#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 2.33 -0.22 1.61 0.02 -1.26 -4.56 135.00 132.92 1l2a s PRO 29 Ca 0.00 1.35 -0.23 0.00 0.02 0.00 0.00 61.00 62.14 1l2a s PRO 29 Cb 0.00 -1.89 0.06 0.00 0.02 0.00 0.00 34.50 32.69 1l2a s PRO 29 CO 0.00 -1.61 0.64 0.99 -0.33 0.00 0.00 177.00 176.69 1l2a s THR 30 N -2.57 0.00 0.15 0.99 2.01 -0.88 -4.98 115.64 110.36 1l2a s THR 30 Ca 0.65 -0.01 -0.33 0.00 0.31 0.00 0.00 61.69 62.31 1l2a s THR 30 Cb -0.20 -0.90 -0.13 0.00 0.01 0.00 0.00 72.50 71.28 1l2a s THR 30 CO 0.50 -0.01 1.65 0.29 -0.69 0.00 0.00 174.62 176.36 1l2a n LYS 31 N 2.55 2.31 -2.19 4.92 4.76 -1.26 -3.13 118.16 126.13 1l2a n LYS 31 Ca -0.14 0.84 -0.40 0.00 -2.87 0.00 0.00 58.31 55.73 1l2a n LYS 31 Cb 0.56 -2.63 -0.02 0.00 -1.84 0.00 0.00 35.03 31.09 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 1.35 3.44 -0.05 7.82 0.00 0.41 -4.94 121.76 129.80 1l2a s ALA 32 Ca 0.79 1.17 0.22 0.00 0.00 0.00 0.00 51.96 54.15 1l2a s ALA 32 Cb -0.63 -3.45 0.61 0.00 0.00 0.00 0.00 23.12 19.65 1l2a s ALA 32 CO 0.38 -0.56 1.69 -1.35 0.00 0.00 0.00 175.76 175.92 1l2a h PRO 33 N 3.34 0.00 -6.10 0.00 0.11 -1.91 -3.48 132.00 123.97 1l2a h PRO 33 Ca -0.49 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 64.94 1l2a h PRO 33 Cb 1.23 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.43 1l2a h PRO 33 CO 0.65 0.25 -0.22 2.41 -0.21 0.00 0.00 178.00 180.88 1l2a n THR 34 N -3.27 1.42 -3.62 -1.15 -1.04 -1.26 -4.95 114.28 100.40 1l2a n THR 34 Ca 0.01 -0.35 -0.32 0.00 -2.04 0.00 0.00 64.05 61.35 1l2a n THR 34 Cb 0.53 -0.23 -0.05 0.00 -1.82 0.00 0.00 70.33 68.76 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 -0.76 3.67 -0.37 -2.82 0.00 -1.26 -4.83 119.74 113.37 1l2a s LYS 35 Ca 0.70 0.02 -0.45 0.00 0.00 0.00 0.00 55.97 56.24 1l2a s LYS 35 Cb -0.97 -2.85 -0.20 0.00 0.00 0.00 0.00 37.83 33.82 1l2a s LYS 35 CO 0.56 0.47 1.50 -0.25 0.00 0.00 0.00 175.35 177.63 1l2a n ASP 36 N 0.24 1.09 0.00 0.03 9.92 -1.26 -2.51 116.55 124.05 1l2a n ASP 36 Ca -0.03 1.17 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 1l2a n ASP 36 Cb 0.52 -0.92 0.00 0.00 -0.64 0.00 0.00 41.12 40.08 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 3.50 1.66 3.65 0.44 0.00 -0.78 -5.04 105.19 108.63 1l2a n GLY 37 Ca 0.28 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.81 1l2a n GLY 37 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1l2a n THR 38 N -1.15 0.10 -1.15 2.61 -1.04 -1.04 -4.76 114.28 107.84 1l2a n THR 38 Ca 0.00 -0.02 -0.32 0.00 -2.04 0.00 0.00 64.05 61.67 1l2a n THR 38 Cb 0.00 -1.32 0.11 0.00 -1.82 0.00 0.00 70.33 67.30 1l2a n THR 38 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1l2a s SER 39 N 1.39 3.93 0.41 8.00 1.04 -1.26 -1.69 113.70 125.52 1l2a s SER 39 Ca 0.84 2.09 0.20 0.00 0.48 0.00 0.00 55.95 59.56 1l2a s SER 39 Cb -0.80 -2.56 0.89 0.00 0.10 0.00 0.00 66.02 63.65 1l2a s SER 39 CO 0.45 -2.43 1.84 1.88 0.98 0.00 0.00 173.24 175.96 1l2a h TYR 40 N -1.08 0.00 0.44 5.02 0.05 -1.89 -2.75 116.97 116.75 1l2a h TYR 40 Ca -0.45 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.32 1l2a h TYR 40 Cb 1.26 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.99 1l2a h TYR 40 CO 0.52 0.31 -0.32 -0.22 -1.05 0.00 0.00 178.16 177.40 1l2a h LYS 41 N 0.00 -0.71 -0.84 4.88 3.64 -1.91 -0.33 116.57 121.30 1l2a h LYS 41 Ca -0.00 0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1l2a h LYS 41 Cb 0.70 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.64 1l2a h LYS 41 CO 0.04 -0.48 0.56 -0.44 -2.27 0.00 0.00 179.45 176.86 1l2a h ASP 42 N -0.74 0.96 -0.44 4.20 3.32 -1.93 -1.71 116.42 120.08 1l2a h ASP 42 Ca -0.04 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1l2a h ASP 42 Cb 0.63 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1l2a h ASP 42 CO 0.01 0.70 0.29 -0.07 -1.72 0.00 0.00 179.24 178.45 1l2a h LEU 43 N 1.14 0.50 -0.23 1.55 3.38 -1.39 0.29 115.31 120.54 1l2a h LEU 43 Ca 0.31 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 1l2a h LEU 43 Cb -0.13 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1l2a h LEU 43 CO -0.07 0.36 -0.01 0.15 0.09 0.00 0.00 178.44 178.96 1l2a h PHE 44 N 0.58 0.45 -0.93 1.13 3.57 -0.32 -2.19 116.94 119.23 1l2a h PHE 44 Ca 0.16 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1l2a h PHE 44 Cb -0.05 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 1l2a h PHE 44 CO -0.00 0.61 0.62 -0.07 -2.23 0.00 0.00 178.31 177.23 1l2a h LEU 45 N 0.17 1.07 0.41 0.59 3.38 -0.52 0.65 115.31 121.06 1l2a h LEU 45 Ca 0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1l2a h LEU 45 Cb 0.43 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1l2a h LEU 45 CO 0.01 0.77 -0.19 -0.08 0.09 0.00 0.00 178.44 179.04 1l2a h GLU 46 N 1.26 -0.52 -0.93 1.13 4.81 -0.47 0.10 114.58 119.96 1l2a h GLU 46 Ca 0.34 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1l2a h GLU 46 Cb -0.14 0.12 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1l2a h GLU 46 CO -0.08 -0.32 0.55 1.25 -0.73 0.00 0.00 179.01 179.69 1l2a h LEU 47 N -0.60 1.12 0.14 1.64 6.46 -0.78 -1.49 115.31 121.80 1l2a h LEU 47 Ca -0.06 -0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.63 1l2a h LEU 47 Cb 0.45 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.10 1l2a h LEU 47 CO 0.09 0.87 -0.07 0.22 -0.62 0.00 0.00 178.44 178.93 1l2a h TYR 48 N 1.28 -0.17 -0.78 1.25 3.20 0.38 -1.47 116.97 120.66 1l2a h TYR 48 Ca 0.33 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.35 1l2a h TYR 48 Cb -0.04 0.06 -0.15 0.00 1.54 0.00 0.00 36.73 38.14 1l2a h TYR 48 CO 0.01 0.06 -0.24 0.78 -1.64 0.00 0.00 178.16 177.13 1l2a h GLY 49 N -0.39 0.43 1.78 1.82 0.00 -0.43 -0.05 103.07 106.23 1l2a h GLY 49 Ca -0.02 0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.55 1l2a h GLY 49 CO 0.03 -0.28 -0.23 0.50 0.00 0.00 0.00 176.54 176.56 1l2a h LYS 50 N -0.03 0.26 -0.18 4.80 1.57 -1.08 -1.63 116.57 120.28 1l2a h LYS 50 Ca 0.36 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.89 1l2a h LYS 50 Cb 0.58 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1l2a h LYS 50 CO -0.82 0.48 -0.56 0.82 -0.57 0.00 0.00 179.45 178.81 1l2a h ILE 51 N 0.24 1.32 0.00 1.86 2.04 0.05 -3.21 117.51 119.80 1l2a h ILE 51 Ca 0.04 -1.81 0.00 0.00 1.00 0.00 0.00 64.86 64.09 1l2a h ILE 51 Cb 0.54 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 1l2a h ILE 51 CO 0.04 0.56 -0.43 0.11 0.00 0.00 0.00 178.15 178.44 1l2a h LYS 52 N 0.43 0.00 -6.41 2.37 1.79 -1.10 -3.42 116.57 110.24 1l2a h LYS 52 Ca 0.01 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 1l2a h LYS 52 Cb 1.11 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.78 1l2a h LYS 52 CO 0.11 0.00 1.15 0.34 -1.08 0.00 0.00 179.45 179.96 1l2a s ASP 53 N -5.10 6.49 0.37 0.86 -1.08 -0.63 -4.91 116.67 112.67 1l2a s ASP 53 Ca 0.06 2.63 0.11 0.00 -0.52 0.00 0.00 52.55 54.83 1l2a s ASP 53 Cb 0.10 -2.55 0.71 0.00 -1.46 0.00 0.00 42.92 39.72 1l2a s ASP 53 CO 0.70 -1.00 1.83 -0.65 0.52 0.00 0.00 175.17 176.57 1l2a h PRO 54 N 9.52 0.06 -0.86 4.34 0.11 -1.90 -2.34 132.00 140.93 1l2a h PRO 54 Ca -0.46 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.72 1l2a h PRO 54 Cb 1.22 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.25 1l2a h PRO 54 CO 0.94 0.40 0.50 0.87 -0.21 0.00 0.00 178.00 180.50 1l2a h LYS 55 N 0.06 0.81 -0.41 1.05 1.57 -1.97 -2.92 116.57 114.77 1l2a h LYS 55 Ca 0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1l2a h LYS 55 Cb 0.62 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 1l2a h LYS 55 CO 0.05 0.54 0.27 -0.91 -0.57 0.00 0.00 179.45 178.82 1l2a h ASN 56 N 0.84 0.47 0.00 0.86 2.35 -1.73 -3.47 115.58 114.90 1l2a h ASN 56 Ca 0.41 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 1l2a h ASN 56 Cb 0.38 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1l2a h ASN 56 CO -0.25 0.35 0.00 0.61 -1.65 0.00 0.00 177.43 176.49 1l2a n GLY 57 N -1.46 0.58 0.28 2.83 0.00 -1.10 -4.98 105.19 101.33 1l2a n GLY 57 Ca 0.03 -0.80 -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 0.89 -2.26 1.61 0.05 -1.80 -3.44 116.97 112.02 1l2a h TYR 58 Ca 0.00 -0.17 -0.51 0.00 0.05 0.00 0.00 58.73 58.10 1l2a h TYR 58 Cb 0.14 -0.23 -0.05 0.00 1.01 0.00 0.00 36.73 37.60 1l2a h TYR 58 CO 0.00 0.87 -0.54 -0.06 -1.05 0.00 0.00 178.16 177.39 1l2a s PHE 59 N -4.80 3.10 0.38 4.88 0.40 -1.26 -2.31 117.98 118.37 1l2a s PHE 59 Ca -0.10 -0.10 -0.26 0.00 -0.60 0.00 0.00 56.93 55.87 1l2a s PHE 59 Cb 0.14 -1.41 -0.09 0.00 0.51 0.00 0.00 43.02 42.17 1l2a s PHE 59 CO 0.83 0.52 1.19 -1.54 0.70 0.00 0.00 175.22 176.92 1l2a s SER 60 N -3.75 6.58 0.16 1.36 1.04 0.21 -4.81 113.70 114.49 1l2a s SER 60 Ca 0.33 2.41 -0.10 0.00 0.48 0.00 0.00 55.95 59.06 1l2a s SER 60 Cb -0.08 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.43 1l2a s SER 60 CO 0.25 -0.64 1.56 1.55 0.98 0.00 0.00 173.24 176.93 1l2a h PRO 61 N 2.80 1.01 0.00 4.02 0.13 -1.96 -2.50 132.00 135.50 1l2a h PRO 61 Ca -0.49 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.23 1l2a h PRO 61 Cb 1.23 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1l2a h PRO 61 CO 0.63 1.10 0.00 -0.25 -0.23 0.00 0.00 178.00 179.25 1l2a n ASP 62 N -4.13 0.00 0.01 1.44 9.92 -1.26 -4.43 116.55 118.10 1l2a n ASP 62 Ca 0.00 0.82 0.11 0.00 -0.53 0.00 0.00 54.79 55.20 1l2a n ASP 62 Cb 0.44 -0.40 0.14 0.00 -0.64 0.00 0.00 41.12 40.66 1l2a n ASP 62 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1l2a n GLU 63 N -1.71 0.06 -2.23 -1.24 4.71 -1.26 -4.96 120.64 114.01 1l2a n GLU 63 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.16 57.14 1l2a n GLU 63 Cb 0.00 -1.53 0.00 0.00 -1.01 0.00 0.00 31.44 28.91 1l2a n GLU 63 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1l2a n GLY 64 N 1.47 0.49 3.76 0.62 0.00 -0.94 -4.98 105.19 105.61 1l2a n GLY 64 Ca 0.05 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.41 5.35 -0.02 -0.61 1.01 -1.25 -4.68 121.20 118.59 1l2a s ILE 65 Ca 0.02 0.40 -0.30 0.00 0.00 0.00 0.00 60.65 60.77 1l2a s ILE 65 Cb -0.01 -3.55 -0.06 0.00 0.01 0.00 0.00 42.46 38.85 1l2a s ILE 65 CO 0.02 0.46 1.68 -2.84 0.00 0.00 0.00 174.94 174.26 1l2a s PRO 66 N 0.05 4.18 0.65 2.79 0.02 -1.26 0.63 135.00 142.07 1l2a s PRO 66 Ca 0.14 2.26 -0.10 0.00 0.02 0.00 0.00 61.00 63.32 1l2a s PRO 66 Cb -0.12 -3.92 -0.00 0.00 0.02 0.00 0.00 34.50 30.47 1l2a s PRO 66 CO 0.03 -0.83 1.03 0.71 -0.33 0.00 0.00 177.00 177.61 1l2a s TYR 67 N 3.77 3.41 0.17 6.54 2.02 -0.98 -4.51 117.35 127.78 1l2a s TYR 67 Ca 0.75 1.04 -0.14 0.00 -0.37 0.00 0.00 57.07 58.35 1l2a s TYR 67 Cb -0.36 -2.89 0.11 0.00 -0.40 0.00 0.00 41.96 38.42 1l2a s TYR 67 CO 0.31 -0.95 1.79 1.25 -1.57 0.00 0.00 175.55 176.39 1l2a h HIS 68 N -0.45 0.48 -2.62 2.71 -0.00 -0.70 -3.39 115.15 111.18 1l2a h HIS 68 Ca -0.45 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 59.89 1l2a h HIS 68 Cb 1.23 -0.14 -0.16 0.00 -0.00 0.00 0.00 27.41 28.34 1l2a h HIS 68 CO 0.54 0.25 0.10 -1.54 -0.00 0.00 0.00 177.93 177.28 1l2a s SER 69 N -5.51 -0.51 0.10 3.26 1.04 -0.78 -0.08 113.70 111.22 1l2a s SER 69 Ca -0.13 0.28 -0.33 0.00 0.48 0.00 0.00 55.95 56.25 1l2a s SER 69 Cb 0.13 0.52 -0.13 0.00 0.10 0.00 0.00 66.02 66.64 1l2a s SER 69 CO 0.73 -0.73 1.58 0.40 0.98 0.00 0.00 173.24 176.20 1l2a h ILE 70 N 2.72 0.10 -4.16 -1.02 2.04 -1.69 -3.39 117.51 112.11 1l2a h ILE 70 Ca -0.30 0.00 -0.55 0.00 1.00 0.00 0.00 64.86 65.01 1l2a h ILE 70 Cb 1.21 0.10 0.17 0.00 -0.74 0.00 0.00 36.82 37.56 1l2a h ILE 70 CO 0.40 0.00 0.42 -1.61 0.00 0.00 0.00 178.15 177.36 1l2a s GLU 71 N -5.89 2.04 -0.21 2.37 8.01 -1.26 -4.90 118.70 118.86 1l2a s GLU 71 Ca -0.17 1.90 0.13 0.00 0.01 0.00 0.00 54.97 56.85 1l2a s GLU 71 Cb 0.06 -1.80 -0.22 0.00 -4.31 0.00 0.00 34.13 27.86 1l2a s GLU 71 CO 0.62 -1.95 -0.02 0.25 0.01 0.00 0.00 175.26 174.18 1l2a n THR 72 N -2.67 1.38 -2.55 3.63 -2.24 -1.26 -4.29 114.28 106.28 1l2a n THR 72 Ca 0.15 -0.75 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 1l2a n THR 72 Cb 0.49 -0.74 -0.02 0.00 -2.10 0.00 0.00 70.33 67.96 1l2a n THR 72 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1l2a s LEU 73 N -5.75 3.44 -0.29 3.22 1.98 -1.26 -1.70 118.68 118.33 1l2a s LEU 73 Ca -0.17 0.15 -0.17 0.00 -2.89 0.00 0.00 54.13 51.05 1l2a s LEU 73 Cb 0.07 -3.16 0.13 0.00 0.66 0.00 0.00 46.19 43.89 1l2a s LEU 73 CO 0.74 -1.52 0.94 -0.51 -1.89 0.00 0.00 176.35 174.11 1l2a s ILE 74 N 5.13 0.00 -0.09 6.68 2.07 -1.26 -4.89 121.20 128.84 1l2a s ILE 74 Ca 0.45 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.68 1l2a s ILE 74 Cb -0.08 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.54 1l2a s ILE 74 CO 0.25 0.00 -0.04 -0.69 -1.91 0.00 0.00 174.94 172.56 1l2a s VAL 75 N 1.23 0.69 0.25 4.00 1.01 -1.26 -2.13 120.40 124.19 1l2a s VAL 75 Ca -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1l2a s VAL 75 Cb -0.04 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.57 1l2a s VAL 75 CO -0.14 0.31 0.00 -1.84 0.00 0.00 0.00 175.10 173.43 1l2a n GLU 76 N 4.98 0.00 0.00 2.72 0.28 -1.26 -5.03 120.64 122.33 1l2a n GLU 76 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.89 1l2a n GLU 76 Cb 0.50 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.37 1l2a n GLU 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1l2a n ALA 77 N -3.12 2.84 -1.80 -1.84 0.00 -1.26 -4.79 120.51 110.54 1l2a n ALA 77 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1l2a n ALA 77 Cb 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.56 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 -1.89 3.91 -0.26 0.00 0.04 -1.26 -4.89 135.00 130.65 1l2a s PRO 78 Ca 0.00 1.38 0.13 0.00 0.04 0.00 0.00 61.00 62.54 1l2a s PRO 78 Cb 0.00 -2.19 0.61 0.00 0.04 0.00 0.00 34.50 32.95 1l2a s PRO 78 CO 0.00 -0.34 1.57 -0.40 0.04 0.00 0.00 177.00 177.87 1l2a n ASP 79 N -0.75 3.92 -3.64 6.66 5.68 -1.26 -4.41 116.55 122.74 1l2a n ASP 79 Ca 0.08 -3.27 -0.03 0.00 -0.50 0.00 0.00 54.79 51.08 1l2a n ASP 79 Cb 0.52 -0.64 -0.07 0.00 -1.14 0.00 0.00 41.12 39.80 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 -2.99 -0.56 0.32 2.11 5.04 -0.90 -4.68 117.35 115.69 1l2a s TYR 80 Ca 0.47 1.13 0.29 0.00 -2.44 0.00 0.00 57.07 56.52 1l2a s TYR 80 Cb 0.39 0.34 1.39 0.00 0.35 0.00 0.00 41.96 44.43 1l2a s TYR 80 CO 0.08 -0.28 2.02 0.78 -1.34 0.00 0.00 175.55 176.82 1l2a h GLY 81 N 5.97 0.00 -3.01 8.97 0.00 -1.50 -3.02 103.07 110.47 1l2a h GLY 81 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1l2a h GLY 81 CO 0.19 0.00 0.00 1.42 0.00 0.00 0.00 176.54 178.15 1l2a n HIS 82 N -3.45 1.44 -1.44 5.60 8.25 -1.26 -1.87 115.22 122.49 1l2a n HIS 82 Ca -0.01 -0.61 -0.29 0.00 -0.26 0.00 0.00 57.72 56.55 1l2a n HIS 82 Cb 0.28 -0.23 0.12 0.00 1.12 0.00 0.00 29.99 31.28 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 -1.80 2.63 0.29 1.59 -7.23 -1.14 -3.40 120.40 111.34 1l2a s VAL 83 Ca 0.51 0.20 0.11 0.00 -1.81 0.00 0.00 61.98 61.00 1l2a s VAL 83 Cb 0.32 -2.87 -0.05 0.00 0.56 0.00 0.00 36.38 34.34 1l2a s VAL 83 CO 0.25 -0.27 -0.17 0.28 -0.31 0.00 0.00 175.10 174.89 1l2a s THR 84 N -3.12 2.46 0.07 5.32 -1.32 0.24 -1.16 115.64 118.13 1l2a s THR 84 Ca 0.62 -2.34 0.03 0.00 -1.21 0.00 0.00 61.69 58.80 1l2a s THR 84 Cb -0.16 -2.40 -0.03 0.00 -1.51 0.00 0.00 72.50 68.40 1l2a s THR 84 CO 0.55 -0.35 -0.10 0.42 -2.21 0.00 0.00 174.62 172.93 1l2a s THR 85 N -2.53 0.81 0.36 5.08 -4.23 -1.25 -0.79 115.64 113.09 1l2a s THR 85 Ca 0.31 -1.34 0.16 0.00 -1.18 0.00 0.00 61.69 59.64 1l2a s THR 85 Cb -0.03 -0.99 0.36 0.00 1.34 0.00 0.00 72.50 73.18 1l2a s THR 85 CO 0.16 -0.41 1.72 0.77 -0.54 0.00 0.00 174.62 176.31 1l2a h SER 86 N 4.11 0.52 -0.07 3.99 4.64 -0.88 -0.26 113.55 125.61 1l2a h SER 86 Ca -0.38 0.13 0.04 0.00 -0.47 0.00 0.00 61.79 61.11 1l2a h SER 86 Cb 1.19 0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 1l2a h SER 86 CO 0.45 0.03 -0.19 -0.08 -0.87 0.00 0.00 176.83 176.17 1l2a h GLU 87 N 0.42 -0.26 -0.71 4.77 4.81 -1.92 -1.31 114.58 120.38 1l2a h GLU 87 Ca 0.66 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.89 1l2a h GLU 87 Cb 1.54 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.95 1l2a h GLU 87 CO -0.43 -0.17 0.36 0.00 -0.73 0.00 0.00 179.01 178.04 1l2a h ALA 88 N 0.69 1.30 -0.72 2.92 0.00 -1.43 -1.86 119.26 120.16 1l2a h ALA 88 Ca 0.08 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1l2a h ALA 88 Cb 0.38 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1l2a h ALA 88 CO -0.22 0.55 0.46 0.74 0.00 0.00 0.00 179.25 180.78 1l2a h PHE 89 N 1.00 0.86 -0.34 0.00 -1.00 -0.89 -0.10 116.94 116.46 1l2a h PHE 89 Ca 0.25 0.02 -0.11 0.00 2.81 0.00 0.00 57.97 60.94 1l2a h PHE 89 Cb 0.07 -0.28 -0.01 0.00 3.61 0.00 0.00 35.95 39.33 1l2a h PHE 89 CO 0.01 0.51 -0.23 0.66 -1.61 0.00 0.00 178.31 177.64 1l2a h SER 90 N 0.91 0.68 -0.59 2.17 4.64 -0.52 -1.58 113.55 119.25 1l2a h SER 90 Ca 0.28 -0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 61.27 1l2a h SER 90 Cb -0.02 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 1l2a h SER 90 CO -0.10 0.90 0.01 1.88 -0.87 0.00 0.00 176.83 178.66 1l2a h TYR 91 N 0.59 1.13 -0.23 4.77 0.05 -1.04 -1.11 116.97 121.13 1l2a h TYR 91 Ca 0.08 -0.19 0.06 0.00 0.05 0.00 0.00 58.73 58.73 1l2a h TYR 91 Cb 0.71 -0.30 -0.07 0.00 1.01 0.00 0.00 36.73 38.09 1l2a h TYR 91 CO 0.03 1.00 -0.22 -0.92 -1.05 0.00 0.00 178.16 177.00 1l2a h TYR 92 N 0.93 -0.58 -0.30 4.88 3.20 -0.66 0.70 116.97 125.15 1l2a h TYR 92 Ca 0.17 0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.12 1l2a h TYR 92 Cb 0.54 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 39.06 1l2a h TYR 92 CO 0.04 -0.30 0.04 0.28 -1.64 0.00 0.00 178.16 176.58 1l2a h VAL 93 N -0.23 0.83 -0.92 1.81 2.07 -1.17 -0.74 116.25 117.90 1l2a h VAL 93 Ca 0.13 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 1l2a h VAL 93 Cb 0.43 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1l2a h VAL 93 CO -0.37 0.03 0.57 -0.25 0.02 0.00 0.00 177.57 177.57 1l2a h TRP 94 N 0.14 1.20 -0.12 1.57 7.01 -0.44 0.30 115.95 125.61 1l2a h TRP 94 Ca 0.14 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.15 1l2a h TRP 94 Cb 0.16 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 26.82 1l2a h TRP 94 CO -0.19 0.79 0.07 1.25 -2.79 0.00 0.00 178.44 177.57 1l2a h LEU 95 N 1.26 0.14 -0.95 0.65 5.85 0.11 -2.47 115.31 119.91 1l2a h LEU 95 Ca 0.33 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.05 1l2a h LEU 95 Cb -0.08 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 40.86 1l2a h LEU 95 CO -0.06 0.14 0.62 -0.33 -0.34 0.00 0.00 178.44 178.46 1l2a h GLU 96 N 0.13 1.18 -0.78 1.25 4.39 -0.48 -1.79 114.58 118.48 1l2a h GLU 96 Ca 0.04 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1l2a h GLU 96 Cb 0.02 -0.27 -0.04 0.00 -0.10 0.00 0.00 28.75 28.37 1l2a h GLU 96 CO -0.01 0.78 0.42 0.00 -1.16 0.00 0.00 179.01 179.05 1l2a h ALA 97 N 1.38 1.00 -0.23 3.43 0.00 -0.69 0.91 119.26 125.05 1l2a h ALA 97 Ca 0.37 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 1l2a h ALA 97 Cb -0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1l2a h ALA 97 CO -0.11 0.51 -0.43 1.98 0.00 0.00 0.00 179.25 181.20 1l2a h MET 98 N 1.08 0.57 0.19 0.00 1.85 -1.24 -1.77 114.93 115.61 1l2a h MET 98 Ca 0.27 -0.30 0.01 0.00 -0.61 0.00 0.00 59.70 59.07 1l2a h MET 98 Cb 0.04 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.05 1l2a h MET 98 CO -0.04 0.89 -0.24 -0.92 -0.40 0.00 0.00 176.91 176.20 1l2a h TYR 99 N 0.46 -0.63 -1.00 1.39 3.20 -0.71 -0.97 116.97 118.72 1l2a h TYR 99 Ca 0.04 0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.05 1l2a h TYR 99 Cb 0.93 0.25 -0.09 0.00 1.54 0.00 0.00 36.73 39.37 1l2a h TYR 99 CO 0.04 -0.35 0.63 0.78 -1.64 0.00 0.00 178.16 177.62 1l2a h GLY 100 N -0.48 1.63 1.02 1.82 0.00 -0.72 0.35 103.07 106.69 1l2a h GLY 100 Ca 0.01 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1l2a h GLY 100 CO -0.08 0.12 0.21 -0.57 0.00 0.00 0.00 176.54 176.21 1l2a h ASN 101 N 0.93 0.94 0.48 0.19 -0.00 -0.99 -2.14 115.58 114.99 1l2a h ASN 101 Ca 0.51 -0.20 -0.30 0.00 -0.00 0.00 0.00 56.30 56.31 1l2a h ASN 101 Cb 0.58 -0.25 -0.04 0.00 -0.00 0.00 0.00 38.32 38.62 1l2a h ASN 101 CO -0.28 0.89 -1.65 -0.07 -0.00 0.00 0.00 177.43 176.32 1l2a h LEU 102 N 0.93 0.13 0.00 0.34 3.38 -0.08 -3.42 115.31 116.59 1l2a h LEU 102 Ca 0.21 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1l2a h LEU 102 Cb 0.29 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1l2a h LEU 102 CO -0.01 1.21 -0.17 0.74 0.09 0.00 0.00 178.44 180.29 1l2a h THR 103 N 0.02 0.00 0.00 0.22 2.02 -0.42 -3.50 112.91 111.26 1l2a h THR 103 Ca -0.27 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1l2a h THR 103 Cb 1.99 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 1l2a h THR 103 CO 0.10 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.60 1l2a n GLY 104 N 1.72 0.62 3.51 2.16 0.00 -0.81 -5.06 105.19 107.33 1l2a n GLY 104 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.61 5.48 -0.09 1.61 3.04 -1.26 -4.99 114.94 118.12 1l2a s ASN 105 Ca 0.00 -0.11 0.18 0.00 0.04 0.00 0.00 52.86 52.97 1l2a s ASN 105 Cb 0.00 -1.99 0.66 0.00 -1.54 0.00 0.00 41.25 38.38 1l2a s ASN 105 CO 0.00 -0.02 1.57 0.79 -3.04 0.00 0.00 177.10 176.40 1l2a n TRP 106 N 4.85 1.27 -0.03 0.43 7.02 -1.26 -4.06 117.44 125.66 1l2a n TRP 106 Ca -0.15 -0.60 -0.09 0.00 -1.02 0.00 0.00 57.50 55.63 1l2a n TRP 106 Cb 0.52 -0.19 -0.03 0.00 -2.42 0.00 0.00 31.31 29.19 1l2a n TRP 106 CO 0.00 0.00 0.00 0.77 -2.02 0.00 0.00 177.69 176.44 1l2a h SER 107 N 3.78 -0.91 -0.75 -0.99 0.02 -1.94 -2.89 113.55 109.88 1l2a h SER 107 Ca 0.00 0.15 0.17 0.00 -0.84 0.00 0.00 61.79 61.27 1l2a h SER 107 Cb 1.31 0.41 -0.12 0.00 0.14 0.00 0.00 62.40 64.14 1l2a h SER 107 CO 0.17 -0.32 0.13 1.23 -1.14 0.00 0.00 176.83 176.91 1l2a h GLY 108 N -0.32 1.00 0.57 -3.77 0.00 -1.91 -0.19 103.07 98.45 1l2a h GLY 108 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 