#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l2a s PRO 29 N 0.00 4.16 0.02 1.61 0.04 -1.26 -4.73 135.00 134.85 1l2a s PRO 29 Ca 0.00 1.88 -0.03 0.00 0.04 0.00 0.00 61.00 62.89 1l2a s PRO 29 Cb 0.00 -2.78 -0.02 0.00 0.04 0.00 0.00 34.50 31.74 1l2a s PRO 29 CO 0.00 -0.24 0.04 -0.08 0.04 0.00 0.00 177.00 176.75 1l2a s THR 30 N -1.35 0.12 0.47 1.26 -1.32 -0.95 -5.00 115.64 108.87 1l2a s THR 30 Ca 0.55 -0.99 -0.24 0.00 -1.21 0.00 0.00 61.69 59.79 1l2a s THR 30 Cb -0.32 -0.57 -0.08 0.00 -1.51 0.00 0.00 72.50 70.02 1l2a s THR 30 CO 0.41 -0.55 1.23 0.29 -2.21 0.00 0.00 174.62 173.79 1l2a n LYS 31 N 1.23 1.73 -2.26 7.08 4.76 -1.26 -3.15 118.16 126.29 1l2a n LYS 31 Ca -0.22 0.62 -0.42 0.00 -2.87 0.00 0.00 58.31 55.43 1l2a n LYS 31 Cb 0.56 -2.37 -0.03 0.00 -1.84 0.00 0.00 35.03 31.35 1l2a n LYS 31 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1l2a s ALA 32 N -1.26 3.52 -1.24 7.82 0.00 -0.47 -4.87 121.76 125.26 1l2a s ALA 32 Ca 0.65 1.02 0.23 0.00 0.00 0.00 0.00 51.96 53.85 1l2a s ALA 32 Cb -0.48 -3.51 1.09 0.00 0.00 0.00 0.00 23.12 20.22 1l2a s ALA 32 CO 0.55 -0.56 1.75 -0.35 0.00 0.00 0.00 175.76 177.15 1l2a n PRO 33 N 4.00 0.19 -1.46 0.00 -0.04 -1.26 -4.94 135.00 131.48 1l2a n PRO 33 Ca 0.11 0.08 -0.55 0.00 -0.04 0.00 0.00 63.50 63.10 1l2a n PRO 33 Cb 0.44 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.34 1l2a n PRO 33 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1l2a n THR 34 N -1.38 0.78 -2.27 0.52 -1.04 -1.26 -4.91 114.28 104.71 1l2a n THR 34 Ca 0.09 -0.20 -0.41 0.00 -2.04 0.00 0.00 64.05 61.49 1l2a n THR 34 Cb 0.22 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.70 1l2a n THR 34 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 1l2a s LYS 35 N -0.39 4.45 0.46 -2.82 0.00 -1.26 -4.86 119.74 115.32 1l2a s LYS 35 Ca 0.80 2.01 -0.24 0.00 0.00 0.00 0.00 55.97 58.54 1l2a s LYS 35 Cb -1.14 -3.18 -0.09 0.00 0.00 0.00 0.00 37.83 33.43 1l2a s LYS 35 CO 0.57 -0.12 1.21 -0.25 0.00 0.00 0.00 175.35 176.75 1l2a n ASP 36 N 1.93 2.16 0.00 0.03 9.92 -1.26 -2.75 116.55 126.58 1l2a n ASP 36 Ca 0.03 1.05 0.00 0.00 -0.53 0.00 0.00 54.79 55.34 1l2a n ASP 36 Cb 0.43 -1.47 0.00 0.00 -0.64 0.00 0.00 41.12 39.44 1l2a n ASP 36 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l2a n GLY 37 N 0.92 0.75 3.73 0.44 0.00 0.12 -5.00 105.19 106.16 1l2a n GLY 37 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1l2a n GLY 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l2a s THR 38 N -2.64 3.32 0.44 2.61 2.01 -1.11 -4.79 115.64 115.48 1l2a s THR 38 Ca 0.00 1.02 -0.23 0.00 0.31 0.00 0.00 61.69 62.79 1l2a s THR 38 Cb 0.00 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.78 1l2a s THR 38 CO 0.00 0.12 1.13 -0.94 -0.69 0.00 0.00 174.62 174.24 1l2a s SER 39 N 0.63 6.35 0.45 3.53 1.04 -1.26 -0.42 113.70 124.02 1l2a s SER 39 Ca 0.59 2.22 0.13 0.00 0.48 0.00 0.00 55.95 59.37 1l2a s SER 39 Cb -0.36 -2.60 1.05 0.00 0.10 0.00 0.00 66.02 64.21 1l2a s SER 39 CO 0.35 -0.78 2.03 1.88 0.98 0.00 0.00 173.24 177.69 1l2a h TYR 40 N 2.18 0.36 -0.21 5.02 0.05 -1.88 -0.84 116.97 121.65 1l2a h TYR 40 Ca -0.49 0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.35 1l2a h TYR 40 Cb 1.24 -0.12 -0.06 0.00 1.01 0.00 0.00 36.73 38.80 1l2a h TYR 40 CO 0.55 0.19 -0.17 -0.22 -1.05 0.00 0.00 178.16 177.46 1l2a h LYS 41 N 0.36 -0.17 -0.37 4.88 3.64 -1.91 0.01 116.57 123.01 1l2a h LYS 41 Ca 0.20 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 1l2a h LYS 41 Cb 0.34 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1l2a h LYS 41 CO -0.05 -0.11 -0.21 -0.44 -2.27 0.00 0.00 179.45 176.37 1l2a h ASP 42 N -0.18 0.73 -0.33 4.20 3.32 -1.59 -0.89 116.42 121.69 1l2a h ASP 42 Ca 0.12 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.92 1l2a h ASP 42 Cb 0.36 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1l2a h ASP 42 CO -0.31 0.93 0.20 -0.07 -1.72 0.00 0.00 179.24 178.27 1l2a h LEU 43 N 0.64 0.39 -1.13 1.55 3.38 -0.89 -0.77 115.31 118.48 1l2a h LEU 43 Ca 0.09 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1l2a h LEU 43 Cb 0.70 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 1l2a h LEU 43 CO 0.05 0.32 0.49 0.15 0.09 0.00 0.00 178.44 179.55 1l2a h PHE 44 N 0.43 1.05 -0.30 1.13 3.57 -0.73 -1.30 116.94 120.79 1l2a h PHE 44 Ca 0.12 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 1l2a h PHE 44 Cb -0.00 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1l2a h PHE 44 CO -0.04 0.69 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.38 1l2a h LEU 45 N 1.11 0.63 0.04 0.59 3.38 -0.63 0.15 115.31 120.58 1l2a h LEU 45 Ca 0.29 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1l2a h LEU 45 Cb -0.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1l2a h LEU 45 CO -0.06 0.88 -0.02 -0.08 0.09 0.00 0.00 178.44 179.25 1l2a h GLU 46 N 0.53 -0.06 -0.48 1.13 4.81 -0.73 -1.62 114.58 118.16 1l2a h GLU 46 Ca 0.07 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1l2a h GLU 46 Cb 0.75 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 1l2a h GLU 46 CO 0.06 0.04 0.08 1.25 -0.73 0.00 0.00 179.01 179.71 1l2a h LEU 47 N -0.14 0.76 -0.19 1.64 6.46 -0.98 -2.33 115.31 120.53 1l2a h LEU 47 Ca -0.01 -0.26 0.05 0.00 -0.12 0.00 0.00 57.88 57.55 1l2a h LEU 47 Cb 0.12 -0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 39.79 1l2a h LEU 47 CO 0.01 0.83 -0.17 0.22 -0.62 0.00 0.00 178.44 178.71 1l2a h TYR 48 N 0.67 -0.43 -0.94 1.25 3.20 -0.69 -0.28 116.97 119.75 1l2a h TYR 48 Ca 0.15 0.03 0.16 0.00 3.14 0.00 0.00 58.73 62.20 1l2a h TYR 48 Cb 0.38 0.22 -0.10 0.00 1.54 0.00 0.00 36.73 38.78 1l2a h TYR 48 CO 0.03 -0.24 0.54 0.78 -1.64 0.00 0.00 178.16 177.63 1l2a h GLY 49 N -0.18 1.58 1.24 1.82 0.00 -0.99 -0.63 103.07 105.90 1l2a h GLY 49 Ca 0.12 -0.33 -0.25 0.00 0.00 0.00 0.00 47.33 46.87 1l2a h GLY 49 CO -0.30 -0.00 -0.98 0.50 0.00 0.00 0.00 176.54 175.76 1l2a h LYS 50 N 0.75 0.70 -0.65 4.80 1.57 -0.81 -1.64 116.57 121.29 1l2a h LYS 50 Ca 0.51 -0.71 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1l2a h LYS 50 Cb 0.70 0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.17 1l2a h LYS 50 CO -0.35 1.29 0.31 0.82 -0.57 0.00 0.00 179.45 180.95 1l2a h ILE 51 N 0.42 1.21 -0.01 1.86 2.04 -0.44 -2.95 117.51 119.64 1l2a h ILE 51 Ca -0.11 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1l2a h ILE 51 Cb 1.62 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1l2a h ILE 51 CO 0.19 0.25 -0.12 0.29 0.00 0.00 0.00 178.15 178.76 1l2a n LYS 52 N -4.34 1.42 -2.42 2.37 4.76 -0.30 -4.59 118.16 115.06 1l2a n LYS 52 Ca 0.06 -0.91 -0.43 0.00 -2.87 0.00 0.00 58.31 54.17 1l2a n LYS 52 Cb 0.14 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 1l2a n LYS 52 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1l2a s ASP 53 N -2.20 6.81 0.44 4.39 -1.08 -0.63 -4.91 116.67 119.48 1l2a s ASP 53 Ca 0.31 1.46 0.13 0.00 -0.52 0.00 0.00 52.55 53.93 1l2a s ASP 53 Cb 0.20 -2.54 1.02 0.00 -1.46 0.00 0.00 42.92 40.14 1l2a s ASP 53 CO 0.41 -0.92 2.00 1.55 0.52 0.00 0.00 175.17 178.73 1l2a h PRO 54 N 8.76 0.40 -0.35 4.34 0.13 -1.90 0.07 132.00 143.44 1l2a h PRO 54 Ca -0.26 -0.02 0.10 0.00 -0.87 0.00 0.00 66.00 64.94 1l2a h PRO 54 Cb 1.10 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 1l2a h PRO 54 CO 1.00 0.26 0.26 0.87 -0.23 0.00 0.00 178.00 180.16 1l2a h LYS 55 N 0.41 0.00 0.00 0.86 6.56 -1.96 -2.78 116.57 119.66 1l2a h LYS 55 Ca 0.24 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.72 1l2a h LYS 55 Cb 0.41 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 1l2a h LYS 55 CO -0.06 0.00 -0.50 -0.91 -2.06 0.00 0.00 179.45 175.92 1l2a h ASN 56 N 0.00 0.00 0.00 0.86 2.35 -1.28 -3.48 115.58 114.04 1l2a h ASN 56 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1l2a h ASN 56 Cb 0.68 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.05 1l2a h ASN 56 CO -0.00 0.50 0.00 0.61 -1.65 0.00 0.00 177.43 176.89 1l2a n GLY 57 N 0.33 0.51 0.21 2.83 0.00 -1.05 -4.97 105.19 103.06 1l2a n GLY 57 Ca -0.00 -0.89 0.06 0.00 0.00 0.00 0.00 46.02 45.19 1l2a n GLY 57 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1l2a h TYR 58 N 0.00 0.00 -3.42 1.61 0.05 -1.83 -3.43 116.97 109.95 1l2a h TYR 58 Ca 0.00 0.00 -0.66 0.00 0.05 0.00 0.00 58.73 58.12 1l2a h TYR 58 Cb 0.29 0.00 -0.20 0.00 1.01 0.00 0.00 36.73 37.83 1l2a h TYR 58 CO 0.00 0.27 -0.84 -0.06 -1.05 0.00 0.00 178.16 176.48 1l2a s PHE 59 N -4.17 2.27 0.25 4.88 0.40 -1.26 -1.71 117.98 118.64 1l2a s PHE 59 Ca -0.02 -0.37 -0.30 0.00 -0.60 0.00 0.00 56.93 55.63 1l2a s PHE 59 Cb 0.14 -1.16 -0.10 0.00 0.51 0.00 0.00 43.02 42.40 1l2a s PHE 59 CO 0.67 0.44 1.50 -1.54 0.70 0.00 0.00 175.22 177.00 1l2a s SER 60 N -2.48 6.56 0.28 1.36 1.04 0.18 -4.86 113.70 115.78 1l2a s SER 60 Ca 0.18 2.75 -0.03 0.00 0.48 0.00 0.00 55.95 59.33 1l2a s SER 60 Cb -0.08 -2.62 0.38 0.00 0.10 0.00 0.00 66.02 63.79 1l2a s SER 60 CO 0.08 -0.78 1.95 -0.65 0.98 0.00 0.00 173.24 174.82 1l2a h PRO 61 N 5.19 1.17 0.20 4.02 0.11 -1.97 -0.75 132.00 139.98 1l2a h PRO 61 Ca -0.46 -0.07 -0.32 0.00 0.11 0.00 0.00 66.00 65.26 1l2a h PRO 61 Cb 1.22 -0.26 0.02 0.00 0.11 0.00 0.00 31.00 32.08 1l2a h PRO 61 CO 0.80 0.78 -1.44 -0.44 -0.21 0.00 0.00 178.00 177.48 1l2a h ASP 62 N 1.21 0.67 0.00 -2.05 3.32 -1.99 -3.41 116.42 114.17 1l2a h ASP 62 Ca 0.34 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1l2a h ASP 62 Cb -0.11 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.22 1l2a h ASP 62 CO -0.08 1.60 -0.08 -1.84 -1.72 0.00 0.00 179.24 177.12 1l2a n GLU 63 N -3.63 6.20 -1.68 3.56 0.00 -1.24 -5.03 120.64 118.81 1l2a n GLU 63 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 57.16 56.97 1l2a n GLU 63 Cb 1.08 -0.52 -0.01 0.00 0.00 0.00 0.00 31.44 31.99 1l2a n GLU 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1l2a n GLY 64 N 1.07 0.40 3.72 -1.84 0.00 -0.29 -4.96 105.19 103.30 1l2a n GLY 64 Ca 0.00 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1l2a n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l2a s ILE 65 N -2.17 4.82 -0.13 -0.61 1.01 -1.26 -4.68 121.20 118.17 1l2a s ILE 65 Ca 0.00 1.78 -0.29 0.00 0.00 0.00 0.00 60.65 62.13 1l2a s ILE 65 Cb 0.00 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 1l2a s ILE 65 CO 0.00 0.27 1.20 -2.16 0.00 0.00 0.00 174.94 174.25 1l2a s PRO 66 N 0.49 4.29 0.83 2.79 0.04 -1.26 0.49 135.00 142.66 1l2a s PRO 66 Ca 0.44 1.61 -0.11 0.00 0.04 0.00 0.00 61.00 62.97 1l2a s PRO 66 Cb -0.20 -3.67 0.09 0.00 0.04 0.00 0.00 34.50 30.76 1l2a s PRO 66 CO 0.24 -0.59 1.09 0.71 0.04 0.00 0.00 177.00 178.49 1l2a s TYR 67 N 2.96 2.58 0.16 0.56 2.02 -0.70 -4.57 117.35 120.37 1l2a s TYR 67 Ca 0.53 1.27 -0.16 0.00 -0.37 0.00 0.00 57.07 58.35 1l2a s TYR 67 Cb -0.22 -3.11 0.04 0.00 -0.40 0.00 0.00 41.96 38.27 1l2a s TYR 67 CO 0.16 -2.02 1.79 1.25 -1.57 0.00 0.00 175.55 175.17 1l2a h HIS 68 N -1.27 0.42 -3.43 2.71 -0.00 -0.84 -3.40 115.15 109.34 1l2a h HIS 68 Ca -0.47 0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 59.86 1l2a h HIS 68 Cb 1.27 -0.13 -0.13 0.00 -0.00 0.00 0.00 27.41 28.41 1l2a h HIS 68 CO 0.47 0.24 -0.09 -1.54 -0.00 0.00 0.00 177.93 177.01 1l2a s SER 69 N -5.49 -0.20 0.19 3.26 1.04 -0.82 -1.21 113.70 110.47 1l2a s SER 69 Ca -0.13 -0.38 -0.12 0.00 0.48 0.00 0.00 55.95 55.80 1l2a s SER 69 Cb 0.11 0.47 0.17 0.00 0.10 0.00 0.00 66.02 66.88 1l2a s SER 69 CO 0.72 -0.87 1.77 0.40 0.98 0.00 0.00 173.24 176.25 1l2a h ILE 70 N 2.38 0.90 -3.89 -1.02 2.04 -1.70 -3.42 117.51 112.80 1l2a h ILE 70 Ca -0.33 -0.16 -0.50 0.00 1.00 0.00 0.00 64.86 64.87 1l2a h ILE 70 Cb 1.25 0.40 0.03 0.00 -0.74 0.00 0.00 36.82 37.76 1l2a h ILE 70 CO 0.47 0.08 0.47 -1.61 0.00 0.00 0.00 178.15 177.56 1l2a s GLU 71 N -6.12 4.32 -0.05 2.37 8.01 -1.26 -4.96 118.70 121.01 1l2a s GLU 71 Ca -0.13 1.74 -0.02 0.00 0.01 0.00 0.00 54.97 56.57 1l2a s GLU 71 Cb 0.15 -2.85 -0.27 0.00 -4.31 0.00 0.00 34.13 26.85 1l2a s GLU 71 CO 0.74 -0.05 0.65 1.79 0.01 0.00 0.00 175.26 178.40 1l2a h THR 72 N 2.61 0.91 -2.67 3.63 1.35 -1.87 -3.36 112.91 113.50 1l2a h THR 72 Ca -0.48 -2.61 -0.64 0.00 -0.55 0.00 0.00 66.41 62.13 1l2a h THR 72 Cb 1.22 2.62 -0.16 0.00 -1.73 0.00 0.00 68.15 70.11 1l2a h THR 72 CO 0.64 0.79 0.50 -0.22 -0.25 0.00 0.00 175.52 176.98 1l2a s LEU 73 N -6.88 4.59 -0.28 3.87 1.98 -1.26 0.34 118.68 121.05 1l2a s LEU 73 Ca -0.13 -1.13 -0.21 0.00 -2.89 0.00 0.00 54.13 49.77 1l2a s LEU 73 Cb 0.07 -2.40 0.09 0.00 0.66 0.00 0.00 46.19 44.61 1l2a s LEU 73 CO 0.82 -1.37 0.78 -0.51 -1.89 0.00 0.00 176.35 174.19 1l2a s ILE 74 N 3.76 0.00 -0.07 6.68 2.07 -1.26 -4.94 121.20 127.44 1l2a s ILE 74 Ca 0.21 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.43 1l2a s ILE 74 Cb -0.17 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.45 1l2a s ILE 74 CO 0.08 0.00 0.05 -0.69 -1.91 0.00 0.00 174.94 172.47 1l2a s VAL 75 N 0.93 0.03 -0.25 4.00 1.01 -1.26 -2.67 120.40 122.19 1l2a s VAL 75 Ca -0.04 0.26 -0.37 0.00 0.00 0.00 0.00 61.98 61.83 1l2a s VAL 75 Cb -0.05 -0.31 0.15 0.00 0.00 0.00 0.00 36.38 36.17 1l2a s VAL 75 CO -0.10 0.14 1.34 -1.83 0.00 0.00 0.00 175.10 174.66 1l2a s GLU 76 N 2.11 0.10 0.00 2.72 -1.05 -1.26 -5.03 118.70 116.29 1l2a s GLU 76 Ca 0.05 -0.04 0.00 0.00 -0.15 0.00 0.00 54.97 54.83 1l2a s GLU 76 Cb -0.13 0.04 0.00 0.00 -0.44 0.00 0.00 34.13 33.61 1l2a s GLU 76 CO -0.04 -0.04 0.00 0.00 0.95 0.00 0.00 175.26 176.12 1l2a n ALA 77 N -0.06 0.00 -1.67 -0.84 0.00 -1.26 -3.90 120.51 112.78 1l2a n ALA 77 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.13 1l2a n ALA 77 Cb 0.57 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.04 1l2a n ALA 77 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1l2a s PRO 78 N 0.00 3.10 -0.13 0.00 0.04 -1.26 -4.85 135.00 131.90 1l2a s PRO 78 Ca 0.00 1.56 0.15 0.00 0.04 0.00 0.00 61.00 62.75 1l2a s PRO 78 Cb 0.00 -1.98 0.47 0.00 0.04 0.00 0.00 34.50 33.04 1l2a s PRO 78 CO 0.00 -1.04 1.38 -0.40 0.04 0.00 0.00 177.00 176.98 1l2a n ASP 79 N -1.74 3.65 -3.63 6.66 5.68 -1.25 -4.42 116.55 121.49 1l2a n ASP 79 Ca 0.11 -2.73 -0.13 0.00 -0.50 0.00 0.00 54.79 51.54 1l2a n ASP 79 Cb 0.51 -0.46 -0.07 0.00 -1.14 0.00 0.00 41.12 39.96 1l2a n ASP 79 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1l2a s TYR 80 N -2.31 -0.81 0.07 2.11 5.04 -1.09 -4.65 117.35 115.71 1l2a s TYR 80 Ca 0.37 1.93 0.28 0.00 -2.44 0.00 0.00 57.07 57.21 1l2a s TYR 80 Cb 0.28 0.31 1.08 0.00 0.35 0.00 0.00 41.96 43.98 1l2a s TYR 80 CO 0.11 -0.39 1.88 0.78 -1.34 0.00 0.00 175.55 176.59 1l2a h GLY 81 N 5.24 0.00 -1.94 8.97 0.00 -0.26 -3.13 103.07 111.94 1l2a h GLY 81 Ca -0.29 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 1l2a h GLY 81 CO 0.07 0.00 0.02 1.42 0.00 0.00 0.00 176.54 178.05 1l2a n HIS 82 N -3.22 1.16 -1.13 5.60 8.25 -1.26 -1.94 115.22 122.68 1l2a n HIS 82 Ca 0.01 -1.07 -0.29 0.00 -0.26 0.00 0.00 57.72 56.11 1l2a n HIS 82 Cb 0.38 -0.40 0.16 0.00 1.12 0.00 0.00 29.99 31.25 1l2a n HIS 82 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1l2a s VAL 83 N -2.94 2.45 0.33 1.59 -7.23 -1.18 -3.26 120.40 110.16 1l2a s VAL 83 Ca 0.44 0.15 0.09 0.00 -1.81 0.00 0.00 61.98 60.85 1l2a s VAL 83 Cb 0.37 -2.58 -0.06 0.00 0.56 0.00 0.00 36.38 34.67 1l2a s VAL 83 CO 0.08 -0.19 -0.04 0.28 -0.31 0.00 0.00 175.10 174.91 1l2a s THR 84 N -2.90 2.51 0.14 5.32 -1.32 0.05 -1.14 115.64 118.30 1l2a s THR 84 Ca 0.64 -2.09 0.03 0.00 -1.21 0.00 0.00 61.69 59.07 1l2a s THR 84 Cb -0.19 -2.71 -0.04 0.00 -1.51 0.00 0.00 72.50 68.05 1l2a s THR 84 CO 0.58 -0.22 -0.08 0.42 -2.21 0.00 0.00 174.62 173.11 1l2a s THR 85 N -2.54 0.98 0.38 5.08 -4.23 -1.26 -2.22 115.64 111.84 1l2a s THR 85 Ca 0.33 -2.02 0.11 0.00 -1.18 0.00 0.00 61.69 58.93 1l2a s THR 85 Cb 0.00 -1.86 0.14 0.00 1.34 0.00 0.00 72.50 72.12 1l2a s THR 85 CO 0.18 -0.73 1.89 0.77 -0.54 0.00 0.00 174.62 176.18 1l2a h SER 86 N 2.81 0.15 -0.25 3.99 4.64 -1.43 -2.46 113.55 120.99 1l2a h SER 86 Ca -0.36 -0.04 0.06 0.00 -0.47 0.00 0.00 61.79 60.98 1l2a h SER 86 Cb 1.19 -0.04 -0.08 0.00 -0.31 0.00 0.00 62.40 63.16 1l2a h SER 86 CO 0.64 0.38 -0.36 -0.08 -0.87 0.00 0.00 176.83 176.54 1l2a h GLU 87 N 0.14 -0.35 -1.00 4.77 4.81 -1.90 0.03 114.58 121.08 1l2a h GLU 87 Ca 0.03 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1l2a h GLU 87 Cb 0.47 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.86 1l2a h GLU 87 CO 0.03 -0.23 0.64 0.00 -0.73 0.00 0.00 179.01 178.72 1l2a h ALA 88 N 0.46 1.46 -0.54 2.92 0.00 -1.81 -1.18 119.26 120.57 1l2a h ALA 88 Ca 0.12 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1l2a h ALA 88 Cb 0.57 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1l2a h ALA 88 CO -0.45 0.36 -0.00 0.74 0.00 0.00 0.00 179.25 179.90 1l2a h PHE 89 N 1.10 1.04 -0.70 0.00 -1.00 -1.22 -0.98 116.94 115.19 1l2a h PHE 89 Ca 0.45 -0.18 -0.00 0.00 2.81 0.00 0.00 57.97 61.05 1l2a h PHE 89 Cb 0.29 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 1l2a h PHE 89 CO -0.00 0.95 0.43 0.66 -1.61 0.00 0.00 178.31 178.74 1l2a h SER 90 N 0.83 0.84 -0.37 2.17 4.64 0.16 -0.40 113.55 121.43 1l2a h SER 90 Ca 0.15 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 1l2a h SER 90 Cb 0.54 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1l2a h SER 90 CO 0.03 0.65 0.12 1.88 -0.87 0.00 0.00 176.83 178.64 1l2a h TYR 91 N 0.96 0.66 -0.51 4.77 0.05 -1.17 -0.86 116.97 120.86 1l2a h TYR 91 Ca 0.25 -0.04 -0.06 0.00 0.05 0.00 0.00 58.73 58.93 1l2a h TYR 91 Cb -0.04 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.48 1l2a h TYR 91 CO -0.01 0.56 0.10 -0.92 -1.05 0.00 0.00 178.16 176.83 1l2a h TYR 92 N 0.63 0.89 -0.28 4.88 3.20 -0.17 -0.13 116.97 125.99 1l2a h TYR 92 Ca 0.15 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1l2a h TYR 92 Cb 0.22 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1l2a h TYR 92 CO 0.01 0.80 0.10 0.28 -1.64 0.00 0.00 178.16 177.71 1l2a h VAL 93 N 0.72 1.19 -0.56 1.81 2.07 -0.76 -2.39 116.25 118.34 1l2a h VAL 93 Ca 0.16 -0.59 0.09 0.00 0.82 0.00 0.00 66.70 67.18 1l2a h VAL 93 Cb 0.38 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 31.13 1l2a h VAL 93 CO 0.01 0.20 0.18 -0.25 0.02 0.00 0.00 177.57 177.73 1l2a h TRP 94 N 0.30 0.31 -0.43 1.57 2.91 -0.81 -0.09 115.95 119.71 1l2a h TRP 94 Ca 0.09 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.17 1l2a h TRP 94 Cb 0.21 -0.05 -0.03 0.00 -0.51 0.00 0.00 29.16 28.77 1l2a h TRP 94 CO -0.00 0.07 0.23 1.25 -1.03 0.00 0.00 178.44 178.96 1l2a h LEU 95 N 0.35 0.35 -0.65 0.65 5.85 -0.92 -1.82 115.31 119.12 1l2a h LEU 95 Ca 0.28 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.89 1l2a h LEU 95 Cb 0.35 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1l2a h LEU 95 CO -0.31 0.25 -0.26 -0.33 -0.34 0.00 0.00 178.44 177.46 1l2a h GLU 96 N 0.47 0.78 -0.27 1.25 4.39 -0.88 -0.69 114.58 119.63 1l2a h GLU 96 Ca 0.18 -0.33 0.06 0.00 0.34 0.00 0.00 59.36 59.61 1l2a h GLU 96 Cb 0.06 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 1l2a h GLU 96 CO -0.11 0.95 -0.16 0.00 -1.16 0.00 0.00 179.01 178.54 1l2a h ALA 97 N 1.03 0.05 -0.67 3.43 0.00 -0.72 0.70 119.26 123.08 1l2a h ALA 97 Ca 0.09 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1l2a h ALA 97 Cb 0.78 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1l2a h ALA 97 CO 0.06 -0.56 0.19 1.98 0.00 0.00 0.00 179.25 180.93 1l2a h MET 98 N -0.13 1.06 -0.27 0.00 1.85 -1.13 -1.52 114.93 114.79 1l2a h MET 98 Ca 0.15 -0.24 0.04 0.00 -0.61 0.00 0.00 59.70 59.04 1l2a h MET 98 Cb 0.35 -0.15 -0.04 0.00 0.43 0.00 0.00 31.60 32.19 1l2a h MET 98 CO -0.35 0.93 0.03 -0.92 -0.40 0.00 0.00 176.91 176.19 1l2a h TYR 99 N 0.99 0.03 -0.45 1.39 3.20 -0.74 -1.34 116.97 120.05 1l2a h TYR 99 Ca 0.21 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.17 1l2a h TYR 99 Cb 0.33 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.57 1l2a h TYR 99 CO 0.02 -0.01 0.14 0.78 -1.64 0.00 0.00 178.16 177.45 1l2a h GLY 100 N 0.12 0.59 0.37 1.82 0.00 -0.39 -1.97 103.07 103.60 1l2a h GLY 100 Ca 0.13 -0.07 0.07 0.00 0.00 0.00 0.00 47.33 47.45 1l2a h GLY 100 CO -0.20 -0.00 -0.02 -0.57 0.00 0.00 0.00 176.54 175.76 1l2a h ASN 101 N 0.30 -0.19 0.89 0.19 -0.00 -0.67 0.15 115.58 116.26 1l2a h ASN 101 Ca 0.22 0.09 0.00 0.00 -0.00 0.00 0.00 56.30 56.61 1l2a h ASN 101 Cb 0.23 0.17 0.00 0.00 -0.00 0.00 0.00 38.32 38.72 1l2a h ASN 101 CO -0.24 -0.06 -0.08 0.18 -0.00 0.00 0.00 177.43 177.23 1l2a n LEU 102 N -5.21 0.09 0.00 0.34 4.77 -0.56 -4.35 117.00 112.08 1l2a n LEU 102 Ca 0.02 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1l2a n LEU 102 Cb 0.20 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1l2a n LEU 102 CO 0.19 0.02 -0.21 1.07 -1.33 0.00 0.00 177.39 177.13 1l2a n THR 103 N -1.48 0.00 -0.03 -5.08 5.66 -0.78 -5.04 114.28 107.53 1l2a n THR 103 Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 1l2a n THR 103 Cb 0.33 -0.37 0.00 0.00 -1.55 0.00 0.00 70.33 68.74 1l2a n THR 103 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1l2a n GLY 104 N 1.73 1.64 3.45 1.09 0.00 0.51 -5.04 105.19 108.57 1l2a n GLY 104 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1l2a n GLY 104 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1l2a s ASN 105 N -3.12 6.22 0.00 1.61 3.04 -1.26 -4.96 114.94 116.48 1l2a s ASN 105 Ca 0.00 -0.90 0.25 0.00 0.04 0.00 0.00 52.86 52.24 1l2a s ASN 105 Cb 0.00 -2.28 0.60 0.00 -1.54 0.00 0.00 41.25 38.03 1l2a s ASN 105 CO 0.00 -0.84 1.49 0.79 -3.04 0.00 0.00 177.10 175.49 1l2a n TRP 106 N 6.05 0.12 0.11 0.43 7.02 -1.26 -4.15 117.44 125.76 1l2a n TRP 106 Ca -0.07 -0.06 0.03 0.00 -1.02 0.00 0.00 57.50 56.38 1l2a n TRP 106 Cb 0.45 0.00 0.41 0.00 -2.42 0.00 0.00 31.31 29.75 1l2a n TRP 106 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1l2a h SER 107 N 3.51 0.25 -0.41 -0.99 4.64 -1.92 -2.54 113.55 116.08 1l2a h SER 107 Ca 0.00 -0.04 0.04 0.00 -0.47 0.00 0.00 61.79 61.31 1l2a h SER 107 Cb 0.75 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.76 1l2a h SER 107 CO 0.00 0.36 0.27 1.23 -0.87 0.00 0.00 176.83 177.83 1l2a h GLY 108 N 0.67 0.48 0.98 -0.77 0.00 -1.92 -0.72 103.07 101.80 1l2a h GLY 108 Ca 0.06 -0.17 -0.08 0.00 0.00 0.00 0.00 47.33 47.15 1l2a h GLY 108 CO 0.01 0.14 -0.02 -2.08 0.00 0.00 0.00 176.54 174.60 1l2a h VAL 109 N 0.42 1.26 -0.32 4.60 2.07 -1.72 0.33 116.25 122.89 1l2a h VAL 109 Ca 0.17 -1.07 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 1l2a h VAL 109 Cb 0.15 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1l2a