#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d8u s SER 72 N 0.00 2.56 -0.12 2.98 1.04 -1.26 -4.82 113.70 114.08 3d8u s SER 72 Ca 0.00 -0.98 0.00 0.00 0.48 0.00 0.00 55.95 55.46 3d8u s SER 72 Cb 0.00 -0.14 -0.02 0.00 0.10 0.00 0.00 66.02 65.97 3d8u s SER 72 CO 0.00 -0.14 -0.14 -0.51 0.98 0.00 0.00 173.24 173.43 3d8u s ILE 73 N -2.75 3.00 0.09 -1.02 -1.16 -1.15 -3.94 121.20 114.27 3d8u s ILE 73 Ca 0.20 -0.69 0.07 0.00 -0.51 0.00 0.00 60.65 59.72 3d8u s ILE 73 Cb -0.02 -2.25 -0.04 0.00 0.61 0.00 0.00 42.46 40.77 3d8u s ILE 73 CO 0.07 0.53 -0.09 0.00 -2.81 0.00 0.00 174.94 172.64 3d8u s ALA 74 N 0.24 2.97 -0.15 1.50 0.00 -0.96 -1.91 121.76 123.46 3d8u s ALA 74 Ca -0.09 -1.21 -0.07 0.00 0.00 0.00 0.00 51.96 50.59 3d8u s ALA 74 Cb -0.15 -0.93 0.06 0.00 0.00 0.00 0.00 23.12 22.09 3d8u s ALA 74 CO 0.05 0.64 0.34 -1.17 0.00 0.00 0.00 175.76 175.62 3d8u s LEU 75 N -2.11 -0.07 -0.37 0.00 2.96 -0.33 -0.23 118.68 118.54 3d8u s LEU 75 Ca 0.21 0.75 -0.07 0.00 -0.22 0.00 0.00 54.13 54.80 3d8u s LEU 75 Cb -0.11 1.06 0.06 0.00 0.50 0.00 0.00 46.19 47.70 3d8u s LEU 75 CO 0.13 -0.20 0.16 -0.63 -1.32 0.00 0.00 176.35 174.49 3d8u s ILE 76 N 1.72 3.85 0.29 6.68 1.01 -1.13 -1.89 121.20 131.73 3d8u s ILE 76 Ca -0.06 -1.30 -0.29 0.00 0.00 0.00 0.00 60.65 58.99 3d8u s ILE 76 Cb -0.10 -3.27 -0.10 0.00 0.01 0.00 0.00 42.46 39.00 3d8u s ILE 76 CO -0.11 -0.32 1.13 -0.63 0.00 0.00 0.00 174.94 175.02 3d8u s ILE 77 N 1.38 3.36 -0.09 2.92 -1.09 0.95 -4.09 121.20 124.54 3d8u s ILE 77 Ca 0.01 1.37 -0.10 0.00 -2.23 0.00 0.00 60.65 59.69 3d8u s ILE 77 Cb -0.21 -3.87 -0.28 0.00 -1.58 0.00 0.00 42.46 36.52 3d8u s ILE 77 CO 0.02 0.33 0.51 1.55 -1.23 0.00 0.00 174.94 176.12 3d8u h PRO 78 N 3.74 0.31 -4.03 2.79 0.13 -1.84 -1.68 132.00 131.43 3d8u h PRO 78 Ca -0.47 -0.53 -0.15 0.00 -0.87 0.00 0.00 66.00 63.98 3d8u h PRO 78 Cb 1.21 0.20 -0.19 0.00 0.13 0.00 0.00 31.00 32.35 3d8u h PRO 78 CO 0.67 1.25 -0.68 -1.12 -0.23 0.00 0.00 178.00 177.89 3d8u s SER 79 N -7.14 0.30 0.15 1.44 0.01 -1.26 -2.25 113.70 104.95 3d8u s SER 79 Ca -0.20 -0.63 0.17 0.00 1.31 0.00 0.00 55.95 56.60 3d8u s SER 79 Cb 0.06 0.14 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 3d8u s SER 79 CO 0.80 -0.40 1.06 0.17 0.41 0.00 0.00 173.24 175.28 3d8u h LEU 80 N 4.16 0.00 -1.14 2.44 -0.00 -1.96 -3.38 115.31 115.43 3d8u h LEU 80 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.55 3d8u h LEU 80 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.85 3d8u h LEU 80 CO 0.49 0.47 0.00 2.22 -0.00 0.00 0.00 178.44 181.62 3d8u n PHE 81 N -2.97 0.34 -3.83 0.17 -1.74 -1.26 -4.57 117.46 103.60 3d8u n PHE 81 Ca -0.05 -0.17 -0.36 0.00 -0.56 0.00 0.00 57.45 56.31 3d8u n PHE 81 Cb 0.77 0.00 -0.13 0.00 1.52 0.00 0.00 39.48 41.63 3d8u n PHE 81 CO 0.00 0.00 0.00 -2.00 -0.56 0.00 0.00 176.76 174.20 3d8u s GLU 82 N -1.66 3.09 0.11 3.97 2.56 -1.26 -4.99 118.70 120.52 3d8u s GLU 82 Ca 0.26 -0.84 -0.07 0.00 0.00 0.00 0.00 54.97 54.32 3d8u s GLU 82 Cb 0.14 -3.23 0.12 0.00 2.00 0.00 0.00 34.13 33.16 3d8u s GLU 82 CO 0.19 -0.39 0.69 1.63 -0.56 0.00 0.00 175.26 176.83 3d8u n LYS 83 N 4.81 -0.10 -0.27 4.30 4.01 -1.26 0.72 118.16 130.37 3d8u n LYS 83 Ca -0.16 0.69 0.07 0.00 -0.51 0.00 0.00 58.31 58.40 3d8u n LYS 83 Cb 0.48 -1.02 0.19 0.00 -0.51 0.00 0.00 35.03 34.17 3d8u n LYS 83 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3d8u h ALA 84 N 0.65 0.91 0.06 7.82 0.00 -1.98 0.56 119.26 127.28 3d8u h ALA 84 Ca 0.16 0.23 -0.15 0.00 0.00 0.00 0.00 54.91 55.15 3d8u h ALA 84 Cb 0.27 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3d8u h ALA 84 CO -0.44 -0.42 -0.77 0.00 0.00 0.00 0.00 179.25 177.62 3d8u h ALA 86 N -0.09 0.56 0.00 0.00 0.00 -0.26 -0.56 119.26 118.92 3d8u h ALA 86 Ca -0.17 0.27 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3d8u h ALA 86 Cb 1.39 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 3d8u h ALA 86 CO 0.01 -0.42 -1.09 0.45 0.00 0.00 0.00 179.25 178.20 3d8u h HIS 87 N 0.02 0.00 0.30 0.00 3.86 -0.03 -3.37 115.15 115.93 3d8u h HIS 87 Ca 0.37 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.56 3d8u h HIS 87 Cb 0.59 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.06 3d8u h HIS 87 CO -0.54 0.48 -0.14 0.35 0.86 0.00 0.00 177.93 178.94 3d8u h PHE 88 N 0.00 -0.37 -0.93 2.45 3.57 -0.94 -3.28 116.94 117.44 3d8u h PHE 88 Ca -0.10 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.59 3d8u h PHE 88 Cb 1.46 0.12 -0.17 0.00 2.79 0.00 0.00 35.95 40.14 3d8u h PHE 88 CO 0.00 -0.02 -0.18 -0.07 -2.23 0.00 0.00 178.31 175.80 3d8u h LEU 89 N -0.87 -0.78 -0.53 0.59 -0.00 -1.30 -2.25 115.31 110.17 3d8u h LEU 89 Ca -0.04 0.27 -0.03 0.00 -0.00 0.00 0.00 57.88 58.08 3d8u h LEU 89 Cb 0.52 0.55 -0.00 0.00 -0.00 0.00 0.00 40.66 41.72 3d8u h LEU 89 CO 0.07 -0.31 -0.16 -0.65 -0.00 0.00 0.00 178.44 177.39 3d8u h PRO 90 N 0.01 0.00 0.00 1.13 0.11 -1.79 0.13 132.00 131.59 3d8u h PRO 90 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 3d8u h PRO 90 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 3d8u h PRO 90 CO -0.93 0.16 -1.13 -1.13 -0.21 0.00 0.00 178.00 174.76 3d8u n SER 91 N -3.19 0.59 0.14 -2.05 3.41 -1.11 -2.10 113.62 109.32 3d8u n SER 91 Ca 0.02 -0.04 0.02 0.00 -0.26 0.00 0.00 58.87 58.62 3d8u n SER 91 Cb 0.51 0.84 0.09 0.00 -0.26 0.00 0.00 64.21 65.39 3d8u n SER 91 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3d8u h PHE 92 N 0.00 0.00 0.08 7.33 3.57 -1.06 -2.66 116.94 124.20 3d8u h PHE 92 Ca 0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 3d8u h PHE 92 Cb 0.83 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.57 3d8u h PHE 92 CO 0.00 0.53 -0.04 0.37 -2.23 0.00 0.00 178.31 176.94 3d8u h GLN 93 N 0.00 -0.10 0.14 1.11 5.75 -0.76 -3.20 115.11 118.05 3d8u h GLN 93 Ca -0.01 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 3d8u h GLN 93 Cb 1.30 0.02 -0.05 0.00 1.07 0.00 0.00 27.48 29.83 3d8u h GLN 93 CO 0.07 0.46 -0.46 1.96 -2.65 0.00 0.00 178.83 178.21 3d8u h GLN 94 N -0.80 -0.68 -0.06 1.69 4.20 -1.46 0.19 115.11 118.18 3d8u h GLN 94 Ca -0.01 0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.77 3d8u h GLN 94 Cb 0.60 0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.51 3d8u h GLN 94 CO 0.02 -0.45 -0.12 0.00 -0.67 0.00 0.00 178.83 177.60 3d8u h ALA 95 N -0.32 -0.08 -0.75 3.87 0.00 -1.65 0.47 119.26 120.79 3d8u h ALA 95 Ca 0.01 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.07 3d8u h ALA 95 Cb 0.72 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 3d8u h ALA 95 CO -0.25 -0.59 0.50 1.25 0.00 0.00 0.00 179.25 180.16 3d8u h LEU 96 N -0.17 0.49 -0.12 0.00 5.85 -1.51 -2.59 115.31 117.26 3d8u h LEU 96 Ca 0.06 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.59 3d8u h LEU 96 Cb 0.26 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3d8u h LEU 96 CO -0.16 0.27 -0.99 0.78 -0.34 0.00 0.00 178.44 178.00 3d8u h ASN 97 N 0.53 0.20 0.40 1.25 -0.26 0.10 -0.80 115.58 117.00 3d8u h ASN 97 Ca 0.36 -0.19 -0.08 0.00 -0.56 0.00 0.00 56.30 55.83 3d8u h ASN 97 Cb 0.67 -0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 3d8u h ASN 97 CO -0.13 1.07 -0.38 0.11 -1.06 0.00 0.00 177.43 177.04 3d8u h LYS 98 N 0.06 0.00 0.00 0.81 1.57 -0.65 -1.74 116.57 116.62 3d8u h LYS 98 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3d8u h LYS 98 Cb 1.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.99 3d8u h LYS 98 CO 0.15 0.38 0.00 0.00 -0.57 0.00 0.00 179.45 179.40 3d8u h ALA 99 N 1.62 1.00 -0.38 3.86 0.00 -1.27 -3.48 119.26 120.61 3d8u h ALA 99 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d8u h ALA 99 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d8u h ALA 99 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 3d8u n GLY 100 N 1.05 0.89 3.17 0.00 0.00 -0.43 -5.10 105.19 104.78 3d8u n GLY 100 Ca 0.04 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 3d8u n GLY 100 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d8u s TYR 101 N -2.19 2.51 0.49 1.61 2.02 -0.48 -5.00 117.35 116.31 3d8u s TYR 101 Ca 0.00 -1.15 -0.21 0.00 -0.37 0.00 0.00 57.07 55.34 3d8u s TYR 101 Cb 0.00 -1.70 -0.07 0.00 -0.40 0.00 0.00 41.96 39.78 3d8u s TYR 101 CO 0.00 -0.50 1.10 1.14 -1.57 0.00 0.00 175.55 175.72 3d8u s GLN 102 N 0.62 3.66 -0.46 -0.62 -2.07 -1.26 -4.24 119.66 115.30 3d8u s GLN 102 Ca -0.12 1.56 -0.01 0.00 -1.82 0.00 0.00 55.36 54.97 3d8u s GLN 102 Cb -0.17 -2.17 0.12 0.00 -1.09 0.00 0.00 33.01 29.70 3d8u s GLN 102 CO 0.03 -0.58 0.24 -1.17 -1.32 0.00 0.00 175.29 172.49 3d8u s LEU 103 N -3.42 5.05 -0.16 2.60 0.20 -1.26 -2.92 118.68 118.77 3d8u s LEU 103 Ca 0.68 -2.37 -0.29 0.00 0.69 0.00 0.00 54.13 52.84 3d8u s LEU 103 Cb -0.22 -1.78 -0.00 0.00 -0.43 0.00 0.00 46.19 43.76 3d8u s LEU 103 CO 0.26 -0.44 1.00 -1.48 -0.29 0.00 0.00 176.35 175.41 3d8u s LEU 104 N 0.64 4.18 0.00 -0.68 2.34 -0.80 -4.98 118.68 119.38 3d8u s LEU 104 Ca 0.12 1.43 0.01 0.00 0.06 0.00 0.00 54.13 55.74 3d8u s LEU 104 Cb -0.22 -3.51 -0.00 0.00 -0.56 0.00 0.00 46.19 41.90 3d8u s LEU 104 CO -0.04 -0.53 0.02 0.00 -1.06 0.00 0.00 176.35 174.74 3d8u n LEU 105 N 5.54 0.00 -3.63 1.48 -0.00 -1.26 -1.19 