8b h GLY 123 N 1.52 0.51 -0.65 2.16 0.00 -0.91 -2.27 103.07 103.43 2r8b h GLY 123 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.60 2r8b h GLY 123 CO 0.08 0.65 0.00 1.17 0.00 0.00 0.00 176.54 178.44 2r8b n LYS 124 N -3.84 0.26 0.00 4.80 4.81 -0.83 -2.56 118.16 120.80 2r8b n LYS 124 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 2r8b n LYS 124 Cb 0.72 -1.08 0.00 0.00 0.02 0.00 0.00 35.03 34.69 2r8b n LYS 124 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2r8b n ALA 126 N 0.06 0.00 -0.03 3.14 0.00 -0.86 -0.39 120.51 122.44 2r8b n ALA 126 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2r8b n ALA 126 Cb 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.39 2r8b n ALA 126 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2r8b h ASP 127 N 0.00 0.29 -0.07 0.00 3.32 -1.77 -0.72 116.42 117.47 2r8b h ASP 127 Ca 0.00 -0.67 0.04 0.00 0.02 0.00 0.00 57.03 56.42 2r8b h ASP 127 Cb 0.00 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.41 2r8b h ASP 127 CO 0.00 0.92 -0.26 0.15 -1.72 0.00 0.00 179.24 178.33 2r8b h PHE 128 N -0.31 -0.70 0.13 4.55 3.57 -0.93 0.37 116.94 123.62 2r8b h PHE 128 Ca -0.02 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2r8b h PHE 128 Cb 0.92 0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2r8b h PHE 128 CO 0.14 -0.35 -0.06 0.82 -2.23 0.00 0.00 178.31 176.63 2r8b h ILE 129 N -0.36 0.88 -0.88 1.41 2.04 -1.78 -1.57 117.51 117.25 2r8b h ILE 129 Ca 0.08 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.95 2r8b h ILE 129 Cb 0.48 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2r8b h ILE 129 CO -0.28 0.01 0.57 0.11 0.00 0.00 0.00 178.15 178.55 2r8b h LYS 130 N -0.19 1.07 -0.64 2.37 1.57 -0.78 0.25 116.57 120.23 2r8b h LYS 130 Ca -0.02 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 2r8b h LYS 130 Cb 0.15 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2r8b h LYS 130 CO 0.03 0.71 0.21 0.00 -0.57 0.00 0.00 179.45 179.82 2r8b h ALA 131 N 1.36 1.17 0.06 3.86 0.00 0.04 -1.89 119.26 123.86 2r8b h ALA 131 Ca 0.35 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2r8b h ALA 131 Cb 0.01 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.56 2r8b h ALA 131 CO -0.12 0.58 -0.69 -0.91 0.00 0.00 0.00 179.25 178.11 2r8b h ASN 132 N 0.93 0.51 -0.96 0.00 2.35 -0.71 -1.88 115.58 115.82 2r8b h ASN 132 Ca 0.21 -0.84 0.16 0.00 -0.55 0.00 0.00 56.30 55.29 2r8b h ASN 132 Cb 0.25 -0.16 -0.17 0.00 0.05 0.00 0.00 38.32 38.30 2r8b h ASN 132 CO -0.01 1.29 -0.34 -0.09 -1.65 0.00 0.00 177.43 176.64 2r8b h ARG 133 N -0.21 -0.01 0.23 0.81 2.43 -0.89 -0.27 114.38 116.47 2r8b h ARG 133 Ca -0.10 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 2r8b h ARG 133 Cb 1.45 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.01 2r8b h ARG 133 CO 0.13 -0.01 -0.11 1.49 -1.51 0.00 0.00 179.97 179.97 2r8b h GLU 134 N -0.01 -0.29 -0.34 0.20 4.22 -1.22 0.23 114.58 117.37 2r8b h GLU 134 Ca 0.38 0.02 0.05 0.00 0.08 0.00 0.00 59.36 59.89 2r8b h GLU 134 Cb 0.63 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2r8b h GLU 134 CO -0.97 -0.11 0.07 1.25 -2.18 0.00 0.00 179.01 177.07 2r8b h HIS 135 N -0.42 0.12 -0.00 0.92 2.76 -0.37 -1.24 115.15 116.91 2r8b h HIS 135 Ca -0.03 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2r8b h HIS 135 Cb 0.32 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.28 2r8b h HIS 135 CO -0.03 0.03 -0.10 0.66 -1.30 0.00 0.00 177.93 177.19 2r8b n TYR 136 N -5.08 0.00 -3.62 5.26 4.02 -0.23 -4.94 117.16 112.56 2r8b n TYR 136 Ca 0.01 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.68 2r8b n TYR 136 Cb 0.15 -0.26 0.06 0.00 -0.02 0.00 0.00 39.34 39.27 2r8b n TYR 136 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2r8b n GLN 137 N -1.17 -6.25 -1.78 -0.72 6.02 -0.02 -4.49 117.38 108.97 2r8b n GLN 137 Ca 0.13 0.74 -0.29 0.00 -0.01 0.00 0.00 57.00 57.56 2r8b n GLN 137 Cb 0.28 -5.61 0.12 0.00 1.02 0.00 0.00 30.24 26.05 2r8b n GLN 137 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2r8b s ALA 138 N -3.43 2.27 0.00 -1.58 0.00 -0.68 -1.59 121.76 116.75 2r8b s ALA 138 Ca 0.23 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.47 2r8b s ALA 138 Cb -0.11 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2r8b