#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 1.35 0.35 3.45 5.66 -1.26 -5.07 114.28 118.75 2r8b n THR 45 Ca 0.00 -0.46 0.14 0.00 -3.05 0.00 0.00 64.05 60.68 2r8b n THR 45 Cb 0.00 -1.48 0.57 0.00 -1.55 0.00 0.00 70.33 67.86 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 -0.28 0.00 -0.75 1.09 2.10 -1.88 -2.87 116.57 113.98 2r8b h LYS 46 Ca -0.56 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.09 2r8b h LYS 46 Cb 1.73 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.06 2r8b h LYS 46 CO -0.18 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.02 2r8b n ASP 47 N -2.63 3.46 0.18 7.07 8.00 -1.26 -4.64 116.55 126.73 2r8b n ASP 47 Ca 0.02 -2.47 0.02 0.00 0.71 0.00 0.00 54.79 53.07 2r8b n ASP 47 Cb 0.28 -0.58 0.32 0.00 -0.02 0.00 0.00 41.12 41.12 2r8b n ASP 47 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2r8b h SER 48 N 2.17 0.00 -3.24 -2.24 4.64 -1.91 -3.39 113.55 109.58 2r8b h SER 48 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 2r8b h SER 48 Cb 1.25 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.24 2r8b h SER 48 CO 0.25 0.43 -0.62 -0.31 -0.87 0.00 0.00 176.83 175.72 2r8b s TYR 49 N -3.90 3.14 0.29 4.77 2.02 -1.26 -5.09 117.35 117.31 2r8b s TYR 49 Ca -0.02 0.07 -0.29 0.00 -0.37 0.00 0.00 57.07 56.46 2r8b s TYR 49 Cb 0.13 -1.62 -0.10 0.00 -0.40 0.00 0.00 41.96 39.97 2r8b s TYR 49 CO 0.72 0.51 1.41 0.12 -1.57 0.00 0.00 175.55 176.74 2r8b s PHE 50 N -1.31 2.97 0.10 2.71 5.36 -1.26 -4.97 117.98 121.58 2r8b s PHE 50 Ca 0.26 1.15 -0.25 0.00 -0.96 0.00 0.00 56.93 57.13 2r8b s PHE 50 Cb -0.12 -3.81 0.07 0.00 -0.34 0.00 0.00 43.02 38.83 2r8b s PHE 50 CO 0.19 -2.49 0.65 -3.38 -1.46 0.00 0.00 175.22 168.73 2r8b s HIS 51 N -0.47 -0.54 0.42 10.12 -3.43 -1.26 -1.83 115.29 118.30 2r8b s HIS 51 Ca 0.56 0.48 -0.18 0.00 -0.80 0.00 0.00 55.06 55.12 2r8b s HIS 51 Cb -0.42 0.53 -0.09 0.00 -1.43 0.00 0.00 32.58 31.16 2r8b s HIS 51 CO 0.49 -0.76 0.89 0.15 -2.00 0.00 0.00 174.74 173.51 2r8b s LYS 52 N -3.15 4.07 0.00 -0.38 1.02 0.87 -4.93 119.74 117.25 2r8b s LYS 52 Ca -0.01 0.92 -0.05 0.00 0.02 0.00 0.00 55.97 56.85 2r8b s LYS 52 Cb -0.01 -2.24 -0.00 0.00 -0.52 0.00 0.00 37.83 35.06 2r8b s LYS 52 CO -0.08 -0.05 0.09 -1.54 -0.92 0.00 0.00 175.35 172.86 2r8b s SER 53 N -2.51 0.06 -0.24 2.83 1.04 -1.26 -0.90 113.70 112.71 2r8b s SER 53 Ca 0.59 -0.22 -0.02 0.00 0.48 0.00 0.00 55.95 56.78 2r8b s SER 53 Cb -0.10 0.18 0.08 0.00 0.10 0.00 0.00 66.02 66.28 2r8b s SER 53 CO 0.20 -0.31 0.06 -0.60 0.98 0.00 0.00 173.24 173.57 2r8b s ARG 54 N -1.20 0.72 0.04 4.02 3.00 0.28 -4.98 118.95 120.83 2r8b s ARG 54 Ca -0.13 -0.70 -0.33 0.00 -1.00 0.00 0.00 55.73 53.57 2r8b s ARG 54 Cb -0.07 -2.05 -0.12 0.00 0.00 0.00 0.00 34.95 32.71 2r8b s ARG 54 CO 0.01 -0.78 1.81 0.00 0.00 0.00 0.00 175.30 176.34 2r8b n ALA 55 N 4.96 1.40 -3.23 6.12 0.00 -1.26 -0.29 120.51 128.21 2r8b n ALA 55 Ca -0.07 0.32 -0.21 0.00 0.00 0.00 0.00 53.44 53.49 2r8b n ALA 55 Cb 0.45 -2.51 0.04 0.00 0.00 0.00 0.00 19.45 17.43 2r8b n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r8b n GLY 56 N 4.15 2.17 3.76 0.00 0.00 -1.26 -4.84 105.19 109.17 2r8b n GLY 56 Ca 0.20 -2.23 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 2r8b n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r8b s VAL 57 N -2.02 2.86 -0.08 1.61 1.01 -1.12 -4.78 120.40 117.88 2r8b s VAL 57 Ca 0.44 0.82 -0.34 0.00 0.00 0.00 0.00 61.98 62.91 2r8b s VAL 57 Cb -0.03 -3.53 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 2r8b s VAL 57 CO 0.28 0.18 1.90 0.00 0.00 0.00 0.00 175.10 177.46 2r8b n ALA 58 N 1.31 0.95 0.00 5.51 0.00 -1.26 -1.84 120.51 125.18 2r8b n ALA 58 Ca 0.02 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2r8b n ALA 58 Cb 0.42 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.35 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 4.47 3.15 3.85 0.00 0.00 -0.78 -4.96 105.19 110.91 2r8b n GLY 59 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.75 2.96 0.67 4.61 0.00 -0.77 -3.77 121.76 122.71 2r8b s ALA 60 Ca 0.00 0.06 -0.17 0.00 0.00 0.00 0.00 51.96 51.85 2r8b s ALA 60 Cb 0.00 -3.13 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 2r8b s ALA 60 CO 0.00 -0.72 0.87 -2.30 0.00 0.00 0.00 175.76 173.61 2r8b n PRO 61 N -2.50 0.61 -3.09 0.00 -0.02 -1.26 -0.97 135.00 127.77 2r8b n PRO 61 Ca 0.07 0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 2r8b n PRO 61 Cb 0.54 -2.11 -0.06 0.00 -0.02 0.00 0.00 33.50 31.85 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 -2.03 4.32 -0.37 2.45 0.20 0.67 -0.67 118.68 123.25 2r8b s LEU 62 Ca 0.73 -0.02 -0.10 0.00 0.69 0.00 0.00 54.13 55.43 2r8b s LEU 62 Cb -0.38 -2.80 0.03 0.00 -0.43 0.00 0.00 46.19 42.62 2r8b s LEU 62 CO 0.50 -0.69 0.19 0.12 -0.29 0.00 0.00 176.35 176.18 2r8b s PHE 63 N 2.82 3.25 -0.14 5.38 2.19 0.20 -0.39 117.98 131.29 2r8b s PHE 63 Ca 0.25 -1.06 -0.04 0.00 0.33 0.00 0.00 56.93 56.41 2r8b s PHE 63 Cb -0.14 -2.41 -0.03 0.00 -1.31 0.00 0.00 43.02 39.12 2r8b s PHE 63 CO 0.17 -0.67 0.02 0.54 1.83 0.00 0.00 175.22 177.11 2r8b s VAL 64 N 1.52 4.41 -0.04 3.12 0.11 0.13 -0.77 120.40 128.89 2r8b s VAL 64 Ca 0.01 -0.19 0.03 0.00 -2.93 0.00 0.00 61.98 58.90 2r8b s VAL 64 Cb -0.19 -2.92 0.01 0.00 -1.53 0.00 0.00 36.38 31.74 2r8b s VAL 64 CO 0.06 0.53 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.49 2r8b s LEU 65 N -0.18 1.74 -0.22 2.54 1.02 -0.84 -1.64 118.68 121.10 2r8b s LEU 65 Ca 0.06 -0.24 0.01 0.00 0.02 0.00 0.00 54.13 53.97 2r8b s LEU 65 Cb -0.12 -0.69 0.05 0.00 0.02 0.00 0.00 46.19 45.45 2r8b s LEU 65 CO 0.02 0.06 -0.08 -0.76 0.02 0.00 0.00 176.35 175.61 2r8b s LEU 66 N 0.34 2.50 0.95 1.79 1.43 -0.37 -4.07 118.68 121.23 2r8b s LEU 66 Ca -0.07 -1.05 -0.11 0.00 -1.03 0.00 0.00 54.13 51.88 2r8b s LEU 66 Cb -0.11 -1.24 0.16 0.00 0.03 0.00 0.00 46.19 45.03 2r8b s LEU 66 CO 0.02 -0.19 1.10 -1.38 0.23 0.00 0.00 176.35 176.13 2r8b s HIS 67 N 1.37 1.80 0.92 0.29 -3.43 -1.26 -2.53 115.29 112.45 2r8b s HIS 67 Ca -0.04 1.54 -0.14 0.00 -0.80 0.00 0.00 55.06 55.62 2r8b s HIS 67 Cb -0.18 -3.22 0.15 0.00 -1.43 0.00 0.00 32.58 27.90 2r8b s HIS 67 CO -0.07 -2.84 1.19 0.20 -2.00 0.00 0.00 174.74 171.21 2r8b s GLY 68 N -2.86 1.62 0.13 -1.38 0.00 -1.20 -2.95 107.32 100.68 2r8b s GLY 68 Ca 0.66 -0.74 -0.35 0.00 0.00 0.00 0.00 44.72 44.29 2r8b s GLY 68 CO 0.59 -0.13 1.30 2.41 0.00 0.00 0.00 173.10 177.27 2r8b n THR 69 N -3.72 0.37 0.00 0.90 -1.04 -1.26 -1.82 114.28 107.70 2r8b n THR 69 Ca 0.09 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2r8b n THR 69 Cb 0.60 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.18 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 2.40 2.85 