117.00 117.95 3d8u n LEU 105 Ca 0.10 -0.83 -0.07 0.00 -0.00 0.00 0.00 56.01 55.20 3d8u n LEU 105 Cb 0.48 0.18 -0.06 0.00 -0.00 0.00 0.00 43.42 44.01 3d8u n LEU 105 CO 0.52 -0.12 0.89 -0.83 -0.00 0.00 0.00 177.39 177.84 3d8u s GLY 106 N -1.70 -0.02 -0.17 1.47 0.00 -0.79 -4.88 107.32 101.23 3d8u s GLY 106 Ca 0.03 2.78 -0.06 0.00 0.00 0.00 0.00 44.72 47.47 3d8u s GLY 106 CO 0.02 1.64 0.04 -0.47 0.00 0.00 0.00 173.10 174.33 3d8u s TYR 107 N -0.19 3.20 -0.25 1.90 5.04 -1.26 -0.04 117.35 125.75 3d8u s TYR 107 Ca 0.04 0.01 -0.00 0.00 -2.44 0.00 0.00 57.07 54.68 3d8u s TYR 107 Cb -0.04 -2.02 0.07 0.00 0.35 0.00 0.00 41.96 40.32 3d8u s TYR 107 CO -0.07 0.16 0.01 -1.54 -1.34 0.00 0.00 175.55 172.76 3d8u s SER 108 N 0.23 3.77 -0.41 4.32 1.04 -0.63 -4.93 113.70 117.10 3d8u s SER 108 Ca 0.02 -1.30 -0.08 0.00 0.48 0.00 0.00 55.95 55.07 3d8u s SER 108 Cb -0.13 -1.02 -0.10 0.00 0.10 0.00 0.00 66.02 64.87 3d8u s SER 108 CO 0.01 -0.31 1.46 0.47 0.98 0.00 0.00 173.24 175.85 3d8u n ASP 109 N 4.76 -1.01 -3.41 7.02 10.43 -1.26 -3.20 116.55 129.88 3d8u n ASP 109 Ca -0.07 -1.55 -0.15 0.00 2.57 0.00 0.00 54.79 55.59 3d8u n ASP 109 Cb 0.44 -0.90 -0.03 0.00 1.84 0.00 0.00 41.12 42.47 3d8u n ASP 109 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 3d8u n TYR 110 N 8.82 -0.53 -4.06 1.24 0.53 -0.95 -4.85 117.16 117.35 3d8u n TYR 110 Ca 0.20 0.19 -0.32 0.00 -1.02 0.00 0.00 57.90 56.95 3d8u n TYR 110 Cb 0.45 -1.15 -0.15 0.00 -1.03 0.00 0.00 39.34 37.45 3d8u n TYR 110 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3d8u s SER 111 N -3.78 4.03 0.40 7.72 0.15 -1.19 -4.96 113.70 116.06 3d8u s SER 111 Ca 0.05 -1.18 0.09 0.00 0.70 0.00 0.00 55.95 55.61 3d8u s SER 111 Cb -0.03 -1.47 0.84 0.00 -1.71 0.00 0.00 66.02 63.65 3d8u s SER 111 CO 0.41 -0.15 1.98 0.16 1.20 0.00 0.00 173.24 176.84 3d8u h ILE 112 N 6.56 1.14 -0.04 6.45 3.07 -1.92 -1.96 117.51 130.81 3d8u h ILE 112 Ca -0.25 -0.52 -0.09 0.00 1.55 0.00 0.00 64.86 65.55 3d8u h ILE 112 Cb 1.07 0.95 0.01 0.00 -0.27 0.00 0.00 36.82 38.58 3d8u h ILE 112 CO 0.49 0.18 -0.32 -0.33 -1.05 0.00 0.00 178.15 177.12 3d8u h GLU 113 N 0.33 0.28 -0.48 0.16 4.39 -1.96 -3.01 114.58 114.27 3d8u h GLU 113 Ca 0.08 -0.25 -0.10 0.00 0.34 0.00 0.00 59.36 59.43 3d8u h GLU 113 Cb 0.20 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 3d8u h GLU 113 CO 0.00 0.93 -0.09 -0.56 -1.16 0.00 0.00 179.01 178.13 3d8u h GLN 114 N -0.28 0.87 -0.84 2.33 -0.00 -1.97 -2.46 115.11 112.77 3d8u h GLN 114 Ca -0.03 -0.29 0.21 0.00 -0.00 0.00 0.00 58.65 58.54 3d8u h GLN 114 Cb 1.01 -0.07 -0.13 0.00 -0.00 0.00 0.00 27.48 28.29 3d8u h GLN 114 CO 0.06 0.92 0.24 1.49 -0.00 0.00 0.00 178.83 181.55 3d8u h GLU 115 N 0.79 0.25 0.00 0.06 4.81 -1.40 0.19 114.58 119.28 3d8u h GLU 115 Ca 0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3d8u h GLU 115 Cb 0.59 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3d8u h GLU 115 CO 0.04 0.17 0.00 0.39 -0.73 0.00 0.00 179.01 178.87 3d8u n GLU 116 N -5.18 0.00 -0.28 1.92 1.02 -0.95 0.93 120.64 118.09 3d8u n GLU 116 Ca 0.19 0.47 0.05 0.00 -0.02 0.00 0.00 57.16 57.84 3d8u n GLU 116 Cb 0.60 -1.44 0.11 0.00 -0.02 0.00 0.00 31.44 30.69 3d8u n GLU 116 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3d8u n LYS 117 N -1.87 -0.07 0.28 3.49 5.02 -1.02 -0.80 118.16 123.19 3d8u n LYS 117 Ca 0.00 1.23 -0.12 0.00 -2.02 0.00 0.00 58.31 57.40 3d8u n LYS 117 Cb 0.00 -1.84 -0.06 0.00 -0.02 0.00 0.00 35.03 33.12 3d8u n LYS 117 CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 3d8u h LEU 118 N 0.00 -0.65 -0.81 -0.35 -0.00 -0.65 -3.28 115.31 109.57 3d8u h LEU 118 Ca 0.38 0.02 0.19 0.00 -0.00 0.00 0.00 57.88 58.47 3d8u h LEU 118 Cb 0.57 0.17 -0.12 0.00 -0.00 0.00 0.00 40.66 41.28 3d8u h LEU 118 CO -0.81 -0.27 0.23 0.17 -0.00 0.00 0.00 178.44 177.76 3d8u h LEU 119 N -1.16 0.05 -0.33 0.17 8.10 0.18 -1.46 115.31 120.88 3d8u h LEU 119 Ca -0.08 0.16 0.04 0.00 0.11 0.00 0.00 57.88 58.12 3d8u h LEU 119 Cb 0.59 0.21 -0.07 0.00 -0.44 0.00 0.00 40.66 40.94 3d8u h LEU 119 CO 0.13 -0.07 -0.52 0.28 -4.11 0.00 0.00 178.44 174.15 3d8u h SER 120 N 0.27 -1.72 -0.52 0.17 0.02 -1.06 -0.30 113.55 110.40 3d8u h SER 120 Ca 0.48 0.22 0.10 0.00 -0.84 0.00 0.00 61.79 61.76 3d8u h SER 120 Cb 0.89 0.70 -0.10 0.00 0.14 0.00 0.00 62.40 64.02 3d8u h SER 120 CO -0.56 -0.40 -0.21 0.74 -1.14 0.00 0.00 176.83 175.26 3d8u h THR 121 N -0.41 0.35 0.15 -2.27 2.02 -1.33 -0.77 112.91 110.65 3d8u h THR 121 Ca 0.06 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.26 3d8u h THR 121 Cb 0.58 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 3d8u h THR 121 CO -0.53 0.00 -0.40 -0.26 0.37 0.00 0.00 175.52 174.71 3d8u h PHE 122 N -0.08 -1.10 -0.71 3.16 0.04 -0.90 -2.20 116.94 115.14 3d8u h PHE 122 Ca 0.25 0.03 0.10 0.00 2.80 0.00 0.00 57.97 61.14 3d8u h PHE 122 Cb 0.46 0.46 -0.07 0.00 2.20 0.00 0.00 35.95 39.00 3d8u h PHE 122 CO -0.50 -0.50 0.35 -0.07 -0.60 0.00 0.00 178.31 176.98 3d8u h LEU 123 N -0.65 0.43 0.00 1.54 -0.00 -0.58 -0.30 115.31 115.76 3d8u h LEU 123 Ca 0.02 0.07 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 3d8u h LEU 123 Cb 0.66 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 3d8u h LEU 123 CO -0.21 0.24 0.00 -1.84 -0.00 0.00 0.00 178.44 176.63 3d8u n GLU 124 N -4.88 0.34 -0.01 1.13 -0.00 -0.34 -3.85 120.64 113.02 3d8u n GLU 124 Ca 0.11 0.00 -0.02 0.00 -0.00 0.00 0.00 57.16 57.26 3d8u n GLU 124 Cb 0.29 -1.39 -0.01 0.00 -0.00 0.00 0.00 31.44 30.33 3d8u n GLU 124 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3d8u n SER 125 N -0.89 0.46 -3.74 -1.84 2.88 -0.13 -5.07 113.62 105.29 3d8u n SER 125 Ca 0.06 0.07 -0.13 0.00 -1.33 0.00 0.00 58.87 57.55 3d8u n SER 125 Cb 0.03 -0.41 -0.10 0.00 -0.75 0.00 0.00 64.21 62.99 3d8u n SER 125 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 3d8u s ARG 126 N -1.45 0.52 0.00 -1.46 3.00 -1.18 -5.11 118.95 113.28 3d8u s ARG 126 Ca -0.05 0.32 0.00 0.00 0.00 0.00 0.00 55.73 55.99 3d8u s ARG 126 Cb 0.01 0.25 0.00 0.00 0.00 0.00 0.00 34.95 35.20 3d8u s ARG 126 CO 0.08 -0.10 0.00 -2.30 0.00 0.00 0.00 175.30 172.98 3d8u n PRO 127 N 2.36 0.00 0.00 3.54 -0.02 -1.26 -4.67 135.00 134.95 3d8u n PRO 127 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 3d8u n PRO 127 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 3d8u n PRO 127 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d8u n ALA 128 N -3.00 0.00 -2.48 3.55 0.00 -1.25 -4.60 120.51 112.73 3d8u n ALA 128 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 3d8u n ALA 128 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3d8u n ALA 128 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d8u s GLY 129 N -0.40 2.10 0.04 0.00 0.00 -1.26 -4.31 107.32 103.49 3d8u s GLY 129 Ca 0.00 -2.07 0.05 0.00 0.00 0.00 0.00 44.72 42.70 3d8u s GLY 129 CO 0.00 -1.88 -0.14 0.54 0.00 0.00 0.00 173.10 171.62 3d8u s VAL 130 N -3.11 1.10 -0.07 1.40 0.11 -0.67 -2.25 120.40 116.92 3d8u s VAL 130 Ca 0.34 -0.99 0.04 0.00 -2.93 0.00 0.00 61.98 58.44 3d8u s VAL 130 Cb 0.08 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.93 3d8u s VAL 130 CO 0.15 0.01 -0.18 0.54 -3.33 0.00 0.00 175.10 172.29 3d8u s VAL 131 N -0.84 1.52 0.03 2.04 0.11 0.68 -2.30 120.40 121.64 3d8u s VAL 131 Ca 0.02 -0.73 0.04 0.00 -2.93 0.00 0.00 61.98 58.38 3d8u s VAL 131 Cb -0.08 -1.33 -0.02 0.00 -1.53 0.00 0.00 36.38 33.42 3d8u s VAL 131 CO 0.01 0.44 -0.13 -0.76 -3.33 0.00 0.00 175.10 171.33 3d8u s LEU 132 N 0.34 2.13 0.23 2.54 1.43 0.82 -2.85 118.68 123.33 3d8u s LEU 132 Ca -0.12 -0.39 -0.13 0.00 -1.03 0.00 0.00 54.13 52.46 3d8u s LEU 132 Cb -0.15 -0.59 -0.08 0.00 0.03 0.00 0.00 46.19 45.40 3d8u s LEU 132 CO 0.05 0.06 0.61 -0.36 0.23 0.00 0.00 176.35 176.94 3d8u s PHE 133 N -0.70 3.48 0.15 0.29 0.08 -1.26 0.58 117.98 120.60 3d8u s PHE 133 Ca 0.02 1.05 0.00 0.00 0.12 0.00 0.00 56.93 58.12 3d8u s PHE 133 Cb -0.07 -2.39 0.00 0.00 -0.57 0.00 0.00 43.02 39.99 3d8u s PHE 133 CO 0.01 0.27 0.00 0.41 -0.10 0.00 0.00 175.22 175.81 3d8u n GLY 134 N 0.11 -2.92 0.09 4.36 0.00 -0.74 -4.83 105.19 101.26 3d8u n GLY 134 Ca -0.00 -1.29 -0.09 0.00 0.00 0.00 0.00 46.02 44.63 3d8u n GLY 134 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3d8u n SER 135 N -2.30 0.57 -4.69 1.61 2.88 -1.26 -4.74 113.62 105.69 3d8u n SER 135 Ca -0.02 0.26 -0.42 0.00 -1.33 0.00 0.00 58.87 57.36 3d8u n SER 135 Cb 0.15 0.32 -0.03 0.00 -0.75 0.00 0.00 64.21 63.90 3d8u n SER 135 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3d8u s GLU 136 N -2.56 4.28 0.00 -1.46 8.01 -1.26 -4.58 118.70 121.13 3d8u s GLU 136 Ca -0.07 1.93 0.00 0.00 0.01 0.00 0.00 54.97 56.84 3d8u s GLU 136 Cb 0.07 -3.60 0.00 0.00 -4.31 0.00 0.00 34.13 26.29 3d8u s GLU 136 CO 0.82 -0.58 0.00 0.72 0.01 0.00 0.00 175.26 176.23 3d8u n HIS 137 N 5.50 0.00 -4.80 1.61 -0.00 -1.26 -4.94 115.22 111.34 3d8u n HIS 137 Ca 0.13 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.60 3d8u n HIS 137 Cb 0.44 0.00 -0.15 0.00 -0.00 0.00 0.00 29.99 30.28 3d8u n HIS 137 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 3d8u s SER 138 N 1.24 2.21 0.20 0.41 0.01 -1.26 -5.01 