1l2a h GLY 108 CO -0.38 -0.24 -0.41 -2.08 0.00 0.00 0.00 176.54 173.42 1l2a h VAL 109 N 0.21 0.17 -0.32 4.60 2.07 -1.77 0.49 116.25 121.70 1l2a h VAL 109 Ca 0.42 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.01 1l2a h VAL 109 Cb 0.75 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 1l2a h VAL 109 CO -0.56 0.00 -0.10 -0.33 0.02 0.00 0.00 177.57 176.60 1l2a h GLU 110 N -0.84 -0.02 -0.10 1.57 5.08 -1.48 -1.76 114.58 117.03 1l2a h GLU 110 Ca -0.03 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1l2a h GLU 110 Cb 0.75 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1l2a h GLU 110 CO -0.07 -0.02 -0.07 1.15 -1.00 0.00 0.00 179.01 179.00 1l2a h THR 111 N -0.03 0.79 -0.17 1.13 2.02 -0.75 -1.20 112.91 114.71 1l2a h THR 111 Ca 0.16 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.35 1l2a h THR 111 Cb 0.27 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1l2a h THR 111 CO -0.35 0.00 0.06 0.00 0.37 0.00 0.00 175.52 175.60 1l2a h ALA 112 N 1.00 0.18 -0.83 6.16 0.00 0.23 -1.11 119.26 124.90 1l2a h ALA 112 Ca 0.06 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1l2a h ALA 112 Cb 0.17 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1l2a h ALA 112 CO -0.14 -0.38 0.43 2.35 0.00 0.00 0.00 179.25 181.51 1l2a h TRP 113 N 0.14 1.15 -0.46 0.00 2.91 -1.27 -1.58 115.95 116.84 1l2a h TRP 113 Ca 0.07 -0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.05 1l2a h TRP 113 Cb 0.04 -0.37 -0.02 0.00 -0.51 0.00 0.00 29.16 28.30 1l2a h TRP 113 CO -0.11 0.81 0.25 -0.22 -1.03 0.00 0.00 178.44 178.15 1l2a h LYS 114 N 1.17 0.65 -0.55 2.65 3.64 -0.74 0.17 116.57 123.55 1l2a h LYS 114 Ca 0.29 -0.08 0.02 0.00 -1.27 0.00 0.00 60.65 59.62 1l2a h LYS 114 Cb 0.06 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.72 1l2a h LYS 114 CO -0.04 0.51 0.34 0.28 -2.27 0.00 0.00 179.45 178.27 1l2a h VAL 115 N 0.61 1.07 -0.26 2.00 2.07 -0.84 0.41 116.25 121.31 1l2a h VAL 115 Ca 0.16 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.47 1l2a h VAL 115 Cb 0.05 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1l2a h VAL 115 CO -0.03 0.12 0.13 -0.03 0.02 0.00 0.00 177.57 177.78 1l2a h MET 116 N 0.67 0.26 -0.45 1.57 1.85 -0.94 0.25 114.93 118.14 1l2a h MET 116 Ca 0.22 -0.02 -0.12 0.00 -0.61 0.00 0.00 59.70 59.17 1l2a h MET 116 Cb 0.01 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 31.97 1l2a h MET 116 CO -0.09 0.17 -0.21 1.49 -0.40 0.00 0.00 176.91 177.87 1l2a h GLU 117 N 0.27 0.90 -0.62 0.39 4.81 -0.31 -0.06 114.58 119.96 1l2a h GLU 117 Ca 0.10 -0.37 -0.04 0.00 -0.13 0.00 0.00 59.36 58.92 1l2a h GLU 117 Cb 0.03 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1l2a h GLU 117 CO -0.07 1.02 0.22 -0.44 -0.73 0.00 0.00 179.01 179.02 1l2a h ASP 118 N 0.78 0.88 0.00 1.04 3.32 0.05 -3.40 116.42 119.09 1l2a h ASP 118 Ca 0.11 -0.19 -0.19 0.00 0.02 0.00 0.00 57.03 56.78 1l2a h ASP 118 Cb 0.76 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 1l2a h ASP 118 CO 0.06 0.83 -1.50 0.79 -1.72 0.00 0.00 179.24 177.70 1l2a n TRP 119 N -4.41 0.00 0.62 4.55 7.02 0.06 -4.85 117.44 120.43 1l2a n TRP 119 Ca 0.04 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.63 1l2a n TRP 119 Cb 0.19 -0.50 -0.07 0.00 -2.42 0.00 0.00 31.31 28.51 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 -3.85 0.06 -3.14 -0.99 3.06 -0.07 -4.75 119.36 109.68 1l2a n ILE 120 Ca -0.25 -0.20 -0.43 0.00 -2.50 0.00 0.00 62.75 59.37 1l2a n ILE 120 Cb 0.60 0.47 -0.07 0.00 0.54 0.00 0.00 39.64 41.18 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 -3.19 4.87 0.04 9.51 1.01 -0.98 -2.20 121.20 130.26 1l2a s ILE 121 Ca 0.03 0.11 -0.34 0.00 0.00 0.00 0.00 60.65 60.44 1l2a s ILE 121 Cb 0.15 -4.17 -0.13 0.00 0.01 0.00 0.00 42.46 38.32 1l2a s ILE 121 CO 0.85 -0.54 1.69 -2.65 0.00 0.00 0.00 174.94 174.28 1l2a n PRO 122 N 6.15 2.06 -2.14 2.79 -0.02 -1.26 -4.86 135.00 137.73 1l2a n PRO 122 Ca -0.02 0.75 -0.28 0.00 -2.02 0.00 0.00 63.50 61.92 1l2a n PRO 122 Cb 0.48 -2.54 0.18 0.00 -0.02 0.00 0.00 33.50 31.61 1l2a n PRO 122 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1l2a s ASP 123 N 2.21 3.18 0.29 2.55 3.84 -1.26 -4.87 116.67 122.60 1l2a s ASP 123 Ca 0.85 -0.05 0.04 0.00 -0.00 0.00 0.00 52.55 53.40 1l2a s ASP 123 Cb -0.71 0.02 0.70 0.00 -1.38 0.00 0.00 42.92 41.55 1l2a s ASP 123 CO 0.45 -2.67 1.77 0.77 -0.00 0.00 0.00 175.17 175.48 1l2a h SER 124 N -1.45 0.70 0.05 2.11 4.64 -1.95 0.88 113.55 118.53 1l2a h SER 124 Ca -0.41 0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.00 1l2a h SER 124 Cb 1.22 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1l2a h SER 124 CO 0.33 0.24 -0.03 0.74 -0.87 0.00 0.00 176.83 177.24 1l2a h THR 125 N 0.71 0.81 -0.30 2.95 2.02 -2.01 -2.46 112.91 114.63 1l2a h THR 125 Ca 0.56 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.62 1l2a h THR 125 Cb 0.87 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1l2a h THR 125 CO -0.39 0.03 0.00 -0.62 0.37 0.00 0.00 175.52 174.91 1l2a n GLU 126 N -4.19 2.40 -2.50 6.66 1.02 0.28 -4.41 120.64 119.89 1l2a n GLU 126 Ca -0.03 -2.09 -0.17 0.00 -0.02 0.00 0.00 57.16 54.85 1l2a n GLU 126 Cb 0.12 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.06 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 1.34 2.52 -1.88 3.49 6.02 -0.92 -4.87 117.38 123.07 1l2a n GLN 127 Ca 0.18 -3.91 -0.42 0.00 -0.01 0.00 0.00 57.00 52.84 1l2a n GLN 127 Cb 0.58 -1.85 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 1l2a n GLN 127 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1l2a s PRO 128 N -3.47 4.19 0.00 -1.09 0.04 -1.25 -2.94 135.00 130.48 1l2a s PRO 128 Ca 0.39 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.88 1l2a s PRO 128 Cb 0.41 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.87 1l2a s PRO 128 CO -0.05 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1l2a n GLY 129 N 2.59 0.59 0.36 0.56 0.00 -1.26 -4.57 105.19 103.45 1l2a n GLY 129 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.15 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 4.45 0.94 0.00 1.61 4.05 -1.81 0.79 114.93 124.97 1l2a h MET 130 Ca 0.00 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1l2a h MET 130 Cb 0.00 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 30.59 1l2a h MET 130 CO 0.00 0.62 0.00 -1.13 0.23 0.00 0.00 176.91 176.63 1l2a n SER 131 N -4.46 0.00 0.07 1.39 3.41 -1.26 -0.75 113.62 112.01 1l2a n SER 131 Ca 0.11 -0.13 0.11 0.00 -0.26 0.00 0.00 58.87 58.71 1l2a n SER 131 Cb 0.15 -0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1l2a n SER 131 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1l2a n SER 132 N -1.02 0.66 -4.50 4.04 7.64 0.27 -4.98 113.62 115.73 1l2a n SER 132 Ca 0.04 0.15 -0.50 0.00 1.01 0.00 0.00 58.87 59.57 1l2a n SER 132 Cb 0.02 0.73 -0.04 0.00 -1.01 0.00 0.00 64.21 63.91 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 -2.42 0.49 -3.80 1.43 9.36 0.07 -4.62 117.16 117.67 1l2a n TYR 133 Ca 0.00 0.87 -0.35 0.00 3.32 0.00 0.00 57.90 61.74 1l2a n TYR 133 Cb 0.52 -2.12 -0.12 0.00 -0.63 0.00 0.00 39.34 37.00 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 -0.45 5.15 0.39 2.98 2.47 -1.26 -4.99 114.94 119.23 1l2a s ASN 134 Ca 0.71 -2.31 0.20 0.00 0.42 0.00 0.00 52.86 51.89 1l2a s ASN 134 Cb -0.95 -1.80 1.18 0.00 -1.45 0.00 0.00 41.25 38.23 1l2a s ASN 134 CO 0.56 -0.47 1.71 -0.65 -3.72 0.00 0.00 177.10 174.53 1l2a h PRO 135 N 7.66 0.30 0.00 0.43 0.11 -1.93 0.82 132.00 139.39 1l2a h PRO 135 Ca -0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1l2a h PRO 135 Cb 1.01 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1l2a h PRO 135 CO 0.68 0.20 0.00 -1.71 -0.21 0.00 0.00 178.00 176.96 1l2a n ASN 136 N -4.73 0.00 -3.06 -2.05 2.85 -1.26 -0.92 115.26 106.09 1l2a n ASN 136 Ca 0.30 0.37 -0.17 0.00 -0.11 0.00 0.00 54.58 54.97 1l2a n ASN 136 Cb 1.04 -0.44 -0.02 0.00 1.24 0.00 0.00 39.78 41.60 1l2a n ASN 136 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1l2a n SER 137 N -1.44 -0.36 -0.30 1.20 2.88 0.28 -4.71 113.62 111.16 1l2a n SER 137 Ca 0.06 -3.05 -0.01 0.00 -1.33 0.00 0.00 58.87 54.54 1l2a n SER 137 Cb 0.20 0.08 0.16 0.00 -0.75 0.00 0.00 64.21 63.91 1l2a n SER 137 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1l2a h PRO 138 N 3.47 1.17 0.00 -1.46 0.11 -1.65 -3.43 132.00 130.21 1l2a h PRO 138 Ca 0.03 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 1l2a h PRO 138 Cb 0.97 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.82 1l2a h PRO 138 CO 0.41 0.79 0.27 0.00 -0.21 0.00 0.00 178.00 179.26 1l2a n ALA 139 N -2.40 -1.65 -2.89 -0.75 0.00 -1.26 -1.29 120.51 110.27 1l2a n ALA 139 Ca 0.10 -1.12 -0.34 0.00 0.00 0.00 0.00 53.44 52.08 1l2a n ALA 139 Cb 0.03 0.88 -0.12 0.00 0.00 0.00 0.00 19.45 20.24 1l2a n ALA 139 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1l2a s THR 140 N -2.19 3.75 0.24 0.00 2.01 -1.26 -4.89 115.64 113.30 1l2a s THR 140 Ca 0.15 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 1l2a s THR 140 Cb -0.04 -2.61 -0.10 0.00 0.01 0.00 0.00 72.50 69.76 1l2a s THR 140 CO 0.10 0.52 1.40 -0.47 -0.69 0.00 0.00 174.62 175.48 1l2a s TYR 141 N 0.09 3.09 -0.02 4.92 5.04 -1.26 -4.79 117.35 124.43 1l2a s TYR 141 Ca -0.02 1.10 -0.02 0.00 -2.44 0.00 0.00 57.07 55.70 1l2a s TYR 141 Cb -0.14 -3.75 0.01 0.00 0.35 0.00 0.00 41.96 38.42 1l2a s TYR 141 CO 0.03 -2.42 0.05 0.00 -1.34 0.00 0.00 175.55 171.87 1l2a s ALA 142 N -0.02 -0.11 0.68 3.97 0.00 -1.26 -1.09 121.76 123.93 1l2a s ALA 142 Ca 0.58 0.14 -0.17 0.00 0.00 0.00 0.00 51.96 52.51 1l2a s ALA 142 Cb -0.40 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.58 1l2a s ALA 142 CO 0.42 -0.03 0.51 -0.25 0.00 0.00 0.00 175.76 176.42 1l2a n ASP 143 N 3.10 -1.19 -4.76 0.00 8.00 -1.26 -5.01 116.55 115.42 1l2a n ASP 143 Ca -0.13 0.63 -0.27 0.00 0.71 0.00 0.00 54.79 55.73 1l2a n ASP 143 Cb 0.59 -1.20 -0.06 0.00 -0.02 0.00 0.00 41.12 40.43 1l2a n ASP 143 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1l2a s GLU 144 N -2.55 2.78 0.16 -1.24 2.02 -0.91 -4.88 118.70 114.07 1l2a s GLU 144 Ca 0.66 -0.90 0.02 0.00 0.02 0.00 0.00 54.97 54.78 1l2a s GLU 144 Cb -0.38 -2.59 -0.05 0.00 0.10 0.00 0.00 34.13 31.22 1l2a s GLU 144 CO 0.57 0.49 -0.03 0.71 0.02 0.00 0.00 175.26 177.02 1l2a s TYR 145 N -1.68 1.19 -1.53 1.61 1.51 -1.26 -4.70 117.35 112.47 1l2a s TYR 145 Ca 0.30 -0.95 0.30 0.00 -1.01 0.00 0.00 57.07 55.70 1l2a s TYR 145 Cb -0.10 -0.67 1.44 0.00 -0.11 0.00 0.00 41.96 42.52 1l2a s TYR 145 CO 0.22 -0.14 2.00 0.39 -1.11 0.00 0.00 175.55 176.91 1l2a n GLU 146 N -0.21 0.55 -3.77 -0.62 4.71 -1.26 -3.67 120.64 116.37 1l2a n GLU 146 Ca -0.08 -0.08 -0.13 0.00 -0.01 0.00 0.00 57.16 56.86 1l2a n GLU 146 Cb 0.62 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.46 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 -2.51 -0.23 0.63 1.62 2.15 -1.26 -4.19 116.67 112.89 1l2a s ASP 147 Ca 0.30 0.28 0.32 0.00 0.43 0.00 0.00 52.55 53.88 1l2a s ASP 147 Cb 0.20 0.44 1.79 0.00 -0.30 0.00 0.00 42.92 45.05 1l2a s ASP 147 CO 0.46 -0.31 2.07 -0.65 -0.17 0.00 0.00 175.17 176.58 1l2a h PRO 148 N 4.60 0.00 0.00 4.34 0.11 -1.86 -2.05 132.00 137.14 1l2a h PRO 148 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1l2a h PRO 148 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1l2a h PRO 148 CO 0.36 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.81 1l2a h SER 149 N 0.00 0.00 0.92 -2.05 4.64 -1.95 -1.59 113.55 113.52 1l2a h SER 149 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1l2a h SER 149 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1l2a h SER 149 CO -0.00 0.00 -0.21 -1.22 -0.87 0.00 0.00 176.83 174.53 1l2a n TYR 150 N -2.57 0.20 -3.54 4.77 4.02 -0.77 -4.90 117.16 114.38 1l2a n TYR 150 Ca 0.00 0.06 -0.34 0.00 -0.01 0.00 0.00 57.90 57.61 1l2a n TYR 150 Cb 0.17 -0.52 -0.05 0.00 -0.02 0.00 0.00 39.34 38.92 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 -3.03 3.55 0.51 -0.72 1.51 -0.60 -4.47 117.35 114.10 1l2a s TYR 151 Ca 0.12 0.80 -0.21 0.00 -1.01 0.00 0.00 57.07 56.77 1l2a s TYR 151 Cb 0.17 -2.18 -0.07 0.00 -0.11 0.00 0.00 41.96 39.78 1l2a s TYR 151 CO 0.61 0.46 1.14 -1.25 -1.11 0.00 0.00 175.55 175.40 1l2a s PRO 152 N -2.14 3.52 -0.03 -1.71 0.04 -1.16 -4.75 135.00 128.76 1l2a s PRO 152 Ca 0.37 1.66 -0.13 0.00 0.04 0.00 0.00 61.00 62.93 1l2a s PRO 152 Cb -0.13 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 1l2a s PRO 152 CO 0.20 -0.72 0.36 0.45 0.04 0.00 0.00 177.00 177.32 1l2a s SER 153 N -1.63 6.71 -0.11 6.66 0.15 -0.47 -4.66 113.70 120.36 1l2a s SER 153 Ca 0.69 0.85 -0.22 0.00 0.70 0.00 0.00 55.95 57.97 1l2a s SER 153 Cb -0.25 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 61.81 1l2a s SER 153 CO 0.29 0.32 0.66 -0.70 1.20 0.00 0.00 173.24 175.01 1l2a s GLU 154 N -0.94 4.37 0.47 5.44 2.12 -1.26 -0.48 118.70 128.42 1l2a s GLU 154 Ca 0.22 0.77 -0.24 0.00 0.36 0.00 0.00 54.97 56.08 1l2a s GLU 154 Cb -0.16 -3.48 -0.07 0.00 0.26 0.00 0.00 34.13 30.69 1l2a s GLU 154 CO 0.11 -0.00 1.33 -0.51 -0.54 0.00 0.00 175.26 175.65 1l2a s LEU 155 N 1.06 4.04 -0.49 2.70 1.43 -0.81 -4.45 118.68 122.17 1l2a s LEU 155 Ca 0.34 2.70 0.03 0.00 -1.03 0.00 0.00 54.13 56.17 1l2a s LEU 155 Cb -0.17 -4.09 0.14 0.00 0.03 0.00 0.00 46.19 42.11 1l2a s LEU 155 CO 0.15 -1.18 0.30 -0.54 0.23 0.00 0.00 176.35 175.31 1l2a s LYS 156 N -2.58 1.53 0.22 1.70 1.02 -0.25 -4.96 119.74 116.42 1l2a s LYS 156 Ca 0.64 -2.33 0.01 0.00 0.02 0.00 0.00 55.97 54.31 1l2a s LYS 156 Cb -0.39 -2.53 0.20 0.00 -0.52 0.00 0.00 37.83 34.59 1l2a s LYS 156 CO 0.48 -1.20 1.54 0.74 -0.92 0.00 0.00 175.35 175.99 1l2a h PHE 157 N 6.34 0.47 0.00 3.18 -1.00 -1.91 -3.36 116.94 120.65 1l2a h PHE 157 Ca 0.04 -0.17 -0.29 0.00 2.81 0.00 0.00 57.97 60.36 1l2a h PHE 157 Cb 0.89 -0.09 -0.05 0.00 3.61 0.00 0.00 35.95 40.31 1l2a h PHE 157 CO 0.50 0.86 -2.13 -0.25 -1.61 0.00 0.00 178.31 175.67 1l2a n ASP 158 N -3.91 0.86 0.08 2.17 8.00 -1.26 -4.67 116.55 117.81 1l2a n ASP 158 Ca -0.03 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.59 1l2a n ASP 158 Cb 0.61 0.97 0.01 0.00 -0.02 0.00 0.00 41.12 42.68 1l2a n ASP 158 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1l2a n THR 159 N -2.59 0.48 -3.81 -3.53 -2.24 -1.26 -4.85 114.28 96.48 1l2a n THR 159 Ca -0.26 -0.48 -0.29 0.00 -2.27 0.00 0.00 64.05 60.76 1l2a n THR 159 Cb 1.01 -0.22 -0.16 0.00 -2.10 0.00 0.00 70.33 68.86 1l2a n THR 159 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1l2a s VAL 160 N -3.34 0.93 0.42 2.28 1.01 -1.26 -5.12 120.40 115.32 1l2a s VAL 160 Ca 0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 60.88 1l2a s VAL 160 Cb 0.11 -1.37 -0.08 0.00 0.00 0.00 0.00 36.38 35.04 1l2a s VAL 160 CO 0.80 -0.20 1.09 -0.60 0.00 0.00 0.00 175.10 176.18 1l2a s ARG 161 N 1.67 4.02 0.17 2.72 3.52 -1.26 -4.68 118.95 125.11 1l2a s ARG 161 Ca -0.02 1.59 0.10 0.00 -0.13 0.00 0.00 55.73 57.27 1l2a s ARG 161 Cb -0.18 -2.48 -0.04 0.00 -1.56 0.00 0.00 34.95 30.69 1l2a s ARG 161 CO -0.08 -0.28 -0.21 0.08 -0.81 0.00 0.00 175.30 173.99 1l2a s VAL 162 N -1.63 2.05 0.66 7.11 1.01 -1.26 -4.62 120.40 123.72 1l2a s VAL 162 Ca 0.60 -1.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.55 1l2a s VAL 162 Cb -0.24 -1.94 0.15 0.00 0.00 0.00 0.00 36.38 34.36 1l2a s VAL 162 CO 0.30 -0.18 0.90 0.61 0.00 0.00 0.00 175.10 176.72 1l2a n GLY 163 N 0.40 -1.28 3.89 4.51 0.00 -1.02 -4.79 105.19 106.89 1l2a n GLY 163 Ca -0.14 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 1l2a n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l2a s SER 164 N -4.29 6.12 -0.43 1.61 0.01 -0.53 -4.44 113.70 111.75 1l2a s SER 164 Ca 0.51 0.15 -0.21 0.00 1.31 0.00 0.00 55.95 57.71 1l2a s SER 164 Cb -0.01 -1.81 0.02 0.00 0.21 0.00 0.00 66.02 64.43 1l2a s SER 164 CO 0.36 0.12 0.64 -0.62 0.41 0.00 0.00 173.24 174.14 1l2a s ASP 165 N -2.79 6.33 0.00 2.44 -1.08 -0.09 -4.83 116.67 116.64 1l2a s ASP 165 Ca 0.33 -0.31 0.28 0.00 -0.52 0.00 0.00 52.55 52.34 1l2a s ASP 165 Cb -0.12 -2.32 1.09 0.00 -1.46 0.00 0.00 42.92 40.12 1l2a s ASP 165 CO 0.27 -0.76 1.77 -0.81 0.52 0.00 0.00 175.17 176.16 1l2a n PRO 166 N 6.23 1.12 -0.06 4.34 -0.04 -1.26 -4.24 135.00 141.09 1l2a n PRO 166 Ca -0.02 -0.55 -0.05 0.00 -0.04 0.00 0.00 63.50 62.84 1l2a n PRO 166 Cb 0.48 -1.49 -0.09 0.00 -0.04 0.00 0.00 33.50 32.36 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 -0.46 0.77 0.04 0.52 0.31 -1.26 -4.70 118.33 113.55 1l2a n VAL 167 Ca 0.16 -0.49 -0.12 0.00 -0.01 0.00 0.00 64.34 63.88 1l2a n VAL 167 Cb 0.31 -0.63 -0.05 0.00 -0.91 0.00 0.00 33.84 32.56 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 -0.98 -0.42 3.52 6.17 -2.00 -2.20 115.15 119.25 1l2a h HIS 168 Ca -0.30 0.03 0.09 0.00 0.71 0.00 0.00 60.37 60.90 1l2a h HIS 168 Cb 1.66 0.44 -0.09 0.00 2.52 0.00 0.00 27.41 31.94 1l2a h HIS 168 CO 0.00 -0.43 -0.29 -0.97 0.71 0.00 0.00 177.93 176.95 1l2a h ASN 169 N -0.48 -0.96 -0.87 3.26 -0.00 -1.86 0.95 115.58 115.61 1l2a h ASN 169 Ca 0.07 0.18 0.17 0.00 -0.00 0.00 0.00 56.30 56.72 1l2a h ASN 169 Cb 0.58 0.47 -0.10 0.00 -0.00 0.00 0.00 38.32 39.27 1l2a h ASN 169 CO -0.31 -0.29 0.44 -0.78 -0.00 0.00 0.00 177.43 176.48 1l2a h ASP 170 N -0.21 0.49 0.06 1.15 3.58 -1.78 -1.01 116.42 118.70 1l2a h ASP 170 Ca 0.19 0.11 -0.27 0.00 0.42 0.00 0.00 57.03 57.48 1l2a h ASP 170 Cb 0.51 0.04 0.02 0.00 1.72 0.00 0.00 39.33 41.62 1l2a h ASP 170 CO -0.54 0.16 -1.07 -0.07 -2.88 0.00 0.00 179.24 174.84 1l2a h LEU 171 N 0.57 0.88 -0.00 2.28 3.38 -0.56 -3.17 115.31 118.68 1l2a h LEU 171 Ca 0.50 -0.72 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1l2a h LEU 171 Cb 0.79 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1l2a h LEU 171 CO -0.41 1.52 0.00 0.58 0.09 0.00 0.00 178.44 180.22 1l2a h VAL 172 N 0.36 1.18 -0.88 1.22 2.07 -0.55 0.24 116.25 119.88 1l2a h VAL 172 Ca -0.14 -0.53 0.26 0.00 0.82 0.00 0.00 66.70 67.11 1l2a h VAL 172 Cb 1.73 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 33.00 1l2a h VAL 172 CO 0.21 0.14 0.65 -1.28 0.02 0.00 0.00 177.57 177.31 1l2a h SER 173 N -0.22 0.00 0.22 0.57 0.87 -1.28 0.33 113.55 114.04 1l2a h SER 173 Ca 0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.22 1l2a h SER 173 Cb 0.23 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.13 1l2a h SER 173 CO 0.00 0.00 -2.08 0.00 -0.53 0.00 0.00 176.83 174.22 1l2a n ALA 174 N -2.69 1.45 -0.15 6.23 0.00 -0.98 -4.77 120.51 119.60 1l2a n ALA 174 Ca 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1l2a n ALA 174 Cb 0.97 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1l2a n ALA 174 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1l2a n TYR 175 N -2.97 0.00 -0.76 0.00 4.01 0.04 -4.99 117.16 112.49 1l2a n TYR 175 Ca -0.27 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1l2a n TYR 175 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.12 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 0.36 -1.91 0.14 2.72 0.00 0.11 -4.66 105.19 101.95 1l2a n GLY 176 Ca 0.00 -1.94 0.12 0.00 0.00 0.00 0.00 46.02 44.21 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 0.00 0.00 -6.47 1.61 0.13 -1.93 -3.35 132.00 121.99 1l2a h PRO 177 Ca 0.00 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.60 1l2a h PRO 177 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1l2a h PRO 177 CO 0.00 0.00 -0.02 -0.80 -0.23 0.00 0.00 178.00 176.95 1l2a s ASN 178 N -5.07 6.83 0.28 1.44 0.01 -1.26 -4.61 114.94 112.55 1l2a s ASN 178 Ca 0.08 1.16 -0.29 0.00 -0.71 0.00 0.00 52.86 53.10 1l2a s ASN 178 Cb 0.10 -2.32 -0.09 0.00 0.41 0.00 0.00 41.25 39.35 1l2a s ASN 178 CO 0.65 -0.00 1.01 -0.32 -1.51 0.00 0.00 177.10 176.94 1l2a s MET 179 N -2.31 4.69 -0.68 -0.60 1.75 -1.26 -5.00 119.30 115.89 1l2a s MET 179 Ca 0.44 1.61 0.05 0.00 -1.25 0.00 0.00 55.69 56.53 1l2a s MET 179 Cb -0.14 -3.14 0.26 0.00 2.84 0.00 0.00 34.83 34.66 1l2a s MET 179 CO 0.20 0.32 0.84 0.98 -0.65 0.00 0.00 175.02 176.70 1l2a n TYR 180 N 1.15 3.57 -4.24 4.11 9.36 -1.26 -4.87 117.16 124.99 1l2a n TYR 180 Ca -0.01 -4.00 -0.14 0.00 3.32 0.00 0.00 57.90 57.08 1l2a n TYR 180 Cb 0.47 -0.62 -0.10 0.00 -0.63 0.00 0.00 39.34 38.46 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 -2.61 2.53 -0.05 2.98 1.43 -1.26 -4.52 118.68 117.17 1l2a s LEU 181 Ca 0.40 -1.01 -0.23 0.00 -1.03 0.00 0.00 54.13 52.27 1l2a s LEU 181 Cb 0.15 -0.31 -0.04 0.00 0.03 0.00 0.00 46.19 46.03 1l2a s LEU 181 CO -0.01 -0.35 0.67 -0.04 0.23 0.00 0.00 176.35 176.85 1l2a s MET 182 N -3.74 4.41 0.55 1.70 -1.94 -1.26 -4.36 119.30 114.67 1l2a s MET 182 Ca 0.16 0.84 -0.20 0.00 -1.71 0.00 0.00 55.69 54.77 1l2a s MET 182 Cb 0.03 -3.42 -0.05 0.00 2.01 0.00 0.00 34.83 33.40 1l2a s MET 182 CO -0.00 0.15 1.24 -1.58 -0.01 0.00 0.00 175.02 174.81 1l2a s HIS 183 N 0.51 2.48 0.06 -0.03 2.46 -0.93 -4.13 115.29 115.70 1l2a s HIS 183 Ca 0.35 1.48 0.07 0.00 0.47 0.00 0.00 55.06 57.43 1l2a s HIS 183 Cb -0.18 -3.54 -0.23 0.00 -0.13 0.00 0.00 32.58 28.50 1l2a s HIS 183 CO 0.18 -2.22 1.05 0.11 -2.47 0.00 0.00 174.74 171.39 1l2a h TRP 184 N 1.31 0.08 -3.47 3.88 5.08 -1.72 -3.35 115.95 117.77 1l2a h TRP 184 Ca -0.50 -0.06 -0.55 0.00 1.08 0.00 0.00 58.89 58.86 1l2a h TRP 184 Cb 1.29 -0.00 -0.33 0.00 -3.00 0.00 0.00 29.16 27.11 1l2a h TRP 184 CO 0.48 1.06 -0.83 -1.17 -1.28 0.00 0.00 178.44 176.71 1l2a s LEU 185 N -6.60 1.75 -0.01 0.11 2.96 -1.26 -0.42 118.68 115.21 1l2a s LEU 185 Ca -0.02 -0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 53.54 1l2a s LEU 185 Cb 0.09 -0.94 0.02 0.00 0.50 0.00 0.00 46.19 45.86 1l2a s LEU 185 CO 0.83 0.07 0.02 -0.32 -1.32 0.00 0.00 176.35 175.63 1l2a s MET 186 N 0.53 -0.02 -0.85 1.98 -2.45 0.03 -2.74 119.30 115.79 1l2a s MET 186 Ca -0.14 0.13 -0.23 0.00 -1.25 0.00 0.00 55.69 54.20 1l2a s MET 186 Cb -0.16 -0.15 0.07 0.00 1.25 0.00 0.00 34.83 35.85 1l2a s MET 186 CO 0.04 -0.11 1.20 0.34 1.05 