h VAL 109 CO -0.04 0.37 0.13 -0.33 0.02 0.00 0.00 177.57 177.72 1l2a h GLU 110 N 0.64 0.48 0.17 1.57 5.08 -1.41 -2.14 114.58 118.97 1l2a h GLU 110 Ca 0.12 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1l2a h GLU 110 Cb 0.52 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1l2a h GLU 110 CO 0.03 0.49 -0.21 1.15 -1.00 0.00 0.00 179.01 179.46 1l2a h THR 111 N 0.37 0.53 -0.67 1.13 2.02 -1.04 0.33 112.91 115.58 1l2a h THR 111 Ca 0.11 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.41 1l2a h THR 111 Cb 0.18 0.53 -0.09 0.00 -1.74 0.00 0.00 68.15 67.04 1l2a h THR 111 CO -0.01 0.00 0.20 0.00 0.37 0.00 0.00 175.52 176.09 1l2a h ALA 112 N 0.32 0.87 0.00 6.16 0.00 -0.88 -0.47 119.26 125.26 1l2a h ALA 112 Ca 0.01 0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 1l2a h ALA 112 Cb 0.42 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1l2a h ALA 112 CO -0.08 -0.26 -0.78 2.35 0.00 0.00 0.00 179.25 180.48 1l2a h TRP 113 N 0.34 0.00 -0.04 0.00 2.91 -1.05 -1.98 115.95 116.13 1l2a h TRP 113 Ca 0.36 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.38 1l2a h TRP 113 Cb 0.54 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.19 1l2a h TRP 113 CO -0.21 0.78 0.02 -0.22 -1.03 0.00 0.00 178.44 177.78 1l2a h LYS 114 N 0.00 0.05 -0.47 2.65 3.64 0.08 -1.71 116.57 120.81 1l2a h LYS 114 Ca -0.01 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1l2a h LYS 114 Cb 1.42 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.21 1l2a h LYS 114 CO 0.10 0.07 0.31 0.28 -2.27 0.00 0.00 179.45 177.93 1l2a h VAL 115 N 0.01 1.12 -0.29 2.00 2.07 -0.98 0.29 116.25 120.48 1l2a h VAL 115 Ca 0.01 -0.23 0.07 0.00 0.82 0.00 0.00 66.70 67.37 1l2a h VAL 115 Cb 0.03 0.44 -0.07 0.00 -1.52 0.00 0.00 31.29 30.17 1l2a h VAL 115 CO -0.00 0.12 -0.18 -0.03 0.02 0.00 0.00 177.57 177.49 1l2a h MET 116 N 0.63 -0.15 0.00 1.57 1.85 -1.23 -2.08 114.93 115.52 1l2a h MET 116 Ca 0.17 0.01 -0.11 0.00 -0.61 0.00 0.00 59.70 59.16 1l2a h MET 116 Cb -0.07 0.03 -0.02 0.00 0.43 0.00 0.00 31.60 31.98 1l2a h MET 116 CO -0.04 -0.10 -0.53 1.05 -0.40 0.00 0.00 176.91 176.89 1l2a h GLU 117 N -0.16 0.00 0.00 0.39 4.11 -0.71 -0.78 114.58 117.43 1l2a h GLU 117 Ca 0.15 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.56 1l2a h GLU 117 Cb 0.39 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1l2a h GLU 117 CO -0.38 0.53 -0.13 -0.44 0.07 0.00 0.00 179.01 178.66 1l2a h ASP 118 N 0.00 0.00 0.00 3.06 3.32 -0.74 -3.40 116.42 118.65 1l2a h ASP 118 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1l2a h ASP 118 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1l2a h ASP 118 CO 0.07 0.13 -0.37 0.79 -1.72 0.00 0.00 179.24 178.13 1l2a n TRP 119 N -3.58 -0.40 0.04 4.55 7.02 -0.80 -4.95 117.44 119.32 1l2a n TRP 119 Ca -0.01 0.07 0.11 0.00 -1.02 0.00 0.00 57.50 56.64 1l2a n TRP 119 Cb 0.26 0.23 -0.09 0.00 -2.42 0.00 0.00 31.31 29.29 1l2a n TRP 119 CO 0.00 0.00 0.00 1.51 -2.02 0.00 0.00 177.69 177.18 1l2a n ILE 120 N -3.03 0.30 -3.15 -0.99 3.06 -0.33 -4.71 119.36 110.51 1l2a n ILE 120 Ca 0.00 -0.53 -0.40 0.00 -2.50 0.00 0.00 62.75 59.32 1l2a n ILE 120 Cb 0.19 -0.16 -0.07 0.00 0.54 0.00 0.00 39.64 40.14 1l2a n ILE 120 CO 0.00 0.00 0.00 -0.63 -2.50 0.00 0.00 176.55 173.42 1l2a s ILE 121 N -3.44 5.01 -0.04 9.51 1.01 -1.00 -2.20 121.20 130.05 1l2a s ILE 121 Ca -0.05 1.07 -0.32 0.00 0.00 0.00 0.00 60.65 61.35 1l2a s ILE 121 Cb 0.12 -3.91 -0.10 0.00 0.01 0.00 0.00 42.46 38.58 1l2a s ILE 121 CO 0.86 0.06 1.95 -2.65 0.00 0.00 0.00 174.94 175.15 1l2a n PRO 122 N 5.57 2.46 -1.59 2.79 -0.02 -1.26 -4.80 135.00 138.16 1l2a n PRO 122 Ca -0.02 0.89 -0.22 0.00 -2.02 0.00 0.00 63.50 62.14 1l2a n PRO 122 Cb 0.49 -2.83 0.15 0.00 -0.02 0.00 0.00 33.50 31.28 1l2a n PRO 122 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1l2a n ASP 123 N 7.36 0.26 -0.35 2.55 3.85 -1.26 -4.88 116.55 124.07 1l2a n ASP 123 Ca 0.22 -1.47 0.15 0.00 -0.71 0.00 0.00 54.79 52.99 1l2a n ASP 123 Cb 0.35 -0.73 0.35 0.00 -1.35 0.00 0.00 41.12 39.74 1l2a n ASP 123 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 1l2a h SER 124 N -1.18 0.71 0.56 -1.12 4.64 -1.95 0.14 113.55 115.34 1l2a h SER 124 Ca -0.32 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1l2a h SER 124 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1l2a h SER 124 CO 0.24 0.18 0.00 0.41 -0.87 0.00 0.00 176.83 176.79 1l2a n THR 125 N -4.84 0.60 0.13 2.95 -1.04 -1.26 -3.04 114.28 107.79 1l2a n THR 125 Ca 0.25 0.15 0.02 0.00 -2.04 0.00 0.00 64.05 62.43 1l2a n THR 125 Cb 0.66 -0.83 0.02 0.00 -1.82 0.00 0.00 70.33 68.36 1l2a n THR 125 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1l2a n GLU 126 N -1.43 -0.16 -2.53 -2.82 1.02 0.02 -4.57 120.64 110.17 1l2a n GLU 126 Ca 0.06 -0.81 -0.22 0.00 -0.02 0.00 0.00 57.16 56.17 1l2a n GLU 126 Cb 0.20 -1.07 0.01 0.00 -0.02 0.00 0.00 31.44 30.56 1l2a n GLU 126 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1l2a n GLN 127 N 0.17 2.83 -1.66 3.49 6.02 -1.13 -4.91 117.38 122.19 1l2a n GLN 127 Ca 0.02 -4.18 -0.47 0.00 -0.01 0.00 0.00 57.00 52.36 1l2a n GLN 127 Cb 0.11 -1.99 -0.04 0.00 1.02 0.00 0.00 30.24 29.34 1l2a n GLN 127 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1l2a n PRO 128 N -0.37 1.97 -3.07 -1.09 -0.04 -1.26 -2.12 135.00 129.03 1l2a n PRO 128 Ca 0.31 0.71 -0.22 0.00 -0.04 0.00 0.00 63.50 64.26 1l2a n PRO 128 Cb 0.70 -2.46 0.04 0.00 -0.04 0.00 0.00 33.50 31.75 1l2a n PRO 128 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1l2a n GLY 129 N 3.22 -0.50 0.21 0.55 0.00 -1.26 -4.68 105.19 102.73 1l2a n GLY 129 Ca 0.17 0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.39 1l2a n GLY 129 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1l2a h MET 130 N -1.52 0.00 -0.04 1.61 -1.53 -1.73 -2.66 114.93 109.05 1l2a h MET 130 Ca -0.53 0.00 0.01 0.00 -3.44 0.00 0.00 59.70 55.75 1l2a h MET 130 Cb 1.36 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 32.41 1l2a h MET 130 CO 0.56 0.28 0.50 0.66 0.14 0.00 0.00 176.91 179.05 1l2a h SER 131 N 0.00 0.00 -0.00 1.39 4.64 -1.85 -0.84 113.55 116.89 1l2a h SER 131 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1l2a h SER 131 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1l2a h SER 131 CO 0.04 0.00 -0.02 -1.20 -0.87 0.00 0.00 176.83 174.78 1l2a n SER 132 N -2.86 1.64 -4.70 4.97 7.64 -1.00 -4.94 113.62 114.37 1l2a n SER 132 Ca -0.01 -1.52 -0.43 0.00 1.01 0.00 0.00 58.87 57.92 1l2a n SER 132 Cb 0.55 0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.74 1l2a n SER 132 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1l2a n TYR 133 N 0.25 2.48 -3.89 1.43 9.36 -0.32 -4.45 117.16 122.02 1l2a n TYR 133 Ca 0.18 0.35 -0.35 0.00 3.32 0.00 0.00 57.90 61.39 1l2a n TYR 133 Cb 0.38 -2.53 -0.14 0.00 -0.63 0.00 0.00 39.34 36.43 1l2a n TYR 133 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1l2a s ASN 134 N 0.40 4.61 0.56 2.98 2.47 -1.26 -4.99 114.94 119.70 1l2a s ASN 134 Ca 0.66 -0.83 0.25 0.00 0.42 0.00 0.00 52.86 53.35 1l2a s ASN 134 Cb -0.58 -1.74 1.50 0.00 -1.45 0.00 0.00 41.25 38.98 1l2a s ASN 134 CO 0.49 -0.15 2.09 -0.65 -3.72 0.00 0.00 177.10 175.16 1l2a h PRO 135 N 8.08 0.00 0.00 0.43 0.11 -1.94 -2.33 132.00 136.35 1l2a h PRO 135 Ca -0.32 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1l2a h PRO 135 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1l2a h PRO 135 CO 0.58 0.00 -0.16 -0.91 -0.21 0.00 0.00 178.00 177.30 1l2a h ASN 136 N 0.00 0.00 -2.11 -2.05 2.35 -1.89 0.50 115.58 112.38 1l2a h ASN 136 Ca 0.11 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.28 1l2a h ASN 136 Cb 0.48 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.46 1l2a h ASN 136 CO -0.00 0.05 -0.98 -1.20 -1.65 0.00 0.00 177.43 173.64 1l2a n SER 137 N -3.06 0.84 -0.36 5.81 7.64 -0.91 -4.62 113.62 118.95 1l2a n SER 137 Ca 0.03 -2.81 -0.00 0.00 1.01 0.00 0.00 58.87 57.10 1l2a n SER 137 Cb 0.55 -0.64 0.13 0.00 -1.01 0.00 0.00 64.21 63.25 1l2a n SER 137 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1l2a h PRO 138 N 4.26 1.21 -2.64 1.43 0.11 -1.66 -3.41 132.00 131.30 1l2a h PRO 138 Ca 0.12 -0.07 0.13 0.00 0.11 0.00 0.00 66.00 66.28 1l2a h PRO 138 Cb 0.84 -0.27 -0.06 0.00 0.11 0.00 0.00 31.00 31.61 1l2a h PRO 138 CO 0.53 0.80 0.38 0.00 -0.21 0.00 0.00 178.00 179.49 1l2a s ALA 139 N -6.09 -1.44 -0.26 -0.75 0.00 -1.26 -1.34 121.76 110.62 1l2a s ALA 139 Ca -0.13 -0.10 -0.08 0.00 0.00 0.00 0.00 51.96 51.65 1l2a s ALA 139 Cb 0.19 0.73 -0.03 0.00 0.00 0.00 0.00 23.12 24.01 1l2a s ALA 139 CO 0.81 -1.04 0.10 0.99 0.00 0.00 0.00 175.76 176.62 1l2a s THR 140 N -3.48 4.55 0.45 0.00 2.01 -1.26 -4.86 115.64 113.05 1l2a s THR 140 Ca 0.12 -0.12 -0.25 0.00 0.31 0.00 0.00 61.69 61.74 1l2a s THR 140 Cb -0.03 -3.16 -0.09 0.00 0.01 0.00 0.00 72.50 69.23 1l2a s THR 140 CO 0.05 0.29 1.38 0.00 -0.69 0.00 0.00 174.62 175.65 1l2a n TYR 141 N 4.96 2.52 -3.74 4.92 9.36 -1.26 -4.72 117.16 129.19 1l2a n TYR 141 Ca -0.15 0.46 -0.13 0.00 3.32 0.00 0.00 57.90 61.39 1l2a n TYR 141 Cb 0.51 -2.43 -0.10 0.00 -0.63 0.00 0.00 39.34 36.69 1l2a n TYR 141 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1l2a s ALA 142 N -1.20 -0.92 0.72 2.98 0.00 -1.26 -1.33 121.76 120.74 1l2a s ALA 142 Ca 0.62 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.46 1l2a s ALA 142 Cb -0.46 -0.55 0.03 0.00 0.00 0.00 0.00 23.12 22.13 1l2a s ALA 142 CO 0.57 -0.19 1.08 -0.51 0.00 0.00 0.00 175.76 176.72 1l2a s ASP 143 N 0.06 4.93 0.08 0.00 1.01 -1.26 -5.00 116.67 116.49 1l2a s ASP 143 Ca -0.01 1.80 0.06 0.00 0.71 0.00 0.00 52.55 55.11 1l2a s ASP 143 Cb -0.03 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.34 1l2a s ASP 143 CO 0.01 -1.75 -0.09 -1.61 0.21 0.00 0.00 175.17 171.94 1l2a s GLU 144 N -4.73 2.26 0.19 8.23 2.02 -1.21 -4.84 118.70 120.63 1l2a s GLU 144 Ca 0.62 -0.93 0.08 0.00 0.02 0.00 0.00 54.97 54.75 1l2a s GLU 144 Cb -0.17 -2.37 -0.05 0.00 0.10 0.00 0.00 34.13 31.65 1l2a s GLU 144 CO 0.52 0.53 -0.15 0.71 0.02 0.00 0.00 175.26 176.89 1l2a s TYR 145 N -1.16 1.71 -2.00 1.61 1.51 -1.26 -4.58 117.35 113.18 1l2a s TYR 145 Ca 0.20 -0.55 0.12 0.00 -1.01 0.00 0.00 57.07 55.84 1l2a s TYR 145 Cb -0.11 -0.81 0.74 0.00 -0.11 0.00 0.00 41.96 41.67 1l2a s TYR 145 CO 0.12 0.34 1.32 0.39 -1.11 0.00 0.00 175.55 176.61 1l2a n GLU 146 N -0.21 0.79 -3.66 -0.62 4.71 -1.26 -4.03 120.64 116.36 1l2a n GLU 146 Ca -0.09 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 56.92 1l2a n GLU 146 Cb 0.60 -1.25 -0.08 0.00 -1.01 0.00 0.00 31.44 29.70 1l2a n GLU 146 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1l2a s ASP 147 N -1.60 -0.66 0.65 1.62 2.15 -1.26 -4.43 116.67 113.14 1l2a s ASP 147 Ca 0.19 1.28 0.38 0.00 0.43 0.00 0.00 52.55 54.83 1l2a s ASP 147 Cb 0.09 1.30 2.09 0.00 -0.30 0.00 0.00 42.92 46.09 1l2a s ASP 147 CO 0.14 -0.22 2.21 -0.65 -0.17 0.00 0.00 175.17 176.49 1l2a h PRO 148 N 5.13 0.00 -0.18 4.34 0.11 -1.85 -2.79 132.00 136.76 1l2a h PRO 148 Ca -0.28 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 1l2a h PRO 148 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1l2a h PRO 148 CO 0.10 0.00 -0.30 0.66 -0.21 0.00 0.00 178.00 178.25 1l2a h SER 149 N 0.00 0.35 0.02 -2.05 4.64 -1.96 -2.79 113.55 111.77 1l2a h SER 149 Ca 0.01 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1l2a h SER 149 Cb 0.24 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1l2a h SER 149 CO -0.00 0.65 0.00 -1.22 -0.87 0.00 0.00 176.83 175.39 1l2a n TYR 150 N -4.10 0.00 -3.96 4.77 4.02 -1.05 -4.78 117.16 112.05 1l2a n TYR 150 Ca -0.01 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.59 1l2a n TYR 150 Cb 0.42 -0.38 -0.04 0.00 -0.02 0.00 0.00 39.34 39.31 1l2a n TYR 150 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1l2a s TYR 151 N -2.76 3.42 0.55 -0.72 1.51 -1.05 -4.46 117.35 113.83 1l2a s TYR 151 Ca 0.01 0.16 -0.18 0.00 -1.01 0.00 0.00 57.07 56.04 1l2a s TYR 151 Cb 0.01 -1.69 -0.05 0.00 -0.11 0.00 0.00 41.96 40.11 1l2a s TYR 151 CO 0.01 0.55 1.09 -1.25 -1.11 0.00 0.00 175.55 174.84 1l2a s PRO 152 N -2.73 3.40 0.08 -1.71 0.04 -1.21 -4.74 135.00 128.14 1l2a s PRO 152 Ca 0.33 1.43 -0.16 0.00 0.04 0.00 0.00 61.00 62.65 1l2a s PRO 152 Cb -0.12 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 1l2a s PRO 152 CO 0.27 -0.77 0.51 0.45 0.04 0.00 0.00 177.00 177.50 1l2a s SER 153 N -2.14 6.89 -0.18 6.66 0.15 0.30 -4.57 113.70 120.80 1l2a s SER 153 Ca 0.69 1.09 -0.22 0.00 0.70 0.00 0.00 55.95 58.21 1l2a s SER 153 Cb -0.20 -2.30 -0.02 0.00 -1.71 0.00 0.00 66.02 61.80 1l2a s SER 153 CO 0.29 0.22 0.69 -0.70 1.20 0.00 0.00 173.24 174.94 1l2a s GLU 154 N -1.48 4.25 0.18 5.44 2.12 -1.26 0.20 118.70 128.15 1l2a s GLU 154 Ca 0.31 0.75 -0.30 0.00 0.36 0.00 0.00 54.97 56.09 1l2a s GLU 154 Cb -0.17 -3.57 -0.09 0.00 0.26 0.00 0.00 34.13 30.56 1l2a s GLU 154 CO 0.18 -0.26 1.38 -0.51 -0.54 0.00 0.00 175.26 175.51 1l2a s LEU 155 N 1.95 4.39 -0.62 2.70 1.43 -0.75 -4.38 118.68 123.41 1l2a s LEU 155 Ca 0.32 2.46 0.05 0.00 -1.03 0.00 0.00 54.13 55.93 1l2a s LEU 155 Cb -0.16 -3.60 0.20 0.00 0.03 0.00 0.00 46.19 42.65 1l2a s LEU 155 CO 0.11 -0.62 0.54 0.29 0.23 0.00 0.00 176.35 176.90 1l2a n LYS 156 N 3.04 1.68 0.14 1.70 5.02 -0.44 -4.83 118.16 124.46 1l2a n LYS 156 Ca 0.08 -4.24 0.12 0.00 -2.02 0.00 0.00 58.31 52.25 1l2a n LYS 156 Cb 0.42 -2.10 0.52 0.00 -0.02 0.00 0.00 35.03 33.84 1l2a n LYS 156 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1l2a n PHE 157 N 1.76 0.80 0.00 2.13 3.01 -1.26 -3.90 117.46 120.01 1l2a n PHE 157 Ca 0.24 0.34 0.00 0.00 1.01 0.00 0.00 57.45 59.04 1l2a n PHE 157 Cb 0.40 -1.04 0.00 0.00 -0.01 0.00 0.00 39.48 38.83 1l2a n PHE 157 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1l2a n ASP 158 N -2.25 0.00 -1.26 4.37 8.00 -1.26 -4.63 116.55 119.52 1l2a n ASP 158 Ca 0.01 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.60 1l2a n ASP 158 Cb 0.18 0.00 0.30 0.00 -0.02 0.00 0.00 41.12 41.58 1l2a n ASP 158 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1l2a n THR 159 N 0.00 1.45 -4.06 -3.53 5.66 -1.26 -4.85 114.28 107.70 1l2a n THR 159 Ca 0.00 -1.15 -0.32 0.00 -3.05 0.00 0.00 64.05 59.53 1l2a n THR 159 Cb 0.00 0.29 -0.15 0.00 -1.55 0.00 0.00 70.33 68.92 1l2a n THR 159 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1l2a s VAL 160 N -1.50 2.21 0.09 1.08 -7.23 -1.25 -5.09 120.40 108.72 1l2a s VAL 160 Ca 0.44 -1.71 -0.29 0.00 -1.81 0.00 0.00 61.98 58.61 1l2a s VAL 160 Cb 0.26 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 1l2a s VAL 160 CO 0.24 -0.10 0.92 -0.13 -0.31 0.00 0.00 175.10 175.73 1l2a s ARG 161 N 1.08 4.65 0.01 4.82 1.81 -1.26 -4.79 118.95 125.27 1l2a s ARG 161 Ca -0.07 1.37 0.01 0.00 -1.72 0.00 0.00 55.73 55.33 1l2a s ARG 161 Cb -0.20 -3.38 -0.04 0.00 -0.45 0.00 0.00 34.95 30.88 1l2a s ARG 161 CO -0.05 0.20 0.02 0.08 -0.68 0.00 0.00 175.30 174.87 1l2a s VAL 162 N 0.08 4.26 1.17 3.52 1.01 -1.26 -4.35 120.40 124.83 1l2a s VAL 162 Ca 0.46 -0.61 -0.19 0.00 0.00 0.00 0.00 61.98 61.64 1l2a s VAL 162 Cb -0.23 -2.93 0.28 0.00 0.00 0.00 0.00 36.38 33.50 1l2a s VAL 162 CO 0.28 0.34 1.13 -0.83 0.00 0.00 0.00 175.10 176.02 1l2a s GLY 163 N -1.69 1.60 0.20 4.51 0.00 -1.05 -4.81 107.32 106.07 1l2a s GLY 163 Ca 0.21 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 44.01 1l2a s GLY 163 CO 0.12 -0.09 0.33 -0.56 0.00 0.00 0.00 173.10 172.91 1l2a s SER 164 N -3.97 6.33 -0.53 1.64 0.01 -0.41 -4.43 113.70 112.35 1l2a s SER 164 Ca 0.71 0.15 -0.15 0.00 1.31 0.00 0.00 55.95 57.97 1l2a s SER 164 Cb -0.09 -1.90 0.12 0.00 0.21 0.00 0.00 66.02 64.36 1l2a s SER 164 CO 0.56 -0.02 0.47 -0.62 0.41 0.00 0.00 173.24 174.04 1l2a s ASP 165 N -3.59 6.13 0.00 2.44 2.15 0.17 -4.86 116.67 119.11 1l2a s ASP 165 Ca 0.35 -1.77 0.30 0.00 0.43 0.00 0.00 52.55 51.86 1l2a s ASP 165 Cb -0.10 -2.19 1.72 0.00 -0.30 0.00 0.00 42.92 42.06 1l2a s ASP 165 CO 0.29 -0.83 2.12 -0.81 -0.17 0.00 0.00 175.17 175.77 1l2a n PRO 166 N 5.21 1.08 -0.04 4.34 -0.04 -1.26 -3.75 135.00 140.54 1l2a n PRO 166 Ca -0.13 -0.11 -0.03 0.00 -0.04 0.00 0.00 63.50 63.18 1l2a n PRO 166 Cb 0.40 -1.47 -0.08 0.00 -0.04 0.00 0.00 33.50 32.31 1l2a n PRO 166 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1l2a n VAL 167 N -0.84 0.58 -0.16 0.52 0.31 -1.26 -4.73 118.33 112.75 1l2a n VAL 167 Ca 0.22 -0.41 -0.03 0.00 -0.01 0.00 0.00 64.34 64.11 1l2a n VAL 167 Cb 0.13 -0.54 0.06 0.00 -0.91 0.00 0.00 33.84 32.58 1l2a n VAL 167 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1l2a h HIS 168 N 0.00 0.30 0.15 3.52 6.17 -2.00 -2.55 115.15 120.74 1l2a h HIS 168 Ca -0.23 0.02 0.01 0.00 0.71 0.00 0.00 60.37 60.89 1l2a h HIS 168 Cb 1.43 -0.06 -0.02 0.00 2.52 0.00 0.00 27.41 31.27 1l2a h HIS 168 CO 0.00 0.10 -0.21 -0.91 0.71 0.00 0.00 177.93 177.61 1l2a h ASN 169 N 0.34 -0.59 0.89 3.26 2.35 -1.85 0.12 115.58 120.11 1l2a h ASN 169 Ca 0.23 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.98 1l2a h ASN 169 Cb 0.25 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1l2a h ASN 169 CO -0.24 -0.30 -0.31 -2.24 -1.65 0.00 0.00 177.43 172.68 1l2a h ASP 170 N -0.42 0.00 0.66 5.81 -0.00 -1.85 0.20 116.42 120.82 1l2a h ASP 170 Ca 0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 57.03 57.01 1l2a h ASP 170 Cb 0.42 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 39.76 1l2a h ASP 170 CO -0.10 0.31 -0.32 -0.07 -0.00 0.00 0.00 179.24 179.07 1l2a h LEU 171 N 0.00 -0.76 -0.57 0.15 3.38 -1.20 -2.64 115.31 113.68 1l2a h LEU 171 Ca -0.00 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.09 1l2a h LEU 171 Cb 0.84 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 1l2a h LEU 171 CO 0.04 -0.53 0.08 0.58 0.09 0.00 0.00 178.44 178.71 1l2a h VAL 172 N -0.91 0.63 -0.87 1.22 2.07 -0.35 0.18 116.25 118.21 1l2a h VAL 172 Ca -0.09 -0.07 0.10 0.00 0.82 0.00 0.00 66.70 67.46 1l2a h VAL 172 Cb 0.69 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 30.80 1l2a h VAL 172 CO 0.15 0.04 0.56 -1.28 0.02 0.00 0.00 177.57 177.06 1l2a h SER 173 N 0.21 0.76 0.22 0.57 0.87 -0.62 0.55 113.55 116.10 1l2a h SER 173 Ca 0.29 0.02 -0.33 0.00 -1.23 0.00 0.00 61.79 60.55 1l2a h SER 173 Cb 0.44 -0.14 0.03 0.00 -0.44 0.00 0.00 62.40 62.29 1l2a h SER 173 CO -0.41 0.45 -1.51 0.00 -0.53 0.00 0.00 176.83 174.83 1l2a h ALA 174 N 1.57 -0.04 0.00 6.23 0.00 -1.00 -3.44 119.26 122.58 1l2a h ALA 174 Ca 0.41 -0.95 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 1l2a h ALA 174 Cb 0.43 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1l2a h ALA 174 CO -0.17 0.78 -1.52 0.66 0.00 0.00 0.00 179.25 179.00 1l2a n TYR 175 N -3.73 0.00 0.00 0.00 4.01 0.58 -4.99 117.16 113.04 1l2a n TYR 175 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1l2a n TYR 175 Cb 1.06 -0.35 0.00 0.00 -0.31 0.00 0.00 39.34 39.74 1l2a n TYR 175 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1l2a n GLY 176 N 2.38 0.13 0.19 2.72 0.00 0.14 -4.82 105.19 105.93 1l2a n GLY 176 Ca -0.10 -2.30 0.09 0.00 0.00 0.00 0.00 46.02 43.71 1l2a n GLY 176 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l2a h PRO 177 N 8.02 0.00 -6.99 1.61 0.13 -1.94 -3.33 132.00 129.50 1l2a h PRO 177 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 1l2a h PRO 177 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 1l2a h PRO 177 CO 0.00 0.14 0.13 -0.80 -0.23 0.00 0.00 178.00 177.24 1l2a s ASN 178 N -6.22 6.08 -0.22 1.44 0.01 -1.26 -4.59 114.94 110.18 1l2a s ASN 178 Ca 0.06 0.87 -0.12 0.00 -0.71 0.00 0.00 52.86 52.96 1l2a s ASN 178 Cb 0.06 -2.10 -0.05 0.00 0.41 0.00 0.00 41.25 39.58 1l2a s ASN 178 CO 0.70 -0.72 0.24 -0.32 -1.51 0.00 0.00 177.10 175.50 1l2a s MET 179 N -4.82 4.12 -0.99 -0.60 1.75 -1.26 -4.98 119.30 112.52 1l2a s MET 179 Ca 0.49 -0.09 -0.04 0.00 -1.25 0.00 0.00 55.69 54.80 1l2a s MET 179 Cb -0.10 -3.53 0.26 0.00 2.84 0.00 0.00 34.83 34.30 1l2a s MET 179 CO 0.45 0.05 0.99 0.98 -0.65 0.00 0.00 175.02 176.84 1l2a n TYR 180 N 4.27 4.35 -4.16 4.11 9.36 -1.26 -4.84 117.16 128.99 1l2a n TYR 180 Ca -0.13 -3.87 -0.11 0.00 3.32 0.00 0.00 57.90 57.12 1l2a n TYR 180 Cb 0.52 -1.33 -0.10 0.00 -0.63 0.00 0.00 39.34 37.80 1l2a n TYR 180 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 1l2a s LEU 181 N -1.59 1.52 -0.18 2.98 1.43 -1.26 -4.53 118.68 117.05 1l2a s LEU 181 Ca 0.30 -1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 52.01 1l2a s LEU 181 Cb -0.05 0.35 -0.05 0.00 0.03 0.00 0.00 46.19 46.47 1l2a s LEU 181 CO -0.08 -0.78 0.23 -0.04 0.23 0.00 0.00 176.35 175.92 1l2a s MET 182 N -4.09 4.23 0.32 1.70 -1.94 -1.26 -4.28 119.30 113.98 1l2a s MET 182 Ca 0.29 -0.03 -0.28 0.00 -1.71 0.00 0.00 55.69 53.96 1l2a s MET 182 Cb 0.07 -3.43 -0.09 0.00 2.01 0.00 0.00 34.83 33.39 1l2a s MET 182 CO 0.06 0.25 1.15 -1.58 -0.01 0.00 0.00 175.02 174.88 1l2a s HIS 183 N 0.47 3.36 0.18 -0.03 2.46 -0.94 -4.00 115.29 116.79 1l2a s HIS 183 Ca 0.13 1.62 0.14 0.00 0.47 0.00 0.00 55.06 57.42 1l2a s HIS 183 Cb -0.12 -3.36 0.41 0.00 -0.13 0.00 0.00 32.58 29.38 1l2a s HIS 183 CO 0.02 -0.93 1.62 0.11 -2.47 0.00 0.00 174.74 173.08 1l2a h TRP 184 N 3.41 0.00 -3.68 3.88 5.08 -1.40 -3.38 115.95 119.85 1l2a h TRP 184 Ca -0.48 0.00 -0.34 0.00 1.08 0.00 0.00 58.89 59.15 1l2a h TRP 184 Cb 1.22 0.00 -0.31 0.00 -3.00 0.00 0.00 29.16 27.07 1l2a h TRP 184 CO 0.57 0.54 -0.75 -1.17 -1.28 0.00 0.00 178.44 176.35 1l2a s LEU 185 N -7.20 1.62 -0.09 0.11 2.96 -1.26 -1.44 118.68 113.37 1l2a s LEU 185 Ca -0.00 -0.08 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 1l2a s LEU 185 Cb 0.11 -0.29 0.04 0.00 0.50 0.00 0.00 46.19 46.55 1l2a s LEU 185 CO 0.73 -0.01 0.23 -0.32 -1.32 0.00 0.00 176.35 175.66 1l2a s MET 186 N 0.43 0.22 -0.83 1.98 -2.45 -0.94 -2.80 119.30 114.91 1l2a s MET 186 Ca -0.05 0.43 -0.20 0.00 -1.25 0.00 0.00 55.69 54.62 1l2a s MET 186 Cb -0.08 -0.02 0.11 0.00 1.25 0.00 0.00 34.83 36.09 1l2a s MET 186 CO -0.00 -0.11 1.05 0.34 1.05 0.00 0.00 175.02 177.34 1l2a s ASP 187 N 0.78 6.47 0.20 1.11 -1.08 0.12 -0.77 116.67 123.50 1l2a s ASP 187 Ca -0.05 -1.71 -0.11 0.00 -0.52 0.00 0.00 52.55 50.16 1l2a s ASP 187 Cb -0.07 -2.40 0.15 0.00 -1.46 0.00 0.00 42.92 39.15 1l2a s ASP 187 CO -0.05 -1.17 1.86 0.58 0.52 0.00 0.00 175.17 176.92 1l2a h VAL 188 N 5.88 1.15 -0.23 1.11 2.07 -1.84 -1.82 116.25 122.57 1l2a h VAL 188 Ca -0.00 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 1l2a h VAL 188 Cb 1.04 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1l2a