113.70 111.50 3d8u s SER 138 Ca 0.00 -0.39 -0.21 0.00 1.31 0.00 0.00 55.95 56.66 3d8u s SER 138 Cb 0.00 -0.22 0.14 0.00 0.21 0.00 0.00 66.02 66.15 3d8u s SER 138 CO 0.00 0.20 1.56 0.06 0.41 0.00 0.00 173.24 175.47 3d8u h GLN 139 N 5.43 -0.07 -0.42 12.44 -0.00 -1.97 0.78 115.11 131.31 3d8u h GLN 139 Ca -0.39 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.24 3d8u h GLN 139 Cb 1.15 0.02 -0.02 0.00 -0.00 0.00 0.00 27.48 28.63 3d8u h GLN 139 CO 0.47 -0.05 0.13 0.07 -0.00 0.00 0.00 178.83 179.45 3d8u h ARG 140 N -0.07 0.61 0.32 0.06 -0.00 -1.97 0.42 114.38 113.74 3d8u h ARG 140 Ca 0.27 -0.09 -0.02 0.00 -0.00 0.00 0.00 59.98 60.14 3d8u h ARG 140 Cb 0.56 -0.11 0.00 0.00 -0.00 0.00 0.00 29.97 30.42 3d8u h ARG 140 CO -0.88 0.54 -0.15 1.79 -0.00 0.00 0.00 179.97 181.27 3d8u h THR 141 N 0.60 0.65 -0.97 0.08 1.35 -1.25 0.35 112.91 113.72 3d8u h THR 141 Ca 0.14 -0.64 0.24 0.00 -0.55 0.00 0.00 66.41 65.60 3d8u h THR 141 Cb 0.18 0.95 -0.07 0.00 -1.73 0.00 0.00 68.15 67.48 3d8u h THR 141 CO -0.01 0.12 0.64 0.45 -0.25 0.00 0.00 175.52 176.47 3d8u h HIS 142 N -0.81 0.52 0.00 4.73 3.86 0.91 0.17 115.15 124.52 3d8u h HIS 142 Ca -0.04 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3d8u h HIS 142 Cb 0.52 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.83 3d8u h HIS 142 CO 0.03 0.10 0.00 1.04 0.86 0.00 0.00 177.93 179.96 3d8u n GLN 143 N -4.52 0.00 -0.26 2.45 3.00 0.14 -2.99 117.38 115.21 3d8u n GLN 143 Ca 0.22 0.01 -0.07 0.00 -0.01 0.00 0.00 57.00 57.15 3d8u n GLN 143 Cb 0.82 -0.79 -0.06 0.00 0.00 0.00 0.00 30.24 30.21 3d8u n GLN 143 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 3d8u n LEU 144 N -0.52 -0.65 0.06 1.08 -0.00 0.10 0.14 117.00 117.22 3d8u n LEU 144 Ca 0.00 1.15 -0.14 0.00 -0.00 0.00 0.00 56.01 57.02 3d8u n LEU 144 Cb 0.00 -0.17 -0.09 0.00 -0.00 0.00 0.00 43.42 43.16 3d8u n LEU 144 CO 0.00 -0.92 0.51 0.17 -0.00 0.00 0.00 177.39 177.15 3d8u h LEU 145 N 0.00 -1.49 -0.38 1.47 -0.00 -0.85 0.76 115.31 114.82 3d8u h LEU 145 Ca 0.10 0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.14 3d8u h LEU 145 Cb 0.25 0.56 0.00 0.00 -0.00 0.00 0.00 40.66 41.47 3d8u h LEU 145 CO -0.58 -0.48 0.00 1.05 -0.00 0.00 0.00 178.44 178.43 3d8u h GLU 146 N -0.62 0.00 0.00 0.17 9.09 -1.05 -2.25 114.58 119.92 3d8u h GLU 146 Ca 0.01 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.23 3d8u h GLU 146 Cb 0.66 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.73 3d8u h GLU 146 CO -0.31 0.00 -0.88 0.00 0.05 0.00 0.00 179.01 177.86 3d8u h ALA 147 N 2.26 0.47 0.00 1.06 0.00 0.18 -3.24 119.26 120.00 3d8u h ALA 147 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3d8u h ALA 147 Cb 0.68 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3d8u h ALA 147 CO 0.00 1.11 0.00 0.45 0.00 0.00 0.00 179.25 180.81 3d8u n SER 148 N -3.39 0.00 0.00 0.00 2.88 0.26 -4.89 113.62 108.47 3d8u n SER 148 Ca 0.00 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.74 3d8u n SER 148 Cb 0.87 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 3d8u n SER 148 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3d8u n ASN 149 N -1.39 0.00 -4.78 -3.46 0.23 -1.16 -4.92 115.26 99.77 3d8u n ASN 149 Ca 0.09 0.00 -0.34 0.00 -0.53 0.00 0.00 54.58 53.81 3d8u n ASN 149 Cb 0.26 -1.57 0.01 0.00 -2.08 0.00 0.00 39.78 36.40 3d8u n ASN 149 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 3d8u s THR 150 N -0.71 3.43 0.41 5.53 -4.23 -1.26 -5.02 115.64 113.79 3d8u s THR 150 Ca 0.00 0.78 -0.22 0.00 -1.18 0.00 0.00 61.69 61.06 3d8u s THR 150 Cb 0.00 -3.28 -0.10 0.00 1.34 0.00 0.00 72.50 70.46 3d8u s THR 150 CO 0.00 -0.30 0.98 -2.84 -0.54 0.00 0.00 174.62 171.92 3d8u s PRO 151 N -3.68 4.22 -0.03 3.99 0.02 -1.26 -4.80 135.00 133.45 3d8u s PRO 151 Ca 0.68 1.28 0.03 0.00 0.02 0.00 0.00 61.00 63.01 3d8u s PRO 151 Cb -0.20 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 31.96 3d8u s PRO 151 CO 0.32 -0.06 -0.12 0.14 -0.33 0.00 0.00 177.00 176.96 3d8u s VAL 152 N -1.93 1.01 -0.28 3.83 -7.23 -1.26 -1.66 120.40 112.88 3d8u s VAL 152 Ca 0.60 -0.48 0.03 0.00 -1.81 0.00 0.00 61.98 60.32 3d8u s VAL 152 Cb -0.15 -0.89 0.07 0.00 0.56 0.00 0.00 36.38 35.98 3d8u s VAL 152 CO 0.19 0.31 -0.06 -0.22 -0.31 0.00 0.00 175.10 175.00 3d8u s LEU 153 N 0.18 3.82 -0.07 1.32 0.20 -0.97 -1.08 118.68 122.08 3d8u s LEU 153 Ca -0.04 -1.62 -0.30 0.00 0.69 0.00 0.00 54.13 52.86 3d8u s LEU 153 Cb -0.10 -1.57 -0.02 0.00 -0.43 0.00 0.00 46.19 44.07 3d8u s LEU 153 CO 0.01 -0.25 1.01 -1.61 -0.29 0.00 0.00 176.35 175.23 3d8u s GLU 154 N 1.04 4.47 -0.91 1.98 2.02 -0.74 -0.13 118.70 126.44 3d8u s GLU 154 Ca -0.03 1.42 -0.21 0.00 0.02 0.00 0.00 54.97 56.17 3d8u s GLU 154 Cb -0.20 -3.51 0.10 0.00 0.10 0.00 0.00 34.13 30.62 3d8u s GLU 154 CO -0.06 -0.23 1.19 0.42 0.02 0.00 0.00 175.26 176.60 3d8u s ILE 155 N 1.67 4.42 0.06 -1.63 -1.09 0.20 -1.89 121.20 122.94 3d8u s ILE 155 Ca 0.50 -1.11 -0.27 0.00 -2.23 0.00 0.00 60.65 57.55 3d8u s ILE 155 Cb -0.20 -4.84 0.09 0.00 -1.58 0.00 0.00 42.46 35.93 3d8u s ILE 155 CO 0.22 -1.63 0.78 0.00 -1.23 0.00 0.00 174.94 173.08 3d8u s ALA 156 N 3.60 -1.74 -0.11 9.38 0.00 0.14 -1.79 121.76 131.24 3d8u s ALA 156 Ca 0.35 0.81 -0.18 0.00 0.00 0.00 0.00 51.96 52.94 3d8u s ALA 156 Cb -0.05 0.60 -0.16 0.00 0.00 0.00 0.00 23.12 23.51 3d8u s ALA 156 CO -0.06 -0.72 0.54 0.93 0.00 0.00 0.00 175.76 176.45 3d8u h GLU 157 N 2.00 -0.04 -6.20 0.00 5.08 -1.81 -3.03 114.58 110.58 3d8u h GLU 157 Ca -0.27 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.55 3d8u h GLU 157 Cb 1.27 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.46 3d8u h GLU 157 CO 0.34 0.53 -0.56 -0.48 -1.00 0.00 0.00 179.01 177.84 3d8u s LEU 158 N -8.47 3.77 -0.13 1.33 2.34 -1.26 -4.84 118.68 111.42 3d8u s LEU 158 Ca -0.12 -0.20 0.02 0.00 0.06 0.00 0.00 54.13 53.89 3d8u s LEU 158 Cb -0.01 -2.35 0.01 0.00 -0.56 0.00 0.00 46.19 43.28 3d8u s LEU 158 CO 0.42 0.03 -0.19 -0.94 -1.06 0.00 0.00 176.35 174.61 3d8u s SER 159 N -3.40 2.80 1.19 1.48 1.04 -1.26 -4.67 113.70 110.87 3d8u s SER 159 Ca 0.32 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 56.07 3d8u s SER 159 Cb -0.09 -1.28 0.28 0.00 0.10 0.00 0.00 66.02 65.04 3d8u s SER 159 CO 0.24 0.04 1.03 -0.94 0.98 0.00 0.00 173.24 174.59 3d8u s SER 160 N 0.93 0.88 0.00 7.02 1.04 -1.26 -4.53 113.70 117.78 3d8u s SER 160 Ca -0.06 1.22 0.00 0.00 0.48 0.00 0.00 55.95 57.59 3d8u s SER 160 Cb -0.15 -1.87 0.00 0.00 0.10 0.00 0.00 66.02 64.10 3d8u s SER 160 CO -0.02 -4.22 0.00 2.29 0.98 0.00 0.00 173.24 172.27 3d8u n LYS 161 N -4.90 -0.52 -0.11 4.02 0.00 -1.26 -4.39 118.16 111.01 3d8u n LYS 161 Ca 0.06 0.62 0.02 0.00 -0.00 0.00 0.00 58.31 59.00 3d8u n LYS 161 Cb 0.56 -0.52 0.04 0.00 -0.00 0.00 0.00 35.03 35.11 3d8u n LYS 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3d8u n ALA 162 N 1.53 0.07 -0.95 0.58 0.00 -1.26 -1.72 120.51 118.75 3d8u n ALA 162 Ca 0.00 0.33 -0.14 0.00 0.00 0.00 0.00 53.44 53.64 3d8u n ALA 162 Cb 0.12 -0.20 -0.04 0.00 0.00 0.00 0.00 19.45 19.33 3d8u n ALA 162 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3d8u n SER 163 N -4.49 5.89 -4.53 0.00 2.88 -1.26 -4.82 113.62 107.28 3d8u n SER 163 Ca 0.05 -2.79 -0.34 0.00 -1.33 0.00 0.00 58.87 54.46 3d8u n SER 163 Cb 0.15 -1.20 -0.11 0.00 -0.75 0.00 0.00 64.21 62.29 3d8u n SER 163 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3d8u s TYR 164 N -0.64 3.08 0.42 0.66 1.51 -0.70 -4.85 117.35 116.83 3d8u s TYR 164 Ca 0.38 -0.21 -0.23 0.00 -1.01 0.00 0.00 57.07 56.01 3d8u s TYR 164 Cb 0.23 -1.98 -0.09 0.00 -0.11 0.00 0.00 41.96 40.01 3d8u s TYR 164 CO -0.05 0.02 1.04 -0.48 -1.11 0.00 0.00 175.55 174.97 3d8u s LEU 165 N 0.35 4.06 0.23 -1.29 2.34 -0.24 -4.94 118.68 119.19 3d8u s LEU 165 Ca -0.02 2.00 -0.19 0.00 0.06 0.00 0.00 54.13 55.98 3d8u s LEU 165 Cb -0.14 -4.29 0.02 0.00 -0.56 0.00 0.00 46.19 41.23 3d8u s LEU 165 CO 0.02 -0.57 0.59 0.54 -1.06 0.00 0.00 176.35 175.88 3d8u s ASN 166 N -1.69 -0.27 -0.28 1.48 4.22 -1.26 -1.78 114.94 115.36 3d8u s ASN 166 Ca 0.60 -0.54 -0.19 0.00 -2.14 0.00 0.00 52.86 50.59 3d8u s ASN 166 Cb -0.20 0.63 0.13 0.00 1.28 0.00 0.00 41.25 43.09 3d8u s ASN 166 CO 0.25 -1.16 0.94 -0.51 -2.04 0.00 0.00 177.10 174.59 3d8u s ILE 167 N -3.90 0.00 0.00 0.54 -1.16 -0.79 -4.93 121.20 110.96 3d8u s ILE 167 Ca 0.11 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.25 3d8u s ILE 167 Cb -0.03 -1.00 0.00 0.00 0.61 0.00 0.00 42.46 42.04 3d8u s ILE 167 CO 0.01 0.00 0.00 0.61 -2.81 0.00 0.00 174.94 172.75 3d8u n GLY 168 N 3.29 0.64 3.93 1.50 0.00 -1.14 0.23 105.19 113.63 3d8u n GLY 168 Ca -0.17 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 3d8u n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d8u s VAL 169 N -2.00 4.10 -0.51 1.61 -7.23 -1.26 -4.78 120.40 110.32 3d8u s VAL 169 Ca 0.00 -0.13 -0.16 0.00 -1.81 0.00 0.00 61.98 59.87 3d8u s VAL 169 Cb 0.00 -3.57 0.10 0.00 0.56 0.00 0.00 36.38 33.47 3d8u s VAL 169 CO 0.00 -0.51 0.48 -0.62 -0.31 0.00 0.00 175.10 174.14 3d8u s ASP 170 N -4.22 6.17 0.37 4.85 3.68 -1.26 -4.54 116.67 121.72 3d8u s ASP 170 Ca 0.50 -1.48 0.18 0.00 2.13 0.00 0.00 52.55 53.89 3d8u s ASP 170 Cb -0.10 -2.21 0.69 0.00 -1.45 0.00 0.00 42.92 39.84 3d8u s ASP 170 CO 0.42 -0.79 1.74 0.45 0.13 0.00 0.00 175.17 177.13 3d8u h HIS 171 N 8.86 0.00 0.04 -5.34 3.86 -1.93 -3.05 115.15 117.59 3d8u h HIS 171 Ca -0.29 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 58.93 3d8u h HIS 171 Cb 1.