0.00 3.41 0.00 -0.68 -4.96 105.19 108.22 2r8b n GLY 70 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.00 -0.14 0.00 -0.02 0.00 -0.76 -4.65 105.19 97.62 2r8b n GLY 71 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 0.00 0.27 1.61 3.85 -1.26 -4.53 116.55 116.49 2r8b n ASP 72 Ca 0.00 -0.04 0.16 0.00 -0.71 0.00 0.00 54.79 54.20 2r8b n ASP 72 Cb 0.00 0.00 0.64 0.00 -1.35 0.00 0.00 41.12 40.41 2r8b n ASP 72 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2r8b h GLU 73 N 0.00 0.00 0.00 0.11 3.07 -1.82 -2.90 114.58 113.05 2r8b h GLU 73 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2r8b h GLU 73 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2r8b h GLU 73 CO 0.00 0.05 -0.86 0.09 -1.40 0.00 0.00 179.01 176.89 2r8b n ASN 74 N -3.18 0.75 -0.15 1.42 3.02 -1.26 -3.85 115.26 112.02 2r8b n ASN 74 Ca 0.00 0.16 -0.07 0.00 -0.03 0.00 0.00 54.58 54.65 2r8b n ASN 74 Cb 0.33 0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 39.84 2r8b n ASN 74 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 2r8b h GLN 75 N 0.00 -0.10 -0.02 3.52 4.20 -1.91 -3.29 115.11 117.52 2r8b h GLN 75 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2r8b h GLN 75 Cb 0.86 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.66 2r8b h GLN 75 CO 0.00 -0.07 -0.47 1.19 -0.67 0.00 0.00 178.83 178.81 2r8b n PHE 76 N -4.14 0.00 0.16 2.96 3.72 -1.26 -4.68 117.46 114.22 2r8b n PHE 76 Ca -0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.27 2r8b n PHE 76 Cb 0.16 -0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.62 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 2.41 -1.03 0.00 1.38 3.57 -1.67 -1.96 116.94 119.65 2r8b h PHE 77 Ca 0.00 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 2r8b h PHE 77 Cb 0.75 0.42 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 2r8b h PHE 77 CO 0.00 -0.46 -0.55 -0.44 -2.23 0.00 0.00 178.31 174.63 2r8b h ASP 78 N -0.64 0.00 -0.40 0.41 3.45 -1.84 -0.71 116.42 116.68 2r8b h ASP 78 Ca -0.03 0.00 0.08 0.00 0.43 0.00 0.00 57.03 57.52 2r8b h ASP 78 Cb 0.59 0.00 -0.09 0.00 -0.56 0.00 0.00 39.33 39.27 2r8b h ASP 78 CO -0.11 0.55 -0.20 0.15 -1.57 0.00 0.00 179.24 178.06 2r8b h PHE 79 N 0.00 -0.51 0.00 4.55 3.57 -1.81 0.20 116.94 122.95 2r8b h PHE 79 Ca -0.01 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2r8b h PHE 79 Cb 1.30 0.29 0.00 0.00 2.79 0.00 0.00 35.95 40.33 2r8b h PHE 79 CO 0.00 -0.28 -0.01 0.41 -2.23 0.00 0.00 178.31 176.20 2r8b n GLY 80 N -1.38 -1.51 0.13 2.40 0.00 -0.75 -2.15 105.19 101.93 2r8b n GLY 80 Ca 0.02 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 2r8b n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r8b h ALA 81 N 2.97 0.10 -0.84 4.61 0.00 0.05 -2.92 119.26 123.23 2r8b h ALA 81 Ca 0.00 -0.49 0.08 0.00 0.00 0.00 0.00 54.91 54.50 2r8b h ALA 81 Cb 0.52 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 2r8b h ALA 81 CO 0.00 0.24 0.55 -0.09 0.00 0.00 0.00 179.25 179.95 2r8b h ARG 82 N -0.17 0.83 -0.08 0.00 2.43 -1.06 -3.18 114.38 113.14 2r8b h ARG 82 Ca -0.04 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 58.89 2r8b h ARG 82 Cb 1.10 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 30.48 2r8b h ARG 82 CO 0.08 0.55 -0.70 -0.07 -1.51 0.00 0.00 179.97 178.32 2r8b h LEU 83 N 0.85 0.75 -7.12 3.80 3.38 -1.39 -3.39 115.31 112.19 2r8b h LEU 83 Ca 0.38 -0.68 -0.62 0.00 0.09 0.00 0.00 57.88 57.05 2r8b h LEU 83 Cb 0.35 -0.22 -0.40 0.00 0.09 0.00 0.00 40.66 40.47 2r8b h LEU 83 CO -0.15 1.32 -0.70 -0.76 0.09 0.00 0.00 178.44 178.24 2r8b s LEU 84 N -8.40 3.22 0.65 1.67 1.43 -1.11 -4.96 118.68 111.18 2r8b s LEU 84 Ca -0.12 -2.75 0.36 0.00 -1.03 0.00 0.00 54.13 50.59 2r8b s LEU 84 Cb 0.06 -1.23 1.96 0.00 0.03 0.00 0.00 46.19 47.01 2r8b s LEU 84 CO 0.87 -0.26 2.13 -0.65 0.23 0.00 0.00 176.35 178.67 2r8b h PRO 85 N 6.66 0.00 0.00 1.29 0.11 -1.77 -0.22 132.00 138.07 2r8b h PRO 85 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2r8b h PRO 85 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2r8b h PRO 85 CO 0.55 0.00 -0.35 0.00 -0.21 0.00 0.00 178.00 177.99 2r8b n GLN 86 N -3.13 0.22 -2.20 1.05 10.64 -1.26 -4.99 117.38 117.71 2r8b n GLN 86 Ca -0.02 -1.12 -0.33 0.00 -1.83 0.00 0.00 57.00 53.70 2r8b n GLN 86 Cb 0.25 -0.63 -0.00 0.00 -0.86 0.00 0.00 30.24 29.00 2r8b n GLN 86 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2r8b s ALA 87 N -0.36 2.76 0.07 2.61 0.00 -0.09 -2.80 121.76 123.95 2r8b s ALA 87 Ca 0.04 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 52.20 2r8b s ALA 87 Cb 0.03 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 2r8b s ALA 87 CO 0.00 -0.67 0.99 -0.08 0.00 0.00 0.00 175.76 176.00 2r8b s THR 88 N -2.24 4.58 -0.07 0.00 -1.32 0.15 -4.17 115.64 112.57 2r8b s THR 88 Ca 0.66 2.00 0.05 0.00 -1.21 0.00 0.00 61.69 63.19 2r8b s THR 88 Cb -0.17 -4.28 -0.01 0.00 -1.51 0.00 0.00 72.50 66.53 2r8b s THR 88 CO 0.31 0.24 -0.24 -0.63 -2.21 0.00 0.00 174.62 172.08 2r8b s ILE 89 N 0.46 2.04 -0.06 5.08 1.01 0.60 -0.62 121.20 129.70 2r8b s ILE 89 Ca 0.50 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.10 2r8b s ILE 89 Cb -0.23 -1.74 0.03 0.00 0.01 0.00 0.00 42.46 40.52 2r8b s ILE 89 CO 0.29 0.56 -0.01 -0.22 0.00 0.00 0.00 174.94 175.57 2r8b s LEU 90 N 0.05 0.79 -0.29 2.97 0.20 0.05 -0.56 118.68 121.90 2r8b s LEU 90 Ca -0.10 -0.10 -0.03 0.00 0.69 0.00 0.00 54.13 54.60 2r8b s LEU 90 Cb -0.15 -0.44 0.11 0.00 -0.43 0.00 0.00 46.19 45.27 2r8b s LEU 90 CO 0.06 -0.16 0.17 -0.55 -0.29 0.00 0.00 176.35 175.58 2r8b s SER 91 N 1.69 2.98 0.29 3.68 0.15 -0.08 -1.99 113.70 120.43 2r8b s SER 91 Ca 0.01 -1.11 -0.09 0.00 0.70 0.00 0.00 55.95 55.45 2r8b s SER 91 Cb -0.13 -0.11 -0.07 0.00 -1.71 0.00 0.00 66.02 64.00 2r8b s SER 91 CO -0.04 -0.42 0.62 -2.16 1.20 0.00 0.00 173.24 172.44 2r8b s PRO 92 N 2.17 3.79 -0.00 5.44 0.04 -1.26 -0.09 135.00 145.09 2r8b s PRO 92 Ca 0.09 0.31 -0.20 0.00 0.04 0.00 0.00 61.00 61.24 2r8b s PRO 92 Cb -0.15 -2.56 -0.05 0.00 0.04 0.00 0.00 34.50 31.77 2r8b s PRO 92 CO -0.35 0.20 0.57 0.54 0.04 0.00 0.00 177.00 178.00 2r8b s VAL 93 N -2.02 4.91 0.92 -0.36 0.11 -0.76 -4.31 120.40 118.90 2r8b s VAL 93 Ca 0.48 1.20 -0.10 0.00 -2.93 0.00 0.00 61.98 60.63 2r8b s VAL 93 Cb -0.11 -3.91 0.14 0.00 -1.53 0.00 0.00 36.38 30.98 2r8b s VAL 93 CO 0.25 0.44 1.10 0.61 -3.33 0.00 0.00 175.10 174.17 2r8b n GLY 94 N 2.38 -0.49 0.98 6.54 0.00 -1.26 -4.56 105.19 108.77 2r8b n GLY 94 Ca -0.08 -0.73 0.09 0.00 0.00 0.00 0.00 46.02 45.31 2r8b n GLY 94 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2r8b n ASP 95 N -4.10 3.25 -4.49 1.61 3.85 -1.00 -4.60 116.55 111.06 2r8b n ASP 95 Ca 0.12 -1.93 -0.33 0.00 -0.71 0.00 0.00 54.79 51.93 