0.00 0.00 175.02 177.55 1l2a s ASP 187 N 0.67 6.38 0.40 1.11 -1.08 0.12 0.82 116.67 125.10 1l2a s ASP 187 Ca -0.06 -1.29 0.10 0.00 -0.52 0.00 0.00 52.55 50.78 1l2a s ASP 187 Cb -0.08 -2.48 0.89 0.00 -1.46 0.00 0.00 42.92 39.79 1l2a s ASP 187 CO -0.02 -1.44 1.96 0.58 0.52 0.00 0.00 175.17 176.77 1l2a h VAL 188 N 6.17 0.93 0.00 1.11 2.07 -1.83 -1.68 116.25 123.03 1l2a h VAL 188 Ca -0.03 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 1l2a h VAL 188 Cb 1.04 0.31 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1l2a h VAL 188 CO 1.25 0.11 -0.47 0.47 0.02 0.00 0.00 177.57 178.95 1l2a n ASP 189 N -4.48 1.17 -3.78 0.57 8.00 -1.26 -3.12 116.55 113.64 1l2a n ASP 189 Ca 0.11 -2.64 -0.26 0.00 0.71 0.00 0.00 54.79 52.70 1l2a n ASP 189 Cb 0.33 -0.34 0.04 0.00 -0.02 0.00 0.00 41.12 41.13 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 -0.51 -4.12 -0.20 -2.24 5.15 -1.04 -4.50 115.26 107.80 1l2a n ASN 190 Ca 0.09 -0.74 -0.07 0.00 -0.60 0.00 0.00 54.58 53.27 1l2a n ASN 190 Cb 0.77 -4.20 0.03 0.00 -0.53 0.00 0.00 39.78 35.85 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 -2.15 0.78 0.52 1.20 7.01 -1.92 -1.88 115.95 119.51 1l2a h TRP 191 Ca -0.59 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 60.38 1l2a h TRP 191 Cb 1.37 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 28.18 1l2a h TRP 191 CO 0.53 0.55 -0.29 1.88 -2.79 0.00 0.00 178.44 178.32 1l2a h TYR 192 N 0.78 -0.76 0.00 2.65 0.05 -1.95 -3.48 116.97 114.26 1l2a h TYR 192 Ca 0.21 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.97 1l2a h TYR 192 Cb 0.02 0.26 0.00 0.00 1.01 0.00 0.00 36.73 38.02 1l2a h TYR 192 CO -0.02 -0.44 0.00 0.41 -1.05 0.00 0.00 178.16 177.06 1l2a n GLY 193 N -1.38 1.64 0.13 3.88 0.00 -0.71 -4.67 105.19 104.09 1l2a n GLY 193 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1l2a n GLY 193 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1l2a n PHE 194 N -1.02 0.84 -0.66 1.61 3.72 -1.26 -4.78 117.46 115.90 1l2a n PHE 194 Ca 0.00 0.33 0.00 0.00 -0.05 0.00 0.00 57.45 57.73 1l2a n PHE 194 Cb 0.00 -1.03 0.00 0.00 -0.94 0.00 0.00 39.48 37.51 1l2a n PHE 194 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1l2a n GLY 195 N 0.01 1.71 2.78 1.37 0.00 -1.26 -5.06 105.19 104.75 1l2a n GLY 195 Ca 0.02 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 1l2a n GLY 195 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l2a s THR 196 N 2.69 1.10 0.00 2.61 2.01 -1.26 -5.03 115.64 117.75 1l2a s THR 196 Ca 0.00 -1.53 0.00 0.00 0.31 0.00 0.00 61.69 60.47 1l2a s THR 196 Cb 0.00 -1.82 0.00 0.00 0.01 0.00 0.00 72.50 70.69 1l2a s THR 196 CO 0.00 -0.65 0.00 0.61 -0.69 0.00 0.00 174.62 173.89 1l2a n GLY 197 N 4.76 1.02 1.73 4.40 0.00 -1.26 -3.60 105.19 112.24 1l2a n GLY 197 Ca -0.01 -0.78 0.04 0.00 0.00 0.00 0.00 46.02 45.26 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 2.74 -3.34 2.61 5.66 -1.26 -4.72 114.28 115.96 1l2a n THR 198 Ca 0.00 -1.60 -0.39 0.00 -3.05 0.00 0.00 64.05 59.01 1l2a n THR 198 Cb 0.00 -0.30 -0.08 0.00 -1.55 0.00 0.00 70.33 68.40 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 -2.86 4.06 -0.44 1.09 0.52 -1.24 -4.19 118.95 115.89 1l2a s ARG 199 Ca 0.52 0.15 -0.41 0.00 -0.52 0.00 0.00 55.73 55.48 1l2a s ARG 199 Cb 0.41 -3.63 -0.17 0.00 0.52 0.00 0.00 34.95 32.07 1l2a s ARG 199 CO 0.14 -0.25 1.61 0.00 0.02 0.00 0.00 175.30 176.81 1l2a n ALA 200 N 5.23 -0.66 -2.37 2.13 0.00 -1.18 -4.31 120.51 119.35 1l2a n ALA 200 Ca -0.07 0.34 -0.31 0.00 0.00 0.00 0.00 53.44 53.40 1l2a n ALA 200 Cb 0.50 -1.76 -0.15 0.00 0.00 0.00 0.00 19.45 18.05 1l2a n ALA 200 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1l2a s THR 201 N 3.71 2.37 -0.20 0.00 2.01 -0.66 -4.96 115.64 117.91 1l2a s THR 201 Ca 0.98 -1.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.55 1l2a s THR 201 Cb -1.33 -1.90 0.00 0.00 0.01 0.00 0.00 72.50 69.28 1l2a s THR 201 CO 0.67 0.48 1.09 -0.36 -0.69 0.00 0.00 174.62 175.81 1l2a s PHE 202 N -0.74 3.24 0.16 4.92 2.99 -1.26 0.16 117.98 127.44 1l2a s PHE 202 Ca 0.12 1.37 0.06 0.00 0.00 0.00 0.00 56.93 58.48 1l2a s PHE 202 Cb -0.10 -3.32 -0.04 0.00 0.00 0.00 0.00 43.02 39.56 1l2a s PHE 202 CO 0.01 -0.76 -0.13 0.96 -0.00 0.00 0.00 175.22 175.30 1l2a s ILE 203 N 3.14 1.44 0.36 0.64 -4.36 -1.11 -0.48 121.20 120.83 1l2a s ILE 203 Ca 0.47 -1.98 0.04 0.00 -0.26 0.00 0.00 60.65 58.92 1l2a s ILE 203 Cb -0.17 -1.80 -0.05 0.00 1.25 0.00 0.00 42.46 41.69 1l2a s ILE 203 CO 0.09 -0.56 0.07 0.21 0.24 0.00 0.00 174.94 174.99 1l2a s ASN 204 N -2.94 2.70 0.00 4.36 2.47 -0.76 -4.31 114.94 116.46 1l2a s ASN 204 Ca 0.16 -1.47 0.00 0.00 0.42 0.00 0.00 52.86 51.97 1l2a s ASN 204 Cb -0.02 0.09 0.00 0.00 -1.45 0.00 0.00 41.25 39.87 1l2a s ASN 204 CO 0.04 -0.70 0.00 0.35 -3.72 0.00 0.00 177.10 173.07 1l2a n THR 205 N -0.80 0.00 -1.65 -5.21 -2.24 -1.26 -1.87 114.28 101.25 1l2a n THR 205 Ca -0.05 0.00 -0.47 0.00 -2.27 0.00 0.00 64.05 61.26 1l2a n THR 205 Cb 0.66 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.85 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 -2.09 2.07 -0.19 4.78 3.72 -1.26 -4.38 117.46 120.11 1l2a n PHE 206 Ca 0.00 0.37 0.00 0.00 -0.05 0.00 0.00 57.45 57.77 1l2a n PHE 206 Cb 0.00 -2.48 0.00 0.00 -0.94 0.00 0.00 39.48 36.06 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 3.10 1.82 -2.18 -1.08 1.13 -1.26 -5.04 117.38 113.88 1l2a n GLN 207 Ca 0.17 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 54.98 1l2a n GLN 207 Cb 0.26 -0.15 0.01 0.00 0.11 0.00 0.00 30.24 30.48 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 0.00 3.53 0.00 -1.09 1.74 -1.26 -5.03 116.66 114.55 1l2a n ARG 208 Ca 0.00 -4.28 0.00 0.00 -0.77 0.00 0.00 57.85 52.80 1l2a n ARG 208 Cb 0.00 -2.27 0.00 0.00 -1.02 0.00 0.00 32.46 29.17 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 -0.63 -2.13 0.20 -0.13 0.00 -1.26 -3.74 105.19 97.49 1l2a n GLY 209 Ca 0.43 -1.49 0.06 0.00 0.00 0.00 0.00 46.02 45.01 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 -0.33 1.61 4.11 -1.67 -2.93 114.58 115.36 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 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1l2a h GLU 210 CO 0.00 0.35 0.00 1.04 0.07 0.00 0.00 179.01 180.47 1l2a n GLN 211 N -3.69 1.97 -3.11 1.06 1.13 -1.26 -1.55 117.38 111.93 1l2a n GLN 211 Ca -0.01 -1.49 -0.45 0.00 -1.94 0.00 0.00 57.00 53.11 1l2a n GLN 211 Cb 0.45 -1.38 -0.02 0.00 0.11 0.00 0.00 30.24 29.40 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 -1.56 3.60 1.13 -1.09 2.12 -1.11 -4.78 118.70 117.00 1l2a s GLU 212 Ca 0.32 -2.07 -0.18 0.00 0.36 0.00 0.00 54.97 53.39 1l2a s GLU 212 Cb 0.17 -4.69 0.26 0.00 0.26 0.00 0.00 34.13 30.12 1l2a s GLU 212 CO 0.24 -1.55 1.17 -1.54 -0.54 0.00 0.00 175.26 173.03 1l2a s SER 213 N 2.97 1.62 0.55 -1.70 1.04 -1.26 -4.86 113.70 112.06 1l2a s SER 213 Ca 0.26 0.55 0.24 0.00 0.48 0.00 0.00 55.95 57.48 1l2a s SER 213 Cb -0.07 -0.76 1.46 0.00 0.10 0.00 0.00 66.02 66.75 1l2a s SER 213 CO -0.09 -3.68 2.07 0.74 0.98 0.00 0.00 173.24 173.25 1l2a h THR 214 N -2.28 0.70 0.00 2.02 2.02 -1.87 -1.31 112.91 112.19 1l2a h THR 214 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1l2a h THR 214 Cb 1.28 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1l2a h THR 214 CO 0.36 0.00 0.00 0.79 0.37 0.00 0.00 175.52 177.04 1l2a n TRP 215 N -4.21 0.00 -0.01 3.16 7.02 -1.26 -3.83 117.44 118.31 1l2a n TRP 215 Ca 0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 1l2a n TRP 215 Cb 0.38 -0.36 0.01 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 -1.36 2.75 -2.36 -0.99 1.02 -0.49 -4.54 120.64 114.66 1l2a n GLU 216 Ca 0.11 -1.48 -0.26 0.00 -0.02 0.00 0.00 57.16 55.52 1l2a n GLU 216 Cb 0.27 -1.02 0.04 0.00 -0.02 0.00 0.00 31.44 30.71 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 -0.94 3.26 -0.39 2.62 -4.23 -1.24 -4.56 115.64 110.16 1l2a s THR 217 Ca 0.02 -0.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.46 1l2a s THR 217 Cb 0.01 -3.32 0.11 0.00 1.34 0.00 0.00 72.50 70.64 1l2a s THR 217 CO 0.01 -0.32 0.13 -0.63 -0.54 0.00 0.00 174.62 173.26 1l2a s ILE 218 N -3.04 2.13 0.35 2.99 1.01 -1.26 -5.02 121.20 118.35 1l2a s ILE 218 Ca 0.56 -2.51 -0.25 0.00 0.00 0.00 0.00 60.65 58.44 1l2a s ILE 218 Cb -0.11 -2.54 -0.13 0.00 0.01 0.00 0.00 42.46 39.69 1l2a s ILE 218 CO 0.45 -0.68 0.81 -2.65 0.00 0.00 0.00 174.94 172.86 1l2a n PRO 219 N 3.97 0.96 -3.69 2.79 -0.02 -1.26 -4.74 135.00 133.00 1l2a n PRO 219 Ca 0.04 0.34 -0.10 0.00 -2.02 0.00 0.00 63.50 61.76 1l2a n PRO 219 Cb 0.39 -1.69 -0.05 0.00 -0.02 0.00 0.00 33.50 32.13 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 -0.11 0.20 6.00 -3.43 -0.78 -5.01 115.29 110.94 1l2a s HIS 220 Ca 0.62 -0.24 -0.29 0.00 -0.80 0.00 0.00 55.06 54.35 1l2a s HIS 220 Cb -0.67 0.18 -0.08 0.00 -1.43 0.00 0.00 32.58 30.58 1l2a s HIS 220 CO 0.58 -0.66 0.89 -1.25 -2.00 0.00 0.00 174.74 172.30 1l2a s PRO 221 N -3.82 4.76 0.28 -0.38 0.04 -1.26 -1.82 135.00 132.79 1l2a s PRO 221 Ca 0.03 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.43 1l2a s PRO 221 Cb 0.03 -3.28 0.39 0.00 0.04 0.00 0.00 34.50 31.67 1l2a s PRO 221 CO -0.12 0.51 1.92 0.77 0.04 0.00 0.00 177.00 180.12 1l2a h SER 222 N 4.34 0.96 -2.89 6.66 0.02 -1.08 -3.36 113.55 118.20 1l2a h SER 222 Ca -0.45 -0.06 -0.68 0.00 -0.84 0.00 0.00 61.79 59.76 1l2a h SER 222 Cb 1.20 -0.24 -0.18 0.00 0.14 0.00 0.00 62.40 63.32 1l2a h SER 222 CO 0.68 0.74 0.24 -0.63 -1.14 0.00 0.00 176.83 176.72 1l2a s ILE 223 N -5.79 4.67 -0.66 3.27 1.01 -1.26 -2.70 121.20 119.74 1l2a s ILE 223 Ca -0.11 -0.71 -0.23 0.00 0.00 0.00 0.00 60.65 59.59 1l2a s ILE 223 Cb 0.17 -4.52 0.06 0.00 0.01 0.00 0.00 42.46 38.18 1l2a s ILE 223 CO 0.80 -1.18 1.02 -0.70 0.00 0.00 0.00 174.94 174.88 1l2a s GLU 224 N 3.10 3.14 -0.20 2.79 2.56 0.17 -4.85 118.70 125.41 1l2a s GLU 224 Ca 0.15 -0.69 0.15 0.00 0.00 0.00 0.00 54.97 54.59 1l2a s GLU 224 Cb -0.21 -4.21 0.51 0.00 2.00 0.00 0.00 34.13 32.22 1l2a s GLU 224 CO 0.08 -1.85 1.41 0.39 -0.56 0.00 0.00 175.26 174.74 1l2a n GLU 225 N 7.97 2.59 -0.96 4.30 1.02 -1.26 -1.78 120.64 132.52 1l2a n GLU 225 Ca -0.02 -2.88 -0.05 0.00 -0.02 0.00 0.00 57.16 54.18 1l2a n GLU 225 Cb 0.46 -1.82 -0.02 0.00 -0.02 0.00 0.00 31.44 30.04 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 -0.70 -0.12 0.55 -0.32 3.72 -1.26 -4.83 117.46 114.50 1l2a n PHE 226 Ca 0.23 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.76 1l2a n PHE 226 Cb 0.90 -1.97 0.44 0.00 -0.94 0.00 0.00 39.48 37.91 1l2a n PHE 226 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1l2a n LYS 227 N -0.29 0.23 -3.09 -1.08 4.01 -1.26 -4.68 118.16 111.98 1l2a n LYS 227 Ca -0.05 0.28 -0.10 0.00 -0.51 0.00 0.00 58.31 57.93 1l2a n LYS 227 Cb 0.39 -1.82 -0.04 0.00 -0.51 0.00 0.00 35.03 33.06 1l2a n LYS 227 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1l2a n TYR 228 N -2.23 -0.32 -2.17 2.13 4.02 -1.26 -5.02 117.16 112.32 1l2a n TYR 228 Ca 0.04 -1.35 0.00 0.00 -0.01 0.00 0.00 57.90 56.59 1l2a n TYR 228 Cb 0.35 0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1l2a n TYR 228 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l2a n GLY 229 N -0.15 2.18 0.00 2.72 0.00 -0.44 -3.94 105.19 105.56 1l2a n GLY 229 Ca 0.03 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 2.22 0.37 -0.02 0.00 -0.12 -1.56 105.19 106.08 1l2a n GLY 230 Ca 0.00 -1.97 0.01 0.00 0.00 0.00 0.00 46.02 44.07 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 1.19 -0.67 1.61 0.11 -1.89 -2.37 132.00 129.97 1l2a h PRO 231 Ca 0.00 -0.07 -0.30 0.00 0.11 0.00 0.00 66.00 65.73 1l2a h PRO 231 Cb 0.00 -0.27 -0.18 0.00 0.11 0.00 0.00 31.00 30.66 1l2a h PRO 231 CO 0.00 0.79 0.28 0.09 -0.21 0.00 0.00 178.00 178.95 1l2a n ASN 232 N -4.47 3.54 0.00 -2.05 3.02 -1.26 -4.99 115.26 109.04 1l2a n ASN 232 Ca 0.14 -3.55 0.00 0.00 -0.03 0.00 0.00 54.58 51.14 1l2a n ASN 232 Cb 0.13 -0.73 0.00 0.00 -0.61 0.00 0.00 39.78 38.57 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 -0.90 3.01 0.00 7.41 0.00 -0.90 -3.33 105.19 110.49 1l2a n GLY 233 Ca 0.44 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.32 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 13.38 0.00 -0.25 1.61 3.01 -1.26 -0.94 117.46 133.01 1l2a n PHE 234 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.49 1l2a n PHE 234 Cb 0.00 -0.13 0.08 0.00 -0.01 0.00 0.00 39.48 39.41 1l2a n PHE 234 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1l2a n LEU 235 N -1.58 -0.30 0.00 4.37 4.77 -1.21 -0.28 117.00 122.77 1l2a n LEU 235 Ca -0.00 1.17 0.15 0.00 -0.03 0.00 0.00 56.01 57.30 1l2a n LEU 235 Cb 0.23 -0.33 0.90 0.00 -2.33 0.00 0.00 43.42 41.88 1l2a n LEU 235 CO 0.22 -1.10 1.07 -0.90 -1.33 0.00 0.00 177.39 175.35 1l2a n ASP 236 N -5.08 0.00 0.10 -1.43 5.68 -1.26 -1.51 116.55 113.05 1l2a n ASP 236 Ca 0.10 -1.01 -0.04 0.00 -0.50 0.00 0.00 54.79 53.34 1l2a n ASP 236 Cb 0.32 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.42 1l2a n ASP 236 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1l2a h LEU 237 N 0.00 0.16 0.00 -2.12 3.38 -1.00 -3.39 115.31 112.34 1l2a h LEU 237 Ca 0.00 -0.10 -0.17 0.00 0.09 0.00 0.00 57.88 57.70 1l2a h LEU 237 Cb 0.00 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1l2a h LEU 237 CO 0.00 0.77 -1.61 0.49 0.09 0.00 0.00 178.44 178.18 1l2a n PHE 238 N -3.80 0.00 -3.89 1.13 3.72 -0.72 -2.99 117.46 110.90 1l2a n PHE 238 Ca -0.02 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.23 1l2a n PHE 238 Cb 0.65 -0.40 -0.15 0.00 -0.94 0.00 0.00 39.48 38.63 1l2a n PHE 238 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 1l2a s THR 239 N -2.21 0.09 -0.22 4.37 -1.32 -0.57 -1.36 115.64 114.42 1l2a s THR 239 Ca -0.15 0.08 -0.21 0.00 -1.21 0.00 0.00 61.69 60.20 1l2a s THR 239 Cb 0.04 -0.17 -0.02 0.00 -1.51 0.00 0.00 72.50 70.84 1l2a s THR 239 CO 0.23 0.10 0.63 -0.75 -2.21 0.00 0.00 174.62 172.61 1l2a s LYS 240 N 0.71 4.17 0.35 7.08 2.20 0.37 -4.26 119.74 130.36 1l2a s LYS 240 Ca -0.07 0.59 0.09 0.00 -0.36 0.00 0.00 55.97 56.22 1l2a s LYS 240 Cb -0.10 -3.61 -0.06 0.00 -1.51 0.00 0.00 37.83 32.55 1l2a s LYS 240 CO -0.02 -0.32 -0.06 0.34 -0.36 0.00 0.00 175.35 174.94 1l2a s ASP 241 N 1.32 3.84 0.22 1.43 -1.08 -1.26 -1.92 116.67 119.22 1l2a s ASP 241 Ca 0.28 -1.18 -0.04 0.00 -0.52 0.00 0.00 52.55 51.08 1l2a s ASP 241 Cb -0.16 -0.39 0.22 0.00 -1.46 0.00 0.00 42.92 41.13 1l2a s ASP 241 CO 0.09 -0.25 1.65 0.03 0.52 0.00 0.00 175.17 177.22 1l2a h ARG 242 N 1.94 0.77 -3.30 4.34 3.08 -1.97 -3.46 114.38 115.78 1l2a h ARG 242 Ca -0.42 -0.29 -0.10 0.00 0.07 0.00 0.00 59.98 59.24 1l2a h ARG 242 Cb 1.25 -0.04 -0.17 0.00 0.08 0.00 0.00 29.97 31.08 1l2a h ARG 242 CO 0.71 0.90 -0.27 -1.54 -1.07 0.00 0.00 179.97 178.70 1l2a s SER 243 N -6.74 -0.11 0.03 7.04 1.04 -1.26 -5.17 113.70 108.53 1l2a s SER 243 Ca -0.09 -0.18 0.02 0.00 0.48 0.00 0.00 55.95 56.19 1l2a s SER 243 Cb 0.13 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.56 1l2a s SER 243 CO 0.83 -0.59 0.02 -0.31 0.98 0.00 0.00 173.24 174.17 1l2a s TYR 244 N -2.39 3.09 -0.01 5.02 1.51 -1.26 -5.12 117.35 118.20 1l2a s TYR 244 Ca -0.06 0.07 -0.09 0.00 -1.01 0.00 0.00 57.07 55.98 1l2a s TYR 244 Cb -0.01 -1.64 0.01 0.00 -0.11 0.00 0.00 41.96 40.20 1l2a s TYR 244 CO -0.02 0.48 0.18 0.00 -1.11 0.00 0.00 175.55 175.08 1l2a s ALA 245 N -1.18 -0.45 0.36 3.71 0.00 -1.26 -5.13 121.76 117.80 1l2a s ALA 245 Ca 0.22 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.93 1l2a s ALA 245 Cb -0.12 0.07 -0.12 0.00 0.00 0.00 0.00 23.12 22.96 1l2a s ALA 245 CO 0.14 -0.21 1.35 1.63 0.00 0.00 0.00 175.76 178.67 1l2a n LYS 246 N 1.51 2.30 -3.79 0.00 5.02 -1.26 -4.94 118.16 117.00 1l2a n LYS 246 Ca -0.22 0.81 -0.08 0.00 -2.02 0.00 0.00 58.31 56.80 1l2a n LYS 246 Cb 0.56 -2.44 -0.03 0.00 -0.02 0.00 0.00 35.03 33.10 1l2a n LYS 246 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1l2a s GLN 247 N -1.97 1.64 0.20 1.97 -2.07 -0.73 -1.82 119.66 116.88 1l2a s GLN 247 Ca 0.55 -0.92 0.08 0.00 -1.82 0.00 0.00 55.36 53.24 1l2a s GLN 247 Cb -0.54 0.58 -0.05 0.00 -1.09 0.00 0.00 33.01 31.92 1l2a s GLN 247 CO 0.63 -0.74 -0.14 1.67 -1.32 0.00 0.00 175.29 175.38 1l2a s TRP 248 N -3.90 1.68 -0.29 9.60 1.48 -0.41 0.43 118.94 127.53 1l2a s TRP 248 Ca 0.10 -0.58 -0.23 0.00 -1.06 0.00 0.00 56.10 54.34 1l2a s TRP 248 Cb -0.04 -0.79 0.14 0.00 -1.16 0.00 0.00 33.47 31.61 1l2a s TRP 248 CO 0.03 0.33 1.08 -0.98 -4.06 0.00 0.00 176.95 173.35 1l2a s ARG 249 N -3.55 0.42 0.35 3.25 3.03 -1.10 -1.39 118.95 119.97 1l2a s ARG 249 Ca 0.21 0.54 0.08 0.00 2.03 0.00 0.00 55.73 58.58 1l2a s ARG 249 Cb -0.01 0.18 -0.07 0.00 -1.03 0.00 0.00 34.95 34.02 1l2a s ARG 249 CO 0.06 -0.06 -0.04 0.71 -1.13 0.00 0.00 175.30 174.85 1l2a s TYR 250 N 0.42 2.31 -0.08 5.89 2.02 0.86 -4.74 117.35 124.03 1l2a s TYR 250 Ca 0.01 -0.64 -0.04 0.00 -0.37 0.00 0.00 57.07 56.04 1l2a s TYR 250 Cb -0.05 -1.45 0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1l2a s TYR 250 CO -0.09 0.42 0.18 0.99 -1.57 0.00 0.00 175.55 175.48 1l2a s THR 251 N -2.79 -0.10 0.46 -0.71 2.01 -1.26 -1.54 115.64 111.71 1l2a s THR 251 Ca 0.33 0.21 -0.02 0.00 0.31 0.00 0.00 61.69 62.52 1l2a s THR 251 Cb 0.06 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.27 1l2a s THR 251 CO 0.16 0.09 0.72 0.54 -0.69 0.00 0.00 174.62 175.43 1l2a s ASN 252 N 1.43 5.96 -0.38 3.53 4.22 -0.38 -1.94 114.94 127.38 1l2a s ASN 252 Ca -0.07 0.53 0.03 0.00 -2.14 0.00 0.00 52.86 51.21 1l2a s ASN 252 Cb -0.11 -1.81 0.11 0.00 1.28 0.00 0.00 41.25 40.72 1l2a s ASN 252 CO -0.07 -0.67 0.10 0.00 -2.04 0.00 0.00 177.10 174.43 1l2a s ALA 253 N -2.63 3.00 0.57 3.54 0.00 -1.26 -4.32 121.76 120.66 1l2a s ALA 253 Ca 0.48 -2.66 0.28 0.00 0.00 0.00 0.00 51.96 50.06 1l2a s ALA 253 Cb -0.10 -2.06 1.50 0.00 0.00 0.00 0.00 23.12 22.46 1l2a s ALA 253 CO 0.40 -1.76 1.98 -1.35 0.00 0.00 0.00 175.76 175.03 1l2a h PRO 254 N 7.49 0.00 0.00 0.00 0.11 -1.82 0.30 132.00 138.08 1l2a h PRO 254 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1l2a h PRO 254 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1l2a h PRO 254 CO 0.57 0.00 0.00 0.38 -0.21 0.00 0.00 178.00 178.74 1l2a h ASP 255 N 0.00 0.00 0.20 -2.05 2.03 -1.91 -1.45 116.42 113.24 1l2a h ASP 255 Ca 0.20 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.49 1l2a h ASP 255 Cb 0.98 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.48 1l2a h ASP 255 CO -0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 179.24 178.11 1l2a h ALA 256 N 2.01 -0.27 -0.61 4.15 0.00 -1.26 -2.18 119.26 121.10 1l2a h ALA 256 Ca 0.00 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.84 1l2a h ALA 256 Cb 0.34 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.12 1l2a h ALA 256 CO 0.00 -0.30 -0.28 0.93 0.00 0.00 0.00 179.25 179.60 1l2a h GLU 257 N -0.97 -0.11 -0.75 0.00 3.07 -1.65 0.01 114.58 114.19 1l2a h GLU 257 Ca -0.03 0.01 0.12 0.00 -0.50 0.00 0.00 59.36 58.96 1l2a h GLU 257 Cb 0.45 0.03 -0.08 0.00 -0.84 0.00 0.00 28.75 28.30 1l2a h GLU 257 CO 0.05 -0.07 0.34 0.78 -1.40 0.00 0.00 179.01 178.70 1l2a h GLY 258 N -0.11 1.14 1.14 -3.84 0.00 -1.33 -1.31 103.07 98.76 1l2a h GLY 258 Ca 0.26 -0.19 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 1l2a h GLY 258 CO -0.68 -0.02 -0.32 -0.09 0.00 0.00 0.00 176.54 175.43 1l2a h ARG 259 N 0.53 0.95 -0.19 4.80 2.43 -0.62 -0.72 114.38 121.57 1l2a h ARG 259 Ca 0.39 -0.46 0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1l2a h ARG 259 Cb 0.52 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1l2a h ARG 259 CO -0.34 1.13 0.07 0.00 -1.51 0.00 0.00 179.97 179.31 1l2a h ALA 260 N 0.83 0.21 -0.22 2.80 0.00 -0.24 0.20 119.26 122.84 1l2a h ALA 260 Ca 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1l2a h ALA 260 Cb 0.91 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1l2a h ALA 260 CO 0.08 -0.36 0.11 0.82 0.00 0.00 0.00 179.25 179.91 1l2a h ILE 261 N 0.16 1.12 -0.77 0.00 2.04 -1.24 0.12 117.51 118.94 1l2a h ILE 261 Ca 0.08 -0.35 0.17 0.00 1.00 0.00 0.00 64.86 65.77 1l2a h ILE 261 Cb 0.05 0.95 -0.14 0.00 -0.74 0.00 0.00 36.82 36.94 1l2a h ILE 261 CO -0.08 0.12 -0.03 -0.61 0.00 0.00 0.00 178.15 177.55 1l2a h GLN 262 N 0.24 0.08 -0.33 2.37 4.15 -0.83 0.62 115.11 121.41 1l2a h GLN 262 Ca 0.08 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 1l2a h GLN 262 Cb 0.09 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 1l2a h GLN 262 CO -0.01 0.05 -0.08 0.00 -1.93 0.00 0.00 178.83 176.86 1l2a h ALA 263 N 1.73 0.45 -0.51 3.38 0.00 0.48 -2.51 119.26 122.28 1l2a h ALA 263 Ca 0.41 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1l2a h ALA 263 Cb 0.72 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1l2a h ALA 263 CO -0.70 0.29 0.21 0.28 0.00 0.00 0.00 179.25 179.33 1l2a h VAL 264 N 0.41 1.18 -0.71 0.00 2.07 -0.08 0.38 116.25 119.51 1l2a h VAL 264 Ca 0.08 -0.56 0.12 0.00 0.82 0.00 0.00 66.70 67.16 1l2a h VAL 264 Cb 0.58 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 30.84 1l2a h VAL 264 CO 0.03 0.22 0.28 0.22 0.02 0.00 0.00 177.57 178.34 1l2a h TYR 265 N 0.72 0.47 0.06 1.57 3.20 -0.48 0.40 116.97 122.91 1l2a h TYR 265 Ca 0.17 0.03 -0.27 0.00 3.14 0.00 0.00 58.73 61.81 1l2a h TYR 265 Cb 0.13 -0.10 0.02 0.00 1.54 0.00 0.00 36.73 38.31 1l2a h TYR 265 CO 0.01 0.08 -1.11 -1.49 -1.64 0.00 0.00 178.16 174.01 1l2a h TRP 266 N 0.44 0.81 0.28 -3.82 4.06 -0.69 0.01 115.95 117.04 1l2a h TRP 266 Ca 0.38 -0.48 0.00 0.00 2.06 0.00 0.00 58.89 60.85 1l2a h TRP 266 Cb 0.53 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.59 1l2a h TRP 266 CO -0.17 1.33 -0.39 0.00 -3.56 0.00 0.00 178.44 175.65 1l2a h ALA 267 N 0.50 -0.78 -0.47 1.49 0.00 0.25 -0.16 119.26 120.09 1l2a h ALA 267 Ca -0.13 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.76 1l2a h ALA 267 Cb 1.77 0.60 -0.10 0.00 0.00 0.00 0.00 17.79 20.06 1l2a h ALA 267 CO 0.20 -0.99 -0.20 -0.97 0.00 0.00 0.00 179.25 177.30 1l2a h ASN 268 N -0.73 -0.69 -0.52 0.00 -0.00 -0.15 0.27 115.58 113.77 1l2a h ASN 268 Ca -0.01 0.17 -0.09 0.00 -0.00 0.00 0.00 56.30 56.37 1l2a h ASN 268 Cb 0.69 0.39 -0.02 0.00 -0.00 0.00 0.00 38.32 39.37 1l2a h ASN 268 CO -0.13 -0.23 0.01 0.50 -0.00 0.00 0.00 177.43 177.58 1l2a h LYS 269 N -0.09 0.95 -0.05 6.67 3.64 -0.70 -0.55 116.57 126.43 1l2a h LYS 269 Ca 0.23 -0.28 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 1l2a h LYS 269 Cb 0.44 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1l2a h LYS 269 CO -0.54 0.93 -0.14 -1.49 -2.27 0.00 0.00 179.45 175.95 1l2a h TRP 270 N 0.88 0.24 0.12 1.91 6.55 -0.36 -0.46 115.95 124.83 1l2a h TRP 270 Ca 0.16 -0.10 0.02 0.00 0.95 0.00 0.00 58.89 59.93 1l2a h TRP 270 Cb 0.50 -0.04 -0.05 0.00 -0.86 0.00 0.00 29.16 28.72 1l2a h TRP 270 CO 0.03 0.75 -0.42 0.00 -1.05 0.00 0.00 178.44 177.75 1l2a h ALA 271 N 0.44 -0.75 -1.00 1.49 0.00 -0.42 -0.54 119.26 118.48 1l2a h ALA 271 Ca -0.00 -0.07 0.23 0.00 0.00 0.00 0.00 54.91 55.07 1l2a h ALA 271 Cb 0.75 0.71 -0.09 0.00 0.00 0.00 0.00 17.79 19.16 1l2a h ALA 271 CO 0.03 -0.99 0.63 0.87 0.00 0.00 0.00 179.25 179.79 1l2a h LYS 272 N -0.66 0.49 0.00 0.00 1.57 -1.14 0.15 116.57 116.99 1l2a h LYS 272 Ca 0.02 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1l2a h LYS 272 Cb 0.68 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1l2a h LYS 272 CO -0.25 0.33 -0.12 0.93 -0.57 0.00 0.00 179.45 179.76 1l2a h GLU 273 N 0.51 0.00 0.00 3.15 5.08 0.42 -2.53 114.58 121.21 1l2a h GLU 273 Ca 0.57 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.85 1l2a h GLU 273 Cb 1.