h VAL 188 CO 1.13 0.17 -0.01 0.47 0.02 0.00 0.00 177.57 179.34 1l2a n ASP 189 N -4.62 3.44 -3.61 0.57 8.00 -1.26 -3.19 116.55 115.87 1l2a n ASP 189 Ca 0.07 -3.14 -0.21 0.00 0.71 0.00 0.00 54.79 52.22 1l2a n ASP 189 Cb 0.04 -0.54 0.06 0.00 -0.02 0.00 0.00 41.12 40.66 1l2a n ASP 189 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1l2a n ASN 190 N -0.75 -2.70 0.19 -2.24 5.15 -0.72 -4.76 115.26 109.43 1l2a n ASN 190 Ca 0.22 -0.70 0.06 0.00 -0.60 0.00 0.00 54.58 53.56 1l2a n ASN 190 Cb 0.87 -4.59 0.38 0.00 -0.53 0.00 0.00 39.78 35.91 1l2a n ASN 190 CO 0.00 0.00 0.00 -0.25 1.40 0.00 0.00 177.26 178.41 1l2a h TRP 191 N -2.03 0.00 0.00 1.20 7.01 -1.93 -1.91 115.95 118.29 1l2a h TRP 191 Ca -0.59 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 60.34 1l2a h TRP 191 Cb 1.36 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 28.41 1l2a h TRP 191 CO 0.47 0.36 -0.32 1.88 -2.79 0.00 0.00 178.44 178.05 1l2a h TYR 192 N 0.00 0.00 0.00 2.65 0.05 -1.95 -3.48 116.97 114.24 1l2a h TYR 192 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1l2a h TYR 192 Cb 0.80 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.54 1l2a h TYR 192 CO 0.00 0.32 0.00 0.41 -1.05 0.00 0.00 178.16 177.84 1l2a n GLY 193 N 0.72 1.96 0.34 3.88 0.00 -0.72 -4.31 105.19 107.07 1l2a n GLY 193 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.18 1l2a n GLY 193 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1l2a h PHE 194 N 0.00 0.00 -1.46 1.61 0.04 -1.93 -3.43 116.94 111.77 1l2a h PHE 194 Ca 0.00 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.32 1l2a h PHE 194 Cb 0.00 0.00 0.03 0.00 2.20 0.00 0.00 35.95 38.18 1l2a h PHE 194 CO 0.00 0.00 -0.13 0.20 -0.60 0.00 0.00 178.31 177.78 1l2a s GLY 195 N -3.69 1.84 0.45 -1.45 0.00 -1.26 -5.03 107.32 98.18 1l2a s GLY 195 Ca -0.03 -1.79 -0.23 0.00 0.00 0.00 0.00 44.72 42.68 1l2a s GLY 195 CO 0.28 -1.45 1.11 -0.51 0.00 0.00 0.00 173.10 172.53 1l2a s THR 196 N -2.61 3.39 0.00 0.90 -4.23 -1.26 -4.88 115.64 106.94 1l2a s THR 196 Ca 0.59 1.01 0.00 0.00 -1.18 0.00 0.00 61.69 62.10 1l2a s THR 196 Cb -0.08 -3.49 0.00 0.00 1.34 0.00 0.00 72.50 70.27 1l2a s THR 196 CO 0.37 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 1l2a n GLY 197 N 0.30 1.27 0.21 3.99 0.00 -1.26 -1.90 105.19 107.80 1l2a n GLY 197 Ca 0.07 0.33 0.08 0.00 0.00 0.00 0.00 46.02 46.50 1l2a n GLY 197 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1l2a n THR 198 N 0.00 1.75 -2.22 2.61 5.66 -1.26 -4.93 114.28 115.89 1l2a n THR 198 Ca 0.00 -1.92 -0.35 0.00 -3.05 0.00 0.00 64.05 58.73 1l2a n THR 198 Cb 0.00 -0.07 0.01 0.00 -1.55 0.00 0.00 70.33 68.71 1l2a n THR 198 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1l2a s ARG 199 N -2.44 3.34 0.13 1.09 0.52 -0.80 -4.21 118.95 116.58 1l2a s ARG 199 Ca 0.27 1.66 -0.31 0.00 -0.52 0.00 0.00 55.73 56.84 1l2a s ARG 199 Cb 0.23 -2.04 -0.08 0.00 0.52 0.00 0.00 34.95 33.58 1l2a s ARG 199 CO 0.04 -0.87 1.42 0.00 0.02 0.00 0.00 175.30 175.91 1l2a s ALA 200 N -1.72 3.63 -0.05 2.13 0.00 -1.19 -3.81 121.76 120.75 1l2a s ALA 200 Ca 0.72 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.88 1l2a s ALA 200 Cb -0.25 -3.55 0.01 0.00 0.00 0.00 0.00 23.12 19.33 1l2a s ALA 200 CO 0.29 -0.65 -0.10 0.99 0.00 0.00 0.00 175.76 176.29 1l2a s THR 201 N 1.03 0.90 0.23 0.00 2.01 -0.95 -4.94 115.64 113.91 1l2a s THR 201 Ca 0.65 -0.37 -0.30 0.00 0.31 0.00 0.00 61.69 61.99 1l2a s THR 201 Cb -0.38 -0.83 -0.09 0.00 0.01 0.00 0.00 72.50 71.21 1l2a s THR 201 CO 0.31 0.29 1.30 -0.36 -0.69 0.00 0.00 174.62 175.47 1l2a s PHE 202 N 0.54 3.24 0.16 4.92 0.40 -1.26 0.16 117.98 126.13 1l2a s PHE 202 Ca -0.10 1.27 -0.02 0.00 -0.60 0.00 0.00 56.93 57.48 1l2a s PHE 202 Cb -0.13 -3.60 -0.04 0.00 0.51 0.00 0.00 43.02 39.76 1l2a s PHE 202 CO 0.02 -1.82 0.11 0.96 0.70 0.00 0.00 175.22 175.19 1l2a s ILE 203 N -0.17 0.07 0.17 0.64 -4.36 -1.12 -1.74 121.20 114.68 1l2a s ILE 203 Ca 0.55 -1.86 -0.08 0.00 -0.26 0.00 0.00 60.65 58.99 1l2a s ILE 203 Cb -0.37 -2.15 -0.01 0.00 1.25 0.00 0.00 42.46 41.18 1l2a s ILE 203 CO 0.41 -0.31 0.28 0.21 0.24 0.00 0.00 174.94 175.77 1l2a s ASN 204 N -3.07 0.05 0.00 4.36 2.47 0.11 -4.48 114.94 114.39 1l2a s ASN 204 Ca 0.27 -0.90 0.00 0.00 0.42 0.00 0.00 52.86 52.65 1l2a s ASN 204 Cb 0.07 0.43 0.00 0.00 -1.45 0.00 0.00 41.25 40.30 1l2a s ASN 204 CO 0.05 -0.89 0.00 0.35 -3.72 0.00 0.00 177.10 172.88 1l2a n THR 205 N -0.22 0.00 -1.67 -5.21 -2.24 -1.26 -1.60 114.28 102.09 1l2a n THR 205 Ca -0.07 0.00 -0.46 0.00 -2.27 0.00 0.00 64.05 61.25 1l2a n THR 205 Cb 0.63 -0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.62 1l2a n THR 205 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1l2a n PHE 206 N -1.88 2.28 0.00 4.78 3.72 -1.26 -4.52 117.46 120.57 1l2a n PHE 206 Ca 0.00 0.27 0.00 0.00 -0.05 0.00 0.00 57.45 57.67 1l2a n PHE 206 Cb 0.00 -2.54 0.00 0.00 -0.94 0.00 0.00 39.48 36.00 1l2a n PHE 206 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1l2a n GLN 207 N 3.38 1.32 -2.30 -1.08 1.13 -1.26 -5.02 117.38 113.55 1l2a n GLN 207 Ca 0.17 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.92 1l2a n GLN 207 Cb 0.29 -0.25 0.01 0.00 0.11 0.00 0.00 30.24 30.40 1l2a n GLN 207 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1l2a n ARG 208 N -0.28 3.22 -0.01 -1.09 1.74 -1.26 -5.06 116.66 113.92 1l2a n ARG 208 Ca 0.00 -4.20 0.00 0.00 -0.77 0.00 0.00 57.85 52.88 1l2a n ARG 208 Cb 0.00 -2.26 -0.00 0.00 -1.02 0.00 0.00 32.46 29.18 1l2a n ARG 208 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1l2a n GLY 209 N -0.50 -1.99 0.26 -0.13 0.00 -1.26 -3.71 105.19 97.86 1l2a n GLY 209 Ca 0.44 -1.39 0.12 0.00 0.00 0.00 0.00 46.02 45.19 1l2a n GLY 209 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1l2a h GLU 210 N 0.00 0.00 -0.67 1.61 4.11 -1.70 -2.72 114.58 115.21 1l2a h GLU 210 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1l2a h GLU 210 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1l2a h GLU 210 CO 0.00 0.13 0.00 1.04 0.07 0.00 0.00 179.01 180.25 1l2a n GLN 211 N -3.70 2.60 -3.19 1.06 1.13 -1.26 -2.15 117.38 111.86 1l2a n GLN 211 Ca -0.02 -2.48 -0.46 0.00 -1.94 0.00 0.00 57.00 52.11 1l2a n GLN 211 Cb 0.24 -1.54 -0.02 0.00 0.11 0.00 0.00 30.24 29.04 1l2a n GLN 211 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1l2a s GLU 212 N -1.11 3.75 1.15 -1.09 2.12 -1.03 -4.75 118.70 117.74 1l2a s GLU 212 Ca 0.46 -2.43 -0.19 0.00 0.36 0.00 0.00 54.97 53.17 1l2a s GLU 212 Cb 0.24 -4.64 0.28 0.00 0.26 0.00 0.00 34.13 30.28 1l2a s GLU 212 CO 0.32 -1.45 1.08 -1.13 -0.54 0.00 0.00 175.26 173.54 1l2a n SER 213 N 4.57 -1.78 0.11 -1.70 3.41 -1.26 -4.86 113.62 112.11 1l2a n SER 213 Ca 0.20 -1.19 0.17 0.00 -0.26 0.00 0.00 58.87 57.80 1l2a n SER 213 Cb 0.46 -0.97 0.72 0.00 -0.26 0.00 0.00 64.21 64.16 1l2a n SER 213 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1l2a h THR 214 N -2.56 0.69 0.00 6.66 2.02 -1.88 -1.87 112.91 115.97 1l2a h THR 214 Ca -0.40 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.78 1l2a h THR 214 Cb 1.20 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1l2a h THR 214 CO 0.26 0.00 -0.12 0.79 0.37 0.00 0.00 175.52 176.83 1l2a n TRP 215 N -4.22 0.21 -1.02 3.16 7.02 -1.26 -3.97 117.44 117.37 1l2a n TRP 215 Ca 0.05 0.06 0.09 0.00 -1.02 0.00 0.00 57.50 56.69 1l2a n TRP 215 Cb 0.44 -0.55 0.15 0.00 -2.42 0.00 0.00 31.31 28.92 1l2a n TRP 215 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1l2a n GLU 216 N -1.68 1.53 -3.35 -0.99 1.02 -0.70 -4.59 120.64 111.87 1l2a n GLU 216 Ca 0.06 -2.57 -0.19 0.00 -0.02 0.00 0.00 57.16 54.45 1l2a n GLU 216 Cb 0.36 -1.52 -0.00 0.00 -0.02 0.00 0.00 31.44 30.26 1l2a n GLU 216 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1l2a s THR 217 N -2.80 3.86 -0.33 2.62 -4.23 -1.24 -4.68 115.64 108.83 1l2a s THR 217 Ca 0.32 -0.97 0.02 0.00 -1.18 0.00 0.00 61.69 59.88 1l2a s THR 217 Cb 0.28 -3.33 0.10 0.00 1.34 0.00 0.00 72.50 70.88 1l2a s THR 217 CO 0.04 -0.13 0.07 -0.63 -0.54 0.00 0.00 174.62 173.42 1l2a s ILE 218 N -2.23 1.78 0.44 2.99 1.01 -1.26 -5.02 121.20 118.91 1l2a s ILE 218 Ca 0.47 -2.01 -0.25 0.00 0.00 0.00 0.00 60.65 58.86 1l2a s ILE 218 Cb -0.10 -2.32 -0.09 0.00 0.01 0.00 0.00 42.46 39.96 1l2a s ILE 218 CO 0.32 -0.63 1.24 -2.65 0.00 0.00 0.00 174.94 173.22 1l2a n PRO 219 N 4.46 1.80 -3.61 2.79 -0.02 -1.26 -4.75 135.00 134.41 1l2a n PRO 219 Ca 0.02 0.64 -0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1l2a n PRO 219 Cb 0.42 -2.35 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 1l2a n PRO 219 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1l2a s HIS 220 N -1.23 -0.29 0.59 6.00 -3.43 -0.63 -4.99 115.29 111.32 1l2a s HIS 220 Ca 0.63 0.12 -0.16 0.00 -0.80 0.00 0.00 55.06 54.85 1l2a s HIS 220 Cb -0.50 0.29 -0.04 0.00 -1.43 0.00 0.00 32.58 30.90 1l2a s HIS 220 CO 0.57 -0.67 1.06 -1.25 -2.00 0.00 0.00 174.74 172.45 1l2a s PRO 221 N -3.21 3.30 -0.06 -0.38 0.04 -1.26 -0.71 135.00 132.71 1l2a s PRO 221 Ca -0.01 1.24 -0.20 0.00 0.04 0.00 0.00 61.00 62.07 1l2a s PRO 221 Cb 0.00 -2.03 -0.31 0.00 0.04 0.00 0.00 34.50 32.21 1l2a s PRO 221 CO -0.08 -0.83 0.82 0.77 0.04 0.00 0.00 177.00 177.72 1l2a h SER 222 N 0.48 0.46 -2.47 6.66 0.02 -1.62 -3.40 113.55 113.68 1l2a h SER 222 Ca -0.47 -0.93 -0.54 0.00 -0.84 0.00 0.00 61.79 59.01 1l2a h SER 222 Cb 1.22 -0.15 -0.08 0.00 0.14 0.00 0.00 62.40 63.54 1l2a h SER 222 CO 0.57 1.46 1.07 -0.63 -1.14 0.00 0.00 176.83 178.16 1l2a s ILE 223 N -2.45 3.74 -0.64 3.27 1.01 -1.26 -2.17 121.20 122.70 1l2a s ILE 223 Ca -0.15 0.48 -0.21 0.00 0.00 0.00 0.00 60.65 60.77 1l2a s ILE 223 Cb 0.02 -4.82 0.09 0.00 0.01 0.00 0.00 42.46 37.76 1l2a s ILE 223 CO 0.82 -1.70 0.85 -0.70 0.00 0.00 0.00 174.94 174.20 1l2a s GLU 224 N 5.70 3.10 -0.11 2.79 2.56 0.17 -4.89 118.70 128.01 1l2a s GLU 224 Ca 0.39 -1.11 0.17 0.00 0.00 0.00 0.00 54.97 54.42 1l2a s GLU 224 Cb -0.08 -4.27 0.65 0.00 2.00 0.00 0.00 34.13 32.43 1l2a s GLU 224 CO 0.17 -1.68 1.56 0.39 -0.56 0.00 0.00 175.26 175.14 1l2a n GLU 225 N 6.99 3.58 -0.26 4.30 1.02 -1.26 -2.54 120.64 132.47 1l2a n GLU 225 Ca -0.06 -2.80 0.00 0.00 -0.02 0.00 0.00 57.16 54.29 1l2a n GLU 225 Cb 0.44 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 1l2a n GLU 225 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1l2a n PHE 226 N 0.81 0.00 0.16 -0.32 3.72 -1.26 -4.82 117.46 115.75 1l2a n PHE 226 Ca 0.24 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.81 1l2a n PHE 226 Cb 0.85 -1.22 0.62 0.00 -0.94 0.00 0.00 39.48 38.79 1l2a n PHE 226 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1l2a h LYS 227 N 0.07 0.00 -4.23 -1.08 6.56 -1.93 -3.41 116.57 112.54 1l2a h LYS 227 Ca 0.00 0.00 -0.22 0.00 -1.06 0.00 0.00 60.65 59.37 1l2a h LYS 227 Cb 0.00 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 31.55 1l2a h LYS 227 CO 0.00 0.00 -0.36 0.71 -2.06 0.00 0.00 179.45 177.74 1l2a s TYR 228 N -4.33 0.97 0.00 -1.35 1.51 -1.26 -5.05 117.35 107.84 1l2a s TYR 228 Ca -0.03 -1.20 0.00 0.00 -1.01 0.00 0.00 57.07 54.83 1l2a s TYR 228 Cb 0.11 -0.24 0.00 0.00 -0.11 0.00 0.00 41.96 41.72 1l2a s TYR 228 CO 0.37 -0.89 0.00 0.41 -1.11 0.00 0.00 175.55 174.33 1l2a n GLY 229 N -0.41 0.67 0.00 0.71 0.00 -0.82 -4.09 105.19 101.25 1l2a n GLY 229 Ca 0.01 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1l2a n GLY 229 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l2a n GLY 230 N 0.00 0.38 0.26 -0.02 0.00 0.94 -1.56 105.19 105.19 1l2a n GLY 230 Ca 0.00 -1.82 -0.03 0.00 0.00 0.00 0.00 46.02 44.17 1l2a n GLY 230 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1l2a h PRO 231 N 0.00 0.62 -0.98 1.61 0.11 -1.92 -2.73 132.00 128.72 1l2a h PRO 231 Ca 0.00 -0.19 -0.65 0.00 0.11 0.00 0.00 66.00 65.27 1l2a h PRO 231 Cb 0.00 -0.06 -0.30 0.00 0.11 0.00 0.00 31.00 30.75 1l2a h PRO 231 CO 0.00 0.72 0.74 0.09 -0.21 0.00 0.00 178.00 179.34 1l2a n ASN 232 N -4.19 7.02 0.00 -2.05 3.02 -1.26 -4.96 115.26 112.85 1l2a n ASN 232 Ca 0.01 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.79 1l2a n ASN 232 Cb 0.34 -0.92 0.00 0.00 -0.61 0.00 0.00 39.78 38.59 1l2a n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l2a n GLY 233 N -0.94 3.97 0.14 7.41 0.00 -1.03 -2.52 105.19 112.23 1l2a n GLY 233 Ca 0.61 0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.87 1l2a n GLY 233 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l2a n PHE 234 N 13.86 0.00 0.07 1.61 3.01 -1.26 -0.04 117.46 134.71 1l2a n PHE 234 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 1l2a n PHE 234 Cb 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 1l2a n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1l2a h LEU 235 N 0.69 -0.54 0.00 4.37 3.38 -1.87 -1.24 115.31 120.09 1l2a h LEU 235 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1l2a h LEU 235 Cb 0.29 0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1l2a h LEU 235 CO 0.00 -0.26 0.00 -0.90 0.09 0.00 0.00 178.44 177.37 1l2a n ASP 236 N -5.32 0.00 0.09 -0.43 5.75 -1.26 -0.31 116.55 115.07 1l2a n ASP 236 Ca -0.06 -0.18 -0.04 0.00 -0.01 0.00 0.00 54.79 54.51 1l2a n ASP 236 Cb 0.23 -0.12 0.16 0.00 -1.03 0.00 0.00 41.12 40.36 1l2a n ASP 236 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1l2a h LEU 237 N 0.00 0.26 0.00 -2.12 3.38 -1.57 -3.39 115.31 111.86 1l2a h LEU 237 Ca 0.00 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 1l2a h LEU 237 Cb 0.05 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1l2a h LEU 237 CO 0.00 0.75 -1.36 0.49 0.09 0.00 0.00 178.44 178.41 1l2a n PHE 238 N -3.92 0.00 -3.89 1.13 3.72 0.58 -3.30 117.46 111.78 1l2a n PHE 238 Ca -0.02 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.10 1l2a n PHE 238 Cb 0.57 -0.24 -0.16 0.00 -0.94 0.00 0.00 39.48 38.71 1l2a n PHE 238 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1l2a s THR 239 N -2.12 1.09 -0.33 4.37 -4.23 -0.74 -0.54 115.64 113.14 1l2a s THR 239 Ca -0.09 -0.61 -0.29 0.00 -1.18 0.00 0.00 61.69 59.52 1l2a s THR 239 Cb 0.04 -1.27 0.00 0.00 1.34 0.00 0.00 72.50 72.61 1l2a s THR 239 CO 0.12 0.14 1.32 -0.75 -0.54 0.00 0.00 174.62 174.91 1l2a s LYS 240 N 1.64 3.83 0.34 3.99 2.20 0.13 -4.37 119.74 127.50 1l2a s LYS 240 Ca 0.01 1.16 0.08 0.00 -0.36 0.00 0.00 55.97 56.86 1l2a s LYS 240 Cb -0.15 -3.91 -0.04 0.00 -1.51 0.00 0.00 37.83 32.21 1l2a s LYS 240 CO -0.08 -1.23 0.14 0.34 -0.36 0.00 0.00 175.35 174.16 1l2a s ASP 241 N 3.05 4.68 0.04 1.43 -1.08 -1.26 -1.80 116.67 121.72 1l2a s ASP 241 Ca 0.57 -0.77 -0.21 0.00 -0.52 0.00 0.00 52.55 51.62 1l2a s ASP 241 Cb -0.16 -0.73 -0.14 0.00 -1.46 0.00 0.00 42.92 40.43 1l2a s ASP 241 CO 0.26 -0.29 1.38 0.08 0.52 0.00 0.00 175.17 177.12 1l2a h ARG 242 N 1.56 0.31 -5.42 4.34 0.11 -1.96 -3.46 114.38 109.86 1l2a h ARG 242 Ca -0.44 -0.14 -0.41 0.00 0.10 0.00 0.00 59.98 59.09 1l2a h ARG 242 Cb 1.25 -0.00 -0.17 0.00 1.11 0.00 0.00 29.97 32.16 1l2a h ARG 242 CO 0.63 0.65 -0.75 0.45 0.10 0.00 0.00 179.97 181.06 1l2a s SER 243 N -5.99 2.08 -0.13 0.08 0.15 -1.26 -5.16 113.70 103.47 1l2a s SER 243 Ca -0.14 -0.87 0.01 0.00 0.70 0.00 0.00 55.95 55.65 1l2a s SER 243 Cb 0.05 -0.07 -0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1l2a s SER 243 CO 0.74 -0.17 -0.18 -0.31 1.20 0.00 0.00 173.24 174.52 1l2a s TYR 244 N -2.42 2.72 0.16 3.44 1.51 -1.26 -5.13 117.35 116.38 1l2a s TYR 244 Ca 0.12 -0.99 0.04 0.00 -1.01 0.00 0.00 57.07 55.24 1l2a s TYR 244 Cb -0.03 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.94 1l2a s TYR 244 CO 0.03 -0.42 -0.09 0.00 -1.11 0.00 0.00 175.55 173.97 1l2a s ALA 245 N 0.60 1.49 0.06 3.71 0.00 -1.26 -5.09 121.76 121.28 1l2a s ALA 245 Ca -0.10 -1.53 -0.31 0.00 0.00 0.00 0.00 51.96 50.03 1l2a s ALA 245 Cb -0.16 0.11 -0.08 0.00 0.00 0.00 0.00 23.12 22.99 1l2a s ALA 245 CO 0.03 -0.12 1.60 0.15 0.00 0.00 0.00 175.76 177.42 1l2a s LYS 246 N -3.77 4.22 0.09 0.00 1.02 -1.26 -4.95 119.74 115.10 1l2a s LYS 246 Ca 0.18 2.26 -0.09 0.00 0.02 0.00 0.00 55.97 58.34 1l2a s LYS 246 Cb 0.03 -3.56 -0.00 0.00 -0.52 0.00 0.00 37.83 33.78 1l2a s LYS 246 CO 0.02 -0.69 0.20 1.14 -0.92 0.00 0.00 175.35 175.10 1l2a s GLN 247 N 2.46 0.87 0.09 1.68 -2.07 -1.05 0.35 119.66 121.98 1l2a s GLN 247 Ca 0.72 -0.96 0.09 0.00 -1.82 0.00 0.00 55.36 53.38 1l2a s GLN 247 Cb -0.38 0.35 -0.04 0.00 -1.09 0.00 0.00 33.01 31.85 1l2a s GLN 247 CO 0.31 -0.28 -0.21 1.67 -1.32 0.00 0.00 175.29 175.46 1l2a s TRP 248 N -3.86 2.47 -0.02 9.60 1.48 -0.26 0.41 118.94 128.75 1l2a s TRP 248 Ca 0.05 -0.31 -0.12 0.00 -1.06 0.00 0.00 56.10 54.67 1l2a s TRP 248 Cb 0.05 -1.37 0.02 0.00 -1.16 0.00 0.00 33.47 31.00 1l2a s TRP 248 CO -0.11 0.30 0.25 -0.98 -4.06 0.00 0.00 176.95 172.35 1l2a s ARG 249 N -1.79 0.55 0.15 3.25 3.03 -0.92 -1.82 118.95 121.40 1l2a s ARG 249 Ca 0.15 -0.17 0.05 0.00 2.03 0.00 0.00 55.73 57.79 1l2a s ARG 249 Cb -0.10 0.24 -0.04 0.00 -1.03 0.00 0.00 34.95 34.02 1l2a s ARG 249 CO 0.07 -0.14 -0.11 0.71 -1.13 0.00 0.00 175.30 174.69 1l2a s TYR 250 N -1.11 1.35 -0.03 5.89 2.02 0.37 -4.68 117.35 121.17 1l2a s TYR 250 Ca -0.12 -0.69 0.01 0.00 -0.37 0.00 0.00 57.07 55.90 1l2a s TYR 250 Cb -0.05 -0.68 0.01 0.00 -0.40 0.00 0.00 41.96 40.84 1l2a s TYR 250 CO 0.03 0.14 -0.05 0.99 -1.57 0.00 0.00 175.55 175.08 1l2a s THR 251 N -3.07 0.52 0.28 -0.71 2.01 -1.26 -1.33 115.64 112.07 1l2a s THR 251 Ca 0.16 -0.18 -0.00 0.00 0.31 0.00 0.00 61.69 61.98 1l2a s THR 251 Cb 0.01 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 1l2a s THR 251 CO 0.02 0.19 0.48 0.54 -0.69 0.00 0.00 174.62 175.16 1l2a s ASN 252 N 0.47 6.35 -0.33 3.53 4.22 0.39 -1.00 114.94 128.57 1l2a s ASN 252 Ca -0.06 0.44 0.03 0.00 -2.14 0.00 0.00 52.86 51.12 1l2a s ASN 252 Cb -0.10 -2.02 0.09 0.00 1.28 0.00 0.00 41.25 40.50 1l2a s ASN 252 CO -0.00 -0.17 0.03 0.00 -2.04 0.00 0.00 177.10 174.92 1l2a s ALA 253 N -2.09 2.85 0.44 3.54 0.00 -1.26 -3.85 121.76 121.39 1l2a s ALA 253 Ca 0.39 -2.32 0.25 0.00 0.00 0.00 0.00 51.96 50.29 1l2a s ALA 253 Cb -0.10 -1.93 1.40 0.00 0.00 0.00 0.00 23.12 22.49 1l2a s ALA 253 CO 0.32 -1.57 2.08 -1.00 0.00 0.00 0.00 175.76 175.59 1l2a h PRO 254 N 7.72 0.00 -0.55 0.00 0.13 -1.82 -1.46 132.00 136.02 1l2a h PRO 254 Ca -0.09 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.11 1l2a h PRO 254 Cb 1.03 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 1l2a h PRO 254 CO 0.53 0.12 0.37 0.38 -0.23 0.00 0.00 178.00 179.16 1l2a h ASP 255 N 0.00 0.39 -0.25 1.44 2.03 -1.91 -0.03 116.42 118.09 1l2a h ASP 255 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1l2a h ASP 255 Cb 0.30 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 38.70 1l2a h ASP 255 CO 0.02 0.25 0.16 0.00 -1.03 0.00 0.00 179.24 178.63 1l2a h ALA 256 N 1.71 0.32 -0.40 4.15 0.00 -1.60 -1.78 119.26 121.67 1l2a h ALA 256 Ca 0.24 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1l2a h ALA 256 Cb 0.39 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1l2a h ALA 256 CO -0.07 -0.19 0.21 0.93 0.00 0.00 0.00 179.25 180.14 1l2a h GLU 257 N 0.33 0.56 -0.14 0.00 3.07 -1.38 -2.17 114.58 114.85 1l2a h GLU 257 Ca 0.09 -0.07 0.05 0.00 -0.50 0.00 0.00 59.36 58.93 1l2a h GLU 257 Cb -0.01 -0.11 -0.06 0.00 -0.84 0.00 0.00 28.75 27.73 1l2a h GLU 257 CO -0.02 0.47 -0.27 0.78 -1.40 0.00 0.00 179.01 178.57 1l2a h GLY 258 N 0.51 -0.31 0.39 -3.84 0.00 -1.00 -1.02 103.07 97.81 1l2a h GLY 258 Ca 0.14 0.33 0.10 0.00 0.00 0.00 0.00 47.33 47.90 1l2a h GLY 258 CO -0.02 -0.21 0.30 -0.09 0.00 0.00 0.00 176.54 176.52 1l2a h ARG 259 N -0.33 0.49 -0.28 4.80 2.43 -1.24 0.58 114.38 120.83 1l2a h ARG 259 Ca 0.10 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1l2a h ARG 259 Cb 0.49 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1l2a h ARG 259 CO -0.33 0.33 0.05 0.00 -1.51 0.00 0.00 179.97 178.51 1l2a h ALA 260 N 1.44 0.37 -0.35 2.80 0.00 -0.97 0.11 119.26 122.66 1l2a h ALA 260 Ca 0.34 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1l2a h ALA 260 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1l2a h ALA 260 CO -0.30 0.05 -0.32 0.82 0.00 0.00 0.00 179.25 179.50 1l2a h ILE 261 N 0.28 1.28 -0.64 0.00 2.04 -0.87 -1.03 117.51 118.56 1l2a h ILE 261 Ca 0.09 -1.47 0.05 0.00 1.00 0.00 0.00 64.86 64.53 1l2a h ILE 261 Cb 0.32 1.36 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 1l2a h ILE 261 CO 0.00 0.48 0.36 -0.61 0.00 0.00 0.00 178.15 178.39 1l2a h GLN 262 N 0.64 0.66 -0.54 2.37 4.15 -0.68 -0.70 115.11 121.01 1l2a h GLN 262 Ca 0.07 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.38 1l2a h GLN 262 Cb 0.86 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.38 1l2a h GLN 262 CO 0.07 0.43 0.06 0.00 -1.93 0.00 0.00 178.83 177.47 1l2a h ALA 263 N 1.33 1.09 -0.17 3.38 0.00 -0.25 -2.73 119.26 121.91 1l2a h ALA 263 Ca 0.28 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1l2a h ALA 263 Cb 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1l2a h ALA 263 CO -0.17 0.58 -0.48 0.28 0.00 0.00 0.00 179.25 179.47 1l2a h VAL 264 N 0.82 1.32 -0.18 0.00 2.07 -0.48 0.12 116.25 119.92 1l2a h VAL 264 Ca 0.17 -1.69 0.05 0.00 0.82 0.00 0.00 66.70 66.04 1l2a h VAL 264 Cb 0.41 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.84 1l2a h VAL 264 CO 0.01 0.52 -0.17 0.22 0.02 0.00 0.00 177.57 178.17 1l2a h TYR 265 N 0.35 -0.45 -0.77 1.57 3.20 -0.85 0.26 116.97 120.28 1l2a h TYR 265 Ca 0.02 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 1l2a h TYR 265 Cb 0.97 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 39.43 1l2a h TYR 265 CO 0.03 -0.25 0.40 -1.49 -1.64 0.00 0.00 178.16 175.21 1l2a h TRP 266 N -0.19 1.07 -0.53 -3.82 4.06 -1.29 0.14 115.95 115.38 1l2a h TRP 266 Ca 0.11 -0.04 0.03 0.00 2.06 0.00 0.00 58.89 61.06 1l2a h TRP 266 Cb 0.36 -0.34 -0.04 0.00 -1.00 0.00 0.00 29.16 28.15 1l2a h TRP 266 CO -0.31 0.77 0.30 0.00 -3.56 0.00 0.00 178.44 175.64 1l2a h ALA 267 N 1.21 0.68 0.00 1.49 0.00 -0.22 0.34 119.26 122.75 1l2a h ALA 267 Ca 0.27 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1l2a h ALA 267 Cb 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1l2a h ALA 267 CO -0.04 -0.00 -0.00 -0.97 0.00 0.00 0.00 179.25 178.24 1l2a h ASN 268 N 0.60 -0.00 0.25 0.00 -0.73 -0.27 -0.50 115.58 114.92 1l2a h ASN 268 Ca 0.22 -0.08 -0.00 0.00 1.87 0.00 0.00 56.30 58.30 1l2a h ASN 268 Cb 0.06 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 1l2a h ASN 268 CO -0.11 0.08 -0.20 0.50 -0.37 0.00 0.00 177.43 177.33 1l2a h LYS 269 N -0.09 -0.44 -0.42 6.67 3.64 -0.72 -1.48 116.57 123.72 1l2a h LYS 269 Ca -0.00 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1l2a h LYS 269 Cb 0.09 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1l2a h LYS 269 CO 0.00 -0.30 0.08 -1.49 -2.27 0.00 0.00 179.45 175.48 1l2a h TRP 270 N -0.46 0.65 -0.28 1.91 6.55 -0.96 -2.23 115.95 121.14 1l2a h TRP 270 Ca -0.01 -0.05 -0.12 0.00 0.95 0.00 0.00 58.89 59.65 1l2a h TRP 270 Cb 0.41 -0.19 -0.00 0.00 -0.86 0.00 0.00 29.16 28.51 1l2a h TRP 270 CO -0.13 0.58 -0.31 0.00 -1.05 0.00 0.00 178.44 177.53 1l2a h ALA 271 N 1.47 0.42 -0.51 1.49 0.00 -0.90 -3.10 119.26 118.14 1l2a h ALA 271 Ca 0.14 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1l2a h ALA 271 Cb 0.27 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1l2a h ALA 271 CO 0.00 0.45 0.06 0.87 0.00 0.00 0.00 179.25 180.63 1l2a h LYS 272 N 0.45 0.81 -0.90 0.00 1.57 -1.11 0.10 116.57 117.50 1l2a h LYS 272 Ca 0.04 -0.19 0.19 0.00 -1.87 0.00 0.00 60.65 58.82 1l2a h LYS 272 Cb 0.89 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 33.02 1l2a h LYS 272 CO 0.08 0.78 0.59 0.93 -0.57 0.00 0.00 179.45 181.25 1l2a h GLU 273 N 0.77 0.46 -0.01 3.15 5.08 -1.38 -0.77 114.58 121.88 1l2a h GLU 273 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1l2a h GLU 273 Cb 0.38 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1l2a h GLU 273 CO 0.01 0.30 -0.01 1.04 -1.00 0.00 0.00 179.01 179.35 1l2a n GLN 274 N -4.53 1.61 -2.34 2.33 6.02 -0.75 -4.91 117.38 114.80 1l2a n GLN 274 Ca 0.19 -0.91 -0.11 0.00 -0.01 0.00 0.00 57.00 56.16 1l2a n GLN 274 Cb 0.65 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.43 1l2a n GLN 274 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1l2a n GLY 275 N 1.17 -0.04 0.28 1.08 0.00 -0.29 -4.94 105.19 102.45 1l2a n GLY 275 Ca 0.19 -0.40 0.06 0.00 0.00 0.00 0.00 46.02 45.88 1l2a n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l2a n LYS 276 N -2.16 0.87 -0.05 1.61 5.02 0.29 -4.83 118.16 118.91 1l2a n LYS 276 Ca -0.11 -2.12 0.25 0.00 -2.02 0.00 0.00 58.31 54.31 1l2a n LYS 276 Cb 0.59 -1.15 0.71 0.00 -0.02 0.00 0.00 35.03 35.16 1l2a n LYS 276 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1l2a h GLY 277 N 0.09 0.00 1.94 0.72 0.00 -1.85 -1.10 103.07 102.87 1l2a h GLY 277 Ca -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 1l2a h GLY 277 CO 0.00 0.00 -0.22 1.48 0.00 0.00 0.00 176.54 177.80 1l2a h SER 278 N 0.00 0.07 0.24 0.19 4.64 -1.92 -2.10 113.55 114.67 1l2a h SER 278 Ca 0.32 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1l2a h SER 278 Cb 1.52 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 1l2a h SER 278 CO -0.00 0.30 0.00 0.00 -0.87 0.00 0.00 176.83 176.26 1l2a n ALA 279 N -2.49 1.25 -0.38 5.18 0.00 -0.42 -2.97 120.51 120.68 1l2a n ALA 279 Ca -0.02 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1l2a n ALA 279 Cb 0.30 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1l2a n ALA 279 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1l2a n VAL 280 N -2.16 0.11 -0.04 0.00 0.24 -0.84 -4.78 118.33 110.87 1l2a n VAL 280 Ca -0.00 -0.36 -0.08 0.00 -2.04 0.00 0.00 64.34 61.85 1l2a n VAL 280 Cb 0.09 1.26 -0.02 0.00 -1.47 0.00 0.00 33.84 33.70 1l2a n VAL 280 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l2a h ALA 281 N 0.00 0.08 -0.65 2.33 0.00 -1.33 0.12 119.26 119.82 1l2a h ALA 281 Ca 0.00 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1l2a h ALA 281 Cb 0.28 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1l2a h ALA 281 CO 0.00 -0.51 0.38 0.66 0.00 0.00 0.00 179.25 179.78 1l2a h SER 282 N -0.06 0.59 -0.90 0.00 4.64 -1.89 -1.10 113.55 114.84 1l2a h SER 282 Ca 0.10 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.42 1l2a h SER 282 Cb 0.21 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 1l2a h SER 282 CO -0.23 0.40 0.50 0.58 -0.87 0.00 0.00 176.83 177.20 1l2a h VAL 283 N 0.72 1.26 -0.74 0.95 2.07 -1.81 -1.23 116.25 117.47 1l2a h VAL 283 Ca 0.28 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 67.23 1l2a h VAL 283 Cb 0.10 0.03 -0.06 0.00 -1.52 0.00 0.00 31.29 29.85 1l2a h VAL 283 CO -0.14 0.29 0.44 0.58 0.02 0.00 0.00 177.57 178.76 1l2a h VAL 284 N 1.25 1.01 -0.37 2.57 2.07 0.27 0.14 116.25 123.20 1l2a h VAL 284 Ca 0.32 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1l2a h VAL 284 Cb 0.01 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1l2a h VAL 284 CO -0.05 0.15 0.19 0.28 0.02 0.00 0.00 177.57 178.15 1l2a h SER 285 N 0.82 0.48 -0.71 0.57 0.02 -0.43 -0.22 113.55 114.07 1l2a h SER 285 Ca 0.32 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 1l2a h SER 285 Cb 0.16 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1l2a h SER 285 CO -0.17 0.46 0.29 0.11 -1.14 0.00 0.00 176.83 176.38 1l2a h LYS 286 N 0.47 1.06 -0.78 3.45 1.57 -0.85 -1.89 116.57 119.59 1l2a h LYS 286 Ca 0.13 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1l2a h LYS 286 Cb 0.10 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1l2a h LYS 286 CO -0.02 0.87 0.32 0.00 -0.57 0.00 0.00 179.45 180.05 1l2a h ALA 287 N 1.14 1.01 -0.22 3.86 0.00 -0.48 0.10 119.26 124.68 1l2a h ALA 287 Ca 0.24 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1l2a h ALA 287 Cb 0.20 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1l2a h ALA 287 CO -0.02 0.63 0.10 0.00 0.00 0.00 0.00 179.25 179.96 1l2a h ALA 288 N 1.17 0.26 0.09 0.00 0.00 -0.69 -0.73 119.26 119.36 1l2a h ALA 288 Ca 0.26 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1l2a h ALA 288 Cb 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1l2a h ALA 288 CO -0.02 -0.31 -0.16 -0.22 0.00 0.00 0.00 179.25 178.53 1l2a h LYS 289 N 0.22 -0.30 -0.86 0.00 3.64 -0.97 -1.35 116.57 116.95 1l2a h LYS 289 Ca 0.09 0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.69 1l2a h LYS 289 Cb 0.03 0.07 -0.12 0.00 -0.41 0.00 0.00 32.23 31.80 1l2a h LYS 289 CO -0.07 -0.20 0.35 1.98 -2.27 0.00 0.00 179.45 179.24 1l2a h MET 290 N -0.32 0.38 -0.59 1.90 4.05 -0.51 0.45 114.93 120.30 1l2a h MET 290 Ca 0.02 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1l2a h MET 290 Cb 0.34 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.02 1l2a h MET 290 CO -0.09 0.25 0.29 0.78 0.23 0.00 0.00 176.91 178.37 1l2a h GLY 291 N 0.40 0.91 0.39 1.39 0.00 -0.43 -2.39 103.07 103.34 1l2a h GLY 291 Ca 0.52 -0.45 0.06 0.00 0.00 0.00 0.00 47.33 47.46 1l2a h GLY 291 CO -0.51 0.43 -0.06 -1.80 0.00 0.00 0.00 176.54 174.60 1l2a h ASP 292 N 0.81 -0.26 -0.07 0.19 1.82 0.16 -2.70 116.42 116.37 1l2a h ASP 292 Ca 0.20 0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.92 1l2a h ASP 292 Cb 0.11 0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.29 1l2a h ASP 292 CO -0.03 -0.09 0.01 -0.26 -1.61 0.00 0.00 179.24 177.26 1l2a h PHE 293 N 0.02 0.19 0.00 0.28 -1.00 -1.16 -2.07 116.94 113.20 1l2a h PHE 293 Ca 0.15 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.93 1l2a h PHE 293 Cb 0.23 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 39.73 1l2a h PHE 293 CO -0.29 0.20 0.15 1.28 -1.61 0.00 0.00 178.31 178.04 1l2a n LEU 294 N -4.43 0.18 0.13 1.54 4.32 -0.92 -0.86 117.00 116.96 1l2a n LEU 294 Ca -0.01 0.48 0.04 0.00 -0.02 0.00 0.00 56.01 56.51 1l2a n LEU 294 Cb 0.15 -0.48 0.46 0.00 -1.62 0.00 0.00 43.42 41.92 1l2a n LEU 294 CO 0.36 -0.54 0.99 0.03 -1.22 0.00 0.00 177.39 177.00 1l2a h ARG 295 N 0.00 0.24 -0.69 3.23 3.08 -1.48 -1.45 114.38 117.30 1l2a h ARG 295 Ca 0.00 -0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.20 1l2a h ARG 295 Cb 0.30 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1l2a h ARG 295 CO 0.00 0.28 0.49 -0.91 -1.07 0.00 0.00 179.97 178.76 1l2a h ASN 296 N 0.24 0.07 0.13 7.04 2.35 -1.23 0.85 115.58 125.03 1l2a h ASN 296 Ca 0.06 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1l2a h ASN 296 Cb 0.20 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1l2a h ASN 296 CO 0.01 0.03 0.00 0.47 -1.65 0.00 0.00 177.43 176.29 1l2a n ASP 297 N -4.36 0.00 -0.48 5.81 8.00 -0.55 -3.51 116.55 121.46 1l2a n ASP 297 Ca 0.14 -0.62 0.14 0.00 0.71 0.00 0.00 54.79 55.16 1l2a n ASP 297 Cb 0.71 -0.08 0.51 0.00 -0.02 0.00 0.00 41.12 42.25 1l2a n ASP 297 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1l2a n MET 298 N -1.08 1.65 -4.49 -1.24 2.81 0.29 -1.77 117.12 113.29 1l2a n MET 298 Ca 0.18 -0.96 -0.30 0.00 -1.81 0.00 0.00 57.70 54.81 1l2a n MET 298 Cb 0.12 -1.48 -0.12 0.00 -0.71 0.00 0.00 33.22 31.03 1l2a n MET 298 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1l2a s PHE 299 N -2.02 2.46 0.47 2.03 0.40 -1.23 -0.94 117.98 119.16 1l2a s PHE 299 Ca 0.37 -0.31 -0.19 0.00 -0.60 0.00 0.00 56.93 56.20 1l2a s PHE 299 Cb 0.21 -1.36 -0.14 0.00 0.51 0.00 0.00 43.02 42.24 1l2a s PHE 299 CO 0.34 0.31 0.08 -3.47 0.70 0.00 0.00 175.22 173.18 1l2a n ASP 300 N 1.13 -2.85 -0.13 1.36 2.03 -0.79 -1.20 116.55 116.10 1l2a n ASP 300 Ca -0.16 0.74 -0.04 0.00 0.52 0.00 0.00 54.79 55.84 1l2a n ASP 300 Cb 0.53 -0.92 0.03 0.00 -0.72 0.00 0.00 41.12 40.03 1l2a n ASP 300 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1l2a h LYS 301 N 0.19 0.05 -0.49 -0.67 3.64 -1.77 -2.38 116.57 115.15 1l2a h LYS 301 Ca -0.40 -0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.67 1l2a h LYS 301 Cb 1.44 -0.01 -0.19 0.00 -0.41 0.00 0.00 32.23 33.05 1l2a h LYS 301 CO 0.45 0.03 -0.19 0.66 -2.27 0.00 0.00 179.45 178.14 1l2a n TYR 302 N -5.27 1.62 -4.07 1.91 4.01 -1.26 -2.58 117.16 111.53 1l2a n TYR 302 Ca 0.03 -1.90 -0.32 0.00 -0.16 0.00 0.00 57.90 55.55 1l2a n TYR 302 Cb 0.23 -0.55 -0.01 0.00 -0.31 0.00 0.00 39.34 38.71 1l2a n TYR 302 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1l2a n PHE 303 N -1.01 -1.89 -3.03 -0.72 3.01 -0.89 -2.53 117.46 110.40 1l2a n PHE 303 Ca 0.38 0.82 -0.31 0.00 1.01 0.00 0.00 57.45 59.35 1l2a n PHE 303 Cb 0.96 -3.43 -0.05 0.00 -0.01 0.00 0.00 39.48 36.95 1l2a n PHE 303 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1l2a s MET 304 N -6.74 3.89 0.14 -1.08 -1.94 -1.26 -1.62 119.30 110.69 1l2a s MET 304 Ca 0.56 0.56 -0.35 0.00 -1.71 0.00 0.00 55.69 54.75 1l2a s MET 304 Cb -0.30 -2.42 -0.15 0.00 2.01 0.00 0.00 34.83 33.97 1l2a s MET 304 CO 0.89 0.08 1.37 1.63 -0.01 0.00 0.00 175.02 178.99 1l2a n LYS 305 N -0.77 1.51 -1.91 2.03 5.02 -0.36 -4.41 118.16 119.27 1l2a n LYS 305 Ca 0.03 0.54 -0.42 0.00 -2.02 0.00 0.00 58.31 56.44 1l2a n LYS 305 Cb 0.53 -2.19 -0.03 0.00 -0.02 0.00 0.00 35.03 33.32 1l2a n LYS 305 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1l2a s ILE 306 N 0.40 2.91 0.00 -0.18 -1.09 -0.60 -2.76 121.20 119.87 1l2a s ILE 306 Ca 0.79 0.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.66 1l2a s ILE 306 Cb -0.83 -3.29 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 1l2a s ILE 306 CO 0.46 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.79 1l2a n GLY 307 N 3.96 0.77 0.32 6.18 0.00 -1.25 -4.92 105.19 110.24 1l2a n GLY 307 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.17 1l2a n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l2a h ALA 308 N 0.00 1.41 -6.02 4.61 0.00 -1.81 -3.47 119.26 113.98 1l2a h ALA 308 Ca 0.00 -0.11 -0.42 0.00 0.00 0.00 0.00 54.91 54.38 1l2a h ALA 308 Cb 0.00 -0.24 0.07 0.00 0.00 0.00 0.00 17.79 17.61 1l2a h ALA 308 CO 0.00 0.47 -0.74 1.04 0.00 0.00 0.00 179.25 180.02 1l2a n GLN 309 N -4.37 -6.51 0.00 0.00 6.02 -1.26 -4.91 117.38 106.35 1l2a n GLN 309 Ca 0.06 0.72 0.00 0.00 -0.01 0.00 0.00 57.00 57.77 1l2a n GLN 309 Cb 0.11 -5.64 0.00 0.00 1.02 0.00 0.00 30.24 25.73 1l2a n GLN 309 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1l2a n ASP 310 N -2.98 0.00 -2.53 1.08 8.00 -1.14 -4.12 116.55 114.87 1l2a n ASP 310 Ca -0.06 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.12 1l2a n ASP 310 Cb 0.58 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.69 1l2a n ASP 310 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1l2a n LYS 311 N -0.18 2.49 -2.46 -1.24 5.02 -1.26 -4.85 118.16 115.69 1l2a n LYS 311 Ca 0.00 -2.82 -0.43 0.00 -2.02 0.00 0.00 58.31 53.04 1l2a n LYS 311 Cb 0.00 -2.14 -0.02 0.00 -0.02 0.00 0.00 35.03 32.85 1l2a n LYS 311 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1l2a s THR 312 N -3.71 4.15 0.63 -0.18 2.01 -1.26 -4.80 115.64 112.48 1l2a s THR 312 Ca 0.54 1.26 -0.18 0.00 0.31 0.00 0.00 61.69 63.62 1l2a s THR 312 Cb 0.41 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 68.65 1l2a s THR 312 CO -0.22 -0.60 1.21 -2.84 -0.69 0.00 0.00 174.62 171.48 1l2a s PRO 313 N 4.29 2.74 0.14 4.92 0.02 -1.26 -1.22 135.00 144.63 1l2a s PRO 313 Ca 0.55 1.82 0.07 0.00 0.02 0.00 0.00 61.00 63.46 1l2a s PRO 313 Cb -0.14 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.44 1l2a s PRO 313 CO 0.25 -1.39 -0.03 0.00 -0.33 0.00 0.00 177.00 175.50 1l2a s ALA 314 N -1.68 3.15 -0.25 -1.55 0.00 -0.64 -4.48 121.76 116.31 1l2a s ALA 314 Ca 0.77 -1.30 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 1l2a s ALA 314 Cb -0.31 -1.00 -0.10 0.00 0.00 0.00 0.00 23.12 21.72 1l2a s ALA 314 CO 0.37 0.56 -0.35 0.25 0.00 0.00 0.00 175.76 176.59 1l2a n THR 315 N 0.20 1.50 0.00 0.00 -2.24 -1.26 -1.29 114.28 111.18 1l2a n THR 315 Ca -0.11 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1l2a n THR 315 Cb 0.54 -2.00 0.00 0.00 -2.10 0.00 0.00 70.33 66.76 1l2a n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l2a n GLY 316 N 1.35 0.41 1.60 3.38 0.00 -1.26 -4.58 105.19 106.09 1l2a n GLY 316 Ca -0.42 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.65 1l2a n GLY 316 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1l2a n TYR 317 N 0.00 1.64 0.43 1.61 4.01 -1.26 -4.30 117.16 119.29 1l2a n TYR 317 Ca 0.00 -0.57 0.12 0.00 -0.16 0.00 0.00 57.90 57.29 1l2a n TYR 317 Cb 0.00 -0.42 0.48 0.00 -0.31 0.00 0.00 39.34 39.09 1l2a n TYR 317 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1l2a n ASP 318 N 0.52 0.66 -0.20 7.72 9.92 -1.26 -2.22 116.55 131.69 1l2a n ASP 318 Ca 0.22 0.65 0.12 0.00 -0.53 0.00 0.00 54.79 55.25 1l2a n ASP 318 Cb 0.99 -0.79 0.27 0.00 -0.64 0.00 0.00 41.12 40.95 1l2a n ASP 318 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1l2a n SER 319 N -2.21 1.01 -4.65 -2.24 3.41 -1.26 -1.56 113.62 106.12 1l2a n SER 319 Ca 0.02 -0.81 -0.43 0.00 -0.26 0.00 0.00 58.87 57.40 1l2a n SER 319 Cb 0.25 0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 1l2a n SER 319 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l2a s ALA 320 N -2.66 3.56 -0.32 7.33 0.00 -0.94 -1.89 121.76 126.84 1l2a s ALA 320 Ca 0.19 0.09 0.22 0.00 0.00 0.00 0.00 51.96 52.47 1l2a s ALA 320 Cb 0.18 -3.64 0.15 0.00 0.00 0.00 0.00 23.12 19.81 1l2a s ALA 320 CO 0.59 -1.36 1.30 1.12 0.00 0.00 0.00 175.76 177.42 1l2a h HIS 321 N 8.06 0.00 0.00 0.00 2.07 -1.37 -3.47 115.15 120.44 1l2a h HIS 321 Ca -0.21 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.31 1l2a h HIS 321 Cb 1.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.05 1l2a h HIS 321 CO 0.81 0.04 0.00 0.66 -3.07 0.00 0.00 177.93 176.37 1l2a n TYR 322 N -2.89 0.00 -3.46 6.12 4.01 -1.03 -5.00 117.16 114.90 1l2a n TYR 322 Ca 0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.57 1l2a n TYR 322 Cb 0.56 -0.77 -0.00 0.00 -0.31 0.00 0.00 39.34 38.81 1l2a n TYR 322 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1l2a s LEU 323 N 0.00 3.97 -0.65 7.72 1.43 -1.26 -4.55 118.68 125.34 1l2a s LEU 323 Ca 0.00 -0.19 -0.25 0.00 -1.03 0.00 0.00 54.13 52.66 1l2a s LEU 323 Cb 0.00 -2.76 0.05 0.00 0.03 0.00 0.00 46.19 43.51 1l2a s LEU 323 CO 0.00 -0.43 1.09 -0.04 0.23 0.00 0.00 176.35 177.20 1l2a s MET 324 N -4.18 3.24 1.08 1.70 -1.94 -1.26 -3.79 119.30 114.15 1l2a s MET 324 Ca 0.45 -0.36 -0.17 0.00 -1.71 0.00 0.00 55.69 53.89 1l2a s MET 324 Cb -0.10 -4.14 0.24 0.00 2.01 0.00 0.00 34.83 32.84 1l2a s MET 324 CO 0.31 -1.83 1.21 0.00 -0.01 0.00 0.00 175.02 174.70 1l2a s ALA 325 N 4.70 1.42 0.38 3.03 0.00 -0.73 -4.45 121.76 126.11 1l2a s ALA 325 Ca 0.31 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 51.30 1l2a s ALA 325 Cb -0.12 -2.84 0.76 0.00 0.00 0.00 0.00 23.12 20.92 1l2a s ALA 325 CO 0.16 -2.99 1.94 2.35 0.00 0.00 0.00 175.76 177.22 1l2a h TRP 326 N -2.09 0.40 -2.85 0.00 2.91 -1.56 -3.43 115.95 109.34 1l2a h TRP 326 Ca -0.45 -0.03 0.07 0.00 1.13 0.00 0.00 58.89 59.61 1l2a h TRP 326 Cb 1.27 -0.12 -0.08 0.00 -0.51 0.00 0.00 29.16 29.72 1l2a h TRP 326 CO -1.55 0.40 0.28 1.52 -1.03 0.00 0.00 178.44 178.06 1l2a s TYR 327 N -5.00 -0.28 0.01 2.65 -0.85 -1.26 -4.42 117.35 108.19 1l2a s TYR 327 Ca -0.07 -0.06 0.07 0.00 -0.52 0.00 0.00 57.07 56.49 1l2a s TYR 327 Cb 0.16 0.65 -0.02 0.00 0.38 0.00 0.00 41.96 43.13 1l2a s TYR 327 CO 0.74 -1.02 -0.21 -0.08 -1.52 0.00 0.00 175.55 173.46 1l2a s THR 328 N -3.72 1.69 0.03 -3.49 -1.32 -1.25 -3.48 115.64 104.09 1l2a s THR 328 Ca 0.08 -1.05 0.02 0.00 -1.21 0.00 0.00 61.69 59.53 1l2a s THR 328 Cb -0.04 -1.43 -0.02 0.00 -1.51 0.00 0.00 72.50 69.51 1l2a s THR 328 CO -0.00 0.35 -0.07 0.00 -2.21 0.00 0.00 174.62 172.69 1l2a s ALA 329 N -0.64 0.56 -0.00 11.08 0.00 -1.01 -0.46 121.76 131.28 1l2a s ALA 329 Ca 0.08 -0.58 -0.16 0.00 0.00 0.00 0.00 51.96 51.30 1l2a s ALA 329 Cb -0.08 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.04 1l2a s ALA 329 CO 0.00 0.04 0.34 1.67 0.00 0.00 0.00 175.76 177.81 1l2a s TRP 330 N -0.90 -0.20 0.24 0.00 -2.14 -0.44 -0.37 118.94 115.12 1l2a s TRP 330 Ca -0.05 0.26 -0.21 0.00 2.66 0.00 0.00 56.10 58.76 1l2a s TRP 330 Cb -0.07 0.12 0.06 0.00 -3.10 0.00 0.00 33.47 30.48 1l2a s TRP 330 CO 0.00 -0.44 0.92 0.20 -2.66 0.00 0.00 176.95 174.97 1l2a s GLY 331 N -1.50 0.07 0.33 3.67 0.00 -0.78 -0.48 107.32 108.63 1l2a s GLY 331 Ca -0.11 -0.33 -0.18 0.00 0.00 0.00 0.00 44.72 44.10 1l2a s GLY 331 CO 0.03 0.77 0.77 -0.32 0.00 0.00 0.00 173.10 174.34 1l2a s GLY 332 N -3.14 0.14 0.57 0.20 0.00 -0.76 -0.65 107.32 103.68 1l2a s GLY 332 Ca 0.16 -0.53 -0.19 0.00 0.00 0.00 0.00 44.72 44.17 1l2a s GLY 332 CO 0.06 -0.15 1.17 -0.32 0.00 0.00 0.00 173.10 173.87 1l2a s GLY 333 N -3.01 2.70 -0.18 0.20 0.00 -0.99 -1.11 107.32 104.94 1l2a s GLY 333 Ca 0.13 0.93 -0.21 0.00 0.00 0.00 0.00 44.72 45.57 1l2a s GLY 333 CO 0.09 1.31 0.35 -2.22 0.00 0.00 0.00 173.10 172.63 1l2a h ILE 334 N 1.07 1.06 0.00 0.90 2.04 -0.43 -3.44 117.51 118.71 1l2a h ILE 334 Ca -0.50 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.12 1l2a h ILE 334 Cb 1.28 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 1l2a h ILE 334 CO 0.56 0.43 0.00 0.61 0.00 0.00 0.00 178.15 179.75 1l2a n GLY 335 N 1.52 -1.55 3.76 5.37 0.00 -1.25 -4.89 105.19 108.16 1l2a n GLY 335 Ca -0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 1l2a n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l2a s ALA 336 N -2.28 2.52 -0.41 4.61 0.00 -1.26 -4.99 121.76 119.95 1l2a s ALA 336 Ca 0.00 0.87 -0.21 0.00 0.00 0.00 0.00 51.96 52.62 1l2a s ALA 336 Cb 0.00 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.73 1l2a s ALA 336 CO 0.00 -1.17 0.66 -1.54 0.00 0.00 0.00 175.76 173.71 1l2a s SER 337 N -1.86 6.38 0.17 0.00 1.04 -1.26 -4.34 113.70 113.82 1l2a s SER 337 Ca 0.74 -0.11 -0.14 0.00 0.48 0.00 0.00 55.95 56.92 1l2a s SER 337 Cb -0.27 -2.33 0.01 0.00 0.10 0.00 0.00 66.02 63.53 1l2a s SER 337 CO 0.34 -0.72 0.40 -1.66 0.98 0.00 0.00 173.24 172.58 1l2a s TRP 338 N 2.84 0.07 0.10 5.02 1.48 -1.26 -4.92 118.94 122.27 1l2a s TRP 338 Ca 0.24 -0.42 -0.22 0.00 -1.06 0.00 0.00 56.10 54.64 1l2a s TRP 338 Cb -0.14 0.19 0.06 0.00 -1.16 0.00 0.00 33.47 32.41 1l2a s TRP 338 CO 0.18 -0.79 0.55 0.00 -4.06 0.00 0.00 176.95 172.82 1l2a s ALA 339 N -3.90 -1.41 0.07 2.67 0.00 -1.26 -2.35 121.76 115.59 1l2a s ALA 339 Ca 0.11 0.50 -0.08 0.00 0.00 0.00 0.00 51.96 52.49 1l2a s ALA 339 Cb 0.01 0.61 -0.01 0.00 0.00 0.00 0.00 23.12 23.74 1l2a s ALA 339 CO -0.04 -0.63 0.15 1.67 0.00 0.00 0.00 175.76 176.92 1l2a s TRP 340 N -3.11 0.18 -0.10 0.00 1.48 0.18 -4.40 118.94 113.16 1l2a s TRP 340 Ca -0.02 -0.56 -0.09 0.00 -1.06 0.00 0.00 56.10 54.37 1l2a s TRP 340 Cb -0.00 -0.10 0.03 0.00 -1.16 0.00 0.00 33.47 32.23 1l2a s TRP 340 CO -0.07 -0.48 0.27 0.21 -4.06 0.00 0.00 176.95 172.83 1l2a s LYS 341 N -3.43 0.32 0.14 3.25 2.20 -0.45 -1.87 119.74 119.90 1l2a s LYS 341 Ca 0.02 0.39 0.09 0.00 -0.36 0.00 0.00 55.97 56.10 1l2a s LYS 341 Cb 0.03 0.14 -0.04 0.00 -1.51 0.00 0.00 37.83 36.46 1l2a s LYS 341 CO -0.09 -0.04 -0.20 0.96 -0.36 0.00 0.00 175.35 175.62 1l2a s ILE 342 N 0.20 1.83 0.00 5.43 -4.36 0.50 -4.17 121.20 120.63 1l2a s ILE 342 Ca -0.00 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.62 1l2a s ILE 342 Cb -0.02 -1.76 0.00 0.00 1.25 0.00 0.00 42.46 41.93 1l2a s ILE 342 CO -0.00 -0.18 0.00 0.61 0.24 0.00 0.00 174.94 175.61 1l2a n GLY 343 N 0.64 1.58 3.39 6.27 0.00 -1.06 -2.41 105.19 113.59 1l2a n GLY 343 Ca -0.16 -1.65 -0.15 0.00 0.00 0.00 0.00 46.02 44.06 1l2a n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l2a n SER 345 N 1.91 0.63 -4.84 0.00 7.64 -1.26 -3.67 113.62 114.02 1l2a n SER 345 Ca -0.17 -0.30 -0.37 0.00 1.01 0.00 0.00 58.87 59.04 1l2a n SER 345 Cb 0.56 0.82 -0.07 0.00 -1.01 0.00 0.00 64.21 64.52 1l2a n SER 345 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1l2a s HIS 346 N -3.17 3.54 -0.04 1.43 3.76 -1.26 -1.33 115.29 118.22 1l2a s HIS 346 Ca 0.04 0.47 0.01 0.00 -0.15 0.00 0.00 55.06 55.44 1l2a s HIS 346 Cb 0.15 -1.96 0.02 0.00 1.11 0.00 0.00 32.58 31.89 1l2a s HIS 346 CO 0.81 0.65 -0.06 0.00 -0.85 0.00 0.00 174.74 175.29 1l2a s ALA 347 N -0.81 0.74 -0.05 -1.40 0.00 0.00 -1.44 121.76 118.80 1l2a s ALA 347 Ca 0.14 -0.12 0.06 0.00 0.00 0.00 0.00 51.96 52.04 1l2a s ALA 347 Cb -0.12 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 1l2a s ALA 347 CO 0.03 0.03 -0.24 -1.58 0.00 0.00 0.00 175.76 174.00 1l2a s HIS 348 N 0.74 2.31 0.39 0.00 5.04 -1.26 -1.27 115.29 121.25 1l2a s HIS 348 Ca -0.11 -0.65 0.09 0.00 -1.54 0.00 0.00 55.06 52.85 1l2a s HIS 348 Cb -0.13 -1.52 0.86 0.00 0.04 0.00 0.00 32.58 31.83 1l2a s HIS 348 CO 0.01 -0.18 1.98 0.27 -2.34 0.00 0.00 174.74 174.48 1l2a h PHE 349 N 6.00 0.61 0.00 3.88 -0.00 -0.89 -2.24 116.94 124.29 1l2a h PHE 349 Ca -0.33 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.65 1l2a h PHE 349 Cb 1.17 -0.20 0.00 0.00 -0.00 0.00 0.00 35.95 36.92 1l2a h PHE 349 CO 0.42 0.32 0.00 0.41 -0.00 0.00 0.00 178.31 179.47 1l2a n GLY 350 N -1.48 -0.47 0.07 6.09 0.00 -1.26 -1.87 105.19 106.27 1l2a n GLY 350 Ca 0.09 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.13 1l2a n GLY 350 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1l2a n TYR 351 N -1.29 0.00 -2.41 1.61 4.02 -0.84 -4.62 117.16 113.62 1l2a n TYR 351 Ca 0.03 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.57 1l2a n TYR 351 Cb 0.04 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.35 1l2a n TYR 351 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1l2a s GLN 352 N -1.62 3.67 -0.43 -0.72 -1.52 -0.78 -4.44 119.66 113.82 1l2a s GLN 352 Ca 0.05 1.52 0.06 0.00 -1.95 0.00 0.00 55.36 55.03 1l2a s GLN 352 Cb 0.07 -2.14 0.20 0.00 -0.22 0.00 0.00 33.01 30.92 1l2a s GLN 352 CO 0.31 -0.57 0.50 -1.71 -0.25 0.00 0.00 175.29 173.57 1l2a n ASN 353 N -0.94 -0.98 0.30 5.90 2.85 -1.26 -4.89 115.26 116.24 1l2a n ASN 353 Ca 0.09 -2.63 0.16 0.00 -0.11 0.00 0.00 54.58 52.09 1l2a n ASN 353 Cb 0.51 -0.00 0.93 0.00 1.24 0.00 0.00 39.78 42.45 1l2a n ASN 353 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1l2a h PRO 354 N 4.91 0.00 0.30 1.20 0.13 -1.89 -0.26 132.00 136.38 1l2a h PRO 354 Ca 0.14 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.26 1l2a h PRO 354 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1l2a h PRO 354 CO 0.34 0.01 -0.14 0.35 -0.23 0.00 0.00 178.00 178.33 1l2a h PHE 355 N 0.00 -0.37 -0.71 1.56 3.57 -1.94 0.11 116.94 119.16 1l2a h PHE 355 Ca -0.00 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.55 1l2a h PHE 355 Cb 0.04 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.85 1l2a h PHE 355 CO 0.00 -0.02 0.41 0.37 -2.23 0.00 0.00 178.31 176.84 1l2a h GLN 356 N -0.83 0.73 -0.33 1.11 -0.00 -1.73 0.45 115.11 114.50 1l2a h GLN 356 Ca -0.04 -0.04 0.07 0.00 -0.00 0.00 0.00 58.65 58.64 1l2a h GLN 356 Cb 0.52 -0.16 -0.08 0.00 0.00 0.00 0.00 27.48 27.75 1l2a h GLN 356 CO 0.07 0.48 -0.20 0.78 0.00 0.00 0.00 178.83 179.96 1l2a h GLY 357 N 0.75 0.02 1.72 2.39 0.00 -1.01 -1.56 103.07 105.37 1l2a h GLY 357 Ca 0.32 0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.87 1l2a h GLY 357 CO -0.18 -0.19 0.03 -0.25 0.00 0.00 0.00 176.54 175.95 1l2a h TRP 358 N -0.15 0.36 -0.12 5.60 7.01 -0.02 -1.10 115.95 127.53 1l2a h TRP 358 Ca 0.17 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.14 1l2a h TRP 358 Cb 0.42 -0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 27.36 1l2a h TRP 358 CO -0.40 0.35 0.02 0.28 -2.79 0.00 0.00 178.44 175.90 1l2a h VAL 359 N 0.36 1.20 0.00 2.65 2.07 -0.16 -2.02 116.25 120.36 1l2a h VAL 359 Ca 0.08 -0.64 -0.13 0.00 0.82 0.00 0.00 66.70 66.84 1l2a h VAL 359 Cb 0.19 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1l2a h VAL 359 CO 0.00 0.19 -0.61 0.77 0.02 0.00 0.00 177.57 177.94 1l2a h SER 360 N -0.03 0.00 -0.11 0.57 4.64 -1.07 -1.93 113.55 115.62 1l2a h SER 360 Ca 0.04 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.25 1l2a h SER 360 Cb 0.