#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oyl s SER 44 N 0.00 4.97 0.07 2.55 1.04 -1.26 -5.04 113.70 116.03 2oyl s SER 44 Ca 0.00 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.13 2oyl s SER 44 Cb 0.00 -1.12 -0.03 0.00 0.10 0.00 0.00 66.02 64.97 2oyl s SER 44 CO 0.00 0.06 -0.17 -0.31 0.98 0.00 0.00 173.24 173.80 2oyl s TYR 45 N -1.87 1.48 0.64 5.02 1.51 -1.26 -4.15 117.35 118.72 2oyl s TYR 45 Ca 0.29 -0.42 -0.17 0.00 -1.01 0.00 0.00 57.07 55.76 2oyl s TYR 45 Cb -0.09 -0.84 -0.01 0.00 -0.11 0.00 0.00 41.96 40.92 2oyl s TYR 45 CO 0.20 0.11 1.21 -0.51 -1.11 0.00 0.00 175.55 175.45 2oyl s LEU 46 N -1.63 3.53 0.09 -1.29 1.02 -1.26 -4.88 118.68 114.26 2oyl s LEU 46 Ca 0.03 2.36 0.08 0.00 0.02 0.00 0.00 54.13 56.62 2oyl s LEU 46 Cb -0.09 -4.59 -0.03 0.00 0.02 0.00 0.00 46.19 41.49 2oyl s LEU 46 CO 0.03 -1.82 -0.21 -0.54 0.02 0.00 0.00 176.35 173.82 2oyl s LYS 47 N -3.57 1.19 0.92 1.70 -0.14 -1.26 -1.22 119.74 117.36 2oyl s LYS 47 Ca 0.76 -1.12 -0.14 0.00 -1.36 0.00 0.00 55.97 54.11 2oyl s LYS 47 Cb -0.30 -1.43 0.21 0.00 -1.68 0.00 0.00 37.83 34.64 2oyl s LYS 47 CO 0.38 0.34 1.26 -0.40 -0.76 0.00 0.00 175.35 176.16 2oyl n ASP 48 N 1.25 0.22 0.15 2.83 5.68 -0.69 -4.91 116.55 121.08 2oyl n ASP 48 Ca -0.19 -1.53 0.12 0.00 -0.50 0.00 0.00 54.79 52.69 2oyl n ASP 48 Cb 0.53 -0.95 0.54 0.00 -1.14 0.00 0.00 41.12 40.11 2oyl n ASP 48 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2oyl h ASP 49 N -1.58 0.00 0.08 -1.12 3.32 -1.96 -1.24 116.42 113.91 2oyl h ASP 49 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2oyl h ASP 49 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2oyl h ASP 49 CO 0.30 0.00 -0.06 0.47 -1.72 0.00 0.00 179.24 178.23 2oyl n ASP 50 N -2.32 1.07 0.00 6.45 8.00 -1.26 -4.93 116.55 123.55 2oyl n ASP 50 Ca 0.01 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.30 2oyl n ASP 50 Cb 0.19 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 2oyl n ASP 50 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oyl n GLY 51 N 1.19 0.70 3.77 0.44 0.00 -0.47 -4.61 105.19 106.21 2oyl n GLY 51 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2oyl n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oyl s ARG 52 N -0.19 4.50 -0.07 1.61 0.52 -1.26 -4.71 118.95 119.35 2oyl s ARG 52 Ca 0.00 1.50 -0.28 0.00 -0.52 0.00 0.00 55.73 56.43 2oyl s ARG 52 Cb 0.00 -2.86 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 2oyl s ARG 52 CO 0.00 0.17 0.91 -1.12 0.02 0.00 0.00 175.30 175.27 2oyl s SER 53 N -1.40 7.19 -0.17 0.23 0.01 0.14 -1.71 113.70 118.00 2oyl s SER 53 Ca 0.50 1.45 -0.15 0.00 1.31 0.00 0.00 55.95 59.06 2oyl s SER 53 Cb -0.23 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 2oyl s SER 53 CO 0.29 -0.30 0.34 -0.76 0.41 0.00 0.00 173.24 173.22 2oyl s LEU 54 N 1.43 4.21 -0.34 2.44 1.43 -0.35 -0.87 118.68 126.63 2oyl s LEU 54 Ca 0.46 0.53 -0.08 0.00 -1.03 0.00 0.00 54.13 54.00 2oyl s LEU 54 Cb -0.19 -2.45 0.02 0.00 0.03 0.00 0.00 46.19 43.61 2oyl s LEU 54 CO 0.21 0.03 0.14 -0.63 0.23 0.00 0.00 176.35 176.33 2oyl s ILE 55 N 0.78 4.20 -0.22 -0.59 1.01 -0.61 -4.60 121.20 121.18 2oyl s ILE 55 Ca 0.18 -0.85 -0.08 0.00 0.00 0.00 0.00 60.65 59.90 2oyl s ILE 55 Cb -0.14 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 2oyl s ILE 55 CO 0.06 -0.11 0.08 -0.76 0.00 0.00 0.00 174.94 174.21 2oyl s LEU 56 N 1.50 3.71 -0.10 2.97 1.43 -1.26 -4.63 118.68 122.30 2oyl s LEU 56 Ca 0.01 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.07 2oyl s LEU 56 Cb -0.19 -1.97 0.04 0.00 0.03 0.00 0.00 46.19 44.10 2oyl s LEU 56 CO 0.04 0.08 0.01 -0.13 0.23 0.00 0.00 176.35 176.58 2oyl s ARG 57 N 0.96 0.59 0.00 1.70 1.81 -1.26 -0.60 118.95 122.15 2oyl s ARG 57 Ca 0.04 -0.02 0.00 0.00 -1.72 0.00 0.00 55.73 54.04 2oyl s ARG 57 Cb -0.14 -1.26 0.00 0.00 -0.45 0.00 0.00 34.95 33.10 2oyl s ARG 57 CO 0.03 -0.40 0.00 0.41 -0.68 0.00 0.00 175.30 174.66 2oyl n GLY 58 N 5.13 1.96 3.33 -3.53 0.00 -0.43 -1.10 105.19 110.55 2oyl n GLY 58 Ca -0.07 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 2oyl n GLY 58 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oyl s PHE 59 N -1.21 1.64 -0.04 1.61 0.08 -1.23 -1.07 117.98 117.75 2oyl s PHE 59 Ca 0.00 -0.63 -0.30 0.00 0.12 0.00 0.00 56.93 56.12 2oyl s PHE 59 Cb 0.00 -0.79 -0.03 0.00 -0.57 0.00 0.00 43.02 41.63 2oyl s PHE 59 CO 0.00 0.29 1.08 -0.80 -0.10 0.00 0.00 175.22 175.68 2oyl s ASN 60 N -3.30 7.20 -0.19 1.36 0.01 0.57 -1.23 114.94 119.35 2oyl s ASN 60 Ca 0.22 1.70 -0.04 0.00 -0.71 0.00 0.00 52.86 54.03 2oyl s ASN 60 Cb 0.00 -2.56 0.06 0.00 0.41 0.00 0.00 41.25 39.17 2oyl s ASN 60 CO 0.06 -0.44 0.07 -0.89 -1.51 0.00 0.00 177.10 174.39 2oyl s THR 61 N 1.70 0.21 0.08 1.60 2.01 -0.56 -1.11 115.64 119.57 2oyl s THR 61 Ca 0.53 -0.42 -0.18 0.00 0.31 0.00 0.00 61.69 61.93 2oyl s THR 61 Cb -0.22 -0.84 0.04 0.00 0.01 0.00 0.00 72.50 71.49 2oyl s THR 61 CO 0.23 -0.30 0.42 0.00 -0.69 0.00 0.00 174.62 174.29 2oyl s ALA 62 N 2.00 -1.03 0.48 7.40 0.00 -1.26 -1.96 121.76 127.39 2oyl s ALA 62 Ca 0.01 0.19 0.18 0.00 0.00 0.00 0.00 51.96 52.35 2oyl s ALA 62 Cb -0.17 0.51 1.20 0.00 0.00 0.00 0.00 23.12 24.67 2oyl s ALA 62 CO -0.11 -0.55 2.01 1.03 0.00 0.00 0.00 175.76 178.14 2oyl h SER 63 N 2.68 0.18 -0.04 0.00 0.87 -1.99 -1.78 113.55 113.46 2oyl h SER 63 Ca -0.32 0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.25 2oyl h SER 63 Cb 1.23 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2oyl h SER 63 CO 0.45 0.11 0.07 0.77 -0.53 0.00 0.00 176.83 177.69 2oyl h SER 64 N 0.20 0.00 0.42 6.23 4.64 -1.96 -0.99 113.55 122.08 2oyl h SER 64 Ca 0.22 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.50 2oyl h SER 64 Cb 0.62 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 2oyl h SER 64 CO -0.04 0.00 -0.20 0.00 -0.87 0.00 0.00 176.83 175.73 2oyl h ALA 65 N 1.90 1.32 -0.97 5.18 0.00 -1.47 -3.25 119.26 121.96 2oyl h ALA 65 Ca 0.02 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.82 2oyl h ALA 65 Cb 0.17 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 2oyl h ALA 65 CO -0.00 0.25 0.63 0.87 0.00 0.00 0.00 179.25 180.99 2oyl h LYS 66 N 0.00 1.07 -0.00 0.00 1.57 -1.35 -2.94 116.57 114.91 2oyl h LYS 66 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2oyl h LYS 66 Cb 0.46 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2oyl h LYS 66 CO 0.03 0.71 -0.61 -1.13 -0.57 0.00 0.00 179.45 177.88 2oyl n SER 67 N -4.51 1.00 -4.68 0.86 3.41 -1.25 -4.81 113.62 103.66 2oyl n SER 67 Ca 0.15 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.34 2oyl n SER 67 Cb 0.21 0.84 -0.03 0.00 -0.26 0.00 0.00 64.21 64.97 2oyl n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oyl s ALA 68 N -2.28 3.66 0.31 7.33 0.00 -1.11 -4.89 121.76 124.78 2oyl s ALA 68 Ca 0.08 1.14 0.09 0.00 0.00 0.00 0.00 51.96 53.27 2oyl s ALA 68 Cb 0.12 -3.70 0.88 0.00 0.00 0.00 0.00 23.12 20.42 2oyl s ALA 68 CO 0.56 -1.16 1.70 -1.35 0.00 0.00 0.00 175.76 175.51 2oyl h PRO 69 N 8.59 0.42 -0.24 0.00 0.11 -1.92 0.55 132.00 139.52 2oyl h PRO 69 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2oyl h PRO 69 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2oyl h PRO 69 CO 0.93 0.28 0.00 -0.40 -0.21 0.00 0.00 178.00 178.60 2oyl n ASP 70 N -5.00 1.93 0.00 -2.05 5.75 -1.26 -4.92 116.55 111.00 2oyl n ASP 70 Ca 0.26 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.24 2oyl n ASP 70 Cb 0.78 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 2oyl n ASP 70 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oyl n GLY 71 N 1.16 0.68 3.88 6.12 0.00 0.18 -4.97 105.19 112.25 2oyl n GLY 71 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2oyl n GLY 71 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2oyl s MET 72 N -0.26 3.68 0.61 1.61 -1.94 -1.26 -4.83 119.30 116.92 2oyl s MET 72 Ca 0.00 0.03 -0.15 0.00 -1.71 0.00 0.00 55.69 53.86 2oyl s MET 72 Cb 0.00 -2.90 -0.03 0.00 2.01 0.00 0.00 34.83 33.91 2oyl s MET 72 CO 0.00 0.50 1.07 -1.25 -0.01 0.00 0.00 175.02 175.34 2oyl s PRO 73 N -2.33 3.16 -1.28 2.03 0.04 -1.26 -4.10 135.00 131.26 2oyl s PRO 73 Ca 0.38 1.26 -0.19 0.00 0.04 0.00 0.00 61.00 62.49 2oyl s PRO 73 Cb -0.13 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.44 2oyl s PRO 73 CO 0.21 -0.94 1.82 1.04 0.04 0.00 0.00 177.00 179.17 2oyl n GLN 74 N -2.16 2.83 -3.65 4.56 6.02 -1.26 -4.82 117.38 118.89 2oyl n GLN 74 Ca 0.09 -3.04 -0.05 0.00 -0.01 0.00 0.00 57.00 53.99 2oyl n GLN 74 Cb 0.53 -3.51 -0.07 0.00 1.02 0.00 0.00 30.24 28.20 2oyl n GLN 74 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2oyl s PHE 75 N 5.46 -1.06 0.42 1.08 5.36 -1.26 -5.03 117.98 122.95 2oyl s PHE 75 Ca 0.56 1.99 0.08 0.00 -0.96 0.00 0.00 56.93 58.59 2oyl s PHE 75 Cb 0.04 0.59 -0.02 0.00 -0.34 0.00 0.00 43.02 43.29 2oyl s PHE 75 CO 0.08 -0.55 0.37 0.95 -1.46 0.00 0.00 175.22 174.61 2oyl s THR 76 N 2.27 2.58 0.27 0.12 -4.23 -1.26 -4.99 115.64 110.38 2oyl s THR 76 Ca -0.07 -1.37 -0.03 0.00 -1.18 0.00 0.00 61.69 59.04 2oyl s THR 76 Cb -0.09 -2.95 0.18 0.00 1.34 0.00 0.00 72.50 70.98 2oyl s THR 76 CO -0.17 0.00 1.84 -0.08 -0.54 0.00 0.00 174.62 175.67 2oyl h GLU 77 N 1.03 0.98 -0.93 3.99 4.81 -2.00 -2.07 114.58 120.39 2oyl h GLU 77 Ca -0.41 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 58.67 2oyl h GLU 77 Cb 1.27 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 2oyl h GLU 77 CO 0.58 0.80 0.62 0.00 -0.73 0.00 0.00 179.01 180.28 2oyl h ALA 78 N 1.33 1.33 -0.83 2.92 0.00 -1.99 -0.94 119.26 121.08 2oyl h ALA 78 Ca 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2oyl h ALA 78 Cb 0.18 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2oyl h ALA 78 CO -0.02 0.62 0.46 -0.44 0.00 0.00 0.00 179.25 179.87 2oyl h ASP 79 N 1.27 1.04 -0.48 0.00 3.32 -1.78 -1.46 116.42 118.32 2oyl h ASP 79 Ca 0.34 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 2oyl h ASP 79 Cb -0.14 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.13 2oyl h ASP 79 CO -0.07 0.84 0.02 0.25 -1.72 0.00 0.00 179.24 178.55 2oyl h LEU 80 N 1.16 0.81 -0.86 1.55 5.85 -0.80 -1.16 115.31 121.85 2oyl h LEU 80 Ca 0.29 -0.30 0.11 0.00 0.84 0.00 0.00 57.88 58.82 2oyl h LEU 80 Cb 0.03 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 40.76 2oyl h LEU 80 CO -0.05 0.91 0.49 0.00 -0.34 0.00 0.00 178.44 179.45 2oyl h ALA 81 N 0.93 1.25 -0.14 1.25 0.00 -0.89 0.23 119.26 121.89 2oyl h ALA 81 Ca 0.14 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2oyl h ALA 81 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2oyl h ALA 81 CO 0.02 0.08 0.02 -0.09 0.00 0.00 0.00 179.25 179.28 2oyl h ARG 82 N 0.79 0.23 -0.32 0.00 2.43 -0.91 -0.76 114.38 115.84 2oyl h ARG 82 Ca 0.43 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.59 2oyl h ARG 82 Cb 0.44 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 2oyl h ARG 82 CO -0.27 0.42 -0.01 1.49 -1.51 0.00 0.00 179.97 180.09 2oyl h GLU 83 N -0.00 0.08 -0.43 0.20 4.81 -0.67 -0.28 114.58 118.30 2oyl h GLU 83 Ca 0.04 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 2oyl h GLU 83 Cb 0.31 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2oyl h GLU 83 CO 0.00 0.05 0.11 -0.92 -0.73 0.00 0.00 179.01 177.52 2oyl h TYR 84 N 0.08 0.71 -0.63 0.92 3.20 -0.90 -0.11 116.97 120.23 2oyl h TYR 84 Ca 0.15 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 2oyl h TYR 84 Cb 0.21 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 2oyl h TYR 84 CO -0.24 0.67 0.30 0.00 -1.64 0.00 0.00 178.16 177.24 2oyl h ALA 85 N 0.96 1.34 0.00 1.82 0.00 -0.88 0.19 119.26 122.68 2oyl h ALA 85 Ca 0.13 -0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 2oyl h ALA 85 Cb 0.31 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2oyl h ALA 85 CO 0.00 0.51 -1.47 -0.44 0.00 0.00 0.00 179.25 177.85 2oyl h ASP 86 N 0.89 0.00 0.00 0.00 3.32 -0.81 -3.42 116.42 116.40 2oyl h ASP 86 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2oyl h ASP 86 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2oyl h ASP 86 CO -0.03 0.99 -0.07 0.23 -1.72 0.00 0.00 179.24 178.65 2oyl n MET 87 N -3.14 2.85 -2.80 3.56 2.81 -0.08 -4.73 117.12 115.60 2oyl n MET 87 Ca -0.11 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.56 2oyl n MET 87 Cb 1.01 -0.28 0.02 0.00 -0.71 0.00 0.00 33.22 33.26 2oyl n MET 87 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oyl n GLY 88 N 0.48 -0.51 3.73 3.03 0.00 0.05 -4.65 105.19 107.32 2oyl n GLY 88 Ca 0.00 0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 2oyl n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2oyl s THR 89 N -3.08 2.59 -0.01 2.61 -4.23 -1.26 -4.98 115.64 107.27 2oyl s THR 89 Ca 0.19 0.27 0.02 0.00 -1.18 0.00 0.00 61.69 60.98 2oyl s THR 89 Cb -0.09 -2.76 0.03 0.00 1.34 0.00 0.00 72.50 71.02 2oyl s THR 89 CO 0.23 -0.17 0.77 -0.46 -0.54 0.00 0.00 174.62 174.44 2oyl n ASN 90 N -2.84 0.69 -3.89 3.99 6.94 -0.25 -4.86 115.26 115.03 2oyl n ASN 90 Ca 0.12 -1.60 -0.11 0.00 -0.02 0.00 0.00 54.58 52.98 2oyl n ASN 90 Cb 0.51 -0.07 -0.10 0.00 -2.36 0.00 0.00 39.78 37.76 2oyl n ASN 90 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 2oyl s PHE 91 N -0.49 0.09 -0.06 -2.53 5.36 -1.03 -0.78 117.98 118.54 2oyl s PHE 91 Ca 0.03 -0.24 -0.05 0.00 -0.96 0.00 0.00 56.93 55.72 2oyl s PHE 91 Cb 0.02 -0.08 0.02 0.00 -0.34 0.00 0.00 43.02 42.65 2oyl s PHE 91 CO 0.00 -0.29 0.14 0.54 -1.46 0.00 0.00 175.22 174.16 2oyl s VAL 92 N -1.58 -0.01 -0.55 3.12 0.11 -0.77 -3.57 120.40 117.14 2oyl s VAL 92 Ca -0.14 0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 58.76 2oyl s VAL 92 Cb -0.07 -0.21 0.09 0.00 -1.53 0.00 0.00 36.38 34.66 2oyl s VAL 92 CO 0.00 0.01 0.62 -0.60 -3.33 0.00 0.00 175.10 171.81 2oyl s ARG 93 N 0.28 3.05 -0.26 1.54 3.52 -0.37 -0.46 118.95 126.24 2oyl s ARG 93 Ca -0.02 -1.26 -0.14 0.00 -0.13 0.00 0.00 55.73 54.18 2oyl s ARG 93 Cb -0.03 -4.21 -0.04 0.00 -1.56 0.00 0.00 34.95 29.11 2oyl s ARG 93 CO -0.01 -1.37 0.35 0.12 -0.81 0.00 0.00 175.30 173.58 2oyl s PHE 94 N 2.42 3.26 -0.13 5.12 5.36 0.50 -1.49 117.98 133.02 2oyl s PHE 94 Ca 0.11 0.39 -0.29 0.00 -0.96 0.00 0.00 56.93 56.17 2oyl s PHE 94 Cb -0.24 -2.53 -0.02 0.00 -0.34 0.00 0.00 43.02 39.89 2oyl s PHE 94 CO 0.07 -0.18 1.25 -0.51 -1.46 0.00 0.00 175.22 174.39 2oyl s LEU 95 N 1.91 4.21 0.50 6.12 1.02 -0.83 -1.08 118.68 130.54 2oyl s LEU 95 Ca 0.14 1.74 0.03 0.00 0.02 0.00 0.00 54.13 56.07 2oyl s LEU 95 Cb -0.16 -3.54 -0.01 0.00 0.02 0.00 0.00 46.19 42.50 2oyl s LEU 95 CO 0.10 -0.71 0.13 0.27 0.02 0.00 0.00 176.35 176.15 2oyl s ILE 96 N 3.13 1.47 -0.08 -0.59 -4.36 0.10 -4.79 121.20 116.08 2oyl s ILE 96 Ca 0.55 -1.83 -0.11 0.00 -0.26 0.00 0.00 60.65 59.01 2oyl s ILE 96 Cb -0.23 -2.30 0.03 0.00 1.25 0.00 0.00 42.46 41.21 2oyl s ILE 96 CO 0.17 0.00 0.28 -0.94 0.24 0.00 0.00 174.94 174.70 2oyl s SER 97 N -3.98 -0.26 0.22 4.36 1.04 -1.26 -1.49 113.70 112.33 2oyl s SER 97 Ca 0.19 0.43 -0.08 0.00 0.48 0.00 0.00 55.95 56.97 2oyl s SER 97 Cb 0.01 0.51 0.19 0.00 0.10 0.00 0.00 66.02 66.83 2oyl s SER 97 CO 0.11 -0.19 1.86 -0.25 0.98 0.00 0.00 173.24 175.75 2oyl h TRP 98 N 5.22 1.12 -0.46 5.02 7.01 -1.81 -1.08 115.95 130.97 2oyl h