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1l2a h GLU 273 CO -0.31 0.12 -1.02 1.96 -1.00 0.00 0.00 179.01 178.76 1l2a h GLN 274 N 0.00 0.00 0.00 2.33 4.20 0.47 -3.48 115.11 118.63 1l2a h GLN 274 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1l2a h GLN 274 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1l2a h GLN 274 CO 0.02 0.19 0.00 0.41 -0.67 0.00 0.00 178.83 178.77 1l2a n GLY 275 N 1.27 1.48 1.05 3.46 0.00 -0.48 -5.01 105.19 106.96 1l2a n GLY 275 Ca -0.03 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.21 0.88 -0.20 1.61 5.02 -0.17 -4.86 118.16 119.23 1l2a n LYS 276 Ca 0.00 -2.72 0.30 0.00 -2.02 0.00 0.00 58.31 53.87 1l2a n LYS 276 Cb 0.10 -0.88 0.73 0.00 -0.02 0.00 0.00 35.03 34.95 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 1.03 0.00 1.79 0.72 0.00 -1.85 -0.50 103.07 104.26 1l2a h GLY 277 Ca -0.10 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1l2a h GLY 277 CO 0.06 0.00 -0.10 1.48 0.00 0.00 0.00 176.54 177.97 1l2a h SER 278 N 0.00 0.24 1.29 0.19 4.64 -1.92 -3.17 113.55 114.82 1l2a h SER 278 Ca 0.45 -0.05 -0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1l2a h SER 278 Cb 1.84 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.87 1l2a h SER 278 CO -0.00 0.38 -0.01 0.00 -0.87 0.00 0.00 176.83 176.32 1l2a h ALA 279 N 1.65 1.00 -0.07 5.18 0.00 -1.50 -3.06 119.26 122.47 1l2a h ALA 279 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1l2a h ALA 279 Cb 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1l2a h ALA 279 CO 0.02 0.01 0.00 1.33 0.00 0.00 0.00 179.25 180.61 1l2a n VAL 280 N -3.10 0.37 -0.35 0.00 0.24 -1.22 -4.82 118.33 109.45 1l2a n VAL 280 Ca 0.02 -0.69 0.14 0.00 -2.04 0.00 0.00 64.34 61.77 1l2a n VAL 280 Cb 0.37 0.88 0.34 0.00 -1.47 0.00 0.00 33.84 33.97 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 1.02 1.71 0.00 2.33 0.00 -1.51 -1.01 119.26 121.80 1l2a h ALA 281 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1l2a h ALA 281 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1l2a h ALA 281 CO 0.00 -0.11 -0.46 0.66 0.00 0.00 0.00 179.25 179.34 1l2a h SER 282 N 0.72 0.00 -0.03 0.00 4.64 -1.87 -2.37 113.55 114.62 1l2a h SER 282 Ca 0.60 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.90 1l2a h SER 282 Cb 0.99 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1l2a h SER 282 CO -0.40 0.21 -0.04 0.58 -0.87 0.00 0.00 176.83 176.31 1l2a h VAL 283 N 0.00 1.39 -0.53 0.95 2.07 -1.58 -2.86 116.25 115.68 1l2a h VAL 283 Ca -0.02 -1.23 0.10 0.00 0.82 0.00 0.00 66.70 66.37 1l2a h VAL 283 Cb 1.18 2.14 -0.11 0.00 -1.52 0.00 0.00 31.29 32.98 1l2a h VAL 283 CO 0.02 0.33 -0.34 0.58 0.02 0.00 0.00 177.57 178.19 1l2a h VAL 284 N -0.39 0.18 -0.86 2.57 2.07 -1.29 0.49 116.25 119.02 1l2a h VAL 284 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1l2a h VAL 284 Cb 0.55 0.18 -0.09 0.00 -1.52 0.00 0.00 31.29 30.42 1l2a h VAL 284 CO 0.01 0.00 0.47 -1.28 0.02 0.00 0.00 177.57 176.79 1l2a h SER 285 N -0.19 0.62 0.02 0.57 0.87 -1.49 -0.38 113.55 113.58 1l2a h SER 285 Ca 0.21 0.07 -0.22 0.00 -1.23 0.00 0.00 61.79 60.63 1l2a h SER 285 Cb 0.55 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1l2a h SER 285 CO -0.64 0.30 -0.81 0.11 -0.53 0.00 0.00 176.83 175.26 1l2a h LYS 286 N 0.71 0.65 -0.57 2.24 1.57 -0.89 -2.70 116.57 117.59 1l2a h LYS 286 Ca 0.45 -0.56 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1l2a h LYS 286 Cb 0.56 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 1l2a h LYS 286 CO -0.32 1.17 0.31 0.00 -0.57 0.00 0.00 179.45 180.05 1l2a h ALA 287 N 0.66 0.72 -0.47 3.86 0.00 -0.65 -0.72 119.26 122.66 1l2a h ALA 287 Ca -0.06 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.84 1l2a h ALA 287 Cb 1.43 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1l2a h ALA 287 CO 0.16 0.24 0.03 0.00 0.00 0.00 0.00 179.25 179.68 1l2a h ALA 288 N 1.14 0.47 -0.54 0.00 0.00 -1.01 0.30 119.26 119.62 1l2a h ALA 288 Ca 0.20 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1l2a h ALA 288 Cb 0.04 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1l2a h ALA 288 CO -0.03 -0.36 0.24 -0.22 0.00 0.00 0.00 179.25 178.88 1l2a h LYS 289 N 0.15 0.79 -0.43 0.00 3.64 -1.13 -1.53 116.57 118.06 1l2a h LYS 289 Ca 0.24 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1l2a h LYS 289 Cb 0.34 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1l2a h LYS 289 CO -0.36 0.67 0.28 1.98 -2.27 0.00 0.00 179.45 179.75 1l2a h MET 290 N 0.73 0.56 -0.74 1.90 4.05 -0.15 -1.49 114.93 119.79 1l2a h MET 290 Ca 0.18 -0.03 0.13 0.00 -0.28 0.00 0.00 59.70 59.70 1l2a h MET 290 Cb 0.15 -0.13 -0.09 0.00 -0.80 0.00 0.00 31.60 30.74 1l2a h MET 290 CO -0.02 0.37 0.31 0.78 0.23 0.00 0.00 176.91 178.58 1l2a h GLY 291 N 0.58 1.11 1.00 1.39 0.00 -0.11 -1.80 103.07 105.25 1l2a h GLY 291 Ca 0.16 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 1l2a h GLY 291 CO -0.04 -0.06 0.38 -1.80 0.00 0.00 0.00 176.54 175.03 1l2a h ASP 292 N 0.48 0.76 0.89 0.19 1.82 -0.32 -2.11 116.42 118.13 1l2a h ASP 292 Ca 0.39 -0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.96 1l2a h ASP 292 Cb 0.55 -0.19 -0.00 0.00 0.68 0.00 0.00 39.33 40.37 1l2a h ASP 292 CO -0.37 0.59 -0.07 -0.26 -1.61 0.00 0.00 179.24 177.53 1l2a h PHE 293 N 0.86 0.00 0.00 0.28 -1.00 -0.52 -2.58 116.94 113.98 1l2a h PHE 293 Ca 0.23 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.01 1l2a h PHE 293 Cb -0.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.53 1l2a h PHE 293 CO -0.02 0.07 0.00 1.25 -1.61 0.00 0.00 178.31 178.00 1l2a h LEU 294 N 0.00 0.00 -2.69 1.54 5.85 -0.69 -1.71 115.31 117.62 1l2a h LEU 294 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1l2a h LEU 294 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1l2a h LEU 294 CO 0.01 0.00 0.10 0.03 -0.34 0.00 0.00 178.44 178.24 1l2a h ARG 295 N 0.00 0.00 0.00 1.25 3.08 -1.53 -1.11 114.38 116.07 1l2a h ARG 295 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1l2a h ARG 295 Cb 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.22 1l2a h ARG 295 CO 0.00 0.00 -0.10 -0.91 -1.07 0.00 0.00 179.97 177.89 1l2a h ASN 296 N 0.00 0.00 0.00 7.04 2.35 -1.55 -2.04 115.58 121.38 1l2a h ASN 296 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1l2a h ASN 296 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1l2a h ASN 296 CO 0.00 0.10 0.00 0.47 -1.65 0.00 0.00 177.43 176.35 1l2a n ASP 297 N -3.76 0.00 -0.87 5.81 8.00 -0.42 -3.85 116.55 121.45 1l2a n ASP 297 Ca -0.02 -0.98 0.11 0.00 0.71 0.00 0.00 54.79 54.61 1l2a n ASP 297 Cb 0.20 -0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.58 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 -1.00 2.14 -4.35 -1.24 2.81 -0.77 -1.75 117.12 112.97 1l2a n MET 298 Ca 0.24 -1.73 -0.30 0.00 -1.81 0.00 0.00 57.70 54.10 1l2a n MET 298 Cb 0.11 -1.45 -0.11 0.00 -0.71 0.00 0.00 33.22 31.06 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 -1.63 2.65 0.47 2.03 0.40 -1.25 -0.63 117.98 120.03 1l2a s PHE 299 Ca 0.35 -0.20 -0.23 0.00 -0.60 0.00 0.00 56.93 56.25 1l2a s PHE 299 Cb 0.20 -1.42 -0.09 0.00 0.51 0.00 0.00 43.02 42.22 1l2a s PHE 299 CO 0.29 0.38 1.06 -3.47 0.70 0.00 0.00 175.22 174.18 1l2a n ASP 300 N 0.95 1.45 -0.34 1.36 2.03 -0.41 -1.54 116.55 120.05 1l2a n ASP 300 Ca -0.15 0.99 0.02 0.00 0.52 0.00 0.00 54.79 56.18 1l2a n ASP 300 Cb 0.52 -1.40 0.09 0.00 -0.72 0.00 0.00 41.12 39.62 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 1.38 -0.01 -0.26 -0.67 3.64 -1.74 -2.04 116.57 116.86 1l2a h LYS 301 Ca -0.46 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.76 1l2a h LYS 301 Cb 1.33 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 33.06 1l2a h LYS 301 CO 0.56 -0.01 -0.31 0.66 -2.27 0.00 0.00 179.45 178.08 1l2a n TYR 302 N -5.55 0.84 -3.82 1.91 4.01 -1.26 -2.35 117.16 110.94 1l2a n TYR 302 Ca 0.12 -1.66 -0.28 0.00 -0.16 0.00 0.00 57.90 55.92 1l2a n TYR 302 Cb 0.44 -0.40 0.04 0.00 -0.31 0.00 0.00 39.34 39.11 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 -1.08 -2.45 -2.39 -0.72 3.01 -0.77 -2.44 117.46 110.62 1l2a n PHE 303 Ca 0.29 0.94 -0.31 0.00 1.01 0.00 0.00 57.45 59.38 1l2a n PHE 303 Cb 0.88 -4.30 -0.02 0.00 -0.01 0.00 0.00 39.48 36.04 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 -6.50 3.74 0.23 -1.08 -1.94 -1.26 -0.77 119.30 111.71 1l2a s MET 304 Ca 0.61 0.65 -0.32 0.00 -1.71 0.00 0.00 55.69 54.92 1l2a s MET 304 Cb -0.29 -2.22 -0.13 0.00 2.01 0.00 0.00 34.83 34.19 1l2a s MET 304 CO 0.80 -0.29 1.52 1.63 -0.01 0.00 0.00 175.02 178.67 1l2a n LYS 305 N -1.97 2.27 -1.72 2.03 5.02 0.43 -4.33 118.16 119.89 1l2a n LYS 305 Ca 0.04 0.81 -0.42 0.00 -2.02 0.00 0.00 58.31 56.73 1l2a n LYS 305 Cb 0.54 -2.54 -0.03 0.00 -0.02 0.00 0.00 35.03 32.98 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 0.33 2.59 0.00 -0.18 -1.09 -0.48 -2.11 121.20 120.26 1l2a s ILE 306 Ca 0.71 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 59.19 1l2a s ILE 306 Cb -0.61 -3.04 0.00 0.00 -1.58 0.00 0.00 42.46 37.23 1l2a s ILE 306 CO 0.45 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 1l2a n GLY 307 N 4.25 0.41 0.32 6.18 0.00 -1.24 -4.95 105.19 110.17 1l2a n GLY 307 Ca 0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 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 1.53 -4.93 4.61 0.00 -1.71 -3.45 119.26 115.30 1l2a h ALA 308 Ca 0.00 0.14 -0.36 0.00 0.00 0.00 0.00 54.91 54.69 1l2a h ALA 308 Cb 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1l2a h ALA 308 CO 0.00 -0.29 -0.53 1.04 0.00 0.00 0.00 179.25 179.47 1l2a n GLN 309 N -4.98 -3.52 0.00 0.00 6.02 -1.26 -4.85 117.38 108.79 1l2a n GLN 309 Ca 0.23 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.82 1l2a n GLN 309 Cb 0.66 -5.32 0.00 0.00 1.02 0.00 0.00 30.24 26.60 1l2a n GLN 309 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1l2a n ASP 310 N -2.26 0.00 -3.39 1.08 -0.08 -1.16 -3.70 116.55 107.05 1l2a n ASP 310 Ca -0.06 0.00 -0.40 0.00 -1.51 0.00 0.00 54.79 52.82 1l2a n ASP 310 Cb 0.57 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 44.01 1l2a n ASP 310 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1l2a n LYS 311 N -0.11 3.80 -3.12 -0.67 5.02 -1.26 -4.84 118.16 116.98 1l2a n LYS 311 Ca 0.00 -2.50 -0.41 0.00 -2.02 0.00 0.00 58.31 53.37 1l2a n LYS 311 Cb 0.00 -2.81 -0.07 0.00 -0.02 0.00 0.00 35.03 32.13 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 1.59 4.92 0.33 -0.18 2.01 -1.26 -4.87 115.64 118.18 1l2a s THR 312 Ca 0.64 0.73 -0.28 0.00 0.31 0.00 0.00 61.69 63.09 1l2a s THR 312 Cb 0.18 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.56 1l2a s THR 312 CO -0.07 -0.21 1.24 -2.84 -0.69 0.00 0.00 174.62 172.05 1l2a s PRO 313 N 2.64 4.35 0.21 4.92 0.02 -1.26 -0.43 135.00 145.45 1l2a s PRO 313 Ca 0.25 2.06 0.05 0.00 0.02 0.00 0.00 61.00 63.37 1l2a s PRO 313 Cb -0.15 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.32 1l2a s PRO 313 CO 0.13 -0.13 0.28 0.00 -0.33 0.00 0.00 177.00 176.95 1l2a s ALA 314 N -1.19 3.84 -0.14 -1.55 0.00 0.05 -4.57 121.76 118.19 1l2a s ALA 314 Ca 0.50 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 1l2a s ALA 314 Cb -0.36 -1.63 -0.07 0.00 0.00 0.00 0.00 23.12 21.05 1l2a s ALA 314 CO 0.48 0.36 -0.16 0.25 0.00 0.00 0.00 175.76 176.69 1l2a n THR 315 N -0.99 0.80 0.00 0.00 -2.24 -1.26 -1.45 114.28 109.13 1l2a n THR 315 Ca -0.08 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1l2a n THR 315 Cb 0.56 -1.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.40 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 2.41 0.42 1.03 3.38 0.00 -1.26 -4.65 105.19 106.52 1l2a n GLY 316 Ca -0.27 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.80 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 0.87 0.29 1.61 4.01 -1.26 -4.36 117.16 118.32 1l2a n TYR 317 Ca 0.00 -0.33 0.07 0.00 -0.16 0.00 0.00 57.90 57.48 1l2a n TYR 317 Cb 0.00 -0.20 0.33 0.00 -0.31 0.00 0.00 39.34 39.15 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 0.42 0.27 -0.96 7.72 9.92 -1.26 -0.88 116.55 131.78 1l2a n ASP 318 Ca 0.14 0.59 0.12 0.00 -0.53 0.00 0.00 54.79 55.11 1l2a n ASP 318 Cb 0.59 -0.64 0.14 0.00 -0.64 0.00 0.00 41.12 40.58 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 -1.82 2.98 -4.68 -2.24 3.41 -1.26 -1.39 113.62 108.62 1l2a n SER 319 Ca 0.01 -1.97 -0.41 0.00 -0.26 0.00 0.00 58.87 56.25 1l2a n SER 319 Cb 0.12 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 63.98 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 -1.92 3.45 -0.79 7.33 0.00 -0.06 -1.29 121.76 128.49 1l2a s ALA 320 Ca 0.30 0.04 0.23 0.00 0.00 0.00 0.00 51.96 52.53 1l2a s ALA 320 Cb 0.20 -3.11 0.12 0.00 0.00 0.00 0.00 23.12 20.33 1l2a s ALA 320 CO 0.30 -0.46 1.11 -2.39 0.00 0.00 0.00 175.76 174.33 1l2a n HIS 321 N 4.72 0.15 -1.50 0.00 1.44 0.20 -4.87 115.22 115.36 1l2a n HIS 321 Ca 0.02 0.04 -0.17 0.00 -2.01 0.00 0.00 57.72 55.60 1l2a n HIS 321 Cb 0.50 -0.31 -0.07 0.00 0.12 0.00 0.00 29.99 30.23 1l2a n HIS 321 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1l2a n TYR 322 N -1.75 0.00 -3.95 -1.40 4.01 -0.92 -4.99 117.16 108.15 1l2a n TYR 322 Ca 0.03 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.56 1l2a n TYR 322 Cb 0.39 -3.07 -0.04 0.00 -0.31 0.00 0.00 39.34 36.30 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 -3.90 3.62 -0.64 7.72 1.43 -1.26 -4.51 118.68 121.15 1l2a s LEU 323 Ca 0.00 -0.45 -0.27 0.00 -1.03 0.00 0.00 54.13 52.38 1l2a s LEU 323 Cb 0.00 -2.20 0.01 0.00 0.03 0.00 0.00 46.19 44.04 1l2a s LEU 323 CO 0.00 -0.23 1.46 -0.04 0.23 0.00 0.00 176.35 177.77 1l2a s MET 324 N -3.92 3.12 1.17 1.70 -1.94 -1.26 -3.77 119.30 114.39 1l2a s MET 324 Ca 0.38 0.23 -0.18 0.00 -1.71 0.00 0.00 55.69 54.41 1l2a s MET 324 Cb -0.06 -4.20 0.27 0.00 2.01 0.00 0.00 34.83 32.85 1l2a s MET 324 CO 0.25 -2.19 1.12 0.00 -0.01 0.00 0.00 175.02 174.20 1l2a s ALA 325 N 6.59 0.76 0.54 3.03 0.00 -0.72 -4.44 121.76 127.52 1l2a s ALA 325 Ca 0.49 -0.92 0.21 0.00 0.00 0.00 0.00 51.96 51.74 1l2a s ALA 325 Cb -0.10 -2.90 1.42 0.00 0.00 0.00 0.00 23.12 21.54 1l2a s ALA 325 CO 0.20 -3.44 2.15 2.35 0.00 0.00 0.00 175.76 177.02 1l2a h TRP 326 N -2.45 0.00 -1.26 0.00 2.91 -1.63 -3.42 115.95 110.08 1l2a h TRP 326 Ca -0.46 0.00 0.33 0.00 1.13 0.00 0.00 58.89 59.89 1l2a h TRP 326 Cb 1.29 0.00 -0.16 0.00 -0.51 0.00 0.00 29.16 29.79 1l2a h TRP 326 CO -1.85 0.00 0.90 1.52 -1.03 0.00 0.00 178.44 177.97 1l2a s TYR 327 N -4.95 -0.04 0.11 2.65 -0.85 -1.26 -4.35 117.35 108.64 1l2a s TYR 327 Ca -0.05 -0.00 0.08 0.00 -0.52 0.00 0.00 57.07 56.58 1l2a s TYR 327 Cb 0.17 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.99 1l2a s TYR 327 CO 0.65 -0.14 -0.16 0.95 -1.52 0.00 0.00 175.55 175.32 1l2a s THR 328 N -2.25 2.97 0.02 -3.49 -4.23 -1.26 -3.40 115.64 104.00 1l2a s THR 328 Ca 0.13 -1.41 0.05 0.00 -1.18 0.00 0.00 61.69 59.28 1l2a s THR 328 Cb 0.03 -2.36 -0.02 0.00 1.34 0.00 0.00 72.50 71.50 1l2a s THR 328 CO -0.04 0.13 -0.14 0.00 -0.54 0.00 0.00 174.62 174.02 1l2a s ALA 329 N -1.14 1.19 -0.01 3.99 0.00 -0.96 -1.25 121.76 123.59 1l2a s ALA 329 Ca 0.18 -0.74 -0.10 0.00 0.00 0.00 0.00 51.96 51.30 1l2a s ALA 329 Cb -0.11 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.79 1l2a s ALA 329 CO 0.10 0.26 0.22 1.67 0.00 0.00 0.00 175.76 178.00 1l2a s TRP 330 N -0.63 -0.07 0.39 0.00 -2.14 -0.59 -0.75 118.94 115.14 1l2a s TRP 330 Ca 0.03 0.09 -0.14 0.00 2.66 0.00 0.00 56.10 58.75 1l2a s TRP 330 Cb -0.07 0.02 0.05 0.00 -3.10 0.00 0.00 33.47 30.38 1l2a s TRP 330 CO 0.01 -0.31 0.77 0.20 -2.66 0.00 0.00 176.95 174.95 1l2a s GLY 331 N -1.23 0.49 0.17 3.67 0.00 -0.99 -0.10 107.32 109.33 1l2a s GLY 331 Ca -0.13 -0.84 -0.23 0.00 0.00 0.00 0.00 44.72 43.52 1l2a s GLY 331 CO 0.03 -0.38 0.70 -0.32 0.00 0.00 0.00 173.10 173.13 1l2a s GLY 332 N -3.09 -0.42 0.52 0.20 0.00 -0.48 -1.39 107.32 102.66 1l2a s GLY 332 Ca 0.17 0.31 -0.22 0.00 0.00 0.00 0.00 44.72 44.98 1l2a s GLY 332 CO 0.12 0.10 1.31 -0.32 0.00 0.00 0.00 173.10 174.32 1l2a s GLY 333 N -2.78 2.86 -0.19 0.20 0.00 -0.83 -1.29 107.32 105.29 1l2a s GLY 333 Ca 0.05 1.24 -0.17 0.00 0.00 0.00 0.00 44.72 45.84 1l2a s GLY 333 CO -0.06 1.75 0.21 1.39 0.00 0.00 0.00 173.10 176.39 1l2a n ILE 334 N -0.86 1.60 0.95 0.90 5.41 -0.76 -4.39 119.36 122.21 1l2a n ILE 334 Ca 0.09 -0.22 0.04 0.00 1.00 0.00 0.00 62.75 63.67 1l2a n ILE 334 Cb 0.46 -1.94 0.13 0.00 -0.71 0.00 0.00 39.64 37.57 1l2a n ILE 334 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1l2a n GLY 335 N 1.58 0.64 3.66 7.39 0.00 -1.26 -4.93 105.19 112.27 1l2a n GLY 335 Ca -0.34 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.63 -1.52 -0.47 4.61 0.00 -1.26 -5.13 121.76 116.36 1l2a s ALA 336 Ca 0.19 0.21 -0.12 0.00 0.00 0.00 0.00 51.96 52.25 1l2a s ALA 336 Cb 0.11 0.74 0.10 0.00 0.00 0.00 0.00 23.12 24.06 1l2a s ALA 336 CO 0.12 -0.92 0.36 -1.12 0.00 0.00 0.00 175.76 174.20 1l2a s SER 337 N -2.81 5.89 0.15 0.00 0.01 -1.26 -4.29 113.70 111.38 1l2a s SER 337 Ca 0.08 -1.61 -0.21 0.00 1.31 0.00 0.00 55.95 55.52 1l2a s SER 337 Cb -0.03 -2.09 0.06 0.00 0.21 0.00 0.00 66.02 64.18 1l2a s SER 337 CO -0.02 -0.66 0.55 -1.66 0.41 0.00 0.00 173.24 171.86 1l2a s TRP 338 N 1.50 -0.45 0.16 2.43 1.48 -1.26 -4.98 118.94 117.81 1l2a s TRP 338 Ca 0.04 0.23 -0.17 0.00 -1.06 0.00 0.00 56.10 55.15 1l2a s TRP 338 Cb -0.25 0.48 0.03 0.00 -1.16 0.00 0.00 33.47 32.57 1l2a s TRP 338 CO 0.03 -0.80 0.46 0.00 -4.06 0.00 0.00 176.95 172.57 1l2a s ALA 339 N -3.69 -0.94 0.16 2.67 0.00 -1.26 -1.97 121.76 116.73 1l2a s ALA 339 Ca 0.01 -0.11 -0.12 0.00 0.00 0.00 0.00 51.96 51.74 1l2a s ALA 339 Cb -0.00 0.78 0.01 0.00 0.00 0.00 0.00 23.12 23.90 1l2a s ALA 339 CO -0.12 -0.71 0.36 1.67 0.00 0.00 0.00 175.76 176.96 1l2a s TRP 340 N -3.83 0.14 -0.16 0.00 1.48 -0.48 -4.56 118.94 111.51 1l2a s TRP 340 Ca 0.06 -0.50 -0.14 0.00 -1.06 0.00 0.00 56.10 54.46 1l2a s TRP 340 Cb 0.01 0.12 0.04 0.00 -1.16 0.00 0.00 33.47 32.48 1l2a s TRP 340 CO -0.08 -0.76 0.43 0.21 -4.06 0.00 0.00 176.95 172.69 1l2a s LYS 341 N -3.91 0.49 0.06 3.25 2.20 -0.41 -2.34 119.74 119.08 1l2a s LYS 341 Ca 0.11 0.61 0.05 0.00 -0.36 0.00 0.00 55.97 56.39 1l2a s LYS 341 Cb 0.02 0.22 -0.03 0.00 -1.51 0.00 0.00 37.83 36.53 1l2a s LYS 341 CO -0.04 -0.07 -0.14 0.96 -0.36 0.00 0.00 175.35 175.70 1l2a s ILE 342 N 0.34 1.13 0.00 5.43 -4.36 0.07 -4.02 121.20 119.79 1l2a s ILE 342 Ca -0.01 -1.19 0.00 0.00 -0.26 0.00 0.00 60.65 59.19 1l2a s ILE 342 Cb -0.03 -1.06 0.00 0.00 1.25 0.00 0.00 42.46 42.62 1l2a s ILE 342 CO -0.01 -0.13 0.00 0.61 0.24 0.00 0.00 174.94 175.66 1l2a n GLY 343 N 1.53 1.36 3.40 6.27 0.00 -0.99 -2.25 105.19 114.51 1l2a n GLY 343 Ca -0.20 -1.58 -0.14 0.00 0.00 0.00 0.00 46.02 44.10 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 2.65 0.32 -4.50 0.00 7.64 -1.26 -3.95 113.62 114.53 1l2a n SER 345 Ca -0.14 0.02 -0.34 0.00 1.01 0.00 0.00 58.87 59.43 1l2a n SER 345 Cb 0.56 -0.02 -0.12 0.00 -1.01 0.00 0.00 64.21 63.62 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 -3.00 2.93 0.04 1.43 3.76 -1.26 -0.83 115.29 118.36 1l2a s HIS 346 Ca 0.12 -0.26 0.04 0.00 -0.15 0.00 0.00 55.06 54.82 1l2a s HIS 346 Cb 0.18 -1.83 -0.02 0.00 1.11 0.00 0.00 32.58 32.02 1l2a s HIS 346 CO 0.64 0.07 -0.13 0.00 -0.85 0.00 0.00 174.74 174.47 1l2a s ALA 347 N -0.10 1.06 -0.06 -1.40 0.00 -0.38 -1.75 121.76 119.13 1l2a s ALA 347 Ca 0.01 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1l2a s ALA 347 Cb -0.13 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1l2a s ALA 347 CO 0.03 0.18 -0.13 -1.58 0.00 0.00 0.00 175.76 174.25 1l2a s HIS 348 N -0.96 1.48 0.47 0.00 5.04 -1.26 -2.02 115.29 118.04 1l2a s HIS 348 Ca -0.01 -0.50 0.20 0.00 -1.54 0.00 0.00 55.06 53.22 1l2a s HIS 348 Cb -0.08 -1.05 1.20 0.00 0.04 0.00 0.00 32.58 32.69 1l2a s HIS 348 CO 0.01 -0.23 1.94 0.27 -2.34 0.00 0.00 174.74 174.40 1l2a h PHE 349 N 6.71 0.28 0.00 3.88 -0.00 -1.16 -1.81 116.94 124.84 1l2a h PHE 349 Ca -0.31 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.67 1l2a h PHE 349 Cb 1.18 -0.09 0.00 0.00 -0.00 0.00 0.00 35.95 37.04 1l2a h PHE 349 CO 0.47 0.11 0.00 0.78 -0.00 0.00 0.00 178.31 179.66 1l2a h GLY 350 N 0.24 0.00 -0.06 6.09 0.00 -1.85 -2.24 103.07 105.25 1l2a