#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4aah h ALA 2 N 0.00 1.15 -0.12 2.12 0.00 -1.98 1.24 119.26 121.68 4aah h ALA 2 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 4aah h ALA 2 Cb 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 4aah h ALA 2 CO 0.00 0.59 0.06 0.22 0.00 0.00 0.00 179.25 180.12 4aah h ASP 3 N 0.97 0.15 -0.25 0.00 3.58 -1.98 0.11 116.42 119.01 4aah h ASP 3 Ca 0.22 -0.12 -0.09 0.00 0.42 0.00 0.00 57.03 57.46 4aah h ASP 3 Cb 0.24 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 4aah h ASP 3 CO -0.01 0.23 -0.12 0.25 -2.88 0.00 0.00 179.24 176.70 4aah h LEU 4 N 0.07 0.64 -1.08 2.28 5.85 -1.64 -1.89 115.31 119.54 4aah h LEU 4 Ca 0.04 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.58 4aah h LEU 4 Cb 0.12 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 4aah h LEU 4 CO -0.01 0.80 0.60 0.44 -0.34 0.00 0.00 178.44 179.93 4aah h ASP 5 N 0.60 1.06 0.33 1.25 3.32 0.19 0.19 116.42 123.37 4aah h ASP 5 Ca 0.10 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 4aah h ASP 5 Cb 0.56 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.85 4aah h ASP 5 CO 0.04 0.78 -0.16 0.50 -1.72 0.00 0.00 179.24 178.67 4aah h LYS 6 N 1.25 -0.43 -0.59 3.56 3.64 -0.02 -1.15 116.57 122.83 4aah h LYS 6 Ca 0.34 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.79 4aah h LYS 6 Cb -0.13 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 4aah h LYS 6 CO -0.07 -0.28 0.34 1.96 -2.27 0.00 0.00 179.45 179.13 4aah h GLN 7 N -0.46 0.63 -0.11 1.90 1.08 -0.70 -1.20 115.11 116.25 4aah h GLN 7 Ca -0.05 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.09 4aah h GLN 7 Cb 0.35 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 4aah h GLN 7 CO 0.07 0.42 -0.04 0.28 -0.95 0.00 0.00 178.83 178.61 4aah h VAL 8 N 0.65 1.10 -0.01 -0.54 2.07 -0.49 -1.89 116.25 117.14 4aah h VAL 8 Ca 0.25 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.36 4aah h VAL 8 Cb 0.10 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 4aah h VAL 8 CO -0.14 0.13 -0.13 0.59 0.02 0.00 0.00 177.57 178.04 4aah n ASN 9 N -4.40 0.82 -4.76 0.57 3.02 -0.45 -4.87 115.26 105.19 4aah n ASN 9 Ca -0.01 -0.88 -0.38 0.00 -0.03 0.00 0.00 54.58 53.28 4aah n ASN 9 Cb 0.18 0.01 -0.06 0.00 -0.61 0.00 0.00 39.78 39.30 4aah n ASN 9 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 4aah s THR 10 N -2.36 5.15 0.15 3.41 2.01 -0.71 -5.05 115.64 118.24 4aah s THR 10 Ca 0.30 0.84 -0.31 0.00 0.31 0.00 0.00 61.69 62.84 4aah s THR 10 Cb 0.20 -3.75 -0.08 0.00 0.01 0.00 0.00 72.50 68.88 4aah s THR 10 CO 0.46 0.42 1.32 0.00 -0.69 0.00 0.00 174.62 176.13 4aah s ALA 11 N 0.03 3.53 0.00 7.40 0.00 -1.26 -3.33 121.76 128.13 4aah s ALA 11 Ca 0.23 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.27 4aah s ALA 11 Cb -0.15 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.47 4aah s ALA 11 CO 0.10 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.73 4aah n GLY 12 N 2.92 1.64 3.91 0.00 0.00 -1.26 -4.82 105.19 107.59 4aah n GLY 12 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 4aah n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah s ALA 13 N -3.09 3.06 -0.47 4.61 0.00 -1.21 -1.11 121.76 123.54 4aah s ALA 13 Ca 0.00 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.30 4aah s ALA 13 Cb 0.00 -2.73 0.22 0.00 0.00 0.00 0.00 23.12 20.61 4aah s ALA 13 CO 0.00 -1.22 0.72 1.87 0.00 0.00 0.00 175.76 177.13 4aah n TRP 14 N -2.92 -2.68 1.42 0.00 -0.00 0.16 -4.88 117.44 108.54 4aah n TRP 14 Ca 0.07 -2.15 0.14 0.00 -0.00 0.00 0.00 57.50 55.56 4aah n TRP 14 Cb 0.59 1.05 0.50 0.00 -0.00 0.00 0.00 31.31 33.46 4aah n TRP 14 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 4aah n PRO 15 N 2.10 1.21 -4.32 5.87 -0.04 -1.23 -1.05 135.00 137.54 4aah n PRO 15 Ca 0.16 -0.66 -0.24 0.00 -0.04 0.00 0.00 63.50 62.72 4aah n PRO 15 Cb 0.58 -1.49 -0.17 0.00 -0.04 0.00 0.00 33.50 32.38 4aah n PRO 15 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 4aah s ILE 16 N -2.24 0.97 0.22 0.52 1.01 -1.26 -4.09 121.20 116.33 4aah s ILE 16 Ca 0.32 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.48 4aah s ILE 16 Cb 0.20 -0.93 0.26 0.00 0.01 0.00 0.00 42.46 42.00 4aah s ILE 16 CO 0.42 0.33 1.58 0.00 0.00 0.00 0.00 174.94 177.27 4aah h ALA 17 N 7.33 0.29 -0.04 9.38 0.00 -1.89 0.31 119.26 134.65 4aah h ALA 17 Ca -0.32 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.86 4aah h ALA 17 Cb 1.17 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.70 4aah h ALA 17 CO 0.45 -0.53 0.00 0.25 0.00 0.00 0.00 179.25 179.43 4aah n THR 18 N -5.49 0.05 0.00 0.00 -2.24 -1.26 -4.91 114.28 100.43 4aah n THR 18 Ca 0.09 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 4aah n THR 18 Cb 0.39 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 4aah n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4aah n GLY 19 N 0.96 3.17 0.00 3.38 0.00 0.11 -1.42 105.19 111.40 4aah n GLY 19 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 4aah n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4aah n GLY 20 N -1.49 0.65 0.32 -0.02 0.00 -1.26 -4.81 105.19 98.59 4aah n GLY 20 Ca 0.00 -1.21 0.11 0.00 0.00 0.00 0.00 46.02 44.91 4aah n GLY 20 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 4aah h TYR 21 N 0.00 0.81 0.00 1.61 0.05 -1.93 -1.24 116.97 116.28 4aah h TYR 21 Ca 0.00 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.82 4aah h TYR 21 Cb 0.00 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 37.52 4aah h TYR 21 CO 0.00 0.12 0.00 1.88 -1.05 0.00 0.00 178.16 179.11 4aah h TYR 22 N 0.58 0.00 -5.79 4.88 -1.99 -1.90 0.63 116.97 113.38 4aah h TYR 22 Ca 0.53 0.00 -0.37 0.00 2.00 0.00 0.00 58.73 60.89 4aah h TYR 22 Cb 0.87 0.00 0.14 0.00 2.00 0.00 0.00 36.73 39.74 4aah h TYR 22 CO -0.08 0.00 -0.75 0.43 -0.00 0.00 0.00 178.16 177.76 4aah n SER 23 N -2.46 -3.29 0.01 3.88 7.64 -0.47 -1.91 113.62 117.03 4aah n SER 23 Ca 0.05 -0.63 0.12 0.00 1.01 0.00 0.00 58.87 59.42 4aah n SER 23 Cb 0.43 -4.92 0.30 0.00 -1.01 0.00 0.00 64.21 59.02 4aah n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4aah n GLN 24 N -4.42 0.04 -3.99 1.43 6.02 -1.25 -4.58 117.38 110.63 4aah n GLN 24 Ca -0.19 0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.39 4aah n GLN 24 Cb 0.63 -1.53 0.02 0.00 1.02 0.00 0.00 30.24 30.39 4aah n GLN 24 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 4aah n HIS 25 N -1.59 -1.51 -4.30 1.08 -0.00 -0.50 -0.86 115.22 107.54 4aah n HIS 25 Ca 0.05 0.19 -0.18 0.00 -0.00 0.00 0.00 57.72 57.79 4aah n HIS 25 Cb 0.35 -2.96 -0.09 0.00 -0.00 0.00 0.00 29.99 27.29 4aah n HIS 25 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 4aah s ASN 26 N -3.57 1.39 -0.13 0.26 6.03 -1.26 -3.15 114.94 114.50 4aah s ASN 26 Ca 0.46 -1.61 -0.11 0.00 -1.03 0.00 0.00 52.86 50.57 4aah s ASN 26 Cb -0.23 0.46 0.04 0.00 -3.03 0.00 0.00 41.25 38.48 4aah s ASN 26 CO 0.95 -0.95 0.35 -0.55 -2.03 0.00 0.00 177.10 174.87 4aah s SER 27 N -3.35 -0.37 0.00 3.54 0.15 0.96 -4.95 113.70 109.68 4aah s SER 27 Ca 0.37 0.71 0.21 0.00 0.70 0.00 0.00 55.95 57.94 4aah s SER 27 Cb 0.04 0.69 1.03 0.00 -1.71 0.00 0.00 66.02 66.07 4aah s SER 27 CO 0.20 -0.13 1.67 -0.81 1.20 0.00 0.00 173.24 175.37 4aah n PRO 28 N 3.19 0.24 -1.97 5.44 -0.04 -1.26 -0.51 135.00 140.09 4aah n PRO 28 Ca -0.15 0.10 -0.42 0.00 -0.04 0.00 0.00 63.50 62.98 4aah n PRO 28 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 4aah n PRO 28 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 4aah s LEU 29 N -2.65 4.35 -0.04 1.53 1.43 -1.26 -4.59 118.68 117.45 4aah s LEU 29 Ca 0.18 2.35 0.05 0.00 -1.03 0.00 0.00 54.13 55.69 4aah s LEU 29 Cb 0.14 -3.55 0.08 0.00 0.03 0.00 0.00 46.19 42.89 4aah s LEU 29 CO 0.33 -0.90 1.00 0.00 0.23 0.00 0.00 176.35 177.02 4aah n ALA 30 N 6.36 2.00 -0.30 4.21 0.00 -1.26 -3.53 120.51 127.99 4aah n ALA 30 Ca 0.16 -1.41 -0.05 0.00 0.00 0.00 0.00 53.44 52.15 4aah n ALA 30 Cb 0.42 -0.12 0.07 0.00 0.00 0.00 0.00 19.45 19.82 4aah n ALA 30 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 4aah h GLN 31 N 0.00 1.13 -5.84 0.00 4.15 -1.98 -3.38 115.11 109.18 4aah h GLN 31 Ca 0.00 -0.14 -0.57 0.00 0.77 0.00 0.00 58.65 58.71 4aah h GLN 31 Cb 0.70 -0.22 -0.07 0.00 0.21 0.00 0.00 27.48 28.10 4aah h GLN 31 CO 0.00 0.84 -0.09 0.42 -1.93 0.00 0.00 178.83 178.07 4aah s ILE 32 N -5.83 5.12 0.33 2.39 1.01 -1.26 -4.97 121.20 117.99 4aah s ILE 32 Ca -0.13 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.60 4aah s ILE 32 Cb 0.16 -3.87 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 4aah s ILE 32 CO 0.81 0.34 0.40 0.54 0.00 0.00 0.00 174.94 177.03 4aah s ASN 33 N 0.47 1.13 0.66 3.58 2.20 -1.26 -4.15 114.94 117.57 4aah s ASN 33 Ca 0.29 -1.57 0.34 0.00 -0.94 0.00 0.00 52.86 50.97 4aah s ASN 33 Cb -0.16 0.62 1.83 0.00 -2.00 0.00 0.00 41.25 41.55 4aah s ASN 33 CO 0.13 -1.21 2.05 0.11 -2.94 0.00 0.00 177.10 175.24 4aah h LYS 34 N 2.13 0.00 0.00 3.55 1.57 -1.82 0.15 116.57 122.15 4aah h LYS 34 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 4aah h LYS 34 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 4aah h LYS 34 CO 0.38 0.00 -1.49 -1.13 -0.57 0.00 0.00 179.45 176.65 4aah n SER 35 N -3.06 0.40 -0.09 0.86 3.41 -1.26 -4.42 113.62 109.47 4aah n SER 35 Ca -0.01 -0.01 -0.23 0.00 -0.26 0.00 0.00 58.87 58.36 4aah n SER 35 Cb 0.31 1.29 -0.12 0.00 -0.26 0.00 0.00 64.21 65.43 4aah n SER 35 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 4aah n ASN 36 N -2.28 1.97 -0.27 4.04 3.02 -0.79 -4.74 115.26 116.21 4aah n ASN 36 Ca -0.01 0.28 0.16 0.00 -0.03 0.00 0.00 54.58 54.97 4aah n ASN 36 Cb 0.53 -0.84 0.30 0.00 -0.61 0.00 0.00 39.78 39.15 4aah n ASN 36 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 4aah n VAL 37 N -4.00 -0.33 0.25 2.41 3.14 0.45 0.19 118.33 120.44 4aah n VAL 37 Ca -0.39 1.70 0.17 0.00 -2.96 0.00 0.00 64.34 62.87 4aah n VAL 37 Cb 0.86 -2.56 0.83 0.00 -1.06 0.00 0.00 33.84 31.91 4aah n VAL 37 CO 0.00 0.00 0.00 0.11 -6.46 0.00 0.00 176.83 170.48 4aah h LYS 38 N 0.00 0.00 -0.28 1.45 1.57 -1.85 -0.37 116.57 117.09 4aah h LYS 38 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 4aah h LYS 38 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 4aah h LYS 38 CO -0.70 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.27 4aah n ASN 39 N -3.25 2.97 -4.76 0.86 3.02 0.13 -4.96 115.26 109.27 4aah n ASN 39 Ca 0.01 -1.92 -0.39 0.00 -0.03 0.00 0.00 54.58 52.24 4aah n ASN 39 Cb 0.42 -0.18 0.01 0.00 -0.61 0.00 0.00 39.78 39.42 4aah n ASN 39 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 4aah s VAL 40 N -1.65 2.33 0.07 2.41 1.01 -0.15 -4.68 120.40 119.74 4aah s VAL 40 Ca 0.36 0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.57 4aah s VAL 40 Cb 0.21 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 4aah s VAL 40 CO 0.30 0.03 0.10 -1.59 0.00 0.00 0.00 175.10 173.94 4aah s LYS 41 N -2.48 0.74 0.35 2.72 -2.85 0.34 -4.93 119.74 113.63 4aah s LYS 41 Ca 0.62 -1.04 -0.28 0.00 -1.00 0.00 0.00 55.97 54.26 4aah s LYS 41 Cb -0.40 0.28 -0.12 0.00 -2.06 0.00 0.00 37.83 35.54 4aah s LYS 41 CO 0.51 -0.20 1.43 0.00 0.10 0.00 0.00 175.35 177.19 4aah n ALA 42 N 0.06 1.96 -0.07 0.59 0.00 -1.26 -1.79 120.51 120.00 4aah n ALA 42 Ca -0.15 0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.56 4aah n ALA 42 Cb 0.62 -2.36 -0.08 0.00 0.00 0.00 0.00 19.45 17.62 4aah n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4aah n ALA 43 N 0.67 1.69 0.00 0.00 0.00 0.24 -4.85 120.51 118.26 4aah n ALA 43 Ca 0.04 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.75 4aah n ALA 43 Cb 0.37 0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.89 4aah n ALA 43 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 4aah n TRP 44 N -2.69 0.00 -4.05 0.00 4.27 -1.19 -5.03 117.44 108.74 4aah n TRP 44 Ca -0.23 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.28 4aah n TRP 44 Cb 0.84 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.71 4aah n TRP 44 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 4aah s SER 45 N 0.00 0.08 -0.15 -0.67 1.04 -1.26 -1.79 113.70 110.95 4aah s SER 45 Ca 0.00 -1.06 -0.08 0.00 0.48 0.00 0.00 55.95 55.29 4aah s SER 45 Cb 0.00 0.43 0.06 0.00 0.10 0.00 0.00 66.02 66.61 4aah s SER 45 CO 0.00 -0.91 0.37 0.12 0.98 0.00 0.00 173.24 173.80 4aah s PHE 46 N -4.04 -0.54 -0.12 5.02 5.36 0.13 -5.00 117.98 118.80 4aah s PHE 46 Ca 0.25 1.17 -0.07 0.00 -0.96 0.00 0.00 56.93 57.32 4aah s PHE 46 Cb 0.04 0.21 -0.04 0.00 -0.34 0.00 0.00 43.02 42.89 4aah s PHE 46 CO 0.05 -0.32 0.13 0.45 -1.46 0.00 0.00 175.22 174.07 4aah s SER 47 N 1.40 6.27 0.30 6.13 0.15 -1.26 -0.12 113.70 126.56 4aah s SER 47 Ca -0.09 0.43 0.23 0.00 0.70 0.00 0.00 55.95 57.22 4aah s SER 47 Cb -0.09 -2.01 0.17 0.00 -1.71 0.00 0.00 66.02 62.38 4aah s SER 47 CO -0.12 0.40 1.31 0.71 1.20 0.00 0.00 173.24 176.74 4aah h THR 48 N 4.01 0.00 -0.23 6.45 1.35 -1.43 -3.48 112.91 119.58 4aah h THR 48 Ca -0.54 -0.97 -0.07 0.00 -0.55 0.00 0.00 66.41 64.28 4aah h THR 48 Cb 1.23 1.69 -0.02 0.00 -1.73 0.00 0.00 68.15 69.31 4aah h THR 48 CO 0.58 0.00 -0.07 0.61 -0.25 0.00 0.00 175.52 176.39 4aah n GLY 49 N 1.16 0.57 3.15 5.82 0.00 -1.25 -5.04 105.19 109.59 4aah n GLY 49 Ca 0.02 -0.88 -0.19 0.00 0.00 0.00 0.00 46.02 44.96 4aah n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4aah s VAL 50 N -2.14 1.08 0.00 1.61 1.01 -1.26 -5.13 120.40 115.57 4aah s VAL 50 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 60.86 4aah s VAL 50 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.37 4aah s VAL 50 CO 0.00 -0.10 0.00 0.18 0.00 0.00 0.00 175.10 175.18 4aah n LEU 51 N 1.64 0.00 -0.78 3.92 7.99 -1.26 -4.03 117.00 124.48 4aah n LEU 51 Ca -0.19 0.00 0.10 0.00 -0.01 0.00 0.00 56.01 55.91 4aah n LEU 51 Cb 0.54 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.83 4aah n LEU 51 CO 0.22 0.00 -0.17 0.59 -1.51 0.00 0.00 177.39 176.52 4aah n ASN 52 N 0.00 -4.64 -4.69 -1.43 3.02 -1.25 -4.67 115.26 101.60 4aah n ASN 52 Ca 0.00 0.38 -0.42 0.00 -0.03 0.00 0.00 54.58 54.51 4aah n ASN 52 Cb 0.00 -2.40 -0.03 0.00 -0.61 0.00 0.00 39.78 36.74 4aah n ASN 52 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 4aah s GLY 53 N -5.19 1.35 -0.59 7.41 0.00 -1.23 -4.44 107.32 104.64 4aah s GLY 53 Ca 0.00 1.44 -0.05 0.00 0.00 0.00 0.00 44.72 46.11 4aah s GLY 53 CO 0.00 3.11 0.42 0.30 0.00 0.00 0.00 173.10 176.93 4aah s HIS 54 N 2.64 3.48 0.45 1.90 3.76 0.21 -4.27 115.29 123.47 4aah s HIS 54 Ca 0.80 -2.46 0.04 0.00 -0.15 0.00 0.00 55.06 53.29 4aah s HIS 54 Cb -0.46 -3.32 0.01 0.00 1.11 0.00 0.00 32.58 29.93 4aah s HIS 54 CO 0.36 -0.90 0.63 -1.21 -0.85 0.00 0.00 174.74 172.76 4aah s GLU 55 N 0.37 2.84 1.36 1.40 2.02 -1.25 -3.90 118.70 121.54 4aah s GLU 55 Ca 0.14 -0.93 0.00 0.00 0.02 0.00 0.00 54.97 54.20 4aah s GLU 55 Cb -0.20 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.37 4aah s GLU 55 CO -0.04 -0.34 0.00 0.41 0.02 0.00 0.00 175.26 175.31 4aah n GLY 56 N -2.00 -1.77 3.38 -1.39 0.00 -1.26 -4.55 105.19 97.60 4aah n GLY 56 Ca 0.05 -1.45 -0.12 0.00 0.00 0.00 0.00 46.02 44.51 4aah n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah s ALA 57 N -1.13 -1.34 0.81 4.61 0.00 -1.26 -3.90 121.76 119.54 4aah s ALA 57 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.14 4aah s ALA 57 Cb 0.00 0.80 0.08 0.00 0.00 0.00 0.00 23.12 23.99 4aah s ALA 57 CO 0.00 -0.71 1.11 -1.25 0.00 0.00 0.00 175.76 174.90 4aah s PRO 58 N -3.71 2.00 -0.09 0.00 0.04 -1.26 -4.70 135.00 127.27 4aah s PRO 58 Ca 0.01 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 61.58 4aah s PRO 58 Cb 0.00 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 4aah s PRO 58 CO -0.12 -1.66 0.05 -0.51 0.04 0.00 0.00 177.00 174.80 4aah s LEU 59 N -5.78 3.86 -0.18 -3.56 1.43 -0.52 -4.95 118.68 108.99 4aah s LEU 59 Ca 0.61 0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.96 4aah s LEU 59 Cb -0.14 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.15 4aah s LEU 59 CO 0.54 0.38 -0.19 -0.69 0.23 0.00 0.00 176.35 176.62 4aah s VAL 60 N -0.97 1.97 -0.31 -1.59 1.01 -0.22 -1.56 120.40 118.74 4aah s VAL 60 Ca 0.15 -0.91 -0.00 0.00 0.00 0.00 0.00 61.98 61.21 4aah s VAL 60 Cb -0.12 -1.81 0.10 0.00 0.00 0.00 0.00 36.38 34.56 4aah s VAL 60 CO 0.04 0.50 0.09 -0.63 0.00 0.00 0.00 175.10 175.10 4aah s ILE 61 N 1.32 0.97 0.00 2.22 1.09 -0.51 0.39 121.20 126.68 4aah s ILE 61 Ca 0.04 -1.45 0.00 0.00 -1.10 0.00 0.00 60.65 58.15 4aah s ILE 61 Cb -0.13 -1.73 0.00 0.00 -1.06 0.00 0.00 42.46 39.54 4aah s ILE 61 CO -0.12 -0.66 0.00 0.61 -0.10 0.00 0.00 174.94 174.67 4aah n GLY 62 N 4.81 1.97 1.30 6.18 0.00 -1.26 -2.66 105.19 115.52 4aah n GLY 62 Ca -0.02 -0.47 0.08 0.00 0.00 0.00 0.00 46.02 45.61 4aah n GLY 62 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4aah n ASP 63 N 8.47 4.48 -4.59 1.61 5.75 -1.26 -4.94 116.55 126.07 4aah n ASP 63 Ca 0.00 -2.74 -0.33 0.00 -0.01 0.00 0.00 54.79 51.71 4aah n ASP 63 Cb 0.00 -0.55 -0.11 0.00 -1.03 0.00 0.00 41.12 39.43 4aah n ASP 63 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 4aah s MET 64 N -2.36 2.66 -0.07 0.11 -1.94 -1.09 0.11 119.30 116.72 4aah s MET 64 Ca 0.45 -0.62 0.04 0.00 -1.71 0.00 0.00 55.69 53.85 4aah s MET 64 Cb 0.33 -2.55 -0.02 0.00 2.01 0.00 0.00 34.83 34.60 4aah s MET 64 CO 0.15 0.64 -0.19 1.41 -0.01 0.00 0.00 175.02 177.02 4aah s MET 65 N -1.09 2.67 -0.19 2.03 1.75 -0.07 -1.43 119.30 122.98 4aah s MET 65 Ca 0.15 -0.79 0.01 0.00 -1.25 0.00 0.00 55.69 53.81 4aah s MET 65 Cb -0.11 -2.33 0.03 0.00 2.84 0.00 0.00 34.83 35.26 4aah s MET 65 CO 0.04 0.45 -0.15 0.71 -0.65 0.00 0.00 175.02 175.43 4aah s TYR 66 N -0.30 2.62 0.06 4.11 1.51 -0.60 -0.39 117.35 124.36 4aah s TYR 66 Ca 0.01 -1.64 0.06 0.00 -1.01 0.00 0.00 57.07 54.49 4aah s TYR 66 Cb -0.13 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 4aah s TYR 66 CO 0.03 -0.77 -0.08 0.08 -1.11 0.00 0.00 175.55 173.69 4aah s VAL 67 N 1.33 3.50 0.08 0.71 1.01 -0.48 -1.44 120.40 125.11 4aah s VAL 67 Ca 0.01 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 60.95 4aah s VAL 67 Cb -0.15 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 4aah s VAL 67 CO -0.10 0.22 -0.08 -1.38 0.00 0.00 0.00 175.10 173.76 4aah s HIS 68 N -1.13 0.85 0.52 5.22 -3.43 -1.26 -1.66 115.29 114.39 4aah s HIS 68 Ca 0.20 -0.70 0.01 0.00 -0.80 0.00 0.00 55.06 53.78 4aah s HIS 68 Cb -0.11 -0.49 -0.01 0.00 -1.43 0.00 0.00 32.58 30.54 4aah s HIS 68 CO 0.12 -0.09 0.03 -1.54 -2.00 0.00 0.00 174.74 171.26 4aah s SER 69 N -2.35 4.18 1.17 7.38 1.04 -1.13 -4.95 113.70 119.03 4aah s SER 69 Ca 0.02 -1.63 -0.13 0.00 0.48 0.00 0.00 55.95 54.69 4aah s SER 69 Cb -0.02 0.53 0.19 0.00 0.10 0.00 0.00 66.02 66.82 4aah s SER 69 CO -0.02 -0.88 0.65 0.00 0.98 0.00 0.00 173.24 173.97 4aah n ALA 70 N -1.31 -2.21 -1.60 5.32 0.00 -1.26 -4.19 120.51 115.26 4aah n ALA 70 Ca -0.18 -0.98 -0.44 0.00 0.00 0.00 0.00 53.44 51.84 4aah n ALA 70 Cb 0.67 -0.07 -0.01 0.00 0.00 0.00 0.00 19.45 20.04 4aah n ALA 70 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 4aah n PHE 71 N -4.03 1.32 0.97 0.00 7.35 0.51 0.60 117.46 124.18 4aah n PHE 71 Ca 0.09 0.67 -0.00 0.00 -0.76 0.00 0.00 57.45 57.45 4aah n PHE 71 Cb 0.36 -2.26 0.01 0.00 0.35 0.00 0.00 39.48 37.94 4aah n PHE 71 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 4aah n PRO 72 N 0.63 1.05 -3.24 -7.13 -0.04 -1.26 -4.87 135.00 120.14 4aah n PRO 72 Ca 0.09 -0.05 -0.13 0.00 -0.04 0.00 0.00 63.50 63.37 4aah n PRO 72 Cb 0.33 -1.35 0.05 0.00 -0.04 0.00 0.00 33.50 32.50 4aah n PRO 72 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 4aah n ASN 73 N 0.17 -6.81 -4.88 3.54 4.13 0.20 -4.36 115.26 107.25 4aah n ASN 73 Ca 0.01 -0.60 -0.30 0.00 1.68 0.00 0.00 54.58 55.37 4aah n ASN 73 Cb 0.35 -5.11 -0.02 0.00 -1.54 0.00 0.00 39.78 33.46 4aah n ASN 73 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 4aah s ASN 74 N -3.31 6.46 -0.09 6.41 0.01 -1.26 -4.57 114.94 118.60 4aah s ASN 74 Ca 0.36 1.13 0.03 0.00 -0.71 0.00 0.00 52.86 53.67 4aah s ASN 74 Cb -0.05 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.29 4aah s ASN 74 CO 0.75 -0.46 -0.19 -0.89 -1.51 0.00 0.00 177.10 174.79 4aah s THR 75 N -2.49 1.70 -0.14 1.60 2.01 0.54 -2.83 115.64 116.02 4aah s THR 75 Ca 0.51 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.72 4aah s THR 75 Cb -0.10 -1.49 0.01 0.00 0.01 0.00 0.00 72.50 70.93 4aah s THR 75 CO 0.35 0.48 -0.21 -0.31 -0.69 0.00 0.00 174.62 174.24 4aah s TYR 76 N 0.46 2.65 -0.23 4.92 2.02 -0.67 0.15 117.35 126.65 4aah s TYR 76 Ca -0.17 -1.37 -0.09 0.00 -0.37 0.00 0.00 57.07 55.07 4aah s TYR 76 Cb -0.17 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 4aah s TYR 76 CO 0.07 -0.64 0.11 0.00 -1.57 0.00 0.00 175.55 173.52 4aah s ALA 77 N 0.90 3.41 -0.02 3.71 0.00 0.52 -1.39 121.76 128.89 4aah s ALA 77 Ca -0.05 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.05 4aah s ALA 77 Cb -0.15 -2.15 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 4aah s ALA 77 CO -0.04 -0.21 -0.26 -0.51 0.00 0.00 0.00 175.76 174.75 4aah s LEU 78 N 1.10 2.05 -0.17 0.00 1.43 0.48 -0.57 118.68 123.00 4aah s LEU 78 Ca 0.06 -0.47 -0.18 0.00 -1.03 0.00 0.00 54.13 52.51 4aah s LEU 78 Cb -0.14 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 4aah s LEU 78 CO 0.04 0.31 0.48 0.21 0.23 0.00 0.00 176.35 177.61 4aah s ASN 79 N -0.55 6.58 0.20 2.29 3.84 -1.26 -0.89 114.94 125.16 4aah s ASN 79 Ca 0.08 0.69 0.13 0.00 0.21 0.00 0.00 52.86 53.97 4aah s ASN 79 Cb -0.10 -2.28 0.69 0.00 -0.55 0.00 0.00 41.25 39.01 4aah s ASN 79 CO -0.00 -0.09 1.37 0.18 -2.79 0.00 0.00 177.10 175.76 4aah n LEU 80 N 4.30 0.33 0.12 3.21 4.32 0.30 -0.40 117.00 129.18 4aah n LEU 80 Ca -0.06 0.63 0.13 0.00 -0.02 0.00 0.00 56.01 56.69 4aah n LEU 80 Cb 0.51 -0.67 0.44 0.00 -1.62 0.00 0.00 43.42 42.08 4aah n LEU 80 CO 0.42 -0.75 0.88 0.59 -1.22 0.00 0.00 177.39 177.31 4aah n ASN 81 N -1.94 0.80 -2.81 -1.43 3.02 -1.26 -4.44 115.26 107.20 4aah n ASN 81 Ca -0.01 0.62 -0.02 0.00 -0.03 0.00 0.00 54.58 55.14 4aah n ASN 81 Cb 0.06 -0.82 0.01 0.00 -0.61 0.00 0.00 39.78 38.43 4aah n ASN 81 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 4aah s ASP 82 N -4.50 -0.88 0.61 6.41 2.15 0.46 -5.00 116.67 115.92 4aah s ASP 82 Ca 0.08 -0.84 0.22 0.00 0.43 0.00 0.00 52.55 52.44 4aah s ASP 82 Cb 0.11 1.15 1.21 0.00 -0.30 0.00 0.00 42.92 45.09 4aah s ASP 82 CO 0.52 -0.05 1.66 -0.65 -0.17 0.00 0.00 175.17 176.48 4aah h PRO 83 N 5.14 0.00 0.00 4.34 0.11 -1.75 -1.34 132.00 138.49 4aah h PRO 83 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 4aah h PRO 83 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 4aah h PRO 83 CO -0.03 0.00 0.00 0.78 -0.21 0.00 0.00 178.00 178.54 4aah h GLY 84 N 0.00 0.00 -5.77 -0.55 0.00 -1.95 -3.43 103.07 91.37 4aah h GLY 84 Ca 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.69 4aah h GLY 84 CO 0.00 0.00 -0.63 0.54 0.00 0.00 0.00 176.54 176.45 4aah s LYS 85 N -3.59 3.58 -0.65 4.80 1.02 -0.51 -5.06 119.74 119.33 4aah s LYS 85 Ca 0.02 -0.46 -0.18 0.00 0.02 0.00 0.00 55.97 55.37 4aah s LYS 85 Cb 0.09 -2.95 0.12 0.00 -0.52 0.00 0.00 37.83 34.57 4aah s LYS 85 CO 0.54 0.36 0.75 0.42 -0.92 0.00 0.00 175.35 176.51 4aah s ILE 86 N 0.07 4.88 0.20 2.17 1.01 -1.26 -4.09 121.20 124.18 4aah s ILE 86 Ca 0.01 -1.20 -0.10 0.00 0.00 0.00 0.00 60.65 59.36 4aah s ILE 86 Cb -0.13 -4.52 0.12 0.00 0.01 0.00 0.00 42.46 37.94 4aah s ILE 86 CO 0.02 -1.16 1.79 0.58 0.00 0.00 0.00 174.94 176.17 4aah h VAL 87 N 5.81 0.92 -2.45 2.92 2.07 -1.21 -3.45 116.25 120.86 4aah h VAL 87 Ca -0.21 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 4aah h VAL 87 Cb 1.08 0.31 -0.18 0.00 -1.52 0.00 0.00 31.29 30.98 4aah h VAL 87 CO 1.07 0.10 0.09 -1.66 0.02 0.00 0.00 177.57 177.19 4aah s TRP 88 N -6.10 -0.52 0.02 1.57 1.48 -1.23 -5.02 118.94 109.14 4aah s TRP 88 Ca -0.13 0.75 -0.01 0.00 -1.06 0.00 0.00 56.10 55.66 4aah s TRP 88 Cb 0.15 0.36 -0.02 0.00 -1.16 0.00 0.00 33.47 32.81 4aah s TRP 88 CO 0.75 -0.61 -0.02 1.14 -4.06 0.00 0.00 176.95 174.15 4aah s GLN 89 N -1.80 0.36 -0.11 3.25 -2.07 -1.26 -0.35 119.66 117.68 4aah s GLN 89 Ca -0.09 -0.67 0.01 0.00 -1.82 0.00 0.00 55.36 52.79 4aah s GLN 89 Cb -0.01 0.13 0.02 0.00 -1.09 0.00 0.00 33.01 32.06 4aah s GLN 89 CO 0.04 -0.06 -0.11 -1.58 -1.32 0.00 0.00 175.29 172.25 4aah s HIS 90 N -1.77 1.68 -0.34 9.60 2.46 0.39 -4.92 115.29 122.40 4aah s HIS 90 Ca -0.13 -0.80 0.00 0.00 0.47 0.00 0.00 55.06 54.60 4aah s HIS 90 Cb -0.08 -1.29 0.11 0.00 -0.13 0.00 0.00 32.58 31.19 4aah s HIS 90 CO -0.02 -0.47 0.13 0.15 -2.47 0.00 0.00 174.74 172.05 4aah s LYS 91 N 1.28 0.87 0.70 2.88 1.02 -1.26 0.20 119.74 125.43 4aah s LYS 91 Ca -0.02 -1.32 -0.15 0.00 0.02 0.00 0.00 55.97 54.50 4aah s LYS 91 Cb -0.14 -2.10 0.02 0.00 -0.52 0.00 0.00 37.83 35.10 4aah s LYS 91 CO -0.04 -1.03 1.15 -2.14 -0.92 0.00 0.00 175.35 172.37 4aah s PRO 92 N 1.30 2.43 -0.40 -1.68 0.02 -1.26 -5.00 135.00 130.40 4aah s PRO 92 Ca 0.12 1.54 -0.10 0.00 0.02 0.00 0.00 61.00 62.58 4aah s PRO 92 Cb -0.19 -1.89 0.06 0.00 0.02 0.00 0.00 34.50 32.50 4aah s PRO 92 CO -0.18 -1.57 0.23 0.21 -0.33 0.00 0.00 177.00 175.37 4aah s LYS 93 N -4.07 2.70 0.01 5.54 2.20 -1.26 -5.00 119.74 119.86 4aah s LYS 93 Ca 0.70 -1.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.06 4aah s LYS 93 Cb -0.24 -3.75 -0.02 0.00 -1.51 0.00 0.00 37.83 32.31 4aah s LYS 93 CO 0.44 -0.84 -0.16 -0.65 -0.36 0.00 0.00 175.35 173.78 4aah s GLN 94 N 1.48 1.17 0.42 4.03 -0.21 -1.26 -5.12 119.66 120.17 4aah s GLN 94 Ca 0.02 -0.69 -0.26 0.00 0.02 0.00 0.00 55.36 54.45 4aah s GLN 94 Cb -0.21 -1.17 -0.09 0.00 1.00 0.00 0.00 33.01 32.53 4aah s GLN 94 CO 0.04 0.31 1.39 0.34 -2.12 0.00 0.00 175.29 175.25 4aah s ASP 95 N -0.76 6.13 0.00 5.90 -1.08 -1.26 -4.90 116.67 120.70 4aah s ASP 95 Ca 0.05 2.85 0.25 0.00 -0.52 0.00 0.00 52.55 55.17 4aah s ASP 95 Cb -0.07 -2.65 1.05 0.00 -1.46 0.00 0.00 42.92 39.79 4aah s ASP 95 CO 0.00 -0.99 1.79 0.00 0.52 0.00 0.00 175.17 176.49 4aah n ALA 96 N 0.06 2.13 0.11 3.66 0.00 -1.26 -3.15 120.51 122.06 4aah n ALA 96 Ca 0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 4aah n ALA 96 Cb 0.42 -1.40 0.14 0.00 0.00 0.00 0.00 19.45 18.61 4aah n ALA 96 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 4aah h SER 97 N 0.00 0.11 -0.97 0.00 4.64 -2.02 -3.06 113.55 112.25 4aah h SER 97 Ca 0.00 -0.07 0.31 0.00 -0.47 0.00 0.00 61.79 61.56 4aah h SER 97 Cb 0.43 -0.03 -0.15 0.00 -0.31 0.00 0.00 62.40 62.33 4aah h SER 97 CO 0.00 0.72 0.43 0.74 -0.87 0.00 0.00 176.83 177.85 4aah h THR 98 N 0.07 0.25 -0.68 2.95 2.02 -1.94 0.20 112.91 115.77 4aah h THR 98 Ca -0.01 -0.08 0.06 0.00 0.77 0.00 0.00 66.41 67.15 4aah h THR 98 Cb 1.13 -0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 4aah h THR 98 CO 0.09 0.04 0.45 0.11 0.37 0.00 0.00 175.52 176.58 4aah h LYS 99 N 0.23 0.70 0.00 6.66 1.57 -1.77 -2.35 116.57 121.61 4aah h LYS 99 Ca 0.69 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.43 4aah h LYS 99 Cb 1.55 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.70 4aah h LYS 99 CO -0.66 0.46 0.00 0.00 -0.57 0.00 0.00 179.45 178.68 4aah n ALA 100 N -2.45 1.88 -1.37 3.86 0.00 0.69 -2.90 120.51 120.22 4aah n ALA 100 Ca 0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.46 4aah n ALA 100 Cb 0.21 -1.31 0.21 0.00 0.00 0.00 0.00 19.45 18.55 4aah n ALA 100 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 4aah n VAL 101 N -1.52 2.48 -4.07 0.00 0.24 -0.88 -4.93 118.33 109.64 4aah n VAL 101 Ca 0.05 -2.60 -0.33 0.00 -2.04 0.00 0.00 64.34 59.42 4aah n VAL 101 Cb 0.23 -0.31 -0.16 0.00 -1.47 0.00 0.00 33.84 32.14 4aah n VAL 101 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 4aah s MET 102 N -3.17 3.04 0.18 7.34 1.00 -1.14 -4.74 119.30 121.81 4aah s MET 102 Ca 0.44 -0.81 -0.03 0.00 0.00 0.00 0.00 55.69 55.29 4aah s MET 102 Cb 0.39 -2.67 0.09 0.00 0.00 0.00 0.00 34.83 32.64 4aah s MET 102 CO 0.01 -0.22 1.48 0.00 0.00 0.00 0.00 175.02 176.28 4aah n ASP 105 N -0.18 0.00 -2.74 0.00 2.03 -1.26 -3.41 116.55 110.99 4aah n ASP 105 Ca 0.23 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.24 4aah n ASP 105 Cb 0.71 0.32 -0.05 0.00 -0.72 0.00 0.00 41.12 41.39 4aah n ASP 105 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 4aah n VAL 106 N -0.32 3.82 -1.64 5.18 0.24 -1.26 -4.95 118.33 119.39 4aah n VAL 106 Ca 0.00 -3.31 -0.29 0.00 -2.04 0.00 0.00 64.34 58.69 4aah n VAL 106 Cb 0.00 -1.73 0.10 0.00 -1.47 0.00 0.00 33.84 30.75 4aah n VAL 106 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 4aah s VAL 107 N -1.90 2.51 -0.23 3.34 -7.23 -1.26 -0.36 120.40 115.27 4aah s VAL 107 Ca 0.58 0.16 -0.06 0.00 -1.81 0.00 0.00 61.98 60.85 4aah s VAL 107 Cb 0.33 -2.98 0.11 0.00 0.56 0.00 0.00 36.38 34.40 4aah s VAL 107 CO -0.19 -0.21 0.46 -0.62 -0.31 0.00 0.00 175.10 174.23 4aah s ASP 108 N -4.12 -0.37 0.00 4.85 -1.08 -1.26 -4.66 116.67 110.02 4aah s ASP 108 Ca 0.62 0.95 0.23 0.00 -0.52 0.00 0.00 52.55 53.83 4aah s ASP 108 Cb -0.14 1.50 1.17 0.00 -1.46 0.00 0.00 42.92 44.00 4aah s ASP 108 CO 0.53 -0.24 1.78 0.54 0.52 0.00 0.00 175.17 178.29 4aah n ARG 109 N 5.40 1.27 0.00 4.34 1.74 0.54 -3.79 116.66 126.15 4aah n ARG 109 Ca -0.08 -0.40 0.00 0.00 -0.77 0.00 0.00 57.85 56.60 4aah n ARG 109 Cb 0.50 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 4aah n ARG 109 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4aah n GLY 110 N 0.97 1.23 3.97 -0.13 0.00 -1.26 -4.07 105.19 105.89 4aah n GLY 110 Ca 0.17 -2.18 -0.21 0.00 0.00 0.00 0.00 46.02 43.80 4aah n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4aah s LEU 111 N 0.00 3.96 0.13 0.99 1.43 -1.26 -4.19 118.68 119.74 4aah s LEU 111 Ca 0.00 0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.23 4aah s LEU 111 Cb 0.00 -2.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 4aah s LEU 111 CO 0.00 -0.41 -0.09 0.00 0.23 0.00 0.00 176.35 176.08 4aah s ALA 112 N -2.26 1.31 -0.02 4.21 0.00 -0.79 -4.53 121.76 119.67 4aah s ALA 112 Ca 0.43 -1.42 0.03 0.00 0.00 0.00 0.00 51.96 50.99 4aah s ALA 112 Cb -0.10 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.09 4aah s ALA 112 CO 0.33 -0.12 -0.10 -0.47 0.00 0.00 0.00 175.76 175.41 4aah s TYR 113 N -3.27 0.98 -0.18 0.00 5.04 -1.26 0.51 117.35 119.18 4aah s TYR 113 Ca 0.14 -0.24 -0.28 0.00 -2.44 0.00 0.00 57.07 54.26 4aah s TYR 113 Cb 0.02 -0.69 0.08 0.00 0.35 0.00 0.00 41.96 41.73 4aah s TYR 113 CO -0.01 -0.09 0.77 0.20 -1.34 0.00 0.00 175.55 175.08 4aah s GLY 114 N 0.13 -0.48 -1.59 8.97 0.00 0.04 -4.82 107.32 109.57 4aah s GLY 114 Ca -0.02 1.86 -0.07 0.00 0.00 0.00 0.00 44.72 46.48 4aah s GLY 114 CO 0.00 1.41 0.38 0.00 0.00 0.00 0.00 173.10 174.90 4aah n ALA 115 N 1.82 -1.73 -2.80 3.20 0.00 -1.26 -0.84 120.51 118.89 4aah n ALA 115 Ca -0.15 -0.26 -0.22 0.00 0.00 0.00 0.00 53.44 52.81 4aah n ALA 115 Cb 0.56 -1.82 0.02 0.00 0.00 0.00 0.00 19.45 18.21 4aah n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4aah n GLY 116 N -1.93 -0.51 3.16 0.00 0.00 -1.26 -4.99 105.19 99.66 4aah n GLY 116 Ca -0.17 0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 4aah n GLY 116 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4aah s GLN 117 N -5.47 0.80 -0.25 1.61 -0.21 -0.02 -2.70 119.66 113.42 4aah s GLN 117 Ca 0.19 -1.08 -0.10 0.00 0.02 0.00 0.00 55.36 54.39 4aah s GLN 117 Cb -0.09 -0.54 -0.05 0.00 1.00 0.00 0.00 33.01 33.34 4aah s GLN 117 CO 0.24 0.09 0.16 0.42 -2.12 0.00 0.00 175.29 174.08 4aah s ILE 118 N -2.17 5.22 -0.26 1.08 -1.09 1.00 -0.78 121.20 124.20 4aah s ILE 118 Ca 0.03 0.14 -0.11 0.00 -2.23 0.00 0.00 60.65 58.47 4aah s ILE 118 Cb -0.05 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.33 4aah s ILE 118 CO 0.00 0.31 0.18 -0.69 -1.23 0.00 0.00 174.94 173.51 4aah s VAL 119 N 1.37 5.33 0.03 2.92 1.01 0.18 -1.00 120.40 130.24 4aah s VAL 119 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.24 4aah s VAL 119 Cb -0.15 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 4aah s VAL 119 CO 0.07 0.30 -0.04 -0.75 0.00 0.00 0.00 175.10 174.68 4aah s LYS 120 N 1.40 0.37 0.50 2.72 2.20 0.32 -1.88 119.74 125.37 4aah s LYS 120 Ca 0.07 -0.68 0.04 0.00 -0.36 0.00 0.00 55.97 55.04 4aah s LYS 120 Cb -0.15 0.04 -0.01 0.00 -1.51 0.00 0.00 37.83 36.20 4aah s LYS 120 CO 0.08 -0.03 0.15 -1.59 -0.36 0.00 0.00 175.35 173.59 4aah s LYS 121 N -1.64 2.20 0.00 4.03 0.00 -1.26 0.16 119.74 123.22 4aah s LYS 121 Ca -0.13 -2.17 0.02 0.00 0.00 0.00 0.00 55.97 53.69 4aah s LYS 121 Cb -0.09 -1.78 -0.01 0.00 0.00 0.00 0.00 37.83 35.95 4aah s LYS 121 CO -0.01 -0.37 -0.08 -0.65 0.00 0.00 0.00 175.35 174.24 4aah s GLN 122 N -3.98 0.60 0.49 1.78 -0.21 -0.31 -4.95 119.66 113.07 4aah s GLN 122 Ca 0.22 -0.35 0.26 0.00 0.02 0.00 0.00 55.36 55.51 4aah s GLN 122 Cb 0.02 -0.55 1.32 0.00 1.00 0.00 0.00 33.01 34.79 4aah s GLN 122 CO 0.13 0.15 1.88 0.00 -2.12 0.00 0.00 175.29 175.32 4aah h ALA 123 N 5.71 2.57 0.00 6.09 0.00 -1.88 -1.37 119.26 130.39 4aah h ALA 123 Ca -0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 4aah h ALA 123 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 4aah h ALA 123 CO 0.48 -0.84 0.00 0.27 0.00 0.00 0.00 179.25 179.16 4aah n ASN 124 N -4.38 0.19 0.00 0.00 6.94 -1.26 -1.94 115.26 114.82 4aah n ASN 124 Ca 0.19 -1.85 0.00 0.00 -0.02 0.00 0.00 54.58 52.90 4aah n ASN 124 Cb 0.85 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 38.17 4aah n ASN 124 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 4aah n GLY 125 N 0.34 0.71 3.88 4.83 0.00 -0.52 -4.59 105.19 109.84 4aah n GLY 125 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 4aah n GLY 125 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 4aah s HIS 126 N -2.35 3.44 -0.04 1.61 3.76 -1.23 0.73 115.29 121.21 4aah s HIS 126 Ca 0.00 0.92 0.02 0.00 -0.15 0.00 0.00 55.06 55.85 4aah s HIS 126 Cb 0.00 -2.32 0.01 0.00 1.11 0.00 0.00 32.58 31.38 4aah s HIS 126 CO 0.00 0.09 -0.08 -1.17 -0.85 0.00 0.00 174.74 172.73 4aah s LEU 127 N -3.38 1.61 0.10 0.89 2.96 -0.10 -1.16 118.68 119.60 4aah s LEU 127 Ca 0.49 -0.18 -0.07 0.00 -0.22 0.00 0.00 54.13 54.14 4aah s LEU 127 Cb -0.11 -0.56 -0.01 0.00 0.50 0.00 0.00 46.19 46.02 4aah s LEU 127 CO 0.26 0.02 0.17 -1.48 -1.32 0.00 0.00 176.35 174.00 4aah s LEU 128 N 0.51 1.52 -0.13 -0.68 2.34 0.42 -1.79 118.68 120.87 4aah s LEU 128 Ca -0.08 -0.75 0.03 0.00 0.06 0.00 0.00 54.13 53.38 4aah s LEU 128 Cb -0.12 0.91 0.01 0.00 -0.56 0.00 0.00 46.19 46.43 4aah s LEU 128 CO 0.01 -0.73 -0.21 0.00 -1.06 0.00 0.00 176.35 174.35 4aah s ALA 129 N -3.89 2.17 0.01 1.48 0.00 -1.08 0.12 121.76 120.57 4aah s ALA 129 Ca 0.08 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 51.06 4aah s ALA 129 Cb 0.05 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 4aah s ALA 129 CO -0.09 0.01 -0.17 -0.51 0.00 0.00 0.00 175.76 175.00 4aah s LEU 130 N 0.77 2.10 0.44 0.00 1.43 -0.17 -0.31 118.68 122.93 4aah s LEU 130 Ca -0.09 -0.39 -0.26 0.00 -1.03 0.00 0.00 54.13 52.36 4aah s LEU 130 Cb -0.16 -0.84 -0.09 0.00 0.03 0.00 0.00 46.19 45.13 4aah s LEU 130 CO -0.00 0.16 1.40 -0.67 0.23 0.00 0.00 176.35 177.47 4aah n ASP 131 N 2.29 3.20 0.10 2.29 2.03 0.23 -0.00 116.55 126.68 4aah n ASP 131 Ca -0.16 1.13 0.13 0.00 0.52 0.00 0.00 54.79 56.41 4aah n ASP 131 Cb 0.54 -1.58 0.42 0.00 -0.72 0.00 0.00 41.12 39.78 4aah n ASP 131 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 4aah n ALA 132 N -0.14 2.26 -0.09 -1.67 0.00 -1.10 -1.10 120.51 118.67 4aah n ALA 132 Ca 0.05 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.38 4aah n ALA 132 Cb 0.41 -1.47 -0.15 0.00 0.00 0.00 0.00 19.45 18.24 4aah n ALA 132 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 4aah n LYS 133 N -2.21 0.98 -0.00 0.00 5.02 -1.26 -4.70 118.16 115.99 4aah n LYS 133 Ca 0.06 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 4aah n LYS 133 Cb 0.41 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.94 4aah n LYS 133 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 4aah n THR 134 N -2.67 0.06 -0.83 -0.18 -2.24 -1.26 -4.93 114.28 102.22 4aah n THR 134 Ca -0.30 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 4aah n THR 134 Cb 1.09 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 4aah n THR 134 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4aah n GLY 135 N 2.58 0.65 3.76 3.38 0.00 -0.26 -4.89 105.19 110.40 4aah n GLY 135 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 4aah n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 4aah s LYS 136 N -0.17 4.35 -0.37 1.61 2.20 -1.26 -4.54 119.74 121.55 4aah s LYS 136 Ca 0.00 2.20 -0.29 0.00 -0.36 0.00 0.00 55.97 57.52 4aah s LYS 136 Cb 0.00 -3.10 0.01 0.00 -1.51 0.00 0.00 37.83 33.22 4aah s LYS 136 CO 0.00 -0.24 1.37 0.42 -0.36 0.00 0.00 175.35 176.54 4aah s ILE 137 N -0.67 3.99 -0.10 5.43 1.01 -1.26 0.77 121.20 130.37 4aah s ILE 137 Ca 0.52 1.05 -0.27 0.00 0.00 0.00 0.00 60.65 61.96 4aah s ILE 137 Cb -0.40 -4.19 -0.26 0.00 0.01 0.00 0.00 42.46 37.63 4aah s ILE 137 CO 0.48 -0.66 0.89 0.78 0.00 0.00 0.00 174.94 176.43 4aah h ASN 138 N 10.18 0.11 -4.98 3.58 2.35 -1.02 -3.48 115.58 122.32 4aah h ASN 138 Ca -0.27 -0.90 -0.09 0.00 -0.55 0.00 0.00 56.30 54.49 4aah h ASN 138 Cb 1.10 -0.04 -0.20 0.00 0.05 0.00 0.00 38.32 39.24 4aah h ASN 138 CO 1.07 1.00 -0.07 -1.66 -1.65 0.00 0.00 177.43 176.12 4aah s TRP 139 N -2.62 -0.39 -0.10 1.19 1.48 -1.20 -5.03 118.94 112.26 4aah s TRP 139 Ca -0.17 0.65 -0.03 0.00 -1.06 0.00 0.00 56.10 55.49 4aah s TRP 139 Cb -0.01 0.23 0.04 0.00 -1.16 0.00 0.00 33.47 32.58 4aah s TRP 139 CO 0.72 -0.48 0.07 -2.00 -4.06 0.00 0.00 176.95 171.20 4aah s GLU 140 N -1.25 0.02 0.30 3.25 2.12 -1.26 -2.62 118.70 119.25 4aah s GLU 140 Ca -0.12 0.15 0.07 0.00 0.36 0.00 0.00 54.97 55.43 4aah s GLU 140 Cb -0.03 -1.15 -0.06 0.00 0.26 0.00 0.00 34.13 33.15 4aah s GLU 140 CO 0.07 -0.49 -0.07 0.14 -0.54 0.00 0.00 175.26 174.37 4aah s VAL 141 N 2.15 1.83 -0.21 3.70 -7.23 -0.74 -4.97 120.40 114.93 4aah s VAL 141 Ca 0.04 -2.15 -0.12 0.00 -1.81 0.00 0.00 61.98 57.94 4aah s VAL 141 Cb -0.14 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.24 4aah s VAL 141 CO -0.06 -0.27 0.22 -1.61 -0.31 0.00 0.00 175.10 173.07 4aah s GLU 142 N -3.69 4.16 -0.16 4.82 2.02 -1.26 -0.92 118.70 123.66 4aah s GLU 142 Ca 0.30 -0.10 0.03 0.00 0.02 0.00 0.00 54.97 55.23 4aah s GLU 142 Cb 0.03 -3.48 -0.12 0.00 0.10 0.00 0.00 34.13 30.66 4aah s GLU 142 CO 0.13 0.15 -0.11 0.28 0.02 0.00 0.00 175.26 175.73 4aah n VAL 143 N 3.94 0.95 -4.35 2.63 0.31 0.22 -4.98 118.33 117.06 4aah n VAL 143 Ca -0.14 -0.41 -0.18 0.00 -0.01 0.00 0.00 64.34 63.61 4aah n VAL 143 Cb 0.52 -1.