2r8b n ASP 95 Cb 0.52 -0.27 -0.13 0.00 -1.35 0.00 0.00 41.12 39.90 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 -1.18 3.28 -0.16 2.12 1.01 -0.44 -5.00 120.40 120.04 2r8b s VAL 96 Ca 0.34 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2r8b s VAL 96 Cb 0.19 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 34.25 2r8b s VAL 96 CO 0.26 0.58 -0.17 -0.55 0.00 0.00 0.00 175.10 175.22 2r8b s SER 97 N -0.54 3.49 -0.85 3.32 0.15 -1.26 -0.19 113.70 117.81 2r8b s SER 97 Ca 0.08 -0.52 -0.13 0.00 0.70 0.00 0.00 55.95 56.07 2r8b s SER 97 Cb -0.12 -1.53 0.22 0.00 -1.71 0.00 0.00 66.02 62.88 2r8b s SER 97 CO 0.02 0.06 0.80 -0.70 1.20 0.00 0.00 173.24 174.62 2r8b s GLU 98 N 0.93 3.63 0.00 5.44 2.12 0.26 -4.60 118.70 126.48 2r8b s GLU 98 Ca -0.03 -2.56 0.00 0.00 0.36 0.00 0.00 54.97 52.74 2r8b s GLU 98 Cb -0.15 -4.42 0.00 0.00 0.26 0.00 0.00 34.13 29.83 2r8b s GLU 98 CO -0.03 -1.28 0.00 0.72 -0.54 0.00 0.00 175.26 174.13 2r8b n HIS 99 N 3.79 0.00 0.00 5.30 8.25 -1.26 -2.92 115.22 128.38 2r8b n HIS 99 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2r8b n HIS 99 Cb 0.46 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 2r8b n HIS 99 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2r8b n GLY 100 N 0.22 1.98 3.67 -1.41 0.00 -1.26 -5.03 105.19 103.35 2r8b n GLY 100 Ca 0.00 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 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 -0.66 3.64 0.26 4.61 0.00 -1.15 -4.89 121.76 123.57 2r8b s ALA 101 Ca 0.00 1.27 -0.29 0.00 0.00 0.00 0.00 51.96 52.93 2r8b s ALA 101 Cb 0.00 -3.79 -0.09 0.00 0.00 0.00 0.00 23.12 19.24 2r8b s ALA 101 CO 0.00 -1.39 0.94 0.00 0.00 0.00 0.00 175.76 175.31 2r8b s ALA 102 N 3.73 3.31 0.25 0.00 0.00 -1.26 0.88 121.76 128.68 2r8b s ALA 102 Ca 0.82 0.60 -0.04 0.00 0.00 0.00 0.00 51.96 53.33 2r8b s ALA 102 Cb -0.41 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 2r8b s ALA 102 CO 0.37 0.20 0.31 -0.98 0.00 0.00 0.00 175.76 175.66 2r8b s ARG 103 N -1.38 1.47 0.00 0.00 1.70 0.73 -1.69 118.95 119.79 2r8b s ARG 103 Ca 0.43 -1.57 0.26 0.00 -0.47 0.00 0.00 55.73 54.38 2r8b s ARG 103 Cb -0.24 0.37 0.69 0.00 -0.57 0.00 0.00 34.95 35.19 2r8b s ARG 103 CO 0.30 -0.56 1.53 1.19 -1.08 0.00 0.00 175.30 176.68 2r8b n PHE 104 N -0.38 0.00 -3.60 5.89 3.01 -1.26 -1.32 117.46 119.79 2r8b n PHE 104 Ca 0.01 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.44 2r8b n PHE 104 Cb 0.64 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 40.01 2r8b n PHE 104 CO 0.00 0.00 0.00 -0.59 1.01 0.00 0.00 176.76 177.18 2r8b s PHE 105 N -2.39 -0.13 -0.04 1.38 -0.71 -1.26 -4.78 117.98 110.06 2r8b s PHE 105 Ca 0.26 0.05 -0.18 0.00 -1.04 0.00 0.00 56.93 56.02 2r8b s PHE 105 Cb 0.19 0.53 -0.05 0.00 -1.21 0.00 0.00 43.02 42.48 2r8b s PHE 105 CO 0.49 -0.27 0.50 0.50 -1.34 0.00 0.00 175.22 175.10 2r8b s ARG 106 N -2.51 4.21 0.01 1.99 3.52 -1.26 -4.98 118.95 119.93 2r8b s ARG 106 Ca 0.10 0.55 -0.02 0.00 -0.13 0.00 0.00 55.73 56.23 2r8b s ARG 106 Cb 0.00 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 30.02 2r8b s ARG 106 CO -0.05 0.40 0.16 1.03 -0.81 0.00 0.00 175.30 176.04 2r8b s ARG 107 N -0.22 3.33 0.98 5.12 0.52 -1.26 0.30 118.95 127.71 2r8b s ARG 107 Ca 0.27 -0.39 -0.11 0.00 -0.52 0.00 0.00 55.73 54.97 2r8b s ARG 107 Cb -0.17 -3.02 0.18 0.00 0.52 0.00 0.00 34.95 32.46 2r8b s ARG 107 CO 0.14 0.66 1.09 0.95 0.02 0.00 0.00 175.30 178.15 2r8b s THR 108 N -1.32 2.31 0.46 0.02 -4.23 0.10 -4.84 115.64 108.14 2r8b s THR 108 Ca 0.27 0.10 -0.22 0.00 -1.18 0.00 0.00 61.69 60.66 2r8b s THR 108 Cb -0.12 -2.30 -0.10 0.00 1.34 0.00 0.00 72.50 71.32 2r8b s THR 108 CO 0.19 -0.13 0.78 0.61 -0.54 0.00 0.00 174.62 175.53 2r8b n GLY 109 N -0.09 -0.83 2.66 3.99 0.00 -1.26 -0.61 105.19 109.05 2r8b n GLY 109 Ca 0.08 0.04 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 2r8b n GLY 109 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r8b n GLU 110 N 0.14 -1.39 -0.34 1.61 4.71 -1.26 -4.41 120.64 119.72 2r8b n GLU 110 Ca 0.11 0.63 0.00 0.00 -0.01 0.00 0.00 57.16 57.89 2r8b n GLU 110 Cb 0.41 -4.79 0.00 0.00 -1.01 0.00 0.00 31.44 26.05 2r8b n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2r8b n GLY 111 N -0.31 0.74 3.74 0.62 0.00 0.22 -5.06 105.19 105.14 2r8b n GLY 111 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.38 4.97 0.25 1.61 0.11 -1.24 -4.73 120.40 118.98 2r8b s VAL 112 Ca 0.00 1.31 -0.31 0.00 -2.93 0.00 0.00 61.98 60.05 2r8b s VAL 112 Cb 0.00 -3.97 -0.12 0.00 -1.53 0.00 0.00 36.38 30.76 2r8b s VAL 112 CO 0.00 0.35 1.58 -1.22 -3.33 0.00 0.00 175.10 172.48 2r8b n TYR 113 N 3.18 2.62 -1.76 1.54 4.01 -1.26 0.02 117.16 125.51 2r8b n TYR 113 Ca -0.05 0.25 -0.29 0.00 -0.16 0.00 0.00 57.90 57.65 2r8b n TYR 113 Cb 0.51 -2.58 0.16 0.00 -0.31 0.00 0.00 39.34 37.12 2r8b n TYR 113 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2r8b s ASP 114 N 0.64 3.33 0.00 7.72 -1.08 0.15 -4.82 116.67 122.61 2r8b s ASP 114 Ca 0.69 0.58 0.00 0.00 -0.52 0.00 0.00 52.55 53.29 2r8b s ASP 114 Cb -0.55 -0.86 0.00 0.00 -1.46 0.00 0.00 42.92 40.05 2r8b s ASP 114 CO 0.44 -2.62 0.00 1.33 0.52 0.00 0.00 175.17 174.84 2r8b n VAL 116 N -3.75 0.00 -0.18 1.11 0.24 -1.26 -0.90 118.33 113.59 2r8b n VAL 116 Ca 0.11 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.32 2r8b n VAL 116 Cb 0.60 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 33.00 2r8b n VAL 116 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2r8b h ASP 117 N 0.00 1.01 -0.67 -1.34 1.82 -1.97 0.39 116.42 115.67 2r8b h ASP 117 Ca 0.00 -0.33 0.01 0.00 -0.39 0.00 0.00 57.03 56.32 2r8b h ASP 117 Cb 0.00 -0.28 -0.03 0.00 0.68 0.00 0.00 39.33 39.70 2r8b h ASP 117 CO 0.00 1.12 0.44 0.25 -1.61 0.00 0.00 179.24 179.44 2r8b h LEU 118 N 0.90 0.76 -0.56 2.28 5.85 -1.34 -0.60 115.31 122.60 2r8b h LEU 118 Ca 0.14 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2r8b h LEU 118 Cb 0.66 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 2r8b h LEU 118 CO 0.05 0.55 0.10 -0.08 -0.34 0.00 0.00 178.44 178.72 2r8b h GLU 119 N 0.90 0.93 -0.67 1.25 4.81 -1.77 -0.49 114.58 119.54 2r8b h GLU 119 Ca 0.24 -0.25 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 2r8b h GLU 119 Cb -0.10 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 29.10 2r8b h GLU 119 CO -0.05 0.89 0.31 -0.09 -0.73 0.00 0.00 179.01 179.33 2r8b h ARG 120 N 0.82 0.52 0.04 1.92 2.43 -0.43 -1.77 114.38 117.92 2r8b h ARG 120 Ca 0.17 -0.03 -0.23 0.00 -0.81 0.00 0.00 59.98 59.08 2r8b h ARG 120 Cb 0.40 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2r8b h ARG 120 CO 0.01 0.34 -1.03 0.00 -1.51 0.00 0.00 179.97 177.78 2r8b h ALA 121 N 1.43 0.33 -0.27 2.80 0.00 -0.83 -1.88 119.26 120.83 2r8b h ALA 121 Ca 0.34 -0.83 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2r8b h ALA 121 Cb 0.37 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2r8b h ALA 121 CO -0.28 1.03 0.04 1.15 0.00 0.00 0.00 179.25 181.19 2r8b h THR 122 N 0.06 1.23 -0.46 0.00 2.02 -0.91 -2.73 112.91 112.13 2r8b h THR 122 Ca -0.06 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.31 2r8b h THR 122 Cb 1.74 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 69.35 2r8b h THR 122 CO 0.16 0.26 0.21 1.23 0.37 0.00 0.00 175.52 177.74 2r8b h GLY 123 N 0.27 0.68 -0.90 2.16 0.00 -1.23 -1.38 103.07 102.67 2r8b h GLY 123 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2r8b h GLY 123 CO 0.01 0.30 0.00 1.17 0.00 0.00 0.00 176.54 178.01 2r8b n LYS 124 N -4.39 0.51 0.00 4.80 4.81 -0.72 -2.85 118.16 120.33 2r8b n LYS 124 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2r8b n LYS 124 Cb 0.13 -1.23 0.00 0.00 0.02 0.00 0.00 35.03 33.95 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 0.17 0.00 -0.02 3.14 0.00 -0.52 -1.20 120.51 122.08 2r8b n ALA 126 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2r8b n ALA 126 Cb 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.52 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 0.16 -0.11 0.00 3.32 -1.79 0.15 116.42 118.15 2r8b h ASP 127 Ca 0.00 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.06 2r8b h ASP 127 Cb 0.00 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 2r8b h ASP 127 CO 0.00 0.15 -0.28 0.15 -1.72 0.00 0.00 179.24 177.54 2r8b h PHE 128 N 0.16 -0.77 0.55 4.55 3.57 -1.39 0.27 116.94 123.88 2r8b h PHE 128 Ca 0.05 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 2r8b h PHE 128 Cb 0.02 0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 2r8b h PHE 128 CO -0.06 -0.36 -0.34 0.82 -2.23 0.00 0.00 178.31 176.14 2r8b h ILE 129 N -0.37 0.31 -1.01 1.41 2.04 -1.71 -1.71 117.51 116.48 2r8b h ILE 129 Ca 0.09 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.19 2r8b h ILE 129 Cb 0.51 0.31 -0.12 0.00 -0.74 0.00 0.00 36.82 36.78 2r8b h ILE 129 CO -0.32 0.00 0.60 0.11 0.00 0.00 0.00 178.15 178.55 2r8b h LYS 130 N -0.84 0.58 -0.16 2.37 1.57 -0.70 -0.96 116.57 118.43 2r8b h LYS 130 Ca -0.06 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.51 2r8b h LYS 130 Cb 0.68 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 2r8b h LYS 130 CO 0.07 0.38 -0.59 0.00 -0.57 0.00 0.00 179.45 178.74 2r8b h ALA 131 N 1.71 0.67 0.07 3.86 0.00 -0.17 -2.42 119.26 122.99 2r8b h ALA 131 Ca 0.63 -0.53 -0.29 0.00 0.00 0.00 0.00 54.91 54.72 2r8b h ALA 131 Cb 1.20 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.94 2r8b h ALA 131 CO -0.45 0.70 -1.17 -0.91 0.00 0.00 0.00 179.25 177.43 2r8b h ASN 132 N 0.40 0.86 -0.86 0.00 2.35 -0.64 -2.15 115.58 115.55 2r8b h ASN 132 Ca -0.00 -0.76 0.09 0.00 -0.55 0.00 0.00 56.30 55.08 2r8b h ASN 132 Cb 1.14 -0.27 -0.11 0.00 0.05 0.00 0.00 38.32 39.13 2r8b h ASN 132 CO 0.11 1.56 -0.47 -1.14 -1.65 0.00 0.00 177.43 175.84 2r8b n ARG 133 N -3.80 -0.34 0.24 0.81 3.00 -0.43 -1.18 116.66 114.96 2r8b n ARG 133 Ca -0.12 1.30 -0.17 0.00 -0.00 0.00 0.00 57.85 58.86 2r8b n ARG 133 Cb 0.95 -1.91 -0.09 0.00 0.00 0.00 0.00 32.46 31.41 2r8b n ARG 133 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2r8b h GLU 134 N 0.00 -0.82 -0.13 -0.14 4.39 -1.28 -0.41 114.58 116.19 2r8b h GLU 134 Ca 0.17 0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.97 2r8b h GLU 134 Cb 0.38 0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 29.16 2r8b h GLU 134 CO -0.81 -0.54 -0.21 1.25 -1.16 0.00 0.00 179.01 177.53 2r8b h HIS 135 N -0.85 -0.57 -0.00 4.33 2.76 -0.75 -1.64 115.15 118.44 2r8b h HIS 135 Ca -0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2r8b h HIS 135 Cb 0.76 0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.99 2r8b h HIS 135 CO -0.25 -0.29 -0.13 0.66 -1.30 0.00 0.00 177.93 176.62 2r8b n TYR 136 N -5.35 0.00 -3.64 5.26 4.02 -0.33 -4.94 117.16 112.18 2r8b n TYR 136 Ca -0.03 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.63 2r8b n TYR 136 Cb 0.26 -0.22 0.06 0.00 -0.02 0.00 0.00 39.34 39.43 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 -1.05 -6.82 -1.58 -0.72 6.02 -0.19 -4.52 117.38 108.52 2r8b n GLN 137 Ca 0.13 0.76 -0.30 0.00 -0.01 0.00 0.00 57.00 57.58 2r8b n GLN 137 Cb 0.29 -5.72 0.09 0.00 1.02 0.00 0.00 30.24 25.92 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 -3.37 2.28 0.00 -1.58 0.00 -1.03 -1.87 121.76 116.20 2r8b s ALA 138 Ca 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.15 2r8b s ALA 138 Cb -0.19 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 19.83 2r8b s ALA 138 CO 0.76 -1.70 0.00 0.41 0.00 0.00 0.00 175.76 175.23 2r8b n GLY 139 N -2.17 0.39 3.75 0.00 0.00 -0.14 -4.63 105.19 102.38 2r8b n GLY 139 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 1.78 3.20 -0.18 1.61 0.02 -1.26 -4.66 135.00 135.51 2r8b s PRO 140 Ca 0.00 2.29 -0.07 0.00 0.02 0.00 0.00 61.00 63.24 2r8b s PRO 140 Cb 0.00 -2.31 -0.04 0.00 0.02 0.00 0.00 34.50 32.16 2r8b s PRO 140 CO 0.00 -1.16 0.07 0.14 -0.33 0.00 0.00 177.00 175.71 2r8b s VAL 141 N -1.27 4.87 0.03 3.83 -7.23 -1.26 -0.24 120.40 119.12 2r8b s VAL 141 Ca 0.70 -0.01 0.06 0.00 -1.81 0.00 0.00 61.98 60.93 2r8b s VAL 141 Cb -0.42 -3.19 -0.02 0.00 0.56 0.00 0.00 36.38 33.32 2r8b s VAL 141 CO 0.50 0.47 -0.18 -0.63 -0.31 0.00 0.00 175.10 174.95 2r8b s ILE 142 N 0.24 1.46 0.06 -0.62 1.01 0.47 -1.15 121.20 122.67 2r8b s ILE 142 Ca 0.04 -1.02 0.01 0.00 0.00 0.00 0.00 60.65 59.69 2r8b s ILE 142 Cb -0.12 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 2r8b s ILE 142 CO 0.00 0.22 -0.06 -0.83 0.00 0.00 0.00 174.94 174.26 2r8b s GLY 143 N -0.94 0.56 -0.08 6.18 0.00 -0.78 -0.69 107.32 111.57 2r8b s GLY 143 Ca 0.06 -1.00 -0.05 0.00 0.00 0.00 0.00 44.72 43.73 2r8b s GLY 143 CO 0.01 -1.07 0.20 -2.27 0.00 0.00 0.00 173.10 169.96 2r8b s LEU 144 N -2.22 0.82 0.01 0.66 0.20 -0.65 0.05 118.68 117.54 2r8b s LEU 144 Ca -0.01 0.41 -0.06 0.00 0.69 0.00 0.00 54.13 55.16 2r8b s LEU 144 Cb -0.03 0.60 -0.00 0.00 -0.43 0.00 0.00 46.19 46.33 2r8b s LEU 144 CO -0.03 -0.12 0.10 -0.83 -0.29 0.00 0.00 176.35 175.18 2r8b s GLY 145 N 0.80 0.09 -0.17 7.98 0.00 -0.64 -1.24 107.32 114.14 2r8b s GLY 145 Ca -0.06 -0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.43 2r8b s GLY 145 CO -0.05 -0.36 -0.16 -0.12 0.00 0.00 0.00 173.10 172.42 2r8b s PHE 146 N -1.39 2.79 0.00 1.90 5.36 -1.05 -4.01 117.98 121.58 2r8b s PHE 146 Ca -0.15 -1.30 0.00 0.00 -0.96 0.00 0.00 56.93 54.52 2r8b s PHE 146 Cb -0.08 -1.92 0.00 0.00 -0.34 0.00 0.00 43.02 40.68 2r8b s PHE 146 CO 0.01 -0.63 0.00 