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.56 3d8u h HIS 171 CO 0.70 0.38 -0.09 0.35 0.86 0.00 0.00 177.93 180.13 3d8u h PHE 172 N 0.00 -0.24 -0.82 2.45 3.57 -1.92 0.11 116.94 120.09 3d8u h PHE 172 Ca -0.00 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.53 3d8u h PHE 172 Cb 0.88 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.67 3d8u h PHE 172 CO 0.00 -0.15 0.52 1.49 -2.23 0.00 0.00 178.31 177.95 3d8u h GLU 173 N -0.18 0.99 -0.10 1.11 4.57 -1.85 -0.28 114.58 118.84 3d8u h GLU 173 Ca 0.02 -0.06 0.03 0.00 -1.18 0.00 0.00 59.36 58.17 3d8u h GLU 173 Cb 0.21 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 3d8u h GLU 173 CO -0.07 0.65 -0.10 0.28 -1.18 0.00 0.00 179.01 178.59 3d8u h VAL 174 N 1.02 0.71 0.27 0.32 2.07 -1.27 0.86 116.25 120.23 3d8u h VAL 174 Ca 0.33 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.84 3d8u h VAL 174 Cb 0.01 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 3d8u h VAL 174 CO -0.11 0.00 -0.26 1.23 0.02 0.00 0.00 177.57 178.45 3d8u h GLY 175 N -0.13 -0.97 -0.81 2.17 0.00 0.02 -1.00 103.07 102.35 3d8u h GLY 175 Ca 0.07 0.43 0.16 0.00 0.00 0.00 0.00 47.33 48.00 3d8u h GLY 175 CO -0.18 -0.32 -0.29 1.70 0.00 0.00 0.00 176.54 177.46 3d8u h LYS 176 N -0.52 -0.02 -0.19 4.80 3.64 -0.87 0.35 116.57 123.75 3d8u h LYS 176 Ca -0.03 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.24 3d8u h LYS 176 Cb 0.45 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 3d8u h LYS 176 CO -0.02 -0.01 -0.29 0.00 -2.27 0.00 0.00 179.45 176.85 3d8u h ALA 177 N 1.64 0.29 -0.74 5.00 0.00 0.10 0.42 119.26 125.98 3d8u h ALA 177 Ca 0.38 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.99 3d8u h ALA 177 Cb 0.63 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3d8u h ALA 177 CO -0.92 0.30 0.49 0.00 0.00 0.00 0.00 179.25 179.12 3d8u h THR 179 N 0.61 0.72 -0.26 0.00 1.03 0.18 -3.09 112.91 112.11 3d8u h THR 179 Ca 0.34 -2.25 -0.02 0.00 -0.01 0.00 0.00 66.41 64.48 3d8u h THR 179 Cb 0.51 2.24 -0.01 0.00 -1.07 0.00 0.00 68.15 69.81 3d8u h THR 179 CO -0.12 0.41 0.07 0.03 -0.01 0.00 0.00 175.52 175.90 3d8u h ARG 180 N 0.00 0.36 0.48 0.00 3.08 0.04 -2.72 114.38 115.62 3d8u h ARG 180 Ca -0.13 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 3d8u h ARG 180 Cb 1.60 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.57 3d8u h ARG 180 CO 0.06 0.33 -0.40 1.25 -1.07 0.00 0.00 179.97 180.15 3d8u h HIS 181 N 0.36 -1.09 -0.86 3.04 2.76 -1.27 1.49 115.15 119.58 3d8u h HIS 181 Ca 0.09 0.00 0.18 0.00 -2.20 0.00 0.00 60.37 58.44 3d8u h HIS 181 Cb 0.13 0.41 -0.16 0.00 1.55 0.00 0.00 27.41 29.34 3d8u h HIS 181 CO 0.00 -0.55 -0.18 -0.07 -1.30 0.00 0.00 177.93 175.84 3d8u h LEU 182 N -0.85 -0.74 0.23 0.26 3.38 -1.54 0.46 115.31 116.51 3d8u h LEU 182 Ca -0.06 0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3d8u h LEU 182 Cb 0.72 0.52 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3d8u h LEU 182 CO -0.00 -0.28 -0.11 0.40 0.09 0.00 0.00 178.44 178.54 3d8u h ILE 183 N 0.01 0.84 -0.30 1.22 2.04 -1.07 0.29 117.51 120.54 3d8u h ILE 183 Ca 0.43 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.97 3d8u h ILE 183 Cb 0.68 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3d8u h ILE 183 CO -0.87 0.09 0.22 -0.33 0.00 0.00 0.00 178.15 177.26 3d8u h GLU 184 N -0.51 0.00 0.00 2.37 5.08 0.31 0.57 114.58 122.40 3d8u h GLU 184 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3d8u h GLU 184 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3d8u h GLU 184 CO 0.05 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.10 3d8u n GLN 185 N -4.40 0.13 0.00 2.33 1.13 0.15 -4.91 117.38 111.81 3d8u n GLN 185 Ca 0.04 0.20 0.00 0.00 -1.94 0.00 0.00 57.00 55.30 3d8u n GLN 185 Cb 0.39 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 29.06 3d8u n GLN 185 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d8u n GLY 186 N 0.92 0.31 3.48 1.08 0.00 0.19 -4.97 105.19 106.20 3d8u n GLY 186 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 3d8u n GLY 186 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d8u s PHE 187 N -2.00 2.98 -2.51 1.61 0.40 0.93 -4.87 117.98 114.53 3d8u s PHE 187 Ca 0.00 -1.29 0.25 0.00 -0.60 0.00 0.00 56.93 55.29 3d8u s PHE 187 Cb 0.00 -4.39 0.75 0.00 0.51 0.00 0.00 43.02 39.89 3d8u s PHE 187 CO 0.00 -1.60 1.57 1.63 0.70 0.00 0.00 175.22 177.52 3d8u n LYS 188 N 7.11 1.89 -3.67 0.44 5.02 -1.26 -3.79 118.16 123.90 3d8u n LYS 188 Ca 0.27 -1.31 -0.28 0.00 -2.02 0.00 0.00 58.31 54.97 3d8u n LYS 188 Cb 0.49 -1.45 -0.12 0.00 -0.02 0.00 0.00 35.03 33.93 3d8u n LYS 188 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3d8u s ASN 189 N -1.81 3.32 -0.07 4.39 6.03 -1.26 -4.96 114.94 120.59 3d8u s ASN 189 Ca 0.35 -3.15 -0.14 0.00 -1.03 0.00 0.00 52.86 48.89 3d8u s ASN 189 Cb 0.20 -1.03 -0.05 0.00 -3.03 0.00 0.00 41.25 37.34 3d8u s ASN 189 CO 0.30 -0.18 0.36 -0.69 -2.03 0.00 0.00 177.10 174.86 3d8u s VAL 190 N -0.31 5.17 0.36 3.54 1.01 -1.26 -2.03 120.40 126.88 3d8u s VAL 190 Ca 0.25 0.71 0.07 0.00 0.00 0.00 0.00 61.98 63.01 3d8u s VAL 190 Cb -0.09 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 3d8u s VAL 190 CO -0.11 0.50 0.42 -0.83 0.00 0.00 0.00 175.10 175.08 3d8u s GLY 191 N -0.45 1.77 -0.04 4.51 0.00 0.11 -4.76 107.32 108.47 3d8u s GLY 191 Ca 0.21 -1.60 0.03 0.00 0.00 0.00 0.00 44.72 43.36 3d8u s GLY 191 CO 0.10 -1.49 -0.12 -0.12 0.00 0.00 0.00 173.10 171.46 3d8u s PHE 192 N -2.27 1.29 -0.10 1.90 5.36 -0.43 -0.42 117.98 123.30 3d8u s PHE 192 Ca 0.46 -0.37 0.01 0.00 -0.96 0.00 0.00 56.93 56.07 3d8u s PHE 192 Cb -0.08 -0.91 0.02 0.00 -0.34 0.00 0.00 43.02 41.71 3d8u s PHE 192 CO 0.30 -0.16 -0.12 0.42 -1.46 0.00 0.00 175.22 174.20 3d8u s ILE 193 N 0.26 1.24 0.12 3.12 1.01 -0.11 -0.73 121.20 126.11 3d8u s ILE 193 Ca -0.06 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.06 3d8u s ILE 193 Cb -0.11 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.17 3d8u s ILE 193 CO 0.02 0.39 0.13 -0.83 0.00 0.00 0.00 174.94 174.65 3d8u s GLY 194 N 1.09 0.63 0.20 6.18 0.00 -0.42 -0.72 107.32 114.27 3d8u s GLY 194 Ca -0.06 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.55 3d8u s GLY 194 CO -0.02 -1.12 0.10 0.00 0.00 0.00 0.00 173.10 172.06 3d8u n ALA 195 N -0.10 0.32 -4.08 3.20 0.00 -1.26 -2.30 120.51 116.30 3d8u n ALA 195 Ca -0.09 -1.05 -0.33 0.00 0.00 0.00 0.00 53.44 51.97 3d8u n ALA 195 Cb 0.63 0.76 -0.04 0.00 0.00 0.00 0.00 19.45 20.79 3d8u n ALA 195 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3d8u n ARG 196 N -0.42 -0.68 -0.48 0.00 -4.01 0.12 -4.73 116.66 106.46 3d8u n ARG 196 Ca -0.00 0.04 0.04 0.00 -1.04 0.00 0.00 57.85 56.88 3d8u n ARG 196 Cb 0.31 -2.66 0.23 0.00 -3.04 0.00 0.00 32.46 27.30 3d8u n ARG 196 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 3d8u n GLY 197 N -2.22 2.20 0.01 2.89 0.00 0.06 -2.16 105.19 105.97 3d8u n GLY 197 Ca -0.21 -0.52 0.08 0.00 0.00 0.00 0.00 46.02 45.37 3d8u n GLY 197 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d8u n ASN 198 N 0.40 1.16 -4.81 1.61 5.03 -1.26 -4.78 115.26 112.60 3d8u n ASN 198 Ca 0.16 -0.27 -0.34 0.00 0.87 0.00 0.00 54.58 55.00 3d8u n ASN 198 Cb 0.74 1.51 -0.07 0.00 -1.02 0.00 0.00 39.78 40.95 3d8u n ASN 198 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 3d8u s HIS 199 N -2.91 3.35 0.24 3.10 2.46 -0.92 -5.01 115.29 115.60 3d8u s HIS 199 Ca -0.02 1.64 0.03 0.00 0.47 0.00 0.00 55.06 57.18 3d8u s HIS 199 Cb 0.11 -2.89 0.28 0.00 -0.13 0.00 0.00 32.58 29.95 3d8u s HIS 199 CO 0.66 -0.13 1.59 0.66 -2.47 0.00 0.00 174.74 175.05 3d8u h SER 200 N 2.12 0.37 -0.71 9.88 4.64 -1.92 -3.15 113.55 124.78 3d8u h SER 200 Ca -0.49 -0.19 0.14 0.00 -0.47 0.00 0.00 61.79 60.79 3d8u h SER 200 Cb 1.19 -0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 63.07 3d8u h SER 200 CO 0.62 0.82 0.22 0.74 -0.87 0.00 0.00 176.83 178.36 3d8u h THR 201 N 0.27 0.61 -0.69 2.95 2.02 -1.95 -1.36 112.91 114.75 3d8u h THR 201 Ca 0.01 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.08 3d8u h THR 201 Cb 1.00 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 3d8u h THR 201 CO 0.08 0.06 0.46 0.25 0.37 0.00 0.00 175.52 176.75 3d8u h LEU 202 N 0.35 0.80 -1.46 2.58 5.85 -1.77 -2.48 115.31 119.17 3d8u h LEU 202 Ca 0.39 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.10 3d8u h LEU 202 Cb 0.61 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 3d8u h LEU 202 CO -0.43 0.58 0.36 -0.61 -0.34 0.00 0.00 178.44 178.00 3d8u h GLN 203 N 0.94 0.72 -0.03 1.25 5.75 -1.39 0.40 115.11 122.74 3d8u h GLN 203 Ca 0.25 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.62 3d8u h GLN 203 Cb -0.11 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.27 3d8u h GLN 203 CO -0.06 0.47 -0.42 0.00 -2.65 0.00 0.00 178.83 176.18 3d8u h ARG 204 N 0.74 0.07 