h GLY 350 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1l2a h GLY 350 CO -0.07 0.00 -0.92 -1.72 0.00 0.00 0.00 176.54 173.83 1l2a n TYR 351 N -2.45 0.00 -2.38 5.60 4.02 -0.68 -4.54 117.16 116.73 1l2a n TYR 351 Ca -0.01 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.51 1l2a n TYR 351 Cb 0.09 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.38 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 -2.94 3.99 -0.40 -0.72 -1.52 -0.85 -4.41 119.66 112.81 1l2a s GLN 352 Ca 0.09 1.68 0.03 0.00 -1.95 0.00 0.00 55.36 55.21 1l2a s GLN 352 Cb 0.16 -2.52 0.16 0.00 -0.22 0.00 0.00 33.01 30.59 1l2a s GLN 352 CO 0.83 -0.33 0.30 1.21 -0.25 0.00 0.00 175.29 177.05 1l2a s ASN 353 N -1.39 2.14 0.30 5.90 3.84 -1.26 -4.88 114.94 119.58 1l2a s ASN 353 Ca 0.60 -2.80 0.25 0.00 0.21 0.00 0.00 52.86 51.13 1l2a s ASN 353 Cb -0.26 -0.49 1.00 0.00 -0.55 0.00 0.00 41.25 40.94 1l2a s ASN 353 CO 0.33 -0.22 1.76 1.55 -2.79 0.00 0.00 177.10 177.73 1l2a h PRO 354 N 6.12 0.00 0.24 0.43 0.13 -1.89 -0.81 132.00 136.21 1l2a h PRO 354 Ca 0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 1l2a h PRO 354 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1l2a h PRO 354 CO 0.35 0.00 -0.11 0.35 -0.23 0.00 0.00 178.00 178.36 1l2a h PHE 355 N 0.00 -0.30 -0.97 1.56 3.57 -1.94 -1.03 116.94 117.84 1l2a h PHE 355 Ca 0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1l2a h PHE 355 Cb 0.46 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 39.23 1l2a h PHE 355 CO 0.00 0.08 0.62 0.37 -2.23 0.00 0.00 178.31 177.15 1l2a h GLN 356 N -0.82 1.08 -0.49 1.11 -0.00 -1.77 -0.26 115.11 113.96 1l2a h GLN 356 Ca -0.03 -0.06 0.03 0.00 -0.00 0.00 0.00 58.65 58.59 1l2a h GLN 356 Cb 0.51 -0.24 -0.04 0.00 0.00 0.00 0.00 27.48 27.71 1l2a h GLN 356 CO 0.05 0.71 0.26 0.78 0.00 0.00 0.00 178.83 180.64 1l2a h GLY 357 N 1.11 0.68 1.79 2.39 0.00 -1.18 -0.86 103.07 107.00 1l2a h GLY 357 Ca 0.42 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.50 1l2a h GLY 357 CO -0.18 0.14 -0.23 -0.25 0.00 0.00 0.00 176.54 176.02 1l2a h TRP 358 N 0.52 0.27 0.13 5.60 7.01 -0.53 -1.46 115.95 127.49 1l2a h TRP 358 Ca 0.21 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 1l2a h TRP 358 Cb 0.09 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.07 1l2a h TRP 358 CO -0.09 0.47 -0.06 0.28 -2.79 0.00 0.00 178.44 176.25 1l2a h VAL 359 N 0.23 0.97 -0.22 2.65 2.07 -0.31 -1.70 116.25 119.94 1l2a h VAL 359 Ca 0.04 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1l2a h VAL 359 Cb 0.53 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1l2a h VAL 359 CO 0.04 0.10 0.03 0.28 0.02 0.00 0.00 177.57 178.04 1l2a h SER 360 N -0.36 0.29 0.42 0.57 0.02 -1.06 -2.25 113.55 111.18 1l2a h SER 360 Ca -0.02 -0.03 -0.26 0.00 -0.84 0.00 0.00 61.79 60.64 1l2a h SER 360 Cb 0.29 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 62.77 1l2a h SER 360 CO 0.03 0.32 -1.11 0.00 -1.14 0.00 0.00 176.83 174.93 1l2a h ALA 361 N 1.73 0.20 0.00 3.77 0.00 -1.12 -3.41 119.26 120.43 1l2a h ALA 361 Ca 0.08 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1l2a h ALA 361 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1l2a h ALA 361 CO -0.00 0.85 -0.18 0.25 0.00 0.00 0.00 179.25 180.17 1l2a n THR 362 N -3.67 0.00 -3.58 0.00 -2.24 -0.65 -4.81 114.28 99.33 1l2a n THR 362 Ca -0.09 -0.27 -0.39 0.00 -2.27 0.00 0.00 64.05 61.04 1l2a n THR 362 Cb 0.93 0.84 -0.11 0.00 -2.10 0.00 0.00 70.33 69.89 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 -0.90 3.62 0.36 -0.78 -1.52 -0.85 -4.97 119.66 114.62 1l2a s GLN 363 Ca 0.00 -0.54 0.03 0.00 -1.95 0.00 0.00 55.36 52.90 1l2a s GLN 363 Cb 0.00 -3.70 0.68 0.00 -0.22 0.00 0.00 33.01 29.78 1l2a s GLN 363 CO 0.00 -0.34 2.01 0.66 -0.25 0.00 0.00 175.29 177.37 1l2a h SER 364 N 8.42 0.65 -0.20 5.90 4.64 -1.95 0.54 113.55 131.55 1l2a h SER 364 Ca -0.33 -0.02 0.06 0.00 -0.47 0.00 0.00 61.79 61.02 1l2a h SER 364 Cb 1.17 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 1l2a h SER 364 CO 0.60 0.49 0.15 0.44 -0.87 0.00 0.00 176.83 177.64 1l2a h ASP 365 N 0.76 0.00 -0.51 4.97 3.32 -1.94 -1.26 116.42 121.76 1l2a h ASP 365 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1l2a h ASP 365 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1l2a h ASP 365 CO -0.04 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 177.97 1l2a n PHE 366 N -4.37 1.39 -1.73 4.55 3.01 0.15 -4.66 117.46 115.81 1l2a n PHE 366 Ca 0.02 -0.68 -0.42 0.00 1.01 0.00 0.00 57.45 57.37 1l2a n PHE 366 Cb 0.29 -0.30 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 1l2a n PHE 366 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1l2a s ALA 367 N -2.18 3.73 0.31 4.37 0.00 -0.48 -4.66 121.76 122.86 1l2a s ALA 367 Ca 0.47 1.40 -0.28 0.00 0.00 0.00 0.00 51.96 53.55 1l2a s ALA 367 Cb 0.33 -3.77 -0.13 0.00 0.00 0.00 0.00 23.12 19.55 1l2a s ALA 367 CO 0.18 -1.26 1.23 -2.30 0.00 0.00 0.00 175.76 173.61 1l2a n PRO 368 N 5.95 1.90 0.15 0.00 -0.02 -1.26 -4.89 135.00 136.82 1l2a n PRO 368 Ca 0.18 0.67 0.13 0.00 -2.02 0.00 0.00 63.50 62.45 1l2a n PRO 368 Cb 0.39 -2.20 0.29 0.00 -0.02 0.00 0.00 33.50 31.96 1l2a n PRO 368 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1l2a h LYS 369 N 2.63 0.00 -7.45 -0.52 3.64 -1.91 -3.46 116.57 109.50 1l2a h LYS 369 Ca -0.44 0.00 -0.43 0.00 -1.27 0.00 0.00 60.65 58.51 1l2a h LYS 369 Cb 1.30 0.00 0.18 0.00 -0.41 0.00 0.00 32.23 33.30 1l2a h LYS 369 CO 0.64 0.00 0.19 -1.54 -2.27 0.00 0.00 179.45 176.46 1l2a s SER 370 N -5.19 1.53 0.07 4.20 1.04 -1.26 -4.86 113.70 109.23 1l2a s SER 370 Ca 0.09 0.66 0.22 0.00 0.48 0.00 0.00 55.95 57.40 1l2a s SER 370 Cb 0.09 -0.95 -0.18 0.00 0.10 0.00 0.00 66.02 65.08 1l2a s SER 370 CO 0.64 -3.75 0.74 -1.54 0.98 0.00 0.00 173.24 170.31 1l2a n SER 371 N -4.51 0.39 -0.25 7.02 3.41 -1.26 -4.31 113.62 114.10 1l2a n SER 371 Ca 0.12 0.09 0.04 0.00 -0.26 0.00 0.00 58.87 58.86 1l2a n SER 371 Cb 0.59 1.30 0.02 0.00 -0.26 0.00 0.00 64.21 65.86 1l2a n SER 371 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1l2a n ASN 372 N -2.39 1.39 -0.20 4.04 3.02 -1.26 -4.76 115.26 115.10 1l2a n ASN 372 Ca -0.02 -1.19 -0.02 0.00 -0.03 0.00 0.00 54.58 53.31 1l2a n ASN 372 Cb 0.55 0.19 0.08 0.00 -0.61 0.00 0.00 39.78 39.99 1l2a n ASN 372 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1l2a h GLY 373 N 1.53 0.87 0.88 7.41 0.00 -1.92 -0.67 103.07 111.17 1l2a h GLY 373 Ca 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 1l2a h GLY 373 CO 0.00 0.12 -0.00 1.70 0.00 0.00 0.00 176.54 178.35 1l2a h LYS 374 N 0.58 0.54 0.02 4.80 3.64 -1.85 -1.20 116.57 123.10 1l2a h LYS 374 Ca 0.27 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1l2a h LYS 374 Cb 0.20 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1l2a h LYS 374 CO -0.19 0.68 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.57 1l2a h ARG 375 N 0.33 -0.02 -0.45 1.90 2.43 -1.83 -0.01 114.38 116.73 1l2a h ARG 375 Ca 0.08 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.33 1l2a h ARG 375 Cb 0.44 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 1l2a h ARG 375 CO 0.02 0.07 0.08 -0.44 -1.51 0.00 0.00 179.97 178.19 1l2a h ASP 376 N -0.12 -0.01 0.25 -3.80 5.19 -1.08 -1.79 116.42 115.07 1l2a h ASP 376 Ca -0.00 0.08 -0.08 0.00 -0.62 0.00 0.00 57.03 56.41 1l2a h ASP 376 Cb 0.11 0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 1l2a h ASP 376 CO 0.00 0.03 -0.31 -0.50 -3.12 0.00 0.00 179.24 175.34 1l2a h TRP 377 N 0.21 0.11 -0.62 4.55 4.06 -1.04 -0.61 115.95 122.61 1l2a h TRP 377 Ca 0.22 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 61.12 1l2a h TRP 377 Cb 0.29 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.39 1l2a h TRP 377 CO -0.22 0.41 0.28 1.15 -3.56 0.00 0.00 178.44 176.50 1l2a h THR 378 N 0.09 1.22 -0.29 1.49 2.02 -0.23 -2.46 112.91 114.75 1l2a h THR 378 Ca 0.01 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.50 1l2a h THR 378 Cb 0.61 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1l2a h THR 378 CO 0.04 0.26 -0.02 0.74 0.37 0.00 0.00 175.52 176.91 1l2a h THR 379 N 0.86 1.26 -0.02 3.16 2.02 -0.82 -3.30 112.91 116.07 1l2a h THR 379 Ca 0.21 -0.99 -0.00 0.00 0.77 0.00 0.00 66.41 66.40 1l2a h THR 379 Cb 0.14 1.32 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1l2a h THR 379 CO -0.02 0.32 0.01 -1.28 0.37 0.00 0.00 175.52 174.91 1l2a h SER 380 N 0.31 0.03 0.09 4.18 0.87 -0.97 -1.11 113.55 116.95 1l2a h SER 380 Ca 0.08 -0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.44 1l2a h SER 380 Cb 0.47 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1l2a h SER 380 CO 0.02 0.16 -0.23 0.10 -0.53 0.00 0.00 176.83 176.35 1l2a h TYR 381 N -0.10 0.26 -0.17 2.24 -0.00 -1.59 0.26 116.97 117.87 1l2a h TYR 381 Ca 0.01 -0.04 -0.18 0.00 -0.00 0.00 0.00 58.73 58.52 1l2a h TYR 381 Cb 0.13 -0.07 -0.00 0.00 -0.00 0.00 0.00 36.73 36.79 1l2a h TYR 381 CO -0.03 0.46 -0.63 0.87 -0.00 0.00 0.00 178.16 178.83 1l2a h LYS 382 N 0.22 0.59 -0.54 0.10 1.57 -1.60 -1.57 116.57 115.34 1l2a h LYS 382 Ca 0.04 -0.41 -0.08 0.00 -1.87 0.00 0.00 60.65 58.32 1l2a h LYS 382 Cb 0.53 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1l2a h LYS 382 CO 0.04 1.03 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.86 1l2a h ARG 383 N 0.44 0.92 -0.38 3.15 9.65 -0.45 -2.30 114.38 125.41 1l2a h ARG 383 Ca -0.01 -0.27 -0.01 0.00 -1.10 0.00 0.00 59.98 58.59 1l2a h ARG 383 Cb 1.20 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.67 1l2a h ARG 383 CO 0.12 0.92 0.20 1.96 2.80 0.00 0.00 179.97 185.96 1l2a h GLN 384 N 0.85 0.54 -0.92 0.20 4.20 -0.37 -1.59 115.11 118.02 1l2a h GLN 384 Ca 0.16 -0.07 0.11 0.00 0.06 0.00 0.00 58.65 58.91 1l2a h GLN 384 Cb 0.51 -0.10 -0.07 0.00 0.30 0.00 0.00 27.48 28.11 1l2a h GLN 384 CO 0.02 0.46 0.59 -0.07 -0.67 0.00 0.00 178.83 179.17 1l2a h LEU 385 N 0.48 0.82 -1.03 1.46 3.38 -1.08 -0.64 115.31 118.71 1l2a h LEU 385 Ca 0.13 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 1l2a h LEU 385 Cb 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1l2a h LEU 385 CO -0.02 0.46 -0.46 -0.33 0.09 0.00 0.00 178.44 178.18 1l2a h GLU 386 N 0.90 0.00 -0.31 1.13 5.08 -0.87 -3.12 114.58 117.38 1l2a h GLU 386 Ca 0.44 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.72 1l2a h GLU 386 Cb 0.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1l2a h GLU 386 CO -0.20 0.46 -0.09 0.35 -1.00 0.00 0.00 179.01 178.53 1l2a h PHE 387 N 0.00 0.70 -0.88 4.33 3.57 -0.15 -1.28 116.94 123.22 1l2a h PHE 387 Ca -0.00 -0.15 0.03 0.00 3.53 0.00 0.00 57.97 61.37 1l2a h PHE 387 Cb 0.86 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.39 1l2a h PHE 387 CO 0.00 0.81 0.58 1.88 -2.23 0.00 0.00 178.31 179.34 1l2a h TYR 388 N 0.38 1.09 -0.39 0.41 0.05 -1.49 -2.55 116.97 114.48 1l2a h TYR 388 Ca 0.08 0.03 -0.16 0.00 0.05 0.00 0.00 58.73 58.73 1l2a h TYR 388 Cb 0.59 -0.36 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1l2a h TYR 388 CO 0.05 0.65 -0.37 1.96 -1.05 0.00 0.00 178.16 179.40 1l2a h GLN 389 N 1.14 0.93 -0.77 4.88 4.20 -1.39 -2.67 115.11 121.44 1l2a h GLN 389 Ca 0.34 -0.49 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1l2a h GLN 389 Cb -0.05 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 1l2a h GLN 389 CO -0.10 1.14 0.45 2.35 -0.67 0.00 0.00 178.83 182.00 1l2a h TRP 390 N 0.75 1.01 -0.13 2.96 7.01 -1.15 -2.92 115.95 123.49 1l2a h TRP 390 Ca 0.06 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.06 1l2a h TRP 390 Cb 0.97 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.70 1l2a h TRP 390 CO 0.06 0.68 0.00 1.28 -2.79 0.00 0.00 178.44 177.68 1l2a n LEU 391 N -4.38 1.62 -4.66 0.65 4.77 -0.97 -4.73 117.00 109.31 1l2a n LEU 391 Ca 0.08 -0.64 -0.43 0.00 -0.03 0.00 0.00 56.01 54.99 1l2a n LEU 391 Cb 0.07 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1l2a n LEU 391 CO 0.37 0.32 1.12 -1.58 -1.33 0.00 0.00 177.39 176.29 1l2a s GLN 392 N -1.84 4.23 1.06 3.23 0.74 -1.02 0.20 119.66 126.25 1l2a s GLN 392 Ca 0.34 1.74 -0.14 0.00 0.05 0.00 0.00 55.36 57.35 1l2a s GLN 392 Cb 0.18 -3.78 0.22 0.00 1.10 0.00 0.00 33.01 30.73 1l2a s GLN 392 CO 0.28 -0.71 1.10 -1.54 -0.55 0.00 0.00 175.29 173.87 1l2a s SER 393 N 2.13 2.12 0.45 6.67 1.04 0.11 -4.54 113.70 121.68 1l2a s SER 393 Ca 0.57 1.03 0.12 0.00 0.48 0.00 0.00 55.95 58.16 1l2a s SER 393 Cb -0.24 -1.59 1.03 0.00 0.10 0.00 0.00 66.02 65.31 1l2a s SER 393 CO 0.17 -3.43 2.05 0.00 0.98 0.00 0.00 173.24 173.02 1l2a h ALA 394 N -2.10 1.77 0.03 5.32 0.00 -0.99 -2.78 119.26 120.51 1l2a h ALA 394 Ca -0.53 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.06 1l2a h ALA 394 Cb 1.33 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1l2a h ALA 394 CO 0.52 0.18 -1.20 0.93 0.00 0.00 0.00 179.25 179.68 1l2a h GLU 395 N 0.17 0.06 0.00 0.00 3.07 -1.90 -3.49 114.58 112.49 1l2a h GLU 395 Ca 0.04 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1l2a h GLU 395 Cb 0.12 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1l2a h GLU 395 CO 0.00 0.96 0.00 0.41 -1.40 0.00 0.00 179.01 178.98 1l2a n GLY 396 N 1.44 1.40 3.79 -3.84 0.00 -1.05 -4.43 105.19 102.49 1l2a n GLY 396 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.69 1.95 -0.27 -0.02 0.00 -1.26 -4.17 107.32 102.86 1l2a s GLY 397 Ca 0.00 0.34 -0.13 0.00 0.00 0.00 0.00 44.72 44.93 1l2a s GLY 397 CO 0.00 0.67 0.26 -0.42 0.00 0.00 0.00 173.10 173.61 1l2a s ILE 398 N -2.64 5.26 1.05 0.90 -1.09 -1.26 -0.71 121.20 122.71 1l2a s ILE 398 Ca 0.63 0.34 -0.14 0.00 -2.23 0.00 0.00 60.65 59.25 1l2a s ILE 398 Cb -0.17 -3.60 0.22 0.00 -1.58 0.00 0.00 42.46 37.33 1l2a s ILE 398 CO 0.45 0.23 1.11 0.00 -1.23 0.00 0.00 174.94 175.50 1l2a s ALA 399 N 1.75 0.92 0.03 9.38 0.00 0.13 -4.98 121.76 128.99 1l2a s ALA 399 Ca 0.11 -0.57 -0.12 0.00 0.00 0.00 0.00 51.96 51.37 1l2a s ALA 399 Cb -0.16 -3.03 -0.06 0.00 0.00 0.00 0.00 23.12 19.87 1l2a s ALA 399 CO 0.10 -3.02 1.19 0.78 0.00 0.00 0.00 175.76 174.81 1l2a h GLY 400 N -2.07 -0.96 0.00 0.00 0.00 -1.71 -3.41 103.07 94.92 1l2a h GLY 400 Ca -0.52 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1l2a h GLY 400 CO 0.51 -0.32 0.00 0.61 0.00 0.00 0.00 176.54 177.34 1l2a n GLY 401 N -1.19 -0.53 3.56 4.60 0.00 -0.85 -0.71 105.19 110.06 1l2a n GLY 401 Ca -0.04 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.37 0.02 4.61 0.00 -0.86 -0.39 121.76 122.78 1l2a s ALA 402 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 51.96 52.10 1l2a s ALA 402 Cb 0.00 0.87 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 1l2a s ALA 402 CO 0.00 -0.85 -0.04 -0.08 0.00 0.00 0.00 175.76 174.79 1l2a s THR 403 N -3.82 0.23 -2.22 0.00 -1.32 0.13 -1.25 115.64 107.39 1l2a s THR 403 Ca 0.05 -0.82 0.25 0.00 -1.21 0.00 0.00 61.69 59.96 1l2a s THR 403 Cb -0.02 -0.33 0.19 0.00 -1.51 0.00 0.00 72.50 70.82 1l2a s THR 403 CO -0.06 -0.38 1.35 -3.20 -2.21 0.00 0.00 174.62 170.13 1l2a n ASN 404 N 1.80 1.86 -3.80 8.08 5.15 -0.01 -0.92 115.26 127.42 1l2a n ASN 404 Ca -0.22 -1.44 -0.30 0.00 -0.60 0.00 0.00 54.58 52.03 1l2a n ASN 404 Cb 0.56 0.22 -0.14 0.00 -0.53 0.00 0.00 39.78 39.89 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 -2.32 3.95 0.08 1.20 0.15 -1.26 -4.70 113.70 110.80 1l2a s SER 405 Ca 0.25 -2.56 -0.31 0.00 0.70 0.00 0.00 55.95 54.04 1l2a s SER 405 Cb 0.19 -1.21 -0.10 0.00 -1.71 0.00 0.00 66.02 63.20 1l2a s SER 405 CO 0.47 -0.29 1.86 0.86 1.20 0.00 0.00 173.24 177.34 1l2a s TRP 406 N 0.40 1.85 0.00 3.44 -0.11 -1.26 -1.36 118.94 121.90 1l2a s TRP 406 Ca 0.16 -0.15 0.00 0.00 1.22 0.00 0.00 56.10 57.33 1l2a s TRP 406 Cb -0.24 -4.18 0.00 0.00 -1.50 0.00 0.00 33.47 27.55 1l2a s TRP 406 CO -0.03 -5.02 0.00 0.09 -4.62 0.00 0.00 176.95 167.37 1l2a n ASN 407 N 6.38 -4.86 -0.15 5.86 3.02 -1.26 -2.53 115.26 121.72 1l2a n ASN 407 Ca 0.18 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.71 1l2a n ASN 407 Cb 0.39 -2.77 -0.01 0.00 -0.61 0.00 0.00 39.78 36.78 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 -0.06 0.53 0.62 7.41 0.00 -0.46 -4.55 105.19 108.68 1l2a n GLY 408 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.94 0.00 -3.93 1.61 1.74 -1.05 -2.15 116.66 109.94 1l2a n ARG 409 Ca -0.02 -1.08 -0.26 0.00 -0.77 0.00 0.00 57.85 55.72 1l2a n ARG 409 Cb 0.06 -0.41 -0.02 0.00 -1.02 0.00 0.00 32.46 31.07 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 0.06 -1.66 -2.03 -1.55 4.01 -1.22 -4.87 117.16 109.90 1l2a n TYR 410 Ca 0.01 0.71 -0.31 0.00 -0.16 0.00 0.00 57.90 58.15 1l2a n TYR 410 Cb 0.74 -3.71 -0.00 0.00 -0.31 0.00 0.00 39.34 36.06 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 -6.52 3.70 0.31 -0.72 2.02 -1.08 -2.98 118.70 113.43 1l2a s GLU 411 Ca 0.04 0.81 -0.29 0.00 0.02 0.00 0.00 54.97 55.55 1l2a s GLU 411 Cb -0.02 -2.10 -0.12 0.00 0.10 0.00 0.00 34.13 32.00 1l2a s GLU 411 CO 0.89 -0.48 1.45 1.63 0.02 0.00 0.00 175.26 178.77 1l2a n LYS 412 N -2.40 2.39 -1.95 1.61 4.76 -1.24 -4.28 118.16 117.05 1l2a n LYS 412 Ca 0.06 0.84 -0.41 0.00 -2.87 0.00 0.00 58.31 55.94 1l2a n LYS 412 Cb 0.54 -2.54 -0.01 0.00 -1.84 0.00 0.00 35.03 31.18 1l2a n LYS 412 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1l2a s TYR 413 N -0.50 2.85 0.66 2.13 2.02 -1.26 -4.97 117.35 118.28 1l2a s TYR 413 Ca 0.61 1.18 -0.17 0.00 -0.37 0.00 0.00 57.07 58.32 1l2a s TYR 413 Cb -0.55 -3.87 -0.06 0.00 -0.40 0.00 0.00 41.96 37.09 1l2a s TYR 413 CO 0.55 -2.61 0.54 -2.30 -1.57 0.00 0.00 175.55 170.17 1l2a n PRO 414 N 1.17 0.41 -1.62 -1.71 -0.02 -1.26 -4.88 135.00 127.09 1l2a n PRO 414 Ca 0.03 0.17 -0.44 0.00 -2.02 0.00 0.00 63.50 61.24 1l2a n PRO 414 Cb 0.40 -1.80 -0.02 0.00 -0.02 0.00 0.00 33.50 32.07 1l2a n PRO 414 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l2a n ALA 415 N -2.09 0.12 -2.39 3.55 0.00 -1.26 -2.57 120.51 115.86 1l2a n ALA 415 Ca 0.11 0.39 -0.17 0.00 0.00 0.00 0.00 53.44 53.77 1l2a n ALA 415 Cb 0.49 -2.08 -0.00 0.00 0.00 0.00 0.00 19.45 17.85 1l2a n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l2a n GLY 416 N 1.24 -0.30 3.68 0.00 0.00 -1.26 -4.99 105.19 103.56 1l2a n GLY 416 Ca 0.09 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.85 4.84 0.31 2.61 2.01 -1.06 -5.04 115.64 116.45 1l2a s THR 417 Ca 0.04 1.82 -0.27 0.00 0.31 0.00 0.00 61.69 63.59 1l2a s THR 417 Cb -0.02 -4.22 -0.10 0.00 0.01 0.00 0.00 72.50 68.18 1l2a s THR 417 CO 0.04 0.02 0.97 -0.94 -0.69 0.00 0.00 174.62 174.03 1l2a s SER 418 N 1.11 7.33 0.24 3.53 1.04 -1.26 -4.91 113.70 120.77 1l2a s SER 418 Ca 0.43 1.94 0.07 0.00 0.48 0.00 0.00 55.95 58.86 1l2a s SER 418 Cb -0.17 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.30 1l2a s SER 418 CO 0.15 -0.08 -0.10 0.42 0.98 0.00 0.00 173.24 174.61 1l2a s THR 419 N -1.47 1.63 -0.19 2.02 -4.23 -1.26 -1.23 115.64 110.91 1l2a s THR 419 Ca 0.48 -2.16 -0.03 0.00 -1.18 0.00 0.00 61.69 58.80 1l2a s THR 419 Cb -0.22 -2.23 0.06 0.00 1.34 0.00 0.00 72.50 71.44 1l2a s THR 419 CO 0.28 -0.45 0.04 0.12 -0.54 0.00 0.00 174.62 174.07 1l2a s PHE 420 N -3.03 0.88 -1.69 3.99 5.36 0.11 -1.37 117.98 122.23 1l2a s PHE 420 Ca 0.26 -0.76 -0.14 0.00 -0.96 0.00 0.00 56.93 55.33 1l2a s PHE 420 Cb 0.02 -0.97 0.13 0.00 -0.34 0.00 0.00 43.02 41.86 1l2a s PHE 420 CO 0.09 -0.59 0.54 0.66 -1.46 0.00 0.00 175.22 174.46 1l2a n TYR 421 N 5.09 -1.47 -0.43 10.12 4.02 -1.26 -0.75 117.16 132.47 1l2a n TYR 421 Ca -0.09 0.73 0.00 0.00 -0.01 0.00 0.00 57.90 58.53 1l2a n TYR 421 Cb 0.47 -2.72 0.00 0.00 -0.02 0.00 0.00 39.34 37.07 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 -1.60 1.01 3.85 2.72 0.00 -1.26 -4.66 105.19 105.26 1l2a n GLY 422 Ca -0.04 0.00 -0.37 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 -0.43 3.67 0.20 1.61 -1.94 0.07 -3.60 119.30 118.89 1l2a s MET 423 Ca 0.00 0.08 -0.29 0.00 -1.71 0.00 0.00 55.69 53.77 1l2a s MET 423 Cb 0.00 -3.22 -0.08 0.00 2.01 0.00 0.00 34.83 33.54 1l2a s MET 423 CO 0.00 0.71 0.91 0.00 -0.01 0.00 0.00 175.02 176.63 1l2a s ALA 424 N -0.94 3.35 0.26 3.03 0.00 -0.10 0.04 121.76 127.40 1l2a s ALA 424 Ca 0.18 0.56 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 1l2a s ALA 424 Cb -0.14 -3.17 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 1l2a s ALA 424 CO 0.07 0.19 1.53 -0.47 0.00 0.00 0.00 175.76 177.08 1l2a s TYR 425 N -0.99 2.90 -0.06 0.00 5.04 -0.36 -0.70 117.35 123.18 1l2a s TYR 425 Ca 0.41 0.87 0.01 0.00 -2.44 0.00 0.00 57.07 55.92 1l2a s TYR 425 Cb -0.25 -3.95 0.02 0.00 0.35 0.00 0.00 41.96 38.13 1l2a s TYR 425 CO 0.30 -3.18 -0.07 0.14 -1.34 0.00 0.00 175.55 171.41 1l2a s VAL 426 N 0.10 0.75 0.43 3.14 -7.23 0.48 -4.84 120.40 113.22 1l2a s VAL 426 Ca 0.62 -0.23 0.09 0.00 -1.81 0.00 0.00 61.98 60.66 1l2a s VAL 426 Cb -0.45 -0.74 0.25 0.00 0.56 0.00 0.00 36.38 36.00 1l2a s VAL 426 CO 0.44 0.28 2.06 1.55 -0.31 0.00 0.00 175.10 179.12 1l2a h PRO 427 N 7.26 0.38 -2.52 4.82 0.13 -1.94 -2.27 132.00 137.85 1l2a h PRO 427 Ca -0.34 -0.03 -0.60 0.00 -0.87 0.00 0.00 66.00 64.16 1l2a h PRO 427 Cb 1.16 -0.08 -0.39 0.00 0.13 0.00 0.00 31.00 31.82 1l2a h PRO 427 CO 0.45 0.29 -0.89 -1.01 -0.23 0.00 0.00 178.00 176.61 1l2a s HIS 428 N -5.28 1.64 0.29 1.56 3.76 -1.26 -3.35 115.29 112.65 1l2a s HIS 428 Ca -0.07 -2.55 -0.30 0.00 -0.15 0.00 0.00 55.06 51.99 1l2a s HIS 428 Cb 0.17 -1.31 -0.13 0.00 1.11 0.00 0.00 32.58 32.42 1l2a s HIS 428 CO 0.72 -0.77 1.39 -2.30 -0.85 0.00 0.00 174.74 172.94 1l2a n PRO 429 N 2.65 2.20 0.00 8.40 -0.02 -1.26 -3.80 135.00 143.17 1l2a n PRO 429 Ca 0.28 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.53 1l2a n PRO 429 Cb 0.45 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 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 1.30 0.00 -5.02 -1.45 0.31 -1.26 -4.53 118.33 107.68 1l2a n VAL 430 Ca 0.08 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.14 1l2a n VAL 430 Cb 0.34 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 33.12 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 