TRP 98 Ca -0.27 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 60.81 2oyl h TRP 98 Cb 1.19 -0.37 -0.02 0.00 -2.10 0.00 0.00 29.16 27.86 2oyl h TRP 98 CO 0.44 0.75 0.31 0.07 -2.79 0.00 0.00 178.44 177.22 2oyl h ARG 99 N 1.16 0.24 0.14 2.65 -0.00 -1.01 0.26 114.38 117.83 2oyl h ARG 99 Ca 0.30 -0.01 -0.32 0.00 -0.00 0.00 0.00 59.98 59.95 2oyl h ARG 99 Cb -0.03 -0.05 -0.00 0.00 -0.00 0.00 0.00 29.97 29.88 2oyl h ARG 99 CO -0.06 0.16 -1.58 0.77 -0.00 0.00 0.00 179.97 179.27 2oyl h SER 100 N 0.25 0.47 -0.25 0.08 0.02 -1.60 -3.17 113.55 109.35 2oyl h SER 100 Ca 0.21 -0.65 -0.06 0.00 -0.84 0.00 0.00 61.79 60.45 2oyl h SER 100 Cb 0.50 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 2oyl h SER 100 CO -0.04 1.54 -0.09 0.58 -1.14 0.00 0.00 176.83 177.68 2oyl h VAL 101 N 0.08 1.29 -2.28 2.27 2.07 -0.81 -3.40 116.25 115.48 2oyl h VAL 101 Ca -0.27 -1.14 -0.59 0.00 0.82 0.00 0.00 66.70 65.53 2oyl h VAL 101 Cb 2.04 1.52 -0.40 0.00 -1.52 0.00 0.00 31.29 32.93 2oyl h VAL 101 CO 0.17 0.35 -0.81 1.21 0.02 0.00 0.00 177.57 178.52 2oyl n GLU 102 N -4.52 1.53 0.29 1.57 2.13 0.04 -0.94 120.64 120.74 2oyl n GLU 102 Ca -0.04 -3.97 0.17 0.00 0.66 0.00 0.00 57.16 53.98 2oyl n GLU 102 Cb 0.32 -1.84 0.87 0.00 0.27 0.00 0.00 31.44 31.07 2oyl n GLU 102 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 2oyl h PRO 103 N 4.48 0.00 -4.20 5.31 0.13 -1.62 -3.43 132.00 132.67 2oyl h PRO 103 Ca 0.16 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.09 2oyl h PRO 103 Cb 0.78 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.71 2oyl h PRO 103 CO 0.64 0.05 -0.71 0.00 -0.23 0.00 0.00 178.00 177.75 2oyl s ALA 104 N -4.04 0.33 -0.08 -0.56 0.00 -1.25 -4.88 121.76 111.29 2oyl s ALA 104 Ca -0.02 -0.76 -0.36 0.00 0.00 0.00 0.00 51.96 50.82 2oyl s ALA 104 Cb 0.12 0.14 -0.13 0.00 0.00 0.00 0.00 23.12 23.24 2oyl s ALA 104 CO 0.52 -0.15 1.76 -2.30 0.00 0.00 0.00 175.76 175.59 2oyl n PRO 105 N 1.29 1.88 -0.95 0.00 -0.02 -1.26 -1.58 135.00 134.37 2oyl n PRO 105 Ca -0.22 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2oyl n PRO 105 Cb 0.56 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2oyl n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oyl n GLY 106 N 4.07 0.53 3.09 -1.23 0.00 -1.26 -4.99 105.19 105.39 2oyl n GLY 106 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 2oyl n GLY 106 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oyl s VAL 107 N -2.38 2.17 -0.10 1.61 1.01 -0.61 -5.11 120.40 116.99 2oyl s VAL 107 Ca 0.00 -1.45 -0.07 0.00 0.00 0.00 0.00 61.98 60.46 2oyl s VAL 107 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2oyl s VAL 107 CO 0.00 0.11 0.17 -0.31 0.00 0.00 0.00 175.10 175.07 2oyl s TYR 108 N 1.15 3.61 -0.65 5.22 2.02 -1.26 -3.66 117.35 123.77 2oyl s TYR 108 Ca -0.05 0.56 -0.21 0.00 -0.37 0.00 0.00 57.07 57.00 2oyl s TYR 108 Cb -0.18 -1.96 0.09 0.00 -0.40 0.00 0.00 41.96 39.50 2oyl s TYR 108 CO -0.07 0.72 0.88 0.34 -1.57 0.00 0.00 175.55 175.85 2oyl s ASP 109 N -1.11 6.21 0.48 2.29 -1.08 -0.12 -4.88 116.67 118.46 2oyl s ASP 109 Ca 0.17 -1.24 0.27 0.00 -0.52 0.00 0.00 52.55 51.23 2oyl s ASP 109 Cb -0.12 -2.37 1.07 0.00 -1.46 0.00 0.00 42.92 40.04 2oyl s ASP 109 CO 0.06 -1.29 1.88 1.56 0.52 0.00 0.00 175.17 177.90 2oyl h GLN 110 N 9.37 0.00 -0.09 4.34 1.08 -1.93 -2.48 115.11 125.40 2oyl h GLN 110 Ca -0.26 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 56.76 2oyl h GLN 110 Cb 1.07 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.50 2oyl h GLN 110 CO 1.14 0.16 -0.72 1.96 -0.95 0.00 0.00 178.83 180.42 2oyl h GLN 111 N 0.00 0.44 -0.27 1.46 7.50 -1.98 -0.12 115.11 122.15 2oyl h GLN 111 Ca -0.00 -0.36 -0.02 0.00 0.50 0.00 0.00 58.65 58.78 2oyl h GLN 111 Cb 0.66 0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.25 2oyl h GLN 111 CO 0.02 0.99 0.11 -0.92 -1.50 0.00 0.00 178.83 177.52 2oyl h TYR 112 N 0.31 0.41 -0.24 2.96 3.20 -1.80 -2.28 116.97 119.53 2oyl h TYR 112 Ca -0.03 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.79 2oyl h TYR 112 Cb 1.29 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.43 2oyl h TYR 112 CO 0.05 0.41 0.04 -0.07 -1.64 0.00 0.00 178.16 176.96 2oyl h LEU 113 N 0.28 0.31 -0.55 2.82 3.38 -1.33 -0.72 115.31 119.50 2oyl h LEU 113 Ca 0.09 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.06 2oyl h LEU 113 Cb 0.18 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2oyl h LEU 113 CO -0.01 0.34 0.31 0.44 0.09 0.00 0.00 178.44 179.61 2oyl h ASP 114 N 0.34 0.48 -0.42 -0.43 3.32 -0.75 0.43 116.42 119.40 2oyl h ASP 114 Ca 0.08 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 2oyl h ASP 114 Cb 0.16 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 2oyl h ASP 114 CO -0.00 0.33 0.06 0.03 -1.72 0.00 0.00 179.24 177.94 2oyl h ARG 115 N 0.61 0.71 -0.33 3.56 3.08 -0.60 0.16 114.38 121.57 2oyl h ARG 115 Ca 0.23 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2oyl h ARG 115 Cb 0.09 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2oyl h ARG 115 CO -0.13 0.75 0.21 0.28 -1.07 0.00 0.00 179.97 180.01 2oyl h VAL 116 N 0.56 1.08 -1.00 2.04 2.07 -1.11 -1.99 116.25 117.90 2oyl h VAL 116 Ca 0.13 -0.15 0.05 0.00 0.82 0.00 0.00 66.70 67.54 2oyl h VAL 116 Cb 0.39 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 2oyl h VAL 116 CO 0.01 0.08 0.65 -0.08 0.02 0.00 0.00 177.57 178.25 2oyl h GLU 117 N 0.44 1.20 -0.29 1.57 4.81 -0.60 0.04 114.58 121.75 2oyl h GLU 117 Ca 0.12 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2oyl h GLU 117 Cb -0.05 -0.27 -0.03 0.00 0.63 0.00 0.00 28.75 29.03 2oyl h GLU 117 CO -0.03 0.80 0.12 -0.44 -0.73 0.00 0.00 179.01 178.73 2oyl h ASP 118 N 1.24 0.16 -0.26 1.04 3.32 -0.55 -0.82 116.42 120.54 2oyl h ASP 118 Ca 0.41 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.46 2oyl h ASP 118 Cb 0.05 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2oyl h ASP 118 CO -0.14 0.13 0.10 0.03 -1.72 0.00 0.00 179.24 177.64 2oyl h ARG 119 N 0.26 0.40 -0.93 3.56 -0.00 -0.66 -2.51 114.38 114.50 2oyl h ARG 119 Ca 0.12 -0.08 0.13 0.00 -0.50 0.00 0.00 59.98 59.65 2oyl h ARG 119 Cb 0.07 -0.06 -0.07 0.00 0.00 0.00 0.00 29.97 29.90 2oyl h ARG 119 CO -0.11 0.44 0.59 0.28 0.00 0.00 0.00 179.97 181.18 2oyl h VAL 120 N 0.27 0.89 -0.89 2.04 2.07 -0.86 -0.51 116.25 119.26 2oyl h VAL 120 Ca 0.09 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.39 2oyl h VAL 120 Cb 0.20 -0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 29.90 2oyl h VAL 120 CO -0.01 0.15 0.58 1.23 0.02 0.00 0.00 177.57 179.55 2oyl h GLY 121 N 0.83 1.30 0.98 2.17 0.00 -0.71 0.99 103.07 108.63 2oyl h GLY 121 Ca 0.46 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 2oyl h GLY 121 CO -0.22 0.30 0.27 1.49 0.00 0.00 0.00 176.54 178.37 2oyl h TRP 122 N 1.01 0.60 -0.31 5.60 6.55 -0.89 -1.10 115.95 127.41 2oyl h TRP 122 Ca 0.38 -0.00 -0.02 0.00 0.95 0.00 0.00 58.89 60.20 2oyl h TRP 122 Cb 0.20 -0.20 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 2oyl h TRP 122 CO -0.00 0.43 0.10 1.88 -1.05 0.00 0.00 178.44 179.79 2oyl h TYR 123 N 0.60 0.49 -0.70 0.49 0.05 -1.18 -3.07 116.97 113.65 2oyl h TYR 123 Ca 0.16 -0.05 0.08 0.00 0.05 0.00 0.00 58.73 58.97 2oyl h TYR 123 Cb 0.01 -0.14 -0.07 0.00 1.01 0.00 0.00 36.73 37.54 2oyl h TYR 123 CO -0.03 0.50 0.36 0.00 -1.05 0.00 0.00 178.16 177.94 2oyl h ALA 124 N 0.93 0.95 0.00 3.88 0.00 -0.62 -1.16 119.26 123.25 2oyl h ALA 124 Ca 0.10 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2oyl h ALA 124 Cb 0.24 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2oyl h ALA 124 CO -0.00 -0.01 -0.01 1.49 0.00 0.00 0.00 179.25 180.72 2oyl h GLU 125 N 0.63 0.00 -0.48 0.00 4.81 -1.11 -2.15 114.58 116.29 2oyl h GLU 125 Ca 0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 2oyl h GLU 125 Cb 0.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2oyl h GLU 125 CO -0.24 0.01 0.00 0.54 -0.73 0.00 0.00 179.01 178.59 2oyl n ARG 126 N -4.43 3.30 -1.15 1.92 1.74 -0.74 -4.96 116.66 112.35 2oyl n ARG 126 Ca -0.03 -2.65 -0.01 0.00 -0.77 0.00 0.00 57.85 54.39 2oyl n ARG 126 Cb 0.10 -1.71 -0.00 0.00 -1.02 0.00 0.00 32.46 29.83 2oyl n ARG 126 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oyl n GLY 127 N 0.60 0.46 3.84 -0.13 0.00 -0.81 -5.02 105.19 104.14 2oyl n GLY 127 Ca 0.21 -1.01 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 2oyl n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oyl s TYR 128 N -2.05 3.42 0.01 1.61 1.51 -0.52 -4.91 117.35 116.44 2oyl s TYR 128 Ca 0.00 1.42 0.00 0.00 -1.01 0.00 0.00 57.07 57.48 2oyl s TYR 128 Cb 0.00 -2.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.07 2oyl s TYR 128 CO 0.00 -0.25 0.09 0.15 -1.11 0.00 0.00 175.55 174.42 2oyl s LYS 129 N -3.80 3.05 -0.10 -0.62 -0.14 0.04 -4.40 119.74 113.77 2oyl s LYS 129 Ca 0.58 -0.52 0.03 0.00 -1.36 0.00 0.00 55.97 54.70 2oyl s LYS 129 Cb -0.10 -2.85 -0.00 0.00 -1.68 0.00 0.00 37.83 33.20 2oyl s LYS 129 CO 0.27 0.63 -0.22 0.08 -0.76 0.00 0.00 175.35 175.35 2oyl s VAL 130 N -1.25 2.28 -0.27 3.17 1.01 0.35 -1.86 120.40 123.83 2oyl s VAL 130 Ca 0.25 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.21 2oyl s VAL 130 Cb -0.12 -1.89 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 2oyl s VAL 130 CO 0.16 0.55 0.07 -0.32 0.00 0.00 0.00 175.10 175.57 2oyl s MET 131 N 0.28 3.37 -0.15 2.72 1.75 0.39 -1.44 119.30 126.22 2oyl s MET 131 Ca -0.15 -0.67 -0.26 0.00 -1.25 0.00 0.00 55.69 53.36 2oyl s MET 131 Cb -0.17 -3.34 -0.02 0.00 2.84 0.00 0.00 34.83 34.14 2oyl s MET 131 CO 0.08 -0.32 0.85 -0.51 -0.65 0.00 0.00 175.02 174.47 2oyl s LEU 132 N 1.56 4.20 -0.31 4.11 1.43 -0.50 -0.37 118.68 128.80 2oyl s LEU 132 Ca 0.05 1.24 -0.06 0.00 -1.03 0.00 0.00 54.13 54.33 2oyl s LEU 132 Cb -0.16 -3.28 0.03 0.00 0.03 0.00 0.00 46.19 42.81 2oyl s LEU 132 CO 0.03 -0.38 0.06 -0.62 0.23 0.00 0.00 176.35 175.67 2oyl s ASP 133 N 1.11 5.07 -0.93 2.29 2.15 -0.24 -0.18 116.67 125.95 2oyl s ASP 133 Ca 0.40 -0.93 -0.24 0.00 0.43 0.00 0.00 52.55 52.21 2oyl s ASP 133 Cb -0.17 -1.84 0.02 0.00 -0.30 0.00 0.00 42.92 40.63 2oyl s ASP 133 CO 0.14 -0.24 1.60 -0.32 -0.17 0.00 0.00 175.17 176.18 2oyl s MET 134 N 1.42 3.18 -0.02 4.34 -2.45 -0.89 -0.72 119.30 124.18 2oyl s MET 134 Ca 0.00 -0.67 -0.15 0.00 -1.25 0.00 0.00 55.69 53.62 2oyl s MET 134 Cb -0.18 -5.08 -0.06 0.00 1.25 0.00 0.00 34.83 30.77 2oyl s MET 134 CO 0.01 -2.57 0.41 -1.58 1.05 0.00 0.00 175.02 172.34 2oyl s HIS 135 N 6.80 3.70 0.03 4.11 2.46 -0.55 -2.24 115.29 129.59 2oyl s HIS 135 Ca 0.53 0.98 -0.05 0.00 0.47 0.00 0.00 55.06 56.99 2oyl s HIS 135 Cb -0.04 -2.32 -0.01 0.00 -0.13 0.00 0.00 32.58 30.08 2oyl s HIS 135 CO -0.03 0.58 0.08 1.14 -2.47 0.00 0.00 174.74 174.05 2oyl s GLN 136 N -0.86 0.55 -0.03 2.88 1.03 -1.26 -4.20 119.66 117.77 2oyl s GLN 136 Ca 0.24 -0.71 0.00 0.00 0.04 0.00 0.00 55.36 54.93 2oyl s GLN 136 Cb -0.16 0.21 0.03 0.00 0.03 0.00 0.00 33.01 33.12 2oyl s GLN 136 CO 0.13 -0.13 0.02 -0.51 -2.54 0.00 0.00 175.29 172.25 2oyl s ASP 137 N -1.98 0.37 -1.44 12.60 1.11 -0.64 -4.75 116.67 121.94 2oyl s ASP 137 Ca -0.07 0.00 -0.11 0.00 0.18 0.00 0.00 52.55 52.55 2oyl s ASP 137 Cb -0.03 -0.17 0.05 0.00 1.07 0.00 0.00 42.92 43.85 2oyl s ASP 137 CO -0.04 -0.12 1.08 0.52 1.18 0.00 0.00 175.17 177.80 2oyl n VAL 138 N 4.26 -2.56 0.00 -1.27 0.31 -1.26 -1.18 118.33 116.63 2oyl n VAL 138 Ca -0.25 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2oyl n VAL 138 Cb 0.50 -3.43 0.00 0.00 -0.91 0.00 0.00 33.84 30.00 2oyl n VAL 138 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oyl n TYR 139 N -4.84 0.00 -3.53 3.52 9.36 -1.26 -4.54 117.16 115.88 2oyl n TYR 139 Ca 0.02 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.13 2oyl n TYR 139 Cb 0.54 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.22 2oyl n TYR 139 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2oyl s SER 140 N 0.00 -0.44 0.62 2.98 0.15 -1.20 -0.66 113.70 115.16 2oyl s SER 140 Ca 0.00 0.29 0.36 0.00 0.70 0.00 0.00 55.95 57.30 2oyl s SER 140 Cb 0.00 0.40 2.06 0.00 -1.71 0.00 0.00 66.02 66.77 2oyl s SER 140 CO 0.00 -0.55 2.29 1.23 1.20 0.00 0.00 173.24 177.42 2oyl h GLY 141 N 2.40 0.00 0.61 9.45 0.00 -1.75 -3.12 103.07 110.66 2oyl h GLY 141 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2oyl h GLY 141 CO 0.33 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.87 2oyl n ALA 142 N -2.21 2.43 0.25 3.60 0.00 -1.26 -3.78 120.51 119.55 2oyl n ALA 142 Ca -0.03 -0.10 0.15 0.00 0.00 0.00 0.00 53.44 53.46 2oyl n ALA 142 Cb 0.09 -1.26 0.51 0.00 0.00 0.00 0.00 19.45 18.79 2oyl n ALA 142 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2oyl h ILE 143 N 0.00 0.07 -3.96 0.00 3.07 -1.87 -3.43 117.51 111.39 2oyl h ILE 143 Ca 0.00 -0.73 -0.25 0.00 1.55 0.00 0.00 64.86 65.42 2oyl h ILE 143 Cb 0.00 1.69 -0.22 0.00 -0.27 0.00 0.00 36.82 38.02 2oyl h ILE 143 CO 0.00 0.03 -0.73 0.42 -1.05 0.00 0.00 178.15 176.82 2oyl s THR 144 N -3.53 0.41 -0.45 0.16 -4.23 -1.25 -4.75 115.64 102.01 2oyl s THR 144 Ca 0.03 -0.93 -0.22 0.00 -1.18 0.00 0.00 61.69 59.38 2oyl s THR 144 Cb 0.08 -0.49 -0.22 0.00 1.34 0.00 0.00 72.50 73.21 2oyl s THR 144 CO 0.59 -0.35 1.76 -2.65 -0.54 0.00 0.00 174.62 173.42 2oyl n PRO 145 N 1.67 0.90 0.00 3.99 -0.02 -1.26 -4.93 135.00 135.34 2oyl n PRO 145 Ca -0.22 -1.41 0.00 0.00 -2.02 0.00 0.00 63.50 59.85 2oyl n PRO 145 Cb 0.55 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 2oyl n PRO 145 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oyl n ALA 155 N 7.60 0.00 -0.09 3.55 0.00 -1.25 -5.13 120.51 125.18 2oyl n ALA 155 Ca 0.45 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.80 2oyl n ALA 155 Cb 0.36 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 2oyl n ALA 155 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2oyl n ILE 156 N 0.00 1.48 -2.25 0.00 2.08 -1.26 -5.02 119.36 114.39 2oyl n ILE 156 Ca 0.00 0.13 -0.18 0.00 0.56 0.00 0.00 62.75 63.26 2oyl n ILE 156 Cb 0.00 -2.33 0.10 0.00 -0.75 0.00 0.00 39.64 36.66 2oyl n ILE 156 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2oyl n GLY 157 N 1.48 0.07 3.48 7.39 0.00 -1.24 -4.95 105.19 111.42 2oyl n GLY 157 Ca -0.15 -1.92 -0.14 0.00 0.00 0.00 0.00 46.02 43.81 2oyl n GLY 157 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oyl s ASN 158 N -4.04 -0.58 0.00 1.61 2.20 -0.33 -2.92 114.94 110.88 2oyl s ASN 158 Ca 0.49 0.34 0.00 0.00 -0.94 0.00 0.00 52.86 52.75 2oyl s ASN 158 Cb -0.02 0.54 0.00 0.00 -2.00 0.00 0.00 41.25 39.77 2oyl s ASN 158 CO 0.33 -0.75 0.00 0.61 -2.94 0.00 0.00 177.10 174.35 2oyl n GLY 159 N 0.27 1.52 3.78 0.45 0.00 -1.25 -1.61 105.19 108.35 2oyl n GLY 159 Ca -0.17 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 2oyl n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyl s ALA 160 N -1.31 2.94 0.77 4.61 0.00 0.17 -0.45 121.76 128.48 2oyl s ALA 160 Ca 0.00 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.58 2oyl s ALA 160 Cb 0.00 -3.30 0.05 0.00 0.00 0.00 0.00 23.12 19.88 2oyl s ALA 160 CO 0.00 -0.39 1.09 -1.25 0.00 0.00 0.00 175.76 175.20 2oyl s PRO 161 N -2.90 2.31 0.27 0.00 0.04 -1.26 -4.45 135.00 129.01 2oyl s PRO 161 Ca 0.64 1.13 -0.02 0.00 0.04 0.00 0.00 61.00 62.80 2oyl s PRO 161 Cb -0.21 -1.91 0.43 0.00 0.04 0.00 0.00 34.50 32.85 2oyl s PRO 161 CO 0.26 -1.59 1.87 0.00 0.04 0.00 0.00 177.00 177.57 2oyl h ALA 162 N -1.09 1.40 0.00 8.56 0.00 -1.94 -1.45 119.26 124.73 2oyl h ALA 162 Ca -0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 2oyl h ALA 162 Cb 1.23 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2oyl h ALA 162 CO 0.52 0.38 -0.03 0.11 0.00 0.00 0.00 179.25 180.23 2oyl h TRP 163 N 1.12 0.00 -0.07 0.00 5.08 -1.92 -1.45 115.95 118.70 2oyl h TRP 163 Ca 0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.41 2oyl h TRP 163 Cb 0.