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.35 4aah n VAL 143 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 4aah s ASP 145 N -3.33 3.44 0.66 0.00 -1.08 -1.23 -4.43 116.67 110.72 4aah s ASP 145 Ca 0.29 -1.11 0.43 0.00 -0.52 0.00 0.00 52.55 51.63 4aah s ASP 145 Cb 0.05 -0.84 2.34 0.00 -1.46 0.00 0.00 42.92 43.01 4aah s ASP 145 CO 0.09 -0.31 2.33 -0.65 0.52 0.00 0.00 175.17 177.16 4aah h PRO 146 N 8.12 0.00 0.00 4.34 0.11 -1.70 -2.44 132.00 140.43 4aah h PRO 146 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 4aah h PRO 146 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 4aah h PRO 146 CO 0.39 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.81 4aah n LYS 147 N -3.12 0.03 -0.36 1.05 5.02 -1.26 -1.67 118.16 117.84 4aah n LYS 147 Ca -0.03 0.23 0.08 0.00 -2.02 0.00 0.00 58.31 56.57 4aah n LYS 147 Cb 0.10 -1.55 0.17 0.00 -0.02 0.00 0.00 35.03 33.73 4aah n LYS 147 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 4aah n VAL 148 N -1.60 1.99 -2.44 -0.18 0.24 -0.94 -3.96 118.33 111.46 4aah n VAL 148 Ca 0.04 -2.70 -0.20 0.00 -2.04 0.00 0.00 64.34 59.44 4aah n VAL 148 Cb 0.21 -0.21 -0.00 0.00 -1.47 0.00 0.00 33.84 32.36 4aah n VAL 148 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 4aah n GLY 149 N -1.23 -0.44 3.48 7.63 0.00 -0.67 -4.28 105.19 109.67 4aah n GLY 149 Ca 0.17 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 4aah n GLY 149 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4aah s SER 150 N -2.18 5.24 0.20 1.61 0.15 -1.11 -4.39 113.70 113.23 4aah s SER 150 Ca 0.03 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.52 4aah s SER 150 Cb -0.01 -1.94 -0.05 0.00 -1.71 0.00 0.00 66.02 62.31 4aah s SER 150 CO 0.04 -0.01 0.08 0.42 1.20 0.00 0.00 173.24 174.96 4aah s THR 151 N 1.47 0.38 -0.07 6.45 -4.23 -0.67 -2.25 115.64 116.72 4aah s THR 151 Ca 0.06 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.58 4aah s THR 151 Cb -0.15 -2.39 -0.03 0.00 1.34 0.00 0.00 72.50 71.27 4aah s THR 151 CO 0.04 -0.19 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.16 4aah s LEU 152 N -3.20 3.52 0.00 4.79 1.43 -0.82 0.64 118.68 125.04 4aah s LEU 152 Ca 0.33 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 4aah s LEU 152 Cb 0.07 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.45 4aah s LEU 152 CO 0.09 0.36 0.00 0.35 0.23 0.00 0.00 176.35 177.38 4aah n THR 153 N 2.01 0.00 -1.71 5.49 -2.24 -1.26 -3.99 114.28 112.58 4aah n THR 153 Ca -0.18 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.31 4aah n THR 153 Cb 0.53 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.85 4aah n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4aah s GLN 154 N -0.97 2.10 0.39 -0.78 -2.07 -1.26 -0.34 119.66 116.73 4aah s GLN 154 Ca 0.00 0.43 -0.23 0.00 -1.82 0.00 0.00 55.36 53.74 4aah s GLN 154 Cb 0.00 -1.94 -0.11 0.00 -1.09 0.00 0.00 33.01 29.88 4aah s GLN 154 CO 0.00 -1.56 0.94 0.00 -1.32 0.00 0.00 175.29 173.35 4aah s ALA 155 N -3.31 3.11 0.91 2.60 0.00 -1.26 -4.64 121.76 119.16 4aah s ALA 155 Ca 0.61 0.43 -0.12 0.00 0.00 0.00 0.00 51.96 52.88 4aah s ALA 155 Cb -0.13 -3.15 0.13 0.00 0.00 0.00 0.00 23.12 19.98 4aah s ALA 155 CO 0.52 0.15 1.09 -2.14 0.00 0.00 0.00 175.76 175.39 4aah s PRO 156 N -2.75 1.17 -0.01 0.00 0.02 -1.26 -4.94 135.00 127.22 4aah s PRO 156 Ca 0.57 0.82 0.04 0.00 0.02 0.00 0.00 61.00 62.45 4aah s PRO 156 Cb -0.13 -1.80 -0.01 0.00 0.02 0.00 0.00 34.50 32.59 4aah s PRO 156 CO 0.17 -2.30 -0.13 0.12 -0.33 0.00 0.00 177.00 174.52 4aah s PHE 157 N -2.92 1.22 -0.04 6.54 5.36 -0.94 -4.63 117.98 122.56 4aah s PHE 157 Ca 0.64 -0.23 0.04 0.00 -0.96 0.00 0.00 56.93 56.41 4aah s PHE 157 Cb -0.18 -0.78 -0.00 0.00 -0.34 0.00 0.00 43.02 41.71 4aah s PHE 157 CO 0.57 -0.02 -0.16 0.08 -1.46 0.00 0.00 175.22 174.23 4aah s VAL 158 N -0.30 1.34 -0.17 3.12 1.01 -1.26 -1.72 120.40 122.42 4aah s VAL 158 Ca 0.05 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 4aah s VAL 158 Cb -0.05 -1.16 0.07 0.00 0.00 0.00 0.00 36.38 35.24 4aah s VAL 158 CO -0.00 0.39 0.39 0.00 0.00 0.00 0.00 175.10 175.88 4aah s ALA 159 N 0.08 -1.01 0.00 5.51 0.00 -0.42 -4.75 121.76 121.17 4aah s ALA 159 Ca -0.04 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.36 4aah s ALA 159 Cb -0.11 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 21.97 4aah s ALA 159 CO 0.02 -0.44 0.00 1.63 0.00 0.00 0.00 175.76 176.97 4aah n LYS 160 N 4.69 0.00 -1.22 0.00 5.02 -1.26 -1.47 118.16 123.91 4aah n LYS 160 Ca -0.18 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.87 4aah n LYS 160 Cb 0.53 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.71 4aah n LYS 160 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 4aah n ASP 161 N 2.85 4.16 -4.18 4.39 9.92 -1.26 -2.02 116.55 130.41 4aah n ASP 161 Ca 0.00 -3.64 -0.26 0.00 -0.53 0.00 0.00 54.79 50.36 4aah n ASP 161 Cb 0.00 -0.84 -0.15 0.00 -0.64 0.00 0.00 41.12 39.48 4aah n ASP 161 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 4aah s THR 162 N -3.49 1.47 -0.12 -3.53 2.01 -0.55 -1.37 115.64 110.06 4aah s THR 162 Ca 0.57 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.81 4aah s THR 162 Cb 0.48 -1.23 0.00 0.00 0.01 0.00 0.00 72.50 71.76 4aah s THR 162 CO 0.09 0.42 -0.21 0.54 -0.69 0.00 0.00 174.62 174.76 4aah s VAL 163 N -0.40 2.23 -0.16 3.82 0.11 -0.28 -1.30 120.40 124.42 4aah s VAL 163 Ca 0.06 -0.94 -0.07 0.00 -2.93 0.00 0.00 61.98 58.10 4aah s VAL 163 Cb -0.08 -1.88 -0.04 0.00 -1.53 0.00 0.00 36.38 32.85 4aah s VAL 163 CO -0.00 0.55 0.07 -0.76 -3.33 0.00 0.00 175.10 171.62 4aah s LEU 164 N 0.54 3.88 -0.04 2.54 1.43 -0.70 -0.07 118.68 126.26 4aah s LEU 164 Ca -0.13 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.10 4aah s LEU 164 Cb -0.17 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.11 4aah s LEU 164 CO 0.04 0.24 0.11 -0.04 0.23 0.00 0.00 176.35 176.93 4aah s MET 165 N -0.03 0.11 -0.01 1.70 -1.94 0.30 -2.21 119.30 117.22 4aah s MET 165 Ca 0.07 0.19 0.02 0.00 -1.71 0.00 0.00 55.69 54.26 4aah s MET 165 Cb -0.12 -0.01 -0.00 0.00 2.01 0.00 0.00 34.83 36.71 4aah s MET 165 CO 0.01 -0.05 -0.07 0.20 -0.01 0.00 0.00 175.02 175.09 4aah s GLY 166 N 0.35 0.40 0.62 -0.03 0.00 -1.26 -0.38 107.32 107.01 4aah s GLY 166 Ca -0.02 -0.29 -0.12 0.00 0.00 0.00 0.00 44.72 44.29 4aah s GLY 166 CO -0.01 -0.15 1.03 0.00 0.00 0.00 0.00 173.10 173.97 4aah s SER 168 N -3.80 5.00 0.00 0.00 0.01 0.21 -4.02 113.70 111.09 4aah s SER 168 Ca 0.57 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.37 4aah s SER 168 Cb -0.12 -1.10 0.00 0.00 0.21 0.00 0.00 66.02 65.01 4aah s SER 168 CO 0.49 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.74 4aah n GLY 169 N -1.00 -0.70 0.31 3.44 0.00 -1.26 -1.67 105.19 104.30 4aah n GLY 169 Ca -0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.08 4aah n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah h ALA 170 N 0.00 2.12 0.00 4.61 0.00 -1.89 0.65 119.26 124.75 4aah h ALA 170 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 4aah h ALA 170 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 4aah h ALA 170 CO 0.00 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.38 4aah n GLU 171 N -4.36 0.06 -0.18 0.00 4.71 -1.26 -1.20 120.64 118.41 4aah n GLU 171 Ca 0.02 0.19 0.05 0.00 -0.01 0.00 0.00 57.16 57.41 4aah n GLU 171 Cb 0.29 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.36 4aah n GLU 171 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 4aah n LEU 172 N -1.45 2.88 -2.00 -4.62 7.99 0.22 0.49 117.00 120.51 4aah n LEU 172 Ca 0.05 -2.18 -0.13 0.00 -0.01 0.00 0.00 56.01 53.74 4aah n LEU 172 Cb 0.18 -0.24 0.03 0.00 -0.11 0.00 0.00 43.42 43.29 4aah n LEU 172 CO 0.15 0.68 0.08 0.61 -1.51 0.00 0.00 177.39 177.40 4aah n GLY 173 N 0.12 0.10 3.77 -0.72 0.00 -0.34 -4.62 105.19 103.50 4aah n GLY 173 Ca 0.11 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 4aah n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4aah s VAL 174 N -3.05 4.70 -0.46 1.61 1.01 -0.91 -4.41 120.40 118.89 4aah s VAL 174 Ca 0.25 1.43 -0.22 0.00 0.00 0.00 0.00 61.98 63.44 4aah s VAL 174 Cb -0.11 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.28 4aah s VAL 174 CO 0.31 0.47 0.74 -0.60 0.00 0.00 0.00 175.10 176.02 4aah s ARG 175 N -0.62 3.34 0.48 2.72 3.52 -1.26 -2.77 118.95 124.36 4aah s ARG 175 Ca 0.33 -0.25 -0.24 0.00 -0.13 0.00 0.00 55.73 55.45 4aah s ARG 175 Cb -0.20 -3.96 -0.07 0.00 -1.56 0.00 0.00 34.95 29.16 4aah s ARG 175 CO 0.21 -1.11 1.37 0.41 -0.81 0.00 0.00 175.30 175.37 4aah n GLY 176 N 5.02 0.83 3.49 8.12 0.00 -0.50 -4.92 105.19 117.25 4aah n GLY 176 Ca 0.01 0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 4aah n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah s ALA 177 N -1.23 -1.65 -0.26 4.61 0.00 -1.26 -1.06 121.76 120.91 4aah s ALA 177 Ca 0.65 1.26 -0.11 0.00 0.00 0.00 0.00 51.96 53.77 4aah s ALA 177 Cb -0.45 -0.10 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 4aah s ALA 177 CO 0.54 -0.35 0.17 0.54 0.00 0.00 0.00 175.76 176.66 4aah s VAL 178 N -1.06 5.27 -0.15 0.00 0.11 -0.43 -4.23 120.40 119.91 4aah s VAL 178 Ca -0.10 0.15 -0.08 0.00 -2.93 0.00 0.00 61.98 59.02 4aah s VAL 178 Cb -0.01 -3.49 -0.04 0.00 -1.53 0.00 0.00 36.38 31.31 4aah s VAL 178 CO 0.08 0.29 0.13 0.20 -3.33 0.00 0.00 175.10 172.47 4aah s ASN 179 N 1.47 6.24 -0.16 3.54 -0.87 0.49 -0.89 114.94 124.75 4aah s ASN 179 Ca 0.07 0.36 0.00 0.00 -1.57 0.00 0.00 52.86 51.72 4aah s ASN 179 Cb -0.15 -2.04 0.00 0.00 -0.02 0.00 0.00 41.25 39.04 4aah s ASN 179 CO 0.08 0.32 -0.15 0.00 -2.57 0.00 0.00 177.10 174.78 4aah s ALA 180 N -0.50 2.50 0.24 0.60 0.00 -0.59 -0.54 121.76 123.47 4aah s ALA 180 Ca 0.12 -1.08 0.10 0.00 0.00 0.00 0.00 51.96 51.10 4aah s ALA 180 Cb -0.12 -1.26 -0.05 0.00 0.00 0.00 0.00 23.12 21.70 4aah s ALA 180 CO 0.02 -0.12 -0.19 -0.06 0.00 0.00 0.00 175.76 175.41 4aah s PHE 181 N 0.95 2.08 -0.15 0.00 0.40 0.90 0.10 117.98 122.26 4aah s PHE 181 Ca -0.03 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.59 4aah s PHE 181 Cb -0.15 -0.94 -0.01 0.00 0.51 0.00 0.00 43.02 42.43 4aah s PHE 181 CO -0.02 0.55 1.15 0.34 0.70 0.00 0.00 175.22 177.94 4aah s ASP 182 N -3.27 7.06 0.20 1.36 -1.08 -0.75 -1.12 116.67 119.06 4aah s ASP 182 Ca 0.25 1.61 -0.12 0.00 -0.52 0.00 0.00 52.55 53.77 4aah s ASP 182 Cb -0.04 -2.55 0.24 0.00 -1.46 0.00 0.00 42.92 39.11 4aah s ASP 182 CO 0.11 -0.65 1.69 0.25 0.52 0.00 0.00 175.17 177.10 4aah h LEU 183 N 9.03 -0.12 -0.78 -1.34 6.46 -1.56 0.40 115.31 127.39 4aah h LEU 183 Ca -0.27 0.12 -0.12 0.00 -0.12 0.00 0.00 57.88 57.49 4aah h LEU 183 Cb 1.11 0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.22 4aah h LEU 183 CO 0.93 -0.04 -0.38 0.11 -0.62 0.00 0.00 178.44 178.44 4aah h LYS 184 N 0.18 0.47 0.00 1.25 6.56 -1.92 -3.39 116.57 119.71 4aah h LYS 184 Ca 0.28 -0.22 0.00 0.00 -1.06 0.00 0.00 60.65 59.65 4aah h LYS 184 Cb 0.43 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 4aah h LYS 184 CO -0.42 0.78 0.00 0.25 -2.06 0.00 0.00 179.45 178.00 4aah n THR 185 N -4.04 0.00 -1.12 -0.16 -2.24 -1.09 -4.97 114.28 100.66 4aah n THR 185 Ca -0.01 -0.24 -0.04 0.00 -2.27 0.00 0.00 64.05 61.49 4aah n THR 185 Cb 0.49 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 4aah n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4aah n GLY 186 N 0.42 0.67 3.77 3.38 0.00 0.14 -4.92 105.19 108.65 4aah n GLY 186 Ca 0.00 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 4aah n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 4aah s GLU 187 N -1.77 4.60 0.24 1.61 2.12 -1.26 -4.69 118.70 119.55 4aah s GLU 187 Ca 0.00 1.21 -0.30 0.00 0.36 0.00 0.00 54.97 56.24 4aah s GLU 187 Cb 0.00 -3.20 -0.10 0.00 0.26 0.00 0.00 34.13 31.09 4aah s GLU 187 CO 0.00 0.53 1.41 -1.17 -0.54 0.00 0.00 175.26 175.48 4aah s LEU 188 N -1.29 4.39 -0.25 2.70 2.96 -1.26 -1.81 118.68 124.12 4aah s LEU 188 Ca 0.38 2.62 -0.16 0.00 -0.22 0.00 0.00 54.13 56.75 4aah s LEU 188 Cb -0.23 -3.62 -0.13 0.00 0.50 0.00 0.00 46.19 42.71 4aah s LEU 188 CO 0.27 -0.66 -0.20 0.29 -1.32 0.00 0.00 176.35 174.73 4aah n LYS 189 N 2.28 0.58 -3.62 1.98 5.02 0.12 -4.94 118.16 119.58 4aah n LYS 189 Ca 0.06 0.35 -0.05 0.00 -2.02 0.00 0.00 58.31 56.65 4aah n LYS 189 Cb 0.41 -1.56 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 4aah n LYS 189 CO 0.00 0.00 0.00 1.67 -0.52 0.00 0.00 177.40 178.55 4aah s TRP 190 N -2.48 -0.21 -0.02 2.13 1.48 -1.24 -5.04 118.94 113.55 4aah s TRP 190 Ca -0.35 0.02 0.01 0.00 -1.06 0.00 0.00 56.10 54.71 4aah s TRP 190 Cb 0.12 0.58 0.02 0.00 -1.16 0.00 0.00 33.47 33.02 4aah s TRP 190 CO 0.51 -0.59 -0.01 0.50 -4.06 0.00 0.00 176.95 173.30 4aah s ARG 191 N -3.04 0.34 -0.28 3.25 3.52 -1.26 -1.54 118.95 119.93 4aah s ARG 191 Ca 0.09 0.02 0.02 0.00 -0.13 0.00 0.00 55.73 55.73 4aah s ARG 191 Cb -0.00 -0.46 0.08 0.00 -1.56 0.00 0.00 34.95 33.00 4aah s ARG 191 CO -0.04 -0.08 -0.01 0.00 -0.81 0.00 0.00 175.30 174.36 4aah s ALA 192 N 0.76 2.30 0.75 6.12 0.00 -0.07 -4.89 121.76 126.73 4aah s ALA 192 Ca -0.08 -1.84 -0.11 0.00 0.00 0.00 0.00 51.96 49.93 4aah s ALA 192 Cb -0.11 -1.65 0.04 0.00 0.00 0.00 0.00 23.12 21.40 4aah s ALA 192 CO -0.01 -1.41 1.08 -0.06 0.00 0.00 0.00 175.76 175.36 4aah s PHE 193 N 1.22 2.97 -0.36 0.00 0.40 -0.33 -1.32 117.98 120.57 4aah s PHE 193 Ca 0.01 1.24 0.23 0.00 -0.60 0.00 0.00 56.93 57.81 4aah s PHE 193 Cb -0.19 -3.03 -0.04 0.00 0.51 0.00 0.00 43.02 40.27 4aah s PHE 193 CO -0.09 -1.53 0.93 0.00 0.70 0.00 0.00 175.22 175.23 4aah n ALA 194 N -3.29 2.95 -2.30 5.36 0.00 -0.22 -4.15 120.51 118.86 4aah n ALA 194 Ca 0.07 -0.36 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 4aah n ALA 194 Cb 0.55 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.92 4aah n ALA 194 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 4aah s THR 195 N -3.32 0.42 0.00 0.00 -4.23 -1.26 0.75 115.64 107.99 4aah s THR 195 Ca -0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 4aah s THR 195 Cb 0.13 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.37 4aah s THR 195 CO 0.82 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.51 4aah n GLY 196 N -0.44 -1.50 3.77 3.99 0.00 -1.15 -4.47 105.19 105.39 4aah n GLY 196 Ca 0.01 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.64 4aah n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 4aah s SER 197 N -4.00 4.79 0.44 1.61 1.04 -1.26 -3.67 113.70 112.65 4aah s SER 197 Ca 0.00 1.91 0.16 0.00 0.48 0.00 0.00 55.95 58.50 4aah s SER 197 Cb 0.00 -2.54 1.08 0.00 0.10 0.00 0.00 66.02 64.66 4aah s SER 197 CO 0.00 -1.84 1.95 0.44 0.98 0.00 0.00 173.24 174.77 4aah h ASP 198 N -0.56 0.34 -0.24 7.02 5.19 -1.95 -0.62 116.42 125.60 4aah h ASP 198 Ca -0.45 0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 55.88 4aah h ASP 198 Cb 1.24 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.69 4aah h ASP 198 CO 0.53 0.19 -0.23 0.44 -3.12 0.00 0.00 179.24 177.05 4aah h ASP 199 N 0.37 0.61 -0.06 6.45 5.19 -1.92 0.21 116.42 127.27 4aah h ASP 199 Ca 0.32 -0.47 -0.16 0.00 -0.62 0.00 0.00 57.03 56.10 4aah h ASP 199 Cb 0.75 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 4aah h ASP 199 CO -0.09 0.96 -0.53 0.77 -3.12 0.00 0.00 179.24 177.23 4aah h SER 200 N 0.28 0.71 1.24 6.45 4.64 -1.52 -3.08 113.55 122.27 4aah h SER 200 Ca 0.04 -0.37 -0.10 0.00 -0.47 0.00 0.00 61.79 60.89 4aah h SER 200 Cb 0.78 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 4aah h SER 200 CO 0.06 1.10 -0.46 0.58 -0.87 0.00 0.00 176.83 177.24 4aah h VAL 201 N 0.50 0.87 -4.95 0.95 2.07 -1.25 -0.85 116.25 113.59 4aah h VAL 201 Ca 0.01 -1.96 -0.04 0.00 0.82 0.00 0.00 66.70 65.53 4aah h VAL 201 Cb 1.09 2.23 0.04 0.00 -1.52 0.00 0.00 31.29 33.13 4aah h VAL 201 CO 0.11 0.45 -0.15 0.54 0.02 0.00 0.00 177.57 178.53 4aah n ARG 202 N -3.33 -1.24 -3.81 1.57 1.74 0.71 -4.46 116.66 107.83 4aah n ARG 202 Ca 0.01 1.19 -0.36 0.00 -0.77 0.00 0.00 57.85 57.91 4aah n ARG 202 Cb 0.65 -5.00 -0.07 0.00 -1.02 0.00 0.00 32.46 27.02 4aah n ARG 202 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 4aah s LEU 203 N -3.92 4.34 0.73 0.55 1.43 -1.07 0.46 118.68 121.21 4aah s LEU 203 Ca 0.08 0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 53.50 4aah s LEU 203 Cb -0.01 -2.11 0.03 0.00 0.03 0.00 0.00 46.19 44.13 4aah s LEU 203 CO 0.61 0.33 1.08 0.00 0.23 0.00 0.00 176.35 178.61 4aah s ALA 204 N -0.61 2.61 0.18 4.21 0.00 -0.75 -4.77 121.76 122.63 4aah s ALA 204 Ca 0.14 -0.19 0.35 0.00 0.00 0.00 0.00 51.96 52.26 4aah s ALA 204 Cb -0.12 -3.09 1.64 0.00 0.00 0.00 0.00 23.12 21.55 4aah s ALA 204 CO 0.03 -1.36 2.05 0.87 0.00 0.00 0.00 175.76 177.35 4aah h LYS 205 N -0.82 0.00 -0.67 0.00 1.57 -1.98 -1.05 116.57 113.63 4aah h LYS 205 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 4aah h LYS 205 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 4aah h LYS 205 CO 0.61 0.00 0.00 -0.40 -0.57 0.00 0.00 179.45 179.09 4aah n ASP 206 N -2.90 4.21 -4.64 0.86 5.75 -1.26 -4.95 116.55 113.62 4aah n ASP 206 Ca -0.01 -2.26 -0.59 0.00 -0.01 0.00 0.00 54.79 51.92 4aah n ASP 206 Cb 0.20 -0.53 -0.08 0.00 -1.03 0.00 0.00 41.12 39.68 4aah n ASP 206 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 4aah n PHE 207 N 1.23 1.83 -1.35 2.11 7.35 -0.40 -1.32 117.46 126.92 4aah n PHE 207 Ca 0.24 0.67 -0.13 0.00 -0.76 0.00 0.00 57.45 57.47 4aah n PHE 207 Cb 0.75 -2.40 -0.06 0.00 0.35 0.00 0.00 39.48 38.13 4aah n PHE 207 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 4aah n ASN 208 N 5.87 -5.04 -0.27 -2.13 3.02 -1.02 -4.84 115.26 110.85 4aah n ASN 208 Ca 0.33 0.32 0.31 0.00 -0.03 0.00 0.00 54.58 55.51 4aah n ASN 208 Cb 0.08 -4.02 0.71 0.00 -0.61 0.00 0.00 39.78 35.94 4aah n ASN 208 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 4aah h SER 209 N 0.00 0.05 1.16 6.41 4.64 -1.46 0.81 113.55 125.16 4aah h SER 209 Ca -0.27 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 4aah h SER 209 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 4aah h SER 209 CO 0.39 0.01 -0.30 0.00 -0.87 0.00 0.00 176.83 176.06 4aah n ALA 210 N -2.72 2.61 -3.16 5.18 0.00 -1.26 -4.21 120.51 116.96 4aah n ALA 210 Ca 0.23 -0.14 -0.18 0.00 0.00 0.00 0.00 53.44 53.35 4aah n ALA 210 Cb 1.10 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.20 4aah n ALA 210 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 4aah n ASN 211 N -2.16 0.52 0.16 0.00 3.02 0.27 -4.98 115.26 112.09 4aah n ASN 211 Ca 0.05 -3.03 0.19 0.00 -0.03 0.00 0.00 54.58 51.76 4aah n ASN 211 Cb 0.43 -0.43 0.77 0.00 -0.61 0.00 0.00 39.78 39.94 4aah n ASN 211 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 4aah h PRO 212 N 3.11 0.00 0.00 3.52 0.13 -1.47 -1.41 132.00 135.87 4aah h PRO 212 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 4aah h PRO 212 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 4aah h PRO 212 CO 0.47 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 175.85 4aah n HIS 213 N -3.54 0.00 0.12 1.56 1.44 -1.26 -2.04 115.22 111.50 4aah n HIS 213 Ca 0.05 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.74 4aah n HIS 213 Cb 0.54 -0.48 0.10 0.00 0.12 0.00 0.00 29.99 30.26 4aah n HIS 213 CO 0.00 0.00 0.00 1.88 -2.81 0.00 0.00 176.34 175.41 4aah h TYR 214 N 0.00 0.00 0.00 -1.40 0.05 -1.59 -3.49 116.97 110.54 4aah h TYR 214 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 4aah h TYR 214 Cb 0.33 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.07 4aah h TYR 214 CO 0.00 0.69 0.00 0.41 -1.05 0.00 0.00 178.16 178.21 4aah n GLY 215 N 0.60 3.07 0.00 3.88 0.00 -0.87 -4.80 105.19 107.07 4aah n GLY 215 Ca -0.01 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.03 4aah n GLY 215 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4aah n GLN 216 N -0.64 0.00 -3.21 1.61 6.02 -1.26 -4.79 117.38 115.11 