s ALA 138 CO 0.77 -2.04 0.00 0.41 0.00 0.00 0.00 175.76 174.90 2r8b n GLY 139 N -3.01 1.14 3.77 0.00 0.00 -0.24 -4.65 105.19 102.20 2r8b n GLY 139 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 2r8b n GLY 139 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2r8b s PRO 140 N 2.12 4.04 -0.26 1.61 0.02 -1.26 -4.62 135.00 136.65 2r8b s PRO 140 Ca 0.00 2.35 -0.10 0.00 0.02 0.00 0.00 61.00 63.27 2r8b s PRO 140 Cb 0.00 -2.87 -0.05 0.00 0.02 0.00 0.00 34.50 31.60 2r8b s PRO 140 CO 0.00 -0.50 0.15 0.08 -0.33 0.00 0.00 177.00 176.40 2r8b s VAL 141 N -1.18 5.11 -0.05 3.83 1.01 -1.26 0.17 120.40 128.04 2r8b s VAL 141 Ca 0.55 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.67 2r8b s VAL 141 Cb -0.42 -3.41 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 2r8b s VAL 141 CO 0.56 0.31 -0.18 -0.63 0.00 0.00 0.00 175.10 175.15 2r8b s ILE 142 N 1.44 1.54 0.13 2.22 1.01 0.90 -1.15 121.20 127.29 2r8b s ILE 142 Ca 0.07 -0.78 0.10 0.00 0.00 0.00 0.00 60.65 60.04 2r8b s ILE 142 Cb -0.15 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 2r8b s ILE 142 CO 0.07 0.44 -0.23 -0.83 0.00 0.00 0.00 174.94 174.39 2r8b s GLY 143 N 0.03 1.45 -0.04 6.18 0.00 -0.58 -0.77 107.32 113.59 2r8b s GLY 143 Ca -0.04 -1.41 -0.01 0.00 0.00 0.00 0.00 44.72 43.25 2r8b s GLY 143 CO 0.03 -1.41 0.08 -2.27 0.00 0.00 0.00 173.10 169.53 2r8b s LEU 144 N -2.14 0.95 0.02 0.66 0.20 -0.39 0.04 118.68 118.01 2r8b s LEU 144 Ca 0.12 0.16 0.01 0.00 0.69 0.00 0.00 54.13 55.11 2r8b s LEU 144 Cb -0.09 0.14 -0.02 0.00 -0.43 0.00 0.00 46.19 45.79 2r8b s LEU 144 CO 0.06 -0.13 -0.04 -0.83 -0.29 0.00 0.00 176.35 175.12 2r8b s GLY 145 N 1.07 0.27 -0.16 7.98 0.00 -0.79 -0.86 107.32 114.82 2r8b s GLY 145 Ca -0.09 -0.54 -0.02 0.00 0.00 0.00 0.00 44.72 44.08 2r8b s GLY 145 CO -0.04 -0.59 -0.09 -0.12 0.00 0.00 0.00 173.10 172.26 2r8b s PHE 146 N -1.20 2.89 0.00 1.90 5.36 -0.98 -3.93 117.98 122.02 2r8b s PHE 146 Ca -0.12 -0.72 0.00 0.00 -0.96 0.00 0.00 56.93 55.13 2r8b s PHE 146 Cb -0.08 -1.94 0.00 0.00 -0.34 0.00 0.00 43.02 40.65 2r8b s PHE 146 CO -0.01 -0.31 0.00 0.45 -1.46 0.00 0.00 175.22 173.89 2r8b n SER 147 N 3.96 0.00 -0.29 6.13 2.88 -1.19 -1.01 113.62 124.10 2r8b n SER 147 Ca -0.18 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.51 2r8b n SER 147 Cb 0.52 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 64.40 2r8b n SER 147 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2r8b h ASN 148 N 0.00 0.59 0.48 -3.46 -0.73 -1.84 0.24 115.58 110.86 2r8b h ASN 148 Ca 0.00 0.06 -0.20 0.00 1.87 0.00 0.00 56.30 58.03 2r8b h ASN 148 Cb 0.00 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.53 2r8b h ASN 148 CO 0.00 0.24 -0.85 1.23 -0.37 0.00 0.00 177.43 177.68 2r8b h GLY 149 N 0.59 0.29 2.00 1.57 0.00 -0.74 -2.46 103.07 104.32 2r8b h GLY 149 Ca 0.50 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 2r8b h GLY 149 CO -0.25 0.43 -0.25 0.00 0.00 0.00 0.00 176.54 176.47 2r8b h ALA 150 N 0.94 1.30 -0.15 3.60 0.00 -1.03 -1.66 119.26 122.26 2r8b h ALA 150 Ca -0.05 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 2r8b h ALA 150 Cb 1.46 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.22 2r8b h ALA 150 CO 0.13 0.32 -0.59 -0.91 0.00 0.00 0.00 179.25 178.20 2r8b h ASN 151 N 0.00 0.78 0.66 0.00 2.35 -0.78 0.47 115.58 119.07 2r8b h ASN 151 Ca -0.00 -0.61 -0.12 0.00 -0.55 0.00 0.00 56.30 55.01 2r8b h ASN 151 Cb 0.55 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.67 2r8b h ASN 151 CO 0.03 1.27 -0.57 -0.29 -1.65 0.00 0.00 177.43 176.22 2r8b h ILE 152 N 0.35 1.33 -0.10 2.81 -0.00 -1.39 -2.33 117.51 118.19 2r8b h ILE 152 Ca -0.03 -1.99 -0.04 0.00 -0.00 0.00 0.00 64.86 62.80 2r8b h ILE 152 Cb 1.22 2.09 -0.00 0.00 -0.00 0.00 0.00 36.82 40.13 2r8b h ILE 152 CO 0.12 0.55 -0.09 0.25 -0.00 0.00 0.00 178.15 178.99 2r8b h LEU 153 N 0.00 0.24 -1.01 2.19 5.85 -1.05 -2.22 115.31 119.31 2r8b h LEU 153 Ca -0.01 -0.47 0.06 0.00 0.84 0.00 0.00 57.88 58.30 2r8b h LEU 153 Cb 1.05 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.95 2r8b h LEU 153 CO 0.07 0.67 0.65 0.00 -0.34 0.00 0.00 178.44 179.49 2r8b h ALA 154 N 0.58 1.38 -0.46 1.25 0.00 0.05 -1.41 119.26 120.65 2r8b h