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.40 2oyl h TRP 163 CO -0.01 0.03 0.00 0.00 -1.28 0.00 0.00 178.44 177.18 2oyl n ALA 164 N -2.29 2.53 -2.96 0.11 0.00 -0.55 -4.85 120.51 112.49 2oyl n ALA 164 Ca -0.03 -0.54 -0.41 0.00 0.00 0.00 0.00 53.44 52.46 2oyl n ALA 164 Cb 0.12 -1.06 -0.10 0.00 0.00 0.00 0.00 19.45 18.40 2oyl n ALA 164 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2oyl s THR 165 N -1.93 4.53 -0.45 0.00 2.01 -0.55 -4.88 115.64 114.38 2oyl s THR 165 Ca 0.35 -1.05 0.03 0.00 0.31 0.00 0.00 61.69 61.34 2oyl s THR 165 Cb 0.20 -3.62 0.12 0.00 0.01 0.00 0.00 72.50 69.21 2oyl s THR 165 CO 0.31 -0.35 0.19 -0.31 -0.69 0.00 0.00 174.62 173.77 2oyl s TYR 166 N 1.52 3.46 -1.06 4.92 2.02 -1.26 -4.91 117.35 122.04 2oyl s TYR 166 Ca 0.02 -3.03 0.24 0.00 -0.37 0.00 0.00 57.07 53.93 2oyl s TYR 166 Cb -0.21 -2.92 0.37 0.00 -0.40 0.00 0.00 41.96 38.80 2oyl s TYR 166 CO 0.05 -0.84 1.32 -1.33 -1.57 0.00 0.00 175.55 173.18 2oyl n MET 167 N 3.67 0.07 -3.46 -0.62 2.81 -1.26 -3.16 117.12 115.17 2oyl n MET 167 Ca 0.04 -0.05 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 2oyl n MET 167 Cb 0.37 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.41 2oyl n MET 167 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2oyl n ASP 168 N -1.42 -5.13 0.00 7.83 8.00 -1.26 -1.50 116.55 123.07 2oyl n ASP 168 Ca 0.06 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 55.06 2oyl n ASP 168 Cb 0.34 -4.13 0.00 0.00 -0.02 0.00 0.00 41.12 37.31 2oyl n ASP 168 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oyl n GLY 169 N -1.54 0.67 3.77 0.44 0.00 -1.26 -5.01 105.19 102.26 2oyl n GLY 169 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2oyl n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oyl s LEU 170 N 0.00 4.26 0.59 0.99 1.43 -0.56 -4.99 118.68 120.40 2oyl s LEU 170 Ca 0.00 2.09 -0.17 0.00 -1.03 0.00 0.00 54.13 55.02 2oyl s LEU 170 Cb 0.00 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.16 2oyl s LEU 170 CO 0.00 -0.38 1.10 -2.16 0.23 0.00 0.00 176.35 175.14 2oyl s PRO 171 N -2.19 3.22 -0.44 1.29 0.04 -1.26 -3.67 135.00 131.99 2oyl s PRO 171 Ca 0.54 1.42 0.03 0.00 0.04 0.00 0.00 61.00 63.02 2oyl s PRO 171 Cb -0.25 -2.00 0.15 0.00 0.04 0.00 0.00 34.50 32.44 2oyl s PRO 171 CO 0.31 -0.92 0.30 0.08 0.04 0.00 0.00 177.00 176.81 2oyl s VAL 172 N -2.13 0.84 0.36 -0.36 1.01 -1.26 -0.89 120.40 117.96 2oyl s VAL 172 Ca 0.68 -2.56 -0.19 0.00 0.00 0.00 0.00 61.98 59.91 2oyl s VAL 172 Cb -0.20 -1.59 -0.10 0.00 0.00 0.00 0.00 36.38 34.49 2oyl s VAL 172 CO 0.33 -1.06 0.84 -1.61 0.00 0.00 0.00 175.10 173.60 2oyl s GLU 173 N 0.23 4.17 0.28 2.72 0.41 -1.26 -4.95 118.70 120.30 2oyl s GLU 173 Ca 0.24 0.93 -0.30 0.00 -0.41 0.00 0.00 54.97 55.43 2oyl s GLU 173 Cb -0.11 -2.41 -0.13 0.00 -1.78 0.00 0.00 34.13 29.70 2oyl s GLU 173 CO -0.09 0.12 1.37 -2.30 -0.49 0.00 0.00 175.26 173.87 2oyl n PRO 174 N -0.28 2.12 -4.36 0.39 -0.02 -1.26 -4.97 135.00 126.62 2oyl n PRO 174 Ca 0.04 0.75 -0.23 0.00 -2.02 0.00 0.00 63.50 62.04 2oyl n PRO 174 Cb 0.53 -2.38 -0.11 0.00 -0.02 0.00 0.00 33.50 31.51 2oyl n PRO 174 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2oyl s GLN 175 N -1.00 1.34 0.19 -0.52 -1.52 -1.26 -5.05 119.66 111.84 2oyl s GLN 175 Ca 0.63 -1.44 0.21 0.00 -1.95 0.00 0.00 55.36 52.81 2oyl s GLN 175 Cb -0.61 -1.47 0.88 0.00 -0.22 0.00 0.00 33.01 31.60 2oyl s GLN 175 CO 0.55 0.30 1.65 -0.35 -0.25 0.00 0.00 175.29 177.18 2oyl n PRO 176 N 0.27 0.14 -3.84 2.91 -0.04 -1.26 -4.68 135.00 128.50 2oyl n PRO 176 Ca -0.13 0.37 -0.12 0.00 -0.04 0.00 0.00 63.50 63.58 2oyl n PRO 176 Cb 0.57 -1.77 -0.12 0.00 -0.04 0.00 0.00 33.50 32.14 2oyl n PRO 176 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2oyl s ARG 177 N -3.23 0.24 0.34 0.54 0.52 -1.26 -5.06 118.95 111.04 2oyl s ARG 177 Ca 0.05 0.03 0.06 0.00 -0.52 0.00 0.00 55.73 55.35 2oyl s ARG 177 Cb 0.09 0.11 0.74 0.00 0.52 0.00 0.00 34.95 36.41 2oyl s ARG 177 CO 0.36 -0.04 1.89 0.11 0.02 0.00 0.00 175.30 177.64 2oyl h TRP 178 N 5.52 0.88 -0.19 -0.53 5.08 -2.00 -1.93 115.95 122.77 2oyl h TRP 178 Ca -0.27 0.02 0.01 0.00 1.08 0.00 0.00 58.89 59.74 2oyl h TRP 178 Cb 1.20 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 27.07 2oyl h TRP 178 CO 0.46 0.37 0.13 0.93 -1.28 0.00 0.00 178.44 179.05 2oyl h GLU 179 N 0.78 0.23 0.00 0.12 3.07 -1.97 -1.86 114.58 114.95 2oyl h GLU 179 Ca 0.42 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 2oyl h GLU 179 Cb 0.55 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2oyl h GLU 179 CO -0.19 0.15 0.00 -0.07 -1.40 0.00 0.00 179.01 177.50 2oyl h LEU 180 N 0.24 0.00 -1.95 1.33 3.38 -1.75 -2.53 115.31 114.02 2oyl h LEU 180 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2oyl h LEU 180 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2oyl h LEU 180 CO -0.02 0.00 -0.11 1.88 0.09 0.00 0.00 178.44 180.29 2oyl h TYR 181 N 0.00 0.00 -0.86 1.13 -1.99 -1.45 -2.98 116.97 110.82 2oyl h TYR 181 Ca 0.00 0.00 0.17 0.00 2.00 0.00 0.00 58.73 60.90 2oyl h TYR 181 Cb 0.39 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.06 2oyl h TYR 181 CO 0.00 0.11 0.56 1.88 -0.00 0.00 0.00 178.16 180.71 2oyl h TYR 182 N 0.00 0.61 -0.34 4.88 0.05 -1.63 -2.49 116.97 118.05 2oyl h TYR 182 Ca -0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 2oyl h TYR 182 Cb 0.24 -0.19 0.00 0.00 1.01 0.00 0.00 36.73 37.79 2oyl h TYR 182 CO 0.00 0.20 0.00 0.44 -1.05 0.00 0.00 178.16 177.75 2oyl n ILE 183 N -4.52 0.44 -2.26 -2.88 -5.35 -1.12 -3.85 119.36 99.81 2oyl n ILE 183 Ca 0.17 -0.66 -0.37 0.00 -0.27 0.00 0.00 62.75 61.63 2oyl n ILE 183 Cb 0.59 0.86 -0.01 0.00 -1.74 0.00 0.00 39.64 39.34 2oyl n ILE 183 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2oyl s GLN 184 N -1.56 3.70 0.25 6.28 -1.52 -0.94 -4.80 119.66 121.07 2oyl s GLN 184 Ca 0.37 1.75 -0.04 0.00 -1.95 0.00 0.00 55.36 55.49 2oyl s GLN 184 Cb 0.22 -2.35 0.46 0.00 -0.22 0.00 0.00 33.01 31.11 2oyl s GLN 184 CO 0.30 -0.59 1.76 -1.35 -0.25 0.00 0.00 175.29 175.16 2oyl h PRO 185 N 1.92 0.56 -0.49 2.91 0.11 -1.88 -0.08 132.00 135.04 2oyl h PRO 185 Ca -0.49 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.50 2oyl h PRO 185 Cb 1.25 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2oyl h PRO 185 CO 0.60 0.37 -0.01 0.78 -0.21 0.00 0.00 178.00 179.53 2oyl h GLY 186 N 0.58 0.90 0.88 -0.55 0.00 -1.09 -1.38 103.07 102.40 2oyl h GLY 186 Ca 0.42 -0.61 -0.15 0.00 0.00 0.00 0.00 47.33 46.99 2oyl h GLY 186 CO -0.34 0.57 -0.51 -2.08 0.00 0.00 0.00 176.54 174.17 2oyl h VAL 187 N 0.77 1.37 -0.88 4.60 2.07 -1.54 -0.95 116.25 121.69 2oyl h VAL 187 Ca 0.15 -1.84 0.06 0.00 0.82 0.00 0.00 66.70 65.89 2oyl h VAL 187 Cb 0.48 2.21 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 2oyl h VAL 187 CO 0.02 0.55 0.55 0.24 0.02 0.00 0.00 177.57 178.95 2oyl h MET 188 N 0.12 0.97 -0.38 1.57 2.86 -1.01 -1.63 114.93 117.43 2oyl h MET 188 Ca -0.04 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.47 2oyl h MET 188 Cb 1.16 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 2oyl h MET 188 CO 0.11 0.64 -0.08 -0.09 1.06 0.00 0.00 176.91 178.55 2oyl h ARG 189 N 1.00 0.72 -0.54 1.72 9.65 -1.19 0.24 114.38 125.98 2oyl h ARG 189 Ca 0.38 -0.27 0.10 0.00 -1.10 0.00 0.00 59.98 59.09 2oyl h ARG 189 Cb 0.17 -0.04 -0.08 0.00 -1.39 0.00 0.00 29.97 28.63 2oyl h ARG 189 CO -0.17 0.86 0.10 0.00 2.80 0.00 0.00 179.97 183.56 2oyl h ALA 190 N 0.84 0.61 -0.21 2.80 0.00 -0.74 0.29 119.26 122.84 2oyl h ALA 190 Ca 0.10 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2oyl h ALA 190 Cb 0.59 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2oyl h ALA 190 CO 0.03 -0.31 -0.15 0.74 0.00 0.00 0.00 179.25 179.56 2oyl h PHE 191 N 0.24 0.56 -0.91 0.00 0.04 -1.20 -1.10 116.94 114.57 2oyl h PHE 191 Ca 0.27 -0.15 0.10 0.00 2.80 0.00 0.00 57.97 60.99 2oyl h PHE 191 Cb 0.39 -0.12 -0.07 0.00 2.20 0.00 0.00 35.95 38.35 2oyl h PHE 191 CO -0.24 0.79 0.58 -0.44 -0.60 0.00 0.00 178.31 178.41 2oyl h ASP 192 N 0.17 0.82 -0.13 2.17 3.32 -0.47 0.28 116.42 122.58 2oyl h ASP 192 Ca 0.04 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 2oyl h ASP 192 Cb 0.67 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 2oyl h ASP 192 CO 0.04 0.48 -0.10 0.78 -1.72 0.00 0.00 179.24 178.72 2oyl h ASN 193 N 0.90 0.31 -0.37 6.45 2.35 -0.37 0.21 115.58 125.06 2oyl h ASN 193 Ca 0.42 -0.45 0.07 0.00 -0.55 0.00 0.00 56.30 55.79 2oyl h ASN 193 Cb 0.41 -0.09 -0.06 0.00 0.05 0.00 0.00 38.32 38.63 2oyl h ASN 193 CO -0.18 0.70 -0.01 0.15 -1.65 0.00 0.00 177.43 176.43 2oyl h PHE 194 N -0.07 -0.04 0.00 1.19 3.57 -0.40 -0.02 116.94 121.17 2oyl h PHE 194 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2oyl h PHE 194 Cb 0.60 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.41 2oyl h PHE 194 CO 0.08 -0.08 0.00 0.91 -2.23 0.00 0.00 178.31 176.99 2oyl n TRP 195 N -5.20 0.00 -2.29 0.41 7.02 0.01 -4.13 117.44 113.26 2oyl n TRP 195 Ca 0.02 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.29 2oyl n TRP 195 Cb 0.20 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 29.00 2oyl n TRP 195 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 2oyl n ASN 196 N -1.07 -5.84 0.04 -0.99 5.15 -0.02 -4.88 115.26 107.65 2oyl n ASN 196 Ca 0.18 0.06 0.04 0.00 -0.60 0.00 0.00 54.58 54.26 2oyl n ASN 196 Cb 0.12 -4.90 0.43 0.00 -0.53 0.00 0.00 39.78 34.89 2oyl n ASN 196 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 2oyl h THR 197 N 0.00 1.12 0.00 -0.44 2.02 -0.83 -1.88 112.91 112.90 2oyl h THR 197 Ca -0.48 -0.32 0.00 0.00 0.77 0.00 0.00 66.41 66.37 2oyl h THR 197 Cb 1.36 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2oyl h THR 197 CO 0.59 0.13 0.00 0.71 0.37 0.00 0.00 175.52 177.32 2oyl h THR 198 N 0.45 0.00 0.00 3.16 1.35 -1.85 -3.47 112.91 112.55 2oyl h THR 198 Ca 0.12 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2oyl h THR 198 Cb 0.05 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2oyl h THR 198 CO -0.02 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.86 2oyl n GLY 199 N 0.51 0.80 0.01 5.82 0.00 -0.71 -4.90 105.19 106.72 2oyl n GLY 199 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 2oyl n GLY 199 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oyl n LYS 200 N -2.31 0.39 -3.18 1.61 5.02 -1.26 -4.69 118.16 113.74 2oyl n LYS 200 Ca 0.00 -0.11 -0.20 0.00 -2.02 0.00 0.00 58.31 55.97 2oyl n LYS 200 Cb 0.00 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 33.46 2oyl n LYS 200 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2oyl n HIS 201 N -1.95 0.44 0.32 2.13 8.25 -1.26 -4.91 115.22 118.24 2oyl n HIS 201 Ca -0.01 -3.78 0.21 0.00 -0.26 0.00 0.00 57.72 53.89 2oyl n HIS 201 Cb 0.47 -0.41 1.08 0.00 1.12 0.00 0.00 29.99 32.24 2oyl n HIS 201 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2oyl h PRO 202 N 3.28 0.00 0.00 -0.41 0.13 -1.86 -2.92 132.00 130.22 2oyl h PRO 202 Ca 0.10 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.18 2oyl h PRO 202 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 2oyl h PRO 202 CO 0.52 0.00 -0.22 1.05 -0.23 0.00 0.00 178.00 179.13 2oyl h GLU 203 N 0.00 0.00 -0.17 0.86 9.09 -1.95 -3.36 114.58 119.06 2oyl h GLU 203 Ca 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.39 2oyl h GLU 203 Cb 0.13 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.22 2oyl h GLU 203 CO 0.00 0.22 0.01 -0.07 0.05 0.00 0.00 179.01 179.21 2oyl h LEU 204 N 0.00 0.28 -1.02 3.06 3.38 -1.80 -0.28 115.31 118.94 2oyl h LEU 204 Ca -0.00 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 2oyl h LEU 204 Cb 0.75 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 2oyl h LEU 204 CO 0.03 0.51 0.20 0.58 0.09 0.00 0.00 178.44 179.84 2oyl h VAL 205 N 0.04 1.23 -0.30 1.22 2.07 -1.72 -0.59 116.25 118.20 2oyl h VAL 205 Ca 0.05 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2oyl h VAL 205 Cb 0.36 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2oyl h VAL 205 CO 0.01 0.30 0.18 -0.08 0.02 0.00 0.00 177.57 177.99 2oyl h GLU 206 N 0.88 0.41 -0.81 1.57 4.57 -1.63 -0.21 114.58 119.37 2oyl h GLU 206 Ca 0.20 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2oyl h GLU 206 Cb 0.24 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 2oyl h GLU 206 CO -0.01 0.33 0.52 0.45 -1.18 0.00 0.00 179.01 179.11 2oyl h HIS 207 N 0.38 0.97 0.08 0.92 3.86 -0.76 -2.21 115.15 118.40 2oyl h HIS 207 Ca 0.11 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.34 2oyl h HIS 207 Cb 0.02 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.17 2oyl h HIS 207 CO -0.04 0.56 -0.04 -0.92 0.86 0.00 0.00 177.93 178.36 2oyl h TYR 208 N 1.01 -0.10 -0.52 2.45 3.20 -0.60 0.52 116.97 122.94 2oyl h TYR 208 Ca 0.32 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.26 2oyl h TYR 208 Cb 0.00 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.24 2oyl h TYR 208 CO -0.03 -0.03 0.19 0.00 -1.64 0.00 0.00 178.16 176.65 2oyl h ALA 209 N 0.78 0.65 0.00 1.82 0.00 -0.95 -1.60 119.26 119.96 2oyl h ALA 209 Ca -0.01 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 2oyl h ALA 209 Cb 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2oyl h ALA 209 CO 0.02 -0.21 -0.46 0.87 0.00 0.00 0.00 179.25 179.47 2oyl h LYS 210 N 0.37 0.00 -0.57 0.00 1.57 -1.21 -0.33 116.57 116.40 2oyl h LYS 210 Ca 0.25 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.96 2oyl h LYS 210 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 2oyl h LYS 210 CO -0.26 0.46 0.06 0.00 -0.57 0.00 0.00 179.45 179.15 2oyl h ALA 211 N 1.54 0.76 -0.80 3.86 0.00 -0.43 -1.24 119.26 122.96 2oyl h ALA 211 Ca -0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2oyl h ALA 211 Cb 1.02 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2oyl h ALA 211 CO 0.06 0.54 0.39 -1.49 0.00 0.00 0.00 179.25 178.75 2oyl h TRP 212 N 0.86 1.15 -0.84 0.00 -0.00 -0.95 -2.32 115.95 113.86 2oyl h TRP 212 Ca 0.17 -0.05 0.04 0.00 -0.00 0.00 0.00 58.89 59.05 2oyl h TRP 212 Cb 0.46 -0.36 -0.05 0.00 -0.00 0.00 0.00 29.16 29.21 2oyl h TRP 212 CO 0.03 0.83 0.53 -0.09 -0.00 0.00 0.00 178.44 179.74 2oyl h ARG 213 N 1.13 0.98 -0.40 0.49 2.43 -0.79 0.97 114.38 119.20 2oyl h ARG 213 Ca 0.28 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2oyl h ARG 213 Cb 0.10 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 2oyl h ARG 213 CO -0.04 0.65 0.25 0.00 -1.51 0.00 0.00 179.97 179.32 2oyl h ALA 214 N 1.36 0.50 -0.32 2.80 0.00 -0.89 0.92 119.26 123.64 2oyl h ALA 214 Ca 0.34 