0.45 -1.46 0.00 0.00 175.22 173.59 2r8b n SER 147 N 4.38 0.00 -0.12 6.13 2.88 -1.17 -1.56 113.62 124.16 2r8b n SER 147 Ca -0.20 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.53 2r8b n SER 147 Cb 0.51 0.00 0.58 0.00 -0.75 0.00 0.00 64.21 64.55 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 0.24 0.40 -3.46 -0.73 -1.84 0.88 115.58 111.07 2r8b h ASN 148 Ca 0.00 0.02 -0.24 0.00 1.87 0.00 0.00 56.30 57.94 2r8b h ASN 148 Cb 0.00 -0.03 0.01 0.00 0.27 0.00 0.00 38.32 38.56 2r8b h ASN 148 CO 0.00 0.12 -1.04 1.23 -0.37 0.00 0.00 177.43 177.36 2r8b h GLY 149 N 0.25 0.43 2.00 1.57 0.00 -1.17 -2.84 103.07 103.31 2r8b h GLY 149 Ca 0.35 -0.85 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 2r8b h GLY 149 CO -0.08 0.75 -0.12 0.00 0.00 0.00 0.00 176.54 177.09 2r8b h ALA 150 N 0.67 1.13 -0.01 3.60 0.00 -0.96 -2.52 119.26 121.17 2r8b h ALA 150 Ca -0.10 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.47 2r8b h ALA 150 Cb 1.70 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.49 2r8b h ALA 150 CO 0.18 0.15 -0.87 -0.91 0.00 0.00 0.00 179.25 177.81 2r8b h ASN 151 N 0.00 0.78 0.44 0.00 2.35 -0.99 0.55 115.58 118.71 2r8b h ASN 151 Ca -0.00 -0.74 -0.12 0.00 -0.55 0.00 0.00 56.30 54.89 2r8b h ASN 151 Cb 0.46 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 2r8b h ASN 151 CO 0.02 1.42 -0.52 -0.29 -1.65 0.00 0.00 177.43 176.40 2r8b h ILE 152 N 0.23 1.37 -0.03 2.81 -0.00 -1.48 -2.03 117.51 118.38 2r8b h ILE 152 Ca -0.11 -1.80 -0.16 0.00 -0.00 0.00 0.00 64.86 62.80 2r8b h ILE 152 Cb 1.54 1.93 0.01 0.00 -0.00 0.00 0.00 36.82 40.30 2r8b h ILE 152 CO 0.17 0.52 -0.59 0.25 -0.00 0.00 0.00 178.15 178.50 2r8b h LEU 153 N 0.08 0.57 -0.39 2.19 5.85 -1.30 -1.87 115.31 120.44 2r8b h LEU 153 Ca -0.00 -0.73 0.06 0.00 0.84 0.00 0.00 57.88 58.06 2r8b h LEU 153 Cb 0.95 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.75 2r8b h LEU 153 CO 0.07 1.22 0.05 0.00 -0.34 0.00 0.00 178.44 179.44 2r8b h ALA 154 N 0.36 0.40 -0.41 1.25 0.00 0.19 -1.21 119.26 119.84 2r8b h ALA 154 Ca -0.07 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2r8b h ALA 154 Cb 1.28 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2r8b h ALA 154 CO 0.12 -0.35 0.20 -0.97 0.00 0.00 0.00 179.25 178.25 2r8b h ASN 155 N 0.17 0.51 -0.11 0.00 -1.24 -1.24 -1.59 115.58 112.08 2r8b h ASN 155 Ca 0.19 -0.04 -0.00 0.00 0.71 0.00 0.00 56.30 57.16 2r8b h ASN 155 Cb 0.24 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.16 2r8b h ASN 155 CO -0.27 0.43 0.05 0.58 -1.29 0.00 0.00 177.43 176.93 2r8b h VAL 156 N 0.57 1.12 -1.14 2.57 2.07 -0.60 0.26 116.25 121.11 2r8b h VAL 156 Ca 0.15 -0.36 0.32 0.00 0.82 0.00 0.00 66.70 67.63 2r8b h VAL 156 Cb 0.06 1.17 -0.10 0.00 -1.52 0.00 0.00 31.29 30.89 2r8b h VAL 156 CO -0.02 0.11 0.74 -0.07 0.02 0.00 0.00 177.57 178.35 2r8b h LEU 157 N 0.04 0.34 0.21 2.57 3.38 -0.35 0.24 115.31 121.74 2r8b h LEU 157 Ca 0.04 0.09 -0.30 0.00 0.09 0.00 0.00 57.88 57.80 2r8b h LEU 157 Cb 0.13 0.04 0.03 0.00 0.09 0.00 0.00 40.66 40.96 2r8b h LEU 157 CO -0.00 -0.00 -1.29 0.40 0.09 0.00 0.00 178.44 177.63 2r8b h ILE 158 N 0.26 1.33 0.00 1.22 2.04 -0.57 -3.28 117.51 118.52 2r8b h ILE 158 Ca 0.66 -2.62 -0.21 0.00 1.00 0.00 0.00 64.86 63.69 2r8b h ILE 158 Cb 1.90 3.02 -0.04 0.00 -0.74 0.00 0.00 36.82 40.97 2r8b h ILE 158 CO -0.30 0.78 -1.61 -0.62 0.00 0.00 0.00 178.15 176.39 2r8b n GLU 159 N -3.83 0.63 -3.28 2.37 -0.58 0.84 -4.27 120.64 112.53 2r8b n GLU 159 Ca -0.16 0.20 -0.26 0.00 -0.42 0.00 0.00 57.16 56.52 2r8b n GLU 159 Cb 1.02 -1.76 -0.07 0.00 -0.57 0.00 0.00 31.44 30.06 2r8b n GLU 159 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2r8b n GLN 160 N -2.88 2.26 0.20 3.49 1.13 0.76 -4.94 117.38 117.39 2r8b n GLN 160 Ca -0.14 -4.39 0.14 0.00 -1.94 0.00 0.00 57.00 50.67 2r8b n GLN 160 Cb 0.91 -2.04 0.72 0.00 0.11 0.00 0.00 30.24 29.93 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 3.86 0.00 -0.30 -1.09 0.13 -1.72 -1.66 132.00 131.23 2r8b h PRO 161 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 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 0.75 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.91 2r8b n GLU 162 N -2.44 2.29 -0.02 0.86 1.02 -1.26 -4.24 120.64 116.85 2r8b n GLU 162 Ca -0.02 -2.10 -0.11 0.00 -0.02 0.00 0.00 57.16 54.91 2r8b n GLU 162 Cb 0.05 -1.45 -0.09 0.00 -0.02 0.00 0.00 31.44 29.93 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 4.00 -0.06 -9.81 -4.62 5.85 -1.66 -3.47 115.31 105.55 2r8b h LEU 163 Ca 0.00 -0.60 -0.53 0.00 0.84 0.00 0.00 57.88 57.59 2r8b h LEU 163 Cb 0.90 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 2r8b h LEU 163 CO 0.00 0.66 0.10 -0.36 -0.34 0.00 0.00 178.44 178.50 2r8b s PHE 164 N -2.88 3.73 -0.19 1.25 0.40 -1.26 -4.57 117.98 114.46 2r8b s PHE 164 Ca -0.14 1.42 -0.05 0.00 -0.60 0.00 0.00 56.93 57.56 2r8b s PHE 164 Cb -0.01 -2.63 -0.22 0.00 0.51 0.00 0.00 43.02 40.68 2r8b s PHE 164 CO 0.54 0.41 0.10 -0.25 0.70 0.00 0.00 175.22 176.72 2r8b n ASP 165 N 1.04 2.04 -3.96 1.36 8.00 -0.30 -4.74 116.55 120.00 2r8b n ASP 165 Ca -0.04 0.11 -0.11 0.00 0.71 0.00 0.00 54.79 55.46 2r8b n ASP 165 Cb 0.50 -0.71 -0.12 0.00 -0.02 0.00 0.00 41.12 40.77 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 -2.53 0.18 -0.07 2.24 0.00 -1.09 -0.72 121.76 119.77 2r8b s ALA 166 Ca -0.28 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 2r8b s ALA 166 Cb 0.08 0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.30 2r8b s ALA 166 CO 0.68 -0.08 0.19 0.00 0.00 0.00 0.00 175.76 176.55 2r8b s ALA 167 N -1.00 -0.45 -0.16 0.00 0.00 -0.35 -1.86 121.76 117.94 2r8b s ALA 167 Ca -0.10 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.47 2r8b s ALA 167 Cb -0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 2r8b s ALA 167 CO -0.00 -0.11 -0.11 0.54 0.00 0.00 0.00 175.76 176.07 2r8b s VAL 168 N 0.43 3.00 0.00 0.00 0.11 0.11 -1.05 120.40 122.99 2r8b s VAL 168 Ca -0.03 -0.65 0.00 0.00 -2.93 0.00 0.00 61.98 58.37 2r8b s VAL 168 Cb -0.04 -2.29 0.00 0.00 -1.53 0.00 0.00 36.38 32.52 2r8b s VAL 168 CO -0.02 0.50 0.00 0.18 -3.33 0.00 0.00 175.10 172.43 2r8b n LEU 169 N 4.07 0.00 -0.44 2.54 4.77 0.20 -1.62 117.00 126.52 2r8b n LEU 169 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 2r8b n LEU 169 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2r8b n LEU 169 CO 0.29 -0.33 0.02 1.41 -1.33 0.00 0.00 177.39 177.45 2r8b n HIS 171 N -0.66 0.00 -1.51 -1.77 8.25 0.53 -1.33 115.22 118.74 2r8b n HIS 171 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 2r8b n HIS 171 Cb 0.00 -0.04 0.09 0.00 1.12 0.00 0.00 29.99 31.17 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 0.19 2.04 -0.23 -0.41 0.04 -1.26 -3.04 135.00 132.33 2r8b s PRO 172 Ca 0.00 0.69 -0.03 0.00 0.04 0.00 0.00 61.00 61.69 2r8b s PRO 172 Cb 0.00 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.73 2r8b s PRO 172 CO 0.00 -1.66 0.21 -1.17 0.04 0.00 0.00 177.00 174.42 2r8b s LEU 173 N -5.82 0.02 -0.18 -3.56 0.20 -1.26 -4.81 118.68 103.27 2r8b s LEU 173 Ca 0.61 -0.56 0.01 0.00 0.69 0.00 0.00 54.13 54.88 2r8b s LEU 173 Cb -0.15 0.21 0.03 0.00 -0.43 0.00 0.00 46.19 45.86 2r8b s LEU 173 CO 0.55 -0.36 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.47 2r8b s ILE 174 N 2.27 1.81 -0.31 6.68 -1.09 -1.26 -4.89 121.20 124.42 2r8b s ILE 174 Ca 0.07 -0.93 0.22 0.00 -2.23 0.00 0.00 60.65 57.78 2r8b s ILE 174 Cb -0.15 -1.75 0.14 0.00 -1.58 0.00 0.00 42.46 39.12 2r8b s ILE 174 CO -0.20 0.36 1.29 1.55 -1.23 0.00 0.00 174.94 176.70 2r8b h PRO 175 N 7.97 0.00 -6.11 2.79 0.13 -2.00 -3.46 132.00 131.31 2r8b h PRO 175 Ca -0.36 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.24 2r8b h PRO 175 Cb 1.12 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.21 2r8b h PRO 175 CO 0.54 0.03 -0.33 -0.59 -0.23 0.00 0.00 178.00 177.43 2r8b s PHE 176 N -3.26 2.15 -0.28 1.56 -0.12 -1.26 -5.09 117.98 111.68 2r8b s PHE 176 Ca 0.03 -0.66 -0.08 0.00 -0.05 0.00 0.00 56.93 56.17 2r8b s PHE 176 Cb 0.08 -2.07 -0.01 0.00 -0.63 0.00 0.00 43.02 40.39 2r8b s PHE 176 CO 0.74 -0.35 0.10 -1.21 -0.05 0.00 0.00 175.22 174.45 2r8b s GLU 177 N -4.23 3.36 0.27 1.99 2.02 -1.26 -5.02 118.70 115.83 2r8b s GLU 177 Ca 0.44 -0.69 -0.30 0.00 0.02 0.00 0.00 54.97 54.45 2r8b s GLU 177 Cb -0.03 -3.41 -0.10 0.00 0.10 0.00 0.00 34.13 30.69 2r8b s GLU 177 CO 0.26 -0.35 1.34 -2.14 0.02 0.00 0.00 175.26 174.39 2r8b s PRO 178 N 1.57 4.35 0.34 0.39 0.02 -1.26 -5.01 135.00 135.40 2r8b s PRO 178 Ca 0.05 2.19 -0.26 0.00 0.02 0.00 0.00 61.00 62.99 2r8b s PRO 178 Cb -0.16 -3.12 -0.10 0.00 0.02 0.00 0.00 34.50 31.14 2r8b s PRO 178 CO 0.04 -0.26 0.99 -1.59 -0.33 0.00 0.00 177.00 175.84 2r8b s LYS 179 N -0.90 4.47 -0.26 5.54 0.00 -1.26 -5.01 119.74 122.32 2r8b s LYS 179 Ca 0.54 1.42 -0.08 0.00 0.00 0.00 0.00 55.97 57.85 2r8b s LYS 179 Cb -0.39 -2.76 -0.02 0.00 0.00 0.00 0.00 37.83 34.66 2r8b s LYS 179 CO 0.46 0.16 0.08 0.42 0.00 0.00 0.00 175.35 176.46 2r8b s ILE 180 N -1.60 4.31 0.09 3.79 -1.09 -1.26 -4.98 121.20 120.47 2r8b s ILE 180 Ca 0.52 -0.25 0.10 0.00 -2.23 0.00 0.00 60.65 58.78 2r8b s ILE 180 Cb -0.21 -3.06 -0.03 0.00 -1.58 0.00 0.00 42.46 37.58 2r8b s ILE 180 CO 0.26 0.28 -0.25 -0.55 -1.23 0.00 0.00 174.94 173.45 2r8b s SER 181 N 1.60 3.02 0.21 3.58 0.15 -1.26 -5.05 113.70 115.95 2r8b s SER 181 Ca 0.06 -0.66 -0.30 0.00 0.70 0.00 0.00 55.95 55.75 2r8b s SER 181 Cb -0.16 -0.22 -0.08 0.00 -1.71 0.00 0.00 66.02 63.85 2r8b s SER 181 CO 0.04 0.18 1.18 -2.16 1.20 0.00 0.00 173.24 173.68 2r8b s PRO 182 N -1.68 4.52 0.32 5.44 0.04 -1.26 -4.62 135.00 137.76 2r8b s PRO 182 Ca 0.11 1.87 -0.02 0.00 0.04 0.00 0.00 61.00 63.00 2r8b s PRO 182 Cb -0.10 -3.22 0.07 0.00 0.04 0.00 0.00 34.50 31.29 2r8b s PRO 182 CO 0.04 -0.03 0.44 0.00 0.04 0.00 0.00 177.00 177.50 2r8b n ALA 183 N 2.16 -0.14 -2.18 8.56 0.00 1.00 -4.60 120.51 125.30 2r8b n ALA 183 Ca 0.03 -0.76 -0.39 0.00 0.00 0.00 0.00 53.44 52.32 2r8b n ALA 183 Cb 0.45 0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.92 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 -3.69 4.48 0.54 0.00 1.02 -1.26 -4.83 119.74 116.00 2r8b s LYS 184 Ca 0.28 1.05 0.29 0.00 0.02 0.00 0.00 55.97 57.61 2r8b s LYS 184 Cb -0.01 -3.29 1.59 0.00 -0.52 0.00 0.00 37.83 35.59 2r8b s LYS 184 CO 0.19 0.48 1.88 -1.35 -0.92 0.00 0.00 175.35 175.62 2r8b h PRO 185 N 4.85 0.00 -0.00 -1.68 0.11 -1.93 0.31 132.00 133.65 2r8b h PRO 185 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2r8b h PRO 185 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2r8b h PRO 185 CO 0.67 0.00 -0.45 0.25 -0.21 0.00 0.00 178.00 178.26 2r8b n THR 186 N -2.67 0.00 -1.66 -1.15 -2.24 -1.26 -3.97 114.28 101.33 2r8b n THR 186 Ca -0.02 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.26 2r8b n THR 186 Cb 0.23 0.43 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 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 -1.10 1.89 -4.26 -0.78 1.74 0.11 -4.85 116.66 109.41 2r8b n ARG 187 Ca 0.08 0.66 -0.24 0.00 -0.77 0.00 0.00 57.85 57.58 2r8b n ARG 187 Cb 0.35 -2.19 -0.17 0.00 -1.02 0.00 0.00 32.46 29.43 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 -1.65 1.43 0.00 5.56 0.52 0.10 -1.45 118.95 123.46 2r8b s ARG 188 Ca 0.58 -0.28 0.07 0.00 -0.52 0.00 0.00 55.73 55.57 2r8b s ARG 188 Cb -0.62 -1.33 -0.02 0.00 0.52 0.00 0.00 34.95 33.50 2r8b s ARG 188 CO 0.60 -0.10 -0.22 0.54 0.02 0.00 0.00 175.30 176.15 2r8b s VAL 189 N 1.09 1.74 -0.20 3.52 0.11 -0.25 -1.22 120.40 125.19 2r8b s VAL 189 Ca -0.07 -1.02 -0.03 0.00 -2.93 0.00 0.00 61.98 57.93 2r8b s VAL 189 Cb -0.14 -1.46 -0.01 0.00 -1.53 0.00 0.00 36.38 33.24 2r8b s VAL 189 CO -0.01 0.42 -0.05 -0.22 -3.33 0.00 0.00 175.10 171.90 2r8b s LEU 190 N -0.70 2.91 -0.14 2.54 2.96 -0.22 -0.38 118.68 125.64 2r8b s LEU 190 Ca 0.08 -0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 2r8b s LEU 190 Cb -0.09 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 2r8b s LEU 190 CO -0.00 0.03 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.39 2r8b s ILE 191 N 1.20 3.93 -0.04 6.68 1.01 0.84 0.60 121.20 135.41 2r8b s ILE 191 Ca 0.02 -0.35 0.05 0.00 0.00 0.00 0.00 60.65 60.37 2r8b s ILE 191 Cb -0.14 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 2r8b s ILE 191 CO -0.01 0.51 -0.19 0.42 0.00 0.00 0.00 174.94 175.66 2r8b s THR 192 N 0.19 2.65 0.12 2.92 -4.23 -0.44 0.20 115.64 117.04 2r8b s THR 192 Ca -0.02 -0.88 -0.19 0.00 -1.18 0.00 0.00 61.69 59.42 2r8b s THR 192 Cb -0.14 -2.00 0.05 0.00 1.34 0.00 0.00 72.50 71.75 2r8b s THR 192 CO 0.03 0.59 0.47 0.00 -0.54 0.00 0.00 174.62 175.17 2r8b s ALA 193 N -0.65 -1.17 -0.04 3.99 0.00 -0.59 -0.35 121.76 122.95 2r8b s ALA 193 Ca 0.10 0.22 -0.02 0.00 0.00 0.00 0.00 51.96 52.25 2r8b s ALA 193 Cb -0.11 0.67 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 2r8b s ALA 193 CO 0.00 -0.64 0.09 0.20 0.00 0.00 0.00 175.76 175.40 2r8b s GLY 194 N -2.61 2.02 0.00 0.00 0.00 -1.26 -1.07 107.32 104.41 2r8b s GLY 194 Ca 0.01 -0.80 0.28 0.00 0.00 0.00 0.00 44.72 44.20 2r8b s GLY 194 CO -0.10 -0.63 1.72 -1.84 0.00 0.00 0.00 173.10 172.25 2r8b n GLU 195 N 1.51 0.61 -1.81 2.90 0.28 0.10 -3.92 120.64 120.31 2r8b n GLU 195 Ca -0.15 -0.27 -0.08 0.00 -0.16 0.00 0.00 57.16 56.49 2r8b n GLU 195 Cb 0.53 -1.49 0.07 0.00 1.43 0.00 0.00 31.44 31.98 2r8b n GLU 195 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2r8b n ARG 