4aah n GLN 216 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 4aah n GLN 216 Cb 0.00 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.20 4aah n GLN 216 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 4aah s PHE 217 N 1.82 3.81 0.00 1.08 0.08 -1.26 -4.23 117.98 119.28 4aah s PHE 217 Ca 0.00 1.33 0.00 0.00 0.12 0.00 0.00 56.93 58.38 4aah s PHE 217 Cb 0.00 -2.56 0.00 0.00 -0.57 0.00 0.00 43.02 39.89 4aah s PHE 217 CO 0.00 0.55 0.00 0.41 -0.10 0.00 0.00 175.22 176.08 4aah n GLY 218 N 1.77 0.82 0.27 4.36 0.00 -1.26 -4.91 105.19 106.24 4aah n GLY 218 Ca -0.09 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.07 4aah n GLY 218 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 4aah h LEU 219 N 0.00 0.00 -1.89 0.99 3.38 -1.91 -2.24 115.31 113.65 4aah h LEU 219 Ca 0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 4aah h LEU 219 Cb 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 4aah h LEU 219 CO 0.00 0.10 0.45 1.23 0.09 0.00 0.00 178.44 180.31 4aah h GLY 220 N 1.32 0.19 0.00 0.83 0.00 -1.77 -1.18 103.07 102.46 4aah h GLY 220 Ca -0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 4aah h GLY 220 CO 0.01 0.01 -1.11 -1.30 0.00 0.00 0.00 176.54 174.15 4aah n THR 221 N -4.39 0.11 0.23 4.70 -2.24 -1.15 -2.91 114.28 108.63 4aah n THR 221 Ca 0.12 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.94 4aah n THR 221 Cb 0.64 -0.62 0.57 0.00 -2.10 0.00 0.00 70.33 68.82 4aah n THR 221 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 4aah h LYS 222 N 0.00 0.00 -0.43 -0.78 1.57 -1.42 -1.43 116.57 114.08 4aah h LYS 222 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 4aah h LYS 222 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 4aah h LYS 222 CO -0.01 0.21 0.00 0.25 -0.57 0.00 0.00 179.45 179.33 4aah n THR 223 N -3.85 0.30 -3.98 -0.16 -2.24 -0.45 -4.71 114.28 99.19 4aah n THR 223 Ca -0.02 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.43 4aah n THR 223 Cb 0.30 -0.11 -0.13 0.00 -2.10 0.00 0.00 70.33 68.29 4aah n THR 223 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 4aah s TRP 224 N -1.64 0.25 -0.38 4.78 0.52 -0.54 -1.28 118.94 120.66 4aah s TRP 224 Ca 0.09 -0.23 -0.19 0.00 0.02 0.00 0.00 56.10 55.79 4aah s TRP 224 Cb 0.06 -0.16 0.01 0.00 -1.15 0.00 0.00 33.47 32.22 4aah s TRP 224 CO 0.05 -0.06 0.57 -2.00 0.02 0.00 0.00 176.95 175.53 4aah s GLU 225 N -0.63 3.52 3.63 4.98 2.12 -1.26 -4.88 118.70 126.18 4aah s GLU 225 Ca -0.05 -0.20 0.00 0.00 0.36 0.00 0.00 54.97 55.08 4aah s GLU 225 Cb -0.04 -3.85 0.00 0.00 0.26 0.00 0.00 34.13 30.49 4aah s GLU 225 CO -0.00 -0.77 0.00 0.41 -0.54 0.00 0.00 175.26 174.35 4aah n GLY 226 N 4.84 0.33 1.23 -1.50 0.00 -1.26 -3.25 105.19 105.59 4aah n GLY 226 Ca -0.03 -0.90 0.02 0.00 0.00 0.00 0.00 46.02 45.11 4aah n GLY 226 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 4aah n ASP 227 N 0.37 3.34 0.27 1.61 8.00 -1.26 -4.43 116.55 124.46 4aah n ASP 227 Ca 0.00 -2.49 0.12 0.00 0.71 0.00 0.00 54.79 53.13 4aah n ASP 227 Cb 0.00 -0.60 0.78 0.00 -0.02 0.00 0.00 41.12 41.28 4aah n ASP 227 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4aah h ALA 228 N 2.83 1.54 0.00 2.24 0.00 -1.92 0.15 119.26 124.10 4aah h ALA 228 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 4aah h ALA 228 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 4aah h ALA 228 CO 0.28 0.07 0.00 -2.67 0.00 0.00 0.00 179.25 176.93 4aah n TRP 229 N -3.93 0.74 0.28 0.00 4.27 -1.26 -2.79 117.44 114.75 4aah n TRP 229 Ca -0.03 0.29 0.15 0.00 -3.89 0.00 0.00 57.50 54.03 4aah n TRP 229 Cb 0.14 -0.97 0.80 0.00 -1.36 0.00 0.00 31.31 29.92 4aah n TRP 229 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 4aah h LYS 230 N 0.00 0.00 -0.55 -2.67 1.57 -1.05 -2.50 116.57 111.36 4aah h LYS 230 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 4aah h LYS 230 Cb 0.35 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.25 4aah h LYS 230 CO 0.00 0.08 -1.03 0.44 -0.57 0.00 0.00 179.45 178.37 4aah n ILE 231 N -3.43 1.66 1.41 1.86 -5.35 -1.12 -4.56 119.36 109.83 4aah n ILE 231 Ca -0.02 -3.35 0.15 0.00 -0.27 0.00 0.00 62.75 59.26 4aah n ILE 231 Cb 0.23 0.51 0.75 0.00 -1.74 0.00 0.00 39.64 39.39 4aah n ILE 231 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 4aah n GLY 232 N -0.62 -1.26 7.00 3.28 0.00 -0.94 -4.35 105.19 108.29 4aah n GLY 232 Ca 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.07 4aah n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4aah n GLY 233 N 1.23 -0.03 1.91 -0.02 0.00 -1.12 -2.31 105.19 104.86 4aah n GLY 233 Ca 0.14 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.14 4aah n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4aah n GLY 234 N 0.00 0.42 3.77 -0.02 0.00 -0.02 -1.41 105.19 107.94 4aah n GLY 234 Ca 0.00 -1.00 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 4aah n GLY 234 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4aah s THR 235 N -2.00 3.11 -0.45 2.61 -4.23 -1.26 -3.19 115.64 110.23 4aah s THR 235 Ca 0.00 0.83 -0.08 0.00 -1.18 0.00 0.00 61.69 61.25 4aah s THR 235 Cb 0.00 -3.42 0.10 0.00 1.34 0.00 0.00 72.50 70.53 4aah s THR 235 CO 0.00 -0.02 0.30 0.54 -0.54 0.00 0.00 174.62 174.90 4aah s ASN 236 N -1.38 5.62 -0.06 3.99 4.22 -1.26 -1.50 114.94 124.58 4aah s ASN 236 Ca 0.64 -1.79 0.09 0.00 -2.14 0.00 0.00 52.86 49.67 4aah s ASN 236 Cb -0.28 -1.98 0.21 0.00 1.28 0.00 0.00 41.25 40.48 4aah s ASN 236 CO 0.34 -0.62 1.15 -2.67 -2.04 0.00 0.00 177.10 173.26 4aah n TRP 237 N 4.87 0.23 0.00 1.54 4.27 -1.26 -4.30 117.44 122.79 4aah n TRP 237 Ca -0.08 -0.68 0.00 0.00 -3.89 0.00 0.00 57.50 52.85 4aah n TRP 237 Cb 0.41 -0.11 0.00 0.00 -1.36 0.00 0.00 31.31 30.26 4aah n TRP 237 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 4aah n GLY 238 N -0.53 1.08 3.48 -1.67 0.00 -1.26 -4.40 105.19 101.89 4aah n GLY 238 Ca 0.09 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 4aah n GLY 238 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 4aah s TRP 239 N 3.46 2.32 0.41 1.61 0.52 -1.18 -4.64 118.94 121.43 4aah s TRP 239 Ca 0.00 -0.33 0.07 0.00 0.02 0.00 0.00 56.10 55.87 4aah s TRP 239 Cb 0.00 -1.03 -0.04 0.00 -1.15 0.00 0.00 33.47 31.25 4aah s TRP 239 CO 0.00 0.68 0.25 0.71 0.02 0.00 0.00 176.95 178.61 4aah s TYR 240 N -2.38 2.65 0.07 -1.98 1.51 -1.26 -4.47 117.35 111.50 4aah s TYR 240 Ca 0.29 -0.54 -0.11 0.00 -1.01 0.00 0.00 57.07 55.69 4aah s TYR 240 Cb -0.06 -2.01 0.01 0.00 -0.11 0.00 0.00 41.96 39.79 4aah s TYR 240 CO 0.15 0.09 0.25 0.00 -1.11 0.00 0.00 175.55 174.93 4aah s ALA 241 N -2.54 -0.48 -0.07 3.71 0.00 -1.04 -4.69 121.76 116.64 4aah s ALA 241 Ca 0.43 -0.30 -0.11 0.00 0.00 0.00 0.00 51.96 51.99 4aah s ALA 241 Cb 0.01 0.43 0.02 0.00 0.00 0.00 0.00 23.12 23.59 4aah s ALA 241 CO 0.24 -0.48 0.27 -0.47 0.00 0.00 0.00 175.76 175.33 4aah s TYR 242 N -3.25 -0.23 -0.35 0.00 5.04 0.22 -1.52 117.35 117.25 4aah s TYR 242 Ca 0.00 0.52 0.02 0.00 -2.44 0.00 0.00 57.07 55.18 4aah s TYR 242 Cb 0.02 0.08 0.10 0.00 0.35 0.00 0.00 41.96 42.51 4aah s TYR 242 CO -0.08 -0.23 0.08 0.34 -1.34 0.00 0.00 175.55 174.33 4aah s ASP 243 N -0.42 4.88 0.30 4.32 -1.08 -0.24 -3.79 116.67 120.65 4aah s ASP 243 Ca -0.05 -2.11 -0.02 0.00 -0.52 0.00 0.00 52.55 49.85 4aah s ASP 243 Cb -0.04 -1.68 0.46 0.00 -1.46 0.00 0.00 42.92 40.21 4aah s ASP 243 CO 0.02 -0.42 1.96 -0.65 0.52 0.00 0.00 175.17 176.60 4aah h PRO 244 N 7.72 1.07 0.26 4.34 0.11 -1.95 1.26 132.00 144.81 4aah h PRO 244 Ca -0.07 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 4aah h PRO 244 Cb 1.03 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 4aah h PRO 244 CO 0.56 0.71 -0.16 -0.22 -0.21 0.00 0.00 178.00 178.68 4aah h LYS 245 N 1.11 -0.38 0.00 1.05 3.64 -1.96 -3.04 116.57 116.98 4aah h LYS 245 Ca 0.31 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.70 4aah h LYS 245 Cb -0.08 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 4aah h LYS 245 CO -0.08 -0.26 -0.10 -0.07 -2.27 0.00 0.00 179.45 176.68 4aah h LEU 246 N -0.40 0.00 1.88 5.20 4.07 -1.97 -3.46 115.31 120.63 4aah h LEU 246 Ca -0.04 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 57.62 4aah h LEU 246 Cb 0.32 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.02 4aah h LEU 246 CO 0.04 0.10 -0.37 -3.20 -1.08 0.00 0.00 178.44 173.93 4aah n ASN 247 N -3.56 -4.63 -4.66 -0.43 4.05 0.43 -4.97 115.26 101.49 4aah n ASN 247 Ca -0.02 0.06 -0.32 0.00 0.45 0.00 0.00 54.58 54.75 4aah n ASN 247 Cb 0.23 -3.71 -0.09 0.00 1.23 0.00 0.00 39.78 37.44 4aah n ASN 247 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 4aah s LEU 248 N -4.19 3.43 0.06 1.20 1.43 -1.07 -1.56 118.68 117.99 4aah s LEU 248 Ca 0.00 -0.04 0.09 0.00 -1.03 0.00 0.00 54.13 53.15 4aah s LEU 248 Cb 0.00 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 4aah s LEU 248 CO 0.00 0.28 -0.24 0.72 0.23 0.00 0.00 176.35 177.34 4aah s PHE 249 N -1.06 2.08 0.14 0.29 -0.12 -0.25 -1.08 117.98 117.98 4aah s PHE 249 Ca 0.19 -0.39 0.10 0.00 -0.05 0.00 0.00 56.93 56.77 4aah s PHE 249 Cb -0.11 -1.21 -0.04 0.00 -0.63 0.00 0.00 43.02 41.02 4aah s PHE 249 CO 0.09 0.15 -0.23 0.71 -0.05 0.00 0.00 175.22 175.90 4aah s TYR 250 N -0.88 2.08 -0.10 3.49 1.51 -0.57 -1.63 117.35 121.25 4aah s TYR 250 Ca 0.10 -0.40 -0.32 0.00 -1.01 0.00 0.00 57.07 55.44 4aah s TYR 250 Cb -0.10 -1.09 0.12 0.00 -0.11 0.00 0.00 41.96 40.78 4aah s TYR 250 CO 0.03 0.34 1.10 1.52 -1.11 0.00 0.00 175.55 177.43 4aah s TYR 251 N -1.38 -0.19 0.03 2.71 1.13 -1.20 -2.50 117.35 115.94 4aah s TYR 251 Ca 0.14 0.10 0.00 0.00 -1.41 0.00 0.00 57.07 55.90 4aah s TYR 251 Cb -0.09 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.26 4aah s TYR 251 CO 0.06 -0.34 0.13 0.20 -2.51 0.00 0.00 175.55 173.09 4aah s GLY 252 N -2.37 2.08 0.12 5.49 0.00 -1.26 -1.75 107.32 109.63 4aah s GLY 252 Ca 0.08 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 43.95 4aah s GLY 252 CO -0.06 -0.81 0.18 -1.35 0.00 0.00 0.00 173.10 171.06 4aah s SER 253 N -2.11 5.93 0.00 1.64 1.04 -0.74 -4.46 113.70 114.99 4aah s SER 253 Ca 0.28 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.78 4aah s SER 253 Cb -0.12 -1.69 0.00 0.00 0.10 0.00 0.00 66.02 64.30 4aah s SER 253 CO 0.20 0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.14 4aah n GLY 254 N -0.08 -0.54 3.83 7.32 0.00 -0.56 -2.92 105.19 112.25 4aah n GLY 254 Ca -0.07 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 4aah n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4aah s ASN 255 N -1.03 6.90 0.66 1.61 4.22 -1.26 -0.91 114.94 125.13 4aah s ASN 255 Ca 0.00 1.54 -0.12 0.00 -2.14 0.00 0.00 52.86 52.13 4aah s ASN 255 Cb 0.00 -2.48 -0.01 0.00 1.28 0.00 0.00 41.25 40.04 4aah s ASN 255 CO 0.00 -0.27 1.05 -2.16 -2.04 0.00 0.00 177.10 173.68 4aah s PRO 256 N -3.01 3.15 0.07 3.55 0.04 -1.26 -0.84 135.00 136.71 4aah s PRO 256 Ca 0.58 0.98 0.07 0.00 0.04 0.00 0.00 61.00 62.67 4aah s PRO 256 Cb -0.10 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 4aah s PRO 256 CO 0.15 -0.93 -0.14 0.00 0.04 0.00 0.00 177.00 176.12 4aah s ALA 257 N -2.92 2.77 0.98 8.56 0.00 -0.98 -4.55 121.76 125.62 4aah s ALA 257 Ca 0.59 -1.23 -0.08 0.00 0.00 0.00 0.00 51.96 51.24 4aah s ALA 257 Cb -0.14 -0.81 0.12 0.00 0.00 0.00 0.00 23.12 22.29 4aah s ALA 257 CO 0.50 0.60 0.70 -0.35 0.00 0.00 0.00 175.76 177.21 4aah n PRO 258 N 1.13 -0.65 0.23 0.00 -0.04 -1.26 -4.60 135.00 129.80 4aah n PRO 258 Ca -0.15 -1.10 0.10 0.00 -0.04 0.00 0.00 63.50 62.31 4aah n PRO 258 Cb 0.52 -0.71 0.52 0.00 -0.04 0.00 0.00 33.50 33.80 4aah n PRO 258 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 4aah h TRP 259 N -1.38 0.00 -1.25 0.54 4.06 0.10 -3.40 115.95 114.62 4aah h TRP 259 Ca -0.23 0.00 -0.37 0.00 2.06 0.00 0.00 58.89 60.35 4aah h TRP 259 Cb 0.63 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.75 4aah h TRP 259 CO 0.00 0.23 0.99 1.21 -3.56 0.00 0.00 178.44 177.31 4aah s ASN 260 N -6.26 5.10 0.33 -3.49 3.84 -0.96 -4.82 114.94 108.68 4aah s ASN 260 Ca -0.01 -0.15 0.09 0.00 0.21 0.00 0.00 52.86 53.00 4aah s ASN 260 Cb 0.12 -2.54 0.82 0.00 -0.55 0.00 0.00 41.25 39.09 4aah s ASN 260 CO 0.63 -2.66 1.80 1.05 -2.79 0.00 0.00 177.10 175.13 4aah h GLU 261 N 13.24 0.67 0.00 0.43 -0.00 -1.85 -2.26 114.58 124.81 4aah h GLU 261 Ca -0.07 -0.04 0.00 0.00 -0.00 0.00 0.00 59.36 59.25 4aah h GLU 261 Cb 1.08 -0.15 0.00 0.00 -0.00 0.00 0.00 28.75 29.68 4aah h GLU 261 CO 1.20 0.44 0.00 2.41 -0.00 0.00 0.00 179.01 183.06 4aah n THR 262 N -4.69 1.13 1.22 -1.06 -1.04 -1.26 -2.29 114.28 106.29 4aah n THR 262 Ca 0.22 0.34 0.13 0.00 -2.04 0.00 0.00 64.05 62.70 4aah n THR 262 Cb 0.60 -1.20 0.33 0.00 -1.82 0.00 0.00 70.33 68.24 4aah n THR 262 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 4aah n MET 263 N -1.77 0.89 -3.04 -2.82 2.81 -0.85 -4.61 117.12 107.72 4aah n MET 263 Ca 0.02 -0.55 -0.18 0.00 -1.81 0.00 0.00 57.70 55.18 4aah n MET 263 Cb 0.14 -1.49 -0.02 0.00 -0.71 0.00 0.00 33.22 31.14 4aah n MET 263 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 4aah n ARG 264 N -0.57 0.79 -1.09 0.03 1.85 -0.97 -4.96 116.66 111.73 4aah n ARG 264 Ca 0.12 -2.77 -0.35 0.00 -1.00 0.00 0.00 57.85 53.85 4aah n ARG 264 Cb 0.36 -1.34 0.08 0.00 -1.05 0.00 0.00 32.46 30.52 4aah n ARG 264 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 4aah n PRO 265 N 1.22 0.08 0.00 2.89 -0.04 -1.26 -4.80 135.00 133.09 4aah n PRO 265 Ca 0.17 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 4aah n PRO 265 Cb 0.59 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 4aah n PRO 265 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4aah n GLY 266 N 1.73 1.77 0.11 0.55 0.00 -1.26 -4.10 105.19 103.99 4aah n GLY 266 Ca 0.08 -2.15 0.13 0.00 0.00 0.00 0.00 46.02 44.08 4aah n GLY 266 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 4aah n ASP 267 N 0.00 0.85 -3.67 1.61 9.92 -0.46 -4.12 116.55 120.68 4aah n ASP 267 Ca 0.00 0.58 -0.24 0.00 -0.53 0.00 0.00 54.79 54.60 4aah n ASP 267 Cb 0.00 -0.81 0.06 0.00 -0.64 0.00 0.00 41.12 39.73 4aah n ASP 267 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 4aah n ASN 268 N -2.30 -4.58 -4.79 -2.24 3.02 -0.40 -0.98 115.26 102.99 4aah n ASN 268 Ca 0.05 -0.65 -0.35 0.00 -0.03 0.00 0.00 54.58 53.60 4aah n ASN 268 Cb 0.43 -4.61 -0.03 0.00 -0.61 0.00 0.00 39.78 34.96 4aah n ASN 268 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 4aah s LYS 269 N -6.20 3.84 -0.62 3.52 1.02 -1.26 -2.56 119.74 117.47 4aah s LYS 269 Ca 0.44 1.41 0.01 0.00 0.02 0.00 0.00 55.97 57.85 4aah s LYS 269 Cb -0.20 -2.17 0.41 0.00 -0.52 0.00 0.00 37.83 35.35 4aah s LYS 269 CO 0.77 -0.41 1.73 0.91 -0.92 0.00 0.00 175.35 177.43 4aah n TRP 270 N -0.83 3.10 -1.64 3.18 7.02 0.23 -4.42 117.44 124.08 4aah n TRP 270 Ca 0.09 -2.68 -0.29 0.00 -1.02 0.00 0.00 57.50 53.60 4aah n TRP 270 Cb 0.52 -0.95 0.10 0.00 -2.42 0.00 0.00 31.31 28.57 4aah n TRP 270 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 4aah s THR 271 N -4.99 2.50 -1.64 -0.99 -4.23 -1.06 -3.98 115.64 101.26 4aah s THR 271 Ca 0.56 0.16 -0.17 0.00 -1.18 0.00 0.00 61.69 61.06 4aah s THR 271 Cb 0.45 -2.98 0.13 0.00 1.34 0.00 0.00 72.50 71.44 4aah s THR 271 CO -0.16 -0.21 0.86 0.23 -0.54 0.00 0.00 174.62 174.79 4aah n MET 272 N -3.50 -4.06 -4.28 3.99 2.81 -0.09 -4.78 117.12 107.20 4aah n MET 272 Ca 0.07 0.46 -0.19 0.00 -1.81 0.00 0.00 57.70 56.22 4aah n MET 272 Cb 0.58 -5.24 -0.13 0.00 -0.71 0.00 0.00 33.22 27.72 4aah n MET 272 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 4aah s THR 273 N -3.30 1.09 -0.13 2.03 -4.23 -1.24 -0.08 115.64 109.78 4aah s THR 273 Ca 0.70 -1.10 -0.21 0.00 -1.18 0.00 0.00 61.69 59.91 4aah s THR 273 Cb -0.37 -1.02 -0.03 0.00 1.34 0.00 0.00 72.50 72.42 4aah s THR 273 CO 0.89 -0.08 0.60 -0.63 -0.54 0.00 0.00 174.62 174.86 4aah s ILE 274 N -1.00 5.09 0.15 2.99 1.01 0.13 -1.80 121.20 127.77 4aah s ILE 274 Ca 0.00 1.19 0.06 0.00 0.00 0.00 0.00 60.65 61.91 4aah s ILE 274 Cb -0.09 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 4aah s ILE 274 CO 0.02 0.23 0.03 0.26 0.00 0.00 0.00 174.94 175.47 4aah s TRP 275 N 1.11 2.94 -0.39 3.97 0.52 -0.72 -0.38 118.94 126.00 4aah s TRP 275 Ca 0.31 -0.09 0.01 0.00 0.02 0.00 0.00 56.10 56.35 4aah s TRP 275 Cb -0.16 -1.44 0.13 0.00 -1.15 0.00 0.00 33.47 30.84 4aah s TRP 275 CO 0.13 0.51 0.20 0.20 0.02 0.00 0.00 176.95 178.00 4aah s GLY 276 N -2.82 1.33 -0.02 0.98 0.00 -0.59 -3.25 107.32 102.95 4aah s GLY 276 Ca 0.28 -2.18 0.06 0.00 0.00 0.00 0.00 44.72 42.87 4aah s GLY 276 CO 0.19 1.69 -0.20 0.50 0.00 0.00 0.00 173.10 175.29 4aah s ARG 277 N 0.85 2.25 0.08 2.90 0.52 -0.64 0.71 118.95 125.61 4aah s ARG 277 Ca 0.16 -0.85 -0.31 0.00 -0.52 0.00 0.00 55.73 54.21 4aah s ARG 277 Cb -0.22 -2.20 -0.08 0.00 0.52 0.00 0.00 34.95 32.96 4aah s ARG 277 CO -0.06 0.58 1.64 0.34 0.02 0.00 0.00 175.30 177.82 4aah s ASP 278 N -0.83 6.60 0.23 0.23 2.15 -0.83 -1.09 116.67 123.14 4aah s ASP 278 Ca 0.11 2.50 -0.07 0.00 0.43 0.00 0.00 52.55 55.52 4aah s ASP 278 Cb -0.10 -2.57 0.30 0.00 -0.30 0.00 0.00 42.92 40.25 4aah s ASP 278 CO 0.01 -0.88 1.85 0.25 -0.17 0.00 0.00 175.17 176.22 4aah h LEU 279 N 8.38 0.78 -0.21 -1.34 5.85 -1.64 0.48 115.31 127.61 4aah h LEU 279 Ca -0.43 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.21 4aah h LEU 279 Cb 1.20 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 4aah h LEU 279 CO 0.93 0.51 -0.26 0.44 -0.34 0.00 0.00 178.44 179.71 4aah h ASP 280 N 0.92 0.59 0.00 1.25 3.32 -1.90 -3.37 116.42 117.23 4aah h ASP 280 Ca 0.35 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.90 4aah h ASP 280 Cb 0.14 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.53 4aah h ASP 280 CO -0.16 0.97 -1.66 0.35 -1.72 0.00 0.00 179.24 177.02 4aah n THR 281 N -4.37 0.00 -0.97 0.35 -2.24 -1.21 -5.00 114.28 100.85 4aah n THR 281 Ca -0.05 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 4aah n THR 281 Cb 0.45 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 4aah n THR 281 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4aah n GLY 282 N 1.53 0.39 3.72 3.38 0.00 0.17 -4.97 105.19 109.41 4aah n GLY 282 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 4aah n GLY 282 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 4aah s MET 283 N -0.62 4.42 0.10 1.61 -1.94 -1.25 -4.66 119.30 116.96 4aah s MET 283 Ca 0.00 1.87 -0.31 0.00 -1.71 0.00 0.00 55.69 55.54 4aah s MET 283 Cb 0.00 -3.30 -0.07 0.00 2.01 0.00 0.00 34.83 33.47 4aah s MET 283 CO 0.00 -0.25 1.38 0.00 -0.01 0.00 0.00 175.02 176.14 4aah s ALA 284 N 0.78 3.58 -0.15 3.03 0.00 0.17 -1.96 121.76 127.21 4aah s ALA 284 Ca 0.58 1.07 -0.03 0.00 0.00 0.00 0.00 51.96 53.59 4aah s ALA 284 Cb -0.32 -3.54 -0.24 0.00 0.00 0.00 0.00 23.12 19.02 4aah s ALA 284 CO 0.31 -0.65 0.23 1.17 0.00 0.00 0.00 175.76 176.82 4aah n LYS 285 N 4.16 0.73 -3.62 0.00 3.00 0.22 -1.80 118.16 120.85 4aah n LYS 285 Ca 0.12 0.23 -0.11 0.00 -0.00 0.00 0.00 58.31 58.55 4aah n LYS 285 Cb 0.43 -1.66 -0.04 0.00 0.00 0.00 0.00 35.03 33.75 4aah n LYS 285 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.40 179.07 4aah s TRP 286 N -2.55 -0.22 -0.29 5.64 1.48 -1.12 -2.44 118.94 119.44 4aah s TRP 286 Ca -0.25 -0.09 -0.15 0.00 -1.06 0.00 0.00 56.10 54.56 4aah s TRP 286 Cb 0.07 0.28 0.11 0.00 -1.16 0.00 0.00 33.47 32.77 4aah s TRP 286 CO 0.73 -0.71 0.76 0.20 -4.06 0.00 0.00 176.95 173.87 4aah s GLY 287 N -2.80 -0.50 -0.15 3.67 0.00 -1.26 -1.54 107.32 104.74 4aah s GLY 287 Ca 0.03 2.59 0.00 0.00 0.00 0.00 