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 2oyl h ALA 214 Cb 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2oyl h ALA 214 CO -0.13 -0.07 0.18 0.28 0.00 0.00 0.00 179.25 179.51 2oyl h VAL 215 N 0.51 1.12 -0.31 0.00 2.07 -0.98 -2.75 116.25 115.91 2oyl h VAL 215 Ca 0.15 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 2oyl h VAL 215 Cb -0.03 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2oyl h VAL 215 CO -0.05 0.12 -0.06 0.00 0.02 0.00 0.00 177.57 177.61 2oyl h ALA 216 N 1.06 1.34 -0.84 1.67 0.00 -0.48 -1.88 119.26 120.13 2oyl h ALA 216 Ca 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2oyl h ALA 216 Cb 0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2oyl h ALA 216 CO -0.02 0.45 0.41 0.22 0.00 0.00 0.00 179.25 180.31 2oyl h ASP 217 N 0.46 1.09 -0.37 0.00 3.58 -0.64 0.92 116.42 121.46 2oyl h ASP 217 Ca 0.09 -0.12 -0.14 0.00 0.42 0.00 0.00 57.03 57.28 2oyl h ASP 217 Cb 0.39 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 2oyl h ASP 217 CO 0.02 0.91 -0.30 -0.09 -2.88 0.00 0.00 179.24 176.90 2oyl h ARG 218 N 1.19 0.90 -0.13 0.28 9.65 -1.13 -3.35 114.38 121.79 2oyl h ARG 218 Ca 0.29 -0.42 0.00 0.00 -1.10 0.00 0.00 59.98 58.75 2oyl h ARG 218 Cb 0.10 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 2oyl h ARG 218 CO -0.04 1.07 0.00 1.19 2.80 0.00 0.00 179.97 184.99 2oyl n PHE 219 N -4.08 0.15 -0.24 2.20 3.72 -0.76 -4.53 117.46 113.92 2oyl n PHE 219 Ca -0.01 -0.10 0.08 0.00 -0.05 0.00 0.00 57.45 57.38 2oyl n PHE 219 Cb 0.49 -0.00 0.34 0.00 -0.94 0.00 0.00 39.48 39.37 2oyl n PHE 219 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oyl h ALA 220 N 3.63 1.72 -0.56 4.37 0.00 -0.97 -1.02 119.26 126.44 2oyl h ALA 220 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2oyl h ALA 220 Cb 0.80 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2oyl h ALA 220 CO 0.00 0.11 0.00 -0.25 0.00 0.00 0.00 179.25 179.11 2oyl n ASP 221 N -4.51 5.01 -4.57 0.00 8.00 -1.26 -4.90 116.55 114.32 2oyl n ASP 221 Ca 0.14 -2.72 -0.42 0.00 0.71 0.00 0.00 54.79 52.50 2oyl n ASP 221 Cb 0.32 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.76 2oyl n ASP 221 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2oyl s ASN 222 N -1.00 6.49 0.61 -2.24 3.84 -0.39 -4.93 114.94 117.31 2oyl s ASN 222 Ca 0.51 0.16 0.40 0.00 0.21 0.00 0.00 52.86 54.14 2oyl s ASN 222 Cb 0.36 -2.39 2.08 0.00 -0.55 0.00 0.00 41.25 40.75 2oyl s ASN 222 CO 0.19 -0.79 2.23 0.44 -2.79 0.00 0.00 177.10 176.37 2oyl h ASP 223 N 8.67 0.00 1.23 -4.21 3.32 -1.90 -2.59 116.42 120.95 2oyl h ASP 223 Ca -0.25 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 2oyl h ASP 223 Cb 1.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2oyl h ASP 223 CO 0.92 0.00 -0.77 0.00 -1.72 0.00 0.00 179.24 177.67 2oyl h ALA 224 N 2.01 0.62 -2.66 3.45 0.00 -1.92 -3.46 119.26 117.30 2oyl h ALA 224 Ca 0.00 -0.03 -0.59 0.00 0.00 0.00 0.00 54.91 54.29 2oyl h ALA 224 Cb 0.14 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 2oyl h ALA 224 CO 0.00 0.03 0.05 0.08 0.00 0.00 0.00 179.25 179.41 2oyl s VAL 225 N -3.31 5.06 -0.04 0.00 1.01 -0.98 -0.50 120.40 121.64 2oyl s VAL 225 Ca 0.01 1.12 0.05 0.00 0.00 0.00 0.00 61.98 63.16 2oyl s VAL 225 Cb 0.08 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.48 2oyl s VAL 225 CO 0.76 0.16 0.12 1.33 0.00 0.00 0.00 175.10 177.48 2oyl n VAL 226 N 4.46 0.00 -3.71 2.92 0.24 -0.52 -4.88 118.33 116.84 2oyl n VAL 226 Ca -0.03 -0.16 -0.14 0.00 -2.04 0.00 0.00 64.34 61.97 2oyl n VAL 226 Cb 0.50 0.48 -0.08 0.00 -1.47 0.00 0.00 33.84 33.27 2oyl n VAL 226 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oyl s ALA 227 N -2.21 -1.01 -0.21 2.33 0.00 -1.16 -1.10 121.76 118.41 2oyl s ALA 227 Ca -0.01 0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.60 2oyl s ALA 227 Cb 0.03 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.14 2oyl s ALA 227 CO 0.21 -0.27 -0.16 0.71 0.00 0.00 0.00 175.76 176.25 2oyl s TYR 228 N -1.07 2.93 -0.54 0.00 2.02 0.21 -1.41 117.35 119.49 2oyl s TYR 228 Ca -0.11 -1.90 -0.20 0.00 -0.37 0.00 0.00 57.07 54.49 2oyl s TYR 228 Cb -0.04 -1.90 0.06 0.00 -0.40 0.00 0.00 41.96 39.69 2oyl s TYR 228 CO 0.05 -0.83 0.71 0.34 -1.57 0.00 0.00 175.55 174.25 2oyl s ASP 229 N 1.23 6.23 0.30 2.29 -1.08 0.75 -0.02 116.67 126.37 2oyl s ASP 229 Ca -0.01 -0.90 0.02 0.00 -0.52 0.00 0.00 52.55 51.15 2oyl s ASP 229 Cb -0.16 -2.32 0.48 0.00 -1.46 0.00 0.00 42.92 39.45 2oyl s ASP 229 CO -0.09 -1.02 1.80 -0.07 0.52 0.00 0.00 175.17 176.31 2oyl h LEU 230 N 10.06 0.56 -7.09 -1.34 3.38 -1.61 -2.36 115.31 116.92 2oyl h LEU 230 Ca -0.28 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 2oyl h LEU 230 Cb 1.09 -0.15 -0.25 0.00 0.09 0.00 0.00 40.66 41.44 2oyl h LEU 230 CO 1.02 0.68 -0.26 -0.32 0.09 0.00 0.00 178.44 179.65 2oyl s MET 231 N -4.85 0.44 0.19 1.13 0.00 -1.26 -4.53 119.30 110.42 2oyl s MET 231 Ca -0.08 1.13 -0.31 0.00 0.00 0.00 0.00 55.69 56.43 2oyl s MET 231 Cb 0.15 0.40 -0.10 0.00 0.00 0.00 0.00 34.83 35.27 2oyl s MET 231 CO 0.78 -0.21 1.52 1.21 0.00 0.00 0.00 175.02 178.32 2oyl s ASN 232 N 2.39 6.61 -0.78 1.11 2.47 -0.95 -4.24 114.94 121.55 2oyl s ASN 232 Ca -0.05 2.63 -0.08 0.00 0.42 0.00 0.00 52.86 55.78 2oyl s ASN 232 Cb -0.11 -2.60 0.01 0.00 -1.45 0.00 0.00 41.25 37.10 2oyl s ASN 232 CO -0.15 -0.78 0.52 -0.62 -3.72 0.00 0.00 177.10 172.35 2oyl n GLU 233 N 3.37 -1.02 -1.61 0.43 1.02 -1.26 -4.54 120.64 117.03 2oyl n GLU 233 Ca 0.11 0.43 -0.49 0.00 -0.02 0.00 0.00 57.16 57.19 2oyl n GLU 233 Cb 0.39 -1.85 -0.05 0.00 -0.02 0.00 0.00 31.44 29.92 2oyl n GLU 233 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2oyl n PRO 234 N -2.89 1.45 -4.65 3.49 -0.02 -1.26 -4.64 135.00 126.48 2oyl n PRO 234 Ca -0.22 0.52 -0.28 0.00 -2.02 0.00 0.00 63.50 61.50 2oyl n PRO 234 Cb 0.55 -2.15 -0.17 0.00 -0.02 0.00 0.00 33.50 31.71 2oyl n PRO 234 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2oyl s PHE 235 N 0.32 1.90 -2.51 6.00 5.36 -1.26 -2.71 117.98 125.08 2oyl s PHE 235 Ca 0.78 -0.81 0.26 0.00 -0.96 0.00 0.00 56.93 56.21 2oyl s PHE 235 Cb -0.84 -1.35 0.91 0.00 -0.34 0.00 0.00 43.02 41.40 2oyl s PHE 235 CO 0.47 -0.39 1.66 0.41 -1.46 0.00 0.00 175.22 175.90 2oyl n GLY 236 N 3.94 0.18 7.00 13.12 0.00 -1.25 -4.97 105.19 123.21 2oyl n GLY 236 Ca -0.20 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2oyl n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oyl n GLY 237 N 1.19 4.10 0.00 -0.02 0.00 -1.26 -1.74 105.19 107.45 2oyl n GLY 237 Ca 0.18 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.40 2oyl n GLY 237 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2oyl n SER 238 N 9.04 0.00 -4.69 1.61 3.41 -1.26 -4.60 113.62 117.13 2oyl n SER 238 Ca 0.00 0.41 -0.35 0.00 -0.26 0.00 0.00 58.87 58.67 2oyl n SER 238 Cb 0.00 -0.46 -0.09 0.00 -0.26 0.00 0.00 64.21 63.40 2oyl n SER 238 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2oyl s LEU 239 N -2.93 4.07 0.01 1.04 1.43 -0.71 -5.10 118.68 116.49 2oyl s LEU 239 Ca 0.13 0.17 -0.00 0.00 -1.03 0.00 0.00 54.13 53.41 2oyl s LEU 239 Cb 0.16 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 2oyl s LEU 239 CO 0.42 0.17 -0.02 -1.10 0.23 0.00 0.00 176.35 176.06 2oyl s GLN 240 N 0.38 0.24 2.17 1.70 -1.52 -1.26 -3.89 119.66 117.47 2oyl s GLN 240 Ca 0.06 -0.45 0.00 0.00 -1.95 0.00 0.00 55.36 53.03 2oyl s GLN 240 Cb -0.12 0.08 0.00 0.00 -0.22 0.00 0.00 33.01 32.76 2oyl s GLN 240 CO -0.01 -0.04 0.00 0.41 -0.25 0.00 0.00 175.29 175.40 2oyl n GLY 241 N 1.97 -1.26 0.40 3.09 0.00 -1.26 -4.13 105.19 104.00 2oyl n GLY 241 Ca -0.21 -1.29 0.22 0.00 0.00 0.00 0.00 46.02 44.74 2oyl n GLY 241 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2oyl h PRO 242 N 0.00 0.42 -0.80 1.61 0.11 -1.95 0.95 132.00 132.33 2oyl h PRO 242 Ca 0.00 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.20 2oyl h PRO 242 Cb 0.00 -0.09 -0.06 0.00 0.11 0.00 0.00 31.00 30.96 2oyl h PRO 242 CO 0.00 0.28 0.52 0.00 -0.21 0.00 0.00 178.00 178.59 2oyl h ALA 243 N 1.64 1.83 0.00 -0.75 0.00 -1.95 0.44 119.26 120.46 2oyl h ALA 243 Ca 0.60 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.44 2oyl h ALA 243 Cb 1.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2oyl h ALA 243 CO -0.32 -0.01 -0.43 0.35 0.00 0.00 0.00 179.25 178.84 2oyl h PHE 244 N 0.67 0.00 -0.51 0.00 3.57 -1.07 -3.21 116.94 116.40 2oyl h PHE 244 Ca 0.38 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.75 2oyl h PHE 244 Cb 0.55 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 2oyl h PHE 244 CO -0.00 0.84 -0.18 0.93 -2.23 0.00 0.00 178.31 177.67 2oyl h GLU 245 N -1.00 1.02 -0.00 1.11 5.08 -0.97 -2.18 114.58 117.64 2oyl h GLU 245 Ca -0.10 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2oyl h GLU 245 Cb 0.85 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2oyl h GLU 245 CO -0.06 1.10 -0.30 0.00 -1.00 0.00 0.00 179.01 178.75 2oyl n ALA 246 N -2.51 3.11 -1.99 3.43 0.00 0.13 -1.93 120.51 120.74 2oyl n ALA 246 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2oyl n ALA 246 Cb 0.44 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.67 2oyl n ALA 246 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oyl n GLY 247 N 1.43 0.21 0.24 0.00 0.00 -0.93 -4.70 105.19 101.44 2oyl n GLY 247 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.19 2oyl n GLY 247 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oyl h PRO 248 N 0.00 0.00 0.39 1.61 0.13 -1.72 -1.92 132.00 130.49 2oyl h PRO 248 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 2oyl h PRO 248 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2oyl h PRO 248 CO 0.00 0.17 -0.19 1.25 -0.23 0.00 0.00 178.00 179.01 2oyl h LEU 249 N 0.00 -0.45 -0.74 1.56 5.85 -1.59 0.03 115.31 119.97 2oyl h LEU 249 Ca -0.00 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.69 2oyl h LEU 249 Cb 0.37 0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.44 2oyl h LEU 249 CO 0.02 -0.08 0.39 0.00 -0.34 0.00 0.00 178.44 178.43 2oyl h ALA 250 N -0.45 1.04 -0.64 1.25 0.00 -1.31 -0.94 119.26 118.22 2oyl h ALA 250 Ca -0.05 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2oyl h ALA 250 Cb 0.55 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2oyl h ALA 250 CO 0.09 -0.01 0.41 0.00 0.00 0.00 0.00 179.25 179.73 2oyl h ALA 251 N 1.44 0.82 -0.29 0.00 0.00 -1.24 -0.66 119.26 119.32 2oyl h ALA 251 Ca 0.37 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 2oyl h ALA 251 Cb 0.38 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2oyl h ALA 251 CO -0.27 0.19 0.11 1.98 0.00 0.00 0.00 179.25 181.26 2oyl h MET 252 N 0.81 0.44 -0.97 0.00 -1.53 -0.37 -1.66 114.93 111.65 2oyl h MET 252 Ca 0.25 -0.09 0.07 0.00 -3.44 0.00 0.00 59.70 56.49 2oyl h MET 252 Cb -0.03 -0.07 -0.07 0.00 -0.55 0.00 0.00 31.60 30.88 2oyl h MET 252 CO -0.08 0.47 0.63 1.88 0.14 0.00 0.00 176.91 179.95 2oyl h TYR 253 N 0.32 1.15 -0.24 1.39 0.05 -0.87 0.26 116.97 119.02 2oyl h TYR 253 Ca 0.10 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.86 2oyl h TYR 253 Cb 0.20 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.56 2oyl h TYR 253 CO -0.00 0.59 -0.04 0.37 -1.05 0.00 0.00 178.16 178.03 2oyl h GLN 254 N 1.12 0.45 -0.76 4.88 5.75 -0.91 -0.17 115.11 125.47 2oyl h GLN 254 Ca 0.42 -0.17 -0.05 0.00 -0.15 0.00 0.00 58.65 58.70 2oyl h GLN 254 Cb 0.20 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 2oyl h GLN 254 CO -0.17 0.67 0.27 -0.09 -2.65 0.00 0.00 178.83 176.86 2oyl h ARG 255 N 0.20 1.17 -0.14 1.69 2.43 -0.87 -0.61 114.38 118.25 2oyl h ARG 255 Ca 0.06 -0.23 -0.18 0.00 -0.81 0.00 0.00 59.98 58.82 2oyl h ARG 255 Cb 0.49 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 2oyl h ARG 255 CO 0.02 0.97 -0.62 1.15 -1.51 0.00 0.00 179.97 179.98 2oyl h THR 256 N 1.12 1.32 -0.13 0.20 2.02 -0.91 -1.17 112.91 115.36 2oyl h THR 256 Ca 0.25 -1.87 0.02 0.00 0.77 0.00 0.00 66.41 65.58 2oyl h THR 256 Cb 0.27 2.06 -0.02 0.00 -1.74 0.00 0.00 68.15 68.72 2oyl h THR 256 CO -0.01 0.58 -0.00 0.74 0.37 0.00 0.00 175.52 177.19 2oyl h THR 257 N 0.34 0.91 -0.66 3.16 2.02 -0.96 0.27 112.91 117.98 2oyl h THR 257 Ca -0.04 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 67.19 2oyl h THR 257 Cb 1.25 0.86 -0.06 0.00 -1.74 0.00 0.00 68.15 68.47 2oyl h THR 257 CO 0.13 0.01 0.36 0.44 0.37 0.00 0.00 175.52 176.83 2oyl h ASP 258 N 0.04 0.52 -0.19 4.18 3.32 -1.02 -0.50 116.42 122.78 2oyl h ASP 258 Ca 0.06 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2oyl h ASP 258 Cb 0.07 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2oyl h ASP 258 CO -0.10 0.33 0.01 0.00 -1.72 0.00 0.00 179.24 177.76 2oyl h ALA 259 N 1.36 0.25 -0.96 3.45 0.00 -0.91 -2.77 119.26 119.68 2oyl h ALA 259 Ca 0.30 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.09 2oyl h ALA 259 Cb 0.21 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.87 2oyl h ALA 259 CO -0.20 -0.04 0.62 0.82 0.00 0.00 0.00 179.25 180.45 2oyl h ILE 260 N 0.09 1.04 0.00 0.00 2.04 -0.71 -1.73 117.51 118.24 2oyl h ILE 260 Ca 0.05 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.55 2oyl h ILE 260 Cb 0.37 -0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.34 2oyl h ILE 260 CO 0.01 0.19 0.00 0.54 0.00 0.00 0.00 178.15 178.89 2oyl n ARG 261 N -4.52 0.39 0.20 2.37 5.12 -0.22 -0.70 116.66 119.32 2oyl n ARG 261 Ca 0.15 0.06 0.07 0.00 -1.93 0.00 0.00 57.85 56.20 2oyl n ARG 261 Cb 0.23 -1.50 0.41 0.00 -1.16 0.00 0.00 32.46 30.44 2oyl n ARG 261 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 2oyl h GLN 262 N 0.00 0.00 0.00 5.56 4.20 -1.08 -3.39 115.11 120.40 2oyl h GLN 262 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2oyl h GLN 262 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2oyl h GLN 262 CO 0.00 0.32 -0.14 1.33 -0.67 0.00 0.00 178.83 179.67 2oyl n VAL 263 N -3.58 0.00 -3.48 -0.54 0.24 -0.79 -5.02 118.33 105.16 2oyl n VAL 263 Ca -0.01 -0.23 -0.16 0.00 -2.04 0.00 0.00 64.34 61.90 2oyl n VAL 263 Cb 0.45 0.84 -0.12 0.00 -1.47 0.00 0.00 33.84 33.54 2oyl n VAL 263 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2oyl s ASP 264 N -0.74 1.10 0.09 -1.34 -1.08 0.13 -4.72 116.67 110.11 2oyl s ASP 264 Ca 0.00 -0.08 0.19 0.00 -0.52 0.00 0.00 52.55 52.14 2oyl s ASP 264 Cb 0.00 0.53 -0.11 0.00 -1.46 0.00 0.00 42.92 41.88 2oyl s ASP 264 CO 0.00 -0.31 0.84 0.00 0.52 0.00 0.00 175.17 176.22 2oyl n GLN 265 N 5.33 0.62 -0.00 4.34 1.13 -1.26 -3.97 117.38 123.57 2oyl n GLN 265 Ca -0.05 0.15 0.06 0.00 -1.94 0.00 0.00 57.00 55.22 2oyl n GLN 265 Cb 0.50 -1.78 -0.08 0.00 0.11 0.00 0.00 30.24 28.98 2oyl n GLN 265 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2oyl n ASP 266 N -2.77 2.19 -4.76 1.08 8.00 -1.26 -4.85 116.55 114.18 2oyl n ASP 266 Ca -0.07 -0.10 -0.41 0.00 0.71 0.00 0.00 54.79 54.92 2oyl n ASP 266 Cb 0.74 1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 43.25 2oyl n ASP 266 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2oyl s THR 267 N -2.67 3.03 0.17 -3.53 2.01 -1.26 -4.97 115.64 108.42 2oyl s THR 267 Ca -0.03 1.03 -0.30 0.00 0.31 0.00 0.00 61.69 62.69 2oyl s THR 267 Cb 0.07 -3.65 -0.08 0.00 0.01 0.00 0.00 72.50 68.85 2oyl