0.08 1.69 2.47 -1.18 -1.46 114.38 116.79 3d8u h ARG 204 Ca 0.20 -0.03 -0.26 0.00 -1.26 0.00 0.00 59.98 58.63 3d8u h ARG 204 Cb -0.08 -0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.27 3d8u h ARG 204 CO -0.04 0.48 -1.07 1.96 0.56 0.00 0.00 179.97 181.86 3d8u h GLN 205 N 0.06 0.57 0.06 0.04 4.20 -0.58 -1.92 115.11 117.55 3d8u h GLN 205 Ca 0.00 -0.73 0.02 0.00 0.06 0.00 0.00 58.65 58.00 3d8u h GLN 205 Cb 0.77 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.76 3d8u h GLN 205 CO 0.06 1.32 -0.16 1.25 -0.67 0.00 0.00 178.83 180.62 3d8u h LEU 206 N 0.17 -0.45 -0.74 1.46 6.46 -0.96 -0.10 115.31 121.15 3d8u h LEU 206 Ca -0.16 0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.69 3d8u h LEU 206 Cb 1.76 0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 41.82 3d8u h LEU 206 CO 0.21 -0.23 0.47 0.45 -0.62 0.00 0.00 178.44 178.72 3d8u h HIS 207 N -0.30 0.89 -0.89 1.25 3.86 -1.35 0.17 115.15 118.78 3d8u h HIS 207 Ca 0.03 0.02 0.09 0.00 -1.16 0.00 0.00 60.37 59.36 3d8u h HIS 207 Cb 0.33 -0.30 -0.07 0.00 1.06 0.00 0.00 27.41 28.43 3d8u h HIS 207 CO -0.18 0.52 0.54 0.78 0.86 0.00 0.00 177.93 180.45 3d8u h GLY 208 N 0.94 1.38 1.39 2.45 0.00 -0.64 0.42 103.07 109.01 3d8u h GLY 208 Ca 0.29 -0.37 -0.20 0.00 0.00 0.00 0.00 47.33 47.05 3d8u h GLY 208 CO -0.10 0.19 -0.73 -0.25 0.00 0.00 0.00 176.54 175.65 3d8u h TRP 209 N 0.92 0.81 -0.15 5.60 7.01 0.93 -2.83 115.95 128.24 3d8u h TRP 209 Ca 0.42 -0.35 -0.15 0.00 2.11 0.00 0.00 58.89 60.91 3d8u h TRP 209 Cb 0.32 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.25 3d8u h TRP 209 CO -0.04 1.14 -0.56 1.96 -2.79 0.00 0.00 178.44 178.16 3d8u h GLN 210 N 0.42 0.45 0.28 2.65 4.20 0.12 -2.99 115.11 120.24 3d8u h GLN 210 Ca -0.04 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.38 3d8u h GLN 210 Cb 1.33 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 3d8u h GLN 210 CO 0.14 0.89 -0.25 1.03 -0.67 0.00 0.00 178.83 179.97 3d8u h SER 211 N 0.35 -0.69 0.00 1.46 0.87 -0.90 -1.32 113.55 113.33 3d8u h SER 211 Ca 0.00 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 3d8u h SER 211 Cb 1.08 0.22 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 3d8u h SER 211 CO 0.10 -0.34 0.00 0.00 -0.53 0.00 0.00 176.83 176.06 3d8u n ALA 212 N -2.51 0.17 0.00 6.23 0.00 -1.08 -1.02 120.51 122.30 3d8u n ALA 212 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3d8u n ALA 212 Cb 0.24 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.54 3d8u n ALA 212 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3d8u n ILE 214 N 0.02 0.00 -0.45 0.00 5.41 -0.50 -3.20 119.36 120.65 3d8u n ILE 214 Ca 0.00 0.00 0.39 0.00 1.00 0.00 0.00 62.75 64.14 3d8u n ILE 214 Cb 0.00 0.00 0.74 0.00 -0.71 0.00 0.00 39.64 39.67 3d8u n ILE 214 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 3d8u h GLU 215 N 0.00 0.04 -0.56 0.38 4.81 -1.32 0.45 114.58 118.39 3d8u h GLU 215 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3d8u h GLU 215 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 3d8u h GLU 215 CO 0.00 0.03 0.00 0.09 -0.73 0.00 0.00 179.01 178.40 3d8u n ASN 216 N -4.21 5.55 -1.89 1.04 4.13 -1.19 -4.94 115.26 113.75 3d8u n ASN 216 Ca 0.32 -2.90 -0.19 0.00 1.68 0.00 0.00 54.58 53.49 3d8u n ASN 216 Cb 1.45 -0.67 -0.05 0.00 -1.54 0.00 0.00 39.78 38.97 3d8u n ASN 216 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3d8u n TYR 217 N 0.59 -0.52 -3.55 3.10 4.02 0.16 -4.99 117.16 115.97 3d8u n TYR 217 Ca 0.27 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.82 3d8u n TYR 217 Cb 1.16 -3.40 -0.05 0.00 -0.02 0.00 0.00 39.34 37.02 3d8u n TYR 217 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3d8u s LEU 218 N -5.06 4.35 -0.32 7.72 1.02 -1.26 -4.97 118.68 120.16 3d8u s LEU 218 Ca 0.00 0.82 -0.10 0.00 0.02 0.00 0.00 54.13 54.87 3d8u s LEU 218 Cb 0.00 -3.01 -0.00 0.00 0.02 0.00 0.00 46.19 43.19 3d8u s LEU 218 CO 0.00 0.16 0.17 -0.89 0.02 0.00 0.00 176.35 175.81 3d8u s THR 219 N -1.41 4.67 -0.71 5.49 2.01 -1.26 -3.27 115.64 121.17 3d8u s THR 219 Ca 0.34 -0.45 -0.02 0.00 0.31 0.00 0.00 61.69 61.86 3d8u s THR 219 Cb -0.14 -3.41 0.37 0.00 0.01 0.00 0.00 72.50 69.32 3d8u s THR 219 CO 0.18 0.02 2.09 -0.81 -0.69 0.00 0.00 174.62 175.41 3d8u n PRO 220 N 5.00 2.64 -1.90 4.92 -0.04 -1.26 -4.69 135.00 139.67 3d8u n PRO 220 Ca -0.13 -3.21 -0.17 0.00 -0.04 0.00 0.00 63.50 59.95 3d8u n PRO 220 Cb 0.49 -2.23 0.05 0.00 -0.04 0.00 0.00 33.50 31.77 3d8u n PRO 220 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3d8u n ASP 221 N -0.55 4.04 -3.55 3.54 5.68 -1.26 -4.80 116.55 119.65 3d8u n ASP 221 Ca 0.56 -3.55 -0.27 0.00 -0.50 0.00 0.00 54.79 51.03 3d8u n ASP 221 Cb 0.47 -0.38 -0.09 0.00 -1.14 0.00 0.00 41.12 39.97 3d8u n ASP 221 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3d8u n HIS 222 N -0.73 3.03 -4.19 2.11 8.25 -1.26 -5.06 115.22 117.37 3d8u n HIS 222 Ca 0.36 -4.12 -0.16 0.00 -0.26 0.00 0.00 57.72 53.53 3d8u n HIS 222 Cb 0.92 -0.53 -0.11 0.00 1.12 0.00 0.00 29.99 31.39 3d8u n HIS 222 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3d8u s PHE 223 N -1.97 1.18 -0.06 4.41 -0.71 -1.26 -1.32 117.98 118.26 3d8u s PHE 223 Ca 0.35 -0.58 0.02 0.00 -1.04 0.00 0.00 56.93 55.68 3d8u s PHE 223 Cb 0.09 -0.64 0.01 0.00 -1.21 0.00 0.00 43.02 41.27 3d8u s PHE 223 CO -0.08 0.05 -0.11 -0.51 -1.34 0.00 0.00 175.22 173.24 3d8u s LEU 224 N -2.27 1.59 0.09 -1.99 1.02 0.09 -4.95 118.68 112.26 3d8u s LEU 224 Ca 0.04 -0.27 0.06 0.00 0.02 0.00 0.00 54.13 53.98 3d8u s LEU 224 Cb -0.05 -0.77 -0.03 0.00 0.02 0.00 0.00 46.19 45.36 3d8u s LEU 224 CO 0.01 0.02 -0.16 0.42 0.02 0.00 0.00 176.35 176.66 3d8u s THR 225 N 0.72 1.30 0.16 5.49 -4.23 -1.26 -1.31 115.64 116.52 3d8u s THR 225 Ca -0.14 -1.44 0.07 0.00 -1.18 0.00 0.00 61.69 59.01 3d8u s THR 225 Cb -0.16 -1.27 -0.04 0.00 1.34 0.00 0.00 72.50 72.37 3d8u s THR 225 CO 0.03 -0.22 -0.16 0.42 -0.54 0.00 0.00 174.62 174.15 3d8u s THR 226 N -1.40 1.64 -0.02 3.99 -4.23 -0.97 -4.99 115.64 109.65 3d8u s THR 226 Ca 0.02 -1.91 0.30 0.00 -1.18 0.00 0.00 61.69 58.92 3d8u s THR 226 Cb -0.09 -1.78 0.36 0.00 1.34 0.00 0.00 72.50 72.32 3d8u s THR 226 CO 0.03 -0.40 1.87 1.12 -0.54 0.00 0.00 174.62 176.70 3d8u h HIS 227 N 3.20 0.00 -3.33 3.99 2.07 -1.91 0.55 115.15 119.72 3d8u h HIS 227 Ca -0.41 0.00 -0.41 0.00 -2.85 0.00 0.00 60.37 56.71 3d8u h HIS 227 Cb 1.20 0.00 0.20 0.00 2.57 0.00 0.00 27.41 31.39 3d8u h HIS 227 CO 0.68 0.03 0.03 -1.21 -3.07 0.00 0.00 177.93 174.39 3d8u s GLU 228 N -3.55 -1.74 0.36 5.12 2.02 -1.26 -3.98 118.70 115.67 3d8u s GLU 228 Ca 0.02 0.12 -0.09 0.00 0.02 0.00 0.00 54.97 55.04 3d8u s GLU 228 Cb 0.08 -1.52 -0.06 0.00 0.10 0.00 0.00 34.13 32.73 3d8u s GLU 228 CO 0.59 -4.09 0.70 0.00 0.02 0.00 0.00 175.26 172.47 3d8u s ALA 229 N -2.69 3.43 0.39 5.21 0.00 -1.26 0.15 121.76 126.99 3d8u s ALA 229 Ca 0.69 -0.28 -0.26 0.00 0.00 0.00 0.00 51.96 52.11 3d8u s ALA 229 Cb -0.13 -2.59 -0.09 0.00 0.00 0.00 0.00 23.12 20.31 3d8u s ALA 229 CO 0.58 0.11 1.28 -1.25 0.00 0.00 0.00 175.76 176.48 3d8u s PRO 230 N -3.65 4.04 0.08 0.00 0.04 -1.26 -4.86 135.00 129.39 3d8u s PRO 230 Ca 0.49 2.11 -0.24 0.00 0.04 0.00 0.00 61.00 63.41 3d8u s PRO 230 Cb -0.10 -2.79 0.06 0.00 0.04 0.00 0.00 34.50 31.71 3d8u s PRO 230 CO 0.29 -0.42 0.57 -1.54 0.04 0.00 0.00 177.00 175.95 3d8u s SER 231 N -0.76 -0.52 0.35 6.66 1.04 -1.26 -4.90 113.70 114.30 3d8u s SER 231 Ca 0.56 0.16 0.19 0.00 0.48 0.00 0.00 55.95 57.34 3d8u s SER 231 Cb -0.37 0.55 0.32 0.00 0.10 0.00 0.00 66.02 66.61 3d8u s SER 231 CO 0.48 -0.82 1.57 0.77 0.98 0.00 0.00 173.24 176.22 3d8u h SER 232 N 2.45 0.00 -0.97 7.02 4.64 -1.89 -2.76 113.55 122.04 3d8u h SER 232 Ca -0.32 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.02 3d8u h SER 232 Cb 1.24 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 3d8u h SER 232 CO 0.40 0.32 0.64 -0.61 -0.87 0.00 0.00 176.83 176.71 3d8u h GLN 233 N 0.00 1.25 -0.85 4.77 4.15 -1.94 -1.16 115.11 121.32 3d8u h GLN 233 Ca -0.00 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.34 3d8u h GLN 233 Cb 1.16 -0.28 -0.04 0.00 0.21 0.00 0.00 27.48 28.53 3d8u h GLN 233 CO 0.04 0.83 0.52 1.25 -1.93 0.00 0.00 178.83 179.54 3d8u h LEU 234 N 1.29 1.01 -0.34 -2.39 6.46 -1.87 -0.55 115.31 118.91 3d8u h LEU 234 Ca 0.37 -0.06 -0.17 0.00 -0.12 0.00 0.00 57.88 57.90 3d8u h LEU 234 Cb -0.10 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 39.57 3d8u h LEU 234 CO -0.09 0.77 -0.44 1.23 -0.62 0.00 0.00 178.44 179.29 3d8u h GLY 235 N 1.16 0.99 0.20 3.75 0.00 -1.21 0.99 103.07 108.94 3d8u h GLY 235 Ca 0.31 -1.07 -0.00 0.00 0.00 0.00 0.00 47.33 46.56 3d8u h GLY 235 CO -0.06 0.96 -0.24 0.00 0.00 0.00 0.00 176.54 177.20 3d8u h ALA 236 N 0.73 -0.90 -0.25 3.60 0.00 -1.11 -0.41 119.26 120.92 3d8u h ALA 236 Ca 0.04 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3d8u h ALA 236 Cb 1.04 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 3d8u h ALA 236 CO 0.10 -0.93 -0.19 0.93 0.00 0.00 0.00 179.25 179.17 3d8u h GLU 237 N -0.45 0.45 -0.13 0.00 5.08 -1.06 0.20 114.58 118.68 3d8u h GLU 237 Ca -0.02 -0.15 0.04 0.00 -1.00 0.00 0.00 59.36 58.23 3d8u h GLU 237 Cb 0.40 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.55 3d8u h GLU 237 CO -0.05 0.63 -0.38 0.78 -1.00 0.00 0.00 179.01 178.98 3d8u h GLY 238 N 0.97 -0.61 0.51 -3.84 0.00 0.11 0.10 103.07 100.30 3d8u h GLY 238 Ca 0.07 0.47 0.04 0.00 0.00 0.00 0.00 47.33 47.91 3d8u h GLY 238 CO 0.04 -0.23 -0.14 -2.00 0.00 0.00 0.00 176.54 174.22 3d8u h LEU 239 N -0.46 -0.42 -0.40 3.11 6.46 0.42 -2.03 115.31 121.98 3d8u h LEU 239 Ca 0.08 0.08 0.06 0.00 -0.12 0.00 0.00 57.88 57.98 3d8u h LEU 239 Cb 0.60 0.20 -0.08 0.00 -0.73 0.00 0.00 40.66 40.65 3d8u h LEU 239 CO -0.38 -0.18 -0.52 0.00 -0.62 0.00 0.00 178.44 176.74 3d8u h ALA 240 N 0.90 -0.68 -0.41 1.25 0.00 0.13 -0.28 119.26 120.16 3d8u h ALA 240 Ca 0.09 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3d8u h ALA 240 Cb 0.30 1.