0.00 44.72 47.35 4aah s GLY 287 CO -0.12 2.65 -0.14 -0.47 0.00 0.00 0.00 173.10 175.02 4aah s TYR 288 N 1.92 2.21 -0.36 1.90 5.04 0.49 -4.90 117.35 123.65 4aah s TYR 288 Ca -0.08 -1.26 -0.28 0.00 -2.44 0.00 0.00 57.07 53.00 4aah s TYR 288 Cb -0.06 -1.61 0.02 0.00 0.35 0.00 0.00 41.96 40.66 4aah s TYR 288 CO -0.19 -0.68 1.06 -1.14 -1.34 0.00 0.00 175.55 173.26 4aah s GLN 289 N 1.48 3.97 0.10 4.97 0.74 -1.26 -0.69 119.66 128.96 4aah s GLN 289 Ca 0.05 0.89 -0.03 0.00 0.05 0.00 0.00 55.36 56.32 4aah s GLN 289 Cb -0.13 -3.78 -0.19 0.00 1.10 0.00 0.00 33.01 30.01 4aah s GLN 289 CO -0.11 -0.99 1.22 0.87 -0.55 0.00 0.00 175.29 175.74 4aah h LYS 290 N 8.36 0.30 -2.80 1.67 1.57 -0.80 -3.41 116.57 121.46 4aah h LYS 290 Ca -0.21 -0.42 -0.60 0.00 -1.87 0.00 0.00 60.65 57.55 4aah h LYS 290 Cb 1.06 0.14 -0.40 0.00 0.08 0.00 0.00 32.23 33.12 4aah h LYS 290 CO 1.04 1.15 -0.79 0.99 -0.57 0.00 0.00 179.45 181.27 4aah s THR 291 N -2.91 0.79 0.34 -0.16 2.01 -1.24 -4.66 115.64 109.80 4aah s THR 291 Ca -0.04 -2.13 -0.28 0.00 0.31 0.00 0.00 61.69 59.55 4aah s THR 291 Cb 0.08 -1.56 -0.10 0.00 0.01 0.00 0.00 72.50 70.93 4aah s THR 291 CO 0.87 -0.94 1.21 -2.84 -0.69 0.00 0.00 174.62 172.23 4aah s PRO 292 N 0.72 4.34 -0.91 4.92 0.02 -1.26 -3.70 135.00 139.13 4aah s PRO 292 Ca 0.18 2.00 -0.08 0.00 0.02 0.00 0.00 61.00 63.12 4aah s PRO 292 Cb -0.24 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.30 4aah s PRO 292 CO 0.01 -0.12 0.68 1.58 -0.33 0.00 0.00 177.00 178.81 4aah n HIS 293 N 0.68 -2.18 -1.71 6.54 -0.00 -0.15 -4.88 115.22 113.52 4aah n HIS 293 Ca 0.01 0.76 -0.41 0.00 -0.00 0.00 0.00 57.72 58.08 4aah n HIS 293 Cb 0.44 -3.24 0.02 0.00 -0.00 0.00 0.00 29.99 27.20 4aah n HIS 293 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 4aah n ASP 294 N -2.39 2.57 0.00 0.26 2.03 -1.24 -4.91 116.55 112.87 4aah n ASP 294 Ca -0.17 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.22 4aah n ASP 294 Cb 0.61 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.50 4aah n ASP 294 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 4aah n GLU 295 N -0.10 -0.13 0.00 -0.67 1.02 -1.26 -4.72 120.64 114.78 4aah n GLU 295 Ca 0.07 -0.30 0.00 0.00 -0.02 0.00 0.00 57.16 56.91 4aah n GLU 295 Cb 0.40 -0.69 0.00 0.00 -0.02 0.00 0.00 31.44 31.14 4aah n GLU 295 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 4aah n TRP 296 N -0.03 0.00 -2.94 -0.32 8.01 -1.26 -4.54 117.44 116.36 4aah n TRP 296 Ca 0.00 -0.09 -0.11 0.00 -1.31 0.00 0.00 57.50 55.99 4aah n TRP 296 Cb 0.20 -0.01 0.06 0.00 -2.01 0.00 0.00 31.31 29.55 4aah n TRP 296 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 4aah n ASP 297 N -0.09 -2.40 -2.76 -0.99 2.03 -1.26 -4.16 116.55 106.93 4aah n ASP 297 Ca 0.00 -0.43 -0.33 0.00 0.52 0.00 0.00 54.79 54.55 4aah n ASP 297 Cb 0.27 -3.65 -0.02 0.00 -0.72 0.00 0.00 41.12 37.00 4aah n ASP 297 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 4aah n PHE 298 N -3.07 2.16 -1.30 -0.67 3.72 -1.26 -4.75 117.46 112.28 4aah n PHE 298 Ca -0.18 -2.16 -0.54 0.00 -0.05 0.00 0.00 57.45 54.53 4aah n PHE 298 Cb 0.61 -1.35 -0.09 0.00 -0.94 0.00 0.00 39.48 37.72 4aah n PHE 298 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 4aah n ALA 299 N 0.45 -0.67 -1.19 4.37 0.00 -1.26 -4.59 120.51 117.62 4aah n ALA 299 Ca 0.51 0.32 -0.20 0.00 0.00 0.00 0.00 53.44 54.08 4aah n ALA 299 Cb 0.41 -1.64 -0.12 0.00 0.00 0.00 0.00 19.45 18.11 4aah n ALA 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4aah n GLY 300 N 4.33 3.56 0.01 0.00 0.00 -1.17 -4.47 105.19 107.44 4aah n GLY 300 Ca 0.33 -1.44 0.11 0.00 0.00 0.00 0.00 46.02 45.02 4aah n GLY 300 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 4aah n VAL 301 N 2.22 0.04 -1.09 1.61 0.24 -1.26 -3.19 118.33 116.91 4aah n VAL 301 Ca 0.49 -0.09 -0.37 0.00 -2.04 0.00 0.00 64.34 62.34 4aah n VAL 301 Cb 0.72 0.56 0.04 0.00 -1.47 0.00 0.00 33.84 33.69 4aah n VAL 301 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 4aah n ASN 302 N -1.66 -4.75 -4.54 -1.34 3.02 -1.26 -3.13 115.26 101.60 4aah n ASN 302 Ca 0.03 0.37 -0.41 0.00 -0.03 0.00 0.00 54.58 54.54 4aah n ASN 302 Cb 0.37 -0.84 0.01 0.00 -0.61 0.00 0.00 39.78 38.71 4aah n ASN 302 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 4aah n GLN 303 N 1.74 0.97 -4.14 3.52 7.27 -1.26 -4.53 117.38 120.94 4aah n GLN 303 Ca 0.02 0.35 -0.35 0.00 0.07 0.00 0.00 57.00 57.10 4aah n GLN 303 Cb 0.53 -1.81 -0.13 0.00 2.41 0.00 0.00 30.24 31.24 4aah n GLN 303 CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 4aah s MET 304 N -1.87 3.57 -0.21 3.69 -1.94 -1.26 -4.43 119.30 116.86 4aah s MET 304 Ca 0.64 -0.55 -0.01 0.00 -1.71 0.00 0.00 55.69 54.06 4aah s MET 304 Cb -0.57 -3.02 0.01 0.00 2.01 0.00 0.00 34.83 33.26 4aah s MET 304 CO 0.57 0.03 -0.12 0.08 -0.01 0.00 0.00 175.02 175.57 4aah s VAL 305 N 0.94 2.69 -0.23 -6.03 1.01 0.01 -4.62 120.40 114.17 4aah s VAL 305 Ca 0.01 -0.79 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 4aah s VAL 305 Cb -0.14 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 4aah s VAL 305 CO 0.01 0.44 0.25 -0.76 0.00 0.00 0.00 175.10 175.04 4aah s LEU 306 N 1.37 4.12 0.18 3.92 1.43 -0.80 -0.14 118.68 128.76 4aah s LEU 306 Ca 0.04 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.42 4aah s LEU 306 Cb -0.14 -2.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.78 4aah s LEU 306 CO -0.08 0.01 -0.02 0.42 0.23 0.00 0.00 176.35 176.91 4aah s THR 307 N 1.19 0.88 -0.32 5.49 -4.23 -0.87 -4.81 115.64 112.97 4aah s THR 307 Ca 0.12 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.65 4aah s THR 307 Cb -0.14 -2.12 0.09 0.00 1.34 0.00 0.00 72.50 71.67 4aah s THR 307 CO 0.06 -0.50 0.00 -1.81 -0.54 0.00 0.00 174.62 171.83 4aah s ASP 308 N -3.21 4.69 0.03 3.99 1.01 -1.26 -1.10 116.67 120.82 4aah s ASP 308 Ca 0.23 -1.87 -0.01 0.00 0.71 0.00 0.00 52.55 51.61 4aah s ASP 308 Cb 0.05 -1.61 -0.02 0.00 1.01 0.00 0.00 42.92 42.34 4aah s ASP 308 CO 0.04 -0.32 -0.02 -1.10 0.21 0.00 0.00 175.17 173.99 4aah s GLN 309 N 0.99 0.42 0.03 8.23 -0.21 -0.92 -4.93 119.66 123.26 4aah s GLN 309 Ca 0.04 -0.79 -0.30 0.00 0.02 0.00 0.00 55.36 54.32 4aah s GLN 309 Cb -0.20 0.15 -0.06 0.00 1.00 0.00 0.00 33.01 33.90 4aah s GLN 309 CO -0.07 -0.07 1.42 -1.25 -2.12 0.00 0.00 175.29 173.20 4aah s PRO 310 N -2.23 4.28 -0.23 2.91 0.04 -1.25 -0.15 135.00 138.37 4aah s PRO 310 Ca -0.09 2.01 0.00 0.00 0.04 0.00 0.00 61.00 62.97 4aah s PRO 310 Cb -0.04 -3.52 0.06 0.00 0.04 0.00 0.00 34.50 31.04 4aah s PRO 310 CO -0.04 -0.56 -0.04 0.08 0.04 0.00 0.00 177.00 176.48 4aah s VAL 311 N 2.18 1.34 -0.93 -0.36 1.01 0.57 -4.59 120.40 119.62 4aah s VAL 311 Ca 0.65 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 4aah s VAL 311 Cb -0.33 -1.65 0.00 0.00 0.00 0.00 0.00 36.38 34.40 4aah s VAL 311 CO 0.28 -0.12 0.37 0.59 0.00 0.00 0.00 175.10 176.22 4aah n ASN 312 N 4.74 -4.30 -0.16 3.32 3.02 -1.26 -2.07 115.26 118.55 4aah n ASN 312 Ca -0.11 -0.18 -0.02 0.00 -0.03 0.00 0.00 54.58 54.24 4aah n ASN 312 Cb 0.45 -3.17 -0.01 0.00 -0.61 0.00 0.00 39.78 36.43 4aah n ASN 312 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4aah n GLY 313 N -1.22 0.45 3.49 7.41 0.00 -1.26 -5.00 105.19 109.06 4aah n GLY 313 Ca -0.07 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 4aah n GLY 313 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4aah s LYS 314 N -1.36 2.01 -0.22 1.61 -2.85 -0.88 -5.00 119.74 113.04 4aah s LYS 314 Ca 0.00 -1.04 -0.29 0.00 -1.00 0.00 0.00 55.97 53.64 4aah s LYS 314 Cb 0.00 -2.19 -0.00 0.00 -2.06 0.00 0.00 37.83 33.57 4aah s LYS 314 CO 0.00 0.52 1.19 1.41 0.10 0.00 0.00 175.35 178.57 4aah s MET 315 N -1.78 4.16 0.03 1.78 -2.45 -1.26 0.21 119.30 119.99 4aah s MET 315 Ca 0.17 1.44 0.05 0.00 -1.25 0.00 0.00 55.69 56.09 4aah s MET 315 Cb -0.11 -3.75 -0.02 0.00 1.25 0.00 0.00 34.83 32.21 4aah s MET 315 CO 0.08 -0.78 -0.14 -0.08 1.05 0.00 0.00 175.02 175.15 4aah s THR 316 N 3.59 1.14 -0.71 10.11 -1.32 0.78 -4.93 115.64 124.31 4aah s THR 316 Ca 0.51 -0.90 -0.27 0.00 -1.21 0.00 0.00 61.69 59.82 4aah s THR 316 Cb -0.18 -1.01 0.02 0.00 -1.51 0.00 0.00 72.50 69.83 4aah s THR 316 CO 0.14 0.10 1.35 -2.16 -2.21 0.00 0.00 174.62 171.85 4aah s PRO 317 N -0.91 3.14 0.27 7.08 0.04 -1.26 -2.18 135.00 141.18 4aah s PRO 317 Ca 0.03 -0.08 0.02 0.00 0.04 0.00 0.00 61.00 61.02 4aah s PRO 317 Cb -0.07 -4.19 -0.03 0.00 0.04 0.00 0.00 34.50 30.24 4aah s PRO 317 CO 0.01 -2.19 0.43 -0.51 0.04 0.00 0.00 177.00 174.78 4aah s LEU 318 N 6.13 4.19 -0.05 -3.56 1.43 -0.26 -0.42 118.68 126.15 4aah s LEU 318 Ca 0.40 0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.81 4aah s LEU 318 Cb -0.09 -3.09 0.01 0.00 0.03 0.00 0.00 46.19 43.05 4aah s LEU 318 CO 0.17 -0.14 -0.12 -0.22 0.23 0.00 0.00 176.35 176.27 4aah s LEU 319 N -3.94 1.72 0.12 1.79 0.20 -0.61 -2.05 118.68 115.91 4aah s LEU 319 Ca 0.37 -0.27 0.06 0.00 0.69 0.00 0.00 54.13 54.98 4aah s LEU 319 Cb -0.10 -0.76 -0.04 0.00 -0.43 0.00 0.00 46.19 44.87 4aah s LEU 319 CO 0.31 0.06 -0.14 -0.44 -0.29 0.00 0.00 176.35 175.86 4aah s SER 320 N 0.41 1.99 -0.29 3.68 0.01 0.80 -1.29 113.70 119.00 4aah s SER 320 Ca -0.09 -0.79 -0.21 0.00 1.31 0.00 0.00 55.95 56.17 4aah s SER 320 Cb -0.13 -0.07 0.17 0.00 0.21 0.00 0.00 66.02 66.20 4aah s SER 320 CO 0.02 -0.13 1.21 -2.28 0.41 0.00 0.00 173.24 172.47 4aah s HIS 321 N -2.02 -0.26 -0.31 2.43 5.04 -0.68 -0.81 115.29 118.68 4aah s HIS 321 Ca 0.08 0.57 -0.09 0.00 -1.54 0.00 0.00 55.06 54.08 4aah s HIS 321 Cb -0.06 0.32 0.00 0.00 0.04 0.00 0.00 32.58 32.89 4aah s HIS 321 CO 0.03 -0.13 0.13 0.42 -2.34 0.00 0.00 174.74 172.85 4aah s ILE 322 N 0.58 4.35 0.57 0.89 1.01 -1.26 -0.61 121.20 126.73 4aah s ILE 322 Ca -0.01 -0.57 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 4aah s ILE 322 Cb -0.04 -3.24 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 4aah s ILE 322 CO -0.12 0.05 0.90 -0.62 0.00 0.00 0.00 174.94 175.14 4aah s ASP 323 N 1.56 5.84 0.53 3.58 2.15 -0.77 -4.75 116.67 124.81 4aah s ASP 323 Ca 0.04 0.89 0.18 0.00 0.43 0.00 0.00 52.55 54.08 4aah s ASP 323 Cb -0.17 -1.96 1.32 0.00 -0.30 0.00 0.00 42.92 41.81 4aah s ASP 323 CO 0.05 -0.93 2.15 0.03 -0.17 0.00 0.00 175.17 176.30 4aah h ARG 324 N -0.12 0.00 0.00 4.34 3.08 -1.81 -1.48 114.38 118.39 4aah h ARG 324 Ca -0.46 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 4aah h ARG 324 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 4aah h ARG 324 CO 0.61 0.00 -0.02 -2.95 -1.07 0.00 0.00 179.97 176.55 4aah h ASN 325 N 0.00 0.00 0.00 7.04 7.08 -1.88 -2.57 115.58 125.25 4aah h ASN 325 Ca 0.01 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.23 4aah h ASN 325 Cb 0.05 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.29 4aah h ASN 325 CO -0.00 0.02 0.00 0.61 -2.08 0.00 0.00 177.43 175.98 4aah n GLY 326 N -0.52 1.07 3.51 9.14 0.00 -0.56 -4.38 105.19 113.45 4aah n GLY 326 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 4aah n GLY 326 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4aah s ILE 327 N -2.00 3.66 -0.18 -0.61 -1.09 -1.26 0.19 121.20 119.92 4aah s ILE 327 Ca 0.00 -0.46 -0.22 0.00 -2.23 0.00 0.00 60.65 57.74 4aah s ILE 327 Cb 0.00 -2.55 -0.02 0.00 -1.58 0.00 0.00 42.46 38.30 4aah s ILE 327 CO 0.00 0.54 0.68 -0.22 -1.23 0.00 0.00 174.94 174.71 4aah s LEU 328 N -0.09 4.17 -0.11 2.97 2.96 0.30 -1.84 118.68 127.03 4aah s LEU 328 Ca 0.01 0.94 -0.00 0.00 -0.22 0.00 0.00 54.13 54.86 4aah s LEU 328 Cb -0.13 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 4aah s LEU 328 CO 0.03 -0.29 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.37 4aah s TYR 329 N 1.86 2.88 -0.11 5.38 2.02 0.22 -1.48 117.35 128.12 4aah s TYR 329 Ca 0.32 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.69 4aah s TYR 329 Cb -0.16 -1.81 0.02 0.00 -0.40 0.00 0.00 41.96 39.61 4aah s TYR 329 CO 0.11 0.02 -0.12 0.99 -1.57 0.00 0.00 175.55 174.98 4aah s THR 330 N -0.08 1.28 0.34 -0.71 2.01 0.36 -1.69 115.64 117.15 4aah s THR 330 Ca -0.01 -0.48 0.06 0.00 0.31 0.00 0.00 61.69 61.57 4aah s THR 330 Cb -0.14 -1.22 -0.07 0.00 0.01 0.00 0.00 72.50 71.09 4aah s THR 330 CO 0.03 0.40 0.01 -0.76 -0.69 0.00 0.00 174.62 173.62 4aah s LEU 331 N 1.32 2.48 -0.15 4.42 1.43 -0.41 0.10 118.68 127.87 4aah s LEU 331 Ca -0.01 -1.32 -0.18 0.00 -1.03 0.00 0.00 54.13 51.59 4aah s LEU 331 Cb -0.14 -0.62 -0.04 0.00 0.03 0.00 0.00 46.19 45.42 4aah s LEU 331 CO -0.05 -0.48 0.49 0.21 0.23 0.00 0.00 176.35 176.74 4aah s ASN 332 N -3.55 6.64 0.00 2.29 3.84 0.64 -1.58 114.94 123.23 4aah s ASN 332 Ca 0.34 0.76 0.22 0.00 0.21 0.00 0.00 52.86 54.39 4aah s ASN 332 Cb 0.08 -2.29 0.97 0.00 -0.55 0.00 0.00 41.25 39.46 4aah s ASN 332 CO 0.15 -0.05 1.70 -2.11 -2.79 0.00 0.00 177.10 174.00 4aah n ARG 333 N 4.03 0.08 -0.00 0.43 1.85 0.44 -1.33 116.66 122.15 4aah n ARG 333 Ca -0.06 0.12 -0.02 0.00 -1.00 0.00 0.00 57.85 56.89 4aah n ARG 333 Cb 0.51 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 30.41 4aah n ARG 333 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 4aah h GLU 334 N 0.00 -0.11 -0.01 2.89 4.81 -1.92 -3.42 114.58 116.83 4aah h GLU 334 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 4aah h GLU 334 Cb 0.33 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.74 4aah h GLU 334 CO 0.00 -0.07 -0.13 0.27 -0.73 0.00 0.00 179.01 178.35 4aah n ASN 335 N -4.83 1.07 0.00 1.04 2.04 -1.25 -4.93 115.26 108.40 4aah n ASN 335 Ca -0.01 -1.03 0.00 0.00 -0.44 0.00 0.00 54.58 53.09 4aah n ASN 335 Cb 0.04 0.42 0.00 0.00 -2.53 0.00 0.00 39.78 37.72 4aah n ASN 335 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 4aah n GLY 336 N 0.73 0.74 3.75 4.83 0.00 -0.44 -4.74 105.19 110.06 4aah n GLY 336 Ca 0.03 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.01 4aah n GLY 336 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4aah s ASN 337 N -2.62 7.12 -0.25 1.61 0.01 -1.23 -4.68 114.94 114.90 4aah s ASN 337 Ca 0.00 2.34 -0.29 0.00 -0.71 0.00 0.00 52.86 54.20 4aah s ASN 337 Cb 0.00 -2.63 -0.01 0.00 0.41 0.00 0.00 41.25 39.03 4aah s ASN 337 CO 0.00 -0.28 1.36 -0.22 -1.51 0.00 0.00 177.10 176.45 4aah s LEU 338 N -1.17 3.95 -0.13 0.60 1.98 -1.26 -0.26 118.68 122.40 4aah s LEU 338 Ca 0.48 1.40 -0.02 0.00 -2.89 0.00 0.00 54.13 53.10 4aah s LEU 338 Cb -0.34 -3.54 -0.07 0.00 0.66 0.00 0.00 46.19 42.90 4aah s LEU 338 CO 0.42 -1.05 -0.14 -0.38 -1.89 0.00 0.00 176.35 173.32 4aah n ILE 339 N 6.06 0.72 -4.11 6.68 5.41 0.29 -4.97 119.36 129.44 4aah n ILE 339 Ca 0.15 -0.24 -0.15 0.00 1.00 0.00 0.00 62.75 63.52 4aah n ILE 339 Cb 0.46 -1.24 -0.13 0.00 -0.71 0.00 0.00 39.64 38.02 4aah n ILE 339 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 4aah s VAL 340 N -2.25 0.44 -0.49 1.39 1.01 0.81 -4.94 120.40 116.38 4aah s VAL 340 Ca -0.18 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.32 4aah s VAL 340 Cb 0.05 -0.43 0.21 0.00 0.00 0.00 0.00 36.38 36.21 4aah s VAL 340 CO 0.27 -0.09 0.71 0.00 0.00 0.00 0.00 175.10 175.99 4aah n ALA 341 N 2.37 -0.79 -2.55 5.51 0.00 -1.23 -0.49 120.51 123.32 4aah n ALA 341 Ca -0.17 -1.60 -0.28 0.00 0.00 0.00 0.00 53.44 51.39 4aah n ALA 341 Cb 0.57 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.62 4aah n ALA 341 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 4aah s GLU 342 N 0.55 2.00 0.17 0.00 0.41 -0.55 -4.50 118.70 116.78 4aah s GLU 342 Ca 0.31 -1.18 -0.31 0.00 -0.41 0.00 0.00 54.97 53.39 4aah s GLU 342 Cb 0.09 -2.19 -0.09 0.00 -1.78 0.00 0.00 34.13 30.17 4aah s GLU 342 CO -0.14 0.47 1.41 0.15 -0.49 0.00 0.00 175.26 176.66 4aah s LYS 343 N -2.48 4.31 0.42 1.61 1.02 -1.26 0.11 119.74 123.47 4aah s LYS 343 Ca 0.22 2.15 0.23 0.00 0.02 0.00 0.00 55.97 58.60 4aah s LYS 343 Cb -0.10 -3.20 0.68 0.00 -0.52 0.00 0.00 37.83 34.69 4aah s LYS 343 CO 0.13 -0.41 1.72 -0.39 -0.92 0.00 0.00 175.35 175.48 4aah h VAL 344 N 3.97 0.44 -2.76 3.17 -1.51 -0.60 -3.44 116.25 115.51 4aah h VAL 344 Ca -0.43 -1.26 -0.12 0.00 -1.23 0.00 0.00 66.70 63.65 4aah h VAL 344 Cb 1.21 1.92 -0.25 0.00 -2.13 0.00 0.00 31.29 32.05 4aah h VAL 344 CO 0.83 0.21 -0.26 -0.62 -1.23 0.00 0.00 177.57 176.50 4aah s ASP 345 N -6.18 -0.43 0.36 4.19 -1.08 -1.26 -5.03 116.67 107.23 4aah s ASP 345 Ca 0.03 0.81 0.23 0.00 -0.52 0.00 0.00 52.55 53.10 4aah s ASP 345 Cb 0.08 0.80 1.24 0.00 -1.46 0.00 0.00 42.92 43.58 4aah s ASP 345 CO 0.65 -0.15 1.69 1.55 0.52 0.00 0.00 175.17 179.43 4aah h PRO 346 N 5.78 0.00 0.00 4.34 0.13 -1.98 -1.58 132.00 138.70 4aah h PRO 346 Ca -0.28 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 4aah h PRO 346 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 4aah h PRO 346 CO 0.26 0.00 -0.05 0.00 -0.23 0.00 0.00 178.00 177.98 4aah h ALA 347 N 1.90 1.06 -2.44 -0.56 0.00 -1.98 -3.44 119.26 113.80 4aah h ALA 347 Ca 0.00 -0.04 -0.53 0.00 0.00 0.00 0.00 54.91 54.33 4aah h ALA 347 Cb 0.07 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 17.89 4aah h ALA 347 CO 0.00 0.06 1.13 0.28 0.00 0.00 0.00 179.25 180.72 4aah n VAL 348 N -3.23 0.45 -0.65 0.00 0.31 -0.60 -4.67 118.33 109.95 4aah n VAL 348 Ca -0.01 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 4aah n VAL 348 Cb 0.26 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 31.04 4aah n VAL 348 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 4aah n ASN 349 N 6.04 0.59 0.07 4.52 0.23 -0.36 -4.81 115.26 121.54 4aah n ASN 349 Ca 0.19 -1.23 -0.02 0.00 -0.53 0.00 0.00 54.58 52.98 4aah n ASN 349 Cb 0.38 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.31 4aah n ASN 349 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 4aah h VAL 350 N 1.52 1.28 -4.42 3.53 -1.51 -1.80 -3.44 116.25 111.41 4aah h VAL 350 Ca 0.00 -1.37 -0.70 0.00 -1.23 0.00 0.00 66.70 63.41 4aah h VAL 350 Cb 0.66 1.53 -0.28 0.00 -2.13 0.00 0.00 31.29 31.07 4aah h VAL 350 CO 0.00 0.42 -0.88 -0.36 -1.23 0.00 0.00 177.57 175.52 4aah s PHE 351 N -4.31 2.36 0.16 5.19 0.08 -1.26 -1.15 117.98 119.05 4aah s PHE 351 Ca -0.05 -0.41 -0.09 0.00 0.12 0.00 0.00 56.93 56.50 4aah s PHE 351 Cb 0.14 -1.46 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 4aah s PHE 351 CO 0.77 0.06 1.53 0.87 -0.10 0.00 0.00 175.22 178.35 4aah h LYS 352 N 5.14 0.94 0.00 0.44 1.57 0.43 -3.47 116.57 121.63 4aah h LYS 352 Ca -0.45 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 57.89 4aah h LYS 352 Cb 1.13 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.43 4aah h LYS 352 CO 0.46 1.10 0.00 0.36 -0.57 0.00 0.00 179.45 180.80 4aah n LYS 353 N -4.08 -2.99 -3.99 3.15 -0.00 -1.25 -5.01 118.16 103.99 4aah n LYS 353 Ca -0.01 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 57.96 4aah n LYS 353 Cb 0.50 0.00 -0.15 0.00 -0.00 0.00 0.00 35.03 35.38 4aah n LYS 353 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 4aah s VAL 354 N -2.00 2.82 -0.31 0.58 0.11 -1.26 0.23 120.40 120.57 4aah s VAL 354 Ca 0.00 -0.71 -0.29 0.00 -2.93 0.00 0.00 61.98 58.05 4aah s VAL 354 Cb 0.00 -2.26 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 4aah s VAL 354 CO 0.00 0.45 1.27 -0.62 -3.33 0.00 0.00 175.10 172.87 4aah s ASP 355 N 1.39 6.70 0.53 3.54 -1.08 -0.44 -4.89 116.67 122.42 4aah s ASP 355 Ca 0.05 1.17 0.30 0.00 -0.52 0.00 0.00 52.55 53.55 4aah s ASP 355 Cb -0.14 -2.54 1.46 0.00 -1.46 0.00 0.00 42.92 40.24 4aah s ASP 355 CO -0.07 -1.06 2.05 -0.07 0.52 0.00 0.00 175.17 176.54 4aah h LEU 356 N 10.79 0.00 0.05 -1.34 3.38 -1.95 0.39 115.31 126.63 4aah h LEU 356 Ca -0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 