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1l2a h SER 360 CO 0.00 0.61 -0.25 0.00 -0.87 0.00 0.00 176.83 176.32 1l2a h ALA 361 N 1.39 1.04 0.00 5.18 0.00 -1.14 -3.41 119.26 122.32 1l2a h ALA 361 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1l2a h ALA 361 Cb 1.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1l2a h ALA 361 CO 0.08 0.58 -0.84 0.25 0.00 0.00 0.00 179.25 179.31 1l2a n THR 362 N -4.11 0.00 -3.16 0.00 -2.24 -0.77 -4.78 114.28 99.22 1l2a n THR 362 Ca -0.00 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1l2a n THR 362 Cb 0.42 -0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.29 1l2a n THR 362 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1l2a s GLN 363 N -1.78 4.16 0.22 -0.78 -1.52 -0.73 -4.97 119.66 114.27 1l2a s GLN 363 Ca 0.00 0.51 -0.11 0.00 -1.95 0.00 0.00 55.36 53.81 1l2a s GLN 363 Cb 0.00 -3.60 0.31 0.00 -0.22 0.00 0.00 33.01 29.50 1l2a s GLN 363 CO 0.00 -0.27 1.62 1.03 -0.25 0.00 0.00 175.29 177.42 1l2a h SER 364 N 7.64 -0.54 0.77 5.90 0.87 -1.95 -0.47 113.55 125.77 1l2a h SER 364 Ca -0.30 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1l2a h SER 364 Cb 1.14 0.39 0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1l2a h SER 364 CO 0.76 -0.21 0.00 0.44 -0.53 0.00 0.00 176.83 177.29 1l2a h ASP 365 N 0.03 0.00 -0.24 6.23 3.32 -1.93 -2.51 116.42 121.32 1l2a h ASP 365 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1l2a h ASP 365 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1l2a h ASP 365 CO -0.68 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 177.33 1l2a n PHE 366 N -2.53 0.46 -1.68 4.55 3.01 -0.24 -4.71 117.46 116.32 1l2a n PHE 366 Ca 0.01 -0.63 -0.47 0.00 1.01 0.00 0.00 57.45 57.37 1l2a n PHE 366 Cb 0.24 -0.11 -0.04 0.00 -0.01 0.00 0.00 39.48 39.56 1l2a n PHE 366 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1l2a n ALA 367 N -0.05 1.01 -1.63 4.37 0.00 -0.86 -4.62 120.51 118.73 1l2a n ALA 367 Ca 0.12 0.28 -0.47 0.00 0.00 0.00 0.00 53.44 53.37 1l2a n ALA 367 Cb 0.52 -2.52 -0.04 0.00 0.00 0.00 0.00 19.45 17.41 1l2a n ALA 367 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1l2a n PRO 368 N 6.61 1.62 -0.04 0.00 -0.02 -1.26 -4.92 135.00 136.98 1l2a n PRO 368 Ca 0.22 0.58 0.03 0.00 -2.02 0.00 0.00 63.50 62.31 1l2a n PRO 368 Cb 0.31 -2.20 0.39 0.00 -0.02 0.00 0.00 33.50 31.98 1l2a n PRO 368 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1l2a h LYS 369 N 4.24 0.62 -7.21 -0.52 6.56 -1.91 -3.45 116.57 114.90 1l2a h LYS 369 Ca -0.45 -0.04 -0.51 0.00 -1.06 0.00 0.00 60.65 58.59 1l2a h LYS 369 Cb 1.30 -0.14 0.20 0.00 -0.57 0.00 0.00 32.23 33.03 1l2a h LYS 369 CO 0.76 0.42 0.13 -1.13 -2.06 0.00 0.00 179.45 177.57 1l2a n SER 370 N -4.46 -0.16 0.19 0.86 3.41 -1.26 -4.89 113.62 107.31 1l2a n SER 370 Ca 0.04 0.31 0.10 0.00 -0.26 0.00 0.00 58.87 59.06 1l2a n SER 370 Cb 0.06 -1.42 0.12 0.00 -0.26 0.00 0.00 64.21 62.71 1l2a n SER 370 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1l2a h SER 371 N -2.03 0.00 -0.00 4.04 4.64 -1.87 -3.36 113.55 114.97 1l2a h SER 371 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1l2a h SER 371 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1l2a h SER 371 CO 0.42 0.11 -0.30 0.59 -0.87 0.00 0.00 176.83 176.78 1l2a n ASN 372 N -3.08 0.59 -0.08 4.97 4.13 -1.26 -4.76 115.26 115.77 1l2a n ASN 372 Ca 0.03 -0.80 -0.07 0.00 1.68 0.00 0.00 54.58 55.42 1l2a n ASN 372 Cb 0.58 0.83 -0.00 0.00 -1.54 0.00 0.00 39.78 39.65 1l2a n ASN 372 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 1l2a h GLY 373 N 1.79 0.32 0.39 7.41 0.00 -1.91 -1.68 103.07 109.39 1l2a h GLY 373 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 47.33 47.43 1l2a h GLY 373 CO 0.00 -0.02 0.32 1.70 0.00 0.00 0.00 176.54 178.54 1l2a h LYS 374 N 0.15 0.52 -0.26 4.80 3.64 -1.84 0.17 116.57 123.73 1l2a h LYS 374 Ca 0.14 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1l2a h LYS 374 Cb 0.15 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1l2a h LYS 374 CO -0.19 0.34 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.20 1l2a h ARG 375 N 0.53 0.49 -0.29 1.90 2.43 -1.76 -1.30 114.38 116.38 1l2a h ARG 375 Ca 0.36 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1l2a h ARG 375 Cb 0.43 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1l2a h ARG 375 CO -0.30 0.69 0.12 -0.44 -1.51 0.00 0.00 179.97 178.53 1l2a h ASP 376 N 0.25 0.40 -0.81 -3.80 3.32 -0.89 -1.94 116.42 112.95 1l2a h ASP 376 Ca 0.07 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 56.97 1l2a h ASP 376 Cb 0.50 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1l2a h ASP 376 CO 0.02 0.44 0.53 -0.50 -1.72 0.00 0.00 179.24 178.01 1l2a h TRP 377 N 0.33 1.03 -0.96 4.55 4.06 -0.97 0.29 115.95 124.27 1l2a h TRP 377 Ca 0.10 0.02 0.12 0.00 2.06 0.00 0.00 58.89 61.19 1l2a h TRP 377 Cb 0.16 -0.35 -0.08 0.00 -1.00 0.00 0.00 29.16 27.89 1l2a h TRP 377 CO -0.01 0.66 0.59 1.15 -3.56 0.00 0.00 178.44 177.26 1l2a h THR 378 N 1.10 0.90 -0.22 1.49 2.02 -0.95 0.00 112.91 117.26 1l2a h THR 378 Ca 0.30 -0.32 -0.11 0.00 0.77 0.00 0.00 66.41 67.05 1l2a h THR 378 Cb -0.11 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.19 1l2a h THR 378 CO -0.06 0.17 -0.30 0.74 0.37 0.00 0.00 175.52 176.44 1l2a h THR 379 N 0.93 1.33 0.68 3.16 2.02 -0.45 -3.28 112.91 117.29 1l2a h THR 379 Ca 0.48 -1.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 1l2a h THR 379 Cb 0.48 1.78 0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1l2a h THR 379 CO -0.27 0.46 -0.33 -1.28 0.37 0.00 0.00 175.52 174.47 1l2a h SER 380 N 0.27 -0.78 -0.63 4.18 0.87 0.85 -0.76 113.55 117.55 1l2a h SER 380 Ca 0.02 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.65 1l2a h SER 380 Cb 0.88 0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 62.99 1l2a h SER 380 CO 0.07 -0.52 0.35 0.10 -0.53 0.00 0.00 176.83 176.30 1l2a h TYR 381 N -0.98 0.64 -0.92 2.24 -0.00 -1.20 0.31 116.97 117.07 1l2a h TYR 381 Ca -0.09 0.02 0.00 0.00 -0.00 0.00 0.00 58.73 58.66 1l2a h TYR 381 Cb 0.72 -0.20 -0.05 0.00 -0.00 0.00 0.00 36.73 37.21 1l2a h TYR 381 CO -0.02 0.31 0.58 0.87 -0.00 0.00 0.00 178.16 179.91 1l2a h LYS 382 N 0.65 1.24 -0.71 0.10 1.57 -1.60 -0.12 116.57 117.70 1l2a h LYS 382 Ca 0.28 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 1l2a h LYS 382 Cb 0.16 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 1l2a h LYS 382 CO -0.17 0.85 0.25 -0.09 -0.57 0.00 0.00 179.45 179.72 1l2a h ARG 383 N 1.26 1.09 -0.38 3.15 9.65 0.63 -2.27 114.38 127.51 1l2a h ARG 383 Ca 0.33 -0.22 -0.04 0.00 -1.10 0.00 0.00 59.98 58.96 1l2a h ARG 383 Cb -0.09 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.31 1l2a h ARG 383 CO -0.07 0.92 0.09 1.96 2.80 0.00 0.00 179.97 185.67 1l2a h GLN 384 N 1.04 0.62 -0.56 0.20 4.20 0.00 -2.62 115.11 117.98 1l2a h GLN 384 Ca 0.23 -0.15 0.08 0.00 0.06 0.00 0.00 58.65 58.87 1l2a h GLN 384 Cb 0.26 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1l2a h GLN 384 CO -0.01 0.66 0.37 -0.07 -0.67 0.00 0.00 178.83 179.11 1l2a h LEU 385 N 0.47 0.38 -0.81 1.46 3.38 -0.66 -0.17 115.31 119.37 1l2a h LEU 385 Ca 0.12 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 1l2a h LEU 385 Cb 0.32 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1l2a h LEU 385 CO 0.00 0.24 -0.56 -0.33 0.09 0.00 0.00 178.44 177.88 1l2a h GLU 386 N 0.43 0.09 0.18 1.13 5.08 -1.09 -3.10 114.58 117.30 1l2a h GLU 386 Ca 0.25 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1l2a h GLU 386 Cb 0.43 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1l2a h GLU 386 CO -0.07 0.63 -0.14 0.35 -1.00 0.00 0.00 179.01 178.78 1l2a h PHE 387 N 0.07 -0.37 -0.59 4.33 3.57 -0.68 0.45 116.94 123.71 1l2a h PHE 387 Ca -0.00 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.60 1l2a h PHE 387 Cb 1.02 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.82 1l2a h PHE 387 CO 0.01 -0.22 0.18 1.88 -2.23 0.00 0.00 178.31 177.93 1l2a h TYR 388 N -0.33 0.31 -0.28 0.41 0.05 -1.55 -1.01 116.97 114.57 1l2a h TYR 388 Ca -0.01 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 1l2a h TYR 388 Cb 0.30 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 1l2a h TYR 388 CO -0.12 0.05 0.14 1.96 -1.05 0.00 0.00 178.16 179.14 1l2a h GLN 389 N 0.34 0.41 -0.79 4.88 4.20 -1.33 -2.68 115.11 120.14 1l2a h GLN 389 Ca 0.30 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.97 1l2a h GLN 389 Cb 0.41 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 1l2a h GLN 389 CO -0.34 0.39 0.52 2.35 -0.67 0.00 0.00 178.83 181.08 1l2a h TRP 390 N 0.33 0.98 0.00 2.96 7.01 -0.44 -2.62 115.95 124.17 1l2a h TRP 390 Ca 0.10 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.12 1l2a h TRP 390 Cb 0.12 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.85 1l2a h TRP 390 CO -0.02 0.60 0.00 1.28 -2.79 0.00 0.00 178.44 177.51 1l2a n LEU 391 N -4.55 0.00 -4.61 0.65 4.77 -0.43 -4.79 117.00 108.04 1l2a n LEU 391 Ca 0.08 0.11 -0.43 0.00 -0.03 0.00 0.00 56.01 55.74 1l2a n LEU 391 Cb 0.04 -0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 1l2a n LEU 391 CO 0.35 -0.01 1.13 -1.58 -1.33 0.00 0.00 177.39 175.96 1l2a s GLN 392 N -2.21 3.76 1.06 3.23 0.74 -0.99 -0.66 119.66 124.59 1l2a s GLN 392 Ca 0.38 0.95 -0.12 0.00 0.05 0.00 0.00 55.36 56.63 1l2a s GLN 392 Cb 0.20 -3.93 0.22 0.00 1.10 0.00 0.00 33.01 30.60 1l2a s GLN 392 CO 0.38 -1.33 1.04 -1.13 -0.55 0.00 0.00 175.29 173.70 1l2a n SER 393 N 8.05 -0.85 0.24 6.67 3.41 -0.47 -4.49 113.62 126.18 1l2a n SER 393 Ca 0.14 0.11 0.10 0.00 -0.26 0.00 0.00 58.87 58.96 1l2a n SER 393 Cb 0.48 -1.35 0.66 0.00 -0.26 0.00 0.00 64.21 63.74 1l2a n SER 393 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l2a h ALA 394 N -2.31 2.02 0.18 7.33 0.00 -0.91 -2.41 119.26 123.16 1l2a h ALA 394 Ca -0.53 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.08 1l2a h ALA 394 Cb 1.30 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.12 1l2a h ALA 394 CO 0.45 -0.06 -1.36 0.93 0.00 0.00 0.00 179.25 179.21 1l2a h GLU 395 N 0.00 0.38 0.00 0.00 3.07 -1.90 -3.49 114.58 112.63 1l2a h GLU 395 Ca 0.02 -0.64 0.00 0.00 -0.50 0.00 0.00 59.36 58.24 1l2a h GLU 395 Cb 0.10 0.24 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1l2a h GLU 395 CO -0.00 1.30 0.00 0.41 -1.40 0.00 0.00 179.01 179.32 1l2a n GLY 396 N 1.61 1.37 3.75 -3.84 0.00 -0.91 -4.53 105.19 102.65 1l2a n GLY 396 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1l2a n GLY 396 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l2a s GLY 397 N -0.03 2.06 -0.23 -0.02 0.00 -1.26 -4.28 107.32 103.56 1l2a s GLY 397 Ca 0.00 0.58 -0.13 0.00 0.00 0.00 0.00 44.72 45.17 1l2a s GLY 397 CO 0.00 0.95 0.28 -0.42 0.00 0.00 0.00 173.10 173.90 1l2a s ILE 398 N -2.39 5.28 1.07 0.90 -1.09 -1.26 -1.37 121.20 122.33 1l2a s ILE 398 Ca 0.68 0.42 -0.14 0.00 -2.23 0.00 0.00 60.65 59.38 1l2a s ILE 398 Cb -0.22 -3.61 0.23 0.00 -1.58 0.00 0.00 42.46 37.28 1l2a s ILE 398 CO 0.47 0.28 1.08 0.00 -1.23 0.00 0.00 174.94 175.54 1l2a s ALA 399 N 1.30 0.60 0.04 9.38 0.00 0.17 -4.98 121.76 128.27 1l2a s ALA 399 Ca 0.13 -0.46 -0.30 0.00 0.00 0.00 0.00 51.96 51.33 1l2a s ALA 399 Cb -0.14 -3.09 -0.17 0.00 0.00 0.00 0.00 23.12 19.72 1l2a s ALA 399 CO 0.07 -3.18 1.37 0.78 0.00 0.00 0.00 175.76 174.79 1l2a h GLY 400 N -2.17 -0.90 0.00 0.00 0.00 -1.74 -3.41 103.07 94.85 1l2a h GLY 400 Ca -0.54 0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.12 1l2a h GLY 400 CO 0.53 -0.33 0.00 0.61 0.00 0.00 0.00 176.54 177.35 1l2a n GLY 401 N -0.99 -0.48 3.51 4.60 0.00 -0.84 -0.29 105.19 110.70 1l2a n GLY 401 Ca -0.13 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.44 1l2a n GLY 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l2a s ALA 402 N -1.00 -1.82 0.03 4.61 0.00 -0.40 -1.54 121.76 121.65 1l2a s ALA 402 Ca 0.00 1.08 0.02 0.00 0.00 0.00 0.00 51.96 53.06 1l2a s ALA 402 Cb 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 1l2a s ALA 402 CO 0.00 -0.62 -0.08 -0.08 0.00 0.00 0.00 175.76 174.99 1l2a s THR 403 N -2.74 0.57 -2.12 0.00 -1.32 0.12 -0.82 115.64 109.34 1l2a s THR 403 Ca 0.03 -0.88 0.24 0.00 -1.21 0.00 0.00 61.69 59.87 1l2a s THR 403 Cb -0.01 -0.59 0.08 0.00 -1.51 0.00 0.00 72.50 70.47 1l2a s THR 403 CO -0.07 -0.23 1.22 -3.20 -2.21 0.00 0.00 174.62 170.14 1l2a n ASN 404 N 1.85 1.95 -3.59 8.08 5.15 -0.44 -0.43 115.26 127.82 1l2a n ASN 404 Ca -0.20 -1.46 -0.29 0.00 -0.60 0.00 0.00 54.58 52.03 1l2a n ASN 404 Cb 0.55 0.34 -0.12 0.00 -0.53 0.00 0.00 39.78 40.03 1l2a n ASN 404 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1l2a s SER 405 N -2.41 3.08 0.28 1.20 0.15 -1.26 -4.73 113.70 110.02 1l2a s SER 405 Ca 0.21 -2.75 -0.30 0.00 0.70 0.00 0.00 55.95 53.82 1l2a s SER 405 Cb 0.19 -0.79 -0.13 0.00 -1.71 0.00 0.00 66.02 63.58 1l2a s SER 405 CO 0.52 -0.24 1.44 1.87 1.20 0.00 0.00 173.24 178.04 1l2a n TRP 406 N 3.34 2.43 -1.00 3.44 -0.00 -1.26 -0.54 117.44 123.85 1l2a n TRP 406 Ca 0.16 0.41 -0.06 0.00 -0.00 0.00 0.00 57.50 58.00 1l2a n TRP 406 Cb 0.38 -2.49 -0.03 0.00 -0.00 0.00 0.00 31.31 29.17 1l2a n TRP 406 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1l2a n ASN 407 N 1.77 -2.35 0.00 5.87 3.02 -1.26 -1.97 115.26 120.34 1l2a n ASN 407 Ca 0.09 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.79 1l2a n ASN 407 Cb 0.34 -2.14 0.00 0.00 -0.61 0.00 0.00 39.78 37.37 1l2a n ASN 407 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l2a n GLY 408 N 0.01 0.78 0.28 7.41 0.00 0.30 -4.63 105.19 109.33 1l2a n GLY 408 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.02 1l2a n GLY 408 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l2a n ARG 409 N -2.42 0.75 -3.86 1.61 1.74 -0.83 -3.32 116.66 110.32 1l2a n ARG 409 Ca 0.00 -1.94 -0.24 0.00 -0.77 0.00 0.00 57.85 54.89 1l2a n ARG 409 Cb 0.00 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1l2a n ARG 409 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1l2a n TYR 410 N -0.82 -1.78 -2.03 -1.55 4.01 -1.18 -4.91 117.16 108.91 1l2a n TYR 410 Ca 0.09 0.79 -0.29 0.00 -0.16 0.00 0.00 57.90 58.34 1l2a n TYR 410 Cb 0.67 -3.98 0.05 0.00 -0.31 0.00 0.00 39.34 35.77 1l2a n TYR 410 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1l2a s GLU 411 N -6.34 2.79 0.47 -0.72 2.02 -1.14 -2.87 118.70 112.90 1l2a s GLU 411 Ca 0.05 0.29 -0.25 0.00 0.02 0.00 0.00 54.97 55.09 1l2a s GLU 411 Cb -0.03 -2.09 -0.08 0.00 0.10 0.00 0.00 34.13 32.04 1l2a s GLU 411 CO 0.86 -1.00 1.41 -1.59 0.02 0.00 0.00 175.26 174.97 1l2a s LYS 412 N -5.28 3.59 0.27 1.61 -2.85 -1.26 -4.32 119.74 111.51 1l2a s LYS 412 Ca 0.57 2.38 -0.29 0.00 -1.00 0.00 0.00 55.97 57.63 1l2a s LYS 412 Cb -0.11 -2.59 -0.09 0.00 -2.06 0.00 0.00 37.83 32.98 1l2a s LYS 412 CO 0.50 -0.88 1.18 0.71 0.10 0.00 0.00 175.35 176.96 1l2a s TYR 413 N -1.22 3.41 0.61 1.78 2.02 -1.26 -4.97 117.35 117.72 1l2a s TYR 413 Ca 0.63 1.56 -0.18 0.00 -0.37 0.00 0.00 57.07 58.71 1l2a s TYR 413 Cb -0.43 -3.42 -0.08 0.00 -0.40 0.00 0.00 41.96 37.63 1l2a s TYR 413 CO 0.55 -1.05 0.43 -2.30 -1.57 0.00 0.00 175.55 171.61 1l2a n PRO 414 N 1.40 0.40 -1.79 -1.71 -0.02 -1.26 -4.90 135.00 127.11 1l2a n PRO 414 Ca 0.00 0.16 -0.39 0.00 -2.02 0.00 0.00 63.50 61.25 1l2a n PRO 414 Cb 0.44 -1.65 0.03 0.00 -0.02 0.00 0.00 33.50 32.29 1l2a n PRO 414 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l2a s ALA 415 N -1.80 3.07 -0.37 3.55 0.00 -1.26 -2.95 121.76 122.00 1l2a s ALA 415 Ca 0.66 1.42 0.00 0.00 0.00 0.00 0.00 51.96 54.04 1l2a s ALA 415 Cb -0.42 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.12 1l2a s ALA 415 CO 0.57 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 175.47 1l2a n GLY 416 N 0.64 0.61 3.60 0.00 0.00 -1.26 -5.01 105.19 103.76 1l2a n GLY 416 Ca 0.07 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1l2a n GLY 416 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l2a s THR 417 N -2.14 4.68 0.41 2.61 2.01 -1.15 -5.04 115.64 117.03 1l2a s THR 417 Ca 0.00 1.04 -0.24 0.00 0.31 0.00 0.00 61.69 62.80 1l2a s THR 417 Cb 0.00 -4.25 -0.08 0.00 0.01 0.00 0.00 72.50 68.17 1l2a s THR 417 CO 0.00 -0.45 1.11 -0.94 -0.69 0.00 0.00 174.62 173.64 1l2a s SER 418 N 1.83 6.56 0.34 3.53 1.04 -1.26 -4.90 113.70 120.84 1l2a s SER 418 Ca 0.34 2.18 0.04 0.00 0.48 0.00 0.00 55.95 58.99 1l2a s SER 418 Cb -0.13 -2.60 -0.06 0.00 0.10 0.00 0.00 66.02 63.34 1l2a s SER 418 CO 0.17 -0.64 0.06 0.42 0.98 0.00 0.00 173.24 174.24 1l2a s THR 419 N -1.56 1.15 -0.28 2.02 -4.23 -1.26 -2.03 115.64 109.45 1l2a s THR 419 Ca 0.59 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 59.08 1l2a s THR 419 Cb -0.26 -2.74 0.12 0.00 1.34 0.00 0.00 72.50 70.96 1l2a s THR 419 CO 0.32 0.00 0.22 0.12 -0.54 0.00 0.00 174.62 174.74 1l2a s PHE 420 N -3.26 -0.14 -1.54 3.99 5.36 -0.63 -0.89 117.98 120.86 1l2a s PHE 420 Ca 0.35 -0.38 -0.11 0.00 -0.96 0.00 0.00 56.93 55.82 1l2a s PHE 420 Cb 0.08 -0.61 0.08 0.00 -0.34 0.00 0.00 43.02 42.23 1l2a s PHE 420 CO 0.15 -0.84 0.76 0.66 -1.46 0.00 0.00 175.22 174.49 1l2a n TYR 421 N 5.29 -1.93 0.00 10.12 4.02 -1.26 -2.10 117.16 131.29 1l2a n TYR 421 Ca -0.04 0.83 0.00 0.00 -0.01 0.00 0.00 57.90 58.68 1l2a n TYR 421 Cb 0.45 -3.63 0.00 0.00 -0.02 0.00 0.00 39.34 36.14 1l2a n TYR 421 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l2a n GLY 422 N -1.65 1.94 3.86 2.72 0.00 -1.26 -4.60 105.19 106.19 1l2a n GLY 422 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 1l2a n GLY 422 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1l2a s MET 423 N -0.40 3.85 0.26 1.61 -1.94 -0.89 -3.90 119.30 117.89 1l2a s MET 423 Ca 0.00 0.30 -0.28 0.00 -1.71 0.00 0.00 55.69 54.00 1l2a s MET 423 Cb 0.00 -2.99 -0.09 0.00 2.01 0.00 0.00 34.83 33.76 1l2a s MET 423 CO 0.00 0.54 0.92 0.00 -0.01 0.00 0.00 175.02 176.47 1l2a s ALA 424 N -1.40 3.31 0.08 3.03 0.00 0.43 -1.60 121.76 125.60 1l2a s ALA 424 Ca 0.34 0.55 -0.31 0.00 0.00 0.00 0.00 51.96 52.55 1l2a s ALA 424 Cb -0.14 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 19.72 1l2a s ALA 424 CO 0.18 0.21 1.68 -0.47 0.00 0.00 0.00 175.76 177.36 1l2a s TYR 425 N -1.33 2.37 -0.12 0.00 5.04 -0.86 -0.70 117.35 121.75 1l2a s TYR 425 Ca 0.44 0.26 0.01 0.00 -2.44 0.00 0.00 57.07 55.34 1l2a s TYR 425 Cb -0.23 -4.00 0.02 0.00 0.35 0.00 0.00 41.96 38.10 1l2a s TYR 425 CO 0.29 -4.03 -0.16 0.14 -1.34 0.00 0.00 175.55 170.45 1l2a s VAL 426 N 2.68 1.58 0.52 3.14 -7.23 -0.59 -4.90 120.40 115.60 1l2a s VAL 426 Ca 0.75 -0.67 0.18 0.00 -1.81 0.00 0.00 61.98 60.43 1l2a s VAL 426 Cb -0.41 -1.45 0.27 0.00 0.56 0.00 0.00 36.38 35.36 1l2a s VAL 426 CO 0.33 0.46 2.14 -0.65 -0.31 0.00 0.00 175.10 177.07 1l2a h PRO 427 N 7.61 0.00 -2.30 4.82 0.11 -1.95 -2.24 132.00 138.06 1l2a h PRO 427 Ca -0.34 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.19 1l2a h PRO 427 Cb 1.16 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.89 1l2a h PRO 427 CO 0.51 0.03 -0.98 0.72 -0.21 0.00 0.00 178.00 178.07 1l2a n HIS 428 N -4.37 -0.38 -1.58 0.65 8.25 -1.26 -3.71 115.22 112.81 1l2a n HIS 428 Ca -0.03 -3.46 -0.43 0.00 -0.26 0.00 0.00 57.72 53.54 1l2a n HIS 428 Cb 0.11 0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.23 1l2a n HIS 428 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1l2a n PRO 429 N 2.32 1.27 0.00 -0.41 -0.02 -1.26 -3.92 135.00 132.98 1l2a n PRO 429 Ca 0.27 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1l2a n PRO 429 Cb 0.48 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1l2a n PRO 429 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1l2a n VAL 430 N -0.13 0.00 -4.99 -1.45 0.31 -1.26 -4.49 118.33 106.32 1l2a n VAL 430 Ca 0.10 