#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hr6 h ASP 17 N 0.00 0.28 -0.38 1.09 3.32 -2.01 -3.46 116.42 115.26 1hr6 h ASP 17 Ca 0.00 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 1hr6 h ASP 17 Cb 0.00 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1hr6 h ASP 17 CO 0.00 0.31 -0.04 -3.20 -1.72 0.00 0.00 179.24 174.59 1hr6 n ASN 18 N -4.86 -1.50 -4.68 6.45 5.15 -1.26 -0.83 115.26 113.72 1hr6 n ASN 18 Ca -0.03 -0.01 -0.42 0.00 -0.60 0.00 0.00 54.58 53.52 1hr6 n ASN 18 Cb 0.09 -0.84 -0.03 0.00 -0.53 0.00 0.00 39.78 38.47 1hr6 n ASN 18 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 1hr6 s PHE 19 N -2.20 3.28 -0.01 1.20 5.36 -1.26 -3.95 117.98 120.39 1hr6 s PHE 19 Ca 0.01 1.34 0.03 0.00 -0.96 0.00 0.00 56.93 57.34 1hr6 s PHE 19 Cb -0.00 -3.34 -0.00 0.00 -0.34 0.00 0.00 43.02 39.33 1hr6 s PHE 19 CO 0.01 -0.93 -0.09 0.15 -1.46 0.00 0.00 175.22 172.89 1hr6 s LYS 20 N 2.31 0.81 -0.01 10.12 1.02 -0.18 -4.99 119.74 128.82 1hr6 s LYS 20 Ca 0.53 -0.32 0.02 0.00 0.02 0.00 0.00 55.97 56.21 1hr6 s LYS 20 Cb -0.22 -0.78 -0.00 0.00 -0.52 0.00 0.00 37.83 36.32 1hr6 s LYS 20 CO 0.19 0.17 -0.06 -1.17 -0.92 0.00 0.00 175.35 173.56 1hr6 s LEU 21 N -0.09 1.92 0.33 3.17 2.96 -1.26 -1.06 118.68 124.65 1hr6 s LEU 21 Ca 0.02 -0.12 -0.14 0.00 -0.22 0.00 0.00 54.13 53.66 1hr6 s LEU 21 Cb -0.05 -0.35 0.03 0.00 0.50 0.00 0.00 46.19 46.31 1hr6 s LEU 21 CO -0.00 0.06 0.67 -0.94 -1.32 0.00 0.00 176.35 174.82 1hr6 s SER 22 N -0.02 0.09 0.20 3.68 1.04 -0.73 -5.00 113.70 112.96 1hr6 s SER 22 Ca 0.01 -1.05 0.09 0.00 0.48 0.00 0.00 55.95 55.48 1hr6 s SER 22 Cb -0.04 0.75 -0.04 0.00 0.10 0.00 0.00 66.02 66.78 1hr6 s SER 22 CO -0.00 -1.46 -0.18 -0.44 0.98 0.00 0.00 173.24 172.14 1hr6 s SER 23 N -3.06 2.86 0.48 7.02 0.01 -1.26 0.18 113.70 119.93 1hr6 s SER 23 Ca 0.18 -0.93 -0.01 0.00 1.31 0.00 0.00 55.95 56.51 1hr6 s SER 23 Cb -0.04 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1hr6 s SER 23 CO 0.12 -0.04 0.72 -0.76 0.41 0.00 0.00 173.24 173.68 1hr6 s LEU 24 N -2.96 3.55 0.44 2.44 1.43 -0.16 -4.95 118.68 118.47 1hr6 s LEU 24 Ca 0.20 0.34 0.15 0.00 -1.03 0.00 0.00 54.13 53.79 1hr6 s LEU 24 Cb -0.05 -3.21 1.06 0.00 0.03 0.00 0.00 46.19 44.03 1hr6 s LEU 24 CO 0.08 -0.79 1.97 0.00 0.23 0.00 0.00 176.35 177.84 1hr6 h ALA 25 N 0.28 2.07 -0.02 4.21 0.00 -1.90 1.00 119.26 124.90 1hr6 h ALA 25 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hr6 h ALA 25 Cb 1.26 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1hr6 h ALA 25 CO 0.58 -0.22 0.00 0.27 0.00 0.00 0.00 179.25 179.87 1hr6 n ASN 26 N -4.47 0.13 0.00 0.00 0.23 -1.26 -4.88 115.26 105.02 1hr6 n ASN 26 Ca 0.11 -1.72 0.00 0.00 -0.53 0.00 0.00 54.58 52.44 1hr6 n ASN 26 Cb 0.42 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 1hr6 n ASN 26 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hr6 n GLY 27 N 0.68 0.78 3.69 4.83 0.00 0.35 -3.81 105.19 111.70 1hr6 n GLY 27 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1hr6 n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1hr6 s LEU 28 N 0.00 4.36 0.19 0.99 2.96 -1.20 -4.43 118.68 121.54 1hr6 s LEU 28 Ca 0.00 2.42 -0.20 0.00 -0.22 0.00 0.00 54.13 56.13 1hr6 s LEU 28 Cb 0.00 -3.56 -0.08 0.00 0.50 0.00 0.00 46.19 43.05 1hr6 s LEU 28 CO 0.00 -0.85 0.69 -0.54 -1.32 0.00 0.00 176.35 174.33 1hr6 s LYS 29 N 2.53 4.26 -0.16 1.98 1.02 -1.16 -0.98 119.74 127.23 1hr6 s LYS 29 Ca 0.72 0.85 0.00 0.00 0.02 0.00 0.00 55.97 57.56 1hr6 s LYS 29 Cb -0.38 -2.99 0.03 0.00 -0.52 0.00 0.00 37.83 33.97 1hr6 s LYS 29 CO 0.31 0.46 -0.13 0.08 -0.92 0.00 0.00 175.35 175.15 1hr6 s VAL 30 N -1.41 1.57 -0.09 3.17 1.01 0.13 -1.00 120.40 123.77 1hr6 s VAL 30 Ca 0.39 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1hr6 s VAL 30 Cb -0.18 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.70 1hr6 s VAL 30 CO 0.21 0.39 -0.19 0.00 0.00 0.00 0.00 175.10 175.51 1hr6 s ALA 31 N 1.48 1.83 0.14 5.51 0.00 0.04 -1.76 121.76 128.99 1hr6 s ALA 31 Ca 0.04 -0.77 0.07 0.00 0.00 0.00 0.00 51.96 51.30 1hr6 s ALA 31 Cb -0.14 -0.74 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 1hr6 s ALA 31 CO -0.10 0.17 -0.16 0.95 0.00 0.00 0.00 175.76 176.62 1hr6 s THR 32 N 0.55 1.59 0.21 0.00 -4.23 -0.23 -0.81 115.64 112.72 1hr6 s THR 32 Ca -0.15 -1.82 -0.19 0.00 -1.18 0.00 0.00 61.69 58.34 1hr6 s THR 32 Cb -0.17 -1.70 0.03 0.00 1.34 0.00 0.00 72.50 72.00 1hr6 s THR 32 CO 0.05 -0.36 0.57 -0.94 -0.54 0.00 0.00 174.62 173.41 1hr6 s SER 33 N -2.56 -0.30 0.24 3.99 1.04 -0.90 -1.01 113.70 114.20 1hr6 s SER 33 Ca 0.13 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1hr6 s SER 33 Cb -0.05 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1hr6 s SER 33 CO 0.05 -1.10 0.00 -3.20 0.98 0.00 0.00 173.24 169.97 1hr6 n ASN 34 N -0.37 -4.23 -4.72 7.02 2.85 -0.01 -1.89 115.26 113.90 1hr6 n ASN 34 Ca -0.10 0.65 -0.31 0.00 -0.11 0.00 0.00 54.58 54.72 1hr6 n ASN 34 Cb 0.62 -1.84 -0.08 0.00 1.24 0.00 0.00 39.78 39.72 1hr6 n ASN 34 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 1hr6 s THR 35 N -1.31 1.46 0.45 -0.44 -4.23 -1.26 -4.48 115.64 105.83 1hr6 s THR 35 Ca 0.00 -1.97 -0.24 0.00 -1.18 0.00 0.00 61.69 58.30 1hr6 s THR 35 Cb 0.00 -2.44 -0.09 0.00 1.34 0.00 0.00 72.50 71.31 1hr6 s THR 35 CO 0.00 0.00 1.09 -2.65 -0.54 0.00 0.00 174.62 172.52 1hr6 n PRO 36 N -1.19 1.46 -0.07 3.99 -0.02 -1.26 -4.30 135.00 133.60 1hr6 n PRO 36 Ca -0.14 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1hr6 n PRO 36 Cb 0.67 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1hr6 n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hr6 n GLY 37 N 1.08 4.39 0.25 -1.23 0.00 -1.26 -5.03 105.19 103.39 1hr6 n GLY 37 Ca 0.09 -1.20 0.17 0.00 0.00 0.00 0.00 46.02 45.07 1hr6 n GLY 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1hr6 h HIS 38 N 0.04 0.00 -2.21 1.61 3.86 -1.99 -3.47 115.15 113.00 1hr6 h HIS 38 Ca 0.00 0.00 0.23 0.00 -1.16 0.00 0.00 60.37 59.44 1hr6 h HIS 38 Cb 0.00 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.40 1hr6 h HIS 38 CO 0.00 0.00 0.66 -0.59 0.86 0.00 0.00 177.93 178.86 1hr6 s PHE 39 N -3.63 -0.00 0.42 2.45 -0.12 -1.26 -4.66 117.98 111.17 1hr6 s PHE 39 Ca 0.01 -0.27 0.06 0.00 -0.05 0.00 0.00 56.93 56.68 1hr6 s PHE 39 Cb 0.09 0.63 -0.07 0.00 -0.63 0.00 0.00 43.02 43.04 1hr6 s PHE 39 CO 0.50 -0.67 0.01 -1.12 -0.05 0.00 0.00 175.22 173.89 1hr6 s SER 40 N -3.28 3.82 0.03 1.98 0.01 0.35 -4.85 113.70 111.76 1hr6 s SER 40 Ca 0.19 -1.40 0.01 0.00 1.31 0.00 0.00 55.95 56.06 1hr6 s SER 40 Cb -0.00 -0.28 -0.02 0.00 0.21 0.00 0.00 66.02 65.93 1hr6 s SER 40 CO 0.02 -0.50 -0.05 0.00 0.41 0.00 0.00 173.24 173.11 1hr6 s ALA 41 N -2.76 0.33 0.02 1.44 0.00 -1.03 -0.73 121.76 119.03 1hr6 s ALA 41 Ca 0.32 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.44 1hr6 s ALA 41 Cb 0.09 0.07 0.06 0.00 0.00 0.00 0.00 23.12 23.34 1hr6 s ALA 41 CO 0.16 -0.06 0.57 -0.48 0.00 0.00 0.00 175.76 175.94 1hr6 s LEU 42 N -1.28 -0.25 0.12 0.00 2.34 -0.23 -0.74 118.68 118.64 1hr6 s LEU 42 Ca -0.11 0.34 -0.25 0.00 0.06 0.00 0.00 54.13 54.17 1hr6 s LEU 42 Cb -0.08 2.25 0.08 0.00 -0.56 0.00 0.00 46.19 47.87 1hr6 s LEU 42 CO -0.00 -0.69 0.69 -0.83 -1.06 0.00 0.00 176.35 174.46 1hr6 s GLY 43 N -1.73 -0.55 -0.15 -3.48 0.00 -0.68 -1.20 107.32 99.52 1hr6 s GLY 43 Ca -0.07 0.61 -0.02 0.00 0.00 0.00 0.00 44.72 45.24 1hr6 s GLY 43 CO 0.02 0.20 -0.09 1.08 0.00 0.00 0.00 173.10 174.31 1hr6 s LEU 44 N -2.68 2.92 -0.16 0.66 1.43 0.32 -1.47 118.68 119.70 1hr6 s LEU 44 Ca 0.03 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.85 1hr6 s LEU 44 Cb -0.01 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.52 1hr6 s LEU 44 CO -0.11 0.14 -0.14 -0.31 0.23 0.00 0.00 176.35 176.15 1hr6 s TYR 45 N 0.53 2.80 -0.12 0.29 1.51 0.89 -0.85 117.35 122.40 1hr6 s TYR 45 Ca -0.06 -1.03 0.00 0.00 -1.01 0.00 0.00 57.07 54.97 1hr6 s TYR 45 Cb -0.15 -1.91 -0.02 0.00 -0.11 0.00 0.00 41.96 39.77 1hr6 s TYR 45 CO 0.03 -0.48 -0.12 0.42 -1.11 0.00 0.00 175.55 174.29 1hr6 s ILE 46 N 0.87 3.12 -1.24 2.71 1.01 -0.17 -0.38 121.20 127.12 1hr6 s ILE 46 Ca -0.04 -0.65 -0.20 0.00 0.00 0.00 0.00 60.65 59.77 1hr6 s ILE 46 Cb -0.15 -2.30 -0.00 0.00 0.01 0.00 0.00 42.46 40.02 1hr6 s ILE 46 CO -0.01 0.53 1.85 -0.67 0.00 0.00 0.00 174.94 176.64 1hr6 n ASP 47 N 3.30 4.06 -2.93 3.58 -0.08 -0.70 -3.26 116.55 120.51 1hr6 n ASP 47 Ca -0.18 -2.82 -0.16 0.00 -1.51 0.00 0.00 54.79 50.12 1hr6 n ASP 47 Cb 0.53 -1.72 -0.06 0.00 2.34 0.00 0.00 41.12 42.21 1hr6 n ASP 47 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1hr6 n ALA 48 N 10.61 0.40 0.00 -1.67 0.00 -1.26 -4.99 120.51 123.60 1hr6 n ALA 48 Ca 0.48 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 52.26 1hr6 n ALA 48 Cb 0.46 1.34 0.00 0.00 0.00 0.00 0.00 19.45 21.25 1hr6 n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hr6 n GLY 49 N -0.55 1.55 0.31 0.00 0.00 -1.26 -1.54 105.19 103.70 1hr6 n GLY 49 Ca 0.05 -1.41 0.14 0.00 0.00 0.00 0.00 46.02 44.80 1hr6 n GLY 49 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1hr6 h SER 50 N 0.00 0.00 0.41 1.61 4.64 -1.18 -2.14 113.55 116.88 1hr6 h SER 50 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hr6 h SER 50 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1hr6 h SER 50 CO 0.00 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 173.85 1hr6 n ARG 51 N -4.25 0.16 0.00 4.77 1.85 -0.61 -2.09 116.66 116.49 1hr6 n ARG 51 Ca 0.01 0.50 0.11 0.00 -1.00 0.00 0.00 57.85 57.47 1hr6 n ARG 51 Cb 0.27 -1.88 0.07 0.00 -1.05 0.00 0.00 32.46 29.87 1hr6 n ARG 51 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1hr6 n PHE 52 N -2.19 0.00 0.28 2.89 3.72 -0.80 -4.29 117.46 117.07 1hr6 n PHE 52 Ca 0.01 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.56 1hr6 n PHE 52 Cb 0.14 0.00 0.48 0.00 -0.94 0.00 0.00 39.48 39.16 1hr6 n PHE 52 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1hr6 h GLU 53 N 3.82 0.00 0.00 -1.08 5.08 -1.52 -3.49 114.58 117.39 1hr6 h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1hr6 h GLU 53 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1hr6 h GLU 53 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1hr6 n GLY 54 N 0.47 1.70 0.07 -3.84 0.00 -1.26 -1.45 105.19 100.88 1hr6 n GLY 54 Ca 0.02 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.44 1hr6 n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hr6 n ARG 55 N 5.77 1.23 0.17 1.61 1.74 -1.26 -4.40 116.66 121.52 1hr6 n ARG 55 Ca 0.00 -0.03 0.02 0.00 -0.77 0.00 0.00 57.85 57.06 1hr6 n ARG 55 Cb 0.00 -1.41 0.29 0.00 -1.02 0.00 0.00 32.46 30.31 1hr6 n ARG 55 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1hr6 h ASN 56 N 0.00 0.00 -0.16 0.55 -0.26 -1.99 -3.27 115.58 110.46 1hr6 h ASN 56 Ca -0.36 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 55.32 1hr6 h ASN 56 Cb 1.79 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 39.02 1hr6 h ASN 56 CO 0.02 0.47 -0.17 0.18 -1.06 0.00 0.00 177.43 176.87 1hr6 n LEU 57 N -3.85 3.29 -4.69 1.61 4.77 -0.53 -5.04 117.00 112.55 1hr6 n LEU 57 Ca -0.01 -3.54 -0.44 0.00 -0.03 0.00 0.00 56.01 51.98 1hr6 n LEU 57 Cb 0.51 -0.55 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1hr6 n LEU 57 CO 0.40 