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 3d8u h ALA 240 CO -0.22 -1.00 0.00 0.87 0.00 0.00 0.00 179.25 178.90 3d8u h LYS 241 N -0.38 0.66 0.12 0.00 1.57 -0.45 -1.08 116.57 117.01 3d8u h LYS 241 Ca 0.09 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3d8u h LYS 241 Cb 0.60 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3d8u h LYS 241 CO -0.59 0.68 -0.06 -0.07 -0.57 0.00 0.00 179.45 178.84 3d8u h LEU 242 N 0.62 -0.14 -1.71 2.94 3.38 -0.89 0.23 115.31 119.75 3d8u h LEU 242 Ca 0.13 -0.09 0.31 0.00 0.09 0.00 0.00 57.88 58.32 3d8u h LEU 242 Cb 0.39 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.11 3d8u h LEU 242 CO 0.01 0.00 0.77 -0.07 0.09 0.00 0.00 178.44 179.25 3d8u h LEU 243 N -0.28 0.20 0.01 1.67 4.07 -0.31 0.15 115.31 120.83 3d8u h LEU 243 Ca -0.02 0.04 -0.29 0.00 0.08 0.00 0.00 57.88 57.69 3d8u h LEU 243 Cb 0.22 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 41.93 3d8u h LEU 243 CO 0.03 0.03 -1.65 0.25 -1.08 0.00 0.00 178.44 176.01 3d8u h LEU 244 N 0.17 0.05 -0.04 1.67 5.85 -0.47 -3.11 115.31 119.42 3d8u h LEU 244 Ca 0.59 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 59.23 3d8u h LEU 244 Cb 1.95 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.96 3d8u h LEU 244 CO -0.15 1.08 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.91 3d8u h ARG 245 N 0.01 -0.05 -0.88 1.25 2.43 0.53 -3.45 114.38 114.21 3d8u h ARG 245 Ca -0.27 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 59.06 3d8u h ARG 245 Cb 1.99 0.01 -0.21 0.00 -0.42 0.00 0.00 29.97 31.34 3d8u h ARG 245 CO 0.09 -0.03 -0.03 0.34 -1.51 0.00 0.00 179.97 178.82 3d8u s ASP 246 N -5.15 -0.91 0.39 -3.80 3.68 0.43 -5.06 116.67 106.25 3d8u s ASP 246 Ca -0.13 0.74 0.20 0.00 2.13 0.00 0.00 52.55 55.49 3d8u s ASP 246 Cb 0.07 1.83 0.68 0.00 -1.45 0.00 0.00 42.92 44.05 3d8u s ASP 246 CO 0.67 -0.17 1.72 0.77 0.13 0.00 0.00 175.17 178.29 3d8u h SER 247 N 7.91 0.00 0.00 -0.34 4.64 -1.78 -2.97 113.55 121.01 3d8u h SER 247 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3d8u h SER 247 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3d8u h SER 247 CO 0.09 0.33 0.12 0.77 -0.87 0.00 0.00 176.83 177.28 3d8u h SER 248 N 0.00 0.00 -0.74 4.97 4.64 -1.95 -3.43 113.55 117.04 3d8u h SER 248 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 3d8u h SER 248 Cb 0.91 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.07 3d8u h SER 248 CO 0.04 0.00 -0.27 -0.11 -0.87 0.00 0.00 176.83 175.62 3d8u n LEU 249 N -2.88 -0.67 0.00 5.97 7.94 -1.12 -4.90 117.00 121.34 3d8u n LEU 249 Ca -0.02 0.84 0.00 0.00 -1.11 0.00 0.00 56.01 55.72 3d8u n LEU 249 Cb 0.18 -0.70 0.00 0.00 0.53 0.00 0.00 43.42 43.43 3d8u n LEU 249 CO 0.16 -1.99 0.11 -0.46 -1.11 0.00 0.00 177.39 174.10 3d8u n ASN 250 N 1.38 0.00 -3.76 1.96 0.23 -0.86 -4.90 115.26 109.31 3d8u n ASN 250 Ca 0.14 -1.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.09 3d8u n ASN 250 Cb 0.15 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.80 3d8u n ASN 250 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3d8u s ALA 251 N 0.00 -0.74 -0.02 -2.53 0.00 -1.23 -1.51 121.76 115.73 3d8u s ALA 251 Ca 0.00 -0.31 0.03 0.00 0.00 0.00 0.00 51.96 51.68 3d8u s ALA 251 Cb 0.00 0.80 -0.00 0.00 0.00 0.00 0.00 23.12 23.92 3d8u s ALA 251 CO 0.00 -0.73 -0.11 -0.51 0.00 0.00 0.00 175.76 174.42 3d8u s LEU 252 N -2.87 1.88 -0.25 0.00 1.02 0.58 -0.71 118.68 118.33 3d8u s LEU 252 Ca 0.09 -0.21 -0.08 0.00 0.02 0.00 0.00 54.13 53.95 3d8u s LEU 252 Cb 0.01 -0.61 -0.03 0.00 0.02 0.00 0.00 46.19 45.58 3d8u s LEU 252 CO -0.05 0.10 0.08 -0.69 0.02 0.00 0.00 176.35 175.81 3d8u s VAL 253 N 0.02 4.43 -0.14 -1.59 1.01 0.43 -0.81 120.40 123.76 3d8u s VAL 253 Ca -0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 3d8u s VAL 253 Cb -0.07 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 3d8u s VAL 253 CO 0.00 0.34 0.01 0.00 0.00 0.00 0.00 175.10 175.46 3d8u h SER 255 N 6.23 0.00 -5.12 0.00 4.64 -1.25 0.19 113.55 118.23 3d8u h SER 255 Ca -0.39 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.81 3d8u h SER 255 Cb 1.18 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.11 3d8u h SER 255 CO 0.63 0.10 -0.54 -1.00 -0.87 0.00 0.00 176.83 175.15 3d8u s HIS 256 N -4.56 0.26 0.17 4.77 3.76 -1.26 -4.17 115.29 114.26 3d8u s HIS 256 Ca -0.04 -0.64 -0.06 0.00 -0.15 0.00 0.00 55.06 54.18 3d8u s HIS 256 Cb 0.15 -0.19 0.06 0.00 1.11 0.00 0.00 32.58 33.72 3d8u s HIS 256 CO 0.62 -0.39 1.49 1.49 -0.85 0.00 0.00 174.74 177.10 3d8u h GLU 257 N 3.47 0.66 -0.75 1.40 4.81 -1.88 -2.31 114.58 119.98 3d8u h GLU 257 Ca -0.33 -0.41 0.09 0.00 -0.13 0.00 0.00 59.36 58.58 3d8u h GLU 257 Cb 1.18 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.53 3d8u h GLU 257 CO 0.54 1.02 0.40 0.93 -0.73 0.00 0.00 179.01 181.18 3d8u h GLU 258 N 0.51 0.67 -0.08 1.92 3.07 -1.92 -1.79 114.58 116.96 3d8u h GLU 258 Ca 0.02 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3d8u h GLU 258 Cb 1.09 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.84 3d8u h GLU 258 CO 0.11 0.44 0.04 0.82 -1.40 0.00 0.00 179.01 179.02 3d8u h ILE 259 N 0.69 1.01 0.00 3.13 2.04 -1.54 -1.20 117.51 121.64 3d8u h ILE 259 Ca 0.36 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 66.13 3d8u h ILE 259 Cb 0.33 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3d8u h ILE 259 CO -0.24 0.02 -0.24 0.00 0.00 0.00 0.00 178.15 177.68 3d8u h ALA 260 N 1.04 1.34 -0.05 1.87 0.00 -1.15 -0.83 119.26 121.48 3d8u h ALA 260 Ca 0.03 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 3d8u h ALA 260 Cb -0.00 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3d8u h ALA 260 CO -0.02 0.30 -0.35 0.82 0.00 0.00 0.00 179.25 180.01 3d8u h ILE 261 N 0.00 1.45 -0.52 0.00 1.08 -0.82 -1.07 117.51 117.63 3d8u h ILE 261 Ca -0.00 -1.82 0.10 0.00 -0.39 0.00 0.00 64.86 62.75 3d8u h ILE 261 Cb 0.51 2.45 -0.10 0.00 -3.07 0.00 0.00 36.82 36.62 3d8u h ILE 261 CO 0.03 0.52 -0.10 1.23 -0.69 0.00 0.00 178.15 179.14 3d8u h GLY 262 N -0.21 0.41 0.94 5.37 0.00 -0.61 -1.06 103.07 107.91 3d8u h GLY 262 Ca -0.03 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 3d8u h GLY 262 CO 0.07 -0.19 -0.05 0.00 0.00 0.00 0.00 176.54 176.37 3d8u h ALA 263 N 1.51 -0.14 0.07 3.60 0.00 -1.01 -0.66 119.26 122.64 3d8u h ALA 263 Ca 0.25 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.13 3d8u h ALA 263 Cb 0.39 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 3d8u h ALA 263 CO -0.51 -0.55 -0.36 1.25 0.00 0.00 0.00 179.25 179.08 3d8u h LEU 264 N -0.20 -1.06 -1.23 0.00 6.46 -0.72 0.10 115.31 118.66 3d8u h LEU 264 Ca -0.01 0.13 0.15 0.00 -0.12 0.00 0.00 57.88 58.03 3d8u h LEU 264 Cb 0.16 0.41 -0.08 0.00 -0.73 0.00 0.00 40.66 40.42 3d8u h LEU 264 CO 0.02 -0.43 0.59 -0.26 -0.62 0.00 0.00 178.44 177.74 3d8u h PHE 265 N -0.56 0.87 -0.01 1.25 0.04 -1.10 -1.73 116.94 115.70 3d8u h PHE 265 Ca 0.04 0.03 -0.17 0.00 2.80 0.00 0.00 57.97 60.67 3d8u h PHE 265 Cb 0.61 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 3d8u h PHE 265 CO -0.34 0.30 -0.75 1.49 -0.60 0.00 0.00 178.31 178.41 3d8u h GLU 266 N 0.72 0.12 0.17 1.51 4.57 0.58 -1.69 114.58 120.57 3d8u h GLU 266 Ca 0.48 -0.11 -0.00 0.00 -1.18 0.00 0.00 59.36 58.54 3d8u h GLU 266 Cb 0.76 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.37 3d8u h GLU 266 CO -0.24 0.81 -0.12 0.00 -1.18 0.00 0.00 179.01 178.28 3d8u h HIS 268 N -0.30 0.60 -0.79 0.00 3.86 -1.06 0.14 115.15 117.61 3d8u h HIS 268 Ca -0.01 0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 3d8u h HIS 268 Cb 0.26 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 28.57 3d8u h HIS 268 CO -0.10 -0.03 0.32 -0.09 0.86 0.00 0.00 177.93 178.90 3d8u h ARG 269 N 0.40 1.16 -0.15 2.45 2.43 -0.39 -2.52 114.38 117.76 3d8u h ARG 269 Ca 0.53 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 3d8u h ARG 269 Cb 0.96 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3d8u h ARG 269 CO -0.51 0.93 0.00 0.54 -1.51 0.00 0.00 179.97 179.43 3d8u n ARG 270 N -4.28 2.09 -2.98 0.20 1.74 -0.56 -4.91 116.66 107.95 3d8u n ARG 270 Ca 0.07 -1.61 -0.22 0.00 -0.77 0.00 0.00 57.85 55.32 3d8u n ARG 270 Cb 0.18 -1.46 0.02 0.00 -1.02 0.00 0.00 32.46 30.17 3d8u n ARG 270 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3d8u n VAL 271 N 0.88 -1.59 -2.73 1.55 0.31 0.36 -4.96 118.33 112.15 3d8u n VAL 271 Ca 0.17 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 3d8u n VAL 271 Cb 0.48 -2.97 -0.03 0.00 -0.91 0.00 0.00 33.84 30.41 3d8u n VAL 271 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3d8u s LEU 272 N -6.50 3.83 0.24 7.52 2.01 -0.37 -5.00 118.68 120.40 3d8u s LEU 272 Ca 0.27 -0.36 -0.27 0.00 0.01 0.00 0.00 54.13 53.78 3d8u s LEU 272 Cb -0.13 -2.80 -0.16 0.00 0.01 0.00 0.00 46.19 43.11 3d8u s LEU 272 CO 0.33 -1.43 0.50 0.29 1.01 0.00 0.00 176.35 177.05 3d8u n LYS 273 N 8.07 0.13 -4.10 1.70 4.76 -1.26 -4.39 118.16 123.07 3d8u n LYS 273 Ca 0.03 0.04 -0.32 0.00 -2.87 0.00 0.00 58.31 55.19 3d8u n LYS 273 Cb 0.48 -1.08 -0.16 0.00 -1.84 0.00 0.00 35.03 32.42 3d8u n LYS 273 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3d8u s VAL 274 N -1.11 1.98 -2.76 -0.18 1.01 -1.26 -1.82 120.40 116.26 3d8u s VAL 274 Ca 0.63 -0.91 0.24 0.00 0.00 0.00 0.00 61.98 61.94 3d8u s VAL 274 Cb -0.86 -1.81 0.30 0.00 0.00 0.00 0.00 36.38 34.01 3d8u s VAL 274 CO 0.57 0.51 1.35 -0.81 0.00 0.00 0.00 175.10 176.72 3d8u n PRO 275 N 4.64 2.35 0.00 2.72 -0.04 -1.25 -4.79 135.00 138.63 3d8u n PRO 275 Ca -0.20 -2.00 0.11 0.00 -0.04 0.00 0.00 63.50 61.37 3d8u n PRO 275 Cb 0.50 -1.48 0.54 0.00 -0.04 0.00 0.00 33.50 33.02 3d8u n PRO 275 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3d8u n THR 276 N 1.32 0.34 -0.04 0.52 -2.24 -1.24 -3.25 114.28 109.69 3d8u n THR 276 Ca 0.16 0.09 -0.08 0.00 -2.27 0.00 0.00 64.05 61.95 3d8u n THR 276 Cb 0.58 -0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 68.07 3d8u n THR 276 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3d8u n ASP 277 N -1.35 1.79 -3.95 3.42 8.00 -0.75 -4.99 116.55 118.71 3d8u n ASP 277 Ca 0.09 0.04 -0.22 0.00 0.71 0.00 0.00 54.79 55.41 3d8u n ASP 277 Cb 0.21 -0.20 -0.16 0.00 -0.02 0.00 0.00 41.12 40.94 3d8u n ASP 277 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3d8u s ILE 278 N -2.16 0.82 0.19 0.53 1.01 -0.81 -4.51 121.20 116.27 3d8u s ILE 278 Ca -0.12 -0.29 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 3d8u s ILE 278 Cb 0.04 -0.79 -0.06 0.00 0.01 0.00 0.00 42.46 41.66 3d8u s ILE 278 CO 0.17 0.29 0.45 0.00 0.00 0.00 0.00 174.94 175.85 3d8u s ALA 279 N 0.81 3.70 0.01 9.38 0.00 -0.57 -3.78 121.76 131.31 3d8u s ALA 279 Ca -0.12 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.40 3d8u s ALA 279 Cb -0.15 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 3d8u s ALA 279 CO 0.02 0.57 -0.12 0.42 0.00 0.00 0.00 175.76 176.64 3d8u s ILE 280 N -1.76 0.96 -0.06 0.00 1.01 0.38 -0.31 121.20 121.42 3d8u s ILE 280 Ca 0.43 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 3d8u s ILE 280 Cb -0.12 -0.83 0.04 0.00 0.01 0.00 0.00 42.46 41.56 3d8u s ILE 280 CO 0.24 0.17 0.12 -0.51 0.00 0.00 0.00 174.94 174.96 3d8u s ILE 281 N -0.46 -0.06 -0.05 2.92 2.07 0.01 -4.27 121.20 121.36 3d8u s ILE 281 Ca 0.03 0.20 -0.04 0.00 -1.41 0.00 0.00 60.65 59.43 3d8u s ILE 281 Cb -0.06 -0.21 -0.04 0.00 0.13 0.00 0.00 42.46 42.29 3d8u s ILE 281 CO 0.00 0.08 0.13 0.00 -1.91 0.00 0.00 174.94 173.24 3d8u n LEU 283 N 1.42 1.07 -2.74 0.00 4.32 0.67 -1.95 117.00 119.79 3d8u n LEU 283 Ca -0.15 -0.29 -0.08 0.00 -0.02 0.00 0.00 56.01 55.48 3d8u n LEU 283 Cb 0.53 -0.11 0.05 0.00 -1.62 0.00 0.00 43.42 42.28 3d8u n LEU 283 CO 0.37 0.20 0.24 1.21 -1.22 0.00 0.00 177.39 178.19 3d8u n GLU 284 N -0.55 0.72 -1.86 3.23 2.13 -1.23 -4.58 120.64 118.51 3d8u n GLU 284 Ca 0.13 -1.63 -0.31 0.00 0.66 0.00 0.00 57.16 56.01 3d8u n GLU 284 Cb 0.35 -1.33 0.02 0.00 0.27 0.00 0.00 31.44 30.75 3d8u n GLU 284 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3d8u s GLY 285 N -1.54 1.65 0.22 8.31 0.00 -0.19 -4.01 107.32 111.75 3d8u s GLY 285 Ca 0.31 -0.16 0.04 0.00 0.00 0.00 0.00 44.72 44.91 3d8u s GLY 285 CO -0.23 0.14 0.14 -1.14 0.00 0.00 0.00 173.10 172.01 3d8u n SER 286 N -2.86 0.21 -2.47 1.64 3.41 -1.26 -4.68 113.62 107.62 3d8u n SER 286 Ca 0.06 -2.31 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 3d8u n SER 286 Cb 0.55 0.85 0.00 0.00 -0.26 0.00 0.00 64.21 65.35 3d8u n SER 286 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3d8u n SER 287 N -2.02 0.00 0.00 4.04 3.41 -1.26 -2.09 113.62 115.70 3d8u n SER 287 Ca 0.01 -1.17 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 3d8u n SER 287 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 3d8u n SER 287 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d8u n GLY 289 N 2.56 0.00 0.43 5.00 0.00 -1.26 -2.27 105.19 109.65 3d8u n GLY 289 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.27 3d8u n GLY 289 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3d8u h GLU 290 N 0.00 0.00 -0.13 1.61 4.81 -1.69 -2.24 114.58 116.94 3d8u h GLU 290 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3d8u h GLU 290 Cb 0.00 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 3d8u h GLU 290 CO 0.00 0.00 -0.25 0.72 -0.73 0.00 0.00 179.01 178.75 3d8u n HIS 291 N -4.30 0.42 -1.85 0.92 8.25 -0.96 -4.59 115.22 113.10 3d8u n HIS 291 Ca 0.14 -1.41 -0.23 0.00 -0.26 0.00 0.00 57.72 55.97 3d8u n HIS 291 Cb 0.80 -0.32 0.16 0.00 1.12 0.00 0.00 29.99 31.75 3d8u n HIS 291 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3d8u n ALA 292 N -1.13 -1.04 -3.72 -1.41 0.00 -0.85 -4.99 120.51 107.37 3d8u n ALA 292 Ca 0.23 -1.42 -0.18 0.00 0.00 0.00 0.00 53.44 52.08 3d8u n ALA 292 Cb 0.81 -0.02 -0.17 0.00 0.00 0.00 0.00 19.45 20.06 3d8u n ALA 292 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3d8u s TYR 293 N -3.21 0.07 0.58 0.00 6.14 -1.26 -2.53 117.35 117.14 3d8u s TYR 293 Ca 0.60 0.18 -0.21 0.00 0.64 0.00 0.00 57.07 58.28 3d8u s TYR 293 Cb -0.02 -0.38 -0.04 0.00 0.42 0.00 0.00 41.96 41.95 3d8u s TYR 293 CO 0.42 -0.15 1.34 -2.14 0.64 0.00 0.00 175.55 175.66 3d8u s PRO 294 N 1.62 2.95 0.70 4.97 0.02 -1.26 -4.97 135.00 139.04 3d8u s PRO 294 Ca -0.02 2.19 -0.15 0.00 0.02 0.00 0.00 61.00 63.03 3d8u s PRO 294 Cb -0.13 -2.13 0.03 0.00 0.02 0.00 0.00 34.50 32.29 3d8u s PRO 294 CO -0.03 -1.32 1.20 -1.54 -0.33 0.00 0.00 177.00 174.98 3d8u s SER 295 N -1.08 4.42 -0.08 2.53 1.04 -1.05 -4.70 113.70 114.77 3d8u s SER 295 Ca 0.75 2.33 0.03 0.00 0.48 0.00 0.00 55.95 59.54 3d8u s SER 295 Cb -0.40 -2.59 -0.01 0.00 0.10 0.00 0.00 66.02 63.12 3d8u s SER 295 CO 0.45 -2.11 -0.20 -1.48 0.98 0.00 0.00 173.24 170.89 3d8u s LEU 296 N -4.98 2.37 -0.11 2.42 0.05 -1.18 -1.75 118.68 115.50 3d8u s LEU 296 Ca 0.74 -0.41 -0.36 0.00 0.05 0.00 0.00 54.13 54.14 3d8u s LEU 296 Cb -0.29 -1.48 -0.14 0.00 -2.05 0.00 0.00 46.19 42.24 3d8u s LEU 296 CO 0.43 0.22 1.76 0.41 -0.55 0.00 0.00 176.35 178.62 3d8u n THR 297 N 3.11 0.38 -3.95 5.48 -1.04 -1.26 -4.66 114.28 112.34 3d8u n THR 297 Ca -0.18 -0.07 -0.09 0.00 -2.04 0.00 0.00 64.05 61.67 3d8u n THR 297 Cb 0.52 -1.53 -0.05 0.00 -1.82 0.00 0.00 70.33 67.46 3d8u n THR 297 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3d8u s SER 298 N 3.26 -0.12 -0.09 8.00 1.04 -0.79 -1.69 113.70 123.30 3d8u s SER 298 Ca 0.92 -0.83 -0.13 0.00 0.48 0.00 0.00 55.95 56.39 3d8u s SER 298 Cb -0.84 0.59 -0.05 0.00 0.10 0.00 0.00 66.02 65.82 3d8u s SER 298 CO 0.55 -1.14 0.33 0.00 0.98 0.00 0.00 173.24 173.95 3d8u s ALA 299 N -3.99 3.67 0.21 5.32 0.00 -0.82 -1.87 121.76 124.28 3d8u s ALA 299 Ca 0.19 -0.37 0.10 0.00 0.00 0.00 0.00 51.96 51.88 3d8u s ALA 299 Cb -0.01 -2.35 -0.05 0.00 0.00 0.00 0.00 23.12 20.72 3d8u s ALA 299 CO 0.07 0.31 -0.20 -1.21 0.00 0.00 0.00 175.76 174.73 3d8u s GLU 300 N -0.33 1.46 0.12 0.00 2.02 0.48 -1.02 118.70 121.43 3d8u s GLU 300 Ca 0.20 -1.57 0.01 0.00 0.02 0.00 0.00 54.97 53.63 3d8u s GLU 300 Cb -0.14 -1.57 -0.04 0.00 0.10 0.00 0.00 34.13 32.47 3d8u s GLU 300 CO 0.08 0.31 -0.03 -0.06 0.02 0.00 0.00 175.26 175.59 3d8u s PHE 301 N -2.19 0.97 -0.79 1.61 0.08 -1.26 -1.87 117.98 114.53 3d8u s PHE 301 Ca 0.22 -1.00 0.02 0.00 0.12 0.00 0.00 56.93 56.29 3d8u s PHE 301 Cb -0.06 -0.56 0.19 0.00 -0.57 0.00 0.00 43.02 42.03 3d8u s PHE 301 CO 0.10 -0.23 0.63 -3.47 -0.10 0.00 0.00 175.22 172.15 3d8u n ASP 302 N -0.10 3.56 0.16 1.36 4.64 -1.26 -4.87 116.55 120.03 3d8u n ASP 302 Ca -0.10 -3.18 0.01 0.00 -1.38 0.00 0.00 54.79 50.13 3d8u n ASP 302 Cb 0.62 -0.89 0.24 0.00 -1.04 0.00 0.00 41.12 40.05 3d8u n ASP 302 CO 0.00 0.00 0.00 1.88 -0.82 0.00 0.00 177.20 178.26 3d8u h TYR 303 N 5.62 0.00 -0.47 -0.67 0.05 -1.93 -2.43 116.97 117.15 3d8u h TYR 303 Ca 0.16 0.00 0.09 0.00 0.05 0.00 0.00 58.73 59.03 3d8u h TYR 303 Cb 0.77 0.00 -0.08 0.00 1.01 0.00 0.00 36.73 38.43 3d8u h TYR 303 CO 0.70 0.53 -0.04 0.93 -1.05 0.00 0.00 178.16 179.24 3d8u h GLU 304 N 0.00 0.07 -1.54 4.88 3.07 -1.88 0.37 114.58 119.55 3d8u h GLU 304 Ca -0.01 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 3d8u h GLU 304 Cb 0.96 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 3d8u h GLU 304 CO 0.07 0.05 0.00 -2.13 -1.40 0.00 0.00 179.01 175.60 3d8u n ARG 305 N -5.26 0.12 0.00 2.33 0.63 -0.92 -2.17 116.66 111.39 3d8u n ARG 305 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 3d8u n ARG 305 Cb 0.25 -1.37 0.00 0.00 0.45 0.00 0.00 32.46 31.79 3d8u n ARG 305 