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.13 1l2a n VAL 430 Cb 0.35 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.13 1l2a n VAL 430 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1l2a s TYR 431 N 0.00 2.19 -0.29 3.52 2.02 -1.25 -4.00 117.35 119.54 1l2a s TYR 431 Ca 0.00 -0.41 0.04 0.00 -0.37 0.00 0.00 57.07 56.33 1l2a s TYR 431 Cb 0.00 -1.35 -0.02 0.00 -0.40 0.00 0.00 41.96 40.19 1l2a s TYR 431 CO 0.00 0.06 0.31 0.00 -1.57 0.00 0.00 175.55 174.35 1l2a n ALA 432 N 2.06 2.49 -3.77 3.71 0.00 -0.91 -1.40 120.51 122.69 1l2a n ALA 432 Ca -0.16 -0.24 -0.30 0.00 0.00 0.00 0.00 53.44 52.73 1l2a n ALA 432 Cb 0.52 -0.14 -0.14 0.00 0.00 0.00 0.00 19.45 19.69 1l2a n ALA 432 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1l2a s ASP 433 N -1.03 3.96 0.85 0.00 2.15 -1.26 -2.41 116.67 118.94 1l2a s ASP 433 Ca 0.03 -2.18 -0.12 0.00 0.43 0.00 0.00 52.55 50.71 1l2a s ASP 433 Cb 0.03 -1.06 0.10 0.00 -0.30 0.00 0.00 42.92 41.70 1l2a s ASP 433 CO 0.12 -0.34 1.14 -2.16 -0.17 0.00 0.00 175.17 173.76 1l2a s PRO 434 N 0.92 1.61 0.24 4.34 0.04 -1.26 -4.48 135.00 136.41 1l2a s PRO 434 Ca 0.14 0.32 -0.31 0.00 0.04 0.00 0.00 61.00 61.18 1l2a s PRO 434 Cb -0.21 -1.89 -0.12 0.00 0.04 0.00 0.00 34.50 32.32 1l2a s PRO 434 CO -0.11 -1.88 1.65 0.41 0.04 0.00 0.00 177.00 177.11 1l2a n GLY 435 N -2.51 1.39 0.07 0.56 0.00 -1.01 -4.86 105.19 98.84 1l2a n GLY 435 Ca 0.07 0.56 0.06 0.00 0.00 0.00 0.00 46.02 46.70 1l2a n GLY 435 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l2a n SER 436 N 3.13 0.27 -0.70 1.61 3.41 -0.49 -1.35 113.62 119.50 1l2a n SER 436 Ca 0.13 0.62 0.08 0.00 -0.26 0.00 0.00 58.87 59.43 1l2a n SER 436 Cb 0.35 -0.66 0.22 0.00 -0.26 0.00 0.00 64.21 63.86 1l2a n SER 436 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1l2a n ASN 437 N -1.86 3.30 0.02 4.04 5.15 -1.26 -4.53 115.26 120.12 1l2a n ASN 437 Ca -0.00 -3.13 -0.19 0.00 -0.60 0.00 0.00 54.58 50.66 1l2a n ASN 437 Cb 0.04 -0.52 -0.10 0.00 -0.53 0.00 0.00 39.78 38.67 1l2a n ASN 437 CO 0.00 0.00 0.00 -0.61 1.40 0.00 0.00 177.26 178.05 1l2a h GLN 438 N 1.23 0.68 -6.24 1.20 4.15 -1.44 -3.43 115.11 111.27 1l2a h GLN 438 Ca 0.02 -0.68 -0.57 0.00 0.77 0.00 0.00 58.65 58.20 1l2a h GLN 438 Cb 1.35 0.18 -0.02 0.00 0.21 0.00 0.00 27.48 29.20 1l2a h GLN 438 CO 0.18 1.27 1.23 -0.46 -1.93 0.00 0.00 178.83 179.12 1l2a s TRP 439 N -3.43 1.78 0.65 3.99 -0.00 -1.26 -0.58 118.94 120.09 1l2a s TRP 439 Ca -0.11 0.42 0.38 0.00 -0.00 0.00 0.00 56.10 56.79 1l2a s TRP 439 Cb 0.07 -4.03 2.10 0.00 -0.00 0.00 0.00 33.47 31.60 1l2a s TRP 439 CO 0.90 -3.51 2.22 0.35 -0.00 0.00 0.00 176.95 176.92 1l2a h PHE 440 N 11.78 0.00 -0.98 5.86 3.57 -1.64 -3.11 116.94 132.42 1l2a h PHE 440 Ca -0.37 0.00 0.19 0.00 3.53 0.00 0.00 57.97 61.32 1l2a h PHE 440 Cb 1.18 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.81 1l2a h PHE 440 CO 0.93 0.00 0.58 0.78 -2.23 0.00 0.00 178.31 178.37 1l2a h GLY 441 N 0.00 1.75 1.42 2.40 0.00 -1.88 -0.85 103.07 105.91 1l2a h GLY 441 Ca 0.01 -0.34 0.04 0.00 0.00 0.00 0.00 47.33 47.04 1l2a h GLY 441 CO -0.00 -0.09 0.30 0.74 0.00 0.00 0.00 176.54 177.49 1l2a h PHE 442 N 0.71 0.45 0.19 5.60 -1.00 -1.93 -0.90 116.94 120.06 1l2a h PHE 442 Ca 0.57 0.01 -0.00 0.00 2.81 0.00 0.00 57.97 61.36 1l2a h PHE 442 Cb 0.92 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 40.32 1l2a h PHE 442 CO -0.02 0.26 -0.13 1.96 -1.61 0.00 0.00 178.31 178.77 1l2a h GLN 443 N 0.46 -0.31 0.75 1.51 1.08 -1.38 -0.12 115.11 117.10 1l2a h GLN 443 Ca 0.19 0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.37 1l2a h GLN 443 Cb 0.16 0.07 0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1l2a h GLN 443 CO -0.05 -0.20 -0.36 0.00 -0.95 0.00 0.00 178.83 177.27 1l2a h ALA 444 N 0.48 -1.00 -0.90 3.87 0.00 -1.44 -1.29 119.26 118.98 1l2a h ALA 444 Ca -0.01 -0.23 0.17 0.00 0.00 0.00 0.00 54.91 54.84 1l2a h ALA 444 Cb 0.28 0.39 -0.17 0.00 0.00 0.00 0.00 17.79 18.29 1l2a h ALA 444 CO 0.00 -0.95 -0.27 -1.49 0.00 0.00 0.00 179.25 176.54 1l2a h TRP 445 N -1.23 -0.65 0.08 0.00 4.06 -1.19 -0.88 115.95 116.13 1l2a h TRP 445 Ca -0.10 0.09 -0.11 0.00 2.06 0.00 0.00 58.89 60.83 1l2a h TRP 445 Cb 0.78 0.42 0.01 0.00 -1.00 0.00 0.00 29.16 29.38 1l2a h TRP 445 CO 0.00 -0.39 -0.47 1.03 -3.56 0.00 0.00 178.44 175.04 1l2a h SER 446 N -0.01 0.28 0.82 -3.49 0.87 -1.01 -3.26 113.55 107.75 1l2a h SER 446 Ca 0.40 -0.96 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 1l2a h SER 446 Cb 0.64 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1l2a h SER 446 CO -0.93 1.22 0.00 0.23 -0.53 0.00 0.00 176.83 176.82 1l2a n MET 447 N -4.33 0.13 -0.21 2.24 2.81 -0.49 -2.27 117.12 115.00 1l2a n MET 447 Ca -0.12 0.29 -0.08 0.00 -1.81 0.00 0.00 57.70 55.98 1l2a n MET 447 Cb 0.67 -1.72 0.03 0.00 -0.71 0.00 0.00 33.22 31.50 1l2a n MET 447 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 1l2a h GLN 448 N 0.00 0.92 -0.57 0.03 -0.00 -1.20 -2.12 115.11 112.17 1l2a h GLN 448 Ca 0.00 -0.19 -0.01 0.00 -0.00 0.00 0.00 58.65 58.45 1l2a h GLN 448 Cb 0.41 -0.13 -0.03 0.00 0.00 0.00 0.00 27.48 27.73 1l2a h GLN 448 CO 0.00 0.82 0.34 0.00 0.00 0.00 0.00 178.83 179.98 1l2a h ARG 449 N 0.84 0.79 -0.55 1.69 3.08 -1.56 -1.67 114.38 117.00 1l2a h ARG 449 Ca 0.19 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1l2a h ARG 449 Cb 0.27 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1l2a h ARG 449 CO -0.01 0.58 0.28 0.28 -1.07 0.00 0.00 179.97 180.04 1l2a h VAL 450 N 0.77 1.18 -0.42 2.04 2.07 -1.51 -0.87 116.25 119.51 1l2a h VAL 450 Ca 0.20 -0.47 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1l2a h VAL 450 Cb 0.01 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1l2a h VAL 450 CO -0.04 0.20 -0.05 0.24 0.02 0.00 0.00 177.57 177.95 1l2a h MET 451 N 0.77 0.77 -0.60 1.57 2.86 -0.69 -0.53 114.93 119.07 1l2a h MET 451 Ca 0.19 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 1l2a h MET 451 Cb 0.05 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1l2a h MET 451 CO -0.03 0.87 0.24 0.93 1.06 0.00 0.00 176.91 179.98 1l2a h GLU 452 N 0.59 0.88 -0.36 1.72 5.08 -0.96 0.12 114.58 121.65 1l2a h GLU 452 Ca 0.11 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1l2a h GLU 452 Cb 0.55 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1l2a h GLU 452 CO 0.03 0.72 0.20 -0.92 -1.00 0.00 0.00 179.01 178.04 1l2a h TYR 453 N 0.87 0.49 -0.55 4.33 3.20 -0.79 -1.30 116.97 123.21 1l2a h TYR 453 Ca 0.20 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.00 1l2a h TYR 453 Cb 0.17 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1l2a h TYR 453 CO 0.01 0.38 0.10 -0.92 -1.64 0.00 0.00 178.16 176.09 1l2a h TYR 454 N 0.45 0.96 -0.53 -3.82 3.20 -0.68 -1.69 116.97 114.87 1l2a h TYR 454 Ca 0.13 -0.13 0.10 0.00 3.14 0.00 0.00 58.73 61.97 1l2a h TYR 454 Cb 0.05 -0.26 -0.11 0.00 1.54 0.00 0.00 36.73 37.96 1l2a h TYR 454 CO -0.03 0.84 -0.21 1.25 -1.64 0.00 0.00 178.16 178.37 1l2a h LEU 455 N 0.79 -0.75 0.00 2.82 6.46 -0.47 0.34 115.31 124.50 1l2a h LEU 455 Ca 0.17 0.18 0.00 0.00 -0.12 0.00 0.00 57.88 58.11 1l2a h LEU 455 Cb 0.40 0.42 0.00 0.00 -0.73 0.00 0.00 40.66 40.75 1l2a h LEU 455 CO 0.01 -0.24 -0.43 -0.62 -0.62 0.00 0.00 178.44 176.54 1l2a n GLU 456 N -5.41 0.26 0.00 1.25 -0.58 -0.52 -4.32 120.64 111.32 1l2a n GLU 456 Ca 0.05 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 1l2a n GLU 456 Cb 0.32 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.49 1l2a n GLU 456 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1l2a n THR 457 N -2.10 0.00 -1.43 2.62 -2.24 -0.65 -5.00 114.28 105.48 1l2a n THR 457 Ca 0.04 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.67 1l2a n THR 457 Cb 0.43 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.65 1l2a n THR 457 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l2a n GLY 458 N 2.59 1.44 3.63 3.38 0.00 0.09 -4.92 105.19 111.40 1l2a n GLY 458 Ca 0.00 -0.07 -0.49 0.00 0.00 0.00 0.00 46.02 45.45 1l2a n GLY 458 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1l2a n ASP 459 N -1.05 2.34 -0.03 1.61 -0.08 -1.26 -4.87 116.55 113.20 1l2a n ASP 459 Ca -0.15 1.10 -0.05 0.00 -1.51 0.00 0.00 54.79 54.18 1l2a n ASP 459 Cb 0.59 -1.30 -0.13 0.00 2.34 0.00 0.00 41.12 42.62 1l2a n ASP 459 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1l2a n SER 460 N 3.09 0.51 0.10 1.67 2.88 -1.26 -3.72 113.62 116.89 1l2a n SER 460 Ca 0.18 0.24 0.10 0.00 -1.33 0.00 0.00 58.87 58.06 1l2a n SER 460 Cb 0.23 0.50 0.44 0.00 -0.75 0.00 0.00 64.21 64.64 1l2a n SER 460 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1l2a n SER 461 N -2.85 0.48 -0.00 -3.46 3.41 -1.26 -2.41 113.62 107.53 1l2a n SER 461 Ca -0.19 0.63 0.07 0.00 -0.26 0.00 0.00 58.87 59.11 1l2a n SER 461 Cb 1.00 -0.73 -0.09 0.00 -0.26 0.00 0.00 64.21 64.13 1l2a n SER 461 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1l2a n VAL 462 N -2.05 0.00 -0.13 -3.33 3.14 -1.24 -4.60 118.33 110.12 1l2a n VAL 462 Ca 0.02 -0.21 -0.04 0.00 -2.96 0.00 0.00 64.34 61.15 1l2a n VAL 462 Cb 0.19 0.76 0.03 0.00 -1.06 0.00 0.00 33.84 33.76 1l2a n VAL 462 CO 0.00 0.00 0.00 0.50 -6.46 0.00 0.00 176.83 170.87 1l2a h LYS 463 N 0.00 0.08 -0.58 1.45 3.64 -1.61 -1.93 116.57 117.62 1l2a h LYS 463 Ca 0.00 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1l2a h LYS 463 Cb 0.44 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1l2a h LYS 463 CO 0.00 0.05 0.16 -0.91 -2.27 0.00 0.00 179.45 176.48 1l2a h ASN 464 N 0.08 0.86 0.03 4.20 2.35 -1.81 -1.68 115.58 119.61 1l2a h ASN 464 Ca 0.21 -0.22 0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1l2a h ASN 464 Cb 0.32 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.41 1l2a h ASN 464 CO -0.38 0.86 -0.46 0.25 -1.65 0.00 0.00 177.43 176.05 1l2a h LEU 465 N 0.82 -1.40 -0.35 1.61 5.85 -1.80 -1.67 115.31 118.37 1l2a h LEU 465 Ca 0.18 0.16 0.04 0.00 0.84 0.00 0.00 57.88 59.10 1l2a h LEU 465 Cb 0.32 0.54 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1l2a h LEU 465 CO -0.00 -0.49 0.12 0.40 -0.34 0.00 0.00 178.44 178.13 1l2a h ILE 466 N -0.63 0.91 -0.40 4.05 2.04 -1.19 -1.59 117.51 120.69 1l2a h ILE 466 Ca 0.03 -0.09 -0.06 0.00 1.00 0.00 0.00 64.86 65.74 1l2a h ILE 466 Cb 0.69 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1l2a h ILE 466 CO -0.32 0.05 0.02 0.11 0.00 0.00 0.00 178.15 178.01 1l2a h LYS 467 N 0.27 0.70 -0.65 2.37 1.79 -1.18 -0.47 116.57 119.40 1l2a h LYS 467 Ca 0.16 -0.22 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1l2a h LYS 467 Cb 0.13 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 30.68 1l2a h LYS 467 CO -0.16 0.78 0.37 -0.22 -1.08 0.00 0.00 179.45 179.14 1l2a h LYS 468 N 0.54 0.89 -0.49 3.15 3.64 -1.10 0.27 116.57 123.46 1l2a h LYS 468 Ca 0.12 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1l2a h LYS 468 Cb 0.45 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1l2a h LYS 468 CO 0.02 0.66 0.10 2.35 -2.27 0.00 0.00 179.45 180.30 1l2a h TRP 469 N 0.88 0.85 -0.05 1.91 7.01 -0.94 -1.79 115.95 123.82 1l2a h TRP 469 Ca 0.23 -0.11 0.01 0.00 2.11 0.00 0.00 58.89 61.12 1l2a h TRP 469 Cb 0.02 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.83 1l2a h TRP 469 CO -0.01 0.77 0.01 0.28 -2.79 0.00 0.00 178.44 176.70 1l2a h VAL 470 N 0.68 0.98 -0.72 2.65 2.07 -1.00 -1.49 116.25 119.42 1l2a h VAL 470 Ca 0.15 -0.01 0.13 0.00 0.82 0.00 0.00 66.70 67.80 1l2a h VAL 470 Cb 0.37 0.95 -0.09 0.00 -1.52 0.00 0.00 31.29 30.99 1l2a h VAL 470 CO 0.01 0.01 0.27 0.44 0.02 0.00 0.00 177.57 178.31 1l2a h ASP 471 N 0.03 0.23 0.04 0.57 3.32 -0.68 0.11 116.42 120.03 1l2a h ASP 471 Ca 0.02 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1l2a h ASP 471 Cb 0.02 0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1l2a h ASP 471 CO -0.03 0.09 -0.02 -0.25 -1.72 0.00 0.00 179.24 177.31 1l2a h TRP 472 N 0.41 -0.05 -0.64 4.55 7.01 -1.04 -2.08 115.95 124.11 1l2a h TRP 472 Ca 0.39 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.37 1l2a h TRP 472 Cb 0.59 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.63 1l2a h TRP 472 CO -0.18 0.14 0.34 0.28 -2.79 0.00 0.00 178.44 176.23 1l2a h VAL 473 N -0.23 1.21 0.00 2.65 2.07 -0.85 -1.45 116.25 119.65 1l2a h VAL 473 Ca -0.01 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 1l2a h VAL 473 Cb 0.21 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1l2a h VAL 473 CO 0.01 0.24 -0.03 0.24 0.02 0.00 0.00 177.57 178.04 1l2a h MET 474 N 0.88 0.00 0.00 1.57 2.86 -0.71 -1.76 114.93 117.78 1l2a h MET 474 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1l2a h MET 474 Cb 0.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1l2a h MET 474 CO -0.03 0.03 0.00 0.66 1.06 0.00 0.00 176.91 178.63 1l2a h SER 475 N 0.00 0.00 0.00 1.22 4.64 -0.55 -3.33 113.55 115.53 1l2a h SER 475 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1l2a h SER 475 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1l2a h SER 475 CO 0.00 0.00 -1.08 -0.62 -0.87 0.00 0.00 176.83 174.26 1l2a n GLU 476 N -2.54 1.62 -2.43 4.77 -0.58 -0.72 -4.95 120.64 115.80 1l2a n GLU 476 Ca 0.05 -0.06 -0.42 0.00 -0.42 0.00 0.00 57.16 56.31 1l2a n GLU 476 Cb 0.44 -1.22 -0.03 0.00 -0.57 0.00 0.00 31.44 30.06 1l2a n GLU 476 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1l2a s ILE 477 N -2.57 4.08 -0.23 -3.67 1.01 -0.83 -4.41 121.20 114.58 1l2a s ILE 477 Ca 0.00 1.48 -0.04 0.00 0.00 0.00 0.00 60.65 62.09 1l2a s ILE 477 Cb 0.09 -3.95 -0.01 0.00 0.01 0.00 0.00 42.46 38.60 1l2a s ILE 477 CO 0.55 0.09 -0.02 -0.54 0.00 0.00 0.00 174.94 175.02 1l2a s LYS 478 N 1.30 3.41 -0.10 2.79 -0.14 0.06 -4.99 119.74 122.06 1l2a s LYS 478 Ca 0.58 -0.61 -0.03 0.00 -1.36 0.00 0.00 55.97 54.55 1l2a s LYS 478 Cb -0.29 -3.07 -0.03 0.00 -1.68 0.00 0.00 37.83 32.76 1l2a s LYS 478 CO 0.28 -0.20 0.03 -0.51 -0.76 0.00 0.00 175.35 174.19 1l2a s LEU 479 N 1.50 3.74 0.10 3.17 1.43 -1.26 -0.67 118.68 126.69 1l2a s LEU 479 Ca 0.06 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.43 1l2a s LEU 479 Cb -0.14 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1l2a s LEU 479 CO -0.02 0.36 -0.19 -0.31 0.23 0.00 0.00 176.35 176.42 1l2a s TYR 480 N -0.74 2.53 0.48 0.29 1.51 -0.61 -5.00 117.35 115.81 1l2a s TYR 480 Ca 0.12 -0.27 0.41 0.00 -1.01 0.00 0.00 57.07 56.32 1l2a s TYR 480 Cb -0.12 -1.36 2.13 0.00 -0.11 0.00 0.00 41.96 42.50 1l2a s TYR 480 CO 0.02 0.35 2.24 -0.44 -1.11 0.00 0.00 175.55 176.62 1l2a h ASP 481 N 3.91 0.00 -0.11 2.29 3.32 -1.98 0.20 116.42 124.04 1l2a h ASP 481 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1l2a h ASP 481 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1l2a h ASP 481 CO 0.46 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.08 1l2a n ASP 482 N -2.99 0.96 0.00 6.45 5.75 -1.26 -4.91 116.55 120.55 1l2a n ASP 482 Ca -0.02 -1.66 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 1l2a n ASP 482 Cb 0.11 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 1l2a n ASP 482 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1l2a n GLY 483 N 0.95 0.78 3.94 6.12 0.00 0.69 -5.03 105.19 112.64 1l2a n GLY 483 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1l2a n GLY 483 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l2a s THR 484 N -3.03 2.07 0.14 2.61 -4.23 -1.25 -4.78 115.64 107.17 1l2a s THR 484 Ca 0.00 -0.15 -0.12 0.00 -1.18 0.00 0.00 61.69 60.24 1l2a s THR 484 Cb 0.00 -2.92 0.01 0.00 1.34 0.00 0.00 72.50 70.93 1l2a s THR 484 CO 0.00 0.00 0.32 0.72 -0.54 0.00 0.00 174.62 175.12 1l2a s PHE 485 N -3.61 0.13 -0.03 3.99 -0.12 -1.26 -1.57 117.98 115.52 1l2a s PHE 485 Ca 0.69 -0.50 -0.08 0.00 -0.05 0.00 0.00 56.93 56.99 1l2a s PHE 485 Cb -0.06 0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.42 1l2a s PHE 485 CO 0.49 -0.71 0.18 0.00 -0.05 0.00 0.00 175.22 175.14 1l2a s ALA 486 N -3.89 -0.43 0.13 1.99 0.00 0.16 -4.79 121.76 114.92 1l2a s ALA 486 Ca 0.10 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.31 1l2a s ALA 486 Cb 0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1l2a s ALA 486 CO -0.05 -0.16 -0.11 0.96 0.00 0.00 0.00 175.76 176.40 1l2a s ILE 487 N -0.74 1.14 0.33 0.00 -4.36 -0.54 -0.76 121.20 116.27 1l2a s ILE 487 Ca -0.08 -1.95 -0.28 0.00 -0.26 0.00 0.00 60.65 58.08 1l2a s ILE 487 Cb -0.05 -1.72 -0.13 0.00 1.25 0.00 0.00 42.46 41.81 1l2a s ILE 487 CO 0.01 -0.68 1.21 -2.65 0.24 0.00 0.00 174.94 173.08 1l2a n PRO 488 N 0.02 1.91 -0.01 0.37 -0.02 -1.26 -1.03 135.00 134.97 1l2a n PRO 488 Ca -0.12 0.67 -0.05 0.00 -2.02 0.00 0.00 63.50 61.98 1l2a n PRO 488 Cb 0.60 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 1l2a n PRO 488 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1l2a n SER 489 N 0.87 0.96 -4.24 2.55 2.88 0.54 -4.71 113.62 112.48 1l2a n SER 489 Ca 0.06 0.15 -0.27 0.00 -1.33 0.00 0.00 58.87 57.48 1l2a n SER 489 Cb 0.35 -0.34 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 1l2a n SER 489 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1l2a s ASP 490 N -5.84 2.50 0.05 -3.46 1.01 -1.10 -1.82 116.67 108.00 1l2a s ASP 490 Ca -0.09 -0.43 0.09 0.00 0.71 0.00 0.00 52.55 52.83 1l2a s ASP 490 Cb 0.03 -0.26 -0.03 0.00 1.01 0.00 0.00 42.92 43.67 1l2a s ASP 490 CO 0.13 0.23 -0.26 -0.76 0.21 0.00 0.00 175.17 174.72 1l2a s LEU 491 N -0.70 2.17 -0.05 1.23 1.02 0.26 -0.75 118.68 121.86 1l2a s LEU 491 Ca 0.08 -0.59 0.06 0.00 0.02 0.00 0.00 54.13 53.70 1l2a s LEU 491 Cb -0.08 -1.24 -0.01 0.00 0.02 0.00 0.00 46.19 44.88 1l2a s LEU 491 CO -0.00 0.24 -0.23 -0.70 0.02 0.00 0.00 176.35 175.69 1l2a s GLU 492 N -1.26 2.23 0.01 1.70 2.12 0.42 -4.48 118.70 119.43 1l2a s GLU 492 Ca 0.11 -0.82 0.07 0.00 0.36 0.00 0.00 54.97 54.70 1l2a s GLU 492 Cb -0.10 -1.94 -0.03 0.00 0.26 0.00 0.00 34.13 32.32 1l2a s GLU 492 CO 0.02 0.37 -0.22 -1.58 -0.54 0.00 0.00 175.26 173.31 1l2a s TRP 493 N -0.19 2.46 0.06 5.30 0.52 -1.26 -1.38 118.94 124.45 1l2a s TRP 493 Ca -0.01 -0.33 0.01 0.00 0.02 0.00 0.00 56.10 55.79 1l2a s TRP 493 Cb -0.12 -1.49 -0.03 0.00 -1.15 0.00 0.00 33.47 30.68 1l2a s TRP 493 CO 0.02 0.12 -0.06 -1.54 0.02 0.00 0.00 176.95 175.51 1l2a s SER 494 N -1.00 0.89 0.00 2.95 1.04 -0.69 -5.02 113.70 111.86 1l2a s SER 494 Ca 0.12 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1l2a s SER 494 Cb -0.10 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.10 1l2a s SER 494 CO 0.02 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 174.48 1l2a n GLY 495 N 0.69 -1.96 3.04 7.32 0.00 -1.26 -1.12 105.19 111.90 1l2a n GLY 495 Ca -0.17 -1.41 -0.12 0.00 0.00 0.00 0.00 46.02 44.32 1l2a n GLY 495 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1l2a s GLN 496 N 0.00 0.47 0.75 1.61 -0.21 -1.23 -4.88 119.66 116.16 1l2a s GLN 496 Ca 0.00 -0.71 -0.14 0.00 0.02 0.00 0.00 55.36 54.53 1l2a s GLN 496 Cb 0.00 -0.19 0.05 0.00 1.00 0.00 0.00 33.01 33.87 1l2a s GLN 496 CO 0.00 0.02 1.19 -1.25 -2.12 0.00 0.00 175.29 173.14 1l2a s PRO 497 N -1.52 2.05 0.57 2.91 0.04 -1.26 -3.62 135.00 134.17 1l2a s PRO 497 Ca -0.11 1.71 -0.19 0.00 0.04 0.00 0.00 61.00 62.44 1l2a s PRO 497 Cb -0.10 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 1l2a s PRO 497 CO 0.00 -1.89 1.18 -0.51 0.04 0.00 0.00 177.00 175.82 1l2a s ASP 498 N -2.16 5.43 0.28 6.66 1.01 -1.26 -4.71 116.67 121.92 1l2a s ASP 498 Ca 0.73 2.32 -0.30 0.00 0.71 0.00 0.00 52.55 56.00 1l2a s ASP 498 Cb -0.28 -2.59 -0.12 0.00 1.01 0.00 0.00 42.92 40.94 1l2a s ASP 498 CO 0.47 -1.43 1.57 0.41 0.21 0.00 0.00 175.17 176.41 1l2a n THR 499 N -1.42 0.92 -2.17 -1.27 -1.04 -1.26 -4.82 114.28 103.22 1l2a n THR 499 Ca 0.13 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.05 61.48 1l2a n THR 499 Cb 0.50 -1.88 -0.03 0.00 -1.82 0.00 0.00 70.33 67.10 1l2a n THR 499 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1l2a s TRP 500 N 0.08 2.47 -1.35 -1.42 -0.11 -0.07 -4.89 118.94 113.64 1l2a s TRP 500 Ca 0.66 0.59 0.14 0.00 1.22 0.00 0.00 56.10 58.70 1l2a s TRP 500 Cb -0.52 -3.74 0.33 0.00 -1.50 0.00 0.00 33.47 28.04 1l2a s TRP 500 CO 0.47 -2.89 1.25 2.41 -4.62 0.00 0.00 176.95 173.57 1l2a n THR 501 N 5.19 0.77 -0.22 5.86 -1.04 -1.26 -4.69 114.28 118.89 1l2a n THR 501 Ca 0.15 -0.88 0.00 0.00 -2.04 0.00 0.00 64.05 61.28 1l2a n THR 501 Cb 0.43 0.69 0.00 0.00 -1.82 0.00 0.00 70.33 69.63 1l2a n THR 501 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1l2a n GLY 502 N 0.82 0.81 3.09 3.41 0.00 -1.26 -5.05 105.19 107.01 1l2a n GLY 502 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1l2a n GLY 502 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l2a s THR 503 N -2.56 -0.02 0.03 2.61 2.01 -1.26 -5.13 115.64 111.32 1l2a s THR 503 Ca 0.00 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 1l2a s THR 503 Cb 0.00 -0.36 -0.06 0.00 0.01 0.00 0.00 72.50 72.09 1l2a s THR 503 CO 0.00 0.03 1.42 -0.47 -0.69 0.00 0.00 174.62 174.91 1l2a s TYR 504 N 0.67 2.90 -0.82 4.92 5.04 -1.26 -4.92 117.35 123.87 1l2a s TYR 504 Ca -0.04 0.80 0.23 0.00 -2.44 0.00 0.00 57.07 55.62 1l2a s TYR 504 Cb -0.06 -3.69 0.18 0.00 0.35 0.00 0.00 41.96 38.73 1l2a s TYR 504 CO -0.04 -2.56 1.16 0.25 -1.34 0.00 0.00 175.55 173.02 1l2a n THR 505 N 4.50 0.09 -0.09 4.34 -2.24 -1.26 -4.96 114.28 114.66 1l2a n THR 505 Ca 0.13 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1l2a n THR 505 Cb 0.43 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1l2a n THR 505 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l2a n GLY 506 N 1.44 0.55 3.68 3.38 0.00 -1.26 -4.71 105.19 108.28 1l2a n GLY 506 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 1l2a n GLY 506 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1l2a n ASN 507 N 0.00 -2.21 0.13 1.61 3.02 -1.26 -4.00 115.26 112.55 1l2a n ASN 507 Ca 0.00 -0.62 0.10 0.00 -0.03 0.00 0.00 54.58 54.02 1l2a n ASN 507 Cb 0.00 -0.81 0.48 0.00 -0.61 0.00 0.00 39.78 38.84 1l2a n ASN 507 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1l2a n PRO 508 N -2.61 0.13 -0.11 3.52 -0.04 -1.26 -1.58 135.00 133.05 1l2a n PRO 508 Ca -0.09 0.56 0.05 0.00 -0.04 0.00 0.00 63.50 63.98 1l2a n PRO 508 Cb 0.31 -1.86 0.11 0.00 -0.04 0.00 0.00 33.50 32.01 1l2a n PRO 508 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1l2a n ASN 509 N -2.13 2.50 -4.52 3.54 4.13 -1.26 -4.88 115.26 112.65 1l2a n ASN 509 Ca -0.00 -1.80 -0.40 0.00 1.68 0.00 0.00 54.58 54.06 1l2a n ASN 509 Cb 0.07 -0.14 -0.11 0.00 -1.54 0.00 0.00 39.78 38.07 1l2a n ASN 509 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1l2a s LEU 510 N -0.95 4.44 -0.01 3.41 2.96 -0.61 -3.56 118.68 124.37 1l2a s LEU 510 Ca 0.18 -0.43 0.07 0.00 -0.22 0.00 0.00 54.13 53.73 1l2a s LEU 510 Cb 0.10 -2.11 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 1l2a s LEU 510 CO 0.14 -0.22 -0.21 -1.00 -1.32 0.00 0.00 176.35 173.73 1l2a s HIS 511 N 1.70 1.88 0.04 5.38 3.76 -0.28 -0.82 115.29 126.96 1l2a s HIS 511 Ca 0.06 -0.36 0.08 0.00 -0.15 0.00 0.00 55.06 54.69 1l2a s HIS 511 Cb -0.17 -1.20 -0.03 0.00 1.11 0.00 0.00 32.58 32.29 1l2a s HIS 511 CO 0.10 -0.01 -0.22 0.54 -0.85 0.00 0.00 174.74 174.30 1l2a s VAL 512 N -0.55 2.49 -0.02 -0.90 0.11 -1.26 -1.70 120.40 118.58 1l2a s VAL 512 Ca 0.08 -1.27 0.01 0.00 -2.93 0.00 0.00 61.98 57.87 1l2a s VAL 512 Cb -0.08 -2.01 0.01 0.00 -1.53 0.00 0.00 36.38 32.76 1l2a s VAL 512 CO -0.00 0.36 -0.04 -0.60 -3.33 0.00 0.00 175.10 171.48 1l2a s ARG 513 N -1.33 0.53 -0.23 1.54 3.52 -0.48 -4.93 118.95 117.57 1l2a s ARG 513 Ca 0.13 -0.13 -0.20 0.00 -0.13 0.00 0.00 55.73 55.40 1l2a s ARG 513 Cb -0.10 -0.55 -0.02 0.00 -1.56 0.00 0.00 34.95 32.71 1l2a s ARG 513 CO 0.04 0.03 0.62 0.08 -0.81 0.00 0.00 175.30 175.25 1l2a s VAL 514 N 0.33 5.01 -0.03 7.11 1.01 -1.26 -0.44 120.40 132.14 1l2a s VAL 514 Ca -0.04 1.13 0.19 0.00 0.00 0.00 0.00 61.98 63.26 1l2a s VAL 514 Cb -0.07 -3.93 -0.29 0.00 0.00 0.00 0.00 36.38 32.09 1l2a s VAL 514 CO -0.00 0.07 0.40 0.35 0.00 0.00 0.00 175.10 175.93 1l2a n THR 515 N 4.94 0.01 -3.73 3.92 -2.24 0.07 -4.97 114.28 112.28 1l2a n THR 515 Ca -0.01 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.24 1l2a n THR 515 Cb 0.49 0.07 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 1l2a n THR 515 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1l2a s SER 516 N -4.15 -0.23 0.11 3.42 1.04 -1.22 -4.97 113.70 107.69 1l2a s SER 516 Ca -0.07 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 55.92 1l2a s SER 516 Cb 0.12 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.74 1l2a s SER 516 CO 0.77 -0.99 -0.10 -0.31 0.98 0.00 0.00 173.24 173.59 1l2a s TYR 517 N -3.87 1.11 0.00 5.02 1.51 -1.26 -0.34 117.35 119.52 1l2a s TYR 517 Ca 0.09 -0.68 0.00 0.00 -1.01 0.00 0.00 57.07 55.47 1l2a s TYR 517 Cb 0.00 -0.60 0.00 0.00 -0.11 0.00 0.00 41.96 41.25 1l2a s TYR 517 CO -0.05 0.02 0.00 0.41 -1.11 0.00 0.00 175.55 174.82 1l2a n GLY 518 N 0.39 3.65 1.83 0.71 0.00 -0.20 -4.82 105.19 106.76 1l2a n GLY 518 Ca -0.15 -0.53 0.01 0.00 0.00 0.00 0.00 46.02 45.36 1l2a n GLY 518 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1l2a n THR 519 N 0.00 0.31 -1.92 2.61 5.66 -1.26 -1.46 114.28 118.21 1l2a n THR 519 Ca 0.00 -1.33 -0.42 0.00 -3.05 0.00 0.00 64.05 59.25 1l2a n THR 519 Cb 0.00 1.