ALA 154 Ca 0.02 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2r8b h ALA 154 Cb 0.59 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2r8b h ALA 154 CO 0.02 0.48 -0.02 -0.97 0.00 0.00 0.00 179.25 178.76 2r8b h ASN 155 N 1.21 0.74 -0.52 0.00 -1.24 -1.14 -0.53 115.58 114.11 2r8b h ASN 155 Ca 0.43 -0.18 0.00 0.00 0.71 0.00 0.00 56.30 57.25 2r8b h ASN 155 Cb 0.12 -0.20 -0.03 0.00 0.73 0.00 0.00 38.32 38.95 2r8b h ASN 155 CO -0.16 0.82 0.34 0.58 -1.29 0.00 0.00 177.43 177.72 2r8b h VAL 156 N 0.72 1.14 -0.61 2.57 2.07 -0.74 0.26 116.25 121.66 2r8b h VAL 156 Ca 0.14 -0.28 0.13 0.00 0.82 0.00 0.00 66.70 67.51 2r8b h VAL 156 Cb 0.47 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2r8b h VAL 156 CO 0.02 0.14 0.41 -0.07 0.02 0.00 0.00 177.57 178.10 2r8b h LEU 157 N 0.70 0.26 0.18 2.57 3.38 -0.24 0.19 115.31 122.35 2r8b h LEU 157 Ca 0.19 0.01 -0.26 0.00 0.09 0.00 0.00 57.88 57.91 2r8b h LEU 157 Cb -0.06 -0.04 0.03 0.00 0.09 0.00 0.00 40.66 40.67 2r8b h LEU 157 CO -0.04 0.14 -1.15 0.40 0.09 0.00 0.00 178.44 177.88 2r8b h ILE 158 N 0.28 1.36 0.00 1.22 2.04 -0.26 -3.28 117.51 118.87 2r8b h ILE 158 Ca 0.29 -2.59 -0.24 0.00 1.00 0.00 0.00 64.86 63.32 2r8b h ILE 158 Cb 0.76 3.09 -0.04 0.00 -0.74 0.00 0.00 36.82 39.88 2r8b h ILE 158 CO -0.07 0.76 -1.57 -0.33 0.00 0.00 0.00 178.15 176.94 2r8b h GLU 159 N -0.16 0.00 -2.17 2.37 4.39 -0.18 -3.38 114.58 115.46 2r8b h GLU 159 Ca -0.21 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.90 2r8b h GLU 159 Cb 1.87 0.00 -0.42 0.00 -0.10 0.00 0.00 28.75 30.10 2r8b h GLU 159 CO 0.19 0.43 -0.67 1.04 -1.16 0.00 0.00 179.01 178.85 2r8b n GLN 160 N -3.00 2.31 0.27 2.33 1.13 0.65 -4.97 117.38 116.10 2r8b n GLN 160 Ca -0.14 -4.48 0.15 0.00 -1.94 0.00 0.00 57.00 50.60 2r8b n GLN 160 Cb 0.97 -2.11 0.89 0.00 0.11 0.00 0.00 30.24 30.09 2r8b n GLN 160 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2r8b h PRO 161 N 4.09 0.00 -0.43 -1.09 0.13 -1.71 -2.64 132.00 130.34 2r8b h PRO 161 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2r8b h PRO 161 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2r8b h PRO 161 CO 0.79 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.95 2r8b n GLU 162 N -3.85 2.31 -0.05 0.86 1.02 -1.26 -4.29 120.64 115.38 2r8b n GLU 162 Ca -0.02 -2.01 -0.01 0.00 -0.02 0.00 0.00 57.16 55.11 2r8b n GLU 162 Cb 0.15 -1.47 -0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2r8b n GLU 162 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2r8b h LEU 163 N 3.65 0.00 -9.63 -4.62 5.85 -1.83 -3.47 115.31 105.26 2r8b h LEU 163 Ca 0.00 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.20 2r8b h LEU 163 Cb 0.82 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.86 2r8b h LEU 163 CO 0.00 0.49 0.58 -0.36 -0.34 0.00 0.00 178.44 178.82 2r8b s PHE 164 N -1.64 3.39 -0.13 1.25 0.40 -1.26 -4.59 117.98 115.40 2r8b s PHE 164 Ca -0.03 1.34 0.12 0.00 -0.60 0.00 0.00 56.93 57.76 2r8b s PHE 164 Cb 0.00 -3.47 -0.24 0.00 0.51 0.00 0.00 43.02 39.83 2r8b s PHE 164 CO 0.05 -1.40 0.31 -0.25 0.70 0.00 0.00 175.22 174.63 2r8b n ASP 165 N 2.84 0.71 -3.81 1.36 8.00 -0.30 -4.78 116.55 120.57 2r8b n ASP 165 Ca 0.06 0.17 -0.11 0.00 0.71 0.00 0.00 54.79 55.62 2r8b n ASP 165 Cb 0.44 0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 41.75 2r8b n ASP 165 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r8b s ALA 166 N -2.54 -0.49 -0.20 2.24 0.00 -1.17 -1.45 121.76 118.15 2r8b s ALA 166 Ca -0.11 -0.11 -0.17 0.00 0.00 0.00 0.00 51.96 51.57 2r8b s ALA 166 Cb 0.07 0.25 0.06 0.00 0.00 0.00 0.00 23.12 23.49 2r8b s ALA 166 CO 0.80 -0.35 0.53 0.00 0.00 0.00 0.00 175.76 176.75 2r8b s ALA 167 N -2.28 -1.34 -0.11 0.00 0.00 -0.86 -1.52 121.76 115.64 2r8b s ALA 167 Ca -0.07 1.61 0.02 0.00 0.00 0.00 0.00 51.96 53.52 2r8b s ALA 167 Cb -0.02 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 2r8b s ALA 167 CO -0.02 -0.27 -0.19 0.14 0.00 0.00 0.00 175.76 175.42 2r8b s VAL 168 N 0.60 2.48 0.04 0.00 -7.23 0.11 -1.11 120.40 115.29 2r8b s VAL 168 Ca -0.03 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.28 2r8b s VAL 168 Cb -0.05 -1.99 0.00 0.00 0.56 0.00 0.00 36.38 34.90 2r8b s VAL 168 CO -0.04 0.54 0.02 0.18 -0.31 0.00 0.00 