1.09 1.31 1.17 -1.33 0.00 0.00 177.39 180.02 1hr6 n LYS 58 N -1.10 2.43 -0.73 3.23 3.00 -1.24 -1.43 118.16 122.33 1hr6 n LYS 58 Ca 0.23 0.88 0.00 0.00 -0.00 0.00 0.00 58.31 59.42 1hr6 n LYS 58 Cb 0.83 -2.69 0.00 0.00 0.00 0.00 0.00 35.03 33.16 1hr6 n LYS 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1hr6 n GLY 59 N 3.76 1.23 0.23 3.14 0.00 -1.26 -4.91 105.19 107.38 1hr6 n GLY 59 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 1hr6 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hr6 h THR 61 N 0.53 1.04 -0.18 0.00 2.02 -1.91 -1.39 112.91 113.02 1hr6 h THR 61 Ca 0.04 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1hr6 h THR 61 Cb 0.93 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1hr6 h THR 61 CO 0.08 0.04 0.08 -0.74 0.37 0.00 0.00 175.52 175.35 1hr6 h HIS 62 N 0.17 0.26 -0.83 3.16 6.17 -1.95 -1.92 115.15 120.20 1hr6 h HIS 62 Ca 0.05 -0.02 0.04 0.00 0.71 0.00 0.00 60.37 61.15 1hr6 h HIS 62 Cb -0.01 -0.08 -0.05 0.00 2.52 0.00 0.00 27.41 29.79 1hr6 h HIS 62 CO -0.07 0.30 0.53 0.82 0.71 0.00 0.00 177.93 180.22 1hr6 h ILE 63 N 0.15 1.10 -0.72 6.26 1.08 -1.37 -1.16 117.51 122.84 1hr6 h ILE 63 Ca 0.06 -0.35 -0.04 0.00 -0.39 0.00 0.00 64.86 64.14 1hr6 h ILE 63 Cb 0.14 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 33.86 1hr6 h ILE 63 CO -0.01 0.18 0.29 -0.07 -0.69 0.00 0.00 178.15 177.86 1hr6 h LEU 64 N 1.01 0.98 -0.91 1.44 3.38 -1.00 -0.63 115.31 119.59 1hr6 h LEU 64 Ca 0.34 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 1hr6 h LEU 64 Cb 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1hr6 h LEU 64 CO -0.13 0.87 -0.40 -2.24 0.09 0.00 0.00 178.44 176.63 1hr6 h ASP 65 N 1.05 0.00 1.41 -0.43 3.04 -0.55 -1.07 116.42 119.86 1hr6 h ASP 65 Ca 0.24 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.03 1hr6 h ASP 65 Cb 0.20 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.49 1hr6 h ASP 65 CO -0.02 0.40 0.00 -0.09 -2.04 0.00 0.00 179.24 177.49 1hr6 h ARG 66 N 0.00 0.00 -0.00 4.15 9.65 -0.64 -2.86 114.38 124.68 1hr6 h ARG 66 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1hr6 h ARG 66 Cb 0.92 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 1hr6 h ARG 66 CO 0.05 0.00 -0.66 -0.11 2.80 0.00 0.00 179.97 182.05 1hr6 n LEU 67 N -2.30 0.94 -4.64 3.80 7.94 -0.30 -4.97 117.00 117.47 1hr6 n LEU 67 Ca 0.05 -0.32 -0.43 0.00 -1.11 0.00 0.00 56.01 54.21 1hr6 n LEU 67 Cb 0.41 -0.11 -0.00 0.00 0.53 0.00 0.00 43.42 44.25 1hr6 n LEU 67 CO 0.29 0.21 0.71 0.00 -1.11 0.00 0.00 177.39 177.49 1hr6 n ALA 68 N -1.22 0.51 -2.56 1.96 0.00 -0.73 -3.03 120.51 115.43 1hr6 n ALA 68 Ca 0.06 0.33 -0.20 0.00 0.00 0.00 0.00 53.44 53.63 1hr6 n ALA 68 Cb 0.35 -2.13 0.01 0.00 0.00 0.00 0.00 19.45 17.67 1hr6 n ALA 68 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1hr6 n PHE 69 N 0.05 -1.22 -1.51 0.00 3.72 -1.26 -5.01 117.46 112.23 1hr6 n PHE 69 Ca 0.08 0.16 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 1hr6 n PHE 69 Cb 0.36 -3.92 0.00 0.00 -0.94 0.00 0.00 39.48 34.98 1hr6 n PHE 69 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1hr6 n LYS 70 N -3.16 2.95 -2.13 -1.08 4.76 -1.17 -4.63 118.16 113.70 1hr6 n LYS 70 Ca -0.19 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 54.90 1hr6 n LYS 70 Cb 0.65 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.86 1hr6 n LYS 70 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1hr6 s SER 71 N -1.00 5.46 0.43 4.39 1.04 -1.26 -4.74 113.70 118.01 1hr6 s SER 71 Ca 0.00 2.26 0.04 0.00 0.48 0.00 0.00 55.95 58.73 1hr6 s SER 71 Cb 0.00 -2.59 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 1hr6 s SER 71 CO 0.00 -1.41 0.14 0.42 0.98 0.00 0.00 173.24 173.37 1hr6 s THR 72 N -1.72 0.55 0.32 2.02 -4.23 -0.09 -1.48 115.64 111.01 1hr6 s THR 72 Ca 0.75 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 1hr6 s THR 72 Cb -0.27 -2.28 0.23 0.00 1.34 0.00 0.00 72.50 71.53 1hr6 s THR 72 CO 0.30 0.00 1.95 -0.33 -0.54 0.00 0.00 174.62 176.01 1hr6 h GLU 73 N 1.71 0.89 -0.22 3.99 4.39 -1.08 -3.10 114.58 121.17 1hr6 h GLU 73 Ca -0.35 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.27 1hr6 h GLU 73 Cb 1.28 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1hr6 h GLU 73 CO 0.55 0.64 0.00 0.72 -1.16 0.00 0.00 179.01 179.77 1hr6 n HIS 74 N -4.39 0.28 -3.65 4.33 8.25 -1.26 -4.94 115.22 113.84 1hr6 n HIS 74 Ca 0.06 -0.24 -0.17 0.00 -0.26 0.00 0.00 57.72 57.11 1hr6 n HIS 74 Cb 0.08 -0.01 -0.16 0.00 1.12 0.00 0.00 29.99 31.03 1hr6 n HIS 74 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1hr6 s VAL 75 N -1.08 -0.25 0.71 1.59 1.01 -1.17 -5.13 120.40 116.07 1hr6 s VAL 75 Ca 0.22 0.31 -0.16 0.00 0.00 0.00 0.00 61.98 62.36 1hr6 s VAL 75 Cb 0.13 -0.32 0.03 0.00 0.00 0.00 0.00 36.38 36.22 1hr6 s VAL 75 CO 0.18 0.11 1.22 -1.61 0.00 0.00 0.00 175.10 175.01 1hr6 s GLU 76 N 2.28 2.25 0.18 2.72 0.41 -1.26 -0.92 118.70 124.36 1hr6 s GLU 76 Ca 0.03 1.82 -0.13 0.00 -0.41 0.00 0.00 54.97 56.29 1hr6 s GLU 76 Cb -0.12 -1.84 0.16 0.00 -1.78 0.00 0.00 34.13 30.55 1hr6 s GLU 76 CO -0.06 -1.77 1.76 0.78 -0.49 0.00 0.00 175.26 175.48 1hr6 h GLY 77 N -0.09 0.67 0.96 -1.39 0.00 -1.91 -0.42 103.07 100.90 1hr6 h GLY 77 Ca -0.48 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 46.71 1hr6 h GLY 77 CO 0.50 0.04 0.20 -0.09 0.00 0.00 0.00 176.54 177.20 1hr6 h ARG 78 N 0.40 0.64 -0.65 4.80 2.43 -1.96 -1.31 114.38 118.73 1hr6 h ARG 78 Ca 0.23 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1hr6 h ARG 78 Cb 0.22 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1hr6 h ARG 78 CO -0.21 0.55 0.36 0.00 -1.51 0.00 0.00 179.97 179.17 1hr6 h ALA 79 N 1.05 0.83 0.14 2.80 0.00 -1.81 0.13 119.26 122.40 1hr6 h ALA 79 Ca 0.15 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1hr6 h ALA 79 Cb 0.13 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1hr6 h ALA 79 CO -0.02 0.34 -0.22 1.98 0.00 0.00 0.00 179.25 181.33 1hr6 h MET 80 N 0.89 -0.41 -0.42 0.00 1.85 -0.74 0.96 114.93 117.06 1hr6 h MET 80 Ca 0.23 0.03 0.03 0.00 -0.61 0.00 0.00 59.70 59.38 1hr6 h MET 80 Cb 0.03 0.09 -0.04 0.00 0.43 0.00 0.00 31.60 32.12 1hr6 h MET 80 CO -0.04 -0.28 0.21 0.00 -0.40 0.00 0.00 176.91 176.40 1hr6 h ALA 81 N 0.33 0.52 -0.44 0.39 0.00 -0.98 -0.94 119.26 118.13 1hr6 h ALA 81 Ca 0.02 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1hr6 h ALA 81 Cb 0.44 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1hr6 h ALA 81 CO -0.11 -0.15 -0.00 0.93 0.00 0.00 0.00 179.25 179.92 1hr6 h GLU 82 N 0.42 0.78 -0.56 0.00 5.08 -0.72 -1.56 114.58 118.03 1hr6 h GLU 82 Ca 0.18 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 1hr6 h GLU 82 Cb 0.08 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1hr6 h GLU 82 CO -0.12 0.85 0.07 1.15 -1.00 0.00 0.00 179.01 179.96 1hr6 h THR 83 N 0.62 1.24 -0.45 1.13 2.02 -0.63 -1.13 112.91 115.72 1hr6 h THR 83 Ca 0.12 -0.96 -0.06 0.00 0.77 0.00 0.00 66.41 66.29 1hr6 h THR 83 Cb 0.49 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1hr6 h THR 83 CO 0.02 0.35 0.03 -0.07 0.37 0.00 0.00 175.52 176.22 1hr6 h LEU 84 N 0.85 0.68 -0.06 2.58 3.38 -0.98 -0.86 115.31 120.91 1hr6 h LEU 84 Ca 0.17 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1hr6 h LEU 84 Cb 0.40 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1hr6 h LEU 84 CO 0.01 0.74 0.01 -0.33 0.09 0.00 0.00 178.44 178.96 1hr6 h GLU 85 N 0.69 0.09 0.00 1.13 5.08 -0.69 -0.88 114.58 119.99 1hr6 h GLU 85 Ca 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1hr6 h GLU 85 Cb 0.38 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1hr6 h GLU 85 CO 0.01 0.31 0.00 -0.07 -1.00 0.00 0.00 179.01 178.26 1hr6 h LEU 86 N -0.14 0.00 -0.60 1.33 3.38 -0.82 0.32 115.31 118.79 1hr6 h LEU 86 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1hr6 h LEU 86 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1hr6 h LEU 86 CO 0.00 0.00 -0.02 0.18 0.09 0.00 0.00 178.44 178.69 1hr6 n LEU 87 N -2.88 0.94 0.00 1.67 4.77 -0.36 -4.87 117.00 116.27 1hr6 n LEU 87 Ca -0.02 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 1hr6 n LEU 87 Cb 0.08 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1hr6 n LEU 87 CO 0.18 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1hr6 n GLY 88 N 1.14 1.65 2.54 -0.72 0.00 0.11 -4.69 105.19 105.22 1hr6 n GLY 88 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 1hr6 n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hr6 n GLY 89 N -0.46 0.80 2.90 -0.02 0.00 -0.40 -4.93 105.19 103.08 1hr6 n GLY 89 Ca 0.00 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1hr6 n GLY 89 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hr6 n ASN 90 N -0.48 6.31 -4.12 1.61 5.15 -1.26 -4.94 115.26 117.53 1hr6 n ASN 90 Ca -0.07 -3.36 -0.09 0.00 -0.60 0.00 0.00 54.58 50.46 1hr6 n ASN 90 Cb 0.40 -1.31 -0.10 0.00 -0.53 0.00 0.00 39.78 38.24 1hr6 n ASN 90 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1hr6 s TYR 91 N -2.13 0.73 -0.12 1.20 1.13 -1.26 -2.08 117.35 114.82 1hr6 s TYR 91 Ca 0.35 -1.15 -0.31 0.00 -1.41 0.00 0.00 57.07 54.55 1hr6 s TYR 91 Cb 0.08 -0.43 0.13 0.00 -1.10 0.00 0.00 41.96 40.65 1hr6 s TYR 91 CO 0.05 -0.49 1.03 1.14 -2.51 0.00 0.00 175.55 174.76 1hr6 s GLN 92 N -4.00 0.57 -0.09 -3.49 -2.07 0.18 -4.98 119.66 105.78 1hr6 s GLN 92 Ca 0.19 -0.06 0.03 0.00 -1.82 0.00 0.00 55.36 53.70 1hr6 s GLN 92 Cb 0.07 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.27 1hr6 s GLN 92 CO -0.02 -0.22 -0.20 0.00 -1.32 0.00 0.00 175.29 173.53 1hr6 s THR 94 N 0.47 0.13 0.08 0.00 -4.23 -0.66 -4.86 115.64 106.57 1hr6 s THR 94 Ca -0.17 -1.77 -0.10 0.00 -1.18 0.00 0.00 61.69 58.47 1hr6 s THR 94 Cb -0.17 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.85 1hr6 s THR 94 CO 0.07 -0.61 0.22 -0.94 -0.54 0.00 0.00 174.62 172.82 1hr6 s SER 95 N -2.99 0.06 0.00 3.99 1.04 -1.26 -1.06 113.70 113.48 1hr6 s SER 95 Ca 0.17 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.06 1hr6 s SER 95 Cb 0.07 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1hr6 s SER 95 CO -0.03 -0.70 0.00 -0.24 0.98 0.00 0.00 173.24 173.25 1hr6 n SER 96 N 0.10 0.00 0.08 7.02 2.88 0.38 -4.96 113.62 119.11 1hr6 n SER 96 Ca -0.16 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.25 1hr6 n SER 96 Cb 0.62 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.02 1hr6 n SER 96 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1hr6 h ARG 97 N 0.00 0.35 0.00 -1.46 3.08 -1.92 -1.79 114.38 112.63 1hr6 h ARG 97 Ca 0.00 -0.41 0.00 0.00 0.07 0.00 0.00 59.98 59.64 1hr6 h ARG 97 Cb 0.00 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1hr6 h ARG 97 CO 0.00 1.11 -0.04 0.39 -1.07 0.00 0.00 179.97 180.36 1hr6 n GLU 98 N -3.69 1.80 -3.91 0.04 1.02 -1.26 -1.57 120.64 113.07 1hr6 n GLU 98 Ca -0.07 -1.58 -0.10 0.00 -0.02 0.00 0.00 57.16 55.40 1hr6 n GLU 98 Cb 0.87 -1.01 -0.09 0.00 -0.02 0.00 0.00 31.44 31.20 1hr6 n GLU 98 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1hr6 s ASN 99 N -1.33 0.15 -0.18 1.62 4.22 -0.59 -4.44 114.94 114.38 1hr6 s ASN 99 Ca 0.08 -0.50 -0.04 0.00 -2.14 0.00 0.00 52.86 50.26 1hr6 s ASN 99 Cb 0.07 0.24 0.09 0.00 1.28 0.00 0.00 41.25 42.94 1hr6 s ASN 99 CO 0.01 -0.52 0.29 -0.22 -2.04 0.00 0.00 177.10 174.62 