s THR 267 CO 0.46 0.24 1.32 0.26 -0.69 0.00 0.00 174.62 176.21 2oyl s TRP 268 N -1.10 3.27 -0.27 4.92 0.51 -0.26 -4.90 118.94 121.12 2oyl s TRP 268 Ca 0.48 1.16 -0.13 0.00 -2.12 0.00 0.00 56.10 55.48 2oyl s TRP 268 Cb -0.37 -3.61 -0.04 0.00 -0.81 0.00 0.00 33.47 28.64 2oyl s TRP 268 CO 0.48 -1.96 0.30 0.08 -0.51 0.00 0.00 176.95 175.34 2oyl s VAL 269 N 0.43 5.23 -0.18 4.03 1.01 -0.54 -0.62 120.40 129.76 2oyl s VAL 269 Ca 0.59 0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.95 2oyl s VAL 269 Cb -0.36 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 2oyl s VAL 269 CO 0.35 0.20 -0.04 0.00 0.00 0.00 0.00 175.10 175.62 2oyl s VAL 271 N 0.85 2.54 0.14 0.00 -7.23 -0.42 -1.73 120.40 114.54 2oyl s VAL 271 Ca -0.01 -0.95 0.06 0.00 -1.81 0.00 0.00 61.98 59.27 2oyl s VAL 271 Cb -0.15 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 2oyl s VAL 271 CO 0.02 0.57 -0.00 0.00 -0.31 0.00 0.00 175.10 175.37 2oyl s ALA 272 N -0.69 3.23 0.92 1.32 0.00 -1.26 -1.17 121.76 124.11 2oyl s ALA 272 Ca 0.11 -1.27 -0.15 0.00 0.00 0.00 0.00 51.96 50.65 2oyl s ALA 272 Cb -0.10 -1.07 0.16 0.00 0.00 0.00 0.00 23.12 22.11 2oyl s ALA 272 CO 0.00 0.56 1.26 -1.25 0.00 0.00 0.00 175.76 176.33 2oyl s PRO 273 N -2.70 1.00 0.57 0.00 0.04 -1.26 -4.89 135.00 127.76 2oyl s PRO 273 Ca 0.27 -0.19 -0.21 0.00 0.04 0.00 0.00 61.00 60.91 2oyl s PRO 273 Cb -0.10 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2oyl s PRO 273 CO 0.18 -2.21 1.35 1.14 0.04 0.00 0.00 177.00 177.50 2oyl s GLN 274 N -5.73 3.01 -0.09 4.56 -2.07 -1.26 -4.25 119.66 113.84 2oyl s GLN 274 Ca 0.69 2.21 -0.19 0.00 -1.82 0.00 0.00 55.36 56.25 2oyl s GLN 274 Cb -0.07 -2.17 -0.29 0.00 -1.09 0.00 0.00 33.01 29.39 2oyl s GLN 274 CO 0.52 -1.28 0.70 0.00 -1.32 0.00 0.00 175.29 173.90 2oyl h ALA 275 N 1.26 0.06 -2.59 2.60 0.00 -1.78 -3.37 119.26 115.44 2oyl h ALA 275 Ca -0.51 -0.89 -0.53 0.00 0.00 0.00 0.00 54.91 52.98 2oyl h ALA 275 Cb 1.31 0.30 0.04 0.00 0.00 0.00 0.00 17.79 19.44 2oyl h ALA 275 CO 0.56 0.58 0.80 -1.50 0.00 0.00 0.00 179.25 179.69 2oyl s ILE 276 N -2.44 2.92 0.00 0.00 1.10 -1.26 -0.55 121.20 120.97 2oyl s ILE 276 Ca -0.18 0.67 0.00 0.00 -0.51 0.00 0.00 60.65 60.63 2oyl s ILE 276 Cb 0.03 -3.43 0.00 0.00 0.15 0.00 0.00 42.46 39.21 2oyl s ILE 276 CO 0.78 0.06 0.00 0.61 -2.11 0.00 0.00 174.94 174.28 2oyl n GLY 277 N 3.49 1.86 0.29 1.50 0.00 -1.26 -4.67 105.19 106.40 2oyl n GLY 277 Ca 0.12 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2oyl n GLY 277 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2oyl h VAL 278 N 0.00 1.26 -0.80 1.61 2.07 -1.67 -1.45 116.25 117.27 2oyl h VAL 278 Ca 0.00 -1.15 0.19 0.00 0.82 0.00 0.00 66.70 66.56 2oyl h VAL 278 Cb 0.00 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 2oyl h VAL 278 CO 0.00 0.41 0.54 0.78 0.02 0.00 0.00 177.57 179.32 2oyl h ASN 279 N 0.84 0.25 -0.22 0.57 4.21 -1.03 -2.24 115.58 117.95 2oyl h ASN 279 Ca 0.15 0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.68 2oyl h ASN 279 Cb 0.57 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.74 2oyl h ASN 279 CO 0.03 0.11 0.00 0.00 -1.29 0.00 0.00 177.43 176.28 2oyl n GLN 280 N -4.43 2.19 0.00 0.81 3.00 -0.64 -0.69 117.38 117.63 2oyl n GLN 280 Ca 0.16 -1.77 0.00 0.00 -0.01 0.00 0.00 57.00 55.38 2oyl n GLN 280 Cb 0.69 -1.47 0.00 0.00 0.00 0.00 0.00 30.24 29.47 2oyl n GLN 280 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2oyl n GLY 281 N 1.35 1.18 3.87 1.08 0.00 -0.84 -4.72 105.19 107.09 2oyl n GLY 281 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2oyl n GLY 281 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oyl s LEU 282 N 0.00 3.77 0.65 0.99 1.02 -0.67 -4.32 118.68 120.11 2oyl s LEU 282 Ca 0.00 1.26 -0.16 0.00 0.02 0.00 0.00 54.13 55.25 2oyl s LEU 282 Cb 0.00 -4.16 -0.01 0.00 0.02 0.00 0.00 46.19 42.05 2oyl s LEU 282 CO 0.00 -0.45 1.13 -2.16 0.02 0.00 0.00 176.35 174.89 2oyl s PRO 283 N -3.92 2.79 -0.03 1.29 0.04 -1.26 -4.22 135.00 129.70 2oyl s PRO 283 Ca 0.53 1.51 -0.04 0.00 0.04 0.00 0.00 61.00 63.04 2oyl s PRO 283 Cb -0.10 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 2oyl s PRO 283 CO 0.31 -1.28 0.18 0.45 0.04 0.00 0.00 177.00 176.71 2oyl s SER 284 N -2.31 6.38 -0.14 6.66 0.15 -1.26 -4.75 113.70 118.42 2oyl s SER 284 Ca 0.70 0.39 0.17 0.00 0.70 0.00 0.00 55.95 57.91 2oyl s SER 284 Cb -0.23 -2.02 0.76 0.00 -1.71 0.00 0.00 66.02 62.81 2oyl s SER 284 CO 0.39 0.29 1.67 0.61 1.20 0.00 0.00 173.24 177.40 2oyl n GLY 285 N 1.17 2.78 3.78 9.45 0.00 -1.26 -4.95 105.19 116.15 2oyl n GLY 285 Ca -0.13 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.61 2oyl n GLY 285 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2oyl s LEU 286 N -2.06 4.29 0.37 0.99 2.96 -1.26 -3.81 118.68 120.17 2oyl s LEU 286 Ca 0.53 2.99 0.08 0.00 -0.22 0.00 0.00 54.13 57.50 2oyl s LEU 286 Cb 0.35 -3.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 2oyl s LEU 286 CO 0.23 -0.89 0.22 0.42 -1.32 0.00 0.00 176.35 175.01 2oyl s THR 287 N -1.14 2.84 0.26 3.68 -4.23 -1.26 -4.92 115.64 110.87 2oyl s THR 287 Ca 0.54 -1.58 -0.30 0.00 -1.18 0.00 0.00 61.69 59.16 2oyl s THR 287 Cb -0.45 -3.01 -0.10 0.00 1.34 0.00 0.00 72.50 70.27 2oyl s THR 287 CO 0.61 -0.10 1.47 -0.75 -0.54 0.00 0.00 174.62 175.31 2oyl s LYS 288 N -3.94 4.24 -0.16 3.99 2.20 -1.26 -4.88 119.74 119.93 2oyl s LYS 288 Ca 0.41 2.36 -0.07 0.00 -0.36 0.00 0.00 55.97 58.31 2oyl s LYS 288 Cb -0.02 -3.09 -0.04 0.00 -1.51 0.00 0.00 37.83 33.18 2oyl s LYS 288 CO 0.24 -0.46 0.08 0.42 -0.36 0.00 0.00 175.35 175.27 2oyl s ILE 289 N -0.06 5.00 0.05 5.43 -1.09 -1.26 -5.07 121.20 124.20 2oyl s ILE 289 Ca 0.60 0.03 -0.25 0.00 -2.23 0.00 0.00 60.65 58.80 2oyl s ILE 289 Cb -0.43 -3.22 -0.06 0.00 -1.58 0.00 0.00 42.46 37.17 2oyl s ILE 289 CO 0.45 0.51 0.75 -1.81 -1.23 0.00 0.00 174.94 173.61 2oyl s ASP 290 N -0.09 7.20 -0.32 3.58 1.01 -1.26 -5.01 116.67 121.77 2oyl s ASP 290 Ca 0.08 1.44 -0.08 0.00 0.71 0.00 0.00 52.55 54.70 2oyl s ASP 290 Cb -0.12 -2.46 0.02 0.00 1.01 0.00 0.00 42.92 41.37 2oyl s ASP 290 CO 0.01 0.04 0.12 -0.62 0.21 0.00 0.00 175.17 174.92 2oyl s ASP 291 N -0.14 5.35 0.00 0.27 -1.08 -1.26 -4.84 116.67 114.97 2oyl s ASP 291 Ca 0.38 -0.84 0.20 0.00 -0.52 0.00 0.00 52.55 51.76 2oyl s ASP 291 Cb -0.20 -1.92 0.97 0.00 -1.46 0.00 0.00 42.92 40.30 2oyl s ASP 291 CO 0.23 -0.26 1.63 -0.81 0.52 0.00 0.00 175.17 176.47 2oyl n PRO 292 N 4.89 0.21 -1.70 4.34 -0.04 -1.26 -4.87 135.00 136.58 2oyl n PRO 292 Ca -0.13 0.11 -0.39 0.00 -0.04 0.00 0.00 63.50 63.05 2oyl n PRO 292 Cb 0.47 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.47 2oyl n PRO 292 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2oyl n ARG 293 N -1.34 1.54 -2.12 0.54 1.85 -1.26 -4.93 116.66 110.94 2oyl n ARG 293 Ca 0.08 0.57 -0.41 0.00 -1.00 0.00 0.00 57.85 57.09 2oyl n ARG 293 Cb 0.18 -2.43 -0.03 0.00 -1.05 0.00 0.00 32.46 29.13 2oyl n ARG 293 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2oyl s ALA 294 N -1.32 3.57 0.00 2.89 0.00 -1.26 -4.73 121.76 120.91 2oyl s ALA 294 Ca 0.70 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2oyl s ALA 294 Cb -0.44 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.16 2oyl s ALA 294 CO 0.51 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 176.05 2oyl n GLY 295 N 2.28 -0.51 3.77 0.00 0.00 -1.26 -4.97 105.19 104.50 2oyl n GLY 295 Ca 0.06 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 44.13 2oyl n GLY 295 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oyl s GLN 296 N 0.00 4.19 0.53 1.61 -0.21 -1.26 -4.98 119.66 119.55 2oyl s GLN 296 Ca 0.00 1.65 -0.22 0.00 0.02 0.00 0.00 55.36 56.82 2oyl s GLN 296 Cb 0.00 -2.67 -0.05 0.00 1.00 0.00 0.00 33.01 31.29 2oyl s GLN 296 CO 0.00 -0.15 1.32 -0.65 -2.12 0.00 0.00 175.29 173.69 2oyl s GLN 297 N -2.29 3.23 -0.53 2.91 -0.21 -1.26 -4.97 119.66 116.55 2oyl s GLN 297 Ca 0.56 2.15 0.07 0.00 0.02 0.00 0.00 55.36 58.15 2oyl s GLN 297 Cb -0.26 -2.27 0.28 0.00 1.00 0.00 0.00 33.01 31.76 2oyl s GLN 297 CO 0.33 -1.09 0.73 0.54 -2.12 0.00 0.00 175.29 173.68 2oyl n ARG 298 N -0.96 2.03 -4.74 2.91 1.74 -1.26 -5.05 116.66 111.32 2oyl n ARG 298 Ca 0.10 -4.18 -0.33 0.00 -0.77 0.00 0.00 57.85 52.66 2oyl n ARG 298 Cb 0.46 -1.92 -0.12 0.00 -1.02 0.00 0.00 32.46 29.86 2oyl n ARG 298 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2oyl s ILE 299 N -2.58 3.43 0.18 0.55 -1.09 -1.26 -1.47 121.20 118.95 2oyl s ILE 299 Ca 0.41 -0.58 0.06 0.00 -2.23 0.00 0.00 60.65 58.30 2oyl s ILE 299 Cb 0.21 -2.38 -0.05 0.00 -1.58 0.00 0.00 42.46 38.66 2oyl s ILE 299 CO -0.07 0.60 -0.11 0.00 -1.23 0.00 0.00 174.94 174.13 2oyl s ALA 300 N -0.77 1.71 -0.19 9.38 0.00 -0.31 -4.27 121.76 127.31 2oyl s ALA 300 Ca 0.12 -1.59 -0.05 0.00 0.00 0.00 0.00 51.96 50.44 2oyl s ALA 300 Cb -0.11 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 2oyl s ALA 300 CO 0.01 -0.05 -0.00 -0.47 0.00 0.00 0.00 175.76 175.25 2oyl s TYR 301 N -3.20 3.06 -0.53 0.00 5.04 -0.25 -1.30 117.35 120.16 2oyl s TYR 301 Ca 0.20 -0.36 0.07 0.00 -2.44 0.00 0.00 57.07 54.54 2oyl s TYR 301 Cb 0.02 -2.05 0.29 0.00 0.35 0.00 0.00 41.96 40.57 2oyl s TYR 301 CO 0.04 -0.15 0.75 0.00 -1.34 0.00 0.00 175.55 174.85 2oyl s PRO 303 N -2.48 1.48 0.34 0.00 0.04 -1.22 -4.44 135.00 128.71 2oyl s PRO 303 Ca 0.41 0.61 0.08 0.00 0.04 0.00 0.00 61.00 62.14 2oyl s PRO 303 Cb 0.22 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.87 2oyl s PRO 303 CO -0.08 -2.03 0.15 -1.01 0.04 0.00 0.00 177.00 174.07 2oyl s HIS 304 N -3.10 2.73 -0.17 0.56 3.76 -1.26 -1.67 115.29 116.14 2oyl s HIS 304 Ca 0.63 -0.37 -0.02 0.00 -0.15 0.00 0.00 55.06 55.15 2oyl s HIS 304 Cb -0.16 -1.65 0.05 0.00 1.11 0.00 0.00 32.58 31.93 2oyl s HIS 304 CO 0.55 0.33 0.00 -1.17 -0.85 0.00 0.00 174.74 173.61 2oyl s LEU 305 N -3.86 1.29 -0.40 0.89 2.96 -0.44 -4.40 118.68 114.72 2oyl s LEU 305 Ca 0.38 -0.70 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 2oyl s LEU 305 Cb -0.03 -0.68 0.16 0.00 0.50 0.00 0.00 46.19 46.14 2oyl s LEU 305 CO 0.23 -0.26 0.34 -0.31 -1.32 0.00 0.00 176.35 175.03 2oyl s TYR 306 N 1.79 0.74 0.28 5.38 2.02 0.13 -4.39 117.35 123.30 2oyl s TYR 306 Ca -0.00 -1.98 -0.30 0.00 -0.37 0.00 0.00 57.07 54.42 2oyl s TYR 306 Cb -0.16 -0.80 -0.13 0.00 -0.40 0.00 0.00 41.96 40.47 2oyl s TYR 306 CO -0.07 -0.87 1.36 -2.30 -1.57 0.00 0.00 175.55 172.10 2oyl n PRO 307 N 3.18 2.08 -0.20 -1.71 -0.02 -1.26 -4.14 135.00 132.92 2oyl n PRO 307 Ca 0.24 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 2oyl n PRO 307 Cb 0.46 -2.36 0.11 0.00 -0.02 0.00 0.00 33.50 31.69 2oyl n PRO 307 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2oyl h LEU 308 N 3.60 0.22 -1.43 2.45 3.38 -1.91 -2.66 115.31 118.96 2oyl h LEU 308 Ca -0.45 0.08 0.15 0.00 0.09 0.00 0.00 57.88 57.75 2oyl h LEU 308 Cb 1.28 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 2oyl h LEU 308 CO 0.71 0.13 0.54 -0.65 0.09 0.00 0.00 178.44 179.26 2oyl h PRO 309 N 0.40 0.54 -6.32 1.13 0.11 -1.91 -3.53 132.00 122.43 2oyl h PRO 309 Ca 0.31 -0.03 -0.55 0.00 0.11 0.00 0.00 66.00 65.84 2oyl h PRO 309 Cb 0.39 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 2oyl h PRO 309 CO -0.31 0.36 0.58 -0.51 -0.21 0.00 0.00 178.00 177.91 2oyl s LEU 310 N -9.59 4.28 -0.46 2.35 1.43 -1.01 -5.11 118.68 110.58 2oyl s LEU 310 Ca -0.09 1.69 0.07 0.00 -1.03 0.00 0.00 54.13 54.76 2oyl s LEU 310 Cb 0.22 -3.56 0.28 0.00 0.03 0.00 0.00 46.19 43.15 2oyl s LEU 310 CO 0.78 -0.47 0.91 1.57 0.23 0.00 0.00 176.35 179.37 2oyl n HIS 316 N 4.83 -2.56 -3.85 0.29 -0.00 -0.83 -5.04 115.22 108.06 2oyl n HIS 316 Ca 0.09 -2.26 -0.09 0.00 0.46 0.00 0.00 57.72 55.92 2oyl n HIS 316 Cb 0.48 1.21 -0.07 0.00 -0.12 0.00 0.00 29.99 31.49 2oyl n HIS 316 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 2oyl s GLU 317 N 0.07 0.88 4.97 1.57 -1.05 -1.26 -4.37 118.70 119.51 2oyl s GLU 317 Ca 0.30 -0.95 0.00 0.00 -0.15 0.00 0.00 54.97 54.16 2oyl s GLU 317 Cb 0.25 0.35 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 2oyl s GLU 317 CO -0.15 -0.29 0.00 0.41 0.95 0.00 0.00 175.26 176.18 2oyl n GLY 318 N -0.08 1.84 0.29 -3.83 0.00 -1.26 -2.61 105.19 99.54 2oyl n GLY 318 Ca -0.15 -0.57 0.02 0.00 0.00 0.00 0.00 46.02 45.32 2oyl n GLY 318 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2oyl h LEU 319 N 0.00 0.49 -0.77 0.99 5.85 -2.00 -2.02 115.31 117.85 2oyl h LEU 319 Ca 0.00 -0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.75 2oyl h LEU 319 Cb 0.00 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 2oyl h LEU 319 CO 0.00 0.47 0.42 0.00 -0.34 0.00 0.00 178.44 179.00 2oyl h ALA 320 N 1.60 1.08 -0.44 1.25 0.00 -1.95 -0.46 119.26 120.35 2oyl h ALA 320 Ca 0.13 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2oyl h ALA 320 Cb 0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2oyl h ALA 320 CO -0.01 0.05 0.20 -0.09 0.00 0.00 0.00 179.25 179.41 2oyl h ARG 321 N 0.72 0.63 -0.45 0.00 2.43 -1.12 -0.93 114.38 115.67 2oyl h ARG 321 Ca 0.37 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2oyl h ARG 321 Cb 0.34 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2oyl h ARG 321 CO -0.24 0.55 0.30 1.15 -1.51 0.00 0.00 179.97 180.21 2oyl h THR 322 N 0.56 1.12 -0.70 0.20 2.02 -1.11 -0.06 112.91 114.93 2oyl h THR 322 Ca 0.15 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 2oyl h THR 322 Cb 0.13 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 2oyl h THR 322 CO -0.02 0.11 0.36 -0.07 0.37 0.00 0.00 175.52 176.28 2oyl h LEU 323 N 0.61 0.89 -0.58 2.58 3.38 -0.97 -1.75 115.31 119.47 2oyl h LEU 323 Ca 0.16 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 2oyl h LEU 323 Cb -0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2oyl h LEU 323 CO -0.04 0.75 -0.02 0.74 0.09 0.00 0.00 178.44 179.96 2oyl h THR 324 N 0.96 1.27 -0.51 0.22 2.02 -0.83 -1.00 112.91 115.04 2oyl h THR 324 Ca 0.24 -1.16 -0.05 0.00 0.77 0.00 0.00 66.41 66.21 2oyl h THR 324 Cb 0.07 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2oyl h THR 324 CO -0.04 0.42 0.14 0.44 0.37 0.00 0.00 175.52 176.86 2oyl h ASP 325 N 0.92 0.76 0.54 4.18 3.32 -0.81 -1.87 116.42 123.47 2oyl h ASP 325 Ca 0.16 -0.22 -0.10 0.00 0.02 0.00 0.00 57.03 56.89 2oyl h ASP 325 Cb 0.58 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2oyl h ASP 325 CO 0.03 0.78 -0.48 -0.37 -1.72 0.00 0.00 179.24 177.48 2oyl h VAL 326 N 0.70 1.29 -0.39 -1.35 -1.51 -1.27 -2.35 116.25 111.38 2oyl h VAL 326 Ca 0.16 -1.69 0.02 0.00 -1.23 0.00 0.00 66.70 63.96 2oyl h VAL 326 Cb 0.30 1.92 -0.03 0.00 -2.13 0.00 0.00 31.29 31.36 2oyl h VAL 326 CO -0.00 0.47 0.22 0.74 -1.23 0.00 0.00 177.57 177.77 2oyl h THR 327 N 0.00 1.03 -0.59 7.19 2.02 -0.85 -0.42 112.91 121.28 2oyl h THR 327 Ca -0.00 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 67.04 2oyl h THR 327 Cb 0.89 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 2oyl h THR 327 CO 0.06 0.08 0.37 0.40 0.37 0.00 0.00 175.52 176.81 2oyl h ILE 328 N 0.45 1.10 -0.25 3.11 2.04 -1.00 0.30 117.51 123.26 2oyl h ILE 328 Ca 0.16 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.79 2oyl h ILE 328 Cb 0.02 