175.10 175.50 2r8b n LEU 169 N 3.54 0.00 0.00 1.32 4.77 0.24 -1.89 117.00 124.97 2r8b n LEU 169 Ca -0.19 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 2r8b n LEU 169 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2r8b n LEU 169 CO 0.29 -0.24 0.00 1.41 -1.33 0.00 0.00 177.39 177.52 2r8b n HIS 171 N -0.52 0.00 -1.63 -1.77 8.25 0.58 -1.41 115.22 118.73 2r8b n HIS 171 Ca -0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.17 2r8b n HIS 171 Cb 0.04 0.00 0.12 0.00 1.12 0.00 0.00 29.99 31.27 2r8b n HIS 171 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2r8b s PRO 172 N 0.00 1.53 -0.24 -0.41 0.04 -1.26 -3.15 135.00 131.51 2r8b s PRO 172 Ca 0.00 0.32 -0.03 0.00 0.04 0.00 0.00 61.00 61.33 2r8b s PRO 172 Cb 0.00 -1.88 0.12 0.00 0.04 0.00 0.00 34.50 32.78 2r8b s PRO 172 CO 0.00 -1.94 0.32 -1.17 0.04 0.00 0.00 177.00 174.26 2r8b s LEU 173 N -5.87 -0.44 -0.21 -3.56 0.20 -1.26 -4.84 118.68 102.70 2r8b s LEU 173 Ca 0.63 -0.05 0.00 0.00 0.69 0.00 0.00 54.13 55.40 2r8b s LEU 173 Cb -0.14 0.83 0.05 0.00 -0.43 0.00 0.00 46.19 46.50 2r8b s LEU 173 CO 0.52 -0.32 -0.06 -0.63 -0.29 0.00 0.00 176.35 175.57 2r8b s ILE 174 N 2.46 1.40 -0.50 6.68 -1.09 -1.26 -4.87 121.20 124.01 2r8b s ILE 174 Ca 0.10 -0.99 0.24 0.00 -2.23 0.00 0.00 60.65 57.77 2r8b s ILE 174 Cb -0.15 -1.61 0.24 0.00 -1.58 0.00 0.00 42.46 39.36 2r8b s ILE 174 CO -0.17 0.01 1.53 1.55 -1.23 0.00 0.00 174.94 176.63 2r8b h PRO 175 N 8.02 0.00 -5.98 2.79 0.13 -2.00 -3.46 132.00 131.50 2r8b h PRO 175 Ca -0.22 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.36 2r8b h PRO 175 Cb 1.09 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.14 2r8b h PRO 175 CO 0.42 0.00 -0.50 -0.59 -0.23 0.00 0.00 178.00 177.10 2r8b s PHE 176 N -3.20 2.64 -0.40 1.56 -0.12 -1.26 -5.09 117.98 112.10 2r8b s PHE 176 Ca 0.07 -0.53 -0.16 0.00 -0.05 0.00 0.00 56.93 56.26 2r8b s PHE 176 Cb 0.08 -1.90 0.01 0.00 -0.63 0.00 0.00 43.02 40.59 2r8b s PHE 176 CO 0.68 0.19 0.39 -1.21 -0.05 0.00 0.00 175.22 175.22 2r8b s GLU 177 N -3.91 3.17 0.43 1.99 2.02 -1.26 -5.04 118.70 116.10 2r8b s GLU 177 Ca 0.41 -0.74 -0.26 0.00 0.02 0.00 0.00 54.97 54.40 2r8b s GLU 177 Cb 0.02 -3.94 -0.09 0.00 0.10 0.00 0.00 34.13 30.22 2r8b s GLU 177 CO 0.23 -0.77 1.43 -2.14 0.02 0.00 0.00 175.26 174.03 2r8b s PRO 178 N 2.02 3.80 -0.25 0.39 0.02 -1.26 -4.95 135.00 134.77 2r8b s PRO 178 Ca 0.11 2.42 -0.25 0.00 0.02 0.00 0.00 61.00 63.30 2r8b s PRO 178 Cb -0.17 -2.73 -0.00 0.00 0.02 0.00 0.00 34.50 31.62 2r8b s PRO 178 CO 0.13 -0.73 0.85 -1.59 -0.33 0.00 0.00 177.00 175.32 2r8b s LYS 179 N -2.36 4.16 0.27 5.54 0.00 -1.26 -5.00 119.74 121.08 2r8b s LYS 179 Ca 0.59 0.94 -0.29 0.00 0.00 0.00 0.00 55.97 57.20 2r8b s LYS 179 Cb -0.44 -3.66 -0.09 0.00 0.00 0.00 0.00 37.83 33.64 2r8b s LYS 179 CO 0.57 -0.56 1.17 0.42 0.00 0.00 0.00 175.35 176.95 2r8b s ILE 180 N 2.91 3.34 -0.07 3.79 -1.09 -1.26 -4.98 121.20 123.84 2r8b s ILE 180 Ca 0.36 1.28 -0.09 0.00 -2.23 0.00 0.00 60.65 59.97 2r8b s ILE 180 Cb -0.15 -3.82 0.02 0.00 -1.58 0.00 0.00 42.46 36.93 2r8b s ILE 180 CO 0.08 0.28 0.24 -0.55 -1.23 0.00 0.00 174.94 173.76 2r8b s SER 181 N -0.54 -0.21 0.14 3.58 0.15 -1.26 -5.08 113.70 110.48 2r8b s SER 181 Ca 0.48 0.35 -0.31 0.00 0.70 0.00 0.00 55.95 57.16 2r8b s SER 181 Cb -0.34 0.44 -0.08 0.00 -1.71 0.00 0.00 66.02 64.33 2r8b s SER 181 CO 0.42 -0.17 1.39 -2.84 1.20 0.00 0.00 173.24 173.24 2r8b s PRO 182 N -0.27 4.32 0.57 5.44 0.02 -1.26 -4.62 135.00 139.20 2r8b s PRO 182 Ca -0.04 2.10 -0.02 0.00 0.02 0.00 0.00 61.00 63.07 2r8b s PRO 182 Cb -0.03 -3.23 0.12 0.00 0.02 0.00 0.00 34.50 31.38 2r8b s PRO 182 CO 0.01 -0.42 0.78 0.00 -0.33 0.00 0.00 177.00 177.04 2r8b n ALA 183 N 3.67 -0.02 -2.04 -1.55 0.00 0.66 -4.53 120.51 116.70 2r8b n ALA 183 Ca 0.11 -1.45 -0.40 0.00 0.00 0.00 0.00 53.44 51.70 2r8b n ALA 183 Cb 0.42 0.20 -0.06 0.00 0.00 0.00 0.00 19.45 20.02 2r8b n ALA 183 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2r8b s LYS 184 N -4.53 4.64 0.54 0.00 1.02 -1.26 -4.82 119.74 115.33 2r8b s LYS 184 Ca 0.51 1.26 0.36 0.00 0.02 0.00 0.00 55.97 58.12 2r8b s LYS 184 Cb -0.03 -3.30 1.54 0.00 -0.52 0.00 0.00 37.83 35.52 2r8b s LYS 184 CO 0.34 0.46 1.81 -1.35 -0.92 