1.89 -0.42 3.52 2.02 -1.25 -3.89 117.35 119.22 1l2a s TYR 431 Ca 0.00 -0.39 0.14 0.00 -0.37 0.00 0.00 57.07 56.45 1l2a s TYR 431 Cb 0.00 -1.23 -0.18 0.00 -0.40 0.00 0.00 41.96 40.15 1l2a s TYR 431 CO 0.00 -0.06 0.49 0.00 -1.57 0.00 0.00 175.55 174.41 1l2a n ALA 432 N 2.66 3.34 -3.64 3.71 0.00 -0.60 -1.19 120.51 124.80 1l2a n ALA 432 Ca -0.16 -0.38 -0.29 0.00 0.00 0.00 0.00 53.44 52.61 1l2a n ALA 432 Cb 0.53 -0.51 -0.13 0.00 0.00 0.00 0.00 19.45 19.34 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 -2.85 3.57 0.77 0.00 2.15 -1.26 -2.44 116.67 116.62 1l2a s ASP 433 Ca 0.01 -2.16 -0.12 0.00 0.43 0.00 0.00 52.55 50.71 1l2a s ASP 433 Cb 0.10 -0.78 0.06 0.00 -0.30 0.00 0.00 42.92 42.00 1l2a s ASP 433 CO 0.59 -0.33 1.15 -2.16 -0.17 0.00 0.00 175.17 174.25 1l2a s PRO 434 N 0.99 2.28 0.18 4.34 0.04 -1.26 -4.35 135.00 137.21 1l2a s PRO 434 Ca 0.15 0.25 -0.33 0.00 0.04 0.00 0.00 61.00 61.11 1l2a s PRO 434 Cb -0.22 -1.97 -0.15 0.00 0.04 0.00 0.00 34.50 32.20 1l2a s PRO 434 CO -0.09 -1.40 1.22 0.41 0.04 0.00 0.00 177.00 177.18 1l2a n GLY 435 N -3.17 0.22 0.23 0.56 0.00 -1.02 -4.83 105.19 97.18 1l2a n GLY 435 Ca 0.08 0.53 0.15 0.00 0.00 0.00 0.00 46.02 46.78 1l2a n GLY 435 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1l2a h SER 436 N 3.61 0.00 -0.28 1.61 4.64 -1.39 -2.08 113.55 119.66 1l2a h SER 436 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1l2a h SER 436 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1l2a h SER 436 CO 0.72 0.00 0.00 -3.20 -0.87 0.00 0.00 176.83 173.48 1l2a n ASN 437 N -2.55 3.79 0.08 4.97 5.15 -1.26 -4.46 115.26 120.97 1l2a n ASN 437 Ca -0.02 -2.87 -0.11 0.00 -0.60 0.00 0.00 54.58 50.98 1l2a n ASN 437 Cb 0.10 -0.50 -0.02 0.00 -0.53 0.00 0.00 39.78 38.83 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 1.88 0.30 -6.34 1.20 4.15 -1.61 -3.44 115.11 111.25 1l2a h GLN 438 Ca 0.00 -0.32 -0.55 0.00 0.77 0.00 0.00 58.65 58.56 1l2a h GLN 438 Cb 1.35 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 29.12 1l2a h GLN 438 CO 0.20 1.02 0.81 -0.46 -1.93 0.00 0.00 178.83 178.46 1l2a s TRP 439 N -3.25 2.92 0.34 3.99 -0.00 -1.26 -1.01 118.94 120.67 1l2a s TRP 439 Ca -0.04 0.92 0.38 0.00 -0.00 0.00 0.00 56.10 57.36 1l2a s TRP 439 Cb 0.10 -3.59 1.85 0.00 -0.00 0.00 0.00 33.47 31.82 1l2a s TRP 439 CO 0.84 -2.12 2.15 0.35 -0.00 0.00 0.00 176.95 178.17 1l2a h PHE 440 N 7.80 0.00 -0.85 5.86 3.57 -1.47 -3.30 116.94 128.55 1l2a h PHE 440 Ca -0.36 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.24 1l2a h PHE 440 Cb 1.17 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.83 1l2a h PHE 440 CO 0.75 0.00 0.49 0.78 -2.23 0.00 0.00 178.31 178.10 1l2a h GLY 441 N 1.08 1.34 0.50 2.40 0.00 -1.89 -0.15 103.07 106.35 1l2a h GLY 441 Ca 0.00 -0.32 0.18 0.00 0.00 0.00 0.00 47.33 47.18 1l2a h GLY 441 CO 0.00 0.12 0.55 0.74 0.00 0.00 0.00 176.54 177.95 1l2a h PHE 442 N 0.80 0.49 0.49 5.60 0.05 -1.94 0.57 116.94 123.00 1l2a h PHE 442 Ca 0.42 0.01 -0.02 0.00 3.82 0.00 0.00 57.97 62.20 1l2a h PHE 442 Cb 0.41 -0.15 0.00 0.00 2.00 0.00 0.00 35.95 38.21 1l2a h PHE 442 CO -0.06 0.16 -0.25 1.96 -0.18 0.00 0.00 178.31 179.94 1l2a h GLN 443 N 0.40 -0.65 0.39 1.51 1.08 -1.25 -0.47 115.11 116.12 1l2a h GLN 443 Ca 0.42 0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.64 1l2a h GLN 443 Cb 1.02 0.15 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 1l2a h GLN 443 CO -0.14 -0.44 -0.19 0.00 -0.95 0.00 0.00 178.83 177.11 1l2a h ALA 444 N -0.17 -0.53 -0.24 3.87 0.00 -1.30 -2.04 119.26 118.85 1l2a h ALA 444 Ca -0.06 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1l2a h ALA 444 Cb 0.53 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1l2a h ALA 444 CO 0.10 -0.76 -0.11 -1.49 0.00 0.00 0.00 179.25 176.99 1l2a h TRP 445 N -0.60 -0.26 0.04 0.00 6.55 -0.92 -1.60 115.95 119.17 1l2a h TRP 445 Ca -0.05 0.03 -0.18 0.00 0.95 0.00 0.00 58.89 59.64 1l2a h TRP 445 Cb 0.45 0.15 0.02 0.00 -0.86 0.00 0.00 29.16 28.91 1l2a h TRP 445 CO -0.03 -0.17 -0.71 1.03 -1.05 0.00 0.00 178.44 177.51 1l2a h SER 446 N -0.07 0.55 0.63 -3.49 0.87 -1.10 -3.23 113.55 107.71 1l2a h SER 446 Ca 0.13 -0.81 -0.05 0.00 -1.23 0.00 0.00 61.79 59.83 1l2a h SER 446 Cb 0.26 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1l2a h SER 446 CO -0.29 1.30 -0.24 0.24 -0.53 0.00 0.00 176.83 177.31 1l2a h MET 447 N -0.13 0.00 -0.89 2.24 2.86 -1.40 -2.10 114.93 115.50 1l2a h MET 447 Ca -0.10 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.58 1l2a h MET 447 Cb 1.45 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.05 1l2a h MET 447 CO 0.14 0.24 0.59 0.37 1.06 0.00 0.00 176.91 179.30 1l2a h GLN 448 N 0.00 1.05 -0.53 1.72 -0.00 -1.31 -0.07 115.11 115.97 1l2a h GLN 448 Ca -0.00 -0.06 -0.10 0.00 -0.00 0.00 0.00 58.65 58.49 1l2a h GLN 448 Cb 0.62 -0.24 -0.02 0.00 0.00 0.00 0.00 27.48 27.84 1l2a h GLN 448 CO 0.03 0.70 -0.05 0.00 0.00 0.00 0.00 178.83 179.50 1l2a h ARG 449 N 1.08 0.95 -0.27 1.69 3.08 -1.42 -2.14 114.38 117.35 1l2a h ARG 449 Ca 0.36 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 60.03 1l2a h ARG 449 Cb 0.08 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1l2a h ARG 449 CO -0.12 0.97 -0.13 0.28 -1.07 0.00 0.00 179.97 179.90 1l2a h VAL 450 N 0.86 1.23 -0.48 2.04 2.07 -1.30 -0.91 116.25 119.76 1l2a h VAL 450 Ca 0.15 -1.01 -0.10 0.00 0.82 0.00 0.00 66.70 66.56 1l2a h VAL 450 Cb 0.58 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1l2a h VAL 450 CO 0.04 0.33 -0.08 0.24 0.02 0.00 0.00 177.57 178.12 1l2a h MET 451 N 0.43 0.89 -0.71 1.57 2.86 -0.62 0.87 114.93 120.21 1l2a h MET 451 Ca 0.08 -0.32 -0.02 0.00 -2.06 0.00 0.00 59.70 57.38 1l2a h MET 451 Cb 0.49 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 1l2a h MET 451 CO 0.03 0.97 0.38 0.93 1.06 0.00 0.00 176.91 180.28 1l2a h GLU 452 N 0.74 0.99 -0.26 1.72 5.08 -1.15 0.41 114.58 122.11 1l2a h GLU 452 Ca 0.13 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1l2a h GLU 452 Cb 0.62 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1l2a h GLU 452 CO 0.04 0.75 0.17 -0.92 -1.00 0.00 0.00 179.01 178.05 1l2a h TYR 453 N 0.98 0.31 -0.27 4.33 3.20 -0.70 0.01 116.97 124.83 1l2a h TYR 453 Ca 0.25 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1l2a h TYR 453 Cb 0.06 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 1l2a h TYR 453 CO -0.00 0.19 0.17 -0.92 -1.64 0.00 0.00 178.16 175.97 1l2a h TYR 454 N 0.34 0.34 -0.55 -3.82 3.20 -0.51 -2.18 116.97 113.78 1l2a h TYR 454 Ca 0.10 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.08 1l2a h TYR 454 Cb -0.03 -0.11 -0.09 0.00 1.54 0.00 0.00 36.73 38.04 1l2a h TYR 454 CO -0.07 0.22 0.05 1.25 -1.64 0.00 0.00 178.16 177.97 1l2a h LEU 455 N 0.36 -0.14 0.02 2.82 6.46 0.33 0.13 115.31 125.29 1l2a h LEU 455 Ca 0.10 0.12 -0.22 0.00 -0.12 0.00 0.00 57.88 57.76 1l2a h LEU 455 Cb -0.03 0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 1l2a h LEU 455 CO -0.02 -0.05 -1.05 -0.33 -0.62 0.00 0.00 178.44 176.37 1l2a h GLU 456 N 0.17 0.07 0.00 1.25 4.39 -0.89 -3.38 114.58 116.18 1l2a h GLU 456 Ca 0.29 -0.11 -0.16 0.00 0.34 0.00 0.00 59.36 59.72 1l2a h GLU 456 Cb 0.44 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 1l2a h GLU 456 CO -0.43 1.05 -1.82 0.25 -1.16 0.00 0.00 179.01 176.90 1l2a n THR 457 N -3.40 0.59 -1.77 1.13 -2.24 -0.83 -5.01 114.28 102.74 1l2a n THR 457 Ca -0.02 -0.48 -0.17 0.00 -2.27 0.00 0.00 64.05 61.11 1l2a n THR 457 Cb 0.95 -0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 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 2.02 1.00 3.64 3.38 0.00 0.45 -4.94 105.19 110.74 1l2a n GLY 458 Ca -0.15 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 1l2a n GLY 458 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l2a s ASP 459 N -2.62 6.40 0.43 1.61 2.15 -1.26 -4.89 116.67 118.49 1l2a s ASP 459 Ca 0.00 1.86 0.29 0.00 0.43 0.00 0.00 52.55 55.13 1l2a s ASP 459 Cb 0.00 -2.53 1.01 0.00 -0.30 0.00 0.00 42.92 41.10 1l2a s ASP 459 CO 0.00 -1.20 1.83 0.28 -0.17 0.00 0.00 175.17 175.90 1l2a h SER 460 N 10.69 0.00 0.00 -0.34 0.02 -1.98 -3.22 113.55 118.73 1l2a h SER 460 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1l2a h SER 460 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1l2a h SER 460 CO 0.98 0.00 0.09 0.77 -1.14 0.00 0.00 176.83 177.53 1l2a h SER 461 N 0.00 0.00 -0.01 3.07 4.64 -2.03 -2.23 113.55 116.99 1l2a h SER 461 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1l2a h SER 461 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1l2a h SER 461 CO 0.00 0.00 -0.03 0.55 -0.87 0.00 0.00 176.83 176.48 1l2a n VAL 462 N -2.53 0.00 -0.11 0.95 3.14 -1.22 -4.67 118.33 113.89 1l2a n VAL 462 Ca -0.02 -0.48 -0.05 0.00 -2.96 0.00 0.00 64.34 60.82 1l2a n VAL 462 Cb 0.13 1.10 0.02 0.00 -1.06 0.00 0.00 33.84 34.04 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 0.97 0.21 -0.48 1.45 3.64 -1.57 -2.53 116.57 118.27 1l2a h LYS 463 Ca 0.00 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 1l2a h LYS 463 Cb 0.22 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1l2a h LYS 463 CO 0.00 0.14 -0.16 -0.91 -2.27 0.00 0.00 179.45 176.25 1l2a h ASN 464 N 0.22 0.93 -0.41 4.20 2.35 -1.83 -0.71 115.58 120.32 1l2a h ASN 464 Ca 0.18 -0.32 0.08 0.00 -0.55 0.00 0.00 56.30 55.68 1l2a h ASN 464 Cb 0.19 -0.25 -0.07 0.00 0.05 0.00 0.00 38.32 38.24 1l2a h ASN 464 CO -0.22 1.08 0.01 0.25 -1.65 0.00 0.00 177.43 176.90 1l2a h LEU 465 N 0.81 -0.15 -0.09 1.61 5.85 -1.86 -1.76 115.31 119.72 1l2a h LEU 465 Ca 0.12 0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.84 1l2a h LEU 465 Cb 0.70 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1l2a h LEU 465 CO 0.05 -0.04 -0.30 0.40 -0.34 0.00 0.00 178.44 178.21 1l2a h ILE 466 N 0.12 1.41 -0.62 4.05 2.04 -1.06 -2.57 117.51 120.87 1l2a h ILE 466 Ca 0.20 -1.66 0.04 0.00 1.00 0.00 0.00 64.86 64.44 1l2a h ILE 466 Cb 0.29 2.23 -0.05 0.00 -0.74 0.00 0.00 36.82 38.56 1l2a h ILE 466 CO -0.33 0.48 0.37 0.11 0.00 0.00 0.00 178.15 178.77 1l2a h LYS 467 N -0.11 0.68 -0.44 2.37 1.79 -1.09 0.12 116.57 119.89 1l2a h LYS 467 Ca -0.01 -0.04 -0.13 0.00 -2.18 0.00 0.00 60.65 58.28 1l2a h LYS 467 Cb 0.93 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 1l2a h LYS 467 CO 0.06 0.45 -0.25 -0.22 -1.08 0.00 0.00 179.45 178.42 1l2a h LYS 468 N 0.70 0.93 -0.48 3.15 3.64 -1.33 -0.93 116.57 122.25 1l2a h LYS 468 Ca 0.26 -0.41 -0.12 0.00 -1.27 0.00 0.00 60.65 59.11 1l2a h LYS 468 Cb 0.09 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1l2a h LYS 468 CO -0.13 1.07 -0.18 2.35 -2.27 0.00 0.00 179.45 180.28 1l2a h TRP 469 N 0.80 1.09 -0.52 1.91 7.01 -1.13 -1.73 115.95 123.37 1l2a h TRP 469 Ca 0.10 -0.25 -0.00 0.00 2.11 0.00 0.00 58.89 60.85 1l2a h TRP 469 Cb 0.81 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.59 1l2a h TRP 469 CO 0.05 1.05 0.31 0.28 -2.79 0.00 0.00 178.44 177.34 1l2a h VAL 470 N 0.84 1.16 -0.49 2.65 2.07 -0.61 -1.51 116.25 120.37 1l2a h VAL 470 Ca 0.12 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1l2a h VAL 470 Cb 0.75 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1l2a h VAL 470 CO 0.06 0.17 0.32 0.44 0.02 0.00 0.00 177.57 178.57 1l2a h ASP 471 N 0.70 0.57 0.40 0.57 3.32 -1.02 0.14 116.42 121.10 1l2a h ASP 471 Ca 0.19 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1l2a h ASP 471 Cb -0.00 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 1l2a h ASP 471 CO -0.03 0.43 -0.24 -0.25 -1.72 0.00 0.00 179.24 177.43 1l2a h TRP 472 N 0.66 -0.62 -0.32 4.55 7.01 -1.12 -1.85 115.95 124.27 1l2a h TRP 472 Ca 0.18 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.22 1l2a h TRP 472 Cb -0.06 0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 27.18 1l2a h TRP 472 CO -0.04 -0.37 0.05 0.28 -2.79 0.00 0.00 178.44 175.58 1l2a h VAL 473 N -0.60 0.83 -0.08 2.65 2.07 -1.14 -1.92 116.25 118.05 1l2a h VAL 473 Ca -0.05 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1l2a h VAL 473 Cb 0.49 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1l2a h VAL 473 CO 0.05 0.03 0.08 0.24 0.02 0.00 0.00 177.57 178.00 1l2a h MET 474 N 0.16 0.00 -0.00 1.57 2.86 -0.59 -1.75 114.93 117.18 1l2a h MET 474 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1l2a h MET 474 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 1l2a h MET 474 CO -0.21 0.00 -0.26 -1.13 1.06 0.00 0.00 176.91 176.37 1l2a n SER 475 N -3.99 0.30 -0.11 1.22 3.41 -0.71 -4.09 113.62 109.65 1l2a n SER 475 Ca -0.01 0.02 0.04 0.00 -0.26 0.00 0.00 58.87 58.66 1l2a n SER 475 Cb 0.19 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.03 1l2a n SER 475 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1l2a n GLU 476 N -1.44 3.12 -3.04 4.33 -0.58 -0.69 -4.99 120.64 117.35 1l2a n GLU 476 Ca 0.07 -0.33 -0.39 0.00 -0.42 0.00 0.00 57.16 56.09 1l2a n GLU 476 Cb 0.33 -0.95 -0.06 0.00 -0.57 0.00 0.00 31.44 30.19 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 -1.38 4.45 -0.27 -3.67 1.01 -1.04 -4.38 121.20 115.92 1l2a s ILE 477 Ca 0.05 1.61 -0.02 0.00 0.00 0.00 0.00 60.65 62.28 1l2a s ILE 477 Cb 0.06 -4.09 0.03 0.00 0.01 0.00 0.00 42.46 38.47 1l2a s ILE 477 CO 0.24 0.53 -0.03 -0.54 0.00 0.00 0.00 174.94 175.14 1l2a s LYS 478 N -1.12 2.79 -0.30 2.79 1.02 -0.42 -5.01 119.74 119.48 1l2a s LYS 478 Ca 0.34 -1.02 -0.10 0.00 0.02 0.00 0.00 55.97 55.22 1l2a s LYS 478 Cb -0.22 -3.08 -0.02 0.00 -0.52 0.00 0.00 37.83 33.99 1l2a s LYS 478 CO 0.25 -0.45 0.15 -0.51 -0.92 0.00 0.00 175.35 173.86 1l2a s LEU 479 N 1.33 3.99 0.21 3.17 1.43 -1.26 -0.69 118.68 126.86 1l2a s LEU 479 Ca -0.01 -0.37 -0.08 0.00 -1.03 0.00 0.00 54.13 52.64 1l2a s LEU 479 Cb -0.17 -2.01 -0.07 0.00 0.03 0.00 0.00 46.19 43.97 1l2a s LEU 479 CO -0.03 -0.14 0.50 -0.31 0.23 0.00 0.00 176.35 176.60 1l2a s TYR 480 N 1.65 3.44 0.39 0.29 1.51 -0.91 -4.99 117.35 118.72 1l2a s TYR 480 Ca 0.05 0.78 0.15 0.00 -1.01 0.00 0.00 57.07 57.04 1l2a s TYR 480 Cb -0.16 -2.18 1.00 0.00 -0.11 0.00 0.00 41.96 40.50 1l2a s TYR 480 CO 0.07 0.31 1.82 -0.44 -1.11 0.00 0.00 175.55 176.20 1l2a h ASP 481 N 2.59 0.51 0.00 2.29 3.32 -1.97 -1.67 116.42 121.50 1l2a h ASP 481 Ca -0.47 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1l2a h ASP 481 Cb 1.17 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1l2a h ASP 481 CO 0.70 0.18 0.00 -0.90 -1.72 0.00 0.00 179.24 177.50 1l2a n ASP 482 N -4.59 0.00 0.00 6.45 5.68 -1.26 -4.87 116.55 117.95 1l2a n ASP 482 Ca 0.22 -1.59 0.00 0.00 -0.50 0.00 0.00 54.79 52.92 1l2a n ASP 482 Cb 0.71 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.69 1l2a n ASP 482 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1l2a n GLY 483 N 0.66 0.74 3.92 6.12 0.00 -0.63 -5.04 105.19 110.96 1l2a n GLY 483 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1l2a n GLY 483 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l2a n THR 484 N -2.37 0.00 -4.00 2.61 -2.24 -1.26 -4.76 114.28 102.26 1l2a n THR 484 Ca 0.00 -1.11 -0.09 0.00 -2.27 0.00 0.00 64.05 60.58 1l2a n THR 484 Cb 0.00 -1.39 -0.05 0.00 -2.10 0.00 0.00 70.33 66.79 1l2a n THR 484 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1l2a s PHE 485 N -3.80 0.38 -0.03 4.78 -0.12 -1.26 -2.14 117.98 115.79 1l2a s PHE 485 Ca 0.75 -0.74 -0.19 0.00 -0.05 0.00 0.00 56.93 56.70 1l2a s PHE 485 Cb -0.02 0.18 0.04 0.00 -0.63 0.00 0.00 43.02 42.58 1l2a s PHE 485 CO 0.52 -1.00 0.41 0.00 -0.05 0.00 0.00 175.22 175.10 1l2a s ALA 486 N -3.99 -1.05 0.15 1.99 0.00 0.14 -4.84 121.76 114.15 1l2a s ALA 486 Ca 0.23 0.62 0.04 0.00 0.00 0.00 0.00 51.96 52.85 1l2a s ALA 486 Cb -0.01 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1l2a s ALA 486 CO 0.09 -0.29 -0.10 0.96 0.00 0.00 0.00 175.76 176.43 1l2a s ILE 487 N -1.22 1.17 0.50 0.00 -4.36 0.63 -1.31 121.20 116.61 1l2a s ILE 487 Ca -0.12 -2.06 -0.23 0.00 -0.26 0.00 0.00 60.65 57.98 1l2a s ILE 487 Cb -0.04 -1.86 -0.07 0.00 1.25 0.00 0.00 42.46 41.74 1l2a s ILE 487 CO 0.06 -0.73 1.30 -2.65 0.24 0.00 0.00 174.94 173.15 1l2a n PRO 488 N -0.20 1.76 0.00 0.37 -0.02 -1.26 0.31 135.00 135.95 1l2a n PRO 488 Ca -0.10 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1l2a n PRO 488 Cb 0.61 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1l2a n PRO 488 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1l2a n SER 489 N -0.48 2.83 -4.36 2.55 3.41 -0.15 -4.70 113.62 112.71 1l2a n SER 489 Ca 0.09 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.38 1l2a n SER 489 Cb 0.43 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.23 1l2a n SER 489 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1l2a s ASP 490 N -3.70 3.42 0.04 4.04 1.01 -1.14 -1.26 116.67 119.08 1l2a s ASP 490 Ca 0.00 -0.38 0.08 0.00 0.71 0.00 0.00 52.55 52.96 1l2a s ASP 490 Cb 0.00 -0.70 -0.03 0.00 1.01 0.00 0.00 42.92 43.21 1l2a s ASP 490 CO 0.00 0.30 -0.23 -0.76 0.21 0.00 0.00 175.17 174.69 1l2a s LEU 491 N -0.48 2.15 -0.04 1.23 1.02 -0.18 -0.53 118.68 121.84 1l2a s LEU 491 Ca 0.06 -0.53 0.04 0.00 0.02 0.00 0.00 54.13 53.72 1l2a s LEU 491 Cb -0.11 -1.11 -0.00 0.00 0.02 0.00 0.00 46.19 44.99 1l2a s LEU 491 CO 0.01 0.21 -0.17 -0.70 0.02 0.00 0.00 176.35 175.72 1l2a s GLU 492 N -1.12 1.74 0.06 1.70 2.12 0.68 -4.54 118.70 119.33 1l2a s GLU 492 Ca 0.09 -0.61 0.09 0.00 0.36 0.00 0.00 54.97 54.91 1l2a s GLU 492 Cb -0.09 -1.53 -0.03 0.00 0.26 0.00 0.00 34.13 32.74 1l2a s GLU 492 CO 0.02 0.26 -0.26 -1.58 -0.54 0.00 0.00 175.26 173.15 1l2a s TRP 493 N -0.01 2.30 0.05 5.30 0.52 -1.26 -0.72 118.94 125.12 1l2a s TRP 493 Ca -0.03 -0.41 -0.06 0.00 0.02 0.00 0.00 56.10 55.62 1l2a s TRP 493 Cb -0.11 -1.36 -0.01 0.00 -1.15 0.00 0.00 33.47 30.84 1l2a s TRP 493 CO 0.02 0.15 0.11 -1.54 0.02 0.00 0.00 176.95 175.71 1l2a s SER 494 N -1.35 0.19 0.06 2.95 1.04 0.19 -4.99 113.70 111.80 1l2a s SER 494 Ca 0.12 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1l2a s SER 494 Cb -0.10 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1l2a s SER 494 CO 0.03 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1l2a n GLY 495 N 0.43 -1.25 3.17 7.32 0.00 -1.26 -0.63 105.19 112.97 1l2a n GLY 495 Ca -0.17 -1.26 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 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 0.61 0.89 1.61 -0.21 -1.22 -4.89 119.66 116.45 1l2a s GLN 496 Ca 0.00 -0.45 -0.11 0.00 0.02 0.00 0.00 55.36 54.82 1l2a s GLN 496 Cb 0.00 0.26 0.13 0.00 1.00 0.00 0.00 33.01 34.40 1l2a s GLN 496 CO 0.00 -0.17 1.09 -1.25 -2.12 0.00 0.00 175.29 172.85 1l2a s PRO 497 N -1.86 1.26 0.45 2.91 0.04 -1.26 -3.81 135.00 132.74 1l2a s PRO 497 Ca -0.11 1.03 -0.20 0.00 0.04 0.00 0.00 61.00 61.76 1l2a s PRO 497 Cb -0.04 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.60 1l2a s PRO 497 CO 0.00 -2.30 0.98 -0.51 0.04 0.00 0.00 177.00 175.21 1l2a s ASP 498 N -3.20 6.73 0.13 6.66 1.01 -1.26 -4.75 116.67 121.98 1l2a s ASP 498 Ca 0.64 1.76 -0.35 0.00 0.71 0.00 0.00 52.55 55.31 1l2a s ASP 498 Cb -0.19 -2.54 -0.16 0.00 1.01 0.00 0.00 42.92 41.03 1l2a s ASP 498 CO 0.58 -0.51 1.22 0.41 0.21 0.00 0.00 175.17 177.08 1l2a n THR 499 N -0.81 0.50 -2.26 -1.27 -1.04 -1.26 -4.84 114.28 103.30 1l2a n THR 499 Ca 0.08 -0.12 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1l2a n THR 499 Cb 0.54 -0.78 -0.03 0.00 -1.82 0.00 0.00 70.33 68.23 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 0.09 3.12 0.00 -1.42 -0.11 -0.47 -4.84 118.94 115.30 1l2a s TRP 500 Ca 0.79 0.98 0.00 0.00 1.22 0.00 0.00 56.10 59.09 1l2a s TRP 500 Cb -0.91 -3.61 0.00 0.00 -1.50 0.00 0.00 33.47 27.45 1l2a s TRP 500 CO 0.50 -2.12 0.57 2.41 -4.62 0.00 0.00 176.95 173.69 1l2a n THR 501 N 4.27 0.31 0.00 5.86 -1.04 -1.26 -4.77 114.28 117.65 1l2a n THR 501 Ca 0.12 -0.38 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 1l2a n THR 501 Cb 0.44 1.01 0.00 0.00 -1.82 0.00 0.00 70.33 69.96 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 -0.16 0.62 3.29 3.41 0.00 -1.26 -5.06 105.19 106.03 1l2a n GLY 502 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.00 -0.02 0.18 2.61 2.01 -1.26 -5.13 115.64 112.04 1l2a s THR 503 Ca 0.00 0.07 -0.32 0.00 0.31 0.00 0.00 61.69 61.75 1l2a s THR 503 Cb 0.00 -0.61 -0.11 0.00 0.01 0.00 0.00 72.50 71.79 1l2a s THR 503 CO 0.00 0.03 1.67 -0.47 -0.69 0.00 0.00 174.62 175.16 1l2a s TYR 504 N 1.13 2.91 -1.99 4.92 5.04 -1.26 -4.90 117.35 123.20 1l2a s TYR 504 Ca -0.07 0.42 0.23 0.00 -2.44 0.00 0.00 57.07 55.21 1l2a s TYR 504 Cb -0.07 -4.06 0.09 0.00 0.35 0.00 0.00 41.96 38.27 1l2a s TYR 504 CO -0.10 -4.03 1.15 0.25 -1.34 0.00 0.00 175.55 171.48 1l2a n THR 505 N 4.04 0.00 -0.09 4.34 -2.24 -1.26 -4.96 114.28 114.12 1l2a n THR 505 Ca 0.15 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1l2a n THR 505 Cb 0.37 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 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 1.41 0.98 3.88 3.38 0.00 -1.26 -4.67 105.19 108.91 1l2a n GLY 506 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.94 0.29 1.61 3.02 -1.26 -4.03 115.26 111.94 1l2a n ASN 507 Ca 0.00 -0.88 0.19 0.00 -0.03 0.00 0.00 54.58 53.87 1l2a n ASN 507 Cb 0.00 -1.10 0.99 0.00 -0.61 0.00 0.00 39.78 39.05 1l2a n ASN 507 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1l2a h PRO 508 N -0.74 0.00 -0.49 3.52 0.13 -1.92 -0.46 132.00 132.04 1l2a h PRO 508 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1l2a h PRO 508 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1l2a h PRO 508 CO 0.34 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.20 1l2a n ASN 509 N -2.88 3.63 -4.55 1.44 5.03 -1.26 -4.86 115.26 111.80 1l2a n ASN 509 Ca -0.02 -2.00 -0.40 0.00 0.87 0.00 0.00 54.58 53.04 1l2a n ASN 509 Cb 0.11 -0.32 -0.11 0.00 -1.02 0.00 0.00 39.78 38.44 1l2a n ASN 509 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1l2a s LEU 510 N -1.35 4.36 -0.01 3.41 2.96 -0.18 -3.46 118.68 124.41 1l2a s LEU 510 Ca 