4aah h LEU 356 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 4aah h LEU 356 CO 1.04 0.11 -0.03 0.11 0.09 0.00 0.00 178.44 179.76 4aah h LYS 357 N 0.00 -0.07 0.00 1.13 1.57 -1.96 -3.34 116.57 113.89 4aah h LYS 357 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 4aah h LYS 357 Cb 0.39 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.72 4aah h LYS 357 CO 0.01 0.47 0.00 1.79 -0.57 0.00 0.00 179.45 181.16 4aah h THR 358 N -0.94 0.00 -1.49 -0.16 1.35 -1.95 -3.47 112.91 106.25 4aah h THR 358 Ca -0.01 -0.73 -0.26 0.00 -0.55 0.00 0.00 66.41 64.86 4aah h THR 358 Cb 0.58 1.72 -0.04 0.00 -1.73 0.00 0.00 68.15 68.67 4aah h THR 358 CO 0.01 0.00 -0.31 0.61 -0.25 0.00 0.00 175.52 175.58 4aah n GLY 359 N 0.98 0.30 3.24 5.82 0.00 0.13 -4.87 105.19 110.80 4aah n GLY 359 Ca 0.04 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 4aah n GLY 359 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4aah s THR 360 N -2.60 1.69 0.14 2.61 2.01 -1.03 -4.92 115.64 113.53 4aah s THR 360 Ca 0.00 -1.01 -0.31 0.00 0.31 0.00 0.00 61.69 60.68 4aah s THR 360 Cb 0.00 -1.42 -0.09 0.00 0.01 0.00 0.00 72.50 71.00 4aah s THR 360 CO 0.00 0.39 1.42 -2.16 -0.69 0.00 0.00 174.62 173.58 4aah s PRO 361 N -0.73 4.30 -0.87 4.92 0.04 -1.26 -1.32 135.00 140.08 4aah s PRO 361 Ca 0.08 2.14 -0.19 0.00 0.04 0.00 0.00 61.00 63.07 4aah s PRO 361 Cb -0.08 -3.22 0.12 0.00 0.04 0.00 0.00 34.50 31.36 4aah s PRO 361 CO 0.00 -0.46 1.08 0.08 0.04 0.00 0.00 177.00 177.74 4aah s VAL 362 N 0.98 4.67 0.51 -0.36 1.01 0.14 -4.93 120.40 122.41 4aah s VAL 362 Ca 0.65 -1.34 -0.23 0.00 0.00 0.00 0.00 61.98 61.06 4aah s VAL 362 Cb -0.39 -4.75 -0.07 0.00 0.00 0.00 0.00 36.38 31.18 4aah s VAL 362 CO 0.32 -1.48 1.27 0.54 0.00 0.00 0.00 175.10 175.75 4aah n ARG 363 N 6.73 1.67 -4.01 2.72 1.74 -1.26 0.10 116.66 124.36 4aah n ARG 363 Ca 0.17 0.61 -0.34 0.00 -0.77 0.00 0.00 57.85 57.53 4aah n ARG 363 Cb 0.48 -2.45 -0.15 0.00 -1.02 0.00 0.00 32.46 29.33 4aah n ARG 363 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 4aah s ASP 364 N -0.81 4.27 0.52 0.55 -1.08 -0.30 -4.68 116.67 115.14 4aah s ASP 364 Ca 0.68 -1.05 0.17 0.00 -0.52 0.00 0.00 52.55 51.83 4aah s ASP 364 Cb -0.45 -1.61 1.30 0.00 -1.46 0.00 0.00 42.92 40.70 4aah s ASP 364 CO 0.52 -0.15 2.15 -0.65 0.52 0.00 0.00 175.17 177.57 4aah h PRO 365 N 7.93 0.00 0.00 4.34 0.11 -1.95 -2.17 132.00 140.27 4aah h PRO 365 Ca -0.29 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 4aah h PRO 365 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 4aah h PRO 365 CO 0.54 0.00 -0.15 1.49 -0.21 0.00 0.00 178.00 179.67 4aah h GLU 366 N 0.00 0.00 -0.36 1.05 4.81 -1.94 -2.87 114.58 115.27 4aah h GLU 366 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 4aah h GLU 366 Cb 0.01 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.29 4aah h GLU 366 CO -0.00 0.15 -0.04 1.19 -0.73 0.00 0.00 179.01 179.58 4aah n PHE 367 N -3.75 1.13 -2.96 0.92 3.72 -0.82 -4.77 117.46 110.93 4aah n PHE 367 Ca -0.02 -1.53 -0.19 0.00 -0.05 0.00 0.00 57.45 55.66 4aah n PHE 367 Cb 0.26 -0.49 0.05 0.00 -0.94 0.00 0.00 39.48 38.37 4aah n PHE 367 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 4aah s ALA 368 N -3.20 4.52 0.00 4.37 0.00 -1.09 -4.77 121.76 121.60 4aah s ALA 368 Ca 0.45 -1.93 0.05 0.00 0.00 0.00 0.00 51.96 50.53 4aah s ALA 368 Cb 0.40 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 4aah s ALA 368 CO 0.01 -0.75 -0.17 0.95 0.00 0.00 0.00 175.76 175.80 4aah s THR 369 N -2.63 1.33 0.17 0.00 -4.23 -1.26 -4.66 115.64 104.36 4aah s THR 369 Ca 0.60 -0.83 -0.21 0.00 -1.18 0.00 0.00 61.69 60.07 4aah s THR 369 Cb -0.07 -1.13 0.06 0.00 1.34 0.00 0.00 72.50 72.70 4aah s THR 369 CO 0.38 0.28 0.58 0.00 -0.54 0.00 0.00 174.62 175.32 4aah s ARG 370 N -0.63 1.32 0.96 3.99 1.70 -1.26 -4.83 118.95 120.19 4aah s ARG 370 Ca 0.06 -0.60 -0.11 0.00 -0.47 0.00 0.00 55.73 54.61 4aah s ARG 370 Cb -0.07 0.57 0.14 0.00 -0.57 0.00 0.00 34.95 35.02 4aah s ARG 370 CO 0.00 -0.57 0.95 -1.33 -1.08 0.00 0.00 175.30 173.27 4aah n MET 371 N -0.37 -0.67 -1.44 3.89 2.81 -1.26 -2.87 117.12 117.22 4aah n MET 371 Ca -0.15 -0.14 -0.09 0.00 -1.81 0.00 0.00 57.70 55.51 4aah n MET 371 Cb 0.64 -2.23 -0.03 0.00 -0.71 0.00 0.00 33.22 30.88 4aah n MET 371 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 4aah n ASP 372 N -3.66 -2.50 -3.74 7.83 8.00 -1.26 -4.90 116.55 116.32 4aah n ASP 372 Ca 0.10 0.23 -0.13 0.00 0.71 0.00 0.00 54.79 55.70 4aah n ASP 372 Cb 0.53 -2.44 -0.14 0.00 -0.02 0.00 0.00 41.12 39.05 4aah n ASP 372 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 4aah s HIS 373 N -1.87 -0.25 -0.37 1.24 2.46 -1.14 -5.11 115.29 110.25 4aah s HIS 373 Ca 0.00 0.64 -0.15 0.00 0.47 0.00 0.00 55.06 56.02 4aah s HIS 373 Cb 0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 32.58 32.43 4aah s HIS 373 CO 0.00 -0.20 0.34 0.21 -2.47 0.00 0.00 174.74 172.62 4aah s LYS 374 N 1.21 3.37 0.31 2.88 2.20 -1.26 -4.45 119.74 123.99 4aah s LYS 374 Ca -0.09 -0.63 -0.28 0.00 -0.36 0.00 0.00 55.97 54.61 4aah s LYS 374 Cb -0.11 -3.86 -0.09 0.00 -1.51 0.00 0.00 37.83 32.25 4aah s LYS 374 CO -0.07 -0.60 1.02 0.20 -0.36 0.00 0.00 175.35 175.53 4aah s GLY 375 N 1.74 2.94 0.04 5.54 0.00 0.19 -4.88 107.32 112.89 4aah s GLY 375 Ca 0.09 0.71 0.03 0.00 0.00 0.00 0.00 44.72 45.55 4aah s GLY 375 CO 0.11 1.23 -0.09 -0.51 0.00 0.00 0.00 173.10 173.84 4aah s THR 376 N -1.38 0.66 -1.48 0.90 -4.23 -1.26 0.18 115.64 109.03 4aah s THR 376 Ca 0.48 -1.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.92 4aah s THR 376 Cb -0.25 -0.68 0.02 0.00 1.34 0.00 0.00 72.50 72.92 4aah s THR 376 CO 0.32 -0.26 0.81 0.59 -0.54 0.00 0.00 174.62 175.54 4aah n ASN 377 N 1.66 -5.98 -4.70 3.99 3.02 -0.89 -4.94 115.26 107.43 4aah n ASN 377 Ca -0.21 -0.41 -0.41 0.00 -0.03 0.00 0.00 54.58 53.52 4aah n ASN 377 Cb 0.55 -4.79 -0.04 0.00 -0.61 0.00 0.00 39.78 34.89 4aah n ASN 377 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 4aah s ILE 378 N -3.22 4.92 -0.07 2.41 1.01 -0.25 -4.90 121.20 121.11 4aah s ILE 378 Ca 0.42 1.74 0.02 0.00 0.00 0.00 0.00 60.65 62.83 4aah s ILE 378 Cb -0.19 -4.18 0.01 0.00 0.01 0.00 0.00 42.46 38.11 4aah s ILE 378 CO 0.52 0.14 -0.14 0.00 0.00 0.00 0.00 174.94 175.47 4aah s PRO 380 N 0.63 2.01 1.04 0.00 0.02 -1.26 -1.22 135.00 136.21 4aah s PRO 380 Ca -0.15 0.36 -0.17 0.00 0.02 0.00 0.00 61.00 61.06 4aah s PRO 380 Cb -0.16 -1.93 0.22 0.00 0.02 0.00 0.00 34.50 32.65 4aah s PRO 380 CO 0.04 -1.61 1.22 -1.54 -0.33 0.00 0.00 177.00 174.78 4aah s SER 381 N -4.24 2.42 0.59 2.53 1.04 0.24 -4.72 113.70 111.56 4aah s SER 381 Ca 0.61 0.51 0.35 0.00 0.48 0.00 0.00 55.95 57.90 4aah s SER 381 Cb -0.13 -0.70 1.88 0.00 0.10 0.00 0.00 66.02 67.17 4aah s SER 381 CO 0.52 -3.19 2.21 0.00 0.98 0.00 0.00 173.24 173.77 4aah h ALA 382 N -1.95 1.21 0.00 5.32 0.00 -1.87 0.16 119.26 122.13 4aah h ALA 382 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.42 4aah h ALA 382 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 4aah h ALA 382 CO 0.41 0.04 0.00 0.52 0.00 0.00 0.00 179.25 180.22 4aah h MET 383 N 0.00 0.00 -1.45 0.00 2.86 -1.89 -3.43 114.93 111.02 4aah h MET 383 Ca -0.00 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.81 4aah h MET 383 Cb 0.16 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.77 4aah h MET 383 CO 0.00 0.00 -0.28 0.41 1.06 0.00 0.00 176.91 178.10 4aah n GLY 384 N 0.36 -1.76 0.55 8.32 0.00 0.56 -4.43 105.19 108.79 4aah n GLY 384 Ca 0.02 -1.36 0.13 0.00 0.00 0.00 0.00 46.02 44.82 4aah n GLY 384 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 4aah n PHE 385 N -2.70 0.02 -3.64 1.61 3.01 -0.97 -4.47 117.46 110.32 4aah n PHE 385 Ca -0.00 -0.01 -0.09 0.00 1.01 0.00 0.00 57.45 58.36 4aah n PHE 385 Cb 0.29 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.70 4aah n PHE 385 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 4aah s HIS 386 N -1.98 -0.70 0.00 1.38 2.46 -1.26 -2.44 115.29 112.75 4aah s HIS 386 Ca 0.36 1.58 0.00 0.00 0.47 0.00 0.00 55.06 57.48 4aah s HIS 386 Cb 0.21 0.39 0.00 0.00 -0.13 0.00 0.00 32.58 33.04 4aah s HIS 386 CO 0.33 -0.34 0.00 -1.71 -2.47 0.00 0.00 174.74 170.54 4aah n ASN 387 N 3.02 0.00 0.03 9.88 2.85 -1.26 -3.88 115.26 125.89 4aah n ASN 387 Ca -0.15 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.34 4aah n ASN 387 Cb 0.56 0.00 0.14 0.00 1.24 0.00 0.00 39.78 41.73 4aah n ASN 387 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 4aah n GLN 388 N 0.00 0.03 -1.88 1.20 0.00 -1.26 -4.72 117.38 110.74 4aah n GLN 388 Ca 0.00 0.48 -0.34 0.00 -0.00 0.00 0.00 57.00 57.14 4aah n GLN 388 Cb 0.00 -1.58 0.04 0.00 0.00 0.00 0.00 30.24 28.70 4aah n GLN 388 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 4aah s GLY 389 N -3.10 2.43 -0.31 1.69 0.00 -1.04 -4.91 107.32 102.09 4aah s GLY 389 Ca 0.01 0.77 -0.09 0.00 0.00 0.00 0.00 44.72 45.41 4aah s GLY 389 CO 0.08 1.14 0.14 -1.34 0.00 0.00 0.00 173.10 173.11 4aah s VAL 390 N -1.98 4.47 0.61 1.40 -7.23 -0.86 -4.67 120.40 112.15 4aah s VAL 390 Ca 0.72 -0.48 -0.07 0.00 -1.81 0.00 0.00 61.98 60.33 4aah s VAL 390 Cb -0.25 -3.29 0.00 0.00 0.56 0.00 0.00 36.38 33.41 4aah s VAL 390 CO 0.37 0.06 0.95 -1.81 -0.31 0.00 0.00 175.10 174.36 4aah s ASP 391 N 1.59 5.65 0.41 4.85 1.01 -1.26 0.12 116.67 129.03 4aah s ASP 391 Ca 0.04 0.87 0.07 0.00 0.71 0.00 0.00 52.55 54.25 4aah s ASP 391 Cb -0.17 -1.85 -0.06 0.00 1.01 0.00 0.00 42.92 41.85 4aah s ASP 391 CO 0.05 -1.08 0.11 -0.94 0.21 0.00 0.00 175.17 173.52 4aah s SER 392 N -4.29 4.21 -0.06 0.27 1.04 -1.12 -4.40 113.70 109.34 4aah s SER 392 Ca 0.54 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.79 4aah s SER 392 Cb -0.11 -0.45 0.02 0.00 0.10 0.00 0.00 66.02 65.59 4aah s SER 392 CO 0.47 -0.50 -0.04 -0.47 0.98 0.00 0.00 173.24 173.68 4aah s TYR 393 N -2.64 0.86 -0.42 5.02 5.04 -0.04 -1.20 117.35 123.97 4aah s TYR 393 Ca 0.39 -0.28 -0.19 0.00 -2.44 0.00 0.00 57.07 54.55 4aah s TYR 393 Cb 0.06 -0.80 0.02 0.00 0.35 0.00 0.00 41.96 41.59 4aah s TYR 393 CO 0.21 -0.28 0.52 0.34 -1.34 0.00 0.00 175.55 175.00 4aah s ASP 394 N 1.32 6.25 0.44 4.32 2.15 0.12 -4.73 116.67 126.54 4aah s ASP 394 Ca -0.04 -0.49 0.30 0.00 0.43 0.00 0.00 52.55 52.74 4aah s ASP 394 Cb -0.14 -2.26 1.15 0.00 -0.30 0.00 0.00 42.92 41.37 4aah s ASP 394 CO -0.02 -0.65 1.87 1.55 -0.17 0.00 0.00 175.17 177.74 4aah h PRO 395 N 8.77 0.00 0.00 4.34 0.13 -1.96 0.57 132.00 143.84 4aah h PRO 395 Ca -0.26 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.85 4aah h PRO 395 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 4aah h PRO 395 CO 0.83 0.00 -0.11 0.93 -0.23 0.00 0.00 178.00 179.42 4aah h GLU 396 N 0.00 0.00 -0.01 0.86 5.08 -1.96 -3.34 114.58 115.20 4aah h GLU 396 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 4aah h GLU 396 Cb 0.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 4aah h GLU 396 CO 0.00 0.67 -0.12 -1.13 -1.00 0.00 0.00 179.01 177.43 4aah n SER 397 N -4.65 1.38 -3.40 1.42 3.41 -1.23 -4.96 113.62 105.59 4aah n SER 397 Ca -0.09 -1.26 -0.19 0.00 -0.26 0.00 0.00 58.87 57.07 4aah n SER 397 Cb 0.35 0.07 0.06 0.00 -0.26 0.00 0.00 64.21 64.43 4aah n SER 397 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 4aah n ARG 398 N -0.13 -2.88 -4.79 4.33 1.74 0.09 -5.01 116.66 110.02 4aah n ARG 398 Ca 0.16 0.76 -0.25 0.00 -0.77 0.00 0.00 57.85 57.74 4aah n ARG 398 Cb 0.37 -5.44 -0.15 0.00 -1.02 0.00 0.00 32.46 26.22 4aah n ARG 398 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 4aah s THR 399 N -3.43 1.53 -0.15 0.55 2.01 -0.61 -4.55 115.64 111.00 4aah s THR 399 Ca 0.36 -0.95 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 4aah s THR 399 Cb -0.07 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 4aah s THR 399 CO 0.77 0.32 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.73 4aah s LEU 400 N -0.74 3.02 -0.38 4.42 2.96 -0.45 0.12 118.68 127.64 4aah s LEU 400 Ca 0.07 -0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.66 4aah s LEU 400 Cb -0.08 -1.71 0.04 0.00 0.50 0.00 0.00 46.19 44.94 4aah s LEU 400 CO 0.00 0.16 0.20 -0.31 -1.32 0.00 0.00 176.35 175.08 4aah s TYR 401 N 0.42 3.26 -0.07 5.38 2.02 -0.34 -1.10 117.35 126.92 4aah s TYR 401 Ca -0.06 -1.14 -0.03 0.00 -0.37 0.00 0.00 57.07 55.46 4aah s TYR 401 Cb -0.15 -2.52 -0.04 0.00 -0.40 0.00 0.00 41.96 38.85 4aah s TYR 401 CO 0.04 -0.70 0.08 0.00 -1.57 0.00 0.00 175.55 173.40 4aah s ALA 402 N 1.51 3.62 -0.42 3.71 0.00 -0.39 -3.05 121.76 126.73 4aah s ALA 402 Ca 0.02 -0.76 -0.14 0.00 0.00 0.00 0.00 51.96 51.08 4aah s ALA 402 Cb -0.20 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.24 4aah s ALA 402 CO 0.05 0.63 0.30 0.20 0.00 0.00 0.00 175.76 176.95 4aah s GLY 403 N -1.20 2.00 0.20 0.00 0.00 -1.26 -0.26 107.32 106.80 4aah s GLY 403 Ca 0.17 -1.81 0.11 0.00 0.00 0.00 0.00 44.72 43.19 4aah s GLY 403 CO 0.07 0.93 -0.19 1.08 0.00 0.00 0.00 173.10 174.99 4aah s LEU 404 N 1.64 2.60 0.05 0.66 1.43 0.24 -4.63 118.68 120.68 4aah s LEU 404 Ca 0.04 -0.81 0.02 0.00 -1.03 0.00 0.00 54.13 52.35 4aah s LEU 404 Cb -0.20 -1.29 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 4aah s LEU 404 CO 0.09 0.10 0.07 0.20 0.23 0.00 0.00 176.35 177.04 4aah s ASN 405 N -2.83 5.52 -0.62 2.29 0.02 -1.02 -1.56 114.94 116.74 4aah s ASN 405 Ca 0.23 0.03 0.05 0.00 -1.02 0.00 0.00 52.86 52.16 4aah s ASN 405 Cb -0.08 -1.51 0.19 0.00 0.02 0.00 0.00 41.25 39.87 4aah s ASN 405 CO 0.12 0.21 0.50 1.57 0.02 0.00 0.00 177.10 179.52 4aah n HIS 406 N 0.78 2.24 -3.96 2.20 -0.00 0.33 -4.43 115.22 112.37 4aah n HIS 406 Ca -0.11 -4.04 -0.15 0.00 0.46 0.00 0.00 57.72 53.88 4aah n HIS 406 Cb 0.52 -0.41 -0.15 0.00 -0.12 0.00 0.00 29.99 29.83 4aah n HIS 406 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 4aah s ILE 407 N -1.28 0.18 0.43 3.57 1.01 -1.26 -1.26 121.20 122.58 4aah s ILE 407 Ca 0.29 0.00 0.06 0.00 0.00 0.00 0.00 60.65 61.01 4aah s ILE 407 Cb 0.01 -0.22 -0.07 0.00 0.01 0.00 0.00 42.46 42.20 4aah s ILE 407 CO -0.15 0.10 0.02 0.00 0.00 0.00 0.00 174.94 174.91 4aah s MET 409 N -3.75 1.71 -0.05 0.00 0.23 -0.46 -1.18 119.30 115.79 4aah s MET 409 Ca 0.31 -1.75 0.05 0.00 -1.03 0.00 0.00 55.69 53.27 4aah s MET 409 Cb 0.08 0.39 -0.00 0.00 -1.53 0.00 0.00 34.83 33.76 4aah s MET 409 CO 0.16 -0.67 -0.21 -0.51 -2.03 0.00 0.00 175.02 171.77 4aah s ASP 410 N -3.24 2.57 -0.12 -1.18 1.01 -0.43 -1.09 116.67 114.19 4aah s ASP 410 Ca 0.34 -0.43 -0.06 0.00 0.71 0.00 0.00 52.55 53.10 4aah s ASP 410 Cb 0.02 -0.77 0.05 0.00 1.01 0.00 0.00 42.92 43.22 4aah s ASP 410 CO 0.20 0.18 0.28 0.86 0.21 0.00 0.00 175.17 176.90 4aah s TRP 411 N 0.02 -0.38 -0.08 4.23 -0.11 0.13 -2.55 118.94 120.19 4aah s TRP 411 Ca -0.06 0.87 -0.03 0.00 1.22 0.00 0.00 56.10 58.10 4aah s TRP 411 Cb -0.13 0.09 0.05 0.00 -1.50 0.00 0.00 33.47 31.98 4aah s TRP 411 CO 0.03 -0.24 0.17 -2.00 -4.62 0.00 0.00 176.95 170.29 4aah s GLU 412 N 1.17 0.06 0.68 5.86 2.12 -0.98 0.53 118.70 128.15 4aah s GLU 412 Ca -0.08 0.54 -0.05 0.00 0.36 0.00 0.00 54.97 55.74 4aah s GLU 412 Cb -0.09 -0.23 0.07 0.00 0.26 0.00 0.00 34.13 34.14 4aah s GLU 412 CO -0.08 -0.27 0.97 -1.25 -0.54 0.00 0.00 175.26 174.09 4aah s PRO 413 N 2.03 2.15 0.03 4.30 0.04 -1.26 -1.64 135.00 140.65 4aah s PRO 413 Ca -0.00 -0.46 -0.22 0.00 0.04 0.00 0.00 61.00 60.36 4aah s PRO 413 Cb -0.12 -2.24 0.05 0.00 0.04 0.00 0.00 34.50 32.23 4aah s PRO 413 CO -0.06 -1.20 0.50 -0.59 0.04 0.00 0.00 177.00 175.69 4aah s PHE 414 N -3.16 -0.40 0.39 0.56 -0.12 -0.25 -4.66 117.98 110.33 4aah s PHE 414 Ca 0.61 0.48 -0.18 0.00 -0.05 0.00 0.00 56.93 57.78 4aah s PHE 414 Cb -0.10 0.31 -0.10 0.00 -0.63 0.00 0.00 43.02 42.50 4aah s PHE 414 CO 0.44 -0.61 0.86 -1.64 -0.05 0.00 0.00 175.22 174.21 4aah s MET 415 N -2.25 4.12 -0.14 1.99 -1.94 -1.26 -4.57 119.30 115.24 4aah s MET 415 Ca -0.06 0.91 -0.30 0.00 -1.71 0.00 0.00 55.69 54.53 4aah s MET 415 Cb -0.01 -2.29 0.13 0.00 2.01 0.00 0.00 34.83 34.67 4aah s MET 415 CO -0.00 0.04 1.04 -0.48 -0.01 0.00 0.00 175.02 175.61 4aah s LEU 416 N -3.14 -0.30 0.99 -0.03 0.05 -1.26 -5.04 118.68 109.95 4aah s LEU 416 Ca 0.58 0.23 -0.17 0.00 0.05 0.00 0.00 54.13 54.83 4aah s LEU 416 Cb -0.10 1.75 0.22 0.00 -2.05 0.00 0.00 46.19 46.01 4aah s LEU 416 CO 0.16 -0.35 1.32 -2.16 -0.55 0.00 0.00 176.35 174.77 4aah s PRO 417 N -1.70 0.38 -0.15 1.48 0.04 -1.26 -5.07 135.00 128.72 4aah s PRO 417 Ca 0.02 -0.44 0.01 0.00 0.04 0.00 0.00 61.00 60.64 4aah s PRO 417 Cb -0.01 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.73 4aah s PRO 417 CO -0.02 -2.59 -0.18 -0.47 0.04 0.00 0.00 177.00 173.78 4aah s TYR 418 N -3.86 2.47 -0.20 0.56 5.04 -1.26 -4.89 117.35 115.21 4aah s TYR 418 Ca 0.75 -1.37 -0.00 0.00 -2.44 0.00 0.00 57.07 54.00 4aah s TYR 418 Cb -0.03 -1.74 0.05 0.00 0.35 0.00 0.00 41.96 40.59 4aah s TYR 418 CO 0.54 -0.69 -0.05 1.03 -1.34 0.00 0.00 175.55 175.04 4aah s ARG 419 N 1.23 1.45 -0.71 4.97 0.52 -1.26 -5.07 118.95 120.08 4aah s ARG 419 Ca 0.01 -0.71 -0.32 0.00 -0.52 0.00 0.00 55.73 54.20 4aah s ARG 419 Cb -0.14 -2.27 -0.16 0.00 0.52 0.00 0.00 34.95 32.90 4aah s ARG 419 CO -0.09 -0.52 2.48 0.00 0.02 0.00 0.00 175.30 177.19 4aah n ALA 420 N 4.81 0.53 0.00 2.13 0.00 -1.26 -0.41 120.51 126.31 4aah n ALA 420 Ca -0.12 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 52.98 4aah n ALA 420 Cb 0.46 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.39 4aah n ALA 420 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4aah n GLY 421 N 6.51 1.13 3.50 0.00 0.00 -1.25 -4.60 105.19 110.48 4aah n GLY 421 Ca 0.54 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.31 4aah n GLY 421 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4aah s GLN 422 N -0.12 1.72 0.42 1.61 -1.52 0.45 -4.61 119.66 117.62 4aah s GLN 422 Ca 0.00 -1.87 -0.24 0.00 -1.95 0.00 0.00 55.36 51.30 4aah s GLN 422 Cb 0.00 -1.58 -0.08 0.00 -0.22 0.00 0.00 33.01 31.13 4aah s GLN 422 CO 0.00 0.15 1.15 -0.06 -0.25 0.00 0.00 175.29 176.29 4aah s PHE 423 N -2.69 3.01 -0.42 0.91 0.08 -1.26 -4.56 117.98 113.05 4aah s PHE 423 Ca 0.31 1.56 0.11 0.00 0.12 0.00 0.00 56.93 59.02 4aah s PHE 423 Cb 0.01 -3.36 0.38 0.00 -0.57 0.00 0.00 43.02 39.49 4aah s PHE 423 CO 0.15 -1.32 0.89 0.34 -0.10 0.00 0.00 175.22 175.18 4aah n PHE 424 N -0.16 1.85 -0.00 0.36 7.35 0.18 -4.88 117.46 122.15 4aah n PHE 424 Ca 0.05 -3.52 -0.00 0.00 -0.76 0.00 0.00 57.45 53.22 4aah n PHE 424 Cb 0.47 -0.38 -0.00 0.00 0.35 0.00 0.00 39.48 39.93 4aah n PHE 424 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 4aah h VAL 425 N 2.18 0.00 -1.81 -2.13 2.07 -1.94 -3.31 116.25 111.31 4aah h VAL 425 Ca 0.09 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 4aah h VAL 425 Cb 0.89 0.00 0.02 0.00 -1.52 0.00 0.00 31.29 30.69 4aah h VAL 425 CO 0.63 0.00 -0.10 0.61 0.02 0.00 0.00 177.57 178.73 4aah n GLY 426 N 1.83 0.69 3.34 2.17 0.00 -1.26 0.13 105.19 112.10 4aah n GLY 426 Ca -0.00 -0.52 -0.14 0.00 0.00 0.00 0.00 46.02 45.36 4aah n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah s ALA 427 N -3.05 -1.11 -0.13 4.61 0.00 -1.26 -1.09 121.76 119.72 4aah s ALA 427 Ca 0.08 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.55 4aah s ALA 427 Cb -0.04 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.34 4aah s ALA 427 CO 0.11 -0.40 -0.14 0.99 0.00 0.00 0.00 175.76 176.32 4aah s THR 428 N -1.99 1.53 0.27 0.00 2.01 -0.65 -4.96 115.64 111.85 4aah s THR 428 Ca -0.08 -0.62 0.06 0.00 0.31 0.00 0.00 61.69 61.36 4aah s THR 428 