1hr6 s LEU 100 N -2.14 -0.36 0.01 3.54 2.96 -1.20 -0.47 118.68 121.01 1hr6 s LEU 100 Ca -0.05 0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 54.16 1hr6 s LEU 100 Cb -0.01 0.78 -0.01 0.00 0.50 0.00 0.00 46.19 47.45 1hr6 s LEU 100 CO -0.05 -0.28 0.02 0.00 -1.32 0.00 0.00 176.35 174.72 1hr6 s MET 101 N 2.44 0.24 -0.24 1.98 0.23 -0.23 -1.00 119.30 122.73 1hr6 s MET 101 Ca 0.05 -0.35 -0.01 0.00 -1.03 0.00 0.00 55.69 54.36 1hr6 s MET 101 Cb -0.14 0.09 0.03 0.00 -1.53 0.00 0.00 34.83 33.28 1hr6 s MET 101 CO -0.12 -0.04 -0.08 0.71 -2.03 0.00 0.00 175.02 173.46 1hr6 s TYR 102 N -0.93 3.07 0.12 3.16 1.51 -0.03 -1.66 117.35 122.59 1hr6 s TYR 102 Ca -0.10 -1.67 0.03 0.00 -1.01 0.00 0.00 57.07 54.32 1hr6 s TYR 102 Cb -0.06 -2.03 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 1hr6 s TYR 102 CO -0.00 -0.76 -0.09 -0.65 -1.11 0.00 0.00 175.55 172.94 1hr6 s GLN 103 N 1.29 0.93 0.02 -0.62 -0.21 0.03 -0.52 119.66 120.57 1hr6 s GLN 103 Ca -0.01 -1.32 -0.28 0.00 0.02 0.00 0.00 55.36 53.77 1hr6 s GLN 103 Cb -0.17 -0.48 0.10 0.00 1.00 0.00 0.00 33.01 33.46 1hr6 s GLN 103 CO -0.05 0.05 0.86 0.00 -2.12 0.00 0.00 175.29 174.04 1hr6 s ALA 104 N -3.10 -1.79 -0.03 6.09 0.00 -0.34 -0.65 121.76 121.94 1hr6 s ALA 104 Ca 0.12 0.91 0.05 0.00 0.00 0.00 0.00 51.96 53.04 1hr6 s ALA 104 Cb 0.01 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 1hr6 s ALA 104 CO -0.01 -0.72 -0.19 -1.54 0.00 0.00 0.00 175.76 173.30 1hr6 s SER 105 N -2.53 2.32 0.20 0.00 1.04 -0.88 -1.06 113.70 112.78 1hr6 s SER 105 Ca 0.05 -0.37 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 1hr6 s SER 105 Cb -0.01 -0.48 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1hr6 s SER 105 CO -0.09 0.20 0.28 0.68 0.98 0.00 0.00 173.24 175.29 1hr6 s VAL 106 N -0.20 0.02 0.54 5.02 -7.23 0.09 -4.55 120.40 114.09 1hr6 s VAL 106 Ca 0.01 -1.65 -0.20 0.00 -1.81 0.00 0.00 61.98 58.34 1hr6 s VAL 106 Cb -0.10 -2.21 -0.06 0.00 0.56 0.00 0.00 36.38 34.57 1hr6 s VAL 106 CO 0.01 -0.10 1.12 -0.36 -0.31 0.00 0.00 175.10 175.45 1hr6 s PHE 107 N -4.06 2.71 0.31 2.82 0.08 -1.26 -0.49 117.98 118.09 1hr6 s PHE 107 Ca 0.27 1.55 0.07 0.00 0.12 0.00 0.00 56.93 58.94 1hr6 s PHE 107 Cb 0.04 -3.26 0.86 0.00 -0.57 0.00 0.00 43.02 40.08 1hr6 s PHE 107 CO 0.07 -1.48 1.67 -0.91 -0.10 0.00 0.00 175.22 174.47 1hr6 h ASN 108 N 1.23 0.33 0.50 1.36 2.35 -1.89 0.12 115.58 119.59 1hr6 h ASN 108 Ca -0.50 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1hr6 h ASN 108 Cb 1.26 0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.79 1hr6 h ASN 108 CO 0.57 -0.08 0.00 0.00 -1.65 0.00 0.00 177.43 176.27 1hr6 n GLN 109 N -5.08 0.18 -0.20 0.81 0.00 -1.26 -3.21 117.38 108.62 1hr6 n GLN 109 Ca 0.26 0.12 0.11 0.00 0.00 0.00 0.00 57.00 57.48 1hr6 n GLN 109 Cb 0.78 -1.50 0.21 0.00 0.00 0.00 0.00 30.24 29.73 1hr6 n GLN 109 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1hr6 n ASP 110 N -1.37 3.40 -0.04 2.61 8.00 0.41 -4.61 116.55 124.96 1hr6 n ASP 110 Ca 0.08 -1.96 -0.09 0.00 0.71 0.00 0.00 54.79 53.53 1hr6 n ASP 110 Cb 0.19 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.00 1hr6 n ASP 110 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1hr6 h VAL 111 N 4.11 0.81 -0.43 2.53 2.07 -1.63 -2.15 116.25 121.56 1hr6 h VAL 111 Ca 0.00 -0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 1hr6 h VAL 111 Cb 0.94 0.81 -0.06 0.00 -1.52 0.00 0.00 31.29 31.46 1hr6 h VAL 111 CO 0.00 0.00 0.08 1.23 0.02 0.00 0.00 177.57 178.90 1hr6 h GLY 112 N 0.00 0.51 0.98 2.17 0.00 -1.88 0.15 103.07 105.00 1hr6 h GLY 112 Ca 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 1hr6 h GLY 112 CO -0.19 -0.05 0.26 1.70 0.00 0.00 0.00 176.54 178.26 1hr6 h LYS 113 N 0.22 0.71 -0.60 4.80 1.63 -1.83 0.73 116.57 122.22 1hr6 h LYS 113 Ca 0.21 -0.09 -0.06 0.00 -0.85 0.00 0.00 60.65 59.86 1hr6 h LYS 113 Cb 0.26 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.73 1hr6 h LYS 113 CO -0.28 0.57 0.16 1.98 -3.45 0.00 0.00 179.45 178.44 1hr6 h MET 114 N 0.66 0.96 -0.89 1.90 4.05 -0.80 -1.05 114.93 119.75 1hr6 h MET 114 Ca 0.17 -0.22 -0.01 0.00 -0.28 0.00 0.00 59.70 59.36 1hr6 h MET 114 Cb 0.09 -0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 30.71 1hr6 h MET 114 CO -0.02 0.87 0.51 1.25 0.23 0.00 0.00 176.91 179.75 1hr6 h LEU 115 N 0.87 1.10 -0.14 3.39 5.85 -0.34 -0.96 115.31 125.08 1hr6 h LEU 115 Ca 0.19 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1hr6 h LEU 115 Cb 0.33 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1hr6 h LEU 115 CO -0.00 0.87 0.09 -0.61 -0.34 0.00 0.00 178.44 178.45 1hr6 h GLN 116 N 1.24 0.19 -0.87 1.25 4.15 -0.31 0.11 115.11 120.87 1hr6 h GLN 116 Ca 0.32 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.70 1hr6 h GLN 116 Cb -0.00 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.60 1hr6 h GLN 116 CO -0.05 0.14 0.45 -0.07 -1.93 0.00 0.00 178.83 177.37 1hr6 h LEU 117 N 0.18 1.11 -0.34 -2.39 3.38 -0.84 -0.72 115.31 115.68 1hr6 h LEU 117 Ca 0.05 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1hr6 h LEU 117 Cb -0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1hr6 h LEU 117 CO -0.01 0.91 0.13 0.24 0.09 0.00 0.00 178.44 179.80 1hr6 h MET 118 N 1.22 0.52 0.00 1.13 2.86 -0.92 -1.90 114.93 117.85 1hr6 h MET 118 Ca 0.30 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.80 1hr6 h MET 118 Cb 0.07 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1hr6 h MET 118 CO -0.04 0.52 -0.20 0.66 1.06 0.00 0.00 176.91 178.90 1hr6 h SER 119 N 0.41 0.00 -0.10 1.22 4.64 -0.70 -0.97 113.55 118.04 1hr6 h SER 119 Ca 0.11 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.40 1hr6 h SER 119 Cb 0.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1hr6 h SER 119 CO -0.01 0.20 -0.08 -0.33 -0.87 0.00 0.00 176.83 175.74 1hr6 h GLU 120 N 0.00 0.23 0.00 4.77 4.39 -0.59 0.42 114.58 123.80 1hr6 h GLU 120 Ca -0.00 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.55 1hr6 h GLU 120 Cb 0.56 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1hr6 h GLU 120 CO 0.03 0.62 -0.14 0.00 -1.16 0.00 0.00 179.01 178.36 1hr6 h THR 121 N -0.15 0.33 0.10 1.13 1.03 -1.10 0.38 112.91 114.62 1hr6 h THR 121 Ca 0.02 -0.92 -0.31 0.00 -0.01 0.00 0.00 66.41 65.19 1hr6 h THR 121 Cb 0.57 1.70 -0.02 0.00 -1.07 0.00 0.00 68.15 69.34 1hr6 h THR 121 CO 0.02 0.13 -1.60 0.58 -0.01 0.00 0.00 175.52 174.64 1hr6 h VAL 122 N 0.00 1.05 0.00 0.00 2.07 -1.10 -3.36 116.25 114.91 1hr6 h VAL 122 Ca -0.00 -2.74 -0.38 0.00 0.82 0.00 0.00 66.70 64.40 1hr6 h VAL 122 Cb 0.69 2.67 -0.07 0.00 -1.52 0.00 0.00 31.29 33.07 1hr6 h VAL 122 CO 0.02 0.78 -2.42 0.54 0.02 0.00 0.00 177.57 176.51 1hr6 n ARG 123 N -3.39 0.67 -2.46 1.57 1.74 0.13 -4.75 116.66 110.17 1hr6 n ARG 123 Ca -0.18 0.07 -0.18 0.00 -0.77 0.00 0.00 57.85 56.80 1hr6 n ARG 123 Cb 1.04 -1.52 0.02 0.00 -1.02 0.00 0.00 32.46 30.98 1hr6 n ARG 123 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1hr6 n PHE 124 N -3.01 2.37 -2.14 -1.55 3.72 0.13 -5.06 117.46 111.92 1hr6 n PHE 124 Ca -0.39 -2.64 -0.38 0.00 -0.05 0.00 0.00 57.45 53.99 1hr6 n PHE 124 Cb 1.08 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 39.38 1hr6 n PHE 124 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1hr6 s PRO 125 N -3.51 3.69 -0.05 -1.08 0.04 -1.19 -0.48 135.00 132.41 1hr6 s PRO 125 Ca 0.41 1.92 -0.11 0.00 0.04 0.00 0.00 61.00 63.26 1hr6 s PRO 125 Cb 0.40 -2.44 -0.31 0.00 0.04 0.00 0.00 34.50 32.19 1hr6 s PRO 125 CO -0.05 -0.65 0.66 0.87 0.04 0.00 0.00 177.00 177.86 1hr6 h LYS 126 N 2.06 0.39 -6.13 4.56 1.57 -1.55 -3.44 116.57 114.02 1hr6 h LYS 126 Ca -0.50 -0.67 -0.28 0.00 -1.87 0.00 0.00 60.65 57.34 1hr6 h LYS 126 Cb 1.26 0.25 0.01 0.00 0.08 0.00 0.00 32.23 33.82 1hr6 h LYS 126 CO 0.60 1.31 -0.62 -0.89 -0.57 0.00 0.00 179.45 179.28 1hr6 n ILE 127 N -3.58 -6.41 -1.50 1.86 5.41 -1.26 -4.96 119.36 108.92 1hr6 n ILE 127 Ca -0.25 -0.17 -0.30 0.00 1.00 0.00 0.00 62.75 63.03 1hr6 n ILE 127 Cb 1.08 -4.72 0.09 0.00 -0.71 0.00 0.00 39.64 35.37 1hr6 n ILE 127 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1hr6 s THR 128 N -3.03 3.25 0.17 1.39 -4.23 -1.26 -4.84 115.64 107.10 1hr6 s THR 128 Ca 0.03 0.41 -0.14 0.00 -1.18 0.00 0.00 61.69 60.81 1hr6 s THR 128 Cb -0.01 -3.11 0.06 0.00 1.34 0.00 0.00 72.50 70.78 1hr6 s THR 128 CO 0.83 -0.53 1.78 -0.33 -0.54 0.00 0.00 174.62 175.83 1hr6 h GLU 129 N -1.06 0.44 -0.49 3.99 5.08 -2.00 -1.69 114.58 118.86 1hr6 h GLU 129 Ca -0.46 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1hr6 h GLU 129 Cb 1.25 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 1hr6 h GLU 129 CO 0.58 0.29 0.30 0.37 -1.00 0.00 0.00 179.01 179.55 1hr6 h GLN 130 N 0.46 0.58 -0.52 2.33 4.15 -1.99 -0.05 115.11 120.06 1hr6 h GLN 130 Ca 0.21 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.55 1hr6 h GLN 130 Cb 0.12 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 1hr6 h GLN 130 CO -0.15 0.38 0.16 0.93 -1.93 0.00 0.00 178.83 178.22 1hr6 h GLU 131 N 0.60 0.77 -0.14 1.69 5.08 -1.83 -1.37 114.58 119.38 1hr6 h GLU 131 Ca 0.19 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1hr6 h GLU 131 Cb 0.00 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 1hr6 h GLU 131 CO -0.08 0.67 -0.21 1.25 -1.00 0.00 0.00 179.01 179.64 1hr6 h LEU 132 N 0.75 0.43 -0.97 1.33 5.85 -0.81 -2.33 115.31 119.57 1hr6 h LEU 132 Ca 0.17 -0.52 0.05 0.00 0.84 0.00 0.00 57.88 58.42 1hr6 h LEU 132 Cb 0.23 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1hr6 h LEU 132 CO -0.01 0.87 0.62 -0.61 -0.34 0.00 0.00 178.44 178.98 1hr6 h GLN 133 N 0.00 1.15 -0.08 1.25 5.75 -0.81 -0.89 115.11 121.47 1hr6 h GLN 133 Ca 0.01 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1hr6 h GLN 133 Cb 0.78 -0.26 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 1hr6 h GLN 133 CO 0.05 0.76 0.05 0.93 -2.65 0.00 0.00 178.83 177.97 1hr6 h GLU 134 N 1.18 0.11 0.00 1.69 5.08 -1.11 -1.21 114.58 120.32 1hr6 h GLU 134 Ca 0.40 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.68 1hr6 h GLU 134 Cb 0.