196 N -0.96 2.30 -2.65 3.44 1.74 0.89 -4.80 116.66 116.64 2r8b n ARG 196 Ca 0.12 -3.57 -0.43 0.00 -0.77 0.00 0.00 57.85 53.21 2r8b n ARG 196 Cb 0.31 -1.71 -0.02 0.00 -1.02 0.00 0.00 32.46 30.02 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 -3.37 6.78 0.18 0.55 -1.08 -1.19 -4.39 116.67 114.15 2r8b s ASP 197 Ca 0.41 0.76 0.22 0.00 -0.52 0.00 0.00 52.55 53.42 2r8b s ASP 197 Cb 0.38 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 40.19 2r8b s ASP 197 CO -0.03 -1.02 1.68 -0.81 0.52 0.00 0.00 175.17 175.50 2r8b n PRO 198 N 7.24 0.15 0.04 4.34 -0.04 -1.26 -2.02 135.00 143.44 2r8b n PRO 198 Ca 0.11 0.33 0.07 0.00 -0.04 0.00 0.00 63.50 63.98 2r8b n PRO 198 Cb 0.48 -1.75 -0.08 0.00 -0.04 0.00 0.00 33.50 32.11 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 -2.03 0.63 -3.77 0.52 5.41 -1.26 -4.75 119.36 114.11 2r8b n ILE 199 Ca 0.03 -0.59 -0.30 0.00 1.00 0.00 0.00 62.75 62.89 2r8b n ILE 199 Cb 0.25 -0.35 -0.14 0.00 -0.71 0.00 0.00 39.64 38.70 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 3.71 1.85 -0.13 0.00 -0.02 -1.26 -4.46 135.00 134.69 2r8b n PRO 201 Ca 0.06 0.66 -0.04 0.00 -2.02 0.00 0.00 63.50 62.16 2r8b n PRO 201 Cb 0.36 -2.29 0.03 0.00 -0.02 0.00 0.00 33.50 31.58 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 2.99 0.61 0.00 -1.45 2.07 -1.87 -1.47 116.25 117.13 2r8b h VAL 202 Ca -0.45 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 2r8b h VAL 202 Cb 1.29 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2r8b h VAL 202 CO 0.75 0.01 -0.12 1.56 0.02 0.00 0.00 177.57 179.78 2r8b h GLN 203 N 0.04 0.00 0.11 1.57 1.08 -1.98 0.15 115.11 116.08 2r8b h GLN 203 Ca 0.21 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 57.14 2r8b h GLN 203 Cb 0.31 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.75 2r8b h GLN 203 CO -0.41 0.12 -1.18 -0.07 -0.95 0.00 0.00 178.83 176.34 2r8b h LEU 204 N 0.00 0.50 -0.39 1.46 3.38 -1.64 -1.26 115.31 117.37 2r8b h LEU 204 Ca -0.00 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 2r8b h LEU 204 Cb 0.23 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2r8b h LEU 204 CO 0.02 1.36 0.21 0.74 0.09 0.00 0.00 178.44 180.85 2r8b h THR 205 N 0.13 1.15 -0.62 0.22 2.02 -0.92 0.86 112.91 115.75 2r8b h THR 205 Ca -0.13 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 2r8b h THR 205 Cb 1.88 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.96 2r8b h THR 205 CO 0.20 0.15 0.35 0.50 0.37 0.00 0.00 175.52 177.09 2r8b h LYS 206 N 0.49 0.84 0.19 6.66 1.63 -0.65 -0.88 116.57 124.85 2r8b h LYS 206 Ca 0.14 -0.08 -0.27 0.00 -0.85 0.00 0.00 60.65 59.58 2r8b h LYS 206 Cb 0.06 -0.17 0.03 0.00 -0.60 0.00 0.00 32.23 31.54 2r8b h LYS 206 CO -0.02 0.61 -1.23 0.00 -3.45 0.00 0.00 179.45 175.35 2r8b h ALA 207 N 1.53 -0.08 -0.49 5.00 0.00 -0.94 -2.78 119.26 121.50 2r8b h ALA 207 Ca 0.22 -0.84 0.08 0.00 0.00 0.00 0.00 54.91 54.38 2r8b h ALA 207 Cb 0.01 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 2r8b h ALA 207 CO -0.04 0.60 0.09 1.25 0.00 0.00 0.00 179.25 181.16 2r8b h LEU 208 N -0.10 -0.01 -0.91 0.00 5.85 -0.58 -1.26 115.31 118.31 2r8b h LEU 208 Ca -0.22 0.09 0.13 0.00 0.84 0.00 0.00 57.88 58.72 2r8b h LEU 208 Cb 1.92 0.12 -0.14 0.00 0.37 0.00 0.00 40.66 42.93 2r8b h LEU 208 CO 0.20 0.03 -0.41 -0.08 -0.34 0.00 0.00 178.44 177.83 2r8b h GLU 209 N 0.23 -0.04 -0.20 1.25 4.81 -1.14 -0.05 114.58 119.43 2r8b h GLU 209 Ca 0.24 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.38 2r8b h GLU 209 Cb 0.33 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 2r8b h GLU 209 CO -0.32 -0.03 -0.28 0.93 -0.73 0.00 0.00 179.01 178.58 2r8b h GLU 210 N -0.04 0.39 0.36 1.92 3.07 -1.17 -1.25 114.58 117.85 2r8b h GLU 210 Ca 0.29 -0.15 -0.02 0.00 -0.50 0.00 0.00 59.36 58.99 2r8b h GLU 210 Cb 0.56 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 2r8b h GLU 210 CO -0.92 0.64 -0.18 0.77 -1.40 0.00 0.00 179.01 177.92 2r8b h SER 211 N 0.34 -0.41 -0.90 1.42 0.02 0.01 -1.92 113.55 112.11 2r8b h SER 211 Ca 0.05 -0.07 0.06 0.00 -0.84 0.00 0.00 61.79 60.99 2r8b h SER 211 Cb 0.67 0.11 -0.06 0.00 0.14 0.00 0.00 62.40 63.26 2r8b h SER 211 CO 0.05 -0.18 0.58 -0.07 -1.14 0.00 0.00 176.83 176.07 2r8b h LEU 212 N -0.63 0.91 -1.93 5.07 3.38 -1.06 -1.66 115.31 119.38 2r8b h LEU 212 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2r8b h LEU 212 Cb 0.46 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2r8b h LEU 212 CO 0.08 0.59 -0.12 0.50 0.09 0.00 0.00 178.44 179.59 2r8b h LYS 213 N 1.04 0.00 0.00 1.13 3.64 -0.98 -0.64 116.57 120.76 2r8b h LYS 213 Ca 0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 2r8b h LYS 213 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2r8b h LYS 213 CO -0.14 0.12 -0.31 0.00 -2.27 0.00 0.00 179.45 176.85 2r8b h ALA 214 N 1.88 0.80 0.00 5.00 0.00 -0.49 -3.17 119.26 123.29 2r8b h ALA 214 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2r8b h ALA 214 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2r8b h ALA 214 CO 0.02 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.23 2r8b h GLN 215 N 0.00 0.00 0.00 0.00 4.20 -1.02 -3.47 115.11 114.82 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 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2r8b h GLN 215 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2r8b n GLY 216 N 0.72 -1.04 7.00 3.46 0.00 -1.20 -0.00 105.19 114.13 2r8b n GLY 216 Ca 0.03 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.61 -1.68 3.74 -0.02 0.00 -1.25 -4.73 105.19 100.64 2r8b n GLY 217 Ca 0.00 -1.32 -0.22 0.00 0.00 0.00 0.00 46.02 44.47 2r8b n GLY 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2r8b s THR 218 N 0.00 3.98 -0.04 2.61 -4.23 -0.53 -4.98 115.64 112.45 2r8b s THR 218 Ca 0.00 -1.64 -0.02 0.00 -1.18 0.00 0.00 61.69 58.85 2r8b s THR 218 Cb 0.00 -3.14 0.03 0.00 1.34 0.00 0.00 72.50 70.72 2r8b s THR 218 CO 0.00 -0.36 0.08 -0.69 -0.54 0.00 0.00 174.62 173.11 2r8b s VAL 219 N -2.22 -0.04 -0.03 2.29 1.01 -1.26 -1.10 120.40 119.05 2r8b s VAL 219 Ca 0.32 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.48 2r8b s VAL 219 Cb -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 36.38 36.16 2r8b s VAL 219 CO 0.23 0.06 -0.13 -0.70 0.00 0.00 0.00 175.10 174.56 2r8b s GLU 220 N 0.83 1.32 -0.11 2.72 2.12 0.49 -4.98 118.70 121.10 2r8b s GLU 220 Ca -0.07 -0.44 0.01 0.00 0.36 0.00 0.00 54.97 54.84 2r8b s GLU 220 Cb -0.09 -1.19 -0.01 0.00 0.26 0.00 0.00 34.13 33.10 2r8b s GLU 220 CO -0.03 0.17 -0.16 0.99 -0.54 0.00 0.00 175.26 175.69 2r8b s THR 221 N 0.12 2.85 -0.21 -1.70 2.01 -1.26 -0.11 115.64 117.34 2r8b s THR 221 Ca -0.03 -0.75 -0.03 0.00 0.31 0.00 0.00 61.69 61.18 2r8b s THR 221 Cb -0.10 -2.16 -0.01 0.00 0.01 0.00 0.00 72.50 70.25 2r8b s THR 221 CO 0.01 0.54 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.74 2r8b s VAL 222 N 0.14 3.28 0.28 3.82 1.01 0.13 -4.95 120.40 124.11 2r8b s VAL 222 Ca -0.08 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 61.42 2r8b s VAL 222 Cb -0.15 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 2r8b s VAL 222 CO 0.05 0.44 0.42 0.26 0.00 0.00 0.00 175.10 176.27 2r8b s TRP 223 N 1.34 3.34 0.05 5.22 0.52 -1.26 -1.54 118.94 126.61 2r8b s TRP 223 Ca 0.04 -0.05 -0.01 0.00 0.02 0.00 0.00 56.10 56.10 2r8b s TRP 223 Cb -0.14 -1.75 -0.04 0.00 -1.15 0.00 0.00 33.47 30.39 2r8b s TRP 223 CO -0.03 0.25 -0.03 -3.38 0.02 0.00 0.00 176.95 173.78 2r8b s HIS 224 N -2.08 0.52 1.10 -1.98 -3.43 -0.23 -4.89 115.29 104.30 2r8b s HIS 224 Ca 0.38 -0.99 -0.18 0.00 -0.80 0.00 0.00 55.06 53.47 2r8b s HIS 224 Cb -0.09 -0.38 0.28 0.00 -1.43 0.00 0.00 32.58 30.96 2r8b s HIS 224 CO 0.30 -0.34 0.88 -0.35 -2.00 0.00 0.00 174.74 173.24 2r8b n PRO 225 N 0.29 -3.24 0.00 -0.38 -0.04 -1.26 0.02 135.00 130.38 2r8b n PRO 225 Ca -0.15 -1.43 0.00 0.00 -0.04 0.00 0.00 63.50 61.88 2r8b n PRO 225 Cb 0.60 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 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 -4.00 -0.04 0.00 0.55 0.00 -1.26 -4.31 105.19 96.13 2r8b n GLY 226 Ca 0.13 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.14 2.61 0.00 -0.02 0.00 -1.26 -0.08 105.19 106.30 2r8b n GLY 227 Ca 0.00 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.41 2r8b n GLY 227 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2r8b n HIS 228 N 0.00 0.00 -2.14 1.61 -0.00 -1.26 -4.12 115.22 109.31 2r8b n HIS 228 Ca 0.00 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.79 2r8b n HIS 228 Cb 0.00 -0.44 -0.01 0.00 -0.12 0.00 0.00 29.99 29.42 2r8b n HIS 228 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 2r8b s GLU 229 N -2.88 3.94 -0.25 1.57 1.03 -1.26 -4.99 118.70 115.85 2r8b s GLU 229 Ca 0.16 2.02 -0.29 0.00 0.03 0.00 0.00 54.97 56.89 2r8b s GLU 229 Cb 0.17 -2.68 0.00 0.00 -0.80 0.00 0.00 34.13 30.82 2r8b s GLU 229 CO 0.45 -0.47 1.19 0.42 -1.33 0.00 0.00 175.26 175.52 2r8b s ILE 230 N -1.34 4.36 0.43 1.83 1.01 -1.26 -4.90 121.20 121.34 2r8b s ILE 230 Ca 0.58 1.60 -0.13 0.00 0.00 0.00 0.00 60.65 62.71 2r8b s ILE 230 Cb -0.35 -4.20 -0.07 0.00 0.01 0.00 0.00 42.46 37.85 2r8b s ILE 230 CO 0.44 -0.32 0.83 -0.13 0.00 0.00 0.00 174.94 175.76 2r8b s ARG 231 N 3.68 3.84 0.45 2.79 0.52 -1.26 -4.98 118.95 123.99 2r8b s ARG 231 Ca 0.51 0.63 0.14 0.00 -0.52 0.00 0.00 55.73 56.49 2r8b s ARG 231 Cb -0.17 -2.32 1.07 0.00 0.52 0.00 0.00 34.95 34.05 2r8b s ARG 231 CO 0.16 -0.10 2.01 0.66 0.02 0.00 0.00 175.30 178.05 2r8b h SER 232 N 1.21 0.31 -0.90 0.23 4.64 -2.00 0.15 113.55 117.19 2r8b h SER 232 Ca -0.47 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 60.95 2r8b h SER 232 Cb 1.19 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 63.15 2r8b h SER 232 CO 0.63 0.19 0.58 1.23 -0.87 0.00 0.00 176.83 178.60 2r8b h GLY 233 N 0.35 1.31 1.03 -0.77 0.00 -2.00 -1.36 103.07 101.63 2r8b h GLY 233 Ca 0.23 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 2r8b h GLY 233 CO -0.06 0.20 0.37 0.83 0.00 0.00 0.00 176.54 177.88 2r8b h GLU 234 N 0.89 1.14 -0.27 4.80 5.08 -1.08 -2.48 114.58 122.66 2r8b h GLU 234 Ca 0.42 -0.18 -0.11 0.00 -1.00 0.00 0.00 59.36 58.49 2r8b h GLU 234 Cb 0.42 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2r8b h GLU 234 CO -0.18 0.90 -0.29 0.82 -1.00 0.00 0.00 179.01 179.26 2r8b h ILE 235 N 1.12 1.28 0.40 3.13 2.04 -1.08 -0.76 117.51 123.63 2r8b h ILE 235 Ca 0.27 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 2r8b h ILE 235 Cb 0.14 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2r8b h ILE 235 CO -0.03 0.43 -0.30 0.44 0.00 0.00 0.00 178.15 178.70 2r8b h ASP 236 N 0.48 -0.76 -0.65 1.72 3.32 -1.08 -0.55 116.42 118.88 2r8b h ASP 236 Ca 0.06 0.06 0.09 0.00 0.02 0.00 0.00 57.03 57.26 2r8b h ASP 236 Cb 0.74 0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 2r8b h ASP 236 CO 0.06 -0.45 0.43 0.00 -1.72 0.00 0.00 179.24 177.56 2r8b h ALA 237 N -0.17 1.94 -0.18 3.45 0.00 -1.20 0.11 119.26 123.21 2r8b h ALA 237 Ca -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2r8b h ALA 237 Cb 0.59 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2r8b h ALA 237 CO 0.01 -0.07 0.08 0.28 0.00 0.00 0.00 179.25 179.55 2r8b h VAL 238 N 0.51 1.13 -0.10 0.00 2.07 -0.47 0.90 116.25 120.30 2r8b h VAL 238 Ca 0.30 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2r8b h VAL 238 Cb 0.50 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2r8b h VAL 238 CO -0.09 0.13 0.05 0.03 0.02 0.00 0.00 177.57 177.70 2r8b h ARG 239 N 0.16 0.14 -0.89 1.57 3.08 0.66 -1.33 114.38 117.77 2r8b h ARG 239 Ca 0.06 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.15 2r8b h ARG 239 Cb 0.12 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 2r8b h ARG 239 CO -0.01 0.20 0.58 0.78 -1.07 0.00 0.00 179.97 180.46 2r8b h GLY 240 N 0.04 1.30 0.56 0.04 0.00 -0.86 -2.73 103.07 101.41 2r8b h GLY 240 Ca 0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 2r8b h GLY 240 CO -0.00 0.32 -0.05 -2.75 0.00 0.00 0.00 176.54 174.06 2r8b h PHE 241 N 1.04 -0.12 0.00 5.60 3.57 -0.19 -3.17 116.94 123.67 2r8b h PHE 241 Ca 0.38 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.87 2r8b h PHE 241 Cb 0.15 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.93 2r8b h PHE 241 CO -0.00 0.29 0.00 1.28 -2.23 0.00 0.00 178.31 177.65 2r8b n LEU 242 N -4.95 0.00 0.27 0.59 4.77 -0.56 -3.51 117.00 113.61 2r8b n LEU 242 Ca -0.09 0.19 0.13 0.00 -0.03 0.00 0.00 56.01 56.22 2r8b n LEU 242 Cb 0.24 -0.19 0.75 0.00 -2.33 0.00 0.00 43.42 41.89 2r8b n LEU 242 CO 0.32 -0.02 0.99 0.00 -1.33 0.00 0.00 177.39 177.35 2r8b h ALA 243 N 3.44 1.29 0.00 -1.18 0.00 -1.45 -1.04 119.26 120.31 2r8b h ALA 243 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2r8b h ALA 243 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2r8b h ALA 243 CO 0.00 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.38 2r8b h ALA 244 N 1.90 1.00 -0.00 0.00 0.00 -1.76 -3.04 119.26 117.35 2r8b h ALA 244 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2r8b h ALA 244 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2r8b h ALA 244 CO 0.01 0.00 -0.74 0.66 0.00 0.00 0.00 179.25 179.18 2r8b n TYR 245 N -2.58 0.00 0.00 0.00 4.01 -0.40 -5.23 117.16 112.97 2r8b n TYR 245 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2r8b n TYR 245 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 2r8b n TYR 245 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81