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 2oyl h ILE 328 CO -0.08 0.14 0.06 0.44 0.00 0.00 0.00 178.15 178.71 2oyl h ASP 329 N 0.75 0.04 -0.27 1.72 3.32 -1.12 0.64 116.42 121.49 2oyl h ASP 329 Ca 0.23 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 2oyl h ASP 329 Cb -0.02 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2oyl h ASP 329 CO -0.08 0.06 0.09 0.00 -1.72 0.00 0.00 179.24 177.58 2oyl h ALA 330 N 1.17 0.35 -0.61 3.45 0.00 -0.60 -2.34 119.26 120.69 2oyl h ALA 330 Ca 0.11 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2oyl h ALA 330 Cb 0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2oyl h ALA 330 CO -0.13 -0.03 0.36 2.35 0.00 0.00 0.00 179.25 181.81 2oyl h TRP 331 N 0.27 0.68 -0.19 0.00 7.01 -0.20 -1.63 115.95 121.90 2oyl h TRP 331 Ca 0.09 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.12 2oyl h TRP 331 Cb 0.23 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 2oyl h TRP 331 CO 0.00 0.37 0.10 -0.09 -2.79 0.00 0.00 178.44 176.04 2oyl h ARG 332 N 0.71 0.21 -0.48 2.65 2.43 -0.72 0.07 114.38 119.24 2oyl h ARG 332 Ca 0.25 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2oyl h ARG 332 Cb 0.06 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2oyl h ARG 332 CO -0.12 0.14 0.26 0.00 -1.51 0.00 0.00 179.97 178.73 2oyl h ALA 333 N 1.09 0.62 -0.33 2.80 0.00 -1.15 -1.18 119.26 121.11 2oyl h ALA 333 Ca 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2oyl h ALA 333 Cb 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2oyl h ALA 333 CO -0.04 0.15 -0.06 -0.91 0.00 0.00 0.00 179.25 178.39 2oyl h ASN 334 N 0.64 0.62 -0.19 0.00 2.35 -1.22 -1.78 115.58 116.00 2oyl h ASN 334 Ca 0.17 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2oyl h ASN 334 Cb 0.07 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2oyl h ASN 334 CO -0.03 0.83 0.12 0.74 -1.65 0.00 0.00 177.43 177.44 2oyl h THR 335 N 0.40 1.05 -0.76 2.81 2.02 -0.88 -0.82 112.91 116.73 2oyl h THR 335 Ca 0.08 -0.11 0.05 0.00 0.77 0.00 0.00 66.41 67.21 2oyl h THR 335 Cb 0.55 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 2oyl h THR 335 CO 0.03 0.05 0.46 0.00 0.37 0.00 0.00 175.52 176.43 2oyl h ALA 336 N 1.06 1.02 0.11 6.16 0.00 -1.18 0.03 119.26 126.46 2oyl h ALA 336 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2oyl h ALA 336 Cb -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2oyl h ALA 336 CO -0.01 0.21 -0.05 1.25 0.00 0.00 0.00 179.25 180.64 2oyl h HIS 337 N 0.87 -0.13 -0.33 0.00 6.17 -0.90 -1.98 115.15 118.85 2oyl h HIS 337 Ca 0.33 -0.00 -0.08 0.00 0.71 0.00 0.00 60.37 61.32 2oyl h HIS 337 Cb 0.12 0.04 -0.02 0.00 2.52 0.00 0.00 27.41 30.08 2oyl h HIS 337 CO -0.05 -0.01 -0.13 1.15 0.71 0.00 0.00 177.93 179.60 2oyl h THR 338 N -0.23 1.24 -0.44 6.26 2.02 -0.98 -0.88 112.91 119.91 2oyl h THR 338 Ca -0.01 -1.09 0.02 0.00 0.77 0.00 0.00 66.41 66.09 2oyl h THR 338 Cb 0.18 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 2oyl h THR 338 CO 0.02 0.36 0.29 0.00 0.37 0.00 0.00 175.52 176.57 2oyl h ALA 339 N 1.33 1.75 -0.05 6.16 0.00 -0.84 -1.13 119.26 126.49 2oyl h ALA 339 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2oyl h ALA 339 Cb 0.54 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2oyl h ALA 339 CO 0.03 0.21 -0.03 0.00 0.00 0.00 0.00 179.25 179.46 2oyl h ARG 340 N 0.54 0.10 -0.90 0.00 3.08 -0.56 -0.34 114.38 116.29 2oyl h ARG 340 Ca 0.17 -0.05 0.17 0.00 0.07 0.00 0.00 59.98 60.34 2oyl h ARG 340 Cb 0.02 -0.00 -0.10 0.00 0.08 0.00 0.00 29.97 29.97 2oyl h ARG 340 CO -0.04 0.53 0.49 0.28 -1.07 0.00 0.00 179.97 180.16 2oyl h VAL 341 N -0.32 0.70 0.00 2.04 2.07 -0.63 0.11 116.25 120.22 2oyl h VAL 341 Ca 0.01 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2oyl h VAL 341 Cb 0.51 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2oyl h VAL 341 CO 0.01 0.12 0.00 0.18 0.02 0.00 0.00 177.57 177.90 2oyl n LEU 342 N -4.85 0.00 0.00 2.57 4.77 -0.48 -4.31 117.00 114.70 2oyl n LEU 342 Ca 0.20 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 2oyl n LEU 342 Cb 0.50 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2oyl n LEU 342 CO 0.20 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 2oyl n GLY 343 N 0.57 1.03 3.62 -0.72 0.00 -0.01 -4.65 105.19 105.03 2oyl n GLY 343 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2oyl n GLY 343 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2oyl n ASP 344 N 0.00 -3.51 -4.92 1.61 8.00 -0.43 -4.96 116.55 112.34 2oyl n ASP 344 Ca 0.00 -0.87 -0.26 0.00 0.71 0.00 0.00 54.79 54.37 2oyl n ASP 344 Cb 0.00 -4.02 -0.01 0.00 -0.02 0.00 0.00 41.12 37.08 2oyl n ASP 344 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2oyl s VAL 345 N -3.56 5.00 0.74 2.53 -7.23 -0.27 -4.69 120.40 112.92 2oyl s VAL 345 Ca 0.24 -0.10 -0.14 0.00 -1.81 0.00 0.00 61.98 60.17 2oyl s VAL 345 Cb -0.07 -3.85 0.05 0.00 0.56 0.00 0.00 36.38 33.06 2oyl s VAL 345 CO 0.82 -0.68 1.17 -2.84 -0.31 0.00 0.00 175.10 173.26 2oyl s PRO 346 N -4.47 2.14 -0.06 4.82 0.02 -1.26 -4.58 135.00 131.61 2oyl s PRO 346 Ca 0.44 1.63 0.04 0.00 0.02 0.00 0.00 61.00 63.13 2oyl s PRO 346 Cb -0.10 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.55 2oyl s PRO 346 CO 0.40 -1.81 -0.18 0.42 -0.33 0.00 0.00 177.00 175.50 2oyl s ILE 347 N -2.18 2.67 -0.12 2.83 1.01 -1.26 -1.09 121.20 123.05 2oyl s ILE 347 Ca 0.71 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 60.51 2oyl s ILE 347 Cb -0.26 -2.03 0.02 0.00 0.01 0.00 0.00 42.46 40.20 2oyl s ILE 347 CO 0.47 0.57 -0.11 -0.63 0.00 0.00 0.00 174.94 175.24 2oyl s ILE 348 N -0.39 1.28 -0.82 2.92 1.01 0.10 -1.57 121.20 123.73 2oyl s ILE 348 Ca 0.04 -0.47 -0.26 0.00 0.00 0.00 0.00 60.65 59.96 2oyl s ILE 348 Cb -0.12 -1.23 0.03 0.00 0.01 0.00 0.00 42.46 41.15 2oyl s ILE 348 CO 0.02 0.41 1.39 -0.22 0.00 0.00 0.00 174.94 176.54 2oyl s LEU 349 N 1.42 3.27 0.31 2.97 2.96 0.48 -3.43 118.68 126.65 2oyl s LEU 349 Ca 0.01 -0.69 0.13 0.00 -0.22 0.00 0.00 54.13 53.35 2oyl s LEU 349 Cb -0.13 -2.56 0.46 0.00 0.50 0.00 0.00 46.19 44.46 2oyl s LEU 349 CO -0.07 -1.81 1.66 1.23 -1.32 0.00 0.00 176.35 176.04 2oyl h GLY 350 N 13.37 0.00 -5.49 7.98 0.00 -1.53 -1.14 103.07 116.25 2oyl h GLY 350 Ca -0.13 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.05 2oyl h GLY 350 CO 1.32 0.00 -0.37 -0.54 0.00 0.00 0.00 176.54 176.95 2oyl s GLU 351 N -3.66 0.34 0.11 4.80 2.02 -1.23 -4.44 118.70 116.64 2oyl s GLU 351 Ca -0.01 0.51 -0.17 0.00 0.02 0.00 0.00 54.97 55.31 2oyl s GLU 351 Cb 0.12 0.09 0.04 0.00 0.10 0.00 0.00 34.13 34.49 2oyl s GLU 351 CO 0.74 -0.08 0.43 -0.59 0.02 0.00 0.00 175.26 175.78 2oyl s PHE 352 N 0.56 -0.26 0.00 1.61 -0.71 -1.25 -1.32 117.98 116.60 2oyl s PHE 352 Ca -0.03 0.01 0.00 0.00 -1.04 0.00 0.00 56.93 55.87 2oyl s PHE 352 Cb -0.05 0.29 0.00 0.00 -1.21 0.00 0.00 43.02 42.05 2oyl s PHE 352 CO -0.03 -0.69 0.00 0.41 -1.34 0.00 0.00 175.22 173.56 2oyl n GLY 353 N -0.10 1.59 3.80 1.99 0.00 -1.26 -0.67 105.19 110.54 2oyl n GLY 353 Ca -0.17 -0.86 -0.07 0.00 0.00 0.00 0.00 46.02 44.93 2oyl n GLY 353 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2oyl s LEU 354 N 0.00 -0.27 -0.27 0.99 2.34 -1.26 -5.02 118.68 115.19 2oyl s LEU 354 Ca 0.00 -0.50 -0.28 0.00 0.06 0.00 0.00 54.13 53.41 2oyl s LEU 354 Cb 0.00 2.57 -0.04 0.00 -0.56 0.00 0.00 46.19 48.16 2oyl s LEU 354 CO 0.00 -1.20 2.09 -0.62 -1.06 0.00 0.00 176.35 175.56 2oyl s ASP 355 N -2.90 5.54 0.00 1.48 -1.08 -1.26 -4.21 116.67 114.23 2oyl s ASP 355 Ca 0.10 1.63 0.15 0.00 -0.52 0.00 0.00 52.55 53.92 2oyl s ASP 355 Cb -0.04 -2.52 0.67 0.00 -1.46 0.00 0.00 42.92 39.57 2oyl s ASP 355 CO 0.04 -1.94 1.46 0.35 0.52 0.00 0.00 175.17 175.61 2oyl n THR 356 N 7.66 0.86 1.49 1.71 -2.24 -0.22 -1.85 114.28 121.69 2oyl n THR 356 Ca 0.28 0.22 0.14 0.00 -2.27 0.00 0.00 64.05 62.41 2oyl n THR 356 Cb 0.46 -0.96 0.57 0.00 -2.10 0.00 0.00 70.33 68.30 2oyl n THR 356 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2oyl n THR 357 N -1.44 0.00 -2.48 4.28 -2.24 -1.26 -4.76 114.28 106.38 2oyl n THR 357 Ca 0.05 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2oyl n THR 357 Cb 0.16 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.57 2oyl n THR 357 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2oyl s LEU 358 N -2.22 4.42 0.21 3.22 1.43 -0.77 -4.99 118.68 119.98 2oyl s LEU 358 Ca 0.34 2.03 -0.32 0.00 -1.03 0.00 0.00 54.13 55.15 2oyl s LEU 358 Cb 0.21 -3.59 -0.14 0.00 0.03 0.00 0.00 46.19 42.69 2oyl s LEU 358 CO 0.41 -0.35 1.38 -2.65 0.23 0.00 0.00 176.35 175.38 2oyl n PRO 359 N 3.19 1.84 -0.40 1.29 -0.02 -1.26 -1.50 135.00 138.15 2oyl n PRO 359 Ca 0.06 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2oyl n PRO 359 Cb 0.47 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2oyl n PRO 359 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oyl n GLY 360 N 2.32 1.03 0.21 -1.23 0.00 -1.26 -1.97 105.19 104.29 2oyl n GLY 360 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 2oyl n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyl h ALA 361 N 0.00 0.67 -0.67 4.61 0.00 -1.56 -2.13 119.26 120.17 2oyl h ALA 361 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2oyl h ALA 361 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2oyl h ALA 361 CO 0.00 0.00 0.39 -0.09 0.00 0.00 0.00 179.25 179.55 2oyl h ARG 362 N 0.60 0.93 -0.62 0.00 2.43 -1.86 -0.04 114.38 115.81 2oyl h ARG 362 Ca 0.21 -0.10 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2oyl h ARG 362 Cb 0.04 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 2oyl h ARG 362 CO -0.10 0.68 0.41 -0.44 -1.51 0.00 0.00 179.97 179.00 2oyl h ASP 363 N 0.92 0.71 0.26 -3.80 3.32 -1.89 0.79 116.42 116.73 2oyl h ASP 363 Ca 0.24 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 2oyl h ASP 363 Cb 0.01 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2oyl h ASP 363 CO -0.04 0.51 -0.13 0.22 -1.72 0.00 0.00 179.24 178.08 2oyl h TYR 364 N 0.84 -0.33 -0.42 4.55 3.20 -1.02 -0.90 116.97 122.89 2oyl h TYR 364 Ca 0.23 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.14 2oyl h TYR 364 Cb -0.10 0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 2oyl h TYR 364 CO -0.03 -0.18 0.14 0.82 -1.64 0.00 0.00 178.16 177.27 2oyl h ILE 365 N -0.39 0.86 -0.49 1.81 2.04 -0.75 -0.27 117.51 120.32 2oyl h ILE 365 Ca -0.04 -0.10 -0.06 0.00 1.00 0.00 0.00 64.86 65.66 2oyl h ILE 365 Cb 0.30 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2oyl h ILE 365 CO 0.06 0.05 0.08 -0.33 0.00 0.00 0.00 178.15 178.01 2oyl h GLU 366 N 0.30 0.77 -0.41 2.37 5.08 -0.77 -1.20 114.58 120.72 2oyl h GLU 366 Ca 0.20 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 2oyl h GLU 366 Cb 0.19 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2oyl h GLU 366 CO -0.21 0.73 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.39 2oyl h ARG 367 N 0.74 0.76 -0.35 2.33 2.43 -0.51 -1.17 114.38 118.60 2oyl h ARG 367 Ca 0.16 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2oyl h ARG 367 Cb 0.34 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 2oyl h ARG 367 CO 0.01 0.87 0.19 0.28 -1.51 0.00 0.00 179.97 179.81 2oyl h VAL 368 N 0.58 1.14 -0.49 0.20 2.07 -0.67 -0.98 116.25 118.09 2oyl h VAL 368 Ca 0.11 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2oyl h VAL 368 Cb 0.56 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2oyl h VAL 368 CO 0.03 0.14 0.09 1.88 0.02 0.00 0.00 177.57 179.73 2oyl h TYR 369 N 0.44 0.79 -0.64 1.57 0.05 -1.15 -0.11 116.97 117.93 2oyl h TYR 369 Ca 0.12 -0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 2oyl h TYR 369 Cb 0.05 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.54 2oyl h TYR 369 CO -0.03 0.69 0.24 0.78 -1.05 0.00 0.00 178.16 178.79 2oyl h GLY 370 N 0.94 1.04 0.89 3.88 0.00 -0.99 -0.70 103.07 108.13 2oyl h GLY 370 Ca 0.16 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 2oyl h GLY 370 CO 0.00 0.54 0.09 -0.84 0.00 0.00 0.00 176.54 176.33 2oyl h THR 371 N 0.90 1.18 -0.60 4.70 2.02 -0.80 -1.19 112.91 119.12 2oyl h THR 371 Ca 0.21 -0.55 0.06 0.00 0.77 0.00 0.00 66.41 66.89 2oyl h THR 371 Cb 0.23 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.68 2oyl h THR 371 CO -0.01 0.18 0.32 0.00 0.37 0.00 0.00 175.52 176.38 2oyl h ALA 372 N 0.92 0.80 -0.24 6.16 0.00 -0.87 -0.74 119.26 125.28 2oyl h ALA 372 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2oyl h ALA 372 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2oyl h ALA 372 CO -0.00 -0.02 0.16 -0.09 0.00 0.00 0.00 179.25 179.29 2oyl h ARG 373 N 0.60 0.32 -0.23 0.00 2.43 -0.92 0.51 114.38 117.09 2oyl h ARG 373 Ca 0.27 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 2oyl h ARG 373 Cb 0.18 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2oyl h ARG 373 CO -0.18 0.21 0.03 0.93 -1.51 0.00 0.00 179.97 179.45 2oyl h GLU 374 N 0.32 0.33 -0.00 0.20 5.08 -0.73 -2.23 114.58 117.55 2oyl h GLU 374 Ca 0.09 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2oyl h GLU 374 Cb -0.03 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2oyl h GLU 374 CO -0.02 0.33 -0.14 -1.33 -1.00 0.00 0.00 179.01 176.84 2oyl n MET 375 N -4.38 0.57 -2.75 2.33 2.81 -0.33 -4.91 117.12 110.45 2oyl n MET 375 Ca 0.00 -0.20 -0.17 0.00 -1.81 0.00 0.00 57.70 55.52 2oyl n MET 375 Cb 0.17 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.21 2oyl n MET 375 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oyl n GLY 376 N 1.32 -0.24 3.91 3.03 0.00 -0.47 -4.72 105.19 108.01 2oyl n GLY 376 Ca 0.13 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2oyl n GLY 376 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyl s ALA 377 N -2.99 3.95 0.70 4.61 0.00 0.05 -4.56 121.76 123.52 2oyl s ALA 377 Ca 0.20 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 2oyl s ALA 377 Cb -0.09 -1.90 0.01 0.00 0.00 0.00 0.00 23.12 21.15 2oyl s ALA 377 CO 0.24 0.75 1.07 0.20 0.00 0.00 0.00 175.76 178.03 2oyl s GLY 378 N -2.04 1.64 -0.02 0.00 0.00 -0.61 -4.60 107.32 101.69 2oyl s GLY 378 Ca 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.85 2oyl s GLY 378 CO 0.20 0.19 0.02 0.14 0.00 0.00 0.00 173.10 173.65 2oyl s VAL 379 N -3.20 0.03 -0.29 1.40 1.01 0.23 -0.39 120.40 119.19 2oyl s VAL 379 Ca 0.58 0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.77 2oyl s VAL 379 Cb -0.12 -0.16 0.08 0.00 0.00 0.00 0.00 36.38 36.17 2oyl s VAL 379 CO 0.54 0.12 -0.04 -0.94 0.00 0.00 0.00 175.10 174.77 2oyl s SER 380 N 1.12 4.55 0.32 3.32 1.04 -0.43 -1.32 113.70 122.30 2oyl s SER 380 Ca -0.08 -1.70 -0.29 0.00 0.48 0.00 0.00 55.95 54.36 2oyl s SER 380 Cb -0.13 -1.56 -0.10 0.00 0.10 0.00 0.00 66.02 64.32 2oyl s SER 380 CO -0.03 -0.27 1.34 -0.47 0.98 0.00 0.00 173.24 174.79 2oyl s TYR 381 N 1.03 3.03 -0.50 5.02 6.14 -0.24 -3.50 117.35 128.34 2oyl s TYR 381 Ca -0.01 1.34 -0.19 0.00 0.64 0.00 0.00 57.07 58.85 2oyl s TYR 381 Cb -0.20 -3.71 0.06 0.00 0.42 0.00 0.00 41.96 38.53 2oyl s TYR 381 CO -0.06 -2.03 0.59 -0.46 0.64 0.00 0.00 175.55 174.23 2oyl s TRP 382 N -0.92 3.07 0.34 4.97 -0.11 0.16 -0.32 118.94 126.13 2oyl s TRP 382 Ca 0.51 -0.56 -0.10 0.00 1.22 0.00 0.00 56.10 57.17 2oyl s TRP 382 Cb -0.40 -3.47 0.04 