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3d8u n GLY 307 N 0.84 -0.01 0.37 5.14 0.00 0.13 0.54 105.19 112.20 3d8u n GLY 307 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 3d8u n GLY 307 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3d8u h THR 308 N 0.00 1.25 -0.43 2.61 1.35 -1.55 -2.31 112.91 113.83 3d8u h THR 308 Ca 0.00 -0.49 -0.13 0.00 -0.55 0.00 0.00 66.41 65.24 3d8u h THR 308 Cb 0.00 -0.14 -0.01 0.00 -1.73 0.00 0.00 68.15 66.26 3d8u h THR 308 CO 0.00 0.25 -0.26 0.11 -0.25 0.00 0.00 175.52 175.37 3d8u h LYS 309 N 1.31 0.92 0.53 4.72 1.57 -0.20 0.15 116.57 125.56 3d8u h LYS 309 Ca 0.35 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3d8u h LYS 309 Cb -0.12 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3d8u h LYS 309 CO -0.07 1.06 -0.39 0.00 -0.57 0.00 0.00 179.45 179.48 3d8u h ALA 310 N 0.92 -0.93 -0.62 3.86 0.00 -1.76 -0.53 119.26 120.20 3d8u h ALA 310 Ca 0.10 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 54.96 3d8u h ALA 310 Cb 0.82 0.52 -0.11 0.00 0.00 0.00 0.00 17.79 19.02 3d8u h ALA 310 CO 0.07 -1.05 -0.04 0.00 0.00 0.00 0.00 179.25 178.23 3d8u h ALA 311 N -0.57 0.56 0.00 0.00 0.00 -1.11 -1.55 119.26 116.60 3d8u h ALA 311 Ca -0.06 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3d8u h ALA 311 Cb 0.76 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3d8u h ALA 311 CO 0.01 -0.41 -0.08 0.93 0.00 0.00 0.00 179.25 179.71 3d8u h GLU 312 N 0.08 -0.13 -0.85 0.00 5.08 -0.44 0.27 114.58 118.59 3d8u h GLU 312 Ca 0.32 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.79 3d8u h GLU 312 Cb 0.51 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.72 3d8u h GLU 312 CO -0.56 -0.09 0.49 0.87 -1.00 0.00 0.00 179.01 178.72 3d8u h LYS 313 N -0.14 0.79 -0.03 2.33 1.57 -0.33 0.25 116.57 121.01 3d8u h LYS 313 Ca 0.03 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 3d8u h LYS 313 Cb 0.18 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3d8u h LYS 313 CO -0.08 0.52 -0.11 1.25 -0.57 0.00 0.00 179.45 180.46 3d8u h LEU 314 N 0.81 0.14 -0.43 2.94 6.46 -0.90 -2.41 115.31 121.92 3d8u h LEU 314 Ca 0.41 -0.66 0.09 0.00 -0.12 0.00 0.00 57.88 57.61 3d8u h LEU 314 Cb 0.39 -0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.20 3d8u h LEU 314 CO -0.26 0.78 -0.13 -0.07 -0.62 0.00 0.00 178.44 178.13 3d8u h LEU 315 N -0.48 -0.48 -1.01 2.25 -0.00 -0.11 0.16 115.31 115.63 3d8u h LEU 315 Ca -0.01 0.14 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 3d8u h LEU 315 Cb 0.77 0.30 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 3d8u h LEU 315 CO 0.02 -0.17 0.00 0.00 -0.00 0.00 0.00 178.44 178.29 3d8u n HIS 316 N -5.34 0.66 0.05 1.13 1.44 0.83 -0.89 115.22 113.09 3d8u n HIS 316 Ca 0.03 0.31 -0.05 0.00 -2.01 0.00 0.00 57.72 56.00 3d8u n HIS 316 Cb 0.25 -1.00 -0.03 0.00 0.12 0.00 0.00 29.99 29.33 3d8u n HIS 316 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3d8u h ALA 317 N 2.11 -0.22 -0.65 1.59 0.00 -0.16 -3.35 119.26 118.57 3d8u h ALA 317 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3d8u h ALA 317 Cb 0.13 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3d8u h ALA 317 CO 0.00 -0.22 0.29 0.82 0.00 0.00 0.00 179.25 180.14 3d8u h ILE 318 N -1.03 1.22 0.03 0.00 2.04 -1.13 -3.46 117.51 115.18 3d8u h ILE 318 Ca -0.02 -0.65 -0.05 0.00 1.00 0.00 0.00 64.86 65.14 3d8u h ILE 318 Cb 0.28 0.42 0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3d8u h ILE 318 CO 0.04 0.27 -0.20 0.07 0.00 0.00 0.00 178.15 178.32 3d8u h LYS 319 N 0.93 0.09 0.00 2.37 -0.00 -1.15 -3.52 116.57 115.28 3d8u h LYS 319 Ca 0.22 -0.13 -0.02 0.00 -0.00 0.00 0.00 60.65 60.72 3d8u h LYS 319 Cb 0.14 0.05 -0.03 0.00 -0.00 0.00 0.00 32.23 32.39 3d8u h LYS 319 CO -0.02 1.01 -0.14 -1.91 -0.00 0.00 0.00 179.45 178.38 3d8u n GLU 321 N -4.51 0.00 -1.30 0.07 2.13 -1.26 -4.97 120.64 110.80 3d8u n GLU 321 Ca -0.11 -0.34 -0.36 0.00 0.66 0.00 0.00 57.16 57.02 3d8u n GLU 321 Cb 0.54 -0.02 0.07 0.00 0.27 0.00 0.00 31.44 32.30 3d8u n GLU 321 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3d8u n PRO 322 N 0.01 0.36 -0.03 5.31 -0.04 -1.26 -4.79 135.00 134.57 3d8u n PRO 322 Ca -0.03 0.17 0.02 0.00 -0.04 0.00 0.00 63.50 63.61 3d8u n PRO 322 Cb 0.57 -1.91 0.03 0.00 -0.04 0.00 0.00 33.50 32.16 3d8u n PRO 322 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3d8u n GLU 323 N -0.95 1.71 0.00 0.54 2.13 -1.26 -4.70 120.64 118.11 3d8u n GLU 323 Ca 0.11 -1.32 0.00 0.00 0.66 0.00 0.00 57.16 56.61 3d8u n GLU 323 Cb 0.50 -1.07 0.00 0.00 0.27 0.00 0.00 31.44 31.13 3d8u n GLU 323 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3d8u n GLU 324 N -0.06 0.00 0.00 5.31 1.02 -1.26 -5.03 120.64 120.62 3d8u n GLU 324 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 3d8u n GLU 324 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.64 3d8u n GLU 324 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3d8u n PRO 326 N 0.00 0.00 -2.85 3.49 -0.05 -1.26 -5.19 135.00 129.15 3d8u n PRO 326 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 63.50 63.34 3d8u n PRO 326 Cb 0.00 0.00 0.04 0.00 -0.05 0.00 0.00 33.50 33.49 3d8u n PRO 326 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 175.50 177.86 3d8u n THR 327 N 0.00 -0.12 -2.89 0.52 -1.04 -1.26 -5.19 114.28 104.30 3d8u n THR 327 Ca 0.00 -2.12 -0.33 0.00 -2.04 0.00 0.00 64.05 59.56 3d8u n THR 327 Cb 0.00 0.84 -0.07 0.00 -1.82 0.00 0.00 70.33 69.28 3d8u n THR 327 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3d8u s SER 328 N -1.57 6.96 0.00 8.00 0.15 -1.26 -4.78 113.70 121.20 3d8u s SER 328 Ca 0.31 1.62 0.00 0.00 0.70 0.00 0.00 55.95 58.58 3d8u s SER 328 Cb 0.25 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 3d8u s SER 328 CO -0.16 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.60 3d8u n GLY 330 N -0.39 0.82 3.47 9.45 0.00 -1.26 -5.16 105.19 112.12 3d8u n GLY 330 Ca 0.05 0.27 -0.11 0.00 0.00 0.00 0.00 46.02 46.23 3d8u n GLY 330 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3d8u s PHE 331 N 1.74 -0.47 -0.04 1.61 -0.71 -1.26 -4.68 117.98 114.17 3d8u s PHE 331 Ca 0.00 0.23 0.05 0.00 -1.04 0.00 0.00 56.93 56.17 3d8u s PHE 331 Cb 0.00 0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 42.34 3d8u s PHE 331 CO 0.00 -0.89 -0.19 0.15 -1.34 0.00 0.00 175.22 172.96 3d8u s LYS 332 N -3.77 2.40 -0.90 1.99 -0.14 -0.78 -4.94 119.74 113.59 3d8u s LYS 332 Ca 0.02 -0.78 -0.17 0.00 -1.36 0.00 0.00 55.97 53.69 3d8u s LYS 332 Cb -0.01 -2.26 0.17 0.00 -1.68 0.00 0.00 37.83 34.04 3d8u s LYS 332 CO -0.11 0.58 0.99 -1.17 -0.76 0.00 0.00 175.35 174.89 3d8u s LEU 333 N -0.64 5.74 -0.45 3.17 0.20 -1.26 -0.39 118.68 125.05 3d8u s LEU 333 Ca 0.10 -2.34 -0.26 0.00 0.69 0.00 0.00 54.13 52.32 3d8u s LEU 333 Cb -0.11 -2.32 -0.07 0.00 -0.43 0.00 0.00 46.19 43.26 3d8u s LEU 333 CO 0.00 -0.85 2.39 0.29 -0.29 0.00 0.00 176.35 177.89 3d8u n LYS 334 N 5.47 1.18 -2.70 1.98 4.76 -0.78 -4.95 118.16 123.12 3d8u n LYS 334 Ca 0.20 0.07 -0.43 0.00 -2.87 0.00 0.00 58.31 55.29 3d8u n LYS 334 Cb 0.48 -3.42 -0.03 0.00 -1.84 0.00 0.00 35.03 30.23 3d8u n LYS 334 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3d8u s ARG 335 N 8.00 4.13 0.00 1.97 0.52 -1.26 -1.88 118.95 130.43 3d8u s ARG 335 Ca 0.99 1.11 0.00 0.00 -0.52 0.00 0.00 55.73 57.31 3d8u s ARG 335 Cb -0.20 -3.69 0.00 0.00 0.52 0.00 0.00 34.95 31.58 3d8u s ARG 335 CO 0.28 -0.74 0.00 0.54 0.02 0.00 0.00 175.30 175.39 3d8u n ARG 336 N 6.52 2.40 -0.06 3.54 1.74 -1.26 -4.92 116.66 124.61 3d8u n ARG 336 Ca 0.10 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.09 3d8u n ARG 336 Cb 0.47 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.89 3d8u n ARG 336 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3d8u h ALA 337 N 1.00 0.31 0.00 7.54 0.00 -1.80 -3.14 119.26 123.16 3d8u h ALA 337 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d8u h ALA 337 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3d8u h ALA 337 CO 0.00 -0.24 0.00 -1.13 0.00 0.00 0.00 179.25 177.88 3d8u n SER 338 N -4.95 0.00 -0.21 0.00 3.41 -0.72 0.46 113.62 111.61 3d8u n SER 338 Ca -0.02 -0.10 0.06 0.00 -0.26 0.00 0.00 58.87 58.55 3d8u n SER 338 Cb 0.04 -0.09 0.08 0.00 -0.26 0.00 0.00 64.21 63.98 3d8u n SER 338 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3d8u n THR 339 N -1.09 1.18 -2.33 6.66 -2.24 -1.19 -0.47 114.28 114.79 3d8u n THR 339 Ca 0.05 -1.41 -0.27 0.00 -2.27 0.00 0.00 64.05 60.16 3d8u n THR 339 Cb 0.04 0.06 0.04 0.00 -2.10 0.00 0.00 70.33 68.37 3d8u n THR 339 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d8u s ALA 340 N -1.78 3.26 -0.11 6.98 0.00 0.17 -4.99 121.76 125.30 3d8u s ALA 340 Ca 0.19 -0.73 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 3d8u s ALA 340 Cb 0.17 -2.62 0.05 0.00 0.00 0.00 0.00 23.12 20.72 3d8u s ALA 340 CO 0.02 -0.92 0.22 -1.50 0.00 0.00 0.00 175.76 173.59 3d8u s ILE 341 N -3.06 -0.24 -0.18 0.00 2.07 -1.26 -4.84 121.20 113.69 3d8u s ILE 341 Ca 0.55 0.25 0.01 0.00 -1.41 0.00 0.00 60.65 60.06 3d8u s ILE 341 Cb -0.11 -0.37 0.01 0.00 0.13 0.00 0.00 42.46 42.12 3d8u s ILE 341 CO 0.45 0.10 0.55 -3.20 -1.91 0.00 0.00 174.94 170.93