Cb -0.02 -1.42 -0.06 0.00 0.01 0.00 0.00 72.50 71.01 4aah s THR 428 CO 0.01 0.45 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.59 4aah s LEU 429 N 1.34 2.42 -0.03 4.42 1.02 -1.26 -2.32 118.68 124.26 4aah s LEU 429 Ca 0.01 -1.20 0.01 0.00 0.02 0.00 0.00 54.13 52.96 4aah s LEU 429 Cb -0.13 -0.56 0.02 0.00 0.02 0.00 0.00 46.19 45.54 4aah s LEU 429 CO -0.08 -0.38 -0.02 0.00 0.02 0.00 0.00 176.35 175.89 4aah s ALA 430 N -3.09 0.43 0.17 4.21 0.00 -1.06 -4.23 121.76 118.19 4aah s ALA 430 Ca 0.30 0.09 0.10 0.00 0.00 0.00 0.00 51.96 52.45 4aah s ALA 430 Cb 0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 4aah s ALA 430 CO 0.11 -0.04 -0.19 -1.64 0.00 0.00 0.00 175.76 174.00 4aah s MET 431 N 0.94 1.70 0.13 0.00 -1.94 -1.22 -1.32 119.30 117.60 4aah s MET 431 Ca -0.10 -1.38 -0.25 0.00 -1.71 0.00 0.00 55.69 52.24 4aah s MET 431 Cb -0.14 -1.98 0.07 0.00 2.01 0.00 0.00 34.83 34.79 4aah s MET 431 CO -0.01 0.43 0.84 1.52 -0.01 0.00 0.00 175.02 177.79 4aah s TYR 432 N -1.55 -0.26 0.52 -0.03 -0.85 -0.33 -3.91 117.35 110.95 4aah s TYR 432 Ca 0.21 -0.00 -0.21 0.00 -0.52 0.00 0.00 57.07 56.54 4aah s TYR 432 Cb -0.09 0.61 -0.06 0.00 0.38 0.00 0.00 41.96 42.81 4aah s TYR 432 CO 0.11 -0.82 1.21 -1.25 -1.52 0.00 0.00 175.55 173.28 4aah s PRO 433 N -3.42 3.38 1.27 -3.49 0.05 -1.26 -0.62 135.00 130.91 4aah s PRO 433 Ca 0.08 1.86 -0.21 0.00 0.05 0.00 0.00 61.00 62.78 4aah s PRO 433 Cb -0.02 -2.20 0.31 0.00 0.05 0.00 0.00 34.50 32.64 4aah s PRO 433 CO -0.03 -0.89 1.08 0.20 0.05 0.00 0.00 177.00 177.42 4aah s GLY 434 N -1.39 1.56 0.11 0.56 0.00 -0.39 -4.53 107.32 103.24 4aah s GLY 434 Ca 0.70 -1.01 0.24 0.00 0.00 0.00 0.00 44.72 44.65 4aah s GLY 434 CO 0.36 -0.07 1.34 -1.55 0.00 0.00 0.00 173.10 173.18 4aah n PRO 435 N -5.00 0.27 0.00 2.90 -0.04 -1.26 -4.34 135.00 127.53 4aah n PRO 435 Ca 0.14 0.08 0.14 0.00 -0.04 0.00 0.00 63.50 63.82 4aah n PRO 435 Cb 0.60 -1.67 0.49 0.00 -0.04 0.00 0.00 33.50 32.87 4aah n PRO 435 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 4aah n ASN 436 N -2.07 1.29 -4.73 3.54 5.03 -1.26 -4.73 115.26 112.33 4aah n ASN 436 Ca 0.03 -1.27 -0.38 0.00 0.87 0.00 0.00 54.58 53.84 4aah n ASN 436 Cb 0.43 0.04 0.05 0.00 -1.02 0.00 0.00 39.78 39.28 4aah n ASN 436 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 4aah n GLY 437 N 1.23 0.64 0.24 7.41 0.00 -1.26 -4.86 105.19 108.58 4aah n GLY 437 Ca 0.17 -0.04 0.14 0.00 0.00 0.00 0.00 46.02 46.29 4aah n GLY 437 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 4aah h PRO 438 N 1.09 0.00 0.00 1.61 0.11 -1.94 0.51 132.00 133.38 4aah h PRO 438 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 4aah h PRO 438 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 4aah h PRO 438 CO 0.55 0.00 -0.20 0.25 -0.21 0.00 0.00 178.00 178.40 4aah n THR 439 N -2.55 0.62 -0.94 -1.15 -2.24 -1.26 -4.96 114.28 101.80 4aah n THR 439 Ca -0.02 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 4aah n THR 439 Cb 0.13 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 4aah n THR 439 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 4aah n LYS 440 N -0.44 -1.45 -0.07 -0.78 4.01 0.17 -4.78 118.16 114.82 4aah n LYS 440 Ca 0.04 0.36 -0.09 0.00 -0.51 0.00 0.00 58.31 58.12 4aah n LYS 440 Cb 0.58 -4.61 -0.09 0.00 -0.51 0.00 0.00 35.03 30.40 4aah n LYS 440 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 4aah n LYS 441 N 0.03 1.28 -1.73 1.97 4.01 -1.26 -4.79 118.16 117.67 4aah n LYS 441 Ca 0.00 0.03 -0.41 0.00 -0.51 0.00 0.00 58.31 57.43 4aah n LYS 441 Cb 0.36 -1.34 0.01 0.00 -0.51 0.00 0.00 35.03 33.55 4aah n LYS 441 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 4aah n GLU 442 N -2.69 2.18 -0.01 1.97 4.71 -1.26 -4.82 120.64 120.72 4aah n GLU 442 Ca -0.25 0.77 0.00 0.00 -0.01 0.00 0.00 57.16 57.68 4aah n GLU 442 Cb 0.89 -2.51 0.01 0.00 -1.01 0.00 0.00 31.44 28.81 4aah n GLU 442 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 4aah n MET 443 N 0.05 2.75 -3.86 3.49 2.81 -0.83 -4.45 117.12 117.07 4aah n MET 443 Ca 0.05 -1.47 -0.10 0.00 -1.81 0.00 0.00 57.70 54.37 4aah n MET 443 Cb 0.40 -1.02 -0.08 0.00 -0.71 0.00 0.00 33.22 31.81 4aah n MET 443 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 4aah s GLY 444 N -0.94 0.07 -0.03 3.03 0.00 -0.79 -0.51 107.32 108.16 4aah s GLY 444 Ca 0.01 -0.44 -0.19 0.00 0.00 0.00 0.00 44.72 44.11 4aah s GLY 444 CO 0.01 -0.61 0.41 1.20 0.00 0.00 0.00 173.10 174.10 4aah s GLN 445 N -3.03 0.76 -0.30 2.90 -0.21 -0.60 0.30 119.66 119.48 4aah s GLN 445 Ca -0.01 -0.05 -0.05 0.00 0.02 0.00 0.00 55.36 55.27 4aah s GLN 445 Cb 0.01 0.35 0.03 0.00 1.00 0.00 0.00 33.01 34.39 4aah s GLN 445 CO -0.06 -0.22 0.04 0.42 -2.12 0.00 0.00 175.29 173.35 4aah s ILE 446 N -1.24 3.50 -0.05 1.08 -1.09 0.79 -0.59 121.20 123.60 4aah s ILE 446 Ca -0.12 -1.00 0.06 0.00 -2.23 0.00 0.00 60.65 57.35 4aah s ILE 446 Cb -0.04 -2.88 -0.01 0.00 -1.58 0.00 0.00 42.46 37.95 4aah s ILE 446 CO 0.06 0.01 -0.24 -0.60 -1.23 0.00 0.00 174.94 172.93 4aah s ARG 447 N 1.39 2.41 -0.14 2.79 3.52 0.64 -1.02 118.95 128.55 4aah s ARG 447 Ca -0.00 -0.88 -0.13 0.00 -0.13 0.00 0.00 55.73 54.58 4aah s ARG 447 Cb -0.18 -2.08 -0.05 0.00 -1.56 0.00 0.00 34.95 31.08 4aah s ARG 447 CO 0.00 0.39 0.28 0.00 -0.81 0.00 0.00 175.30 175.17 4aah s ALA 448 N -0.20 3.63 0.17 6.12 0.00 -0.49 -1.26 121.76 129.73 4aah s ALA 448 Ca -0.02 -0.46 0.10 0.00 0.00 0.00 0.00 51.96 51.59 4aah s ALA 448 Cb -0.13 -2.34 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 4aah s ALA 448 CO 0.03 0.18 -0.22 -0.06 0.00 0.00 0.00 175.76 175.69 4aah s PHE 449 N 0.16 2.12 -0.30 0.00 0.08 -0.26 0.94 117.98 120.72 4aah s PHE 449 Ca 0.17 -0.40 -0.15 0.00 0.12 0.00 0.00 56.93 56.67 4aah s PHE 449 Cb -0.13 -1.06 -0.03 0.00 -0.57 0.00 0.00 43.02 41.23 4aah s PHE 449 CO 0.05 0.42 0.36 0.34 -0.10 0.00 0.00 175.22 176.29 4aah s ASP 450 N -2.57 6.22 0.47 1.36 -1.08 -0.66 -1.34 116.67 119.07 4aah s ASP 450 Ca 0.18 0.10 0.26 0.00 -0.52 0.00 0.00 52.55 52.57 4aah s ASP 450 Cb -0.08 -2.20 0.80 0.00 -1.46 0.00 0.00 42.92 39.98 4aah s ASP 450 CO 0.08 -0.23 1.77 -0.07 0.52 0.00 0.00 175.17 177.24 4aah h LEU 451 N 8.66 0.00 0.00 -1.34 3.38 -1.89 0.20 115.31 124.31 4aah h LEU 451 Ca -0.31 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 4aah h LEU 451 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 4aah h LEU 451 CO 0.66 0.09 -1.00 0.71 0.09 0.00 0.00 178.44 178.99 4aah h THR 452 N 0.00 0.20 0.00 0.22 1.35 -1.94 -3.37 112.91 109.36 4aah h THR 452 Ca -0.00 -1.36 0.00 0.00 -0.55 0.00 0.00 66.41 64.50 4aah h THR 452 Cb 0.81 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 4aah h THR 452 CO 0.01 0.11 -1.34 0.35 -0.25 0.00 0.00 175.52 174.40 4aah n THR 453 N -2.81 0.00 -1.28 6.82 -2.24 -1.21 -4.86 114.28 108.70 4aah n THR 453 Ca -0.02 -0.25 -0.10 0.00 -2.27 0.00 0.00 64.05 61.41 4aah n THR 453 Cb 0.64 0.37 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 4aah n THR 453 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4aah n GLY 454 N 1.76 1.09 3.90 3.38 0.00 0.05 -4.99 105.19 110.38 4aah n GLY 454 Ca -0.01 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 4aah n GLY 454 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4aah s LYS 455 N -2.64 3.51 -0.10 1.61 1.02 -1.23 -4.88 119.74 117.04 4aah s LYS 455 Ca 0.00 -0.23 -0.20 0.00 0.02 0.00 0.00 55.97 55.56 4aah s LYS 455 Cb 0.00 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 34.21 4aah s LYS 455 CO 0.00 0.63 0.55 0.00 -0.92 0.00 0.00 175.35 175.62 4aah s ALA 456 N -1.38 3.43 -0.04 5.17 0.00 -1.26 -1.65 121.76 126.03 4aah s ALA 456 Ca 0.30 -0.07 -0.07 0.00 0.00 0.00 0.00 51.96 52.11 4aah s ALA 456 Cb -0.13 -2.75 -0.29 0.00 0.00 0.00 0.00 23.12 19.95 4aah s ALA 456 CO 0.20 -0.02 0.67 0.87 0.00 0.00 0.00 175.76 177.48 4aah h LYS 457 N 6.67 0.33 -3.03 0.00 1.57 0.20 -3.48 116.57 118.82 4aah h LYS 457 Ca -0.41 -0.56 -0.01 0.00 -1.87 0.00 0.00 60.65 57.80 4aah h LYS 457 Cb 1.19 0.21 -0.11 0.00 0.08 0.00 0.00 32.23 33.59 4aah h LYS 457 CO 0.75 1.22 0.19 1.67 -0.57 0.00 0.00 179.45 182.71 4aah s TRP 458 N -2.59 -0.48 -0.02 -1.35 1.48 -1.25 -5.01 118.94 109.73 4aah s TRP 458 Ca -0.15 0.24 0.01 0.00 -1.06 0.00 0.00 56.10 55.15 4aah s TRP 458 Cb 0.06 0.55 0.01 0.00 -1.16 0.00 0.00 33.47 32.93 4aah s TRP 458 CO 0.84 -0.88 -0.04 0.99 -4.06 0.00 0.00 176.95 173.81 4aah s THR 459 N -3.77 0.37 -0.17 0.66 2.01 -1.26 -1.39 115.64 112.09 4aah s THR 459 Ca 0.02 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.90 4aah s THR 459 Cb -0.01 -0.36 0.02 0.00 0.01 0.00 0.00 72.50 72.15 4aah s THR 459 CO -0.11 0.14 -0.20 -0.75 -0.69 0.00 0.00 174.62 173.01 4aah s LYS 460 N 0.31 3.00 0.29 4.92 2.36 -0.18 -4.98 119.74 125.46 4aah s LYS 460 Ca -0.03 -0.83 -0.14 0.00 -2.55 0.00 0.00 55.97 52.41 4aah s LYS 460 Cb -0.07 -2.55 -0.08 0.00 -1.05 0.00 0.00 37.83 34.07 4aah s LYS 460 CO -0.00 -0.17 0.69 -1.58 1.55 0.00 0.00 175.35 175.83 4aah s TRP 461 N 1.20 3.41 0.05 4.03 0.52 -1.26 -0.15 118.94 126.74 4aah s TRP 461 Ca 0.03 1.15 0.04 0.00 0.02 0.00 0.00 56.10 57.34 4aah s TRP 461 Cb -0.13 -2.48 -0.03 0.00 -1.15 0.00 0.00 33.47 29.68 4aah s TRP 461 CO -0.11 0.16 -0.13 -1.21 0.02 0.00 0.00 176.95 175.69 4aah s GLU 462 N -2.84 0.77 0.18 4.98 0.41 0.15 -4.92 118.70 117.43 4aah s GLU 462 Ca 0.51 -0.84 -0.13 0.00 -0.41 0.00 0.00 54.97 54.11 4aah s GLU 462 Cb -0.11 -0.73 0.09 0.00 -1.78 0.00 0.00 34.13 31.60 4aah s GLU 462 CO 0.18 0.17 1.83 -0.22 -0.49 0.00 0.00 175.26 176.73 4aah h LYS 463 N 4.55 0.80 -5.97 1.61 3.64 -1.95 -2.06 116.57 117.19 4aah h LYS 463 Ca -0.39 -0.06 -0.58 0.00 -1.27 0.00 0.00 60.65 58.35 4aah h LYS 463 Cb 1.19 -0.17 -0.10 0.00 -0.41 0.00 0.00 32.23 32.74 4aah h LYS 463 CO 0.41 0.55 -0.58 -0.06 -2.27 0.00 0.00 179.45 177.51 4aah s PHE 464 N -6.06 2.58 0.40 1.91 0.08 -1.26 -1.97 117.98 113.65 4aah s PHE 464 Ca -0.13 -0.48 -0.24 0.00 0.12 0.00 0.00 56.93 56.19 4aah s PHE 464 Cb 0.13 -1.64 -0.11 0.00 -0.57 0.00 0.00 43.02 40.82 4aah s PHE 464 CO 0.76 0.39 0.88 0.00 -0.10 0.00 0.00 175.22 177.15 4aah n ALA 465 N -1.05 -0.35 -2.74 5.36 0.00 -1.20 -3.37 120.51 117.16 4aah n ALA 465 Ca -0.03 0.23 -0.43 0.00 0.00 0.00 0.00 53.44 53.21 4aah n ALA 465 Cb 0.63 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 18.10 4aah n ALA 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4aah n ALA 466 N -0.51 4.75 -0.13 0.00 0.00 -1.17 -4.43 120.51 119.03 4aah n ALA 466 Ca 0.10 -4.41 -0.12 0.00 0.00 0.00 0.00 53.44 49.01 4aah n ALA 466 Cb 0.38 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 16.99 4aah n ALA 466 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 4aah h TRP 467 N 6.23 1.10 0.08 0.00 2.91 -1.88 -3.34 115.95 121.05 4aah h TRP 467 Ca 0.32 -0.30 -0.28 0.00 1.13 0.00 0.00 58.89 59.76 4aah h TRP 467 Cb 0.73 -0.24 0.02 0.00 -0.51 0.00 0.00 29.16 29.16 4aah h TRP 467 CO 1.11 1.11 -1.15 0.78 -1.03 0.00 0.00 178.44 179.26 4aah h GLY 468 N 0.85 0.63 0.00 2.65 0.00 -1.75 -2.75 103.07 102.70 4aah h GLY 468 Ca 0.08 -1.26 0.00 0.00 0.00 0.00 0.00 47.33 46.16 4aah h GLY 468 CO 0.08 1.11 0.00 0.61 0.00 0.00 0.00 176.54 178.34 4aah n GLY 469 N 1.26 0.55 3.13 4.60 0.00 -1.26 -2.02 105.19 111.44 4aah n GLY 469 Ca -0.11 -2.21 -0.09 0.00 0.00 0.00 0.00 46.02 43.61 4aah n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4aah s THR 470 N -0.58 0.15 0.06 2.61 -4.23 0.12 -4.44 115.64 109.33 4aah s THR 470 Ca 0.00 -1.26 0.07 0.00 -1.18 0.00 0.00 61.69 59.32 4aah s THR 470 Cb 0.00 -1.11 -0.03 0.00 1.34 0.00 0.00 72.50 72.71 4aah s THR 470 CO 0.00 -0.70 -0.19 -0.22 -0.54 0.00 0.00 174.62 172.98 4aah s LEU 471 N -2.43 2.21 -0.11 4.79 2.96 -0.74 -2.78 118.68 122.58 4aah s LEU 471 Ca -0.01 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 4aah s LEU 471 Cb 0.02 -0.83 0.01 0.00 0.50 0.00 0.00 46.19 45.89 4aah s LEU 471 CO -0.07 0.09 -0.15 -0.47 -1.32 0.00 0.00 176.35 174.42 4aah s TYR 472 N -0.95 2.01 -0.01 5.38 5.04 -1.19 -1.49 117.35 126.15 4aah s TYR 472 Ca 0.05 -0.96 0.08 0.00 -2.44 0.00 0.00 57.07 53.80 4aah s TYR 472 Cb -0.09 -1.45 -0.02 0.00 0.35 0.00 0.00 41.96 40.75 4aah s TYR 472 CO 0.02 -0.49 -0.25 0.95 -1.34 0.00 0.00 175.55 174.44 4aah s THR 473 N 1.00 2.02 -0.17 4.34 -4.23 -0.99 -0.03 115.64 117.57 4aah s THR 473 Ca -0.06 -1.12 0.08 0.00 -1.18 0.00 0.00 61.69 59.41 4aah s THR 473 Cb -0.15 -1.68 0.08 0.00 1.34 0.00 0.00 72.50 72.09 4aah s THR 473 CO -0.02 0.54 1.09 1.17 -0.54 0.00 0.00 174.62 176.86 4aah n LYS 474 N 2.37 0.06 0.00 3.99 4.81 0.33 -1.64 118.16 128.08 4aah n LYS 474 Ca -0.16 0.46 0.10 0.00 -0.87 0.00 0.00 58.31 57.84 4aah n LYS 474 Cb 0.51 -1.97 0.56 0.00 0.02 0.00 0.00 35.03 34.15 4aah n LYS 474 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 4aah n GLY 475 N -1.28 -0.76 0.98 3.14 0.00 -1.25 -4.84 105.19 101.19 4aah n GLY 475 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 4aah n GLY 475 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4aah n GLY 476 N 0.31 1.15 3.33 -0.02 0.00 -0.65 -2.55 105.19 106.76 4aah n GLY 476 Ca 0.13 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 4aah n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4aah s LEU 477 N 0.00 2.26 -0.30 0.99 2.01 -1.08 -1.99 118.68 120.58 4aah s LEU 477 Ca 0.00 -0.67 -0.00 0.00 0.01 0.00 0.00 54.13 53.47 4aah s LEU 477 Cb 0.00 -1.09 0.06 0.00 0.01 0.00 0.00 46.19 45.17 4aah s LEU 477 CO 0.00 0.15 -0.02 0.54 1.01 0.00 0.00 176.35 178.03 4aah s VAL 478 N -1.01 2.72 -0.15 -1.59 0.11 -0.63 -2.35 120.40 117.50 4aah s VAL 478 Ca 0.10 -1.56 -0.17 0.00 -2.93 0.00 0.00 61.98 57.43 4aah s VAL 478 Cb -0.10 -2.61 -0.04 0.00 -1.53 0.00 0.00 36.38 32.10 4aah s VAL 478 CO 0.04 -0.15 0.42 0.26 -3.33 0.00 0.00 175.10 172.35 4aah s TRP 479 N 1.18 3.47 0.06 1.54 0.52 -0.55 -1.24 118.94 123.92 4aah s TRP 479 Ca -0.05 0.77 -0.17 0.00 0.02 0.00 0.00 56.10 56.67 4aah s TRP 479 Cb -0.20 -2.50 0.03 0.00 -1.15 0.00 0.00 33.47 29.65 4aah s TRP 479 CO -0.03 0.15 0.40 1.52 0.02 0.00 0.00 176.95 179.01 4aah s TYR 480 N 0.73 -0.23 0.03 -1.98 1.13 -0.78 -1.79 117.35 114.47 4aah s TYR 480 Ca 0.22 0.12 0.02 0.00 -1.41 0.00 0.00 57.07 56.03 4aah s TYR 480 Cb -0.14 0.21 -0.04 0.00 -1.10 0.00 0.00 41.96 40.89 4aah s TYR 480 CO 0.08 -0.59 0.03 0.00 -2.51 0.00 0.00 175.55 172.56 4aah s ALA 481 N -2.79 3.40 0.26 9.51 0.00 -1.26 0.01 121.76 130.89 4aah s ALA 481 Ca -0.03 -0.98 0.10 0.00 0.00 0.00 0.00 51.96 51.05 4aah s ALA 481 Cb -0.00 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.70 4aah s ALA 481 CO -0.05 0.69 -0.10 0.95 0.00 0.00 0.00 175.76 177.25 4aah s THR 482 N -1.21 3.00 0.46 0.00 -4.23 0.24 -4.63 115.64 109.26 4aah s THR 482 Ca 0.23 -2.07 0.21 0.00 -1.18 0.00 0.00 61.69 58.88 4aah s THR 482 Cb -0.12 -2.57 0.24 0.00 1.34 0.00 0.00 72.50 71.39 4aah s THR 482 CO 0.15 -0.34 2.06 -0.07 -0.54 0.00 0.00 174.62 175.88 4aah h LEU 483 N 2.23 0.00 -0.80 4.79 3.38 -1.77 0.33 115.31 123.46 4aah h LEU 483 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 4aah h LEU 483 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 4aah h LEU 483 CO 0.59 0.13 0.00 -0.90 0.09 0.00 0.00 178.44 178.35 4aah n ASP 484 N -4.04 1.19 0.00 -0.43 5.75 -1.26 -3.84 116.55 113.92 4aah n ASP 484 Ca -0.02 -1.68 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 4aah n ASP 484 Cb 0.22 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 4aah n ASP 484 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4aah n GLY 485 N 1.01 0.92 3.52 6.12 0.00 -0.99 -4.61 105.19 111.16 4aah n GLY 485 Ca 0.14 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 4aah n GLY 485 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4aah s TYR 486 N -2.00 2.48 -0.14 1.61 1.51 -1.26 0.06 117.35 119.60 4aah s TYR 486 Ca 0.00 -0.28 -0.01 0.00 -1.01 0.00 0.00 57.07 55.77 4aah s TYR 486 Cb 0.00 -1.15 -0.02 0.00 -0.11 0.00 0.00 41.96 40.68 4aah s TYR 486 CO 0.00 0.59 -0.11 -1.17 -1.11 0.00 0.00 175.55 173.75 4aah s LEU 487 N -3.16 2.79 0.14 -1.29 2.96 -0.73 -0.59 118.68 118.79 4aah s LEU 487 Ca 0.27 -0.31 0.07 0.00 -0.22 0.00 0.00 54.13 53.94 4aah s LEU 487 Cb -0.07 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 4aah s LEU 487 CO 0.15 0.15 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.65 4aah s LYS 488 N 0.42 1.11 -0.12 1.98 1.02 0.10 -1.53 119.74 122.72 4aah s LYS 488 Ca -0.09 -1.32 -0.00 0.00 0.02 0.00 0.00 55.97 54.57 4aah s LYS 488 Cb -0.16 -1.00 0.03 0.00 -0.52 0.00 0.00 37.83 36.18 4aah s LYS 488 CO 0.05 0.19 -0.07 0.00 -0.92 0.00 0.00 175.35 174.60 4aah s ALA 489 N -2.26 1.35 0.17 5.17 0.00 -0.16 -1.86 121.76 124.16 4aah s ALA 489 Ca 0.12 -0.59 0.06 0.00 0.00 0.00 0.00 51.96 51.55 4aah s ALA 489 Cb -0.04 -0.95 -0.04 0.00 0.00 0.00 0.00 23.12 22.09 4aah s ALA 489 CO 0.04 -0.48 0.06 -0.51 0.00 0.00 0.00 175.76 174.87 4aah s LEU 490 N 1.70 3.55 -0.22 0.00 1.43 -0.37 0.19 118.68 124.97 4aah s LEU 490 Ca 0.04 -0.26 -0.29 0.00 -1.03 0.00 0.00 54.13 52.59 4aah s LEU 490 Cb -0.13 -2.19 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 4aah s LEU 490 CO -0.08 0.08 1.25 -0.62 0.23 0.00 0.00 176.35 177.21 4aah s ASP 491 N -3.00 6.87 0.40 2.29 -1.08 0.16 -1.61 116.67 120.70 4aah s ASP 491 Ca 0.29 1.49 0.10 0.00 -0.52 0.00 0.00 52.55 53.91 4aah s ASP 491 Cb -0.10 -2.54 0.90 0.00 -1.46 0.00 0.00 42.92 39.72 4aah s ASP 491 CO 0.21 -0.86 1.98 -0.55 0.52 0.00 0.00 175.17 176.47 4aah h ASN 492 N 8.50 0.49 -0.23 -0.34 -1.07 -1.73 0.34 115.58 121.55 4aah h ASN 492 Ca -0.25 0.00 0.05 0.00 0.07 0.00 0.00 56.30 56.17 4aah h ASN 492 Cb 1.10 -0.10 -0.05 0.00 -2.07 0.00 0.00 38.32 37.20 4aah h ASN 492 CO 0.99 0.31 -0.09 0.11 0.07 0.00 0.00 177.43 178.83 4aah h LYS 493 N 0.56 -0.05 0.00 4.14 6.56 -1.91 -3.36 116.57 122.50 4aah h LYS 493 Ca 0.27 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.86 4aah h LYS 493 Cb 0.34 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 4aah h LYS 493 CO -0.08 -0.03 0.00 -0.40 -2.06 0.00 0.00 179.45 176.88 4aah n ASP 494 N -5.25 0.41 -0.20 0.86 5.68 -1.14 -4.96 116.55 111.95 4aah n ASP 494 Ca -0.02 -0.73 -0.03 0.00 -0.50 0.00 0.00 54.79 53.52 4aah n ASP 494 Cb 0.17 0.30 -0.01 0.00 -1.14 0.00 0.00 41.12 40.43 4aah n ASP 494 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4aah n GLY 495 N 0.30 0.58 3.78 6.12 0.00 0.12 -4.79 105.19 111.29 4aah n GLY 495 Ca 0.00 -0.95 -0.38 0.00 0.00 0.00 0.00 46.02 44.69 4aah n GLY 495 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4aah s LYS 496 N -2.19 4.63 -0.18 1.61 -2.85 -1.24 -4.70 119.74 114.81 4aah s LYS 496 Ca 0.00 1.31 -0.29 0.00 -1.00 0.00 0.00 55.97 55.98 4aah s LYS 496 Cb 0.00 -3.00 -0.01 0.00 -2.06 0.00 0.00 37.83 32.76 4aah s LYS 496 CO 0.00 0.39 1.28 -1.21 0.10 0.00 0.00 175.35 175.92 4aah s GLU 497 N -1.69 4.19 -0.06 1.78 2.02 -1.26 0.40 118.70 124.08 4aah s GLU 497 Ca 0.45 1.64 0.21 0.00 0.02 0.00 0.00 54.97 57.29 4aah s GLU 497 Cb -0.21 -3.79 -0.32 0.00 0.10 0.00 0.00 34.13 29.92 4aah s GLU 497 CO 0.26 -0.76 0.39 1.28 0.02 0.00 0.00 175.26 176.45 4aah n LEU 498 N 6.75 0.00 -3.56 1.80 4.32 0.13 -4.95 117.00 121.49 4aah n LEU 498 Ca 0.14 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 56.07 4aah n LEU 498 Cb 0.45 0.10 -0.02 0.00 -1.62 0.00 0.00 43.42 42.33 4aah n LEU 498 CO 0.57 0.10 0.89 0.86 -1.22 0.00 0.00 177.39 178.58 4aah s TRP 499 N -3.29 -0.21 0.17 -1.77 -0.00 -1.05 -4.45 118.94 108.32 4aah s TRP 499 Ca -0.08 0.14 -0.24 0.00 -0.00 0.00 0.00 56.10 55.92 4aah