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.76 1l2a n THR 519 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1l2a s ASP 520 N -2.25 6.48 0.18 1.09 -1.08 -1.26 -4.91 116.67 114.92 1l2a s ASP 520 Ca 0.26 2.20 -0.03 0.00 -0.52 0.00 0.00 52.55 54.46 1l2a s ASP 520 Cb 0.32 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 39.32 1l2a s ASP 520 CO -0.11 -1.09 1.45 -0.07 0.52 0.00 0.00 175.17 175.88 1l2a h LEU 521 N 10.92 0.58 -0.06 -1.34 3.38 -1.98 0.02 115.31 126.82 1l2a h LEU 521 Ca -0.41 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.18 1l2a h LEU 521 Cb 1.19 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 1l2a h LEU 521 CO 0.96 1.08 -0.11 1.23 0.09 0.00 0.00 178.44 181.69 1l2a h GLY 522 N 1.12 0.20 0.84 0.83 0.00 -1.88 -1.37 103.07 102.81 1l2a h GLY 522 Ca -0.02 -0.23 0.05 0.00 0.00 0.00 0.00 47.33 47.14 1l2a h GLY 522 CO 0.12 0.21 0.63 -2.08 0.00 0.00 0.00 176.54 175.42 1l2a h VAL 523 N -0.29 1.11 -0.47 4.60 2.07 -1.92 0.67 116.25 122.03 1l2a h VAL 523 Ca 0.01 -0.40 -0.10 0.00 0.82 0.00 0.00 66.70 67.03 1l2a h VAL 523 Cb 0.67 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1l2a h VAL 523 CO 0.02 0.21 -0.09 0.00 0.02 0.00 0.00 177.57 177.74 1l2a h ALA 524 N 1.46 0.64 0.25 1.67 0.00 -0.91 -1.47 119.26 120.91 1l2a h ALA 524 Ca 0.40 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1l2a h ALA 524 Cb 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1l2a h ALA 524 CO -0.15 0.52 -0.20 0.78 0.00 0.00 0.00 179.25 180.21 1l2a h GLY 525 N 0.73 -0.47 0.03 0.00 0.00 -0.59 -1.70 103.07 101.08 1l2a h GLY 525 Ca 0.12 0.22 0.15 0.00 0.00 0.00 0.00 47.33 47.83 1l2a h GLY 525 CO 0.04 -0.19 0.25 0.23 0.00 0.00 0.00 176.54 176.86 1l2a h SER 526 N -0.46 0.16 0.09 0.19 0.87 -0.86 0.02 113.55 113.56 1l2a h SER 526 Ca -0.01 0.13 -0.15 0.00 -1.23 0.00 0.00 61.79 60.52 1l2a h SER 526 Cb 0.41 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 1l2a h SER 526 CO -0.01 0.03 -0.54 0.25 -0.53 0.00 0.00 176.83 176.03 1l2a h LEU 527 N 0.36 0.54 -0.57 2.23 5.85 -1.16 -2.07 115.31 120.48 1l2a h LEU 527 Ca 0.42 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.77 1l2a h LEU 527 Cb 0.68 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1l2a h LEU 527 CO -0.46 0.97 0.03 0.00 -0.34 0.00 0.00 178.44 178.64 1l2a h ALA 528 N 1.04 0.77 0.19 1.25 0.00 -0.76 -1.22 119.26 120.52 1l2a h ALA 528 Ca 0.01 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1l2a h ALA 528 Cb 1.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1l2a h ALA 528 CO 0.10 0.58 -0.32 -0.97 0.00 0.00 0.00 179.25 178.63 1l2a h ASN 529 N 0.89 -0.92 -0.70 0.00 -0.73 -0.93 -0.42 115.58 112.77 1l2a h ASN 529 Ca 0.17 0.10 0.09 0.00 1.87 0.00 0.00 56.30 58.53 1l2a h ASN 529 Cb 0.51 0.34 -0.07 0.00 0.27 0.00 0.00 38.32 39.37 1l2a h ASN 529 CO 0.02 -0.43 0.35 0.00 -0.37 0.00 0.00 177.43 177.00 1l2a h ALA 530 N 0.00 0.97 -0.21 1.57 0.00 -1.26 0.20 119.26 120.53 1l2a h ALA 530 Ca 0.01 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 1l2a h ALA 530 Cb 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1l2a h ALA 530 CO -0.15 -0.06 -0.66 -0.07 0.00 0.00 0.00 179.25 178.32 1l2a h LEU 531 N 0.59 0.90 -0.44 0.00 3.38 -1.07 -0.73 115.31 117.93 1l2a h LEU 531 Ca 0.35 -0.54 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 1l2a h LEU 531 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1l2a h LEU 531 CO -0.27 1.33 -0.06 0.00 0.09 0.00 0.00 178.44 179.53 1l2a h ALA 532 N 0.67 0.60 0.05 1.53 0.00 -0.69 0.10 119.26 121.53 1l2a h ALA 532 Ca -0.02 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1l2a h ALA 532 Cb 1.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1l2a h ALA 532 CO 0.14 0.45 -0.03 1.15 0.00 0.00 0.00 179.25 180.96 1l2a h THR 533 N 0.66 1.02 -0.18 0.00 2.02 -0.63 0.13 112.91 115.93 1l2a h THR 533 Ca 0.12 -0.23 0.05 0.00 0.77 0.00 0.00 66.41 67.12 1l2a h THR 533 Cb 0.58 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 68.09 1l2a h THR 533 CO 0.03 0.06 -0.26 0.22 0.37 0.00 0.00 175.52 175.94 1l2a h TYR 534 N -0.18 -0.71 -0.51 3.16 3.20 -1.09 0.11 116.97 120.95 1l2a h TYR 534 Ca -0.01 0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.99 1l2a h TYR 534 Cb 0.15 0.34 -0.07 0.00 1.54 0.00 0.00 36.73 38.69 1l2a h TYR 534 CO -0.04 -0.34 0.09 0.00 -1.64 0.00 0.00 178.16 176.23 1l2a h ALA 535 N 0.65 0.57 -0.59 1.82 0.00 -0.69 0.76 119.26 121.79 1l2a h ALA 535 Ca 0.11 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.21 1l2a h ALA 535 Cb 0.48 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 1l2a h ALA 535 CO -0.35 -0.32 0.25 0.00 0.00 0.00 0.00 179.25 178.84 1l2a h ALA 536 N 1.41 0.76 -0.90 0.00 0.00 -0.25 -1.86 119.26 118.42 1l2a h ALA 536 Ca 0.26 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.25 1l2a h ALA 536 Cb 0.36 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1l2a h ALA 536 CO -0.35 -0.14 0.59 0.00 0.00 0.00 0.00 179.25 179.36 1l2a h ALA 537 N 1.37 1.16 0.00 0.00 0.00 0.97 -2.09 119.26 120.67 1l2a h ALA 537 Ca 0.28 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1l2a h ALA 537 Cb 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1l2a h ALA 537 CO -0.25 0.50 -0.27 1.79 0.00 0.00 0.00 179.25 181.02 1l2a h THR 538 N 1.19 1.16 -0.17 0.00 1.35 -0.12 -1.93 112.91 114.39 1l2a h THR 538 Ca 0.34 -0.95 -0.05 0.00 -0.55 0.00 0.00 66.41 65.21 1l2a h THR 538 Cb -0.09 1.52 -0.00 0.00 -1.73 0.00 0.00 68.15 67.84 1l2a h THR 538 CO -0.09 0.27 -0.07 -0.08 -0.25 0.00 0.00 175.52 175.30 1l2a h GLU 539 N 0.00 0.35 -0.45 4.72 4.81 -0.94 -0.07 114.58 123.00 1l2a h GLU 539 Ca -0.00 -0.15 -0.11 0.00 -0.13 0.00 0.00 59.36 58.97 1l2a h GLU 539 Cb 0.49 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 1l2a h GLU 539 CO 0.04 0.65 -0.13 -0.09 -0.73 0.00 0.00 179.01 178.75 1l2a h ARG 540 N 0.04 0.89 0.00 1.92 2.43 -1.30 -3.39 114.38 114.98 1l2a h ARG 540 Ca 0.04 -0.35 -0.04 0.00 -0.81 0.00 0.00 59.98 58.81 1l2a h ARG 540 Cb 0.54 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1l2a h ARG 540 CO 0.02 1.00 -1.57 0.91 -1.51 0.00 0.00 179.97 178.83 1l2a n TRP 541 N -4.23 0.00 -3.71 2.20 7.02 -0.74 -5.05 117.44 112.93 1l2a n TRP 541 Ca -0.00 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.23 1l2a n TRP 541 Cb 0.40 -0.32 0.01 0.00 -2.42 0.00 0.00 31.31 28.98 1l2a n TRP 541 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1l2a s GLU 542 N -2.68 2.25 0.41 -0.99 2.02 -0.04 -5.01 118.70 114.66 1l2a s GLU 542 Ca -0.04 -1.96 0.08 0.00 0.02 0.00 0.00 54.97 53.06 1l2a s GLU 542 Cb 0.06 -2.21 0.87 0.00 0.10 0.00 0.00 34.13 32.95 1l2a s GLU 542 CO 0.47 -0.70 2.05 0.78 0.02 0.00 0.00 175.26 177.87 1l2a h GLY 543 N 0.60 0.60 -3.47 -1.39 0.00 -1.92 -3.45 103.07 94.03 1l2a h GLY 543 Ca -0.35 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 46.70 1l2a h GLY 543 CO 0.53 0.20 -0.10 -1.59 0.00 0.00 0.00 176.54 175.59 1l2a s LYS 544 N -5.50 0.97 0.21 4.80 -2.85 -1.26 -5.09 119.74 111.02 1l2a s LYS 544 Ca -0.08 -0.51 -0.32 0.00 -1.00 0.00 0.00 55.97 54.05 1l2a s LYS 544 Cb 0.18 0.43 -0.12 0.00 -2.06 0.00 0.00 37.83 36.26 1l2a s LYS 544 CO 0.73 -0.35 1.69 -1.17 0.10 0.00 0.00 175.35 176.36 1l2a s LEU 545 N -2.34 4.37 -1.01 2.77 2.96 -1.26 -4.34 118.68 119.83 1l2a s LEU 545 Ca -0.02 2.83 -0.23 0.00 -0.22 0.00 0.00 54.13 56.50 1l2a s LEU 545 Cb 0.00 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 43.11 1l2a s LEU 545 CO -0.06 -0.95 1.66 -0.62 -1.32 0.00 0.00 176.35 175.06 1l2a s ASP 546 N 1.15 6.00 0.42 3.68 -1.08 -1.26 -4.83 116.67 120.74 1l2a s ASP 546 Ca 0.74 -1.27 0.10 0.00 -0.52 0.00 0.00 52.55 51.60 1l2a s ASP 546 Cb -0.49 -2.57 0.90 0.00 -1.46 0.00 0.00 42.92 39.30 1l2a s ASP 546 CO 0.32 -1.97 1.99 0.74 0.52 0.00 0.00 175.17 176.77 1l2a h THR 547 N 6.84 1.13 -0.15 1.71 2.02 -1.95 -2.45 112.91 120.07 1l2a h THR 547 Ca 0.18 -0.50 -0.17 0.00 0.77 0.00 0.00 66.41 66.69 1l2a h THR 547 Cb 1.00 1.02 0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1l2a h THR 547 CO 1.35 0.17 -0.56 0.11 0.37 0.00 0.00 175.52 176.96 1l2a h LYS 548 N 0.25 0.64 -0.64 6.66 1.57 -2.00 -1.76 116.57 121.29 1l2a h LYS 548 Ca 0.06 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1l2a h LYS 548 Cb 0.21 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1l2a h LYS 548 CO 0.01 1.11 0.42 0.00 -0.57 0.00 0.00 179.45 180.41 1l2a h ALA 549 N 0.53 0.81 -0.48 3.86 0.00 -1.83 -1.75 119.26 120.40 1l2a h ALA 549 Ca -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1l2a h ALA 549 Cb 1.19 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1l2a h ALA 549 CO 0.12 0.25 0.25 -0.09 0.00 0.00 0.00 179.25 179.78 1l2a h ARG 550 N 0.87 0.67 -0.27 0.00 2.43 -1.36 -1.69 114.38 115.04 1l2a h ARG 550 Ca 0.23 -0.09 -0.12 0.00 -0.81 0.00 0.00 59.98 59.20 1l2a h ARG 550 Cb -0.09 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 1l2a h ARG 550 CO -0.05 0.54 -0.34 -0.44 -1.51 0.00 0.00 179.97 178.18 1l2a h ASP 551 N 0.63 0.60 -0.43 -3.80 3.32 -1.12 -2.59 116.42 113.03 1l2a h ASP 551 Ca 0.17 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.87 1l2a h ASP 551 Cb 0.07 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1l2a h ASP 551 CO -0.02 0.89 -0.10 -0.03 -1.72 0.00 0.00 179.24 178.26 1l2a h MET 552 N 0.49 0.89 -0.51 3.56 4.05 -1.11 -0.69 114.93 121.61 1l2a h MET 552 Ca 0.05 -0.31 0.06 0.00 -0.28 0.00 0.00 59.70 59.22 1l2a h MET 552 Cb 0.82 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 31.50 1l2a h MET 552 CO 0.07 0.95 0.23 0.00 0.23 0.00 0.00 176.91 178.39 1l2a h ALA 553 N 1.08 0.65 -0.32 0.39 0.00 -0.98 -1.04 119.26 119.04 1l2a h ALA 553 Ca 0.13 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1l2a h ALA 553 Cb 0.62 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1l2a h ALA 553 CO 0.04 -0.13 -0.15 0.00 0.00 0.00 0.00 179.25 179.00 1l2a h ALA 554 N 1.30 1.13 -0.29 0.00 0.00 -1.07 -2.45 119.26 117.87 1l2a h ALA 554 Ca 0.24 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1l2a h ALA 554 Cb 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1l2a h ALA 554 CO -0.19 0.55 0.04 0.93 0.00 0.00 0.00 179.25 180.57 1l2a h GLU 555 N 0.53 0.50 -0.27 0.00 4.39 -0.56 0.77 114.58 119.93 1l2a h GLU 555 Ca 0.09 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.66 1l2a h GLU 555 Cb 0.57 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 1l2a h GLU 555 CO 0.04 0.61 0.14 -0.07 -1.16 0.00 0.00 179.01 178.57 1l2a h LEU 556 N 0.31 0.22 -0.44 1.33 3.38 -1.00 -0.13 115.31 118.98 1l2a h LEU 556 Ca 0.09 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1l2a h LEU 556 Cb 0.36 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1l2a h LEU 556 CO 0.01 0.17 -0.01 0.58 0.09 0.00 0.00 178.44 179.28 1l2a h VAL 557 N 0.30 1.26 -0.69 1.22 2.07 -1.35 0.15 116.25 119.22 1l2a h VAL 557 Ca 0.11 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.60 1l2a h VAL 557 Cb 0.02 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1l2a h VAL 557 CO -0.07 0.36 0.43 0.78 0.02 0.00 0.00 177.57 179.10 1l2a h ASN 558 N 0.62 0.71 0.73 0.57 2.35 -0.55 -2.81 115.58 117.20 1l2a h ASN 558 Ca 0.12 -0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.61 1l2a h ASN 558 Cb 0.51 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1l2a h ASN 558 CO 0.02 0.50 -1.21 0.03 -1.65 0.00 0.00 177.43 175.12 1l2a h ARG 559 N 0.85 0.17 -0.10 0.81 3.08 -0.71 -0.41 114.38 118.08 1l2a h ARG 559 Ca 0.27 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1l2a h ARG 559 Cb 0.00 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1l2a h ARG 559 CO -0.10 1.11 -0.29 0.00 -1.07 0.00 0.00 179.97 179.62 1l2a h ALA 560 N 0.72 1.33 0.02 0.04 0.00 -0.96 -2.27 119.26 118.15 1l2a h ALA 560 Ca -0.11 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 54.28 1l2a h ALA 560 Cb 1.91 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 1l2a h ALA 560 CO 0.17 0.47 -1.10 2.35 0.00 0.00 0.00 179.25 181.13 1l2a h TRP 561 N 0.16 0.09 -0.23 0.00 2.91 -1.42 -2.86 115.95 114.60 1l2a h TRP 561 Ca 0.02 -0.06 0.03 0.00 1.13 0.00 0.00 58.89 60.01 1l2a h TRP 561 Cb 0.61 -0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.22 1l2a h TRP 561 CO 0.01 1.43 0.06 -0.92 -1.03 0.00 0.00 178.44 177.99 1l2a h TYR 562 N -0.84 0.10 0.00 2.65 3.20 -1.17 -2.88 116.97 118.03 1l2a h TYR 562 Ca -0.29 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.60 1l2a h TYR 562 Cb 1.36 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.61 1l2a h TYR 562 CO 0.13 0.04 -0.38 -0.91 -1.64 0.00 0.00 178.16 175.40 1l2a h ASN 563 N 0.15 0.00 0.00 -2.11 2.35 -1.55 -1.25 115.58 113.18 1l2a h ASN 563 Ca 0.10 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1l2a h ASN 563 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1l2a h ASN 563 CO -0.12 0.03 -0.14 0.49 -1.65 0.00 0.00 177.43 176.04 1l2a n PHE 564 N -2.52 0.00 -1.64 1.19 3.01 -1.08 -4.49 117.46 111.93 1l2a n PHE 564 Ca 0.03 -0.67 -0.45 0.00 1.01 0.00 0.00 57.45 57.38 1l2a n PHE 564 Cb 0.48 -0.11 -0.02 0.00 -0.01 0.00 0.00 39.48 39.82 1l2a n PHE 564 CO 0.00 0.00 0.00 0.98 1.01 0.00 0.00 176.76 178.75 1l2a n TYR 565 N -0.95 1.86 -3.40 1.38 9.36 -1.09 -0.09 117.16 124.23 1l2a n TYR 565 Ca 0.10 0.55 -0.41 0.00 3.32 0.00 0.00 57.90 61.47 1l2a n TYR 565 Cb 0.63 -2.38 -0.09 0.00 -0.63 0.00 0.00 39.34 36.87 1l2a n TYR 565 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1l2a h SER 567 N 8.47 0.00 0.00 0.00 4.64 -1.86 -2.06 113.55 122.74 1l2a h SER 567 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1l2a h SER 567 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1l2a h SER 567 CO 0.70 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 176.04 1l2a n GLU 568 N -2.31 0.97 -0.81 4.77 4.71 -1.26 -4.92 120.64 121.79 1l2a n GLU 568 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 1l2a n GLU 568 Cb 0.33 -1.28 0.00 0.00 -1.01 0.00 0.00 31.44 29.48 1l2a n GLU 568 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1l2a n GLY 569 N 0.74 0.50 0.68 0.62 0.00 -0.77 -4.96 105.19 102.00 1l2a n GLY 569 Ca 0.13 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.45 1l2a n GLY 569 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l2a n LYS 570 N -2.81 1.94 0.00 1.61 5.02 -1.26 -4.81 118.16 117.85 1l2a n LYS 570 Ca 0.00 -1.37 0.00 0.00 -2.02 0.00 0.00 58.31 54.92 1l2a n LYS 570 Cb 0.00 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1l2a n LYS 570 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1l2a n GLY 571 N 1.25 0.55 3.56 0.72 0.00 -1.26 -4.70 105.19 105.31 1l2a n GLY 571 Ca 0.17 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.77 1l2a n GLY 571 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1l2a s VAL 572 N 0.00 2.70 -0.11 1.61 -7.23 -1.26 -1.35 120.40 114.77 1l2a s VAL 572 Ca 0.00 -2.15 -0.11 0.00 -1.81 0.00 0.00 61.98 57.91 1l2a s VAL 572 Cb 0.00 -2.61 0.03 0.00 0.56 0.00 0.00 36.38 34.36 1l2a s VAL 572 CO 0.00 -0.31 0.32 0.54 -0.31 0.00 0.00 175.10 175.34 1l2a s VAL 573 N -2.49 0.01 0.34 1.32 0.11 0.87 -4.73 120.40 115.82 1l2a s VAL 573 Ca 0.32 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.32 1l2a s VAL 573 Cb -0.03 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.32 1l2a s VAL 573 CO 0.18 -0.03 0.54 -0.89 -3.33 0.00 0.00 175.10 171.57 1l2a s THR 574 N 0.00 5.10 -0.18 5.04 2.01 -0.80 -4.55 115.64 122.27 1l2a s THR 574 Ca -0.02 -0.43 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 1l2a s THR 574 Cb -0.03 -3.85 0.05 0.00 0.01 0.00 0.00 72.50 68.69 1l2a s THR 574 CO 0.01 -0.53 0.01 -0.70 -0.69 0.00 0.00 174.62 172.72 1l2a s GLU 575 N -4.23 0.87 -0.02 4.92 2.12 -1.25 -3.24 118.70 117.87 1l2a s GLU 575 Ca 0.40 -0.43 -0.00 0.00 0.36 0.00 0.00 54.97 55.31 1l2a s GLU 575 Cb -0.10 -1.99 0.03 0.00 0.26 0.00 0.00 34.13 32.33 1l2a s GLU 575 CO 0.35 -0.56 0.03 -1.83 -0.54 0.00 0.00 175.26 172.71 1l2a s GLU 576 N 1.79 -0.03 -0.25 4.30 -1.05 0.62 -4.95 118.70 119.13 1l2a s GLU 576 Ca -0.00 0.19 -0.29 0.00 -0.15 0.00 0.00 54.97 54.71 1l2a s GLU 576 Cb -0.16 -0.26 0.00 0.00 -0.44 0.00 0.00 34.13 33.27 1l2a s GLU 576 CO -0.07 -0.17 1.16 0.00 0.95 0.00 0.00 175.26 177.13 1l2a s ALA 577 N 1.10 3.56 -1.01 -0.84 0.00 -1.26 -0.12 121.76 123.19 1l2a s ALA 577 Ca -0.09 0.16 -0.05 0.00 0.00 0.00 0.00 51.96 51.98 1l2a s ALA 577 Cb -0.13 -3.65 0.25 0.00 0.00 0.00 0.00 23.12 19.59 1l2a s ALA 577 CO -0.03 -1.36 0.96 0.54 0.00 0.00 0.00 175.76 175.87 1l2a n ARG 578 N 6.76 3.11 -0.12 0.00 5.12 -0.51 -4.86 116.66 126.16 1l2a n ARG 578 Ca 0.13 -4.47 0.05 0.00 -1.93 0.00 0.00 57.85 51.63 1l2a n ARG 578 Cb 0.46 -2.48 0.37 0.00 -1.16 0.00 0.00 32.46 29.65 1l2a n ARG 578 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1l2a h ALA 579 N 6.26 1.69 0.00 7.54 0.00 -1.92 -1.89 119.26 130.95 1l2a h ALA 579 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1l2a h ALA 579 Cb 0.83 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1l2a h ALA 579 CO 0.94 0.24 0.00 0.38 0.00 0.00 0.00 179.25 180.81 1l2a h ASP 580 N 0.71 0.00 0.39 0.00 2.03 -1.98 -2.68 116.42 114.89 1l2a h ASP 580 Ca 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 1l2a h ASP 580 Cb 0.11 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.61 1l2a h ASP 580 CO -0.07 0.00 0.00 -1.22 -1.03 0.00 0.00 179.24 176.92 1l2a n TYR 581 N -2.57 0.00 0.29 4.15 4.02 -0.71 -1.52 117.16 120.82 1l2a n TYR 581 Ca -0.02 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.03 1l2a n TYR 581 Cb 0.06 -0.47 0.90 0.00 -0.02 0.00 0.00 39.34 39.81 1l2a n TYR 581 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 1l2a h LYS 582 N 0.00 0.00 0.00 -0.72 2.10 -1.71 -1.79 116.57 114.45 1l2a h LYS 582 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1l2a h LYS 582 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 1l2a h LYS 582 CO 0.00 0.04 0.00 0.54 -2.00 0.00 0.00 179.45 178.03 1l2a n ARG 583 N -3.66 0.18 -0.32 0.07 1.74 -0.58 -1.83 116.66 112.27 1l2a n ARG 583 Ca -0.03 0.44 0.14 0.00 -0.77 0.00 0.00 57.85 57.63 1l2a n ARG 583 Cb 0.13 -1.87 0.32 0.00 -1.02 0.00 0.00 32.46 30.03 1l2a n ARG 583 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1l2a h PHE 584 N 0.00 0.81 0.00 -1.55 0.04 -1.53 -2.82 116.94 111.88 1l2a h PHE 584 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1l2a h PHE 584 Cb 0.32 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1l2a h PHE 584 CO 0.00 0.04 -0.86 1.19 -0.60 0.00 0.00 178.31 178.07 1l2a n PHE 585 N -4.95 0.00 -0.03 -0.55 3.01 -0.79 -2.15 117.46 111.99 1l2a n PHE 585 Ca 0.23 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.75 1l2a n PHE 585 Cb 0.65 -0.08 -0.17 0.00 -0.01 0.00 0.00 39.48 39.88 1l2a n PHE 585 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1l2a n GLU 586 N -1.47 0.67 -2.81 -1.08 1.02 -0.76 -4.93 120.64 111.28 1l2a n GLU 586 Ca -0.00 -0.15 -0.42 0.00 -0.02 0.00 0.00 57.16 56.57 1l2a n GLU 586 Cb 0.12 -1.53 -0.03 0.00 -0.02 0.00 0.00 31.44 29.98 1l2a n GLU 586 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1l2a s GLN 587 N -3.27 4.28 0.02 3.49 2.00 -1.07 -5.01 119.66 120.10 1l2a s GLN 587 Ca -0.08 1.13 -0.27 0.00 -2.00 0.00 0.00 55.36 54.14 1l2a s GLN 587 Cb 0.12 -3.60 -0.04 0.00 0.80 0.00 0.00 33.01 30.29 1l2a s GLN 587 CO 0.89 -0.43 0.83 -2.00 -0.50 0.00 0.00 175.29 174.08 1l2a s GLU 588 N 2.50 4.53 -0.34 1.67 2.12 -1.26 -1.93 118.70 125.99 1l2a s GLU 588 Ca 0.40 1.17 -0.15 0.00 0.36 0.00 0.00 54.97 56.75 1l2a s GLU 588 Cb -0.16 -3.41 -0.01 0.00 0.26 0.00 0.00 34.13 30.81 1l2a s GLU 588 CO 0.11 0.13 0.35 0.08 -0.54 0.00 0.00 175.26 175.38 1l2a s VAL 589 N 0.44 5.18 0.25 3.70 1.01 0.26 -4.90 120.40 126.35 1l2a s VAL 589 Ca 0.43 -0.01 -0.31 0.00 0.00 0.00 0.00 61.98 62.09 1l2a s VAL 589 Cb -0.20 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.23 1l2a s VAL 589 CO 0.24 -0.09 1.45 0.00 0.00 0.00 0.00 175.10 176.70 1l2a n TYR 590 N 5.35 2.29 -4.37 5.22 9.36 -1.26 -4.38 117.16 129.36 1l2a n TYR 590 Ca -0.10 0.39 -0.21 0.00 3.32 0.00 0.00 57.90 61.31 1l2a n TYR 590 Cb 0.49 -2.49 -0.16 0.00 -0.63 0.00 0.00 39.34 36.56 1l2a n TYR 590 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1l2a s VAL 591 N -0.02 0.77 0.40 2.97 1.01 -1.26 -5.01 120.40 119.26 1l2a s VAL 591 Ca 0.68 -0.33 -0.27 0.00 0.00 0.00 0.00 61.98 62.06 1l2a s VAL 591 Cb -0.62 -0.70 -0.10 0.00 0.00 0.00 0.00 36.38 34.95 1l2a s VAL 591 CO 0.49 0.25 1.47 -2.65 0.00 0.00 0.00 175.10 174.66 1l2a n PRO 592 N 3.46 2.56 -1.72 2.72 -0.02 -1.26 -4.56 135.00 136.18 1l2a n PRO 592 Ca -0.20 0.90 -0.43 0.00 -2.02 0.00 0.00 63.50 61.76 1l2a n PRO 592 Cb 0.53 -2.66 -0.02 0.00 -0.02 0.00 0.00 33.50 31.34 1l2a n PRO 592 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l2a n ALA 593 N 0.26 2.27 0.00 3.55 0.00 -1.26 -1.69 120.51 123.64 1l2a n ALA 593 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1l2a n ALA 593 Cb 0.39 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.41 1l2a n ALA 593 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l2a n GLY 594 N 2.54 3.00 3.77 0.00 0.00 -1.26 -5.04 105.19 108.19 1l2a n GLY 594 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1l2a n GLY 594 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1l2a s TRP 595 N -2.02 3.13 -0.08 1.61 -0.00 -0.68 -5.05 118.94 115.85 1l2a s TRP 595 Ca 0.00 1.49 -0.17 0.00 -0.00 0.00 0.00 56.10 57.42 1l2a s TRP 595 Cb 0.00 -3.57 0.04 0.00 -0.00 0.00 0.00 33.47 29.94 1l2a s TRP 595 CO 0.00 -1.57 0.41 -1.12 -0.00 0.00 0.00 176.95 174.67 1l2a s SER 596 N -0.66 -0.35 -0.08 5.86 0.01 -1.26 -4.52 113.70 112.70 1l2a s SER 596 Ca 0.50 0.48 -0.32 0.00 1.31 0.00 0.00 55.95 57.92 1l2a s SER 596 Cb -0.37 0.56 0.13 0.00 0.21 0.00 0.00 66.02 66.56 1l2a s SER 596 CO 0.49 -0.35 1.39 -0.83 0.41 0.00 0.00 173.24 174.35 1l2a s GLY 597 N -0.70 -0.43 -0.00 3.44 0.00 -0.88 -4.09 107.32 104.66 1l2a s GLY 597 Ca -0.08 0.75 0.03 0.00 0.00 0.00 0.00 44.72 45.42 1l2a s GLY 597 CO 0.04 1.42 -0.10 -0.51 0.00 0.00 0.00 173.10 173.94 1l2a s THR 598 N -2.09 0.80 0.63 0.90 -4.23 -0.60 0.71 115.64 111.75 1l2a s THR 598 Ca 0.18 -0.47 -0.14 0.00 -1.18 0.00 0.00 61.69 60.08 1l2a s THR 598 Cb 0.06 -0.68 -0.02 0.00 1.34 0.00 0.00 72.50 73.20 1l2a s THR 598 CO -0.05 0.20 1.05 -0.04 -0.54 0.00 0.00 174.62 175.23 1l2a s MET 599 N -0.31 3.24 0.00 3.99 -1.94 -0.19 -1.94 119.30 122.16 1l2a s MET 599 Ca 0.03 1.07 0.00 0.00 -1.71 0.00 0.00 55.69 55.08 1l2a s MET 599 Cb -0.04 -2.03 0.01 0.00 2.01 0.00 0.00 34.83 34.78 1l2a s MET 599 CO -0.00 -0.86 0.69 -2.30 -0.01 0.00 0.00 175.02 172.53 1l2a n PRO 600 N -2.44 0.00 -0.06 2.03 -0.02 -1.26 -0.25 135.00 132.99 1l2a n PRO 600 Ca 0.08 0.19 0.03 0.00 -2.02 0.00 0.00 63.50 61.78 1l2a n PRO 600 Cb 0.53 -1.82 0.06 0.00 -0.02 0.00 0.00 33.50 32.25 1l2a n PRO 600 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1l2a n ASN 601 N -1.19 2.30 0.00 2.55 6.94 -1.26 -4.99 115.26 119.60 1l2a n ASN 601 Ca -0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 54.58 52.31 1l2a n ASN 601 Cb 0.32 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.60 1l2a n ASN 601 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1l2a n GLY 602 N -0.52 2.97 3.53 4.83 0.00 0.65 -5.03 105.19 111.62 1l2a n GLY 602 Ca 0.06 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.53 1l2a n GLY 602 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1l2a n ASP 603 N 0.07 0.56 -4.60 1.61 8.00 -1.26 -4.51 116.55 116.43 1l2a n ASP 603 Ca 0.00 1.14 -0.40 0.00 0.71 0.00 0.00 54.79 56.24 1l2a n ASP 603 Cb 0.00 -1.04 -0.08 0.00 -0.02 0.00 0.00 41.12 39.97 1l2a n ASP 603 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1l2a s LYS 604 N -0.00 3.95 -0.60 -1.24 1.02 -1.26 -1.02 119.74 120.59 1l2a s LYS 604 Ca 0.84 0.11 -0.24 0.00 0.02 0.00 0.00 55.97 56.70 1l2a s LYS 604 Cb -1.09 -3.69 0.05 0.00 -0.52 0.00 0.00 37.83 32.58 1l2a s LYS 604 CO 0.53 -0.38 0.98 0.42 -0.92 0.00 0.00 175.35 175.98 1l2a s ILE 605 N 2.23 4.30 0.11 2.17 1.01 0.22 -4.84 121.20 126.41 1l2a s ILE 605 Ca 0.18 0.10 -0.15 0.00 0.00 0.00 0.00 60.65 60.78 1l2a s ILE 605 Cb -0.16 -4.62 0.03 0.00 0.01 0.00 0.00 42.46 37.72 1l2a s ILE 605 CO 0.10 -1.29 0.37 0.00 0.00 0.00 0.00 174.94 174.12 1l2a s GLN 606 N 4.16 1.01 0.20 2.79 -2.07 -1.26 -2.07 119.66 122.42 1l2a s GLN 606 Ca 0.28 -0.70 -0.33 0.00 -1.82 0.00 0.00 55.36 52.80 1l2a s GLN 606 Cb -0.13 0.44 -0.14 0.00 -1.09 0.00 0.00 33.01 32.09 1l2a s GLN 606 CO 0.16 -0.38 1.44 -2.30 -1.32 0.00 0.00 175.29 172.89 1l2a n PRO 607 N -0.10 1.95 0.00 9.60 -0.02 -1.26 -2.95 135.00 142.22 1l2a n PRO 607 Ca -0.16 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1l2a n PRO 607 Cb 0.63 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1l2a n PRO 607 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l2a n GLY 608 N 2.57 1.46 3.75 -1.23 0.00 -1.26 -5.04 105.19 105.44 1l2a n GLY 608 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1l2a n GLY 608 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1l2a s ILE 609 N -2.11 2.86 0.22 -0.61 -4.36 -1.15 -4.86 121.20 111.19 1l2a s ILE 609 Ca 0.00 0.44 0.07 0.00 -0.26 0.00 0.00 60.65 60.90 1l2a s ILE 609 Cb 0.00 -3.01 -0.04 0.00 1.25 0.00 0.00 42.46 40.66 1l2a s ILE 609 CO 0.00 -0.21 0.12 -0.54 0.24 0.00 0.00 174.94 174.55 1l2a s LYS 610 N -3.83 2.73 0.15 0.37 -0.14 -1.26 -0.57 119.74 117.19 1l2a s LYS 610 Ca 0.71 -1.08 -0.06 0.00 -1.36 0.00 0.00 55.97 54.18 1l2a s LYS 610 Cb -0.25 -2.48 0.24 0.00 -1.68 0.00 0.00 37.83 33.66 1l2a s LYS 610 CO 0.40 0.42 0.89 0.34 -0.76 0.00 0.00 175.35 176.64 1l2a n PHE 611 N -0.77 0.17 0.21 3.18 -0.00 -0.81 -0.95 117.46 118.49 1l2a n PHE 611 Ca -0.08 0.70 0.08 0.00 -0.00 0.00 0.00 57.45 58.15 1l2a n PHE 611 Cb 0.57 -0.81 0.43 0.00 -0.00 0.00 0.00 39.48 39.68 1l2a n PHE 611 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 1l2a h ILE 612 N 0.00 0.76 -0.46 -2.13 6.09 -1.74 -3.28 117.51 116.76 1l2a h ILE 612 Ca 0.26 -1.23 -0.05 0.00 -1.37 0.00 0.00 64.86 62.47 1l2a h ILE 612 Cb 0.40 1.77 -0.02 0.00 0.47 0.00 0.00 36.82 39.44 1l2a h ILE 612 CO -0.59 0.28 0.08 0.44 -3.07 0.00 0.00 178.15 175.30 1l2a h ASP 613 N 0.00 0.67 0.03 2.19 3.32 -1.35 -2.51 116.42 118.77 1l2a h ASP 613 Ca -0.00 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1l2a h ASP 613 Cb 0.75 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1l2a h ASP 613 CO 0.04 0.69 -0.14 2.30 -1.72 0.00 0.00 179.24 180.41 1l2a n ILE 614 N -4.28 0.00 -2.86 0.35 -5.35 -1.24 -4.23 119.36 101.76 1l2a n ILE 614 Ca 0.03 -0.30 -0.24 0.00 -0.27 0.00 0.00 62.75 61.97 1l2a n ILE 614 Cb 0.23 0.91 -0.02 0.00 -1.74 0.00 0.00 39.64 39.02 1l2a n ILE 614 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1l2a n ARG 615 N 0.31 2.66 0.20 6.28 1.74 -0.96 -4.92 116.66 121.97 1l2a n ARG 615 Ca 0.14 -4.35 0.08 0.00 -0.77 0.00 0.00 57.85 52.95 1l2a n ARG 615 Cb 0.45 -2.05 0.37 0.00 -1.02 0.00 0.00 32.46 30.21 1l2a n ARG 615 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1l2a h THR 616 N 2.51 0.70 0.00 0.55 2.02 -1.69 -2.53 112.91 114.47 1l2a h THR 616 Ca 0.14 -1.36 -0.00 0.00 0.77 0.00 0.00 66.41 65.96 1l2a h THR 616 Cb 0.75 1.88 -0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1l2a h THR 616 CO 0.74 0.30 -0.01 0.11 0.37 0.00 0.00 175.52 177.02 1l2a h LYS 617 N 0.00 0.00 -0.44 6.66 1.57 -1.91 -2.46 116.57 119.98 1l2a h LYS 617 Ca -0.00 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.90 1l2a h LYS 617 Cb 0.86 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 1l2a h LYS 617 CO 0.04 0.01 0.33 1.88 -0.57 0.00 0.00 179.45 181.14 1l2a h TYR 618 N 0.00 0.00 0.00 -1.35 0.05 -1.81 -1.20 116.97 112.67 1l2a h TYR 618 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 1l2a h TYR 618 Cb 0.04 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.78 1l2a h TYR 618 CO 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 178.16 177.10 1l2a h ARG 619 N 0.00 0.00 -0.08 4.88 3.08 -1.67 0.13 114.38 120.71 1l2a h ARG 619 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1l2a h ARG 619 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.92 1l2a h ARG 619 CO -0.00 0.01 0.00 1.04 -1.07 0.00 0.00 179.97 179.95 1l2a n GLN 620 N -3.39 1.80 -2.23 0.04 3.00 -0.45 -4.81 117.38 111.34 1l2a n GLN 620 Ca -0.03 -1.17 -0.41 0.00 -0.01 0.00 0.00 57.00 55.38 1l2a n GLN 620 Cb 0.10 -1.45 -0.03 0.00 0.00 0.00 0.00 30.24 28.86 1l2a n GLN 620 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1l2a s ASP 621 N -1.84 6.92 0.57 1.08 -1.08 0.03 -4.91 116.67 117.45 1l2a s ASP 621 Ca 0.35 2.50 0.32 0.00 -0.52 0.00 0.00 52.55 55.20 1l2a s ASP 621 Cb 0.20 -2.63 1.41 0.00 -1.46 0.00 0.00 42.92 40.44 1l2a s ASP 621 CO 0.31 -0.45 1.74 -0.65 0.52 0.00 0.00 175.17 176.63 1l2a h PRO 622 N 4.23 0.00 -0.41 4.34 0.11 -1.92 -1.07 132.00 137.29 1l2a h PRO 622 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1l2a h PRO 622 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1l2a h PRO 622 CO 0.70 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.15 1l2a n TYR 623 N -3.80 0.54 0.28 0.65 4.02 -1.26 -4.58 117.16 113.01 1l2a n TYR 623 Ca 0.19 -0.44 -0.16 0.00 -0.01 0.00 0.00 57.90 57.48 1l2a n TYR 623 Cb 1.10 -0.02 -0.08 0.00 -0.02 0.00 0.00 39.34 40.32 1l2a n TYR 623 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 1l2a h TYR 624 N 2.70 -0.65 -0.30 -0.72 3.20 -1.42 -2.36 116.97 117.42 1l2a h TYR 624 Ca 0.00 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1l2a h TYR 624 Cb 0.78 0.21 -0.07 0.00 1.54 0.00 0.00 36.73 39.20 1l2a h TYR 624 CO 0.27 -0.35 -0.48 -0.44 -1.64 0.00 0.00 178.16 175.52 1l2a h ASP 625 N -0.82 -1.60 -0.82 -2.11 3.32 -1.81 0.13 116.42 112.72 1l2a h ASP 625 Ca -0.07 0.20 0.20 0.00 0.02 0.00 0.00 57.03 57.38 1l2a h ASP 625 Cb 0.59 0.65 -0.13 0.00 0.22 0.00 0.00 39.33 40.65 1l2a h ASP 625 CO 0.12 -0.37 0.19 0.40 -1.72 0.00 0.00 179.24 177.86 1l2a h ILE 626 N -0.38 0.39 0.07 0.35 2.04 -1.84 0.43 117.51 118.57 1l2a h ILE 626 Ca 0.05 -0.08 -0.24 0.00 1.00 0.00 0.00 64.86 65.59 1l2a h ILE 626 Cb 0.53 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1l2a h ILE 626 CO -0.49 0.04 -1.12 -0.37 0.00 0.00 0.00 178.15 176.22 1l2a h VAL 627 N 0.22 1.56 -0.30 1.67 -1.51 -0.84 -2.81 116.25 114.24 1l2a h VAL 627 Ca 0.49 -3.10 -0.17 0.00 -1.23 0.00 0.00 66.70 62.69 1l2a h VAL 627 Cb 0.91 2.84 -0.00 0.00 -2.13 0.00 0.00 31.29 32.92 1l2a h VAL 627 CO -0.61 0.90 -0.46 0.22 -1.23 0.00 0.00 177.57 176.39 1l2a h TYR 628 N 0.06 1.04 -0.27 5.19 3.20 0.54 -1.90 116.97 124.84 1l2a h TYR 628 Ca -0.09 -0.35 -0.09 0.00 3.14 0.00 0.00 58.73 61.34 1l2a h TYR 628 Cb 1.84 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.90 1l2a h TYR 628 CO 0.04 1.16 -0.22 1.96 -1.64 0.00 0.00 178.16 179.47 1l2a h GLN 629 N 0.61 0.49 0.00 1.82 1.08 -0.28 -1.59 115.11 117.25 1l2a h GLN 629 Ca 0.03 -0.17 -0.07 0.00 -1.45 0.00 0.00 58.65 56.98 1l2a h GLN 629 Cb 1.06 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 1l2a h GLN 629 CO 0.11 0.68 -0.33 0.00 -0.95 0.00 0.00 178.83 178.33 1l2a h ALA 630 N 1.33 1.32 0.50 3.87 0.00 -1.46 -2.35 119.26 122.48 1l2a h ALA 630 Ca 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 1l2a h ALA 630 Cb 0.62 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1l2a h ALA 630 CO 0.04 0.42 -0.24 -0.92 0.00 0.00 0.00 179.25 178.55 1l2a h TYR 631 N 0.00 -0.63 -0.35 0.00 3.20 -0.48 -0.84 116.97 117.88 1l2a h TYR 631 Ca -0.00 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.92 1l2a h TYR 631 Cb 0.64 0.21 -0.09 0.00 1.54 0.00 0.00 36.73 39.03 1l2a h TYR 631 CO 0.00 -0.30 -0.37 -0.07 -1.64 0.00 0.00 178.16 175.78 1l2a h LEU 632 N -0.92 -1.20 0.00 2.82 3.38 -1.22 0.49 115.31 118.66 1l2a h LEU 632 Ca -0.07 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1l2a h LEU 632 Cb 0.60 0.54 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1l2a h LEU 632 CO 0.11 -0.35 0.00 0.54 0.09 0.00 0.00 178.44 178.83 1l2a n ARG 633 N -5.42 0.57 -3.22 1.13 1.74 -0.89 -4.89 116.66 105.67 1l2a n ARG 633 Ca -0.00 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.84 1l2a n ARG 633 Cb 0.34 -1.29 0.05 0.00 -1.02 0.00 0.00 32.46 30.55 1l2a n ARG 633 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1l2a n GLY 634 N 0.10 -0.53 3.31 -0.13 0.00 0.16 -5.02 105.19 103.08 1l2a n GLY 634 Ca 0.08 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.07 1l2a n GLY 634 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1l2a s GLU 635 N -5.92 1.20 0.11 1.61 2.02 -0.34 -5.05 118.70 112.33 1l2a s GLU 635 Ca 0.40 -1.38 -0.31 0.00 0.02 0.00 0.00 54.97 53.70 1l2a s GLU 635 Cb -0.18 -1.17 -0.07 0.00 0.10 0.00 0.00 34.13 32.81 1l2a s GLU 635 CO 0.50 0.23 1.33 0.00 0.02 0.00 0.00 175.26 177.33 1l2a s ALA 636 N -2.21 3.53 0.69 5.21 0.00 -1.26 -4.27 121.76 123.45 1l2a s ALA 636 Ca 0.15 1.04 -0.13 0.00 0.00 0.00 0.00 51.96 53.02 1l2a s ALA 636 Cb -0.05 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.58 1l2a s ALA 636 CO 0.05 -0.55 1.08 -1.25 0.00 0.00 0.00 175.76 175.10 1l2a s PRO 637 N 0.98 2.73 -0.19 0.00 0.04 -1.26 -4.80 135.00 132.50 1l2a s PRO 637 Ca 0.62 1.20 -0.04 0.00 0.04 0.00 0.00 61.00 62.82 1l2a s PRO 637 Cb -0.35 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1l2a s PRO 637 CO 0.31 -1.28 -0.04 0.08 0.04 0.00 0.00 177.00 176.10 1l2a s VAL 638 N -2.69 3.61 0.10 -0.36 1.01 -1.26 -1.42 120.40 119.39 1l2a s VAL 638 Ca 0.63 -0.44 0.10 0.00 0.00 0.00 0.00 61.98 62.27 1l2a s VAL 638 Cb -0.17 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1l2a s VAL 638 CO 0.48 0.45 -0.26 -0.76 0.00 0.00 0.00 175.10 175.02 1l2a s LEU 639 N 0.94 2.31 -0.23 3.92 1.02 0.83 -4.92 118.68 122.55 1l2a s LEU 639 Ca -0.00 -0.66 -0.05 0.00 0.02 0.00 0.00 54.13 53.43 1l2a s LEU 639 Cb -0.15 -1.28 -0.02 0.00 0.02 0.00 0.00 46.19 44.77 1l2a s LEU 639 CO 0.01 0.21 0.01 0.20 0.02 0.00 0.00 176.35 176.80 1l2a s ASN 640 N -1.75 4.66 -0.05 2.29 0.01 -1.26 -0.28 114.94 118.57 1l2a s ASN 640 Ca 0.14 -0.33 0.05 0.00 -0.71 0.00 0.00 52.86 52.00 1l2a s ASN 640 Cb -0.10 -1.82 -0.01 0.00 0.41 0.00 0.00 41.25 39.74 1l2a s ASN 640 CO 0.05 -0.03 -0.20 -0.31 -1.51 0.00 0.00 177.10 175.09 1l2a s TYR 641 N 1.53 2.00 -0.87 2.20 4.12 -1.20 -4.89 117.35 120.23 1l2a s TYR 641 Ca 0.06 -0.58 -0.03 0.00 0.02 0.00 0.00 57.07 56.54 1l2a s TYR 641 Cb -0.15 -1.33 0.22 0.00 -1.52 0.00 0.00 41.96 39.18 1l2a s TYR 641 CO -0.00 -0.18 0.76 -1.01 0.02 0.00 0.00 175.55 175.13 1l2a s HIS 642 N -0.05 3.86 0.26 2.71 3.76 -1.26 -1.90 115.29 122.66 1l2a s HIS 642 Ca -0.03 -2.94 -0.29 0.00 -0.15 0.00 0.00 55.06 51.64 1l2a s HIS 642 Cb -0.12 -3.29 -0.09 0.00 1.11 0.00 0.00 32.58 30.18 1l2a s HIS 642 CO 0.03 -0.77 1.22 1.03 -0.85 0.00 0.00 174.74 175.40 1l2a s ARG 643 N -1.14 4.48 0.15 1.40 0.52 -1.26 -2.19 118.95 120.90 1l2a s ARG 643 Ca 0.26 1.99 -0.25 0.00 -0.52 0.00 0.00 55.73 57.20 1l2a s ARG 643 Cb -0.09 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.21 1l2a s ARG 643 CO -0.11 -0.06 1.60 0.35 0.02 0.00 0.00 175.30 177.10 1l2a h PHE 644 N 4.31 -0.97 0.00 -0.53 3.57 -1.38 -2.81 116.94 119.14 1l2a h PHE 644 Ca -0.46 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.04 1l2a h PHE 644 Cb 1.22 0.46 -0.01 0.00 2.79 0.00 0.00 35.95 40.41 1l2a h PHE 644 CO 0.59 -0.41 -0.22 0.11 -2.23 0.00 0.00 178.31 176.15 1l2a h TRP 645 N -0.35 0.00 0.04 0.41 5.08 -1.91 -2.23 115.95 117.00 1l2a h TRP 645 Ca 0.12 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.09 1l2a h TRP 645 Cb 0.56 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 1l2a h TRP 645 CO -0.48 0.22 -0.02 0.45 -1.28 0.00 0.00 178.44 177.33 1l2a h HIS 646 N 0.00 -0.06 -0.86 0.12 3.86 -1.88 -0.49 115.15 115.84 1l2a h HIS 646 Ca -0.00 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1l2a h HIS 646 Cb 0.57 0.02 -0.05 0.00 1.06 0.00 0.00 27.41 29.01 1l2a h HIS 646 CO 0.00 0.02 0.55 0.93 0.86 0.00 0.00 177.93 180.30 1l2a h GLU 647 N -0.12 1.05 -0.11 2.45 4.39 -1.19 -2.41 114.58 118.63 1l2a h GLU 647 Ca -0.01 -0.06 -0.11 0.00 0.34 0.00 0.00 59.36 59.52 1l2a h GLU 647 Cb 0.10 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1l2a h GLU 647 CO 0.01 0.69 -0.35 0.28 -1.16 0.00 0.00 179.01 178.48 1l2a h VAL 648 N 1.08 1.38 -0.86 3.13 2.07 -1.29 -0.57 116.25 121.20 1l2a h VAL 648 Ca 0.34 -1.67 0.09 0.00 0.82 0.00 0.00 66.70 66.27 1l2a h VAL 648 Cb -0.00 2.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 1l2a h VAL 648 CO -0.11 0.49 0.56 0.44 0.02 0.00 0.00 177.57 178.97 1l2a h ASP 649 N 0.02 0.78 -0.09 0.57 3.32 -1.03 0.32 116.42 120.31 1l2a h ASP 649 Ca -0.01 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1l2a h ASP 649 Cb 0.98 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.38 1l2a h ASP 649 CO 0.08 0.48 -0.10 0.25 -1.72 0.00 0.00 179.24 178.23 1l2a h LEU 650 N 0.87 0.25 -0.53 1.55 5.85 -1.33 -2.70 115.31 119.28 1l2a h LEU 650 Ca 0.39 -0.49 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1l2a h LEU 650 Cb 0.35 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 1l2a h LEU 650 CO -0.16 0.68 0.28 0.00 -0.34 0.00 0.00 178.44 178.91 1l2a h ALA 651 N 0.57 0.68 -0.56 1.25 0.00 -0.08 -2.09 119.26 119.03 1l2a h ALA 651 Ca 0.01 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1l2a h ALA 651 Cb 0.61 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1l2a h ALA 651 CO 0.02 -0.05 0.16 0.28 0.00 0.00 0.00 179.25 179.66 1l2a h VAL 652 N 0.55 1.24 -0.50 0.00 2.07 -0.47 -0.81 116.25 118.34 1l2a h VAL 652 Ca 0.23 -0.84 0.09 0.00 0.82 0.00 0.00 66.70 67.00 1l2a h VAL 652 Cb 0.11 0.72 -0.08 0.00 -1.52 0.00 0.00 31.29 30.52 1l2a h VAL 652 CO -0.14 0.31 0.04 0.00 0.02 0.00 0.00 177.57 177.80 1l2a h ALA 653 N 1.03 0.51 -0.59 1.67 0.00 -1.19 0.68 119.26 121.37 1l2a h ALA 653 Ca 0.18 0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.30 1l2a h ALA 653 Cb 0.31 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1l2a h ALA 653 CO -0.00 -0.36 0.25 0.52 0.00 0.00 0.00 179.25 179.66 1l2a h MET 654 N 0.17 0.45 -0.39 0.00 2.86 -0.95 -1.64 114.93 115.42 1l2a h MET 654 Ca 0.25 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.77 1l2a h MET 654 Cb 0.36 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 1l2a h MET 654 CO -0.38 0.30 -0.14 0.78 1.06 0.00 0.00 176.91 178.53 1l2a h GLY 655 N 0.46 0.77 0.96 8.32 0.00 0.55 0.52 103.07 114.64 1l2a h GLY 655 Ca 0.28 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1l2a h GLY 655 CO -0.25 0.54 0.10 -2.08 0.00 0.00 0.00 176.54 174.85 1l2a h VAL 656 N 0.64 1.09 -0.67 4.60 2.07 0.63 0.94 116.25 125.54 1l2a h VAL 656 Ca 0.11 -0.22 0.07 0.00 0.82 0.00 0.00 66.70 67.48 1l2a h VAL 656 Cb 0.60 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1l2a h VAL 656 CO 0.04 0.08 0.35 -0.07 0.02 0.00 0.00 177.57 177.99 1l2a h LEU 657 N 0.20 0.49 -1.70 2.57 4.07 -0.98 -1.10 115.31 118.86 1l2a h LEU 657 Ca 0.06 0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.06 1l2a h LEU 657 Cb 0.04 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.72 1l2a h LEU 657 CO -0.01 0.31 0.13 0.00 -1.08 0.00 0.00 178.44 177.79 1l2a h ALA 658 N 1.38 1.77 0.01 1.53 0.00 -0.50 -0.62 119.26 122.83 1l2a h ALA 658 Ca 0.31 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1l2a h ALA 658 Cb 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1l2a h ALA 658 CO -0.22 0.20 -0.11 1.15 0.00 0.00 0.00 179.25 180.27 1l2a h THR 659 N 0.34 1.75 0.00 0.00 2.02 0.09 -3.33 112.91 113.79 1l2a h THR 659 Ca 0.09 -2.36 0.00 0.00 0.77 0.00 0.00 66.41 64.90 1l2a h THR 659 Cb 0.01 3.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.78 1l2a h THR 659 CO -0.02 0.61 -0.81 -1.22 0.37 0.00 0.00 175.52 174.46 1l2a n TYR 660 N -4.56 0.02 -3.11 3.16 4.02 -0.50 -4.54 117.16 111.64 1l2a n TYR 660 Ca -0.11 0.01 -0.18 0.00 -0.01 0.00 0.00 57.90 57.61 1l2a n TYR 660 Cb 0.52 -0.14 -0.02 0.00 -0.02 0.00 0.00 39.34 39.68 1l2a n TYR 660 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1l2a n PHE 661 N -1.54 -0.52 0.35 -0.72 3.72 -0.24 -4.98 117.46 113.53 1l2a n PHE 661 Ca 0.04 -3.44 0.12 0.00 -0.05 0.00 0.00 57.45 54.12 1l2a n PHE 661 Cb 0.34 -0.04 0.51 0.00 -0.94 0.00 0.00 39.48 39.34 1l2a n PHE 661 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1l2a n PRO 662 N 0.64 0.18 0.06 -1.08 -0.04 -1.24 -1.26 135.00 132.25 1l2a n PRO 662 Ca 0.21 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.26 1l2a n PRO 662 Cb 0.63 -1.88 0.34 0.00 -0.04 0.00 0.00 33.50 32.54 1l2a n PRO 662 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1l2a n ASP 663 N -2.23 0.60 -4.77 3.54 8.00 -1.26 -4.90 116.55 115.53 1l2a n ASP 663 Ca 0.01 0.29 -0.34 0.00 0.71 0.00 0.00 54.79 55.47 1l2a n ASP 663 Cb 0.19 -0.27 0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1l2a n ASP 663 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1l2a s MET 664 N -3.10 2.88 -0.28 -1.24 -1.94 -0.39 -5.03 119.30 110.20 1l2a s MET 664 Ca 0.10 1.49 -0.09 0.00 -1.71 0.00 0.00 55.69 55.48 1l2a s MET 664 Cb 0.14 -1.95 0.13 0.00 2.01 0.00 0.00 34.83 35.16 1l2a s MET 664 CO 0.64 -1.21 0.61 -0.08 -0.01 0.00 0.00 175.02 174.97 1l2a s THR 665 N -2.15 -0.94 0.28 2.05 -1.32 -1.26 -3.96 115.64 108.33 1l2a s THR 665 Ca 0.69 0.02 -0.26 0.00 -1.21 0.00 0.00 61.69 60.93 1l2a s THR 665 Cb -0.22 -0.95 -0.15 0.00 -1.51 0.00 0.00 72.50 69.66 1l2a s THR 665 CO 0.38 0.01 0.57 0.00 -2.21 0.00 0.00 174.62 173.37 1l2a n TYR 666 N 5.44 -0.32 -3.77 9.09 9.36 0.44 -4.66 117.16 132.74 1l2a n TYR 666 Ca -0.10 0.81 -0.13 0.00 3.32 0.00 0.00 57.90 61.79 1l2a n TYR 666 Cb 0.49 -2.00 -0.09 0.00 -0.63 0.00 0.00 39.34 37.11 1l2a n TYR 666 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1l2a s LYS 667 N -1.22 0.62 0.23 2.98 0.00 -1.26 0.16 119.74 121.24 1l2a s LYS 667 Ca 0.62 -0.12 -0.30 0.00 0.00 0.00 0.00 55.97 56.17 1l2a s LYS 667 Cb -0.79 0.28 -0.10 0.00 0.00 0.00 0.00 37.83 37.22 1l2a s LYS 667 CO 0.58 -0.16 1.41 0.14 0.00 0.00 0.00 175.35 177.33 1l2a s VAL 668 N -1.12 2.81 -2.00 1.79 -7.23 -1.26 -4.93 120.40 108.45 1l2a s VAL 668 Ca -0.12 0.67 0.24 0.00 -1.81 0.00 0.00 61.98 60.96 1l2a s VAL 668 Cb -0.05 -3.43 0.69 0.00 0.56 0.00 0.00 36.38 34.15 1l2a s VAL 668 CO 0.04 0.10 1.81 -0.81 -0.31 0.00 0.00 175.10 175.92