0.00 0.00 175.35 175.69 2r8b h PRO 185 N 4.69 0.01 -0.00 -1.68 0.11 -1.93 0.22 132.00 133.42 2r8b h PRO 185 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2r8b h PRO 185 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2r8b h PRO 185 CO 0.68 0.01 -0.17 0.25 -0.21 0.00 0.00 178.00 178.56 2r8b n THR 186 N -4.19 0.00 -1.64 -1.15 -2.24 -1.26 -4.01 114.28 99.78 2r8b n THR 186 Ca 0.25 -0.02 -0.44 0.00 -2.27 0.00 0.00 64.05 61.58 2r8b n THR 186 Cb 1.22 -0.17 -0.01 0.00 -2.10 0.00 0.00 70.33 69.28 2r8b n THR 186 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2r8b n ARG 187 N -1.31 1.72 -4.39 -0.78 1.74 0.78 -4.81 116.66 109.62 2r8b n ARG 187 Ca 0.09 0.60 -0.24 0.00 -0.77 0.00 0.00 57.85 57.54 2r8b n ARG 187 Cb 0.31 -2.08 -0.17 0.00 -1.02 0.00 0.00 32.46 29.51 2r8b n ARG 187 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2r8b s ARG 188 N -1.67 1.46 0.09 5.56 0.52 -0.53 -0.20 118.95 124.19 2r8b s ARG 188 Ca 0.57 -0.31 0.08 0.00 -0.52 0.00 0.00 55.73 55.55 2r8b s ARG 188 Cb -0.64 -1.29 -0.03 0.00 0.52 0.00 0.00 34.95 33.50 2r8b s ARG 188 CO 0.61 -0.04 -0.22 0.54 0.02 0.00 0.00 175.30 176.21 2r8b s VAL 189 N 0.88 1.80 -0.12 3.52 0.11 -0.20 -2.04 120.40 124.34 2r8b s VAL 189 Ca -0.11 -1.50 0.02 0.00 -2.93 0.00 0.00 61.98 57.46 2r8b s VAL 189 Cb -0.15 -1.61 0.02 0.00 -1.53 0.00 0.00 36.38 33.11 2r8b s VAL 189 CO 0.01 0.03 -0.16 -0.22 -3.33 0.00 0.00 175.10 171.44 2r8b s LEU 190 N -1.75 1.76 -0.09 2.54 2.96 -0.27 -0.85 118.68 122.98 2r8b s LEU 190 Ca 0.08 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 2r8b s LEU 190 Cb -0.10 -1.14 -0.02 0.00 0.50 0.00 0.00 46.19 45.42 2r8b s LEU 190 CO 0.04 0.01 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.35 2r8b s ILE 191 N 1.05 3.41 -0.05 6.68 1.01 0.46 0.79 121.20 134.55 2r8b s ILE 191 Ca -0.05 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.10 2r8b s ILE 191 Cb -0.15 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 2r8b s ILE 191 CO -0.03 0.56 -0.24 0.42 0.00 0.00 0.00 174.94 175.65 2r8b s THR 192 N -0.30 1.95 0.14 2.92 -4.23 -0.50 0.07 115.64 115.70 2r8b s THR 192 Ca 0.03 -1.01 -0.11 0.00 -1.18 0.00 0.00 61.69 59.42 2r8b s THR 192 Cb -0.13 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.06 2r8b s THR 192 CO 0.03 0.55 0.30 0.00 -0.54 0.00 0.00 174.62 174.95 2r8b s ALA 193 N -0.16 -0.32 0.01 3.99 0.00 -0.72 -0.31 121.76 124.25 2r8b s ALA 193 Ca -0.03 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.35 2r8b s ALA 193 Cb -0.13 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 2r8b s ALA 193 CO 0.03 -0.63 0.00 0.20 0.00 0.00 0.00 175.76 175.37 2r8b s GLY 194 N -2.90 1.88 0.36 0.00 0.00 -1.26 -1.27 107.32 104.13 2r8b s GLY 194 Ca 0.10 -0.96 0.19 0.00 0.00 0.00 0.00 44.72 44.05 2r8b s GLY 194 CO -0.05 -0.84 1.61 0.83 0.00 0.00 0.00 173.10 174.65 2r8b h GLU 195 N 4.26 0.00 -0.84 2.90 5.08 -0.60 -3.33 114.58 122.06 2r8b h GLU 195 Ca -0.49 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.31 2r8b h GLU 195 Cb 1.17 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.01 2r8b h GLU 195 CO 0.58 0.34 -0.64 0.54 -1.00 0.00 0.00 179.01 178.83 2r8b n ARG 196 N -3.28 3.51 -2.86 2.33 1.74 0.20 -4.74 116.66 113.55 2r8b n ARG 196 Ca 0.01 -4.11 -0.42 0.00 -0.77 0.00 0.00 57.85 52.56 2r8b n ARG 196 Cb 0.60 -2.28 -0.04 0.00 -1.02 0.00 0.00 32.46 29.71 2r8b n ARG 196 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2r8b s ASP 197 N -3.41 6.65 0.06 0.55 -1.08 -1.20 -4.29 116.67 113.95 2r8b s ASP 197 Ca 0.52 0.54 0.26 0.00 -0.52 0.00 0.00 52.55 53.35 2r8b s ASP 197 Cb 0.42 -2.44 1.04 0.00 -1.46 0.00 0.00 42.92 40.48 2r8b s ASP 197 CO 0.01 -0.79 1.81 -0.81 0.52 0.00 0.00 175.17 175.92 2r8b n PRO 198 N 6.59 0.06 0.07 4.34 -0.04 -1.26 -2.01 135.00 142.75 2r8b n PRO 198 Ca 0.06 0.11 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 2r8b n PRO 198 Cb 0.48 -1.58 0.05 0.00 -0.04 0.00 0.00 33.50 32.41 2r8b n PRO 198 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2r8b n ILE 199 N -1.69 0.43 -3.49 0.52 5.41 -1.26 -4.75 119.36 114.52 2r8b n ILE 199 Ca 0.06 -0.41 -0.29 0.00 1.00 0.00 0.00 62.75 63.11 2r8b n ILE 199 Cb 0.32 -0.16 -0.12 0.00 -0.71 0.00 0.00 39.64 38.97 2r8b n ILE 