0.42 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 54.11 1l2a s LEU 510 Cb 0.24 -2.15 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 1l2a s LEU 510 CO 0.33 -0.18 -0.19 -1.00 -1.32 0.00 0.00 176.35 173.98 1l2a s HIS 511 N 1.75 1.66 0.02 5.38 3.76 0.19 -0.83 115.29 127.23 1l2a s HIS 511 Ca 0.07 -0.32 0.07 0.00 -0.15 0.00 0.00 55.06 54.74 1l2a s HIS 511 Cb -0.17 -1.06 -0.02 0.00 1.11 0.00 0.00 32.58 32.44 1l2a s HIS 511 CO 0.11 -0.02 -0.22 0.54 -0.85 0.00 0.00 174.74 174.30 1l2a s VAL 512 N -0.46 1.75 -0.02 -0.90 0.11 -1.26 -0.64 120.40 118.99 1l2a s VAL 512 Ca 0.07 -1.14 0.02 0.00 -2.93 0.00 0.00 61.98 58.00 1l2a s VAL 512 Cb -0.07 -1.50 0.00 0.00 -1.53 0.00 0.00 36.38 33.29 1l2a s VAL 512 CO -0.01 0.32 -0.06 -0.60 -3.33 0.00 0.00 175.10 171.42 1l2a s ARG 513 N -0.97 0.66 -0.28 1.54 3.52 0.10 -4.89 118.95 118.63 1l2a s ARG 513 Ca 0.08 -0.21 -0.26 0.00 -0.13 0.00 0.00 55.73 55.22 1l2a s ARG 513 Cb -0.09 -0.65 0.00 0.00 -1.56 0.00 0.00 34.95 32.66 1l2a s ARG 513 CO 0.01 0.08 0.89 0.08 -0.81 0.00 0.00 175.30 175.55 1l2a s VAL 514 N 0.16 4.73 -0.35 7.11 1.01 -1.26 -0.23 120.40 131.57 1l2a s VAL 514 Ca -0.02 1.51 0.22 0.00 0.00 0.00 0.00 61.98 63.70 1l2a s VAL 514 Cb -0.06 -4.22 -0.23 0.00 0.00 0.00 0.00 36.38 31.87 1l2a s VAL 514 CO -0.00 -0.24 0.74 0.35 0.00 0.00 0.00 175.10 175.95 1l2a n THR 515 N 5.50 0.11 -3.63 3.92 -2.24 0.31 -4.97 114.28 113.28 1l2a n THR 515 Ca 0.07 -0.36 -0.12 0.00 -2.27 0.00 0.00 64.05 61.37 1l2a n THR 515 Cb 0.47 0.18 -0.05 0.00 -2.10 0.00 0.00 70.33 68.83 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 -4.21 -0.30 0.29 3.42 1.04 -1.20 -4.96 113.70 107.79 1l2a s SER 516 Ca -0.02 -0.07 0.11 0.00 0.48 0.00 0.00 55.95 56.45 1l2a s SER 516 Cb 0.14 0.46 -0.05 0.00 0.10 0.00 0.00 66.02 66.66 1l2a s SER 516 CO 0.86 -0.74 -0.16 -0.31 0.98 0.00 0.00 173.24 173.87 1l2a s TYR 517 N -2.95 2.27 0.00 5.02 1.51 -1.26 -0.98 117.35 120.96 1l2a s TYR 517 Ca -0.02 -0.41 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1l2a s TYR 517 Cb 0.00 -1.09 0.00 0.00 -0.11 0.00 0.00 41.96 40.76 1l2a s TYR 517 CO -0.06 0.64 0.00 0.41 -1.11 0.00 0.00 175.55 175.43 1l2a n GLY 518 N -0.65 1.63 0.20 0.71 0.00 0.15 -4.78 105.19 102.44 1l2a n GLY 518 Ca -0.05 -0.94 0.03 0.00 0.00 0.00 0.00 46.02 45.05 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 0.73 -1.70 2.61 5.66 -1.26 -0.27 114.28 120.05 1l2a n THR 519 Ca 0.00 -0.84 -0.64 0.00 -3.05 0.00 0.00 64.05 59.52 1l2a n THR 519 Cb 0.00 0.37 -0.09 0.00 -1.55 0.00 0.00 70.33 69.06 1l2a n THR 519 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1l2a n ASP 520 N -0.51 1.51 0.04 1.09 -0.08 -1.26 -4.89 116.55 112.45 1l2a n ASP 520 Ca 0.05 1.11 -0.11 0.00 -1.51 0.00 0.00 54.79 54.33 1l2a n ASP 520 Cb 0.57 -0.96 -0.13 0.00 2.34 0.00 0.00 41.12 42.94 1l2a n ASP 520 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1l2a h LEU 521 N 6.00 0.15 0.75 -2.67 3.38 -1.97 -1.25 115.31 119.70 1l2a h LEU 521 Ca -0.42 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.30 1l2a h LEU 521 Cb 1.36 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 42.07 1l2a h LEU 521 CO 0.98 1.18 -0.36 1.23 0.09 0.00 0.00 178.44 181.56 1l2a h GLY 522 N 2.61 -1.05 0.40 0.83 0.00 -1.89 -1.58 103.07 102.40 1l2a h GLY 522 Ca -0.17 0.39 0.14 0.00 0.00 0.00 0.00 47.33 47.68 1l2a h GLY 522 CO 0.13 -0.38 0.63 -2.08 0.00 0.00 0.00 176.54 174.84 1l2a h VAL 523 N -1.12 0.87 -0.79 4.60 2.07 -1.94 0.32 116.25 120.26 1l2a h VAL 523 Ca -0.10 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 1l2a h VAL 523 Cb 0.79 -0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 1l2a h VAL 523 CO 0.17 0.17 0.38 0.00 0.02 0.00 0.00 177.57 178.30 1l2a h ALA 524 N 1.57 1.02 -0.15 1.67 0.00 -1.15 0.12 119.26 122.34 1l2a h ALA 524 Ca 0.51 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 1l2a h ALA 524 Cb 0.59 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1l2a h ALA 524 CO -0.29 0.59 -0.05 0.78 0.00 0.00 0.00 179.25 180.29 1l2a h GLY 525 N 1.13 0.32 0.68 0.00 0.00 0.34 -0.55 103.07 104.98 1l2a h GLY 525 Ca 0.27 -0.27 0.07 0.00 0.00 0.00 0.00 47.33 47.40 1l2a h GLY 525 CO -0.03 0.25 0.46 0.23 0.00 0.00 0.00 176.54 177.45 1l2a h SER 526 N -0.03 0.71 -0.35 0.19 0.87 -0.34 0.58 113.55 115.18 1l2a h SER 526 Ca 0.03 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1l2a h SER 526 Cb 0.50 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1l2a h SER 526 CO 0.02 0.45 0.07 0.25 -0.53 0.00 0.00 176.83 177.08 1l2a h LEU 527 N 0.84 0.55 -0.73 2.23 5.85 -0.85 0.86 115.31 124.05 1l2a h LEU 527 Ca 0.35 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.88 1l2a h LEU 527 Cb 0.21 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1l2a h LEU 527 CO -0.19 0.65 0.43 0.00 -0.34 0.00 0.00 178.44 179.00 1l2a h ALA 528 N 0.91 0.99 0.78 1.25 0.00 -0.75 -0.59 119.26 121.86 1l2a h ALA 528 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1l2a h ALA 528 Cb 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1l2a h ALA 528 CO 0.00 0.14 -0.45 -0.97 0.00 0.00 0.00 179.25 177.98 1l2a h ASN 529 N 0.80 -1.11 -0.65 0.00 -0.73 -0.19 0.16 115.58 113.86 1l2a h ASN 529 Ca 0.32 0.06 0.13 0.00 1.87 0.00 0.00 56.30 58.68 1l2a h ASN 529 Cb 0.17 0.31 -0.12 0.00 0.27 0.00 0.00 38.32 38.95 1l2a h ASN 529 CO -0.17 -0.71 -0.20 0.00 -0.37 0.00 0.00 177.43 175.98 1l2a h ALA 530 N -1.00 0.35 -0.40 1.57 0.00 -0.74 0.34 119.26 119.38 1l2a h ALA 530 Ca -0.10 0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1l2a h ALA 530 Cb 0.91 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1l2a h ALA 530 CO 0.13 -0.47 0.07 -0.07 0.00 0.00 0.00 179.25 178.91 1l2a h LEU 531 N -0.03 0.62 -0.10 0.00 3.38 -0.89 -0.56 115.31 117.72 1l2a h LEU 531 Ca 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1l2a h LEU 531 Cb 0.50 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1l2a h LEU 531 CO -0.69 0.72 0.02 0.00 0.09 0.00 0.00 178.44 178.58 1l2a h ALA 532 N 0.93 0.14 -0.31 1.53 0.00 -0.57 -0.51 119.26 120.46 1l2a h ALA 532 Ca 0.12 -0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1l2a h ALA 532 Cb 0.36 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.04 1l2a h ALA 532 CO 0.01 -0.21 -0.15 1.15 0.00 0.00 0.00 179.25 180.05 1l2a h THR 533 N -0.06 0.54 -0.67 0.00 2.02 -0.89 0.11 112.91 113.96 1l2a h THR 533 Ca 0.03 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.28 1l2a h THR 533 Cb 0.28 0.54 -0.06 0.00 -1.74 0.00 0.00 68.15 67.18 1l2a h THR 533 CO 0.00 0.00 0.35 0.22 0.37 0.00 0.00 175.52 176.46 1l2a h TYR 534 N -0.10 0.64 -0.21 3.16 3.20 -1.03 0.79 116.97 123.42 1l2a h TYR 534 Ca 0.16 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 1l2a h TYR 534 Cb 0.34 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1l2a h TYR 534 CO -0.35 0.28 0.12 0.00 -1.64 0.00 0.00 178.16 176.57 1l2a h ALA 535 N 1.37 0.27 -0.79 1.82 0.00 0.00 -1.18 119.26 120.75 1l2a h ALA 535 Ca 0.31 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.27 1l2a h ALA 535 Cb 0.25 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 1l2a h ALA 535 CO -0.21 -0.23 0.44 0.00 0.00 0.00 0.00 179.25 179.25 1l2a h ALA 536 N 1.03 1.11 -0.71 0.00 0.00 -0.37 -1.54 119.26 118.79 1l2a h ALA 536 Ca 0.07 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1l2a h ALA 536 Cb 0.03 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1l2a h ALA 536 CO -0.01 0.06 0.44 0.00 0.00 0.00 0.00 179.25 179.74 1l2a h ALA 537 N 1.44 0.93 -0.41 0.00 0.00 -0.13 -1.19 119.26 119.91 1l2a h ALA 537 Ca 0.38 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.21 1l2a h ALA 537 Cb 0.35 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1l2a h ALA 537 CO -0.25 0.22 0.00 1.79 0.00 0.00 0.00 179.25 181.01 1l2a h THR 538 N 0.86 1.22 -0.39 0.00 1.35 -0.25 -1.49 112.91 114.22 1l2a h THR 538 Ca 0.29 -0.89 -0.05 0.00 -0.55 0.00 0.00 66.41 65.20 1l2a h THR 538 Cb 0.03 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 67.35 1l2a h THR 538 CO -0.11 0.31 0.04 -0.08 -0.25 0.00 0.00 175.52 175.43 1l2a h GLU 539 N 0.61 0.66 -0.39 4.72 4.81 -1.00 -0.60 114.58 123.40 1l2a h GLU 539 Ca 0.13 -0.19 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1l2a h GLU 539 Cb 0.39 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1l2a h GLU 539 CO 0.01 0.73 -0.16 -0.09 -0.73 0.00 0.00 179.01 178.78 1l2a h ARG 540 N 0.49 0.79 0.00 1.92 2.43 -0.90 -3.38 114.38 115.74 1l2a h ARG 540 Ca 0.11 -0.33 -0.08 0.00 -0.81 0.00 0.00 59.98 58.87 1l2a h ARG 540 Cb 0.41 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1l2a h ARG 540 CO 0.01 0.96 -1.41 0.91 -1.51 0.00 0.00 179.97 178.93 1l2a n TRP 541 N -4.29 0.00 1.04 2.20 7.02 -0.59 -4.74 117.44 118.09 1l2a n TRP 541 Ca -0.02 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.58 1l2a n TRP 541 Cb 0.40 -0.27 0.05 0.00 -2.42 0.00 0.00 31.31 29.07 1l2a n TRP 541 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1l2a n GLU 542 N -2.07 1.06 -0.97 -0.99 1.02 -0.24 -4.96 120.64 113.49 1l2a n GLU 542 Ca -0.07 -0.84 0.00 0.00 -0.02 0.00 0.00 57.16 56.22 1l2a n GLU 542 Cb 0.53 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 1l2a n GLU 542 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l2a n GLY 543 N 1.41 0.29 2.99 0.62 0.00 -1.18 -4.95 105.19 104.38 1l2a n GLY 543 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.07 1l2a n GLY 543 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1l2a s LYS 544 N -0.89 0.43 0.05 1.61 2.20 -1.22 -5.04 119.74 116.86 1l2a s LYS 544 Ca 0.00 0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 55.98 1l2a s LYS 544 Cb 0.00 -0.12 -0.08 0.00 -1.51 0.00 0.00 37.83 36.12 1l2a s LYS 544 CO 0.00 -0.65 1.65 -1.17 -0.36 0.00 0.00 175.35 174.82 1l2a s LEU 545 N 2.65 4.36 -0.81 5.43 2.96 -1.26 -4.19 118.68 127.82 1l2a s LEU 545 Ca 0.15 2.44 -0.25 0.00 -0.22 0.00 0.00 54.13 56.25 1l2a s LEU 545 Cb -0.15 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 42.99 1l2a s LEU 545 CO -0.18 -0.89 1.61 -0.62 -1.32 0.00 0.00 176.35 174.95 1l2a s ASP 546 N 2.61 5.80 0.21 3.68 -1.08 -1.26 -4.84 116.67 121.79 1l2a s ASP 546 Ca 0.74 -0.56 -0.09 0.00 -0.52 0.00 0.00 52.55 52.13 1l2a s ASP 546 Cb -0.39 -2.55 0.15 0.00 -1.46 0.00 0.00 42.92 38.67 1l2a s ASP 546 CO 0.32 -2.09 1.80 0.74 0.52 0.00 0.00 175.17 176.46 1l2a h THR 547 N 6.70 1.25 -0.26 1.71 2.02 -1.95 -2.79 112.91 119.60 1l2a h THR 547 Ca -0.07 -0.70 -0.08 0.00 0.77 0.00 0.00 66.41 66.33 1l2a h THR 547 Cb 1.06 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1l2a h THR 547 CO 1.29 0.30 -0.18 0.11 0.37 0.00 0.00 175.52 177.40 1l2a h LYS 548 N 1.10 0.45 -0.17 6.66 1.57 -1.99 -0.27 116.57 123.92 1l2a h LYS 548 Ca 0.27 -0.14 -0.18 0.00 -1.87 0.00 0.00 60.65 58.72 1l2a h LYS 548 Cb 0.12 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.40 1l2a h LYS 548 CO -0.03 0.62 -0.59 0.00 -0.57 0.00 0.00 179.45 178.88 1l2a h ALA 549 N 1.40 0.30 -0.44 3.86 0.00 -1.87 -1.57 119.26 120.94 1l2a h ALA 549 Ca 0.07 -0.53 0.07 0.00 0.00 0.00 0.00 54.91 54.52 1l2a h ALA 549 Cb 0.56 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1l2a h ALA 549 CO 0.04 0.55 0.11 -0.09 0.00 0.00 0.00 179.25 179.85 1l2a h ARG 550 N 0.40 0.24 -0.03 0.00 2.43 -1.20 -1.26 114.38 114.96 1l2a h ARG 550 Ca -0.03 -0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 58.96 1l2a h ARG 550 Cb 1.22 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 1l2a h ARG 550 CO 0.13 0.16 -0.72 -0.44 -1.51 0.00 0.00 179.97 177.58 1l2a h ASP 551 N 0.25 0.25 0.17 -3.80 3.32 -1.01 -2.06 116.42 113.55 1l2a h ASP 551 Ca 0.21 -0.17 -0.13 0.00 0.02 0.00 0.00 57.03 56.96 1l2a h ASP 551 Cb 0.25 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1l2a h ASP 551 CO -0.26 0.89 -0.49 -0.03 -1.72 0.00 0.00 179.24 177.62 1l2a h MET 552 N 0.14 0.37 -0.47 3.56 4.05 -1.09 0.11 114.93 121.61 1l2a h MET 552 Ca -0.02 -0.21 -0.02 0.00 -0.28 0.00 0.00 59.70 59.17 1l2a h MET 552 Cb 1.28 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 32.08 1l2a h MET 552 CO 0.11 0.78 0.20 0.00 0.23 0.00 0.00 176.91 178.23 1l2a h ALA 553 N 1.19 0.60 -0.21 0.39 0.00 -0.78 0.41 119.26 120.86 1l2a h ALA 553 Ca 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1l2a h ALA 553 Cb 0.97 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1l2a h ALA 553 CO 0.08 0.20 0.04 0.00 0.00 0.00 0.00 179.25 179.57 1l2a h ALA 554 N 1.04 0.28 -0.73 0.00 0.00 -1.10 -2.09 119.26 116.66 1l2a h ALA 554 Ca 0.16 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 55.01 1l2a h ALA 554 Cb 0.17 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.80 1l2a h ALA 554 CO -0.02 -0.05 0.33 0.93 0.00 0.00 0.00 179.25 180.44 1l2a h GLU 555 N 0.15 0.51 -0.44 0.00 4.39 -0.59 0.30 114.58 118.91 1l2a h GLU 555 Ca 0.06 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 1l2a h GLU 555 Cb 0.31 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1l2a h GLU 555 CO 0.00 0.34 0.05 -0.07 -1.16 0.00 0.00 179.01 178.17 1l2a h LEU 556 N 0.53 0.71 0.12 1.33 3.38 -0.70 -1.00 115.31 119.67 1l2a h LEU 556 Ca 0.38 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1l2a h LEU 556 Cb 0.49 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1l2a h LEU 556 CO -0.33 0.80 -0.06 0.58 0.09 0.00 0.00 178.44 179.53 1l2a h VAL 557 N 0.59 1.04 -0.31 1.22 2.07 -0.93 -1.69 116.25 118.24 1l2a h VAL 557 Ca 0.13 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.99 1l2a h VAL 557 Cb 0.41 1.48 -0.08 0.00 -1.52 0.00 0.00 31.29 31.58 1l2a h VAL 557 CO 0.01 0.17 -0.48 0.78 0.02 0.00 0.00 177.57 178.07 1l2a h ASN 558 N -0.50 -1.56 0.25 0.57 2.35 -0.95 0.18 115.58 115.92 1l2a h ASN 558 Ca -0.02 0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1l2a h ASN 558 Cb 0.40 0.65 -0.00 0.00 0.05 0.00 0.00 38.32 39.42 1l2a h ASN 558 CO 0.03 -0.41 -0.15 0.03 -1.65 0.00 0.00 177.43 175.28 1l2a h ARG 559 N -0.42 0.00 0.15 0.81 3.08 -1.21 0.39 114.38 117.18 1l2a h ARG 559 Ca 0.09 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.86 1l2a h ARG 559 Cb 0.61 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.68 1l2a h ARG 559 CO -0.53 0.15 -1.28 0.00 -1.07 0.00 0.00 179.97 177.24 1l2a h ALA 560 N 1.85 0.04 0.23 0.04 0.00 -0.82 -3.14 119.26 117.47 1l2a h ALA 560 Ca -0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 54.05 1l2a h ALA 560 Cb 0.31 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1l2a h ALA 560 CO 0.02 0.85 -0.11 2.35 0.00 0.00 0.00 179.25 182.36 1l2a h TRP 561 N 0.13 -0.29 -0.99 0.00 2.91 0.58 -3.07 115.95 115.21 1l2a h TRP 561 Ca -0.17 -0.01 0.10 0.00 1.13 0.00 0.00 58.89 59.94 1l2a h TRP 561 Cb 1.98 0.10 -0.12 0.00 -0.51 0.00 0.00 29.16 30.60 1l2a h TRP 561 CO 0.09 -0.01 -0.56 0.98 -1.03 0.00 0.00 178.44 177.91 1l2a n TYR 562 N -4.98 -0.38 0.99 2.65 9.36 0.12 -2.22 117.16 122.71 1l2a n TYR 562 Ca -0.06 1.24 0.13 0.00 3.32 0.00 0.00 57.90 62.53 1l2a n TYR 562 Cb 0.21 -0.62 0.36 0.00 -0.63 0.00 0.00 39.34 38.66 1l2a n TYR 562 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1l2a n ASN 563 N -5.27 0.36 -0.13 2.98 3.02 -1.18 -0.44 115.26 114.59 1l2a n ASN 563 Ca 0.03 -0.01 0.02 0.00 -0.03 0.00 0.00 54.58 54.59 1l2a n ASN 563 Cb 0.28 0.02 0.03 0.00 -0.61 0.00 0.00 39.78 39.49 1l2a n ASN 563 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1l2a n PHE 564 N -1.52 0.00 -1.67 3.10 3.01 -1.14 -3.81 117.46 115.44 1l2a n PHE 564 Ca 0.06 -0.34 -0.45 0.00 1.01 0.00 0.00 57.45 57.73 1l2a n PHE 564 Cb 0.34 -0.06 -0.03 0.00 -0.01 0.00 0.00 39.48 39.72 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 -0.43 2.16 -3.31 1.38 9.36 -0.94 0.11 117.16 125.49 1l2a n TYR 565 Ca 0.03 0.39 -0.38 0.00 3.32 0.00 0.00 57.90 61.26 1l2a n TYR 565 Cb 0.50 -2.48 -0.07 0.00 -0.63 0.00 0.00 39.34 36.67 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 7.25 0.53 0.00 0.00 0.87 -1.92 -2.69 113.55 117.59 1l2a h SER 567 Ca -0.36 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 59.89 1l2a h SER 567 Cb 1.16 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1l2a h SER 567 CO 0.74 0.71 0.00 -0.62 -0.53 0.00 0.00 176.83 177.12 1l2a n GLU 568 N -4.56 0.00 -0.99 2.24 4.71 -1.26 -4.83 120.64 115.95 1l2a n GLU 568 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 1l2a n GLU 568 Cb 0.26 -1.43 0.00 0.00 -1.01 0.00 0.00 31.44 29.25 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 -0.90 0.61 0.00 0.62 0.00 -1.01 -4.95 105.19 99.56 1l2a n GLY 569 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.52 0.62 0.00 1.61 5.02 -1.26 -4.84 118.16 116.79 1l2a n LYS 570 Ca 0.00 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1l2a n LYS 570 Cb 0.02 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 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 0.58 1.43 2.96 0.72 0.00 -1.26 -4.73 105.19 104.89 1l2a n GLY 571 Ca 0.16 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.16 -0.21 1.61 -7.23 -1.26 -2.54 120.40 110.61 1l2a s VAL 572 Ca 0.00 0.23 0.01 0.00 -1.81 0.00 0.00 61.98 60.40 1l2a s VAL 572 Cb 0.00 -0.33 0.03 0.00 0.56 0.00 0.00 36.38 36.64 1l2a s VAL 572 CO 0.00 0.09 -0.14 0.54 -0.31 0.00 0.00 175.10 175.28 1l2a s VAL 573 N 1.65 2.35 0.87 1.32 0.11 0.12 -4.62 120.40 122.19 1l2a s VAL 573 Ca -0.05 -1.07 -0.15 0.00 -2.93 0.00 0.00 61.98 57.79 1l2a s VAL 573 Cb -0.11 -2.12 -0.02 0.00 -1.53 0.00 0.00 36.38 32.60 1l2a s VAL 573 CO -0.07 0.34 0.25 0.41 -3.33 0.00 0.00 175.10 172.71 1l2a n THR 574 N 4.60 0.59 -3.58 5.04 -1.04 -1.18 -4.36 114.28 114.37 1l2a n THR 574 Ca -0.18 -0.31 -0.23 0.00 -2.04 0.00 0.00 64.05 61.28 1l2a n THR 574 Cb 0.48 -0.55 -0.16 0.00 -1.82 0.00 0.00 70.33 68.28 1l2a n THR 574 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1l2a s GLU 575 N -3.02 0.10 -0.00 -2.82 2.12 -1.26 -3.62 118.70 110.20 1l2a s GLU 575 Ca 0.57 0.07 0.03 0.00 0.36 0.00 0.00 54.97 56.00 1l2a s GLU 575 Cb -0.26 -1.49 -0.01 0.00 0.26 0.00 0.00 34.13 32.63 1l2a s GLU 575 CO 0.67 -0.63 -0.10 -1.83 -0.54 0.00 0.00 175.26 172.82 1l2a s GLU 576 N 2.21 0.80 -0.13 4.30 -1.05 -1.20 -5.00 118.70 118.64 1l2a s GLU 576 Ca 0.04 -0.40 -0.25 0.00 -0.15 0.00 0.00 54.97 54.21 1l2a s GLU 576 Cb -0.16 -0.77 -0.02 0.00 -0.44 0.00 0.00 34.13 32.74 1l2a s GLU 576 CO -0.10 0.21 0.80 0.00 0.95 0.00 0.00 175.26 177.12 1l2a s ALA 577 N -0.32 3.45 -0.86 -0.84 0.00 -1.26 -4.18 121.76 117.74 1l2a s ALA 577 Ca 0.03 0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.07 1l2a s ALA 577 Cb -0.04 -3.16 0.21 0.00 0.00 0.00 0.00 23.12 20.13 1l2a s ALA 577 CO -0.00 -0.48 0.74 0.54 0.00 0.00 0.00 175.76 176.56 1l2a n ARG 578 N 4.76 2.51 -0.18 0.00 5.12 -1.25 -4.89 116.66 122.73 1l2a n ARG 578 Ca 0.03 -4.49 0.10 0.00 -1.93 0.00 0.00 57.85 51.56 1l2a n ARG 578 Cb 0.50 -2.39 0.40 0.00 -1.16 0.00 0.00 32.46 29.81 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 5.82 1.84 0.00 7.54 0.00 -1.93 -1.83 119.26 130.70 1l2a h ALA 579 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1l2a h ALA 579 Cb 0.79 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1l2a h ALA 579 CO 0.84 0.01 0.00 0.38 0.00 0.00 0.00 179.25 180.48 1l2a h ASP 580 N 0.64 0.00 0.46 0.00 2.03 -1.98 -3.04 116.42 114.52 1l2a h ASP 580 Ca 0.34 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.64 1l2a h ASP 580 Cb 0.48 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.98 1l2a h ASP 580 CO -0.12 0.00 0.00 1.88 -1.03 0.00 0.00 179.24 179.97 1l2a h TYR 581 N 0.00 0.00 -0.31 4.15 -1.99 -1.74 -0.03 116.97 117.05 1l2a h TYR 581 Ca 0.00 0.00 0.09 0.00 2.00 0.00 0.00 58.73 60.82 1l2a h TYR 581 Cb 0.18 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.90 1l2a h TYR 581 CO 0.00 0.00 0.36 1.57 -0.00 0.00 0.00 178.16 180.09 1l2a h LYS 582 N 0.00 0.00 0.00 4.88 2.10 -1.75 -1.74 116.57 120.06 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 0.