0.00 -1.50 0.00 0.00 33.47 28.14 2oyl s TRP 382 CO 0.51 -0.99 0.62 -1.13 -4.62 0.00 0.00 176.95 171.35 2oyl n SER 383 N 6.05 -1.80 0.00 5.86 3.41 -1.26 -4.40 113.62 121.48 2oyl n SER 383 Ca -0.07 -2.47 0.13 0.00 -0.26 0.00 0.00 58.87 56.19 2oyl n SER 383 Cb 0.45 3.06 0.59 0.00 -0.26 0.00 0.00 64.21 68.05 2oyl n SER 383 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2oyl n SER 384 N -1.52 0.00 -4.72 4.04 3.41 -0.27 -4.24 113.62 110.32 2oyl n SER 384 Ca -0.06 0.34 -0.39 0.00 -0.26 0.00 0.00 58.87 58.51 2oyl n SER 384 Cb 0.52 -0.44 0.04 0.00 -0.26 0.00 0.00 64.21 64.06 2oyl n SER 384 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2oyl n ASP 385 N -1.44 2.39 -4.76 4.04 9.92 -1.26 -4.71 116.55 120.73 2oyl n ASP 385 Ca 0.08 0.98 -0.41 0.00 -0.53 0.00 0.00 54.79 54.91 2oyl n ASP 385 Cb 0.28 -1.54 -0.02 0.00 -0.64 0.00 0.00 41.12 39.21 2oyl n ASP 385 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2oyl s PRO 386 N -2.75 4.21 0.00 -0.24 0.04 -1.26 -4.25 135.00 130.76 2oyl s PRO 386 Ca 0.70 2.41 0.00 0.00 0.04 0.00 0.00 61.00 64.15 2oyl s PRO 386 Cb -0.43 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2oyl s PRO 386 CO 0.50 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.50 2oyl n GLY 387 N 1.54 1.57 0.27 0.56 0.00 -0.62 -4.77 105.19 103.73 2oyl n GLY 387 Ca 0.04 -1.82 0.18 0.00 0.00 0.00 0.00 46.02 44.42 2oyl n GLY 387 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oyl h PRO 388 N 0.00 0.00 0.00 1.61 0.13 -1.90 -1.65 132.00 130.19 2oyl h PRO 388 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.97 2oyl h PRO 388 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2oyl h PRO 388 CO 0.00 0.00 -0.77 -1.49 -0.23 0.00 0.00 178.00 175.51 2oyl h TRP 389 N 0.00 0.00 -5.36 1.56 4.06 -1.91 -0.57 115.95 113.73 2oyl h TRP 389 Ca 0.00 0.00 -0.41 0.00 2.06 0.00 0.00 58.89 60.54 2oyl h TRP 389 Cb 0.26 0.00 0.07 0.00 -1.00 0.00 0.00 29.16 28.49 2oyl h TRP 389 CO 0.00 0.77 0.08 0.41 -3.56 0.00 0.00 178.44 176.14 2oyl n GLY 390 N 0.71 0.80 0.23 1.49 0.00 -0.62 -4.57 105.19 103.23 2oyl n GLY 390 Ca -0.01 -2.04 0.12 0.00 0.00 0.00 0.00 46.02 44.09 2oyl n GLY 390 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oyl h PRO 391 N 0.00 0.00 -4.60 1.61 0.13 -1.81 -3.42 132.00 123.91 2oyl h PRO 391 Ca -0.28 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.47 2oyl h PRO 391 Cb 1.07 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.91 2oyl h PRO 391 CO 0.31 0.14 -0.77 0.71 -0.23 0.00 0.00 178.00 178.16 2oyl s TYR 392 N -3.52 0.73 0.91 1.56 2.02 -1.26 -0.65 117.35 117.13 2oyl s TYR 392 Ca 0.02 -0.14 -0.12 0.00 -0.37 0.00 0.00 57.07 56.46 2oyl s TYR 392 Cb 0.09 -0.47 0.13 0.00 -0.40 0.00 0.00 41.96 41.31 2oyl s TYR 392 CO 0.62 -0.02 1.10 -0.51 -1.57 0.00 0.00 175.55 175.17 2oyl s LEU 393 N -0.15 2.12 0.48 -1.29 1.43 0.52 -1.59 118.68 120.20 2oyl s LEU 393 Ca 0.03 1.33 0.23 0.00 -1.03 0.00 0.00 54.13 54.68 2oyl s LEU 393 Cb -0.04 -3.71 1.26 0.00 0.03 0.00 0.00 46.19 43.74 2oyl s LEU 393 CO -0.00 -2.64 1.90 -0.65 0.23 0.00 0.00 176.35 175.18 2oyl h PRO 394 N -1.55 0.20 -0.10 1.29 0.11 -1.89 -0.15 132.00 129.90 2oyl h PRO 394 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2oyl h PRO 394 Cb 1.30 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2oyl h PRO 394 CO 0.57 0.13 0.00 -0.40 -0.21 0.00 0.00 178.00 178.09 2oyl n ASP 395 N -4.41 0.89 0.00 -2.05 5.75 -1.26 -4.89 116.55 110.58 2oyl n ASP 395 Ca 0.17 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.29 2oyl n ASP 395 Cb 0.74 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 2oyl n ASP 395 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oyl n GLY 396 N 0.93 0.66 3.74 6.12 0.00 -0.07 -5.05 105.19 111.51 2oyl n GLY 396 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2oyl n GLY 396 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oyl s THR 397 N -2.37 3.03 0.27 2.61 2.01 -1.26 -4.71 115.64 115.22 2oyl s THR 397 Ca 0.00 0.83 -0.29 0.00 0.31 0.00 0.00 61.69 62.54 2oyl s THR 397 Cb 0.00 -3.53 -0.09 0.00 0.01 0.00 0.00 72.50 68.88 2oyl s THR 397 CO 0.00 0.11 1.25 -1.10 -0.69 0.00 0.00 174.62 174.19 2oyl s GLN 398 N 0.06 4.45 0.82 4.92 -0.21 -1.26 -0.36 119.66 128.09 2oyl s GLN 398 Ca 0.59 2.04 -0.06 0.00 0.02 0.00 0.00 55.36 57.95 2oyl s GLN 398 Cb -0.38 -3.15 0.17 0.00 1.00 0.00 0.00 33.01 30.64 2oyl s GLN 398 CO 0.38 -0.10 1.13 0.95 -2.12 0.00 0.00 175.29 175.53 2oyl s THR 399 N -0.67 2.03 0.62 -0.19 -4.23 0.17 -4.85 115.64 108.52 2oyl s THR 399 Ca 0.51 -0.41 0.30 0.00 -1.18 0.00 0.00 61.69 60.91 2oyl s THR 399 Cb -0.36 -2.62 0.35 0.00 1.34 0.00 0.00 72.50 71.21 2oyl s THR 399 CO 0.44 0.00 1.99 0.25 -0.54 0.00 0.00 174.62 176.77 2oyl h LEU 400 N -0.97 0.00 -0.96 4.79 5.85 -1.88 -2.92 115.31 119.22 2oyl h LEU 400 Ca -0.38 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.30 2oyl h LEU 400 Cb 1.25 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 2oyl h LEU 400 CO 0.36 0.00 0.29 0.25 -0.34 0.00 0.00 178.44 179.00 2oyl h LEU 401 N 0.00 0.95 0.47 2.25 5.85 -1.86 -2.75 115.31 120.22 2oyl h LEU 401 Ca 0.09 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 2oyl h LEU 401 Cb 0.72 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2oyl h LEU 401 CO -0.00 0.84 -0.24 0.58 -0.34 0.00 0.00 178.44 179.28 2oyl h VAL 402 N 1.02 0.51 -0.07 1.05 2.07 -1.75 0.15 116.25 119.22 2oyl h VAL 402 Ca 0.24 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.70 2oyl h VAL 402 Cb 0.19 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2oyl h VAL 402 CO -0.02 0.00 -0.21 0.44 0.02 0.00 0.00 177.57 177.80 2oyl h ASP 403 N -0.65 0.12 -0.32 0.57 3.32 -1.77 -1.14 116.42 116.55 2oyl h ASP 403 Ca -0.06 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 56.87 2oyl h ASP 403 Cb 0.50 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 2oyl h ASP 403 CO 0.09 0.34 -0.16 0.74 -1.72 0.00 0.00 179.24 178.54 2oyl h THR 404 N 0.11 1.29 0.00 0.35 2.02 -1.12 -3.26 112.91 112.30 2oyl h THR 404 Ca 0.02 -1.26 -0.00 0.00 0.77 0.00 0.00 66.41 65.94 2oyl h THR 404 Cb 0.45 1.43 -0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2oyl h THR 404 CO 0.03 0.41 -0.39 -0.07 0.37 0.00 0.00 175.52 175.87 2oyl h LEU 405 N 0.44 0.00 -6.77 2.58 3.38 -0.50 -3.42 115.31 111.02 2oyl h LEU 405 Ca 0.07 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.32 2oyl h LEU 405 Cb 0.69 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.34 2oyl h LEU 405 CO 0.05 0.00 2.43 -3.20 0.09 0.00 0.00 178.44 177.81 2oyl n ASN 406 N -2.94 4.58 -4.31 -0.43 5.15 -0.45 -4.89 115.26 111.97 2oyl n ASN 406 Ca 0.02 -2.94 -0.20 0.00 -0.60 0.00 0.00 54.58 50.87 2oyl n ASN 406 Cb 0.54 -1.63 -0.11 0.00 -0.53 0.00 0.00 39.78 38.05 2oyl n ASN 406 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2oyl s LYS 407 N 2.59 1.20 0.49 1.20 -0.14 -1.26 -4.90 119.74 118.91 2oyl s LYS 407 Ca 0.46 -1.39 -0.24 0.00 -1.36 0.00 0.00 55.97 53.45 2oyl s LYS 407 Cb 0.08 -1.15 -0.07 0.00 -1.68 0.00 0.00 37.83 35.01 2oyl s LYS 407 CO -0.02 0.22 1.38 -2.14 -0.76 0.00 0.00 175.35 174.04 2oyl s PRO 408 N -2.92 3.48 0.04 -1.68 0.02 -1.26 -4.82 135.00 127.85 2oyl s PRO 408 Ca 0.15 2.31 -0.18 0.00 0.02 0.00 0.00 61.00 63.29 2oyl s PRO 408 Cb -0.04 -2.49 0.04 0.00 0.02 0.00 0.00 34.50 32.02 2oyl s PRO 408 CO 0.05 -0.94 0.42 1.52 -0.33 0.00 0.00 177.00 177.72 2oyl s TYR 409 N -1.26 -0.28 0.04 6.54 1.13 -1.02 -4.74 117.35 117.76 2oyl s TYR 409 Ca 0.65 0.27 -0.30 0.00 -1.41 0.00 0.00 57.07 56.28 2oyl s TYR 409 Cb -0.42 0.22 -0.04 0.00 -1.10 0.00 0.00 41.96 40.62 2oyl s TYR 409 CO 0.52 -0.56 1.08 -2.14 -2.51 0.00 0.00 175.55 171.94 2oyl s PRO 410 N -2.34 4.50 -0.19 -3.49 0.02 -1.26 -1.02 135.00 131.23 2oyl s PRO 410 Ca -0.06 1.59 -0.17 0.00 0.02 0.00 0.00 61.00 62.38 2oyl s PRO 410 Cb -0.01 -3.40 -0.21 0.00 0.02 0.00 0.00 34.50 30.90 2oyl s PRO 410 CO -0.01 -0.14 0.24 0.54 -0.33 0.00 0.00 177.00 177.30 2oyl n ARG 411 N 3.85 0.62 -3.61 5.54 1.74 0.58 -4.36 116.66 121.02 2oyl n ARG 411 Ca 0.07 0.49 -0.16 0.00 -0.77 0.00 0.00 57.85 57.48 2oyl n ARG 411 Cb 0.49 -1.73 -0.14 0.00 -1.02 0.00 0.00 32.46 30.06 2oyl n ARG 411 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2oyl s ALA 412 N -2.42 -0.31 -0.11 7.54 0.00 -1.02 -1.57 121.76 123.87 2oyl s ALA 412 Ca -0.27 0.56 -0.02 0.00 0.00 0.00 0.00 51.96 52.23 2oyl s ALA 412 Cb 0.06 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 22.10 2oyl s ALA 412 CO 0.64 -0.81 -0.01 0.08 0.00 0.00 0.00 175.76 175.65 2oyl s VAL 413 N 2.34 4.15 -1.38 0.00 1.01 -0.05 -0.59 120.40 125.89 2oyl s VAL 413 Ca 0.04 -0.29 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 2oyl s VAL 413 Cb -0.13 -2.76 0.08 0.00 0.00 0.00 0.00 36.38 33.57 2oyl s VAL 413 CO -0.09 0.57 2.03 0.00 0.00 0.00 0.00 175.10 177.61 2oyl n ALA 414 N 2.57 5.11 0.00 5.51 0.00 -1.26 -0.68 120.51 131.76 2oyl n ALA 414 Ca -0.18 -4.00 0.00 0.00 0.00 0.00 0.00 53.44 49.26 2oyl n ALA 414 Cb 0.53 -3.39 0.00 0.00 0.00 0.00 0.00 19.45 16.59 2oyl n ALA 414 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oyl n GLY 415 N 3.98 1.07 3.66 0.00 0.00 -1.26 -4.29 105.19 108.34 2oyl n GLY 415 Ca 0.48 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 2oyl n GLY 415 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oyl s THR 416 N -1.06 4.91 -0.23 2.61 2.01 -0.77 -4.19 115.64 118.92 2oyl s THR 416 Ca 0.00 1.48 -0.29 0.00 0.31 0.00 0.00 61.69 63.19 2oyl s THR 416 Cb 0.00 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.43 2oyl s THR 416 CO 0.00 0.02 1.27 -2.16 -0.69 0.00 0.00 174.62 173.06 2oyl s PRO 417 N 2.30 4.09 0.01 4.92 0.04 -1.26 -0.13 135.00 144.97 2oyl s PRO 417 Ca 0.34 1.46 0.07 0.00 0.04 0.00 0.00 61.00 62.91 2oyl s PRO 417 Cb -0.16 -3.81 -0.24 0.00 0.04 0.00 0.00 34.50 30.34 2oyl s PRO 417 CO 0.10 -0.89 0.88 1.79 0.04 0.00 0.00 177.00 178.92 2oyl h THR 418 N 5.70 1.17 -1.96 1.26 1.35 -1.49 -3.48 112.91 115.46 2oyl h THR 418 Ca -0.26 -2.93 0.05 0.00 -0.55 0.00 0.00 66.41 62.73 2oyl h THR 418 Cb 1.10 2.63 -0.19 0.00 -1.73 0.00 0.00 68.15 69.95 2oyl h THR 418 CO 1.00 0.72 0.43 -1.83 -0.25 0.00 0.00 175.52 175.59 2oyl s GLU 419 N -2.63 0.81 0.21 4.72 -1.05 -1.24 -5.02 118.70 114.49 2oyl s GLU 419 Ca -0.05 -0.00 -0.18 0.00 -0.15 0.00 0.00 54.97 54.59 2oyl s GLU 419 Cb 0.08 0.38 0.03 0.00 -0.44 0.00 0.00 34.13 34.17 2oyl s GLU 419 CO 0.83 -0.29 0.56 1.67 0.95 0.00 0.00 175.26 178.98 2oyl s TRP 420 N -1.90 -0.11 0.07 4.83 1.48 -1.26 -0.84 118.94 121.22 2oyl s TRP 420 Ca -0.02 -0.25 -0.14 0.00 -1.06 0.00 0.00 56.10 54.63 2oyl s TRP 420 Cb -0.01 0.44 0.02 0.00 -1.16 0.00 0.00 33.47 32.77 2oyl s TRP 420 CO -0.01 -0.98 0.33 -1.54 -4.06 0.00 0.00 176.95 170.69 2oyl s SER 421 N -2.89 -0.15 -0.03 -2.66 1.04 -0.25 -5.00 113.70 103.76 2oyl s SER 421 Ca 0.10 -0.24 -0.23 0.00 0.48 0.00 0.00 55.95 56.06 2oyl s SER 421 Cb -0.02 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.55 2oyl s SER 421 CO -0.00 -0.70 0.51 -0.94 0.98 0.00 0.00 173.24 173.08 2oyl s SER 422 N -2.33 -0.44 0.33 7.02 1.04 -1.26 -1.35 113.70 116.71 2oyl s SER 422 Ca -0.02 0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.83 2oyl s SER 422 Cb 0.01 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 2oyl s SER 422 CO -0.06 -0.55 0.07 0.35 0.98 0.00 0.00 173.24 174.04 2oyl n THR 423 N 1.03 0.00 -0.17 2.02 -2.24 -0.10 -4.96 114.28 109.86 2oyl n THR 423 Ca -0.20 -1.78 0.18 0.00 -2.27 0.00 0.00 64.05 59.97 2oyl n THR 423 Cb 0.57 0.55 0.54 0.00 -2.10 0.00 0.00 70.33 69.88 2oyl n THR 423 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2oyl h SER 424 N 1.12 0.33 0.00 3.42 0.02 -1.98 -3.12 113.55 113.33 2oyl h SER 424 Ca -0.26 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.62 2oyl h SER 424 Cb 0.92 -0.04 -0.19 0.00 0.14 0.00 0.00 62.40 63.23 2oyl h SER 424 CO 0.42 0.16 -0.75 -0.90 -1.14 0.00 0.00 176.83 174.62 2oyl n ASP 425 N -4.46 1.34 -3.63 3.07 5.68 -1.26 -3.97 116.55 113.32 2oyl n ASP 425 Ca 0.15 -2.92 -0.14 0.00 -0.50 0.00 0.00 54.79 51.38 2oyl n ASP 425 Cb 0.61 -0.41 -0.07 0.00 -1.14 0.00 0.00 41.12 40.11 2oyl n ASP 425 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 2oyl s ARG 426 N -1.58 0.82 -0.02 0.11 3.52 -1.18 -4.24 118.95 116.38 2oyl s ARG 426 Ca 0.35 0.79 0.01 0.00 -0.13 0.00 0.00 55.73 56.75 2oyl s ARG 426 Cb 0.37 0.40 0.01 0.00 -1.56 0.00 0.00 34.95 34.17 2oyl s ARG 426 CO -0.12 -0.13 -0.03 -1.17 -0.81 0.00 0.00 175.30 173.04 2oyl s LEU 427 N 0.06 1.67 -0.02 -0.88 0.20 -0.55 -0.92 118.68 118.23 2oyl s LEU 427 Ca -0.02 -0.07 0.04 0.00 0.69 0.00 0.00 54.13 54.76 2oyl s LEU 427 Cb -0.04 -0.25 -0.00 0.00 -0.43 0.00 0.00 46.19 45.46 2oyl s LEU 427 CO 0.02 -0.01 -0.13 -1.58 -0.29 0.00 0.00 176.35 174.37 2oyl s GLN 428 N 0.37 1.15 -0.04 1.98 0.74 -0.46 -0.13 119.66 123.28 2oyl s GLN 428 Ca -0.04 -0.44 -0.02 0.00 0.05 0.00 0.00 55.36 54.92 2oyl s GLN 428 Cb -0.07 -1.07 0.03 0.00 1.10 0.00 0.00 33.01 32.99 2oyl s GLN 428 CO -0.01 0.22 0.08 -1.17 -0.55 0.00 0.00 175.29 173.87 2oyl s LEU 429 N -0.10 1.08 -0.12 3.68 2.96 -0.09 -1.10 118.68 125.00 2oyl s LEU 429 Ca 0.01 0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 54.06 2oyl s LEU 429 Cb -0.07 0.16 -0.03 0.00 0.50 0.00 0.00 46.19 46.75 2oyl s LEU 429 CO 0.00 -0.11 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.97 2oyl s THR 430 N 0.89 3.79 -0.09 3.68 2.01 -0.02 -0.12 115.64 125.79 2oyl s THR 430 Ca -0.07 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 61.55 2oyl s THR 430 Cb -0.10 -2.61 0.00 0.00 0.01 0.00 0.00 72.50 69.80 2oyl s THR 430 CO -0.03 0.54 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.59 2oyl s ILE 431 N -0.14 1.86 -0.38 1.82 1.01 0.38 -1.12 121.20 124.64 2oyl s ILE 431 Ca 0.02 -0.91 -0.25 0.00 0.00 0.00 0.00 60.65 59.52 2oyl s ILE 431 Cb -0.13 -1.62 0.01 0.00 0.01 0.00 0.00 42.46 40.74 2oyl s ILE 431 CO 0.03 0.52 0.87 -0.70 0.00 0.00 0.00 174.94 175.65 2oyl s GLU 432 N 0.36 3.76 0.78 2.79 2.12 0.82 -1.44 118.70 127.88 2oyl s GLU 432 Ca -0.17 0.41 -0.11 0.00 0.36 0.00 0.00 54.97 55.46 2oyl s GLU 432 Cb -0.17 -3.82 0.06 0.00 0.26 0.00 0.00 34.13 30.46 2oyl s GLU 432 CO 0.07 -0.95 1.11 -1.25 -0.54 0.00 0.00 175.26 173.70 2oyl s PRO 433 N 3.36 2.14 -0.27 4.30 0.04 -1.26 -1.84 135.00 141.48 2oyl s PRO 433 Ca 0.35 1.27 -0.02 0.00 0.04 0.00 0.00 61.00 62.64 2oyl s PRO 433 Cb -0.12 -1.88 0.11 0.00 0.04 0.00 0.00 34.50 32.66 2oyl s PRO 433 CO 0.19 -1.74 0.23 0.34 0.04 0.00 0.00 177.00 176.06 2oyl s ASP 434 N -3.14 2.07 0.61 6.66 -1.08 -1.26 -4.83 116.67 115.70 2oyl s ASP 434 Ca 0.63 -0.75 0.38 0.00 -0.52 0.00 0.00 52.55 52.30 2oyl s ASP 434 Cb -0.19 0.25 1.99 0.00 -1.46 0.00 0.00 42.92 43.51 2oyl s ASP 434 CO 0.54 -0.39 2.23 0.00 0.52 0.00 0.00 175.17 178.08 2oyl h ALA 435 N 8.31 1.08 0.00 3.66 0.00 -1.95 -2.50 119.26 127.87 2oyl h ALA 435 Ca -0.16 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2oyl h ALA 435 Cb 1.08 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2oyl h ALA 435 CO 0.35 0.02 -0.10 0.00 0.00 0.00 0.00 179.25 179.52 2oyl h ALA 436 N 1.98 1.00 -2.32 0.00 0.00 -1.99 -3.43 119.26 114.50 2oyl h ALA 436 Ca -0.00 -0.09 -0.58 0.00 0.00 0.00 0.00 54.91 54.24 2oyl h ALA 436 Cb 0.17 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 2oyl h ALA 436 CO 0.00 0.13 0.47 0.42 0.00 0.00 0.00 179.25 180.26 2oyl s ILE 437 N -3.59 4.84 -0.05 0.00 1.01 -0.94 -4.93 121.20 117.54 2oyl s ILE 437 Ca 0.02 1.68 0.20 0.00 0.00 0.00 0.00 60.65 62.54 2oyl s ILE 437 Cb 0.09 -4.16 -0.30 0.00 0.01 0.00 0.00 42.46 38.10 2oyl s ILE 437 CO 0.60 -0.02 0.38 0.35 0.00 0.00 0.00 174.94 176.25 2oyl n THR 438 N 4.93 0.21 -2.28 2.92 -2.24 -1.26 -4.98 114.28 111.58 2oyl n THR 438 Ca 0.06 -0.51 -0.35 0.00 -2.27 0.00 0.00 64.05 60.97 2oyl n THR 438 Cb 0.48 -0.05 -0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2oyl n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oyl s ALA 439 N -3.25 2.76 0.67 6.98 0.00 -1.26 -5.03 121.76 122.63 2oyl s ALA 439 Ca -0.08 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 52.60 2oyl s ALA 439 Cb 0.12 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 2oyl s ALA 439 CO 0.83 -0.72 1.05 -1.25 0.00 0.00 0.00 175.76 175.67 2oyl s PRO 440 N -3.17 3.18 0.22 0.00 0.04 -1.26 -4.73 135.00 129.28 2oyl s PRO 440 Ca 0.71 0.