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2r8b n PRO 201 N 4.03 2.18 -0.34 0.00 -0.02 -1.26 -4.43 135.00 135.17 2r8b n PRO 201 Ca 0.11 0.78 -0.02 0.00 -2.02 0.00 0.00 63.50 62.34 2r8b n PRO 201 Cb 0.37 -2.50 0.03 0.00 -0.02 0.00 0.00 33.50 31.38 2r8b n PRO 201 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2r8b h VAL 202 N 3.30 0.04 -0.18 -1.45 2.07 -1.86 -1.96 116.25 116.22 2r8b h VAL 202 Ca -0.45 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.03 2r8b h VAL 202 Cb 1.26 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2r8b h VAL 202 CO 0.81 0.00 -0.05 1.56 0.02 0.00 0.00 177.57 179.91 2r8b h GLN 203 N -0.04 0.26 -0.34 1.57 1.08 -1.98 0.11 115.11 115.78 2r8b h GLN 203 Ca 0.31 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 57.31 2r8b h GLN 203 Cb 0.58 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2r8b h GLN 203 CO -0.92 0.34 -0.39 -0.07 -0.95 0.00 0.00 178.83 176.84 2r8b h LEU 204 N 0.26 0.87 -0.46 1.46 3.38 -1.72 0.68 115.31 119.78 2r8b h LEU 204 Ca 0.06 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2r8b h LEU 204 Cb 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2r8b h LEU 204 CO 0.01 1.15 0.21 0.74 0.09 0.00 0.00 178.44 180.64 2r8b h THR 205 N 0.67 1.19 -0.39 0.22 2.02 -0.89 0.15 112.91 115.88 2r8b h THR 205 Ca 0.05 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.62 2r8b h THR 205 Cb 0.96 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 2r8b h THR 205 CO 0.09 0.22 0.10 0.50 0.37 0.00 0.00 175.52 176.79 2r8b h LYS 206 N 0.60 0.63 -0.18 6.66 1.63 -0.60 -0.96 116.57 124.34 2r8b h LYS 206 Ca 0.16 -0.15 -0.11 0.00 -0.85 0.00 0.00 60.65 59.70 2r8b h LYS 206 Cb 0.15 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.69 2r8b h LYS 206 CO -0.02 0.65 -0.36 0.00 -3.45 0.00 0.00 179.45 176.27 2r8b h ALA 207 N 0.95 1.04 -0.74 5.00 0.00 -0.76 -2.10 119.26 122.64 2r8b h ALA 207 Ca 0.12 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 2r8b h ALA 207 Cb 0.31 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2r8b h ALA 207 CO 0.00 0.59 0.22 1.25 0.00 0.00 0.00 179.25 181.32 2r8b h LEU 208 N 0.33 1.09 -0.29 0.00 5.85 -0.09 -1.66 115.31 120.55 2r8b h LEU 208 Ca 0.04 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.60 2r8b h LEU 208 Cb 0.79 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 2r8b h LEU 208 CO 0.06 1.01 -0.00 -0.08 -0.34 0.00 0.00 178.44 179.09 2r8b h GLU 209 N 1.11 0.08 -0.19 1.25 4.81 -0.82 -0.81 114.58 120.01 2r8b h GLU 209 Ca 0.24 -0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.35 2r8b h GLU 209 Cb 0.32 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2r8b h GLU 209 CO -0.01 0.05 -0.38 0.93 -0.73 0.00 0.00 179.01 178.88 2r8b h GLU 210 N 0.08 0.43 0.48 1.92 3.07 -1.19 0.16 114.58 119.52 2r8b h GLU 210 Ca 0.14 -0.20 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 2r8b h GLU 210 Cb 0.19 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 2r8b h GLU 210 CO -0.24 0.75 -0.23 0.77 -1.40 0.00 0.00 179.01 178.65 2r8b h SER 211 N 0.36 -0.55 -0.93 1.42 0.02 -0.93 -1.81 113.55 111.13 2r8b h SER 211 Ca 0.04 -0.08 0.18 0.00 -0.84 0.00 0.00 61.79 61.09 2r8b h SER 211 Cb 0.83 0.14 -0.11 0.00 0.14 0.00 0.00 62.40 63.41 2r8b h SER 211 CO 0.07 -0.19 0.52 -0.07 -1.14 0.00 0.00 176.83 176.01 2r8b h LEU 212 N -0.94 0.63 -1.85 5.07 3.38 -1.08 -0.29 115.31 120.23 2r8b h LEU 212 Ca -0.07 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2r8b h LEU 212 Cb 0.59 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2r8b h LEU 212 CO 0.11 0.21 -0.12 0.50 0.09 0.00 0.00 178.44 179.23 2r8b h LYS 213 N 0.66 0.00 0.00 1.13 3.64 -0.49 -1.47 116.57 120.04 2r8b h LYS 213 Ca 0.54 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.85 2r8b h LYS 213 Cb 0.85 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 2r8b h LYS 213 CO -0.40 0.12 -0.31 0.00 -2.27 0.00 0.00 179.45 176.60 2r8b h ALA 214 N 1.88 0.89 0.00 5.00 0.00 -0.17 -2.98 119.26 123.88 2r8b h ALA 214 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2r8b h ALA 214 Cb 0.24 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2r8b h ALA 214 CO 0.02 0.38 -0.03 1.96 0.00 0.00 0.00 179.25 181.58 2r8b h GLN 215 N 0.00 0.00 0.00 0.00 4.20 -1.09 -3.47 115.11 114.74 2r8b h GLN 215 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2r8b h GLN 215 Cb 1.