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1hr6 h GLU 134 CO -0.14 0.11 -0.33 1.96 -1.00 0.00 0.00 179.01 179.60 1hr6 h GLN 135 N 0.08 0.00 0.08 2.33 1.08 -0.99 -1.78 115.11 115.92 1hr6 h GLN 135 Ca 0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1hr6 h GLN 135 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1hr6 h GLN 135 CO -0.01 0.33 -0.04 0.87 -0.95 0.00 0.00 178.83 179.04 1hr6 h LYS 136 N 0.00 -0.11 -0.58 1.46 1.57 -0.85 0.68 116.57 118.74 1hr6 h LYS 136 Ca -0.00 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 1hr6 h LYS 136 Cb 0.60 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.85 1hr6 h LYS 136 CO 0.04 0.36 0.16 1.25 -0.57 0.00 0.00 179.45 180.69 1hr6 h LEU 137 N -0.62 0.08 -1.08 2.94 5.85 -1.14 -0.79 115.31 120.54 1hr6 h LEU 137 Ca -0.01 0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1hr6 h LEU 137 Cb 0.51 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 1hr6 h LEU 137 CO 0.02 0.06 -0.34 -1.28 -0.34 0.00 0.00 178.44 176.55 1hr6 h SER 138 N 0.30 0.21 -0.13 1.25 0.87 -1.29 -2.89 113.55 111.87 1hr6 h SER 138 Ca 0.30 -0.08 -0.09 0.00 -1.23 0.00 0.00 61.79 60.69 1hr6 h SER 138 Cb 0.41 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 1hr6 h SER 138 CO -0.35 0.55 -0.20 0.00 -0.53 0.00 0.00 176.83 176.29 1hr6 h ALA 139 N 1.47 1.10 -0.45 6.23 0.00 0.59 -1.32 119.26 126.88 1hr6 h ALA 139 Ca 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1hr6 h ALA 139 Cb 0.70 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1hr6 h ALA 139 CO 0.05 0.56 0.28 0.93 0.00 0.00 0.00 179.25 181.07 1hr6 h GLU 140 N 0.49 0.60 -0.60 0.00 5.08 -1.18 0.16 114.58 119.13 1hr6 h GLU 140 Ca 0.08 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 1hr6 h GLU 140 Cb 0.62 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1hr6 h GLU 140 CO 0.04 0.43 0.02 1.88 -1.00 0.00 0.00 179.01 180.38 1hr6 h TYR 141 N 0.60 1.13 -0.40 4.33 0.05 -1.47 -1.42 116.97 119.79 1hr6 h TYR 141 Ca 0.16 -0.19 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1hr6 h TYR 141 Cb -0.03 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 37.39 1hr6 h TYR 141 CO -0.04 0.99 0.18 1.49 -1.05 0.00 0.00 178.16 179.74 1hr6 h GLU 142 N 0.96 0.59 -0.28 4.88 4.81 -0.65 -2.33 114.58 122.56 1hr6 h GLU 142 Ca 0.18 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1hr6 h GLU 142 Cb 0.53 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1hr6 h GLU 142 CO 0.03 0.53 0.18 0.82 -0.73 0.00 0.00 179.01 179.83 1hr6 h ILE 143 N 0.51 1.09 -0.94 2.32 5.03 -0.43 -0.74 117.51 124.35 1hr6 h ILE 143 Ca 0.14 -0.21 0.16 0.00 -0.12 0.00 0.00 64.86 64.82 1hr6 h ILE 143 Cb 0.15 0.72 -0.10 0.00 -3.03 0.00 0.00 36.82 34.57 1hr6 h ILE 143 CO -0.01 0.09 0.54 0.44 -0.68 0.00 0.00 178.15 178.53 1hr6 h ASP 144 N 0.37 0.72 -0.08 1.72 3.32 -1.12 -1.68 116.42 119.66 1hr6 h ASP 144 Ca 0.10 0.08 -0.18 0.00 0.02 0.00 0.00 57.03 57.05 1hr6 h ASP 144 Cb -0.00 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1hr6 h ASP 144 CO -0.02 0.31 -0.61 -0.33 -1.72 0.00 0.00 179.24 176.86 1hr6 h GLU 145 N 0.76 0.69 -0.70 3.56 5.08 -0.85 -3.20 114.58 119.93 1hr6 h GLU 145 Ca 0.51 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1hr6 h GLU 145 Cb 0.70 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.99 1hr6 h GLU 145 CO -0.35 1.09 0.33 0.28 -1.00 0.00 0.00 179.01 179.37 1hr6 h VAL 146 N 0.51 1.22 0.00 3.13 2.07 -0.26 -2.39 116.25 120.55 1hr6 h VAL 146 Ca -0.01 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1hr6 h VAL 146 Cb 1.20 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1hr6 h VAL 146 CO 0.12 0.27 0.00 0.79 0.02 0.00 0.00 177.57 178.77 1hr6 n TRP 147 N -4.33 0.00 0.40 1.57 7.02 -0.86 -1.91 117.44 119.33 1hr6 n TRP 147 Ca 0.07 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.59 1hr6 n TRP 147 Cb 0.14 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.01 1hr6 n TRP 147 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 1hr6 n MET 148 N -0.63 2.67 -3.56 -0.99 2.81 -0.90 -4.91 117.12 111.60 1hr6 n MET 148 Ca 0.03 -0.43 -0.41 0.00 -1.81 0.00 0.00 57.70 55.08 1hr6 n MET 148 Cb 0.01 -1.01 -0.09 0.00 -0.71 0.00 0.00 33.22 31.42 1hr6 n MET 148 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1hr6 s LYS 149 N -1.39 2.65 0.45 0.03 1.02 -0.80 -4.96 119.74 116.74 1hr6 s LYS 149 Ca 0.06 -1.48 0.22 0.00 0.02 0.00 0.00 55.97 54.80 1hr6 s LYS 149 Cb 0.07 -3.85 1.21 0.00 -0.52 0.00 0.00 37.83 34.74 1hr6 s LYS 149 CO 0.25 -0.99 1.85 -1.35 -0.92 0.00 0.00 175.35 174.19 1hr6 h PRO 150 N 8.47 0.27 0.00 -1.68 0.11 -1.91 0.29 132.00 137.55 1hr6 h PRO 150 Ca -0.24 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1hr6 h PRO 150 Cb 1.09 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1hr6 h PRO 150 CO 0.79 0.18 0.00 0.93 -0.21 0.00 0.00 178.00 179.69 1hr6 h GLU 151 N 0.28 0.00 0.00 1.05 3.07 -1.95 -2.13 114.58 114.90 1hr6 h GLU 151 Ca 0.47 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 59.02 1hr6 h GLU 151 Cb 1.39 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.25 1hr6 h GLU 151 CO -0.14 0.00 -2.18 1.28 -1.40 0.00 0.00 179.01 176.58 1hr6 n LEU 152 N -2.54 2.75 -0.07 1.33 4.77 0.87 -4.55 117.00 119.56 1hr6 n LEU 152 Ca 0.01 -0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.76 1hr6 n LEU 152 Cb 0.22 -0.64 -0.06 0.00 -2.33 0.00 0.00 43.42 40.61 1hr6 n LEU 152 CO 0.21 0.82 0.69 0.58 -1.33 0.00 0.00 177.39 178.35 1hr6 h VAL 153 N 0.00 1.30 -0.12 4.08 2.07 -1.04 -2.81 116.25 119.73 1hr6 h VAL 153 Ca -0.46 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 65.99 1hr6 h VAL 153 Cb 1.74 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 33.11 1hr6 h VAL 153 CO -0.06 0.33 -0.00 -0.07 0.02 0.00 0.00 177.57 177.78 1hr6 h LEU 154 N 0.08 -0.05 -1.63 2.57 -0.00 -1.65 0.89 115.31 115.53 1hr6 h LEU 154 Ca 0.05 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1hr6 h LEU 154 Cb 0.53 0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.22 1hr6 h LEU 154 CO 0.02 -0.01 0.12 -0.65 -0.00 0.00 0.00 178.44 177.93 1hr6 h PRO 155 N 0.04 0.37 -0.09 1.13 0.11 -1.79 0.26 132.00 132.03 1hr6 h PRO 155 Ca 0.05 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1hr6 h PRO 155 Cb 0.07 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.10 1hr6 h PRO 155 CO -0.09 0.29 0.02 1.49 -0.21 0.00 0.00 178.00 179.50 1hr6 h GLU 156 N 0.37 0.15 -0.47 1.05 4.57 -0.97 -1.96 114.58 117.32 1hr6 h GLU 156 Ca 0.10 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 1hr6 h GLU 156 Cb 0.05 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 1hr6 h GLU 156 CO -0.01 0.33 0.19 -0.07 -1.18 0.00 0.00 179.01 178.26 1hr6 h LEU 157 N -0.06 0.61 0.15 1.64 3.38 -0.15 -1.81 115.31 119.06 1hr6 h LEU 157 Ca 0.03 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1hr6 h LEU 157 Cb 0.25 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1hr6 h LEU 157 CO 0.00 0.55 -0.16 0.25 0.09 0.00 0.00 178.44 179.17 1hr6 h LEU 158 N 0.67 -0.42 -0.13 1.67 5.85 -0.16 -1.91 115.31 120.87 1hr6 h LEU 158 Ca 0.16 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1hr6 h LEU 158 Cb 0.13 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1hr6 h LEU 158 CO -0.02 -0.24 0.02 0.45 -0.34 0.00 0.00 178.44 178.31 1hr6 h HIS 159 N -0.34 0.24 -0.90 1.25 3.86 -1.16 -0.01 115.15 118.08 1hr6 h HIS 159 Ca 0.01 -0.03 0.14 0.00 -1.16 0.00 0.00 60.37 59.33 1hr6 h HIS 159 Cb 0.33 -0.06 -0.09 0.00 1.06 0.00 0.00 27.41 28.64 1hr6 h HIS 159 CO -0.14 0.41 0.51 1.15 0.86 0.00 0.00 177.93 180.71 1hr6 h THR 160 N -0.00 0.78 0.09 2.45 2.02 -1.27 -1.86 112.91 115.12 1hr6 h THR 160 Ca 0.04 -0.25 -0.26 0.00 0.77 0.00 0.00 66.41 66.71 1hr6 h THR 160 Cb 0.30 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 1hr6 h THR 160 CO 0.00 0.13 -1.15 0.00 0.37 0.00 0.00 175.52 174.87 1hr6 h ALA 161 N 1.56 0.18 -0.27 6.16 0.00 -1.17 0.22 119.26 125.94 1hr6 h ALA 161 Ca 0.48 -0.83 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1hr6 h ALA 161 Cb 0.64 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1hr6 h ALA 161 CO -0.34 0.92 0.13 0.00 0.00 0.00 0.00 179.25 179.96 1hr6 h ALA 162 N 0.63 1.72 0.00 0.00 0.00 -0.19 -3.05 119.26 118.36 1hr6 h ALA 162 Ca -0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1hr6 h ALA 162 Cb 1.85 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1hr6 h ALA 162 CO 0.19 0.24 -0.01 0.66 0.00 0.00 0.00 179.25 180.33 1hr6 n TYR 163 N -4.44 0.00 -3.85 0.00 4.02 -0.91 0.16 117.16 112.13 1hr6 n TYR 163 Ca 0.01 -0.72 -0.28 0.00 -0.01 0.00 0.00 57.90 56.90 1hr6 n TYR 163 Cb 0.11 -0.10 0.03 0.00 -0.02 0.00 0.00 39.34 39.37 1hr6 n TYR 163 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1hr6 n SER 164 N -0.93 -4.19 -0.39 7.72 7.64 -0.45 -2.52 113.62 120.49 1hr6 n SER 164 Ca 0.08 -0.77 -0.05 0.00 1.01 0.00 0.00 58.87 59.13 1hr6 n SER 164 Cb 0.45 -4.00 -0.02 0.00 -1.01 0.00 0.00 64.21 59.63 1hr6 n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hr6 n GLY 165 N -1.69 0.73 3.46 0.23 0.00 0.66 -5.01 105.19 103.56 1hr6 n GLY 165 Ca -0.03 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 1hr6 n GLY 165 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hr6 s GLU 166 N -1.94 1.67 1.37 1.61 0.41 -1.05 -3.72 118.70 117.06 1hr6 s GLU 166 Ca 0.00 -1.25 0.00 0.00 -0.41 0.00 0.00 54.97 53.31 1hr6 s GLU 166 Cb 0.00 -2.04 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 1hr6 s GLU 166 CO 0.00 0.46 0.00 0.25 -0.49 0.00 0.00 175.26 175.48 1hr6 n THR 167 N 0.76 0.00 0.06 3.63 -2.24 -1.26 -0.33 114.28 114.90 1hr6 n THR 167 Ca -0.16 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.66 1hr6 n THR 167 Cb 0.53 0.00 0.23 0.00 -2.10 0.00 0.00 70.33 68.99 1hr6 n THR 167 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1hr6 n LEU 168 N 0.00 0.21 -0.50 3.22 4.77 -1.26 -0.37 117.00 123.07 1hr6 n LEU 168 Ca 0.00 0.58 0.05 0.00 -0.03 0.00 0.00 56.01 56.62 1hr6 n LEU 168 Cb 0.00 -0.61 0.09 0.00 -2.33 0.00 0.00 43.42 40.58 1hr6 n LEU 168 CO 0.00 -0.66 0.52 0.61 -1.33 0.00 0.00 177.39 176.53 1hr6 n GLY 169 N -1.41 1.22 3.73 -0.72 0.00 0.55 -4.74 105.19 103.82 1hr6 n GLY 169 Ca -0.01 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1hr6 n GLY 169 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hr6 s SER 170 N -0.93 6.83 -0.25 1.61 0.15 0.50 -3.85 113.70 117.75 1hr6 s SER 170 Ca 0.17 2.44 -0.43 0.00 0.70 0.00 0.00 55.95 58.83 1hr6 s SER 170 Cb 0.10 -2.61 -0.19 0.00 -1.71 0.00 0.00 66.02 61.61 1hr6 s SER 170 CO 0.14 -0.60 1.45 -2.65 1.20 0.00 0.00 173.24 172.78 1hr6 n PRO 171 N 2.92 0.36 0.12 5.44 -0.02 -1.26 -4.80 135.00 137.75 1hr6 n PRO 171 Ca 0.08 0.13 0.03 0.00 -2.02 0.00 0.00 63.50 61.72 1hr6 n PRO 171 Cb 0.42 -1.68 0.01 0.00 -0.02 0.00 0.00 33.50 32.22 1hr6 n PRO 171 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1hr6 h LEU 172 N 4.84 0.00 -8.70 2.45 5.85 -1.93 -3.42 115.31 114.39 1hr6 h LEU 172 Ca -0.47 0.00 -0.66 0.00 0.84 0.00 0.00 57.88 57.59 1hr6 h LEU 172 Cb 1.37 0.00 -0.20 0.00 0.37 0.00 0.00 40.66 42.20 1hr6 h LEU 172 CO 0.86 0.44 -0.54 -0.63 -0.34 0.00 0.00 178.44 178.23 1hr6 s ILE 173 N -3.00 4.94 0.13 4.05 1.01 -1.26 -5.01 121.20 122.05 1hr6 s ILE 173 Ca 0.02 -0.17 -0.31 0.00 0.00 0.00 0.00 60.65 60.19 1hr6 s ILE 173 Cb 0.08 -3.45 -0.08 0.00 0.01 0.00 0.00 42.46 39.02 1hr6 s ILE 173 CO 0.76 0.13 1.36 0.00 0.00 0.00 0.00 174.94 177.20 1hr6 n PRO 175 N 3.64 1.65 -0.15 0.00 -0.02 -1.26 -4.83 135.00 134.03 1hr6 n PRO 175 Ca 0.10 0.59 -0.03 0.00 -2.02 0.00 0.00 63.50 62.14 1hr6 n PRO 175 Cb 0.43 -2.23 0.05 0.00 -0.02 0.00 0.00 33.50 31.73 1hr6 n PRO 175 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1hr6 h ARG 176 N 4.50 0.22 0.00 -0.52 2.43 -1.98 -1.96 114.38 117.07 1hr6 h ARG 176 Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1hr6 h ARG 176 Cb 1.30 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1hr6 h ARG 176 CO 0.78 0.15 0.00 0.41 -1.51 0.00 0.00 179.97 179.80 1hr6 n GLY 177 N -1.27 -0.82 0.03 2.80 0.00 -1.26 -2.23 105.19 102.44 1hr6 n GLY 177 Ca 0.05 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1hr6 n GLY 177 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hr6 n LEU 178 N -1.55 0.63 -0.23 0.99 4.77 -0.74 -4.36 117.00 116.52 1hr6 n LEU 178 Ca 0.02 -0.02 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1hr6 n LEU 178 Cb 0.10 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1hr6 n LEU 178 CO 0.09 0.06 1.04 0.40 -1.33 0.00 0.00 177.39 177.65 1hr6 h ILE 179 N 0.00 1.22 0.00 -0.08 2.04 -1.48 -2.82 117.51 116.39 1hr6 h ILE 179 Ca 0.00 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1hr6 h ILE 179 Cb 0.68 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1hr6 h ILE 179 CO 0.00 0.25 -0.02 -0.65 0.00 0.00 0.00 178.15 177.72 1hr6 h PRO 180 N 0.87 0.00 -0.59 2.37 0.11 -1.77 -2.50 132.00 130.49 1hr6 h PRO 180 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1hr6 h PRO 180 Cb 0.