s TRP 499 Cb 0.12 0.52 0.06 0.00 -0.00 0.00 0.00 33.47 34.17 4aah s TRP 499 CO 0.88 -0.33 0.79 0.54 -0.00 0.00 0.00 176.95 178.83 4aah s ASN 500 N -2.24 -0.33 -0.20 5.86 2.20 -1.26 -0.99 114.94 117.99 4aah s ASN 500 Ca 0.07 -0.30 -0.16 0.00 -0.94 0.00 0.00 52.86 51.53 4aah s ASN 500 Cb -0.01 0.57 0.06 0.00 -2.00 0.00 0.00 41.25 39.87 4aah s ASN 500 CO -0.06 -1.01 0.52 0.12 -2.94 0.00 0.00 177.10 173.73 4aah s PHE 501 N -3.56 -0.64 -0.49 1.54 5.36 -0.58 -4.96 117.98 114.64 4aah s PHE 501 Ca 0.08 1.46 -0.24 0.00 -0.96 0.00 0.00 56.93 57.27 4aah s PHE 501 Cb -0.03 0.26 0.03 0.00 -0.34 0.00 0.00 43.02 42.95 4aah s PHE 501 CO -0.02 -0.32 0.87 0.21 -1.46 0.00 0.00 175.22 174.50 4aah s LYS 502 N 0.68 3.39 0.61 10.12 2.47 -1.26 -1.78 119.74 133.97 4aah s LYS 502 Ca -0.03 -0.14 -0.07 0.00 -1.56 0.00 0.00 55.97 54.17 4aah s LYS 502 Cb -0.05 -3.99 0.01 0.00 -1.46 0.00 0.00 37.83 32.34 4aah s LYS 502 CO -0.05 -1.28 0.93 -1.64 0.16 0.00 0.00 175.35 173.48 4aah s MET 503 N 3.60 2.92 0.21 4.03 -1.94 0.11 -5.00 119.30 123.24 4aah s MET 503 Ca 0.31 0.08 -0.10 0.00 -1.71 0.00 0.00 55.69 54.27 4aah s MET 503 Cb -0.12 -2.23 0.22 0.00 2.01 0.00 0.00 34.83 34.71 4aah s MET 503 CO 0.22 -0.75 1.81 -1.35 -0.01 0.00 0.00 175.02 174.94 4aah h PRO 504 N -0.25 0.68 -4.60 2.03 0.11 -1.97 -3.45 132.00 124.55 4aah h PRO 504 Ca -0.45 -0.04 -0.23 0.00 0.11 0.00 0.00 66.00 65.39 4aah h PRO 504 Cb 1.25 -0.15 -0.15 0.00 0.11 0.00 0.00 31.00 32.06 4aah h PRO 504 CO 0.61 0.45 -0.67 0.45 -0.21 0.00 0.00 178.00 178.63 4aah s SER 505 N -5.61 0.89 0.91 -2.05 0.15 -1.26 -4.66 113.70 102.06 4aah s SER 505 Ca -0.13 -1.12 -0.11 0.00 0.70 0.00 0.00 55.95 55.29 4aah s SER 505 Cb 0.16 0.17 0.12 0.00 -1.71 0.00 0.00 66.02 64.75 4aah s SER 505 CO 0.76 -0.59 1.03 0.61 1.20 0.00 0.00 173.24 176.25 4aah n GLY 506 N -0.11 -0.61 3.49 9.45 0.00 -1.25 -4.06 105.19 112.10 4aah n GLY 506 Ca -0.09 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 4aah n GLY 506 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4aah s GLY 507 N -2.45 1.59 0.00 -0.02 0.00 0.11 -0.91 107.32 105.65 4aah s GLY 507 Ca 0.66 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 44.46 4aah s GLY 507 CO 0.59 -0.61 0.99 0.29 0.00 0.00 0.00 173.10 174.36 4aah n ILE 508 N 2.54 0.96 -3.93 0.90 -5.35 -1.26 -4.06 119.36 109.16 4aah n ILE 508 Ca -0.18 -0.98 -0.12 0.00 -0.27 0.00 0.00 62.75 61.20 4aah n ILE 508 Cb 0.52 0.52 -0.01 0.00 -1.74 0.00 0.00 39.64 38.93 4aah n ILE 508 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 4aah n GLY 509 N -0.45 3.34 3.51 3.28 0.00 -1.25 -4.18 105.19 109.44 4aah n GLY 509 Ca 0.00 -2.25 -0.31 0.00 0.00 0.00 0.00 46.02 43.47 4aah n GLY 509 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4aah s SER 510 N -2.28 4.10 0.85 1.61 0.15 -1.22 -4.24 113.70 112.67 4aah s SER 510 Ca 0.08 -0.37 -0.11 0.00 0.70 0.00 0.00 55.95 56.25 4aah s SER 510 Cb -0.01 -0.75 0.10 0.00 -1.71 0.00 0.00 66.02 63.66 4aah s SER 510 CO 0.05 0.24 1.10 -2.84 1.20 0.00 0.00 173.24 172.99 4aah s PRO 511 N -1.67 1.60 0.20 5.44 0.02 -1.26 -4.56 135.00 134.77 4aah s PRO 511 Ca 0.17 1.21 0.01 0.00 0.02 0.00 0.00 61.00 62.41 4aah s PRO 511 Cb -0.11 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 4aah s PRO 511 CO 0.08 -2.12 0.05 0.00 -0.33 0.00 0.00 177.00 174.69 4aah s MET 512 N -4.82 1.20 0.02 5.54 0.23 -0.39 -4.72 119.30 116.36 4aah s MET 512 Ca 0.63 -1.61 -0.06 0.00 -1.03 0.00 0.00 55.69 53.63 4aah s MET 512 Cb -0.19 -0.15 -0.01 0.00 -1.53 0.00 0.00 34.83 32.96 4aah s MET 512 CO 0.57 -0.23 0.10 -0.08 -2.03 0.00 0.00 175.02 173.36 4aah s THR 513 N -3.79 0.11 0.27 3.16 -1.32 -1.26 -1.12 115.64 111.68 4aah s THR 513 Ca 0.30 -0.90 -0.19 0.00 -1.21 0.00 0.00 61.69 59.69 4aah s THR 513 Cb 0.07 -0.64 0.01 0.00 -1.51 0.00 0.00 72.50 70.44 4aah s THR 513 CO 0.08 -0.50 0.66 -0.72 -2.21 0.00 0.00 174.62 171.93 4aah s TYR 514 N -1.98 -0.05 0.00 9.09 1.13 -0.45 -4.72 117.35 120.38 4aah s TYR 514 Ca -0.10 -0.39 0.06 0.00 -1.41 0.00 0.00 57.07 55.23 4aah s TYR 514 Cb -0.05 0.57 -0.02 0.00 -1.10 0.00 0.00 41.96 41.37 4aah s TYR 514 CO -0.02 -1.18 -0.20 0.45 -2.51 0.00 0.00 175.55 172.10 4aah s SER 515 N -2.95 2.35 -0.13 -0.18 0.15 -0.27 -0.30 113.70 112.38 4aah s SER 515 Ca 0.14 -0.41 -0.05 0.00 0.70 0.00 0.00 55.95 56.33 4aah s SER 515 Cb -0.05 -0.24 0.06 0.00 -1.71 0.00 0.00 66.02 64.08 4aah s SER 515 CO 0.08 0.21 0.28 0.12 1.20 0.00 0.00 173.24 175.13 4aah s PHE 516 N -0.57 -0.43 -1.35 3.44 5.36 -0.00 -4.73 117.98 119.70 4aah s PHE 516 Ca 0.07 0.96 -0.15 0.00 -0.96 0.00 0.00 56.93 56.86 4aah s PHE 516 Cb -0.08 0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.65 4aah s PHE 516 CO 0.00 -0.32 0.43 1.63 -1.46 0.00 0.00 175.22 175.50 4aah n LYS 517 N 4.90 -1.25 -1.38 10.12 4.76 -1.26 -0.09 118.16 133.96 4aah n LYS 517 Ca -0.14 0.20 -0.13 0.00 -2.87 0.00 0.00 58.31 55.37 4aah n LYS 517 Cb 0.51 -3.51 -0.06 0.00 -1.84 0.00 0.00 35.03 30.14 4aah n LYS 517 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 4aah n GLY 518 N -2.17 1.38 3.20 0.72 0.00 -1.26 -5.00 105.19 102.06 4aah n GLY 518 Ca -0.22 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 4aah n GLY 518 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 4aah s LYS 519 N -3.06 1.93 -0.05 1.61 2.20 0.88 -5.11 119.74 118.14 4aah s LYS 519 Ca 0.00 -0.73 -0.22 0.00 -0.36 0.00 0.00 55.97 54.66 4aah s LYS 519 Cb 0.00 -1.73 -0.04 0.00 -1.51 0.00 0.00 37.83 34.55 4aah s LYS 519 CO 0.00 0.35 0.66 -1.14 -0.36 0.00 0.00 175.35 174.86 4aah s GLN 520 N -0.20 4.41 0.06 4.03 0.74 -1.26 -0.82 119.66 126.62 4aah s GLN 520 Ca 0.00 0.82 0.07 0.00 0.05 0.00 0.00 55.36 56.30 4aah s GLN 520 Cb -0.11 -3.42 -0.03 0.00 1.10 0.00 0.00 33.01 30.56 4aah s GLN 520 CO 0.01 0.16 -0.18 0.71 -0.55 0.00 0.00 175.29 175.44 4aah s TYR 521 N 0.48 1.60 -0.20 1.67 1.51 0.59 -4.51 117.35 118.48 4aah s TYR 521 Ca 0.35 -0.39 -0.05 0.00 -1.01 0.00 0.00 57.07 55.97 4aah s TYR 521 Cb -0.18 -0.92 -0.02 0.00 -0.11 0.00 0.00 41.96 40.73 4aah s TYR 521 CO 0.17 0.11 -0.01 0.42 -1.11 0.00 0.00 175.55 175.13 4aah s ILE 522 N -0.98 3.83 -0.10 2.71 -1.09 -0.81 -1.34 121.20 123.43 4aah s ILE 522 Ca 0.05 -0.35 -0.01 0.00 -2.23 0.00 0.00 60.65 58.10 4aah s ILE 522 Cb -0.09 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 38.03 4aah s ILE 522 CO 0.02 0.43 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.30 4aah s GLY 523 N 1.09 1.76 -0.07 6.18 0.00 -0.28 -0.69 107.32 115.31 4aah s GLY 523 Ca 0.02 -0.84 -0.06 0.00 0.00 0.00 0.00 44.72 43.84 4aah s GLY 523 CO 0.01 -0.48 0.19 -0.45 0.00 0.00 0.00 173.10 172.37 4aah s SER 524 N -0.54 -0.20 0.63 1.64 0.15 -0.47 -1.26 113.70 113.66 4aah s SER 524 Ca 0.09 0.38 -0.10 0.00 0.70 0.00 0.00 55.95 57.01 4aah s SER 524 Cb -0.12 0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 64.55 4aah s SER 524 CO 0.02 -0.07 1.02 -0.04 1.20 0.00 0.00 173.24 175.37 4aah s MET 525 N 0.16 3.31 -0.00 5.44 -1.94 -1.26 -1.67 119.30 123.34 4aah s MET 525 Ca -0.01 0.55 -0.11 0.00 -1.71 0.00 0.00 55.69 54.41 4aah s MET 525 Cb -0.02 -2.11 0.01 0.00 2.01 0.00 0.00 34.83 34.73 4aah s MET 525 CO -0.00 -0.69 0.21 1.52 -0.01 0.00 0.00 175.02 176.05 4aah s TYR 526 N -3.18 -0.05 0.00 -0.03 -0.85 0.07 -4.67 117.35 108.64 4aah s TYR 526 Ca 0.55 0.03 0.00 0.00 -0.52 0.00 0.00 57.07 57.14 4aah s TYR 526 Cb -0.11 0.01 0.00 0.00 0.38 0.00 0.00 41.96 42.25 4aah s TYR 526 CO 0.52 -0.33 0.00 0.41 -1.52 0.00 0.00 175.55 174.62 4aah n GLY 527 N 1.36 1.89 3.77 5.49 0.00 -0.08 -2.19 105.19 115.42 4aah n GLY 527 Ca -0.22 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 44.87 4aah n GLY 527 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4aah s VAL 528 N 0.00 3.19 -2.03 1.61 0.11 -0.96 -0.62 120.40 121.71 4aah s VAL 528 Ca 0.00 0.78 0.00 0.00 -2.93 0.00 0.00 61.98 59.83 4aah s VAL 528 Cb 0.00 -3.33 0.00 0.00 -1.53 0.00 0.00 36.38 31.52 4aah s VAL 528 CO 0.00 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.25 4aah n GLY 529 N 0.20 -0.65 7.00 6.54 0.00 -1.26 -3.47 105.19 113.54 4aah n GLY 529 Ca 0.10 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.67 4aah n GLY 529 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4aah n GLY 530 N 0.00 -1.89 0.31 -0.02 0.00 -1.26 -3.03 105.19 99.30 4aah n GLY 530 Ca 0.00 -1.37 0.01 0.00 0.00 0.00 0.00 46.02 44.67 4aah n GLY 530 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 4aah h TRP 531 N 0.00 0.93 -0.87 1.61 2.91 -1.95 -2.77 115.95 115.82 4aah h TRP 531 Ca 0.00 0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.11 4aah h TRP 531 Cb 0.00 -0.30 -0.06 0.00 -0.51 0.00 0.00 29.16 28.30 4aah h TRP 531 CO 0.00 0.45 0.57 -1.35 -1.03 0.00 0.00 178.44 177.07 4aah h PRO 532 N 0.90 0.94 -0.65 2.65 0.11 -1.94 -2.92 132.00 131.10 4aah h PRO 532 Ca 0.38 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.42 4aah h PRO 532 Cb 0.23 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.12 4aah h PRO 532 CO -0.19 0.62 0.01 0.41 -0.21 0.00 0.00 178.00 178.64 4aah n GLY 533 N -1.41 2.77 0.22 -0.55 0.00 -1.05 -4.56 105.19 100.62 4aah n GLY 533 Ca 0.13 -0.78 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 4aah n GLY 533 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 4aah h VAL 534 N 3.35 1.28 0.20 1.61 -1.51 -1.50 0.30 116.25 119.99 4aah h VAL 534 Ca 0.01 -1.40 -0.01 0.00 -1.23 0.00 0.00 66.70 64.07 4aah h VAL 534 Cb 1.77 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 32.41 4aah h VAL 534 CO 0.43 0.44 -0.10 1.23 -1.23 0.00 0.00 177.57 178.33 4aah h GLY 535 N 1.08 -0.28 1.16 5.19 0.00 -1.85 0.11 103.07 108.47 4aah h GLY 535 Ca 0.05 0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 4aah h GLY 535 CO 0.06 -0.10 0.37 -2.00 0.00 0.00 0.00 176.54 174.87 4aah h LEU 536 N -0.50 0.98 -0.12 3.11 5.85 -1.82 0.51 115.31 123.33 4aah h LEU 536 Ca -0.03 -0.11 -0.21 0.00 0.84 0.00 0.00 57.88 58.37 4aah h LEU 536 Cb 0.38 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 4aah h LEU 536 CO 0.05 0.83 -0.98 0.58 -0.34 0.00 0.00 178.44 178.57 4aah h VAL 537 N 1.08 1.60 -0.01 1.05 2.07 -0.26 -3.33 116.25 118.44 4aah h VAL 537 Ca 0.26 -3.03 0.00 0.00 0.82 0.00 0.00 66.70 64.75 4aah h VAL 537 Cb 0.10 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 4aah h VAL 537 CO -0.03 0.87 -0.05 0.49 0.02 0.00 0.00 177.57 178.87 4aah n PHE 538 N -3.51 0.00 -2.24 1.57 3.72 0.37 -5.00 117.46 112.38 4aah n PHE 538 Ca -0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.33 4aah n PHE 538 Cb 0.89 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.45 4aah n PHE 538 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 4aah n ASP 539 N 0.42 -4.16 -4.69 4.37 9.92 0.15 -5.03 116.55 117.53 4aah n ASP 539 Ca 0.06 -0.23 -0.33 0.00 -0.53 0.00 0.00 54.79 53.75 4aah n ASP 539 Cb 0.26 -2.64 -0.09 0.00 -0.64 0.00 0.00 41.12 38.02 4aah n ASP 539 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 4aah s LEU 540 N -3.73 3.56 0.00 0.64 2.01 0.62 -4.98 118.68 116.81 4aah s LEU 540 Ca 0.15 0.05 0.00 0.00 0.01 0.00 0.00 54.13 54.34 4aah s LEU 540 Cb -0.02 -1.97 0.00 0.00 0.01 0.00 0.00 46.19 44.21 4aah s LEU 540 CO 0.32 0.31 0.00 0.35 1.01 0.00 0.00 176.35 178.34 4aah n THR 541 N 1.62 0.00 -2.22 5.49 -2.24 -1.26 -4.68 114.28 110.98 4aah n THR 541 Ca -0.16 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 4aah n THR 541 Cb 0.53 -0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 4aah n THR 541 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 4aah s ASP 542 N -2.26 6.82 0.36 3.42 2.15 -1.26 -4.91 116.67 121.00 4aah s ASP 542 Ca 0.00 2.00 0.06 0.00 0.43 0.00 0.00 52.55 55.04 4aah s ASP 542 Cb 0.00 -2.54 0.75 0.00 -0.30 0.00 0.00 42.92 40.83 4aah s ASP 542 CO 0.00 -0.81 1.94 1.55 -0.17 0.00 0.00 175.17 177.69 4aah h PRO 543 N 8.58 0.73 0.00 4.34 0.13 -1.95 -0.82 132.00 143.01 4aah h PRO 543 Ca -0.34 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.68 4aah h PRO 543 Cb 1.15 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 4aah h PRO 543 CO 0.95 0.48 -0.33 1.03 -0.23 0.00 0.00 178.00 179.90 4aah h SER 544 N 0.75 0.00 -4.20 1.44 0.87 -1.87 -1.75 113.55 108.79 4aah h SER 544 Ca 0.34 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.39 4aah h SER 544 Cb 0.33 0.00 0.17 0.00 -0.44 0.00 0.00 62.40 62.46 4aah h SER 544 CO -0.12 0.33 0.25 0.00 -0.53 0.00 0.00 176.83 176.76 4aah s ALA 545 N -3.11 1.68 -1.19 6.23 0.00 -0.31 -1.77 121.76 123.28 4aah s ALA 545 Ca 0.04 0.34 -0.07 0.00 0.00 0.00 0.00 51.96 52.27 4aah s ALA 545 Cb 0.07 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.86 4aah s ALA 545 CO 0.71 -2.38 1.04 0.41 0.00 0.00 0.00 175.76 175.54 4aah n GLY 546 N -0.49 -0.37 2.38 0.00 0.00 -1.26 -2.37 105.19 103.07 4aah n GLY 546 Ca 0.10 0.14 -0.18 0.00 0.00 0.00 0.00 46.02 46.08 4aah n GLY 546 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 4aah n LEU 547 N -4.45 -1.45 0.00 0.99 4.77 -1.24 -1.30 117.00 114.32 4aah n LEU 547 Ca -0.01 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 4aah n LEU 547 Cb 0.56 -2.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.09 4aah n LEU 547 CO 0.57 -0.55 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 4aah n GLY 548 N -0.63 1.40 0.27 -0.72 0.00 -0.73 -4.61 105.19 100.18 4aah n GLY 548 Ca -0.19 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.81 4aah n GLY 548 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4aah h ALA 549 N 0.00 1.25 -0.29 4.61 0.00 -1.23 -3.24 119.26 120.36 4aah h ALA 549 Ca 0.00 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.72 4aah h ALA 549 Cb 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 4aah h ALA 549 CO 0.00 0.50 -0.00 0.28 0.00 0.00 0.00 179.25 180.02 4aah h VAL 550 N 0.58 0.78 -0.09 0.00 2.07 -1.61 -2.19 116.25 115.78 4aah h VAL 550 Ca 0.12 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.63 4aah h VAL 550 Cb 0.40 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 4aah h VAL 550 CO 0.02 0.01 -0.07 1.23 0.02 0.00 0.00 177.57 178.79 4aah h GLY 551 N 0.08 0.02 0.22 2.17 0.00 -1.39 -2.84 103.07 101.33 4aah h GLY 551 Ca 0.14 0.08 0.07 0.00 0.00 0.00 0.00 47.33 47.62 4aah h GLY 551 CO -0.24 -0.08 -0.16 0.00 0.00 0.00 0.00 176.54 176.06 4aah h ALA 552 N 1.01 0.06 -0.74 3.60 0.00 -1.60 -2.98 119.26 118.62 4aah h ALA 552 Ca 0.06 0.11 -0.38 0.00 0.00 0.00 0.00 54.91 54.70 4aah h ALA 552 Cb 0.16 0.38 -0.22 0.00 0.00 0.00 0.00 17.79 18.11 4aah h ALA 552 CO -0.14 -0.56 0.48 1.19 0.00 0.00 0.00 179.25 180.22 4aah n PHE 553 N -5.33 2.29 -0.18 0.00 3.01 -0.85 -4.63 117.46 111.76 4aah n PHE 553 Ca 0.00 -1.48 -0.01 0.00 1.01 0.00 0.00 57.45 56.97 4aah n PHE 553 Cb 0.25 -0.76 0.09 0.00 -0.01 0.00 0.00 39.48 39.04 4aah n PHE 553 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 4aah h ARG 554 N 0.84 0.34 0.00 -1.08 0.11 -1.34 -2.30 114.38 110.95 4aah h ARG 554 Ca 0.46 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.52 4aah h ARG 554 Cb 2.39 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 33.39 4aah h ARG 554 CO 0.82 0.23 0.00 0.39 0.10 0.00 0.00 179.97 181.50 4aah n GLU 555 N -5.03 0.05 -0.26 0.08 1.02 -1.26 -3.88 120.64 111.36 4aah n GLU 555 Ca 0.07 0.29 0.05 0.00 -0.02 0.00 0.00 57.16 57.55 4aah n GLU 555 Cb 0.25 -1.59 0.29 0.00 -0.02 0.00 0.00 31.44 30.37 4aah n GLU 555 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 4aah h LEU 556 N 0.00 0.80 -1.93 -4.62 6.46 -1.78 -2.44 115.31 111.81 4aah h LEU 556 Ca 0.00 0.01 0.32 0.00 -0.12 0.00 0.00 57.88 58.09 4aah h LEU 556 Cb 0.28 -0.16 -0.05 0.00 -0.73 0.00 0.00 40.66 40.00 4aah h LEU 556 CO 0.00 0.51 0.80 -0.61 -0.62 0.00 0.00 178.44 178.52 4aah h GLN 557 N 0.90 0.04 -0.70 1.25 4.15 -1.75 0.47 115.11 119.48 4aah h GLN 557 Ca 0.37 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.78 4aah h GLN 557 Cb 0.26 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.94 4aah h GLN 557 CO -0.13 0.03 0.00 0.09 -1.93 0.00 0.00 178.83 176.88 4aah n ASN 558 N -4.24 3.87 0.00 -0.69 5.03 -0.92 -4.27 115.26 114.04 4aah n ASN 558 Ca 0.24 -2.06 0.00 0.00 0.87 0.00 0.00 54.58 53.64 4aah n ASN 558 Cb 1.16 -0.48 0.00 0.00 -1.02 0.00 0.00 39.78 39.44 4aah n ASN 558 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 4aah n HIS 559 N 1.50 0.00 -3.76 3.10 8.25 0.08 -5.11 115.22 119.28 4aah n HIS 559 Ca 0.24 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.61 4aah n HIS 559 Cb 0.63 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.71 4aah n HIS 559 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 4aah s THR 560 N -1.68 0.01 0.33 1.59 -1.32 -0.76 -4.83 115.64 108.99 4aah s THR 560 Ca 0.00 -0.79 0.03 0.00 -1.21 0.00 0.00 61.69 59.72 4aah s THR 560 Cb 0.00 -1.71 -0.04 0.00 -1.51 0.00 0.00 72.50 69.24 4aah s THR 560 CO 0.00 -0.04 0.13 -1.10 -2.21 0.00 0.00 174.62 171.40 4aah s GLN 561 N -3.88 1.69 1.13 7.08 -1.52 -1.26 -4.29 119.66 118.59 4aah s GLN 561 Ca 0.10 -1.98 -0.14 0.00 -1.95 0.00 0.00 55.36 51.39 4aah s GLN 561 Cb -0.03 -0.41 0.22 0.00 -0.22 0.00 0.00 33.01 32.57 4aah s GLN 561 CO 0.01 -0.39 0.76 -1.33 -0.25 0.00 0.00 175.29 174.09 4aah n MET 562 N -0.69 -1.97 -3.79 2.91 2.81 -1.26 -4.58 117.12 110.56 4aah n MET 562 Ca -0.02 -0.54 0.02 0.00 -1.81 0.00 0.00 57.70 55.35 4aah n MET 562 Cb 0.65 -2.07 0.01 0.00 -0.71 0.00 0.00 33.22 31.11 4aah n MET 562 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 4aah n GLY 563 N 1.20 0.29 3.12 3.03 0.00 -1.26 -4.81 105.19 106.75 4aah n GLY 563 Ca 0.04 -1.04 0.05 0.00 0.00 0.00 0.00 46.02 45.07 4aah n GLY 563 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4aah s GLY 564 N -3.71 -0.99 0.00 -0.02 0.00 -1.25 -3.81 107.32 97.55 4aah s GLY 564 Ca 0.27 2.01 0.00 0.00 0.00 0.00 0.00 44.72 47.00 4aah s GLY 564 CO -0.00 4.12 0.00 0.61 0.00 0.00 0.00 173.10 177.83 4aah n GLY 565 N 4.99 -0.84 3.16 0.20 0.00 -0.93 -1.00 105.19 110.76 4aah n GLY 565 Ca 0.09 -0.83 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 4aah n GLY 565 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 4aah s LEU 566 N 0.00 2.06 -0.02 0.99 2.96 0.83 -0.75 118.68 124.74 4aah s LEU 566 Ca 0.00 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.63 4aah s LEU 566 Cb 0.00 -0.83 -0.01 0.00 0.50 0.00 0.00 46.19 45.84 4aah s LEU 566 CO 0.00 0.18 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.99 4aah s MET 567 N -0.53 1.63 0.00 1.98 -1.94 -0.67 -0.69 119.30 119.09 4aah s MET 567 Ca 0.06 -0.66 0.08 0.00 -1.71 0.00 0.00 55.69 53.46 4aah s MET 567 Cb -0.07 -1.52 -0.02 0.00 2.01 0.00 0.00 34.83 35.23 4aah s MET 567 CO -0.00 0.36 -0.24 0.08 -0.01 0.00 0.00 175.02 175.21 4aah s VAL 568 N -0.29 2.28 0.23 -6.03 1.01 -0.74 -1.37 120.40 115.49 4aah s VAL 568 Ca 0.04 -1.17 0.06 0.00 0.00 0.00 0.00 61.98 60.91 4aah s VAL 568 Cb -0.09 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 4aah s VAL 568 CO 0.00 0.48 -0.07 -0.36 0.00 0.00 0.00 175.10 175.16 4aah s PHE 569 N -0.72 1.70 -0.05 5.22 0.40 0.13 -0.59 117.98 124.07 4aah s PHE 569 Ca 0.11 -0.74 -0.30 0.00 -0.60 0.00 0.00 56.93 55.41 4aah s PHE 569 Cb -0.10 -0.93 0.10 0.00 0.51 0.00 0.00 43.02 42.60 4aah s PHE 569 CO 0.01 0.19 1.33 -1.54 0.70 0.00 0.00 175.22 175.91 4aah s SER 570 N -3.34 0.00 0.00 1.36 1.04 -0.74 -1.92 113.70 110.10 4aah s SER 570 Ca 0.26 -0.11 0.31 0.00 0.48 0.00 0.00 55.95 56.89 4aah s SER 570 Cb 0.03 0.08 1.60 0.00 0.10 0.00 0.00 66.02 67.83 4aah s SER 570 CO 0.08 -0.16 2.06 0.18 0.98 0.00 0.00 173.24 176.38