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 2r8b h GLN 215 CO 0.04 0.03 0.00 0.41 -0.67 0.00 0.00 178.83 178.64 2r8b n GLY 216 N 0.08 1.80 6.62 3.46 0.00 -1.13 -0.24 105.19 115.79 2r8b n GLY 216 Ca 0.01 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.92 2r8b n GLY 216 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r8b n GLY 217 N 0.21 -2.05 3.85 -0.02 0.00 -1.26 -4.77 105.19 101.14 2r8b n GLY 217 Ca 0.00 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 2r8b n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r8b s THR 218 N 0.00 4.70 -0.05 2.61 2.01 0.72 -4.97 115.64 120.66 2r8b s THR 218 Ca 0.00 0.93 -0.02 0.00 0.31 0.00 0.00 61.69 62.91 2r8b s THR 218 Cb 0.00 -3.64 0.03 0.00 0.01 0.00 0.00 72.50 68.90 2r8b s THR 218 CO 0.00 -0.13 0.10 -0.69 -0.69 0.00 0.00 174.62 173.22 2r8b s VAL 219 N -1.91 -0.04 -0.04 3.82 1.01 -1.26 -1.04 120.40 120.94 2r8b s VAL 219 Ca 0.52 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.68 2r8b s VAL 219 Cb -0.11 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.11 2r8b s VAL 219 CO 0.18 0.07 -0.04 -0.70 0.00 0.00 0.00 175.10 174.61 2r8b s GLU 220 N 0.98 0.72 -0.09 2.72 2.12 -0.03 -4.97 118.70 120.15 2r8b s GLU 220 Ca -0.08 -0.10 0.02 0.00 0.36 0.00 0.00 54.97 55.17 2r8b s GLU 220 Cb -0.10 -0.74 -0.02 0.00 0.26 0.00 0.00 34.13 33.52 2r8b s GLU 220 CO -0.04 -0.05 -0.14 0.99 -0.54 0.00 0.00 175.26 175.47 2r8b s THR 221 N 0.77 2.99 -0.19 -1.70 2.01 -1.26 -0.40 115.64 117.85 2r8b s THR 221 Ca -0.10 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.20 2r8b s THR 221 Cb -0.13 -2.21 0.03 0.00 0.01 0.00 0.00 72.50 70.20 2r8b s THR 221 CO 0.00 0.56 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.62 2r8b s VAL 222 N -0.12 2.03 0.23 3.82 1.01 0.11 -4.96 120.40 122.52 2r8b s VAL 222 Ca -0.02 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 60.91 2r8b s VAL 222 Cb -0.14 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2r8b s VAL 222 CO 0.04 0.41 0.41 0.26 0.00 0.00 0.00 175.10 176.21 2r8b s TRP 223 N 1.27 3.48 0.10 5.22 0.52 -1.26 -1.76 118.94 126.52 2r8b s TRP 223 Ca 0.02 0.26 0.02 0.00 0.02 0.00 0.00 56.10 56.42 2r8b s TRP 223 Cb -0.15 -1.79 -0.04 0.00 -1.15 0.00 0.00 33.47 30.34 2r8b s TRP 223 CO -0.11 0.35 -0.06 -3.38 0.02 0.00 0.00 176.95 173.78 2r8b s HIS 224 N -1.96 0.91 0.74 -1.98 -3.43 -0.39 -4.91 115.29 104.27 2r8b s HIS 224 Ca 0.38 -0.93 -0.12 0.00 -0.80 0.00 0.00 55.06 53.58 2r8b s HIS 224 Cb -0.10 -0.53 0.18 0.00 -1.43 0.00 0.00 32.58 30.70 2r8b s HIS 224 CO 0.30 -0.17 0.67 -0.35 -2.00 0.00 0.00 174.74 173.20 2r8b n PRO 225 N -0.06 -2.24 0.00 -0.38 -0.04 -1.26 -0.46 135.00 130.56 2r8b n PRO 225 Ca -0.12 -1.07 0.00 0.00 -0.04 0.00 0.00 63.50 62.27 2r8b n PRO 225 Cb 0.61 -0.99 0.00 0.00 -0.04 0.00 0.00 33.50 33.08 2r8b n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r8b n GLY 226 N -1.86 -0.10 0.00 0.55 0.00 -1.26 -4.31 105.19 98.21 2r8b n GLY 226 Ca 0.09 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2r8b n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r8b n GLY 227 N -0.07 1.40 0.18 -0.02 0.00 -1.26 -0.63 105.19 104.79 2r8b n GLY 227 Ca 0.00 -0.73 0.12 0.00 0.00 0.00 0.00 46.02 45.41 2r8b n GLY 227 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2r8b h HIS 228 N 0.00 0.00 -1.96 1.61 2.76 -1.92 -3.36 115.15 112.27 2r8b h HIS 228 Ca 0.00 0.00 -0.64 0.00 -2.20 0.00 0.00 60.37 57.53 2r8b h HIS 228 Cb 0.00 0.00 0.10 0.00 1.55 0.00 0.00 27.41 29.06 2r8b h HIS 228 CO 0.00 0.00 0.05 -0.85 -1.30 0.00 0.00 177.93 175.83 2r8b n GLU 229 N -2.87 0.99 -2.40 5.26 -0.00 -1.26 -4.98 120.64 115.38 2r8b n GLU 229 Ca 0.03 0.35 -0.42 0.00 -0.00 0.00 0.00 57.16 57.12 2r8b n GLU 229 Cb 0.52 -1.69 -0.03 0.00 -0.00 0.00 0.00 31.44 30.24 2r8b n GLU 229 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2r8b s ILE 230 N -0.72 4.15 0.21 3.84 -1.09 -1.26 -4.93 121.20 121.40 2r8b s ILE 230 Ca 0.66 1.47 0.00 0.00 -2.23 0.00 0.00 60.65 60.54 2r8b s ILE 230 Cb -0.81 -3.94 -0.04 0.00 -1.58 0.00 0.00 42.46 36.08 2r8b s ILE 230 CO 0.57 -0.04 0.39 -0.13 -1.23 