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1hr6 h PRO 180 CO -0.03 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 176.66 1hr6 n SER 181 N -3.37 3.19 -4.57 -2.05 3.41 -1.06 -4.78 113.62 104.38 1hr6 n SER 181 Ca -0.02 -2.02 -0.42 0.00 -0.26 0.00 0.00 58.87 56.14 1hr6 n SER 181 Cb 0.14 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 63.66 1hr6 n SER 181 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1hr6 s ILE 182 N -1.26 4.05 0.37 -1.33 1.01 -0.94 -4.98 121.20 118.13 1hr6 s ILE 182 Ca 0.39 0.75 0.07 0.00 0.00 0.00 0.00 60.65 61.86 1hr6 s ILE 182 Cb 0.21 -4.72 -0.00 0.00 0.01 0.00 0.00 42.46 37.96 1hr6 s ILE 182 CO 0.26 -1.35 0.48 -0.94 0.00 0.00 0.00 174.94 173.39 1hr6 s SER 183 N 3.02 5.71 0.37 3.58 1.04 -1.26 -5.00 113.70 121.16 1hr6 s SER 183 Ca 0.40 -0.35 0.07 0.00 0.48 0.00 0.00 55.95 56.55 1hr6 s SER 183 Cb -0.08 -0.94 0.72 0.00 0.10 0.00 0.00 66.02 65.82 1hr6 s SER 183 CO 0.23 -0.57 1.92 0.50 0.98 0.00 0.00 173.24 176.30 1hr6 h LYS 184 N 0.84 0.40 -0.35 4.02 3.64 -1.96 -1.04 116.57 122.13 1hr6 h LYS 184 Ca -0.43 -0.08 0.04 0.00 -1.27 0.00 0.00 60.65 58.91 1hr6 h LYS 184 Cb 1.27 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.99 1hr6 h LYS 184 CO 0.51 0.45 0.12 -0.92 -2.27 0.00 0.00 179.45 177.34 1hr6 h TYR 185 N 0.39 0.22 -0.07 1.91 5.03 -1.98 0.34 116.97 122.81 1hr6 h TYR 185 Ca 0.09 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.29 1hr6 h TYR 185 Cb 0.29 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.51 1hr6 h TYR 185 CO 0.01 0.10 -0.50 1.88 -1.32 0.00 0.00 178.16 178.33 1hr6 h TYR 186 N 0.27 0.23 -0.43 -3.82 0.05 -1.78 -0.34 116.97 111.16 1hr6 h TYR 186 Ca 0.16 -0.07 -0.13 0.00 0.05 0.00 0.00 58.73 58.73 1hr6 h TYR 186 Cb 0.12 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 1hr6 h TYR 186 CO -0.14 0.65 -0.25 -0.07 -1.05 0.00 0.00 178.16 177.31 1hr6 h LEU 187 N 0.15 0.91 -0.73 3.88 3.38 -0.51 -1.04 115.31 121.35 1hr6 h LEU 187 Ca 0.01 -0.35 -0.13 0.00 0.09 0.00 0.00 57.88 57.50 1hr6 h LEU 187 Cb 0.93 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1hr6 h LEU 187 CO 0.07 1.11 -0.41 -0.07 0.09 0.00 0.00 178.44 179.24 1hr6 h LEU 188 N 0.76 0.52 -0.49 1.67 3.38 -0.09 -0.80 115.31 120.27 1hr6 h LEU 188 Ca 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1hr6 h LEU 188 Cb 0.80 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1hr6 h LEU 188 CO 0.07 0.87 0.23 -0.78 0.09 0.00 0.00 178.44 178.92 1hr6 h ASP 189 N 0.41 0.64 -0.06 -0.43 3.58 -0.67 0.22 116.42 120.11 1hr6 h ASP 189 Ca 0.04 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.35 1hr6 h ASP 189 Cb 0.89 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.77 1hr6 h ASP 189 CO 0.08 0.59 0.03 0.22 -2.88 0.00 0.00 179.24 177.28 1hr6 h TYR 190 N 0.64 0.08 -0.80 0.28 5.03 -1.00 -2.19 116.97 119.01 1hr6 h TYR 190 Ca 0.17 -0.00 0.04 0.00 2.58 0.00 0.00 58.73 61.52 1hr6 h TYR 190 Cb 0.13 -0.02 -0.05 0.00 1.55 0.00 0.00 36.73 38.33 1hr6 h TYR 190 CO -0.01 0.17 0.50 0.00 -1.32 0.00 0.00 178.16 177.51 1hr6 h ARG 191 N -0.04 0.92 0.00 1.82 3.08 -0.95 -0.23 114.38 118.98 1hr6 h ARG 191 Ca 0.02 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1hr6 h ARG 191 Cb 0.12 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1hr6 h ARG 191 CO -0.00 0.61 0.00 0.09 -1.07 0.00 0.00 179.97 179.60 1hr6 n ASN 192 N -4.62 0.46 -0.07 7.04 3.02 0.76 -1.00 115.26 120.84 1hr6 n ASN 192 Ca 0.10 0.60 -0.20 0.00 -0.03 0.00 0.00 54.58 55.05 1hr6 n ASN 192 Cb 0.12 -0.70 -0.13 0.00 -0.61 0.00 0.00 39.78 38.46 1hr6 n ASN 192 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1hr6 n LYS 193 N -1.99 0.69 -0.03 3.52 5.02 -0.76 -4.50 118.16 120.10 1hr6 n LYS 193 Ca 0.03 0.23 0.02 0.00 -2.02 0.00 0.00 58.31 56.57 1hr6 n LYS 193 Cb 0.24 -1.61 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 1hr6 n LYS 193 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1hr6 n PHE 194 N -3.49 0.00 -2.74 2.13 3.72 -0.17 -4.75 117.46 112.16 1hr6 n PHE 194 Ca -0.40 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.57 1hr6 n PHE 194 Cb 0.99 -0.49 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 1hr6 n PHE 194 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1hr6 n TYR 195 N -2.23 4.67 -4.15 1.38 4.02 -0.17 -4.73 117.16 115.95 1hr6 n TYR 195 Ca -0.11 -3.14 -0.17 0.00 -0.01 0.00 0.00 57.90 54.47 1hr6 n TYR 195 Cb 0.63 -2.33 -0.12 0.00 -0.02 0.00 0.00 39.34 37.50 1hr6 n TYR 195 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1hr6 s THR 196 N 2.39 0.97 0.35 -0.72 -4.23 -1.26 -4.85 115.64 108.29 1hr6 s THR 196 Ca 0.46 -1.29 0.05 0.00 -1.18 0.00 0.00 61.69 59.73 1hr6 s THR 196 Cb 0.01 -0.99 0.29 0.00 1.34 0.00 0.00 72.50 73.14 1hr6 s THR 196 CO 0.02 -0.29 1.97 1.55 -0.54 0.00 0.00 174.62 177.33 1hr6 h PRO 197 N 4.27 0.78 0.00 3.99 0.13 -1.86 0.21 132.00 139.52 1hr6 h PRO 197 Ca -0.39 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1hr6 h PRO 197 Cb 1.19 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1hr6 h PRO 197 CO 0.41 0.51 0.00 -0.85 -0.23 0.00 0.00 178.00 177.85 1hr6 n GLU 198 N -4.47 0.17 -0.70 0.86 0.00 -1.25 -2.26 120.64 112.99 1hr6 n GLU 198 Ca 0.10 0.36 0.07 0.00 0.00 0.00 0.00 57.16 57.68 1hr6 n GLU 198 Cb 0.18 -1.79 0.33 0.00 0.00 0.00 0.00 31.44 30.16 1hr6 n GLU 198 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1hr6 n ASN 199 N -2.10 4.77 -4.09 -1.84 5.15 0.05 -4.90 115.26 112.29 1hr6 n ASN 199 Ca 0.03 -3.02 -0.15 0.00 -0.60 0.00 0.00 54.58 50.84 1hr6 n ASN 199 Cb 0.25 -0.63 -0.12 0.00 -0.53 0.00 0.00 39.78 38.75 1hr6 n ASN 199 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1hr6 s THR 200 N -2.83 0.73 -0.03 -0.44 2.01 -0.96 -1.72 115.64 112.40 1hr6 s THR 200 Ca 0.49 -1.09 0.03 0.00 0.31 0.00 0.00 61.69 61.43 1hr6 s THR 200 Cb 0.39 -0.75 0.00 0.00 0.01 0.00 0.00 72.50 72.15 1hr6 s THR 200 CO 0.12 -0.28 -0.12 -0.69 -0.69 0.00 0.00 174.62 172.96 1hr6 s VAL 201 N -1.24 1.02 -0.23 3.82 1.01 0.48 -2.96 120.40 122.30 1hr6 s VAL 201 Ca -0.06 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1hr6 s VAL 201 Cb -0.09 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1hr6 s VAL 201 CO 0.01 0.31 -0.02 0.00 0.00 0.00 0.00 175.10 175.39 1hr6 s ALA 202 N 0.12 2.88 0.12 5.51 0.00 -0.17 -0.08 121.76 130.13 1hr6 s ALA 202 Ca -0.03 -1.16 0.10 0.00 0.00 0.00 0.00 51.96 50.87 1hr6 s ALA 202 Cb -0.09 -1.77 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1hr6 s ALA 202 CO 0.01 -0.44 -0.25 0.00 0.00 0.00 0.00 175.76 175.09 1hr6 s ALA 203 N 1.50 2.18 -0.01 0.00 0.00 -0.54 -0.78 121.76 124.10 1hr6 s ALA 203 Ca 0.06 -1.38 -0.02 0.00 0.00 0.00 0.00 51.96 50.62 1hr6 s ALA 203 Cb -0.14 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.64 1hr6 s ALA 203 CO -0.02 0.48 0.04 -0.06 0.00 0.00 0.00 175.76 176.20 1hr6 s PHE 204 N -1.08 0.01 -0.12 0.00 0.40 0.01 -1.69 117.98 115.50 1hr6 s PHE 204 Ca 0.11 0.00 0.03 0.00 -0.60 0.00 0.00 56.93 56.47 1hr6 s PHE 204 Cb -0.10 -0.02 0.00 0.00 0.51 0.00 0.00 43.02 43.41 1hr6 s PHE 204 CO 0.05 -0.07 -0.21 0.08 0.70 0.00 0.00 175.22 175.77 1hr6 s VAL 205 N -0.32 2.26 -0.09 -0.44 1.01 0.08 -2.12 120.40 120.79 1hr6 s VAL 205 Ca -0.04 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1hr6 s VAL 205 Cb -0.02 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.46 1hr6 s VAL 205 CO -0.00 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1hr6 n GLY 206 N 3.75 0.43 3.08 4.51 0.00 -0.79 -2.46 105.19 113.70 1hr6 n GLY 206 Ca -0.19 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.52 1hr6 n GLY 206 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hr6 s VAL 207 N -2.03 1.46 0.46 1.61 1.01 -1.26 -4.48 120.40 117.17 1hr6 s VAL 207 Ca 0.00 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.08 1hr6 s VAL 207 Cb 0.00 -1.32 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 1hr6 s VAL 207 CO 0.00 0.43 1.32 -2.65 0.00 0.00 0.00 175.10 174.20 1hr6 n PRO 208 N 3.88 1.94 -0.28 2.72 -0.02 -1.26 -4.66 135.00 137.31 1hr6 n PRO 208 Ca -0.21 0.70 0.03 0.00 -2.02 0.00 0.00 63.50 62.00 1hr6 n PRO 208 Cb 0.52 -2.49 0.24 0.00 -0.02 0.00 0.00 33.50 31.75 1hr6 n PRO 208 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1hr6 h HIS 209 N 1.95 1.02 -0.03 6.00 2.76 -1.96 -1.65 115.15 123.25 1hr6 h HIS 209 Ca -0.49 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.71 1hr6 h HIS 209 Cb 1.29 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 29.91 1hr6 h HIS 209 CO 0.47 0.56 0.00 1.49 -1.30 0.00 0.00 177.93 179.16 1hr6 h GLU 210 N 1.02 0.02 -0.88 5.26 4.57 -2.00 -0.77 114.58 121.80 1hr6 h GLU 210 Ca 0.36 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.53 1hr6 h GLU 210 Cb 0.13 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.68 1hr6 h GLU 210 CO -0.12 0.01 0.51 -0.22 -1.18 0.00 0.00 179.01 178.00 1hr6 h LYS 211 N 0.02 1.22 -0.49 1.92 1.63 -1.78 -1.47 116.57 117.61 1hr6 h LYS 211 Ca 0.01 -0.13 -0.01 0.00 -0.85 0.00 0.00 60.65 59.67 1hr6 h LYS 211 Cb 0.01 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.37 1hr6 h LYS 211 CO -0.02 0.87 0.26 0.00 -3.45 0.00 0.00 179.45 177.12 1hr6 h ALA 212 N 1.27 0.62 -0.44 5.00 0.00 -0.94 -0.91 119.26 123.87 1hr6 h ALA 212 Ca 0.31 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1hr6 h ALA 212 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1hr6 h ALA 212 CO -0.05 0.15 0.01 -0.07 0.00 0.00 0.00 179.25 179.28 1hr6 h LEU 213 N 0.64 0.67 0.88 0.00 3.38 -0.75 -0.00 115.31 120.13 1hr6 h LEU 213 Ca 0.17 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1hr6 h LEU 213 Cb 0.06 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.64 1hr6 h LEU 213 CO -0.03 0.73 -0.42 -0.33 0.09 0.00 0.00 178.44 178.48 1hr6 h GLU 214 N 0.66 -1.14 -0.93 1.13 5.08 -0.69 -2.03 114.58 116.66 1hr6 h GLU 214 Ca 0.13 0.08 0.06 0.00 -1.00 0.00 0.00 59.36 58.63 1hr6 h GLU 214 Cb 0.40 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 29.85 1hr6 h GLU 214 CO 0.01 -0.76 0.59 -0.07 -1.00 0.00 0.00 179.01 177.78 1hr6 h LEU 215 N -1.22 0.95 -0.18 1.33 3.38 -1.08 -0.26 115.31 118.22 1hr6 h LEU 215 Ca -0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1hr6 h LEU 215 Cb 0.91 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1hr6 h LEU 215 CO 0.20 0.61 0.08 0.74 0.09 0.00 0.00 178.44 180.16 1hr6 h THR 216 N 1.09 1.15 -0.55 0.22 2.02 -1.01 -1.52 112.91 114.30 1hr6 h THR 216 Ca 0.40 -0.44 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 1hr6 h THR 216 Cb 0.14 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.64 1hr6 h THR 216 CO -0.17 0.14 0.17 1.23 0.37 0.00 0.00 175.52 177.27 1hr6 h GLY 217 N 0.15 0.87 1.13 2.16 0.00 -0.90 0.85 