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 2oyl s PRO 440 Cb -0.24 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.18 2oyl s PRO 440 CO 0.28 -0.89 1.33 0.99 0.04 0.00 0.00 177.00 178.75 2oyl s THR 441 N -3.13 3.07 -0.13 1.26 2.01 -0.53 -4.62 115.64 113.56 2oyl s THR 441 Ca 0.57 0.90 0.02 0.00 0.31 0.00 0.00 61.69 63.49 2oyl s THR 441 Cb -0.12 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.81 2oyl s THR 441 CO 0.54 0.14 -0.20 -0.70 -0.69 0.00 0.00 174.62 173.71 2oyl s GLU 442 N -0.31 3.09 -0.01 4.92 2.12 0.24 -1.09 118.70 127.66 2oyl s GLU 442 Ca 0.56 -0.83 0.03 0.00 0.36 0.00 0.00 54.97 55.09 2oyl s GLU 442 Cb -0.38 -2.46 -0.00 0.00 0.26 0.00 0.00 34.13 31.55 2oyl s GLU 442 CO 0.40 0.05 -0.10 0.42 -0.54 0.00 0.00 175.26 175.49 2oyl s ILE 443 N 0.68 0.80 -0.10 -3.70 1.01 0.12 -0.31 121.20 119.71 2oyl s ILE 443 Ca -0.10 -0.41 -0.19 0.00 0.00 0.00 0.00 60.65 59.95 2oyl s ILE 443 Cb -0.16 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 2oyl s ILE 443 CO 0.01 0.23 0.52 -0.47 0.00 0.00 0.00 174.94 175.24 2oyl s TYR 444 N -0.08 3.54 -0.17 3.97 5.04 -0.18 -0.70 117.35 128.77 2oyl s TYR 444 Ca 0.01 0.98 0.00 0.00 -2.44 0.00 0.00 57.07 55.62 2oyl s TYR 444 Cb -0.06 -2.59 0.04 0.00 0.35 0.00 0.00 41.96 39.70 2oyl s TYR 444 CO -0.00 0.18 -0.08 -0.51 -1.34 0.00 0.00 175.55 173.80 2oyl s LEU 445 N 0.55 1.79 0.45 6.97 1.43 -0.69 -2.43 118.68 126.75 2oyl s LEU 445 Ca 0.28 -0.68 -0.24 0.00 -1.03 0.00 0.00 54.13 52.47 2oyl s LEU 445 Cb -0.16 -1.04 -0.07 0.00 0.03 0.00 0.00 46.19 44.94 2oyl s LEU 445 CO 0.12 -0.15 1.25 -2.16 0.23 0.00 0.00 176.35 175.64 2oyl s PRO 446 N 1.54 3.74 0.39 1.29 0.04 -1.26 -4.79 135.00 135.95 2oyl s PRO 446 Ca 0.01 1.99 0.17 0.00 0.04 0.00 0.00 61.00 63.22 2oyl s PRO 446 Cb -0.15 -2.52 0.81 0.00 0.04 0.00 0.00 34.50 32.68 2oyl s PRO 446 CO -0.08 -0.63 1.82 1.49 0.04 0.00 0.00 177.00 179.64 2oyl h GLU 447 N 2.21 0.00 -0.27 4.56 4.81 -1.96 -1.98 114.58 121.95 2oyl h GLU 447 Ca -0.50 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 58.79 2oyl h GLU 447 Cb 1.26 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.58 2oyl h GLU 447 CO 0.61 0.35 -0.10 0.00 -0.73 0.00 0.00 179.01 179.13 2oyl h ALA 448 N 1.65 0.13 0.00 2.92 0.00 -1.93 -2.53 119.26 119.51 2oyl h ALA 448 Ca -0.00 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2oyl h ALA 448 Cb 0.72 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2oyl h ALA 448 CO 0.05 -0.50 -0.86 0.78 0.00 0.00 0.00 179.25 178.71 2oyl h GLY 449 N -0.06 0.00 -6.22 0.00 0.00 -1.67 -3.40 103.07 91.73 2oyl h GLY 449 Ca 0.14 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.88 2oyl h GLY 449 CO -0.31 0.00 -0.73 0.69 0.00 0.00 0.00 176.54 176.18 2oyl n PHE 450 N -2.86 2.46 0.58 5.60 3.01 -0.75 -4.69 117.46 120.80 2oyl n PHE 450 Ca -0.01 -3.99 0.11 0.00 1.01 0.00 0.00 57.45 54.56 2oyl n PHE 450 Cb 0.63 -0.49 0.44 0.00 -0.01 0.00 0.00 39.48 40.05 2oyl n PHE 450 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2oyl n PRO 451 N 1.14 0.11 0.00 -1.08 -0.04 -0.97 -4.50 135.00 129.66 2oyl n PRO 451 Ca 0.27 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 2oyl n PRO 451 Cb 0.44 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 2oyl n PRO 451 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2oyl n GLY 452 N 0.48 3.42 3.99 0.55 0.00 -1.26 -5.09 105.19 107.28 2oyl n GLY 452 Ca 0.04 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2oyl n GLY 452 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2oyl s ASP 453 N 1.00 4.88 0.18 1.61 2.15 -1.26 -4.96 116.67 120.27 2oyl s ASP 453 Ca 0.00 -0.29 0.08 0.00 0.43 0.00 0.00 52.55 52.77 2oyl s ASP 453 Cb 0.00 -0.35 -0.04 0.00 -0.30 0.00 0.00 42.92 42.23 2oyl s ASP 453 CO 0.00 -1.45 -0.05 0.68 -0.17 0.00 0.00 175.17 174.18 2oyl s VAL 454 N -2.89 3.45 -0.21 1.11 -7.23 -1.26 -1.35 120.40 112.03 2oyl s VAL 454 Ca 0.62 -1.55 -0.01 0.00 -1.81 0.00 0.00 61.98 59.23 2oyl s VAL 454 Cb -0.08 -2.73 0.01 0.00 0.56 0.00 0.00 36.38 34.15 2oyl s VAL 454 CO 0.41 -0.11 -0.12 -2.28 -0.31 0.00 0.00 175.10 172.68 2oyl s HIS 455 N -1.73 2.90 -0.15 2.82 2.46 0.12 -4.57 115.29 117.14 2oyl s HIS 455 Ca 0.26 -1.39 0.02 0.00 0.47 0.00 0.00 55.06 54.42 2oyl s HIS 455 Cb -0.09 -2.01 0.01 0.00 -0.13 0.00 0.00 32.58 30.37 2oyl s HIS 455 CO 0.17 -0.70 -0.21 0.08 -2.47 0.00 0.00 174.74 171.60 2oyl s VAL 456 N 1.36 2.07 -0.11 0.89 1.01 -1.26 -1.21 120.40 123.15 2oyl s VAL 456 Ca 0.04 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 2oyl s VAL 456 Cb -0.14 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 2oyl s VAL 456 CO -0.08 0.55 -0.02 -1.61 0.00 0.00 0.00 175.10 173.93 2oyl s GLU 457 N 0.96 3.21 0.00 2.72 2.02 -0.32 -4.64 118.70 122.65 2oyl s GLU 457 Ca -0.03 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.49 2oyl s GLU 457 Cb -0.15 -2.81 0.00 0.00 0.10 0.00 0.00 34.13 31.27 2oyl s GLU 457 CO -0.05 0.53 0.00 0.41 0.02 0.00 0.00 175.26 176.16 2oyl n GLY 458 N 2.68 0.72 3.32 -1.39 0.00 -1.26 -1.01 105.19 108.24 2oyl n GLY 458 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 2oyl n GLY 458 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyl s ALA 459 N -2.76 -0.98 -0.10 4.61 0.00 -1.26 -4.65 121.76 116.62 2oyl s ALA 459 Ca 0.00 -0.00 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 2oyl s ALA 459 Cb 0.00 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.76 2oyl s ALA 459 CO 0.00 -0.64 0.33 -0.51 0.00 0.00 0.00 175.76 174.94 2oyl s ASP 460 N -2.77 6.57 -0.02 0.00 1.01 -0.40 -4.89 116.67 116.17 2oyl s ASP 460 Ca 0.02 0.68 -0.30 0.00 0.71 0.00 0.00 52.55 53.66 2oyl s ASP 460 Cb 0.02 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.70 2oyl s ASP 460 CO -0.12 0.19 1.25 -0.69 0.21 0.00 0.00 175.17 176.02 2oyl s VAL 461 N -0.16 4.07 -0.20 -1.27 1.01 -1.26 -0.40 120.40 122.19 2oyl s VAL 461 Ca 0.20 1.43 -0.13 0.00 0.00 0.00 0.00 61.98 63.48 2oyl s VAL 461 Cb -0.14 -3.92 -0.20 0.00 0.00 0.00 0.00 36.38 32.12 2oyl s VAL 461 CO 0.08 0.02 0.11 0.52 0.00 0.00 0.00 175.10 175.83 2oyl n VAL 462 N 4.50 1.61 -3.54 2.92 0.31 0.71 -4.91 118.33 119.93 2oyl n VAL 462 Ca 0.11 -0.35 -0.16 0.00 -0.01 0.00 0.00 64.34 63.93 2oyl n VAL 462 Cb 0.46 -1.84 -0.06 0.00 -0.91 0.00 0.00 33.84 31.49 2oyl n VAL 462 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2oyl s GLY 463 N -5.40 -0.52 -0.26 2.92 0.00 -1.00 -4.99 107.32 98.08 2oyl s GLY 463 Ca -0.29 0.99 -0.03 0.00 0.00 0.00 0.00 44.72 45.39 2oyl s GLY 463 CO 0.63 0.66 0.10 0.86 0.00 0.00 0.00 173.10 175.35 2oyl s TRP 464 N -1.78 0.79 -0.47 1.90 -0.00 -1.26 -0.42 118.94 117.69 2oyl s TRP 464 Ca -0.08 -1.01 -0.18 0.00 -0.00 0.00 0.00 56.10 54.83 2oyl s TRP 464 Cb -0.01 -1.10 0.05 0.00 -0.00 0.00 0.00 33.47 32.41 2oyl s TRP 464 CO 0.04 -0.75 0.52 0.34 -0.00 0.00 0.00 176.95 177.10 2oyl s ASP 465 N 1.94 6.20 0.00 5.86 -1.08 -0.48 -4.93 116.67 124.18 2oyl s ASP 465 Ca 0.06 -0.93 0.29 0.00 -0.52 0.00 0.00 52.55 51.45 2oyl s ASP 465 Cb -0.17 -2.25 1.28 0.00 -1.46 0.00 0.00 42.92 40.33 2oyl s ASP 465 CO -0.24 -0.75 1.95 0.54 0.52 0.00 0.00 175.17 177.18 2oyl n ARG 466 N 5.80 0.08 -0.12 4.34 1.74 -1.26 -0.58 116.66 126.66 2oyl n ARG 466 Ca -0.08 -0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.75 2oyl n ARG 466 Cb 0.46 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.29 2oyl n ARG 466 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2oyl n GLN 467 N -1.46 0.57 0.18 5.56 6.02 -1.26 -4.32 117.38 122.67 2oyl n GLN 467 Ca 0.08 0.46 0.14 0.00 -0.01 0.00 0.00 57.00 57.67 2oyl n GLN 467 Cb 0.32 -1.65 0.44 0.00 1.02 0.00 0.00 30.24 30.37 2oyl n GLN 467 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2oyl h SER 468 N -1.00 0.00 -0.87 1.08 4.64 -2.00 -3.47 113.55 111.93 2oyl h SER 468 Ca -0.48 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 2oyl h SER 468 Cb 1.41 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.45 2oyl h SER 468 CO -0.29 0.00 -0.21 0.54 -0.87 0.00 0.00 176.83 176.00 2oyl n ARG 469 N -2.67 -0.71 -3.64 4.77 5.12 0.25 -4.98 116.66 114.81 2oyl n ARG 469 Ca 0.03 0.67 -0.39 0.00 -1.93 0.00 0.00 57.85 56.23 2oyl n ARG 469 Cb 0.38 -4.63 -0.11 0.00 -1.16 0.00 0.00 32.46 26.93 2oyl n ARG 469 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2oyl s LEU 470 N -2.43 4.11 -0.09 0.55 1.43 -0.98 -1.71 118.68 119.56 2oyl s LEU 470 Ca 0.00 -0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 52.49 2oyl s LEU 470 Cb 0.00 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.15 2oyl s LEU 470 CO 0.00 -0.18 0.46 -0.22 0.23 0.00 0.00 176.35 176.65 2oyl s LEU 471 N 1.64 4.32 -0.09 1.79 2.96 0.12 -1.38 118.68 128.05 2oyl s LEU 471 Ca 0.05 0.85 0.03 0.00 -0.22 0.00 0.00 54.13 54.85 2oyl s LEU 471 Cb -0.17 -2.68 -0.01 0.00 0.50 0.00 0.00 46.19 43.83 2oyl s LEU 471 CO 0.07 0.07 -0.20 0.42 -1.32 0.00 0.00 176.35 175.39 2oyl s THR 472 N 0.26 2.45 0.16 3.68 -4.23 0.44 -0.70 115.64 117.71 2oyl s THR 472 Ca 0.25 -0.90 0.04 0.00 -1.18 0.00 0.00 61.69 59.90 2oyl s THR 472 Cb -0.16 -1.96 -0.05 0.00 1.34 0.00 0.00 72.50 71.68 2oyl s THR 472 CO 0.11 0.56 -0.08 0.68 -0.54 0.00 0.00 174.62 175.35 2oyl s VAL 473 N 0.06 1.11 -0.05 2.29 -7.23 -0.25 -0.20 120.40 116.13 2oyl s VAL 473 Ca -0.08 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.08 2oyl s VAL 473 Cb -0.15 -1.96 -0.00 0.00 0.56 0.00 0.00 36.38 34.82 2oyl s VAL 473 CO 0.05 -0.65 -0.17 -0.60 -0.31 0.00 0.00 175.10 173.43 2oyl s ARG 474 N -3.78 1.88 0.12 4.82 3.52 0.46 -1.45 118.95 124.52 2oyl s ARG 474 Ca 0.19 -0.61 0.07 0.00 -0.13 0.00 0.00 55.73 55.26 2oyl s ARG 474 Cb 0.03 -1.60 -0.04 0.00 -1.56 0.00 0.00 34.95 31.79 2oyl s ARG 474 CO 0.02 0.21 -0.18 0.95 -0.81 0.00 0.00 175.30 175.50 2oyl s THR 475 N 0.15 1.59 0.63 4.11 -4.23 -1.26 -1.28 115.64 115.35 2oyl s THR 475 Ca -0.06 -1.67 -0.17 0.00 -1.18 0.00 0.00 61.69 58.61 2oyl s THR 475 Cb -0.13 -1.58 -0.01 0.00 1.34 0.00 0.00 72.50 72.12 2oyl s THR 475 CO 0.03 -0.23 1.15 -2.16 -0.54 0.00 0.00 174.62 172.87 2oyl s PRO 476 N -2.32 2.86 0.00 3.99 0.04 -1.26 -4.97 135.00 133.33 2oyl s PRO 476 Ca 0.09 1.59 0.12 0.00 0.04 0.00 0.00 61.00 62.84 2oyl s PRO 476 Cb -0.08 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2oyl s PRO 476 CO 0.04 -1.24 0.73 0.00 0.04 0.00 0.00 177.00 176.57 2oyl n ALA 477 N -2.03 2.92 -0.90 8.56 0.00 -1.26 -4.63 120.51 123.17 2oyl n ALA 477 Ca 0.12 -0.48 0.08 0.00 0.00 0.00 0.00 53.44 53.16 2oyl n ALA 477 Cb 0.51 -0.43 0.22 0.00 0.00 0.00 0.00 19.45 19.76 2oyl n ALA 477 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2oyl n ASP 478 N -0.14 3.50 -0.24 0.00 5.75 -1.26 -4.62 116.55 119.54 2oyl n ASP 478 Ca 0.05 -2.91 0.07 0.00 -0.01 0.00 0.00 54.79 51.99 2oyl n ASP 478 Cb 0.26 -0.48 0.10 0.00 -1.03 0.00 0.00 41.12 39.96 2oyl n ASP 478 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2oyl n SER 479 N -0.56 1.57 -0.03 -1.12 7.64 -1.26 -5.12 113.62 114.74 2oyl n SER 479 Ca 0.19 -2.76 0.00 0.00 1.01 0.00 0.00 58.87 57.31 2oyl n SER 479 Cb 0.79 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 2oyl n SER 479 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oyl n GLY 480 N -0.95 -1.51 3.75 0.23 0.00 -1.26 -4.85 105.19 100.60 2oyl n GLY 480 Ca 0.11 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 2oyl n GLY 480 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oyl s ASN 481 N -4.00 6.82 -0.11 1.61 -0.87 -1.26 -4.50 114.94 112.63 2oyl s ASN 481 Ca 0.00 2.53 0.01 0.00 -1.57 0.00 0.00 52.86 53.83 2oyl s ASN 481 Cb 0.00 -2.62 -0.02 0.00 -0.02 0.00 0.00 41.25 38.59 2oyl s ASN 481 CO 0.00 -0.55 -0.14 -0.69 -2.57 0.00 0.00 177.10 173.15 2oyl s VAL 482 N -0.29 3.04 -0.22 1.60 1.01 -0.52 -4.91 120.40 120.11 2oyl s VAL 482 Ca 0.55 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 2oyl s VAL 482 Cb -0.38 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 2oyl s VAL 482 CO 0.43 0.54 0.04 -0.89 0.00 0.00 0.00 175.10 175.22 2oyl s THR 483 N 0.07 4.20 -0.16 3.92 2.01 -1.26 -0.47 115.64 123.96 2oyl s THR 483 Ca -0.05 -0.22 -0.04 0.00 0.31 0.00 0.00 61.69 61.68 2oyl s THR 483 Cb -0.15 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 2oyl s THR 483 CO 0.04 0.39 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.66 2oyl s VAL 484 N 1.22 4.09 -0.11 3.82 1.01 0.83 -4.32 120.40 126.94 2oyl s VAL 484 Ca 0.04 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2oyl s VAL 484 Cb -0.14 -2.80 0.02 0.00 0.00 0.00 0.00 36.38 33.45 2oyl s VAL 484 CO 0.02 0.49 -0.15 -0.89 0.00 0.00 0.00 175.10 174.58 2oyl s THR 485 N 0.29 1.48 -0.16 3.92 2.01 -0.18 -0.91 115.64 122.09 2oyl s THR 485 Ca -0.02 -0.63 0.01 0.00 0.31 0.00 0.00 61.69 61.36 2oyl s THR 485 Cb -0.14 -1.36 0.01 0.00 0.01 0.00 0.00 72.50 71.02 2oyl s THR 485 CO 0.02 0.44 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.52 2oyl s VAL 486 N 1.04 2.32 0.16 3.82 1.01 0.82 -1.17 120.40 128.40 2oyl s VAL 486 Ca -0.05 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2oyl s VAL 486 Cb -0.15 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2oyl s VAL 486 CO -0.02 0.53 0.01 0.42 0.00 0.00 0.00 175.10 176.03 2oyl s THR 487 N 0.98 0.53 0.50 3.92 -4.23 -0.35 -1.49 115.64 115.51 2oyl s THR 487 Ca -0.03 -1.96 -0.20 0.00 -1.18 0.00 0.00 61.69 58.32 2oyl s THR 487 Cb -0.15 -2.06 -0.07 0.00 1.34 0.00 0.00 72.50 71.56 2oyl s THR 487 CO -0.04 -0.51 1.10 -2.84 -0.54 0.00 0.00 174.62 171.78 2oyl s PRO 488 N -3.94 3.62 0.54 3.99 0.02 -1.26 0.15 135.00 138.13 2oyl s PRO 488 Ca 0.23 1.54 -0.22 0.00 0.02 0.00 0.00 61.00 62.57 2oyl s PRO 488 Cb 0.06 -2.13 -0.05 0.00 0.02 0.00 0.00 34.50 32.41 2oyl s PRO 488 CO 0.02 -0.61 1.35 0.00 -0.33 0.00 0.00 177.00 177.44 2oyl s ALA 489 N -1.81 2.82 -2.00 -1.55 0.00 -0.45 -4.46 121.76 114.31 2oyl s ALA 489 Ca 0.69 1.32 0.14 0.00 0.00 0.00 0.00 51.96 54.11 2oyl s ALA 489 Cb -0.22 -3.56 0.83 0.00 0.00 0.00 0.00 23.12 20.17 2oyl s ALA 489 CO 0.25 -1.35 1.25 0.00 0.00 0.00 0.00 175.76 175.92