0.00 0.00 174.94 174.50 2r8b s ARG 231 N 2.60 3.50 0.24 2.79 0.52 -1.26 -5.00 118.95 122.34 2r8b s ARG 231 Ca 0.57 -0.42 0.00 0.00 -0.52 0.00 0.00 55.73 55.37 2r8b s ARG 231 Cb -0.25 -2.85 0.57 0.00 0.52 0.00 0.00 34.95 32.94 2r8b s ARG 231 CO 0.21 0.40 1.23 0.43 0.02 0.00 0.00 175.30 177.59 2r8b n SER 232 N -0.81 -0.12 0.00 0.23 7.64 -1.26 -1.31 113.62 117.99 2r8b n SER 232 Ca -0.05 1.34 -0.02 0.00 1.01 0.00 0.00 58.87 61.14 2r8b n SER 232 Cb 0.54 -0.48 0.23 0.00 -1.01 0.00 0.00 64.21 63.49 2r8b n SER 232 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2r8b h GLY 233 N 0.00 0.55 1.00 0.23 0.00 -1.99 -1.98 103.07 100.88 2r8b h GLY 233 Ca 0.46 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2r8b h GLY 233 CO -0.75 0.37 0.02 0.83 0.00 0.00 0.00 176.54 177.01 2r8b h GLU 234 N 0.46 0.03 -0.34 4.80 5.08 -1.59 -0.20 114.58 122.82 2r8b h GLU 234 Ca 0.08 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2r8b h GLU 234 Cb 0.55 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 2r8b h GLU 234 CO 0.04 0.02 0.10 0.82 -1.00 0.00 0.00 179.01 178.99 2r8b h ILE 235 N 0.04 0.88 -0.19 3.13 1.08 -1.28 0.16 117.51 121.33 2r8b h ILE 235 Ca 0.01 -0.08 0.05 0.00 -0.39 0.00 0.00 64.86 64.45 2r8b h ILE 235 Cb -0.00 0.63 -0.05 0.00 -3.07 0.00 0.00 36.82 34.32 2r8b h ILE 235 CO -0.00 0.04 -0.15 0.44 -0.69 0.00 0.00 178.15 177.79 2r8b h ASP 236 N 0.24 -0.48 -0.64 1.72 3.32 -1.19 0.26 116.42 119.65 2r8b h ASP 236 Ca 0.15 0.10 0.08 0.00 0.02 0.00 0.00 57.03 57.39 2r8b h ASP 236 Cb 0.14 0.24 -0.07 0.00 0.22 0.00 0.00 39.33 39.86 2r8b h ASP 236 CO -0.17 -0.19 0.30 0.00 -1.72 0.00 0.00 179.24 177.46 2r8b h ALA 237 N 0.96 0.86 0.50 3.45 0.00 -0.49 0.93 119.26 125.47 2r8b h ALA 237 Ca 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2r8b h ALA 237 Cb 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2r8b h ALA 237 CO -0.28 -0.10 -0.44 0.28 0.00 0.00 0.00 179.25 178.71 2r8b h VAL 238 N 0.52 0.13 -0.61 0.00 2.07 0.29 0.17 116.25 118.82 2r8b h VAL 238 Ca 0.31 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.96 2r8b h VAL 238 Cb 0.33 0.13 -0.11 0.00 -1.52 0.00 0.00 31.29 30.12 2r8b h VAL 238 CO -0.26 0.00 -0.04 0.03 0.02 0.00 0.00 177.57 177.32 2r8b h ARG 239 N -0.93 0.08 -0.64 1.57 3.08 0.12 0.74 114.38 118.40 2r8b h ARG 239 Ca -0.05 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.00 2r8b h ARG 239 Cb 0.80 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 2r8b h ARG 239 CO -0.03 0.05 0.42 0.78 -1.07 0.00 0.00 179.97 180.13 2r8b h GLY 240 N 0.09 0.90 0.86 0.04 0.00 -0.56 -2.75 103.07 101.64 2r8b h GLY 240 Ca 0.31 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2r8b h GLY 240 CO -0.55 0.33 0.05 -2.75 0.00 0.00 0.00 176.54 173.63 2r8b h PHE 241 N 0.86 0.31 -0.02 5.60 3.57 0.16 -2.86 116.94 124.56 2r8b h PHE 241 Ca 0.23 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2r8b h PHE 241 Cb -0.09 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.56 2r8b h PHE 241 CO -0.03 0.41 0.00 1.28 -2.23 0.00 0.00 178.31 177.74 2r8b n LEU 242 N -4.80 0.68 -0.10 0.59 4.77 -0.36 -3.66 117.00 114.13 2r8b n LEU 242 Ca -0.04 -0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 55.63 2r8b n LEU 242 Cb 0.16 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 2r8b n LEU 242 CO 0.35 0.12 0.93 0.00 -1.33 0.00 0.00 177.39 177.47 2r8b h ALA 243 N 4.08 0.39 -1.50 -1.18 0.00 -1.24 -1.66 119.26 118.16 2r8b h ALA 243 Ca 0.00 0.04 0.43 0.00 0.00 0.00 0.00 54.91 55.38 2r8b h ALA 243 Cb 0.22 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 2r8b h ALA 243 CO 0.00 -0.28 1.09 0.00 0.00 0.00 0.00 179.25 180.07 2r8b n ALA 244 N -2.33 1.44 0.61 0.00 0.00 -1.24 -1.85 120.51 117.15 2r8b n ALA 244 Ca 0.01 0.49 0.07 0.00 0.00 0.00 0.00 53.44 54.01 2r8b n ALA 244 Cb 0.12 -0.86 -0.09 0.00 0.00 0.00 0.00 19.45 18.62 2r8b n ALA 244 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2r8b n TYR 245 N -3.45 0.00 0.00 0.00 4.01 -0.62 -5.23 117.16 111.87 2r8b n TYR 245 Ca 0.34 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.08 2r8b n TYR 245 Cb 1.54 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 40.53 2r8b n TYR 245 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81