103.07 107.34 1hr6 h GLY 217 Ca 0.06 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.85 1hr6 h GLY 217 CO -0.01 0.45 0.16 1.70 0.00 0.00 0.00 176.54 178.84 1hr6 h LYS 218 N 0.79 1.08 0.00 4.80 3.64 -0.69 -1.10 116.57 125.10 1hr6 h LYS 218 Ca 0.18 -0.26 -0.02 0.00 -1.27 0.00 0.00 60.65 59.28 1hr6 h LYS 218 Cb 0.23 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1hr6 h LYS 218 CO -0.01 0.96 -1.77 0.66 -2.27 0.00 0.00 179.45 177.02 1hr6 n TYR 219 N -4.23 0.00 -0.02 1.91 4.01 -0.61 -4.66 117.16 113.56 1hr6 n TYR 219 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1hr6 n TYR 219 Cb 0.26 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 1hr6 n TYR 219 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1hr6 n LEU 220 N -2.10 0.06 -0.34 7.72 7.99 0.29 -4.83 117.00 125.78 1hr6 n LEU 220 Ca -0.05 -0.42 0.09 0.00 -0.01 0.00 0.00 56.01 55.63 1hr6 n LEU 220 Cb 0.47 0.00 0.29 0.00 -0.11 0.00 0.00 43.42 44.06 1hr6 n LEU 220 CO 0.34 0.01 1.22 1.23 -1.51 0.00 0.00 177.39 178.69 1hr6 h GLY 221 N 0.00 1.58 -1.64 -0.72 0.00 -0.43 -2.42 103.07 99.44 1hr6 h GLY 221 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 1hr6 h GLY 221 CO 0.00 0.10 0.00 2.09 0.00 0.00 0.00 176.54 178.73 1hr6 n ASP 222 N -4.63 2.50 -4.77 0.19 5.75 -1.26 -4.66 116.55 109.67 1hr6 n ASP 222 Ca 0.19 -1.93 -0.41 0.00 -0.01 0.00 0.00 54.79 52.63 1hr6 n ASP 222 Cb 0.42 -0.26 -0.02 0.00 -1.03 0.00 0.00 41.12 40.23 1hr6 n ASP 222 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 1hr6 s TRP 223 N -1.47 2.97 0.08 2.11 -0.00 -0.91 -5.01 118.94 116.70 1hr6 s TRP 223 Ca 0.33 1.29 0.09 0.00 -0.00 0.00 0.00 56.10 57.81 1hr6 s TRP 223 Cb 0.18 -3.77 -0.03 0.00 -0.00 0.00 0.00 33.47 29.85 1hr6 s TRP 223 CO 0.24 -2.22 -0.24 -0.65 -0.00 0.00 0.00 176.95 174.09 1hr6 s GLN 224 N -1.50 1.40 0.67 5.86 -0.21 -1.26 -4.85 119.66 119.77 1hr6 s GLN 224 Ca 0.52 -1.14 -0.13 0.00 0.02 0.00 0.00 55.36 54.63 1hr6 s GLN 224 Cb -0.41 -1.67 0.00 0.00 1.00 0.00 0.00 33.01 31.93 1hr6 s GLN 224 CO 0.52 0.41 1.07 0.45 -2.12 0.00 0.00 175.29 175.63 1hr6 s SER 225 N -1.62 5.28 0.00 5.90 0.15 -1.26 -4.78 113.70 117.37 1hr6 s SER 225 Ca 0.10 1.79 0.23 0.00 0.70 0.00 0.00 55.95 58.77 1hr6 s SER 225 Cb -0.10 -2.52 0.08 0.00 -1.71 0.00 0.00 66.02 61.77 1hr6 s SER 225 CO 0.04 -1.51 1.13 0.35 1.20 0.00 0.00 173.24 174.45 1hr6 n THR 226 N -2.73 0.00 -3.63 6.45 -2.24 -1.26 -4.99 114.28 105.88 1hr6 n THR 226 Ca 0.09 -0.19 -0.27 0.00 -2.27 0.00 0.00 64.05 61.41 1hr6 n THR 226 Cb 0.53 1.06 0.04 0.00 -2.10 0.00 0.00 70.33 69.86 1hr6 n THR 226 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1hr6 n HIS 227 N -0.42 -1.99 -1.67 4.78 8.25 -1.26 -4.98 115.22 117.93 1hr6 n HIS 227 Ca 0.09 0.57 -0.30 0.00 -0.26 0.00 0.00 57.72 57.82 1hr6 n HIS 227 Cb 0.42 -3.67 0.07 0.00 1.12 0.00 0.00 29.99 27.93 1hr6 n HIS 227 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1hr6 s PRO 228 N -5.74 2.49 0.26 -0.41 0.04 -1.26 -5.00 135.00 125.38 1hr6 s PRO 228 Ca 0.40 0.63 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1hr6 s PRO 228 Cb -0.12 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.35 1hr6 s PRO 228 CO 0.84 -1.33 1.45 -2.14 0.04 0.00 0.00 177.00 175.85 1hr6 s PRO 229 N -5.21 4.25 -0.15 0.56 0.02 -1.26 -4.94 135.00 128.28 1hr6 s PRO 229 Ca 0.59 2.33 -0.29 0.00 0.02 0.00 0.00 61.00 63.65 1hr6 s PRO 229 Cb -0.13 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 1hr6 s PRO 229 CO 0.54 -0.43 1.25 0.42 -0.33 0.00 0.00 177.00 178.45 1hr6 s ILE 230 N -0.13 4.29 -0.31 2.83 1.09 -1.26 -4.94 121.20 122.77 1hr6 s ILE 230 Ca 0.59 1.57 0.11 0.00 -1.10 0.00 0.00 60.65 61.81 1hr6 s ILE 230 Cb -0.42 -4.01 0.46 0.00 -1.06 0.00 0.00 42.46 37.43 1hr6 s ILE 230 CO 0.45 -0.12 1.14 0.35 -0.10 0.00 0.00 174.94 176.66 1hr6 n THR 231 N 5.27 2.10 -3.54 2.92 -2.24 -1.26 -5.02 114.28 112.51 1hr6 n THR 231 Ca 0.13 -3.97 -0.41 0.00 -2.27 0.00 0.00 64.05 57.53 1hr6 n THR 231 Cb 0.45 -0.48 -0.07 0.00 -2.10 0.00 0.00 70.33 68.13 1hr6 n THR 231 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1hr6 s LYS 232 N -3.60 2.71 0.32 -0.78 1.02 -1.26 -4.99 119.74 113.17 1hr6 s LYS 232 Ca 0.43 -2.04 -0.27 0.00 0.02 0.00 0.00 55.97 54.12 1hr6 s LYS 232 Cb 0.39 -3.99 -0.10 0.00 -0.52 0.00 0.00 37.83 33.61 1hr6 s LYS 232 CO -0.02 -1.21 0.98 0.15 -0.92 0.00 0.00 175.35 174.33 1hr6 s LYS 233 N 0.88 4.54 0.50 1.68 1.02 -1.26 -5.05 119.74 122.05 1hr6 s LYS 233 Ca 0.10 1.44 -0.20 0.00 0.02 0.00 0.00 55.97 57.34 1hr6 s LYS 233 Cb -0.22 -2.85 -0.08 0.00 -0.52 0.00 0.00 37.83 34.15 1hr6 s LYS 233 CO -0.03 0.22 1.03 0.14 -0.92 0.00 0.00 175.35 175.79 1hr6 s VAL 234 N -1.52 3.89 0.02 3.17 -7.23 -1.26 -4.98 120.40 112.49 1hr6 s VAL 234 Ca 0.50 1.12 -0.30 0.00 -1.81 0.00 0.00 61.98 61.49 1hr6 s VAL 234 Cb -0.22 -3.47 -0.04 0.00 0.56 0.00 0.00 36.38 33.21 1hr6 s VAL 234 CO 0.28 -0.31 1.11 0.00 -0.31 0.00 0.00 175.10 175.86 1hr6 s ALA 235 N -2.10 3.32 -0.39 1.32 0.00 -1.26 -4.91 121.76 117.73 1hr6 s ALA 235 Ca 0.66 0.68 -0.04 0.00 0.00 0.00 0.00 51.96 53.26 1hr6 s ALA 235 Cb -0.15 -3.41 0.10 0.00 0.00 0.00 0.00 23.12 19.65 1hr6 s ALA 235 CO 0.22 -0.40 0.18 -0.65 0.00 0.00 0.00 175.76 175.11 1hr6 s GLN 236 N 1.22 2.17 0.17 0.00 -0.21 -1.26 -3.49 119.66 118.25 1hr6 s GLN 236 Ca 0.55 -1.68 -0.31 0.00 0.02 0.00 0.00 55.36 53.95 1hr6 s GLN 236 Cb -0.25 -3.56 -0.09 0.00 1.00 0.00 0.00 33.01 30.11 1hr6 s GLN 236 CO 0.27 -0.99 1.40 -0.47 -2.12 0.00 0.00 175.29 173.38 1hr6 s TYR 237 N 1.21 3.19 -0.03 0.91 6.14 -1.26 -4.68 117.35 122.83 1hr6 s TYR 237 Ca 0.05 1.00 0.02 0.00 0.64 0.00 0.00 57.07 58.79 1hr6 s TYR 237 Cb -0.22 -3.71 -0.03 0.00 0.42 0.00 0.00 41.96 38.41 1hr6 s TYR 237 CO -0.03 -2.41 0.01 0.25 0.64 0.00 0.00 175.55 174.01 1hr6 n THR 238 N 3.29 0.18 0.00 4.34 -2.24 0.12 -1.56 114.28 118.42 1hr6 n THR 238 Ca 0.09 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1hr6 n THR 238 Cb 0.42 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 1hr6 n THR 238 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hr6 n GLY 239 N 2.86 -1.94 0.00 3.38 0.00 -0.58 -4.47 105.19 104.44 1hr6 n GLY 239 Ca -0.04 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1hr6 n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hr6 n GLY 240 N -2.26 0.76 3.28 -0.02 0.00 0.00 -4.66 105.19 102.29 1hr6 n GLY 240 Ca 0.00 -1.36 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 1hr6 n GLY 240 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hr6 s GLU 241 N -1.89 1.13 -0.18 1.61 2.02 -1.26 -0.86 118.70 119.28 1hr6 s GLU 241 Ca 0.00 -1.31 -0.29 0.00 0.02 0.00 0.00 54.97 53.39 1hr6 s GLU 241 Cb 0.00 -1.09 0.13 0.00 0.10 0.00 0.00 34.13 33.27 1hr6 s GLU 241 CO 0.00 0.22 1.02 0.45 0.02 0.00 0.00 175.26 176.96 1hr6 s SER 242 N -2.53 -0.36 -0.13 -0.19 0.15 -0.79 -4.99 113.70 104.86 1hr6 s SER 242 Ca 0.12 0.44 -0.06 0.00 0.70 0.00 0.00 55.95 57.15 1hr6 s SER 242 Cb -0.05 0.35 0.06 0.00 -1.71 0.00 0.00 66.02 64.67 1hr6 s SER 242 CO 0.04 -0.31 0.29 0.00 1.20 0.00 0.00 173.24 174.47 1hr6 s ILE 244 N 1.69 4.30 0.68 0.00 -4.36 -0.39 -4.99 121.20 118.14 1hr6 s ILE 244 Ca -0.06 -1.07 -0.17 0.00 -0.26 0.00 0.00 60.65 59.09 1hr6 s ILE 244 Cb -0.11 -3.15 -0.01 0.00 1.25 0.00 0.00 42.46 40.44 1hr6 s ILE 244 CO -0.10 -0.04 0.96 -2.65 0.24 0.00 0.00 174.94 173.35 1hr6 n PRO 245 N -0.05 0.65 -1.70 0.37 -0.02 -1.26 -1.30 135.00 131.70 1hr6 n PRO 245 Ca -0.09 0.27 -0.38 0.00 -2.02 0.00 0.00 63.50 61.28 1hr6 n PRO 245 Cb 0.54 -2.20 0.05 0.00 -0.02 0.00 0.00 33.50 31.87 1hr6 n PRO 245 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1hr6 n PRO 246 N -1.53 1.31 -1.15 0.52 -0.02 -1.26 -4.32 135.00 128.56 1hr6 n PRO 246 Ca 0.13 0.49 -0.31 0.00 -2.02 0.00 0.00 63.50 61.80 1hr6 n PRO 246 Cb 0.49 -2.44 0.11 0.00 -0.02 0.00 0.00 33.50 31.64 1hr6 n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hr6 s ALA 247 N -1.37 2.09 0.30 3.55 0.00 -1.26 -4.96 121.76 120.11 1hr6 s ALA 247 Ca 0.76 0.33 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 1hr6 s ALA 247 Cb -0.41 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 1hr6 s ALA 247 CO 0.46 -1.98 1.24 -2.14 0.00 0.00 0.00 175.76 173.35 1hr6 s PRO 248 N -4.85 4.45 -0.41 0.00 0.02 -1.26 -4.98 135.00 127.96 1hr6 s PRO 248 Ca 0.62 2.07 -0.25 0.00 0.02 0.00 0.00 61.00 63.47 1hr6 s PRO 248 Cb -0.18 -3.12 0.02 0.00 0.02 0.00 0.00 34.50 31.23 1hr6 s PRO 248 CO 0.56 -0.08 0.87 0.14 -0.33 0.00 0.00 177.00 178.17 1hr6 s VAL 249 N -0.98 4.59 0.00 3.83 -7.23 -1.26 -5.02 120.40 114.33 1hr6 s VAL 249 Ca 0.49 0.84 0.00 0.00 -1.81 0.00 0.00 61.98 61.49 1hr6 s VAL 249 Cb -0.37 -4.34 0.00 0.00 0.56 0.00 0.00 36.38 32.23 1hr6 s VAL 249 CO 0.47 -0.65 0.00 0.49 -0.31 0.00 0.00 175.10 175.11 1hr6 n PHE 250 N 6.82 0.00 0.00 2.82 3.72 -1.26 -5.09 117.46 124.46 1hr6 n PHE 250 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 1hr6 n PHE 250 Cb 0.48 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 1hr6 n PHE 250 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hr6 n GLY 251 N 4.73 0.21 0.00 1.37 0.00 -1.26 -4.83 105.19 105.40 1hr6 n GLY 251 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1hr6 n GLY 251 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1hr6 n ASN 252 N 0.00 0.00 -4.72 1.61 0.23 -1.26 -4.81 115.26 106.30 1hr6 n ASN 252 Ca 0.00 0.12 -0.42 0.00 -0.53 0.00 0.00 54.58 53.75 1hr6 n ASN 252 Cb 0.00 -0.35 -0.03 0.00 -2.08 0.00 0.00 39.78 37.33 1hr6 n ASN 252 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1hr6 s LEU 253 N -2.69 4.37 0.23 -4.53 1.43 -1.26 -4.98 118.68 111.26 1hr6 s LEU 253 Ca 0.18 2.56 -0.30 0.00 -1.03 0.00 0.00 54.13 55.54 1hr6 s LEU 253 Cb 0.14 -3.60 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 1hr6 s LEU 253 CO 0.35 -0.75 1.26 -2.84 0.23 0.00 0.00 176.35 174.59 1hr6 s PRO 254 N 0.74 4.44 0.02 1.29 0.02 -1.26 -4.61 135.00 135.64 1hr6 s PRO 254 Ca 0.66 2.01 -0.30 0.00 0.02 0.00 0.00 61.00 63.39 1hr6 s PRO 254 Cb -0.42 -3.18 -0.04 0.00 0.02 0.00 0.00 34.50 30.88 1hr6 s PRO 254 CO 0.34 -0.14 1.13 -2.00 -0.33 0.00 0.00 177.00 176.00 1hr6 s GLU 255 N -0.66 4.46 0.11 5.54 2.12 -1.26 -5.03 118.70 123.99 1hr6 s GLU 255 Ca 0.53 1.63 0.09 0.00 0.36 0.00 0.00 54.97 57.58 1hr6 s GLU 255 Cb -0.36 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.57 1hr6 s GLU 255 CO 0.41 -0.23 -0.21 -0.51 -0.54 0.00 0.00 175.26 174.18 1hr6 s LEU 256 N 1.28 2.32 0.19 2.70 1.43 -1.26 -4.21 118.68 121.12 1hr6 s LEU 256 Ca 0.56 -0.72 0.07 0.00 -1.03 0.00 0.00 54.13 53.01 1hr6 s LEU 256 Cb -0.26 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 1hr6 s LEU 256 CO 0.27 0.06 0.05 -0.36 0.23 0.00 0.00 176.35 176.60 1hr6 s PHE 257 N -1.26 2.93 0.05 0.29 0.40 0.56 -4.66 117.98 116.28 1hr6 s PHE 257 Ca 0.09 -0.11 0.03 0.00 -0.60 0.00 0.00 56.93 56.34 1hr6 s PHE 257 Cb -0.09 -1.40 -0.02 0.00 0.51 0.00 0.00 43.02 42.02 1hr6 s PHE 257 CO 0.05 0.53 -0.10 -1.01 0.70 0.00 0.00 175.22 175.38 1hr6 s HIS 258 N -1.82 0.89 -0.15 0.36 3.76 -0.71 -1.54 115.29 116.07 1hr6 s HIS 258 Ca 0.29 -0.45 -0.11 0.00 -0.15 0.00 0.00 55.06 54.64 1hr6 s HIS 258 Cb -0.09 -0.52 0.05 0.00 1.11 0.00 0.00 32.58 33.13 1hr6 s HIS 258 CO 0.20 -0.02 0.38 -1.50 -0.85 0.00 0.00 174.74 172.95 1hr6 s ILE 259 N -1.23 -0.01 -0.07 0.60 2.07 -0.14 -0.27 121.20 122.14 1hr6 s ILE 259 Ca -0.06 0.05 0.03 0.00 -1.41 0.00 0.00 60.65 59.26 1hr6 s ILE 259 Cb -0.09 -0.55 0.01 0.00 0.13 0.00 0.00 42.46 41.96 1hr6 s ILE 259 CO 0.01 0.02 -0.15 -1.10 -1.91 0.00 0.00 174.94 171.81 1hr6 s GLN 260 N 0.72 1.97 -0.09 3.50 -0.21 0.23 -1.15 119.66 124.63 1hr6 s GLN 260 Ca -0.04 -0.53 0.02 0.00 0.02 0.00 0.00 55.36 54.82 1hr6 s GLN 260 Cb -0.05 -1.60 0.01 0.00 1.00 0.00 0.00 33.01 32.37 1hr6 s GLN 260 CO -0.05 0.09 -0.13 0.42 -2.12 0.00 0.00 175.29 173.50 1hr6 s ILE 261 N 0.50 1.31 0.22 1.08 1.01 -0.50 -0.51 121.20 124.31 1hr6 s ILE 261 Ca -0.14 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 59.87 1hr6 s ILE 261 Cb -0.16 -1.21 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 1hr6 s ILE 261 CO 0.05 0.40 0.37 -0.83 0.00 0.00 0.00 174.94 174.93 1hr6 s GLY 262 N 0.92 0.64 0.21 6.18 0.00 0.17 -1.09 107.32 114.36 1hr6 s GLY 262 Ca -0.09 -0.99 0.05 0.00 0.00 0.00 0.00 44.72 43.69 1hr6 s GLY 262 CO 0.00 -0.79 -0.05 -1.36 0.00 0.00 0.00 173.10 170.90 1hr6 s PHE 263 N -4.02 1.54 0.26 1.90 0.40 0.27 0.53 117.98 118.85 1hr6 s PHE 263 Ca 0.23 -0.82 -0.31 0.00 -0.60 0.00 0.00 56.93 55.43 1hr6 s PHE 263 Cb 0.02 -0.85 -0.12 0.00 0.51 0.00 0.00 43.02 42.58 1hr6 s PHE 263 CO 0.07 0.07 1.57 -1.91 0.70 0.00 0.00 175.22 175.72 1hr6 n GLU 264 N -0.37 2.52 0.00 0.44 2.13 -1.26 -0.48 120.64 123.62 1hr6 n GLU 264 Ca -0.07 0.90 0.00 0.00 0.66 0.00 0.00 57.16 58.65 1hr6 n GLU 264 Cb 0.63 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.67 1hr6 n GLU 264 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hr6 n GLY 265 N 2.58 2.15 3.53 8.31 0.00 0.13 -4.63 105.19 117.27 1hr6 n GLY 265 Ca 0.11 -1.93 -0.27 0.00 0.00 0.00 0.00 46.02 43.93 1hr6 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hr6 s LEU 266 N 0.00 2.84 0.56 0.99 1.43 -1.26 -3.98 118.68 119.26 1hr6 s LEU 266 Ca 0.00 -0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 52.26 1hr6 s LEU 266 Cb 0.00 -1.54 -0.05 0.00 0.03 0.00 0.00 46.19 44.63 1hr6 s LEU 266 CO 0.00 0.11 1.19 -2.84 0.23 0.00 0.00 176.35 175.04 1hr6 s PRO 267 N -2.75 3.19 0.65 1.29 0.02 -1.26 -4.21 135.00 131.93 1hr6 s PRO 267 Ca 0.23 1.78 0.42 0.00 0.02 0.00 0.00 61.00 63.46 1hr6 s PRO 267 Cb -0.09 -2.02 2.29 0.00 0.02 0.00 0.00 34.50 34.70 1hr6 s PRO 267 CO 0.14 -1.02 2.29 -0.84 -0.33 0.00 0.00 177.00 177.23 1hr6 h ILE 268 N 1.12 0.00 -0.44 2.83 -2.65 -1.21 -1.12 117.51 116.04 1hr6 h ILE 268 Ca -0.50 0.00 0.00 0.00 1.03 0.00 0.00 64.86 65.39 1hr6 h ILE 268 Cb 1.28 0.93 0.00 0.00 -2.05 0.00 0.00 36.82 36.99 1hr6 h ILE 268 CO 0.56 0.00 0.00 -0.90 0.03 0.00 0.00 178.15 177.84 1hr6 n ASP 269 N -3.01 3.50 -4.77 2.16 5.68 -1.26 -4.91 116.55 113.94 1hr6 n ASP 269 Ca -0.03 -2.21 -0.39 0.00 -0.50 0.00 0.00 54.79 51.66 1hr6 n ASP 269 Cb 0.10 -0.37 -0.01 0.00 -1.14 0.00 0.00 41.12 39.71 1hr6 n ASP 269 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 1hr6 s HIS 270 N -1.38 2.86 0.48 2.11 2.46 -0.43 -4.90 115.29 116.49 1hr6 s HIS 270 Ca 0.34 1.43 0.24 0.00 0.47 0.00 0.00 55.06 57.54 1hr6 s HIS 270 Cb 0.20 -3.63 1.28 0.00 -0.13 0.00 0.00 32.58 30.31 1hr6 s HIS 270 CO 0.19 -1.97 1.89 -1.35 -2.47 0.00 0.00 174.74 171.03 1hr6 h PRO 271 N 2.67 0.19 -0.55 2.88 0.11 -1.94 -1.86 132.00 133.50 1hr6 h PRO 271 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1hr6 h PRO 271 Cb 1.24 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1hr6 h PRO 271 CO 0.62 0.12 0.00 -0.25 -0.21 0.00 0.00 178.00 178.29 1hr6 n ASP 272 N -4.40 3.10 -0.33 -2.05 8.00 -1.26 -4.44 116.55 115.17 1hr6 n ASP 272 Ca 0.17 -1.98 0.01 0.00 0.71 0.00 0.00 54.79 53.70 1hr6 n ASP 272 Cb 0.77 -0.36 0.15 0.00 -0.02 0.00 0.00 41.12 41.66 1hr6 n ASP 272 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1hr6 h ILE 273 N 3.48 1.06 -0.31 0.53 -0.00 -1.64 0.88 117.51 121.50 1hr6 h ILE 273 Ca 0.00 -0.36 -0.10 0.00 -0.00 0.00 0.00 64.86 64.40 1hr6 h ILE 273 Cb 0.79 -0.07 -0.01 0.00 -0.00 0.00 0.00 36.82 37.53 1hr6 h ILE 273 CO 0.00 0.19 -0.23 1.88 -0.00 0.00 0.00 178.15 179.99 1hr6 h TYR 274 N 1.04 0.68 -0.23 2.19 0.05 -1.82 0.95 116.97 119.83 1hr6 h TYR 274 Ca 0.39 -0.14 -0.01 0.00 0.05 0.00 0.00 58.73 59.01 1hr6 h TYR 274 Cb 0.16 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1hr6 h TYR 274 CO -0.02 0.78 0.10 0.00 -1.05 0.00 0.00 178.16 177.97 1hr6 h ALA 275 N 1.22 0.30 -0.29 3.88 0.00 -1.59 -0.90 119.26 121.87 1hr6 h ALA 275 Ca 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1hr6 h ALA 275 Cb 0.68 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1hr6 h ALA 275 CO 0.05 -0.13 0.04 1.25 0.00 0.00 0.00 179.25 180.46 1hr6 h LEU 276 N 0.23 0.39 -0.49 0.00 5.85 -0.43 -0.87 115.31 119.99 1hr6 h LEU 276 Ca 0.08 -0.05 -0.17 0.00 0.84 0.00 0.00 57.88 58.58 1hr6 h LEU 276 Cb 0.14 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1hr6 h LEU 276 CO -0.01 0.42 -0.67 0.00 -0.34 0.00 0.00 178.44 177.84 1hr6 h ALA 277 N 1.64 0.68 -0.49 1.25 0.00 -0.44 -2.21 119.26 119.70 1hr6 h ALA 277 Ca 0.10 -0.58 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1hr6 h ALA 277 Cb 0.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1hr6 h ALA 277 CO 0.00 0.75 0.06 1.15 0.00 0.00 0.00 179.25 181.21 1hr6 h THR 278 N 0.26 1.25 -0.61 0.00 2.02 -0.38 -0.53 112.91 114.93 1hr6 h THR 278 Ca -0.02 -0.95 0.07 0.00 0.77 0.00 0.00 66.41 66.28 1hr6 h THR 278 Cb 1.22 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 68.49 1hr6 h THR 278 CO 0.11 0.34 0.28 0.25 0.37 0.00 0.00 175.52 176.87 1hr6 h LEU 279 N 0.69 0.36 -0.71 2.58 5.85 -0.98 0.55 115.31 123.65 1hr6 h LEU 279 Ca 0.15 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1hr6 h LEU 279 Cb 0.42 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1hr6 h LEU 279 CO 0.01 0.23 0.38 -0.61 -0.34 0.00 0.00 178.44 178.11 1hr6 h GLN 280 N 0.52 1.00 -0.34 1.25 -0.00 -1.03 0.53 115.11 117.03 1hr6 h GLN 280 Ca 0.29 -0.12 -0.12 0.00 -0.00 0.00 0.00 58.65 58.70 1hr6 h GLN 280 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.55 1hr6 h GLN 280 CO -0.24 0.76 -0.26 1.15 0.00 0.00 0.00 178.83 180.24 1hr6 h THR 281 N 0.99 1.29 -0.87 2.39 2.02 -0.16 0.24 112.91 118.80 1hr6 h THR 281 Ca 0.25 -1.41 -0.01 0.00 0.77 0.00 0.00 66.41 66.01 1hr6 h THR 281 Cb 0.05 1.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 1hr6 h THR 281 CO -0.04 0.46 0.52 0.25 0.37 0.00 0.00 175.52 177.08 1hr6 h LEU 282 N 0.56 1.05 -0.06 2.58 6.46 0.50 -2.49 115.31 123.92 1hr6 h LEU 282 Ca 0.07 -0.07 -0.09 0.00 -0.12 0.00 0.00 57.88 57.67 1hr6 h LEU 282 Cb 0.83 -0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.49 1hr6 h LEU 282 CO 0.07 0.81 -0.32 -0.07 -0.62 0.00 0.00 178.44 178.31 1hr6 h LEU 283 N 1.20 0.38 0.00 2.25 3.38 -0.77 -2.39 115.31 119.37 1hr6 h LEU 283 Ca 0.31 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1hr6 h LEU 283 Cb -0.04 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1hr6 h LEU 283 CO -0.06 0.98 0.00 0.61 0.09 0.00 0.00 178.44 180.06 1hr6 n GLY 284 N 0.73 3.34 0.00 0.83 0.00 0.83 -0.95 105.19 109.99 1hr6 n GLY 284 Ca -0.08 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1hr6 n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hr6 n GLY 285 N 0.00 -1.26 0.00 -0.02 0.00 -1.26 -1.15 105.19 101.50 1hr6 n GLY 285 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1hr6 n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hr6 n GLY 286 N -0.03 -0.57 3.89 -0.02 0.00 0.97 -4.89 105.19 104.55 1hr6 n GLY 286 Ca 0.00 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 1hr6 n GLY 286 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1hr6 s GLY 287 N 0.00 2.16 0.00 -0.02 0.00 -1.26 -0.34 107.32 107.86 1hr6 s GLY 287 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1hr6 s GLY 287 CO 0.00 -0.75 0.89 -1.26 0.00 0.00 0.00 173.10 171.98 1hr6 n SER 288 N 0.65 0.00 -0.07 1.64 2.88 -0.05 -2.72 113.62 115.95 1hr6 n SER 288 Ca -0.08 0.40 -0.08 0.00 -1.33 0.00 0.00 58.87 57.78 1hr6 n SER 288 Cb 0.52 -0.40 -0.04 0.00 -0.75 0.00 0.00 64.21 63.54 1hr6 n SER 288 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1hr6 h PHE 289 N 0.00 0.00 -6.14 0.66 3.57 -1.93 -3.51 116.94 109.59 1hr6 h PHE 289 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1hr6 h PHE 289 Cb 0.10 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1hr6 h PHE 289 CO 0.00 0.36 -0.98 -1.13 -2.23 0.00 0.00 178.31 174.33 1hr6 n SER 290 N -4.61 -6.82 -4.82 0.41 3.41 -1.10 -4.98 113.62 95.09 1hr6 n SER 290 Ca -0.11 0.61 -0.37 0.00 -0.26 0.00 0.00 58.87 58.74 1hr6 n SER 290 Cb 0.31 -2.27 -0.06 0.00 -0.26 0.00 0.00 64.21 61.92 1hr6 n SER 290 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hr6 s ALA 291 N -1.09 3.73 0.00 7.33 0.00 -1.26 -5.00 121.76 125.47 1hr6 s ALA 291 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1hr6 s ALA 291 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.87 1hr6 s ALA 291 CO 0.15 0.43 0.00 0.41 0.00 0.00 0.00 175.76 176.75 1hr6 n GLY 292 N 2.24 4.47 1.18 0.00 0.00 -1.26 -5.09 105.19 106.73 1hr6 n GLY 292 Ca -0.15 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 1hr6 n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hr6 n GLY 293 N -1.95 -1.44 3.42 -0.02 0.00 -1.26 -4.91 105.19 99.03 1hr6 n GLY 293 Ca 0.00 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 1hr6 n GLY 293 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1hr6 n PRO 294 N -1.98 0.45 0.00 1.61 -0.02 -1.26 -3.32 135.00 130.49 1hr6 n PRO 294 Ca 0.05 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 1hr6 n PRO 294 Cb 0.18 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 1hr6 n PRO 294 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hr6 n GLY 295 N 1.90 1.36 0.33 -1.23 0.00 -1.26 -4.96 105.19 101.33 1hr6 n GLY 295 Ca 0.11 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.36 1hr6 n GLY 295 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1hr6 h LYS 296 N 3.25 0.00 0.00 1.61 2.10 -1.90 -3.46 116.57 118.16 1hr6 h LYS 296 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1hr6 h LYS 296 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1hr6 h LYS 296 CO 0.00 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 177.86 1hr6 n GLY 297 N -0.94 0.77 0.05 0.07 0.00 -1.26 -5.01 105.19 98.86 1hr6 n GLY 297 Ca -0.03 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.13 1hr6 n GLY 297 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1hr6 n MET 298 N 0.00 0.36 -0.94 1.61 0.00 -1.26 -3.55 117.12 113.34 1hr6 n MET 298 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 57.70 57.60 1hr6 n MET 298 Cb 0.00 -1.50 0.34 0.00 0.00 0.00 0.00 33.22 32.06 1hr6 n MET 298 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1hr6 n TYR 299 N -1.24 2.22 -3.34 3.17 4.01 -1.26 -4.41 117.16 116.31 1hr6 n TYR 299 Ca 0.11 -1.03 -0.34 0.00 -0.16 0.00 0.00 57.90 56.49 1hr6 n TYR 299 Cb 0.29 -0.60 -0.06 0.00 -0.31 0.00 0.00 39.34 38.66 1hr6 n TYR 299 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1hr6 s SER 300 N -1.04 6.75 0.26 7.72 1.04 -1.23 -4.91 113.70 122.28 1hr6 s SER 300 Ca 0.54 1.06 -0.02 0.00 0.48 