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.56 1l2a h LYS 582 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 1l2a h ARG 583 N 0.00 0.00 -0.88 0.07 3.08 -1.26 -2.21 114.38 113.17 1l2a h ARG 583 Ca 0.15 0.00 0.22 0.00 0.07 0.00 0.00 59.98 60.42 1l2a h ARG 583 Cb 0.87 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.76 1l2a h ARG 583 CO -0.00 0.00 0.04 0.74 -1.07 0.00 0.00 179.97 179.68 1l2a h PHE 584 N 0.00 -0.01 0.00 3.04 0.04 -1.51 -2.73 116.94 115.77 1l2a h PHE 584 Ca 0.00 0.06 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 1l2a h PHE 584 Cb 0.56 0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.84 1l2a h PHE 584 CO 0.00 -0.32 -1.78 1.19 -0.60 0.00 0.00 178.31 176.80 1l2a n PHE 585 N -5.40 0.00 -0.04 -0.55 3.01 -0.91 -1.81 117.46 111.76 1l2a n PHE 585 Ca 0.19 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.57 1l2a n PHE 585 Cb 0.62 -0.46 -0.14 0.00 -0.01 0.00 0.00 39.48 39.49 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 -2.20 0.65 -2.54 -1.08 1.02 -0.88 -4.89 120.64 110.72 1l2a n GLU 586 Ca -0.10 0.19 -0.43 0.00 -0.02 0.00 0.00 57.16 56.80 1l2a n GLU 586 Cb 0.59 -1.71 -0.02 0.00 -0.02 0.00 0.00 31.44 30.28 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 -2.63 4.04 0.12 3.49 2.00 -1.03 -4.99 119.66 120.65 1l2a s GLN 587 Ca -0.06 1.20 -0.30 0.00 -2.00 0.00 0.00 55.36 54.20 1l2a s GLN 587 Cb 0.08 -3.79 -0.07 0.00 0.80 0.00 0.00 33.01 30.03 1l2a s GLN 587 CO 0.83 -0.95 1.23 -2.00 -0.50 0.00 0.00 175.29 173.90 1l2a s GLU 588 N 3.80 4.43 -0.25 1.67 2.12 -1.26 -1.87 118.70 127.35 1l2a s GLU 588 Ca 0.50 1.86 -0.16 0.00 0.36 0.00 0.00 54.97 57.53 1l2a s GLU 588 Cb -0.15 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 1l2a s GLU 588 CO 0.18 -0.23 0.43 0.08 -0.54 0.00 0.00 175.26 175.18 1l2a s VAL 589 N 0.65 5.14 0.28 3.70 1.01 -0.53 -4.87 120.40 125.78 1l2a s VAL 589 Ca 0.58 0.71 -0.30 0.00 0.00 0.00 0.00 61.98 62.97 1l2a s VAL 589 Cb -0.32 -3.75 -0.10 0.00 0.00 0.00 0.00 36.38 32.20 1l2a s VAL 589 CO 0.32 0.15 1.46 -0.47 0.00 0.00 0.00 175.10 176.56 1l2a s TYR 590 N 2.01 2.93 -0.02 5.22 5.04 -1.26 -4.34 117.35 126.93 1l2a s TYR 590 Ca 0.18 1.04 0.00 0.00 -2.44 0.00 0.00 57.07 55.86 1l2a s TYR 590 Cb -0.16 -3.87 0.02 0.00 0.35 0.00 0.00 41.96 38.30 1l2a s TYR 590 CO 0.09 -2.77 0.01 0.08 -1.34 0.00 0.00 175.55 171.61 1l2a s VAL 591 N -0.26 0.08 0.52 3.14 1.01 -1.26 -5.01 120.40 118.61 1l2a s VAL 591 Ca 0.58 0.09 -0.23 0.00 0.00 0.00 0.00 61.98 62.42 1l2a s VAL 591 Cb -0.43 -0.16 -0.06 0.00 0.00 0.00 0.00 36.38 35.73 1l2a s VAL 591 CO 0.47 0.09 1.36 -2.65 0.00 0.00 0.00 175.10 174.37 1l2a n PRO 592 N 3.83 1.80 -1.69 2.72 -0.02 -1.26 -4.53 135.00 135.85 1l2a n PRO 592 Ca -0.23 0.66 -0.44 0.00 -2.02 0.00 0.00 63.50 61.46 1l2a n PRO 592 Cb 0.53 -2.56 -0.03 0.00 -0.02 0.00 0.00 33.50 31.42 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 -0.83 1.62 -1.14 3.55 0.00 -1.26 -2.03 120.51 120.42 1l2a n ALA 593 Ca 0.09 0.42 -0.05 0.00 0.00 0.00 0.00 53.44 53.90 1l2a n ALA 593 Cb 0.44 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.51 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 2.81 0.73 3.73 0.00 0.00 -1.26 -5.02 105.19 106.18 1l2a n GLY 594 Ca 0.14 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.06 3.36 0.02 1.61 -0.00 -0.86 -5.10 118.94 115.91 1l2a s TRP 595 Ca 0.00 0.27 -0.03 0.00 -0.00 0.00 0.00 56.10 56.33 1l2a s TRP 595 Cb 0.00 -1.98 -0.01 0.00 -0.00 0.00 0.00 33.47 31.47 1l2a s TRP 595 CO 0.00 0.42 0.05 -1.54 -0.00 0.00 0.00 176.95 175.87 1l2a s SER 596 N -0.33 0.18 0.10 5.86 1.04 -1.26 -4.37 113.70 114.93 1l2a s SER 596 Ca 0.09 -0.47 -0.25 0.00 0.48 0.00 0.00 55.95 55.81 1l2a s SER 596 Cb -0.12 0.17 0.08 0.00 0.10 0.00 0.00 66.02 66.25 1l2a s SER 596 CO 0.01 -0.39 1.14 -0.83 0.98 0.00 0.00 173.24 174.15 1l2a s GLY 597 N -1.71 0.02 0.12 7.32 0.00 -1.13 -4.18 107.32 107.75 1l2a s GLY 597 Ca -0.11 -0.19 0.04 0.00 0.00 0.00 0.00 44.72 44.46 1l2a s GLY 597 CO -0.02 3.78 -0.11 -0.51 0.00 0.00 0.00 173.10 176.24 1l2a s THR 598 N -2.09 1.08 0.48 0.90 -4.23 -0.60 -0.71 115.64 110.47 1l2a s THR 598 Ca 0.25 -1.79 -0.07 0.00 -1.18 0.00 0.00 61.69 58.91 1l2a s THR 598 Cb -0.02 -1.54 -0.04 0.00 1.34 0.00 0.00 72.50 72.24 1l2a s THR 598 CO 0.03 -0.59 0.81 -0.04 -0.54 0.00 0.00 174.62 174.29 1l2a s MET 599 N -3.07 3.60 0.32 3.99 -1.94 -0.03 -1.33 119.30 120.84 1l2a s MET 599 Ca 0.10 0.32 0.09 0.00 -1.71 0.00 0.00 55.69 54.49 1l2a s MET 599 Cb -0.02 -2.34 0.88 0.00 2.01 0.00 0.00 34.83 35.37 1l2a s MET 599 CO 0.01 -0.22 1.71 -1.35 -0.01 0.00 0.00 175.02 175.16 1l2a h PRO 600 N 0.37 0.49 0.00 2.03 0.11 -1.86 -0.29 132.00 132.85 1l2a h PRO 600 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1l2a h PRO 600 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1l2a h PRO 600 CO 0.62 0.32 0.00 0.27 -0.21 0.00 0.00 178.00 179.01 1l2a n ASN 601 N -4.95 0.00 0.00 -2.05 6.94 -1.26 -4.90 115.26 109.05 1l2a n ASN 601 Ca 0.27 -0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.57 1l2a n ASN 601 Cb 0.76 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.97 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 0.82 0.84 3.72 4.83 0.00 -0.12 -5.07 105.19 110.22 1l2a n GLY 602 Ca 0.14 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1l2a n GLY 602 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l2a s ASP 603 N -2.10 7.02 0.04 1.61 1.01 -1.25 -4.87 116.67 118.13 1l2a s ASP 603 Ca 0.00 2.14 -0.23 0.00 0.71 0.00 0.00 52.55 55.17 1l2a s ASP 603 Cb 0.00 -2.59 -0.06 0.00 1.01 0.00 0.00 42.92 41.29 1l2a s ASP 603 CO 0.00 -0.49 0.69 -0.54 0.21 0.00 0.00 175.17 175.04 1l2a s LYS 604 N 0.73 4.42 -0.54 8.23 1.02 -1.26 -0.85 119.74 131.49 1l2a s LYS 604 Ca 0.59 0.93 -0.09 0.00 0.02 0.00 0.00 55.97 57.41 1l2a s LYS 604 Cb -0.32 -3.34 0.14 0.00 -0.52 0.00 0.00 37.83 33.79 1l2a s LYS 604 CO 0.31 0.36 0.42 0.42 -0.92 0.00 0.00 175.35 175.94 1l2a s ILE 605 N -0.25 4.34 0.04 2.17 1.01 0.11 -4.71 121.20 123.91 1l2a s ILE 605 Ca 0.35 -2.03 -0.02 0.00 0.00 0.00 0.00 60.65 58.95 1l2a s ILE 605 Cb -0.20 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1l2a s ILE 605 CO 0.21 -0.83 -0.01 0.00 0.00 0.00 0.00 174.94 174.32 1l2a s GLN 606 N 1.02 0.54 0.22 2.79 -2.07 -1.26 -2.84 119.66 118.06 1l2a s GLN 606 Ca 0.09 -1.00 -0.31 0.00 -1.82 0.00 0.00 55.36 52.32 1l2a s GLN 606 Cb -0.24 0.19 -0.14 0.00 -1.09 0.00 0.00 33.01 31.74 1l2a s GLN 606 CO -0.02 -0.11 1.33 -2.30 -1.32 0.00 0.00 175.29 172.87 1l2a n PRO 607 N 0.56 1.79 0.00 9.60 -0.02 -1.26 -2.61 135.00 143.06 1l2a n PRO 607 Ca -0.17 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1l2a n PRO 607 Cb 0.59 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 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 2.07 0.47 3.52 -1.23 0.00 -1.26 -5.04 105.19 103.71 1l2a n GLY 608 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1l2a n GLY 608 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1l2a n ILE 609 N -1.40 0.00 -4.43 -0.61 -5.35 -1.07 -4.85 119.36 101.64 1l2a n ILE 609 Ca 0.00 -0.14 -0.22 0.00 -0.27 0.00 0.00 62.75 62.12 1l2a n ILE 609 Cb 0.00 -0.81 -0.10 0.00 -1.74 0.00 0.00 39.64 36.98 1l2a n ILE 609 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1l2a s LYS 610 N -4.12 1.55 0.23 6.28 -0.14 -1.26 -1.45 119.74 120.84 1l2a s LYS 610 Ca 0.62 -1.75 -0.15 0.00 -1.36 0.00 0.00 55.97 53.33 1l2a s LYS 610 Cb -0.22 -1.36 0.27 0.00 -1.68 0.00 0.00 37.83 34.85 1l2a s LYS 610 CO 0.63 0.16 1.50 0.34 -0.76 0.00 0.00 175.35 177.22 1l2a n PHE 611 N -0.56 0.08 0.22 3.18 -0.00 -0.78 -1.16 117.46 118.44 1l2a n PHE 611 Ca -0.06 1.19 0.06 0.00 -0.00 0.00 0.00 57.45 58.64 1l2a n PHE 611 Cb 0.62 -0.89 0.49 0.00 -0.00 0.00 0.00 39.48 39.69 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 0.99 0.43 -2.13 6.09 -1.67 -3.32 117.51 117.91 1l2a h ILE 612 Ca 0.36 -0.96 -0.02 0.00 -1.37 0.00 0.00 64.86 62.87 1l2a h ILE 612 Cb 0.60 1.55 0.00 0.00 0.47 0.00 0.00 36.82 39.44 1l2a h ILE 612 CO -0.96 0.26 -0.20 0.44 -3.07 0.00 0.00 178.15 174.61 1l2a h ASP 613 N 0.00 -0.48 0.00 2.19 3.32 -1.45 -0.89 116.42 119.11 1l2a h ASP 613 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1l2a h ASP 613 Cb 0.53 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1l2a h ASP 613 CO 0.03 -0.31 0.00 2.30 -1.72 0.00 0.00 179.24 179.54 1l2a n ILE 614 N -5.32 0.00 -2.50 0.35 -5.35 -1.25 -3.53 119.36 101.77 1l2a n ILE 614 Ca -0.11 0.00 -0.20 0.00 -0.27 0.00 0.00 62.75 62.17 1l2a n ILE 614 Cb 0.25 -0.52 0.01 0.00 -1.74 0.00 0.00 39.64 37.64 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 -0.90 2.68 -0.19 6.28 1.74 -0.35 -4.93 116.66 120.98 1l2a n ARG 615 Ca 0.15 -4.04 -0.03 0.00 -0.77 0.00 0.00 57.85 53.16 1l2a n ARG 615 Cb 0.07 -1.92 0.04 0.00 -1.02 0.00 0.00 32.46 29.63 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 2.85 0.34 0.00 0.55 2.02 -1.56 -1.37 112.91 115.73 1l2a h THR 616 Ca 0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.34 1l2a h THR 616 Cb 1.09 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1l2a h THR 616 CO 0.70 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.88 1l2a n LYS 617 N -5.42 0.00 0.09 6.66 5.02 -1.26 0.62 118.16 123.86 1l2a n LYS 617 Ca 0.06 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.33 1l2a n LYS 617 Cb 0.33 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.80 1l2a n LYS 617 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 1l2a h TYR 618 N 0.00 0.00 0.00 2.13 0.05 -1.60 -3.25 116.97 114.30 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 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1l2a h TYR 618 CO 0.00 0.71 0.00 0.00 -1.05 0.00 0.00 178.16 177.82 1l2a h ARG 619 N 0.00 0.00 -0.58 4.88 3.08 -0.03 -1.70 114.38 120.03 1l2a h ARG 619 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1l2a h ARG 619 Cb 1.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.64 1l2a h ARG 619 CO 0.08 0.00 0.00 1.04 -1.07 0.00 0.00 179.97 180.02 1l2a n GLN 620 N -2.42 2.50 -2.76 0.04 3.00 -1.23 -4.92 117.38 111.59 1l2a n GLN 620 Ca -0.00 -2.06 -0.41 0.00 -0.01 0.00 0.00 57.00 54.52 1l2a n GLN 620 Cb 0.13 -1.51 -0.05 0.00 0.00 0.00 0.00 30.24 28.81 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 -0.95 7.52 0.48 1.08 -1.08 -0.64 -4.94 116.67 118.14 1l2a s ASP 621 Ca 0.38 1.81 0.26 0.00 -0.52 0.00 0.00 52.55 54.48 1l2a s ASP 621 Cb 0.21 -2.58 1.39 0.00 -1.46 0.00 0.00 42.92 40.48 1l2a s ASP 621 CO 0.24 0.01 1.76 1.55 0.52 0.00 0.00 175.17 179.24 1l2a h PRO 622 N 5.15 0.00 -0.12 4.34 0.13 -1.93 -1.27 132.00 138.30 1l2a h PRO 622 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1l2a h PRO 622 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1l2a h PRO 622 CO 0.70 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.13 1l2a n TYR 623 N -2.52 0.16 -0.25 1.56 4.02 -1.26 -4.65 117.16 114.22 1l2a n TYR 623 Ca -0.02 -0.41 -0.06 0.00 -0.01 0.00 0.00 57.90 57.40 1l2a n TYR 623 Cb 0.22 -0.03 0.05 0.00 -0.02 0.00 0.00 39.34 39.55 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 0.85 1.00 0.28 -0.72 3.20 -1.48 -2.86 116.97 117.24 1l2a h TYR 624 Ca 0.00 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 1l2a h TYR 624 Cb 0.53 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1l2a h TYR 624 CO 0.08 0.76 -0.27 -0.44 -1.64 0.00 0.00 178.16 176.64 1l2a h ASP 625 N 0.96 -0.75 -0.95 -2.11 3.32 -1.83 0.10 116.42 115.16 1l2a h ASP 625 Ca 0.23 0.06 0.28 0.00 0.02 0.00 0.00 57.03 57.62 1l2a h ASP 625 Cb 0.15 0.25 -0.17 0.00 0.22 0.00 0.00 39.33 39.78 1l2a h ASP 625 CO -0.03 -0.36 0.18 0.40 -1.72 0.00 0.00 179.24 177.71 1l2a h ILE 626 N -0.55 0.11 0.10 0.35 2.04 -1.87 0.63 117.51 118.33 1l2a h ILE 626 Ca -0.04 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1l2a h ILE 626 Cb 0.47 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1l2a h ILE 626 CO -0.03 0.01 -0.05 0.58 0.00 0.00 0.00 178.15 178.66 1l2a h VAL 627 N 0.07 1.12 -0.02 1.67 2.07 -1.30 -2.13 116.25 117.73 1l2a h VAL 627 Ca 0.62 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1l2a h VAL 627 Cb 1.36 1.73 -0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1l2a h VAL 627 CO -0.81 0.23 0.01 0.22 0.02 0.00 0.00 177.57 177.25 1l2a h TYR 628 N -0.61 0.03 0.65 1.57 3.20 0.13 -1.36 116.97 120.58 1l2a h TYR 628 Ca -0.01 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 1l2a h TYR 628 Cb 0.49 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 1l2a h TYR 628 CO 0.07 0.03 -0.39 1.96 -1.64 0.00 0.00 178.16 178.20 1l2a h GLN 629 N 0.01 -0.94 -0.97 1.82 7.50 0.08 -0.29 115.11 122.33 1l2a h GLN 629 Ca 0.01 0.06 0.25 0.00 0.50 0.00 0.00 58.65 59.47 1l2a h GLN 629 Cb 0.01 0.21 -0.06 0.00 0.05 0.00 0.00 27.48 27.69 1l2a h GLN 629 CO -0.00 -0.63 0.66 0.00 -1.50 0.00 0.00 178.83 177.36 1l2a h ALA 630 N -0.70 2.50 -0.35 3.87 0.00 -1.40 -1.25 119.26 121.92 1l2a h ALA 630 Ca -0.08 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1l2a h ALA 630 Cb 0.78 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1l2a h ALA 630 CO 0.09 -0.81 -0.43 -0.92 0.00 0.00 0.00 179.25 177.18 1l2a h TYR 631 N 0.24 1.11 -0.65 0.00 3.20 -0.33 -0.08 116.97 120.47 1l2a h TYR 631 Ca 0.50 -0.35 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1l2a h TYR 631 Cb 1.53 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 39.54 1l2a h TYR 631 CO -0.00 1.18 0.34 -0.07 -1.64 0.00 0.00 178.16 177.97 1l2a h LEU 632 N 0.72 0.80 -1.99 2.82 3.38 0.09 -2.02 115.31 119.11 1l2a h LEU 632 Ca 0.05 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1l2a h LEU 632 Cb 1.03 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1l2a h LEU 632 CO 0.10 0.66 -0.07 0.03 0.09 0.00 0.00 178.44 179.25 1l2a h ARG 633 N 0.90 0.00 0.00 1.13 3.08 -1.37 -3.47 114.38 114.66 1l2a h ARG 633 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1l2a h ARG 633 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1l2a h ARG 633 CO -0.03 0.07 0.00 0.41 -1.07 0.00 0.00 179.97 179.35 1l2a n GLY 634 N -1.20 0.73 0.00 0.04 0.00 -0.76 -5.10 105.19 98.90 1l2a n GLY 634 Ca -0.03 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1l2a n GLY 634 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1l2a n GLU 635 N -2.45 2.18 -4.71 1.61 0.28 -0.06 -5.01 120.64 112.48 1l2a n GLU 635 Ca 0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.16 56.74 1l2a n GLU 635 Cb 0.00 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 32.70 1l2a n GLU 635 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1l2a s ALA 636 N -2.00 1.41 0.40 -1.84 0.00 -1.26 -4.39 121.76 114.07 1l2a s ALA 636 Ca 0.00 -0.53 -0.25 0.00 0.00 0.00 0.00 51.96 51.18 1l2a s ALA 636 Cb 0.00 -0.58 -0.11 0.00 0.00 0.00 0.00 23.12 22.43 1l2a s ALA 636 CO 0.00 0.16 1.06 -2.30 0.00 0.00 0.00 175.76 174.68 1l2a n PRO 637 N 3.66 1.47 -2.10 0.00 -0.02 -1.26 -4.75 135.00 132.00 1l2a n PRO 637 Ca -0.22 0.52 -0.39 0.00 -2.02 0.00 0.00 63.50 61.40 1l2a n PRO 637 Cb 0.52 -2.07 -0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1l2a n PRO 637 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1l2a n VAL 638 N -0.30 5.14 -2.56 -1.45 0.31 -1.26 -3.91 118.33 114.30 1l2a n VAL 638 Ca 0.09 -4.59 -0.24 0.00 -0.01 0.00 0.00 64.34 59.59 1l2a n VAL 638 Cb 0.38 -1.82 0.04 0.00 -0.91 0.00 0.00 33.84 31.52 1l2a n VAL 638 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 1l2a s LEU 639 N -2.84 3.23 0.09 7.52 0.05 -1.26 -5.01 118.68 120.46 1l2a s LEU 639 Ca 0.51 0.28 0.02 0.00 0.05 0.00 0.00 54.13 54.99 1l2a s LEU 639 Cb 0.23 -3.10 -0.04 0.00 -2.05 0.00 0.00 46.19 41.23 1l2a s LEU 639 CO -0.14 -1.15 -0.08 0.20 -0.55 0.00 0.00 176.35 174.63 1l2a s ASN 640 N -4.38 1.18 0.13 1.48 0.01 -1.26 -3.22 114.94 108.87 1l2a s ASN 640 Ca 0.56 -0.86 -0.06 0.00 -0.71 0.00 0.00 52.86 51.79 1l2a s ASN 640 Cb -0.10 0.06 -0.02 0.00 0.41 0.00 0.00 41.25 41.59 1l2a s ASN 640 CO 0.41 -0.36 0.17 -0.31 -1.51 0.00 0.00 177.10 175.50 1l2a s TYR 641 N -2.86 0.52 -0.44 2.20 4.12 -1.24 -4.94 117.35 114.72 1l2a s TYR 641 Ca 0.06 -0.91 0.05 0.00 0.02 0.00 0.00 57.07 56.29 1l2a s TYR 641 Cb 0.00 -0.22 0.19 0.00 -1.52 0.00 0.00 41.96 40.41 1l2a s TYR 641 CO -0.02 -0.60 0.48 0.72 0.02 0.00 0.00 175.55 176.15 1l2a n HIS 642 N -0.12 -1.64 -2.13 2.71 8.25 -1.26 -3.10 115.22 117.92 1l2a n HIS 642 Ca -0.09 -2.82 -0.42 0.00 -0.26 0.00 0.00 57.72 54.14 1l2a n HIS 642 Cb 0.63 0.52 -0.03 0.00 1.12 0.00 0.00 29.99 32.23 1l2a n HIS 642 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1l2a s ARG 643 N 0.10 4.32 0.20 -0.41 0.52 -1.26 -2.02 118.95 120.39 1l2a s ARG 643 Ca 0.33 2.14 -0.13 0.00 -0.52 0.00 0.00 55.73 57.55 1l2a s ARG 643 Cb 0.06 -3.19 0.23 0.00 0.52 0.00 0.00 34.95 32.57 1l2a s ARG 643 CO -0.16 -0.38 1.67 0.35 0.02 0.00 0.00 175.30 176.80 1l2a h PHE 644 N 5.93 -0.05 -0.14 -0.53 3.57 -0.69 -2.36 116.94 122.67 1l2a h PHE 644 Ca -0.44 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.02 1l2a h PHE 644 Cb 1.21 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 40.05 1l2a h PHE 644 CO 0.63 -0.14 -0.30 0.11 -2.23 0.00 0.00 178.31 176.38 1l2a h TRP 645 N 0.11 0.30 -0.26 0.41 5.08 -1.90 -1.26 115.95 118.43 1l2a h TRP 645 Ca 0.28 -0.06 0.01 0.00 1.08 0.00 0.00 58.89 60.20 1l2a h TRP 645 Cb 0.43 -0.07 -0.02 0.00 -3.00 0.00 0.00 29.16 26.50 1l2a h TRP 645 CO -0.34 0.55 0.14 0.45 -1.28 0.00 0.00 178.44 177.95 1l2a h HIS 646 N 0.24 0.26 -0.49 0.12 3.86 -1.81 0.33 115.15 117.66 1l2a h HIS 646 Ca 0.03 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1l2a h HIS 646 Cb 0.65 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 29.01 1l2a h HIS 646 CO 0.01 0.15 0.31 0.93 0.86 0.00 0.00 177.93 180.19 1l2a h GLU 647 N 0.29 0.60 0.01 2.45 4.39 -0.97 -2.61 114.58 118.74 1l2a h GLU 647 Ca 0.10 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 1l2a h GLU 647 Cb 0.01 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1l2a h GLU 647 CO -0.06 0.39 -0.00 0.28 -1.16 0.00 0.00 179.01 178.46 1l2a h VAL 648 N 0.61 1.28 -0.96 3.13 2.07 -0.98 -1.31 116.25 120.10 1l2a h VAL 648 Ca 0.19 -0.84 0.13 0.00 0.82 0.00 0.00 66.70 66.99 1l2a h VAL 648 Cb -0.01 1.85 -0.08 0.00 -1.52 0.00 0.00 31.29 31.52 1l2a h VAL 648 CO -0.07 0.22 0.61 0.44 0.02 0.00 0.00 177.57 178.79 1l2a h ASP 649 N -0.37 0.84 0.12 0.57 3.32 -0.88 0.93 116.42 120.96 1l2a h ASP 649 Ca -0.00 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1l2a h ASP 649 Cb 0.36 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1l2a h ASP 649 CO 0.00 0.44 -0.06 0.25 -1.72 0.00 0.00 179.24 178.15 1l2a h LEU 650 N 0.90 -0.14 -0.33 1.55 5.85 -1.46 -1.92 115.31 119.75 1l2a h LEU 650 Ca 0.48 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 59.02 1l2a h LEU 650 Cb 0.55 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 1l2a h LEU 650 CO -0.24 0.16 -0.01 0.00 -0.34 0.00 0.00 178.44 178.01 1l2a h ALA 651 N 0.37 0.29 -0.29 1.25 0.00 0.18 -1.10 119.26 119.96 1l2a h ALA 651 Ca -0.02 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1l2a h ALA 651 Cb 0.37 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1l2a h ALA 651 CO 0.03 -0.41 0.13 0.28 0.00 0.00 0.00 179.25 179.28 1l2a h VAL 652 N 0.08 1.11 -0.45 0.00 2.07 0.83 0.21 116.25 120.11 1l2a h VAL 652 Ca 0.16 -0.33 -0.11 0.00 0.82 0.00 0.00 66.70 67.24 1l2a h VAL 652 Cb 0.22 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1l2a h VAL 652 CO -0.28 0.13 -0.17 0.00 0.02 0.00 0.00 177.57 177.28 1l2a h ALA 653 N 1.74 0.63 -0.43 1.67 0.00 -0.48 0.34 119.26 122.72 1l2a h ALA 653 Ca 0.10 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.71 1l2a h ALA 653 Cb 0.07 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1l2a h ALA 653 CO -0.01 0.57 0.14 0.52 0.00 0.00 0.00 179.25 180.46 1l2a h MET 654 N 0.74 0.29 -0.34 0.00 2.86 -0.08 -1.67 114.93 116.73 1l2a h MET 654 Ca 0.11 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.79 1l2a h MET 654 Cb 0.73 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.27 1l2a h MET 654 CO 0.06 0.19 0.02 0.78 1.06 0.00 0.00 176.91 179.02 1l2a h GLY 655 N 0.30 0.35 0.87 8.32 0.00 0.09 -0.46 103.07 112.54 1l2a h GLY 655 Ca 0.20 0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.57 1l2a h GLY 655 CO -0.21 -0.06 0.28 -2.08 0.00 0.00 0.00 176.54 174.47 1l2a h VAL 656 N 0.13 1.04 -0.62 4.60 2.07 -0.11 0.16 116.25 123.52 1l2a h VAL 656 Ca 0.16 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1l2a h VAL 656 Cb 0.21 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.36 1l2a h VAL 656 CO -0.25 0.10 0.32 -0.07 0.02 0.00 0.00 177.57 177.69 1l2a h LEU 657 N 0.56 0.45 -1.11 2.57 4.07 -1.09 -0.46 115.31 120.29 1l2a h LEU 657 Ca 0.19 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.18 1l2a h LEU 657 Cb 0.03 -0.05 -0.04 0.00 1.08 0.00 0.00 40.66 41.68 1l2a h LEU 657 CO -0.09 0.29 0.45 0.00 -1.08 0.00 0.00 178.44 178.01 1l2a h ALA 658 N 1.34 1.33 0.00 1.53 0.00 0.08 0.20 119.26 123.73 1l2a h ALA 658 Ca 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1l2a h ALA 658 Cb 0.21 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1l2a h ALA 658 CO -0.20 0.57 -0.08 1.15 0.00 0.00 0.00 179.25 180.69 1l2a h THR 659 N 1.08 1.61 0.00 0.00 2.02 -0.38 -3.29 112.91 113.94 1l2a h THR 659 Ca 0.28 -1.90 -0.11 0.00 0.77 0.00 0.00 66.41 65.44 1l2a h THR 659 Cb -0.01 2.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.25 1l2a h THR 659 CO -0.05 0.50 -1.94 -1.22 0.37 0.00 0.00 175.52 173.18 1l2a n TYR 660 N -4.64 0.20 -3.42 3.16 4.02 -0.21 -4.63 117.16 111.64 1l2a n TYR 660 Ca -0.10 0.06 -0.26 0.00 -0.01 0.00 0.00 57.90 57.59 1l2a n TYR 660 Cb 0.43 -0.73 -0.08 0.00 -0.02 0.00 0.00 39.34 38.93 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 -2.49 2.11 0.25 -0.72 3.72 0.69 -4.97 117.46 116.04 1l2a n PHE 661 Ca -0.11 -3.95 0.14 0.00 -0.05 0.00 0.00 57.45 53.48 1l2a n PHE 661 Cb 0.75 -0.45 0.47 0.00 -0.94 0.00 0.00 39.48 39.31 1l2a n PHE 661 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1l2a h PRO 662 N 4.40 0.00 0.00 -1.08 0.13 -1.62 -2.52 132.00 131.31 1l2a h PRO 662 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1l2a h PRO 662 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1l2a h PRO 662 CO 0.68 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.24 1l2a n ASP 663 N -3.13 0.47 -4.84 1.44 8.00 -1.26 -4.88 116.55 112.35 1l2a n ASP 663 Ca 0.02 0.55 -0.31 0.00 0.71 0.00 0.00 54.79 55.75 1l2a n ASP 663 Cb 0.41 -0.67 0.02 0.00 -0.02 0.00 0.00 41.12 40.86 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 -3.06 3.32 -0.19 -1.24 -1.94 -0.95 -5.05 119.30 110.19 1l2a s MET 664 Ca 0.12 0.89 -0.09 0.00 -1.71 0.00 0.00 55.69 54.91 1l2a s MET 664 Cb 0.15 -2.04 0.07 0.00 2.01 0.00 0.00 34.83 35.02 1l2a s MET 664 CO 0.56 -0.80 0.43 0.99 -0.01 0.00 0.00 175.02 176.20 1l2a s THR 665 N -3.02 -0.27 0.44 2.05 2.01 -1.26 -3.87 115.64 111.71 1l2a s THR 665 Ca 0.57 0.12 -0.23 0.00 0.31 0.00 0.00 61.69 62.46 1l2a s THR 665 Cb -0.13 -0.66 -0.11 0.00 0.01 0.00 0.00 72.50 71.62 1l2a s THR 665 CO 0.51 0.05 0.76 0.00 -0.69 0.00 0.00 174.62 175.25 1l2a n TYR 666 N 4.71 0.27 -3.76 4.92 9.36 -0.68 -4.80 117.16 127.17 1l2a n TYR 666 Ca -0.17 0.57 -0.13 0.00 3.32 0.00 0.00 57.90 61.49 1l2a n TYR 666 Cb 0.53 -2.10 -0.13 0.00 -0.63 0.00 0.00 39.34 37.02 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 -1.85 0.22 -0.05 2.98 0.00 -1.26 -1.86 119.74 117.93 1l2a s LYS 667 Ca 0.64 0.41 -0.30 0.00 0.00 0.00 0.00 55.97 56.72 1l2a s LYS 667 Cb -0.57 -0.00 -0.06 0.00 0.00 0.00 0.00 37.83 37.20 1l2a s LYS 667 CO 0.57 -0.10 1.77 0.54 0.00 0.00 0.00 175.35 178.13 1l2a s VAL 668 N 0.68 3.40 -2.00 1.79 0.11 -1.26 -4.92 120.40 118.20 1l2a s VAL 668 Ca -0.05 0.48 0.26 0.00 -2.93 0.00 0.00 61.98 59.75 1l2a s VAL 668 Cb -0.06 -3.33 0.75 0.00 -1.53 0.00 0.00 36.38 32.21 1l2a s VAL 668 CO -0.04 -0.06 1.93 -0.81 -3.33 0.00 0.00 175.10 172.79