0.00 0.00 55.95 58.01 1hr6 s SER 300 Cb 0.43 -2.28 0.54 0.00 0.10 0.00 0.00 66.02 64.81 1hr6 s SER 300 CO 0.14 -0.02 1.70 0.03 0.98 0.00 0.00 173.24 176.07 1hr6 h ARG 301 N 2.95 0.35 0.00 4.02 3.08 -1.44 0.99 114.38 124.33 1hr6 h ARG 301 Ca -0.48 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.54 1hr6 h ARG 301 Cb 1.18 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 31.15 1hr6 h ARG 301 CO 0.67 0.23 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.68 1hr6 h LEU 302 N 0.36 0.00 0.07 3.04 3.38 -1.29 0.46 115.31 121.33 1hr6 h LEU 302 Ca 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.43 1hr6 h LEU 302 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1hr6 h LEU 302 CO -0.49 0.06 -0.03 1.88 0.09 0.00 0.00 178.44 179.95 1hr6 h TYR 303 N 0.00 -0.09 0.25 1.13 0.05 -1.05 -0.97 116.97 116.30 1hr6 h TYR 303 Ca -0.00 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1hr6 h TYR 303 Cb 0.13 0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.90 1hr6 h TYR 303 CO 0.00 0.46 -0.12 1.15 -1.05 0.00 0.00 178.16 178.60 1hr6 h THR 304 N -0.90 0.78 0.00 -2.88 2.02 -0.91 0.12 112.91 111.14 1hr6 h THR 304 Ca -0.01 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1hr6 h THR 304 Cb 0.59 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1hr6 h THR 304 CO 0.02 0.04 -0.41 1.41 0.37 0.00 0.00 175.52 176.94 1hr6 n HIS 305 N -5.20 0.62 0.02 3.16 8.25 0.16 -4.30 115.22 117.93 1hr6 n HIS 305 Ca -0.10 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1hr6 n HIS 305 Cb 0.18 -0.71 0.00 0.00 1.12 0.00 0.00 29.99 30.58 1hr6 n HIS 305 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1hr6 n VAL 306 N -2.10 0.37 -0.16 1.59 0.31 -0.98 -4.61 118.33 112.75 1hr6 n VAL 306 Ca 0.04 0.12 -0.02 0.00 -0.01 0.00 0.00 64.34 64.47 1hr6 n VAL 306 Cb 0.43 -1.06 0.07 0.00 -0.91 0.00 0.00 33.84 32.36 1hr6 n VAL 306 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1hr6 h LEU 307 N 0.00 0.06 -0.98 7.52 -0.00 -0.84 0.95 115.31 122.01 1hr6 h LEU 307 Ca 0.00 0.08 -0.09 0.00 -0.00 0.00 0.00 57.88 57.88 1hr6 h LEU 307 Cb 0.00 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 1hr6 h LEU 307 CO 0.00 0.06 -0.41 0.78 -0.00 0.00 0.00 178.44 178.87 1hr6 h ASN 308 N 0.27 0.00 0.10 -0.43 2.35 -0.98 -3.33 115.58 113.57 1hr6 h ASN 308 Ca 0.25 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.79 1hr6 h ASN 308 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 1hr6 h ASN 308 CO -0.31 0.41 -1.05 1.56 -1.65 0.00 0.00 177.43 176.39 1hr6 h GLN 309 N 0.00 0.21 -5.23 0.81 1.08 -1.51 -3.46 115.11 107.02 1hr6 h GLN 309 Ca -0.00 -0.36 -0.66 0.00 -1.45 0.00 0.00 58.65 56.17 1hr6 h GLN 309 Cb 0.88 0.13 -0.29 0.00 -0.05 0.00 0.00 27.48 28.16 1hr6 h GLN 309 CO 0.05 1.17 -0.79 0.71 -0.95 0.00 0.00 178.83 179.03 1hr6 s TYR 310 N -2.42 2.80 -1.53 2.96 2.02 0.24 -4.98 117.35 116.43 1hr6 s TYR 310 Ca -0.19 -0.88 0.17 0.00 -0.37 0.00 0.00 57.07 55.80 1hr6 s TYR 310 Cb 0.03 -1.88 -0.00 0.00 -0.40 0.00 0.00 41.96 39.70 1hr6 s TYR 310 CO 0.76 -0.37 0.88 2.48 -1.57 0.00 0.00 175.55 177.73 1hr6 n TYR 311 N 3.88 0.00 0.55 2.71 4.11 -1.26 -3.80 117.16 123.35 1hr6 n TYR 311 Ca -0.19 0.00 0.05 0.00 -0.00 0.00 0.00 57.90 57.77 1hr6 n TYR 311 Cb 0.52 0.00 0.29 0.00 -0.00 0.00 0.00 39.34 40.15 1hr6 n TYR 311 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.86 178.83 1hr6 n PHE 312 N -0.09 0.00 -3.58 -3.48 1.16 -1.26 -4.19 117.46 106.02 1hr6 n PHE 312 Ca 0.07 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.24 1hr6 n PHE 312 Cb 0.35 -0.25 -0.11 0.00 -1.61 0.00 0.00 39.48 37.86 1hr6 n PHE 312 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1hr6 s VAL 313 N -2.50 4.77 -0.92 1.97 1.01 -1.25 -0.87 120.40 122.61 1hr6 s VAL 313 Ca 0.11 -0.68 0.23 0.00 0.00 0.00 0.00 61.98 61.64 1hr6 s VAL 313 Cb 0.08 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.75 1hr6 s VAL 313 CO 0.16 -0.17 1.14 -1.84 0.00 0.00 0.00 175.10 174.39 1hr6 n GLU 314 N 5.03 0.06 -3.64 2.72 -0.00 -0.65 -4.71 120.64 119.45 1hr6 n GLU 314 Ca -0.12 -0.00 -0.11 0.00 -0.00 0.00 0.00 57.16 56.93 1hr6 n GLU 314 Cb 0.47 -1.52 -0.07 0.00 -0.00 0.00 0.00 31.44 30.32 1hr6 n GLU 314 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1hr6 s ASN 315 N -3.18 -0.81 -0.22 -1.84 3.04 -1.15 -0.87 114.94 109.91 1hr6 s ASN 315 Ca 0.08 1.42 -0.06 0.00 0.04 0.00 0.00 52.86 54.34 1hr6 s ASN 315 Cb 0.16 1.37 0.11 0.00 -1.54 0.00 0.00 41.25 41.35 1hr6 s ASN 315 CO 0.79 -0.24 0.45 0.00 -3.04 0.00 0.00 177.10 175.06 1hr6 s VAL 317 N 2.65 0.11 -0.09 0.00 0.11 -0.16 -0.02 120.40 123.01 1hr6 s VAL 317 Ca 0.01 -0.93 -0.15 0.00 -2.93 0.00 0.00 61.98 57.97 1hr6 s VAL 317 Cb -0.13 -0.96 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 1hr6 s VAL 317 CO -0.14 -0.51 0.38 0.00 -3.33 0.00 0.00 175.10 171.49 1hr6 s ALA 318 N -2.72 3.62 0.06 1.54 0.00 -0.30 -0.03 121.76 123.94 1hr6 s ALA 318 Ca -0.04 -0.30 0.09 0.00 0.00 0.00 0.00 51.96 51.71 1hr6 s ALA 318 Cb -0.00 -2.43 -0.03 0.00 0.00 0.00 0.00 23.12 20.65 1hr6 s ALA 318 CO -0.05 0.25 -0.26 -0.59 0.00 0.00 0.00 175.76 175.11 1hr6 s PHE 319 N -0.16 2.35 -0.40 0.00 -0.12 -0.07 -4.88 117.98 114.70 1hr6 s PHE 319 Ca 0.22 -0.39 0.02 0.00 -0.05 0.00 0.00 56.93 56.73 1hr6 s PHE 319 Cb -0.15 -1.37 0.15 0.00 -0.63 0.00 0.00 43.02 41.03 1hr6 s PHE 319 CO 0.09 0.19 0.27 1.21 -0.05 0.00 0.00 175.22 176.93 1hr6 s ASN 320 N -1.45 2.54 -0.42 1.98 3.04 -1.26 -1.57 114.94 117.80 1hr6 s ASN 320 Ca 0.13 -2.63 -0.26 0.00 0.04 0.00 0.00 52.86 50.14 1hr6 s ASN 320 Cb -0.10 -0.53 0.02 0.00 -1.54 0.00 0.00 41.25 39.10 1hr6 s ASN 320 CO 0.03 -0.24 0.96 -1.00 -3.04 0.00 0.00 177.10 173.81 1hr6 s HIS 321 N 0.52 2.98 -0.18 0.43 3.76 -0.40 -4.95 115.29 117.45 1hr6 s HIS 321 Ca 0.24 0.63 0.00 0.00 -0.15 0.00 0.00 55.06 55.78 1hr6 s HIS 321 Cb -0.12 -3.89 0.01 0.00 1.11 0.00 0.00 32.58 29.69 1hr6 s HIS 321 CO -0.08 -1.00 -0.17 0.45 -0.85 0.00 0.00 174.74 173.10 1hr6 s SER 322 N 2.10 3.37 0.02 1.40 0.15 -1.26 -0.43 113.70 119.06 1hr6 s SER 322 Ca 0.39 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.46 1hr6 s SER 322 Cb -0.10 -1.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 1hr6 s SER 322 CO 0.23 0.02 0.01 -1.22 1.20 0.00 0.00 173.24 173.47 1hr6 n TYR 323 N 4.52 -0.46 -0.34 3.44 4.01 0.62 -4.59 117.16 124.36 1hr6 n TYR 323 Ca -0.20 -0.09 -0.03 0.00 -0.16 0.00 0.00 57.90 57.41 1hr6 n TYR 323 Cb 0.50 -0.01 0.10 0.00 -0.31 0.00 0.00 39.34 39.62 1hr6 n TYR 323 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1hr6 h SER 324 N 0.04 1.12 0.00 7.72 4.64 -1.95 0.14 113.55 125.26 1hr6 h SER 324 Ca -0.02 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1hr6 h SER 324 Cb 0.05 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 61.86 1hr6 h SER 324 CO 0.03 0.88 0.00 -0.90 -0.87 0.00 0.00 176.83 175.96 1hr6 n ASP 325 N -4.34 1.16 -2.21 4.97 5.75 -1.26 -4.58 116.55 116.03 1hr6 n ASP 325 Ca 0.10 -1.43 -0.00 0.00 -0.01 0.00 0.00 54.79 53.45 1hr6 n ASP 325 Cb 0.08 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.17 1hr6 n ASP 325 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1hr6 n SER 326 N -0.21 -0.72 -3.58 -1.12 2.88 -1.25 -4.49 113.62 105.11 1hr6 n SER 326 Ca 0.00 -1.30 -0.01 0.00 -1.33 0.00 0.00 58.87 56.23 1hr6 n SER 326 Cb 0.22 1.16 0.01 0.00 -0.75 0.00 0.00 64.21 64.84 1hr6 n SER 326 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1hr6 s GLY 327 N -2.89 -0.11 -0.07 0.46 0.00 -1.26 -0.28 107.32 103.17 1hr6 s GLY 327 Ca 0.12 0.05 -0.00 0.00 0.00 0.00 0.00 44.72 44.89 1hr6 s GLY 327 CO 0.01 2.07 -0.04 -0.42 0.00 0.00 0.00 173.10 174.73 1hr6 s ILE 328 N -2.42 0.63 -0.05 0.90 1.01 0.43 0.22 121.20 121.91 1hr6 s ILE 328 Ca 0.20 -0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.81 1hr6 s ILE 328 Cb -0.00 -0.70 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 1hr6 s ILE 328 CO 0.02 0.28 -0.24 0.12 0.00 0.00 0.00 174.94 175.11 1hr6 s PHE 329 N 1.47 2.37 0.00 3.97 2.19 0.37 -1.28 117.98 127.08 1hr6 s PHE 329 Ca -0.02 -0.69 0.00 0.00 0.33 0.00 0.00 56.93 56.55 1hr6 s PHE 329 Cb -0.13 -1.56 0.00 0.00 -1.31 0.00 0.00 43.02 40.02 1hr6 s PHE 329 CO -0.04 -0.21 0.00 0.41 1.83 0.00 0.00 175.22 177.22 1hr6 n GLY 330 N 2.94 0.74 3.08 13.12 0.00 -0.61 -0.57 105.19 123.90 1hr6 n GLY 330 Ca -0.17 -0.58 -0.19 0.00 0.00 0.00 0.00 46.02 45.07 1hr6 n GLY 330 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hr6 s ILE 331 N -1.97 0.89 -0.05 -0.61 1.01 -0.25 -0.89 121.20 119.33 1hr6 s ILE 331 Ca 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.03 1hr6 s ILE 331 Cb 0.00 -0.78 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 1hr6 s ILE 331 CO 0.00 0.13 -0.11 -0.55 0.00 0.00 0.00 174.94 174.42 1hr6 s SER 332 N -0.58 4.33 -0.06 3.58 0.15 0.96 -1.41 113.70 120.67 1hr6 s SER 332 Ca 0.03 -0.12 -0.04 0.00 0.70 0.00 0.00 55.95 56.51 1hr6 s SER 332 Cb -0.05 -0.99 0.03 0.00 -1.71 0.00 0.00 66.02 63.29 1hr6 s SER 332 CO 0.00 0.35 0.15 -0.22 1.20 0.00 0.00 173.24 174.72 1hr6 s LEU 333 N -0.83 1.09 -0.04 3.45 1.98 -0.30 -0.98 118.68 123.04 1hr6 s LEU 333 Ca 0.12 0.31 0.05 0.00 -2.89 0.00 0.00 54.13 51.72 1hr6 s LEU 333 Cb -0.11 0.45 -0.00 0.00 0.66 0.00 0.00 46.19 47.19 1hr6 s LEU 333 CO 0.01 -0.10 -0.18 -0.44 -1.89 0.00 0.00 176.35 173.75 1hr6 s SER 334 N 0.60 2.29 0.28 3.68 0.01 0.15 -0.97 113.70 119.74 1hr6 s SER 334 Ca -0.04 -0.38 -0.13 0.00 1.31 0.00 0.00 55.95 56.71 1hr6 s SER 334 Cb -0.06 -0.63 0.01 0.00 0.21 0.00 0.00 66.02 65.55 1hr6 s SER 334 CO -0.03 0.17 0.55 0.00 0.41 0.00 0.00 173.24 174.34 1hr6 s ILE 336 N -3.68 3.19 0.50 0.00 -1.09 -0.05 -0.33 121.20 119.75 1hr6 s ILE 336 Ca 0.21 1.07 0.34 0.00 -2.23 0.00 0.00 60.65 60.05 1hr6 s ILE 336 Cb -0.02 -3.63 0.54 0.00 -1.58 0.00 0.00 42.46 37.77 1hr6 s ILE 336 CO 0.11 0.16 1.74 -0.65 -1.23 0.00 0.00 174.94 175.07 1hr6 h PRO 337 N 3.03 0.09 -0.64 2.79 0.11 -1.92 0.13 132.00 135.59 1hr6 h PRO 337 Ca -0.48 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 1hr6 h PRO 337 Cb 1.23 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1hr6 h PRO 337 CO 0.64 0.06 0.24 1.96 -0.21 0.00 0.00 178.00 180.68 1hr6 h GLN 338 N 0.09 0.96 0.00 1.05 7.50 -1.95 -2.85 115.11 119.90 1hr6 h GLN 338 Ca 0.66 -0.17 0.00 0.00 0.50 0.00 0.00 58.65 59.64 1hr6 h GLN 338 Cb 2.37 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 29.75 1hr6 h GLN 338 CO -0.12 0.80 -0.16 0.00 -1.50 0.00 0.00 178.83 177.84 1hr6 n ALA 339 N -2.45 2.60 -0.37 3.87 0.00 0.45 -4.35 120.51 120.26 1hr6 n ALA 339 Ca 0.05 -0.14 0.03 0.00 0.00 0.00 0.00 53.44 53.38 1hr6 n ALA 339 Cb 0.19 -1.37 0.09 0.00 0.00 0.00 0.00 19.45 18.36 1hr6 n ALA 339 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hr6 n ALA 340 N -1.62 0.07 0.26 0.00 0.00 -1.08 0.55 120.51 118.70 1hr6 n ALA 340 Ca 0.06 1.04 0.10 0.00 0.00 0.00 0.00 53.44 54.64 1hr6 n ALA 340 Cb 0.38 -0.55 0.53 0.00 0.00 0.00 0.00 19.45 19.80 1hr6 n ALA 340 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1hr6 h PRO 341 N 0.00 0.00 0.00 0.00 0.11 -1.16 -0.68 132.00 130.27 1hr6 h PRO 341 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1hr6 h PRO 341 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1hr6 h PRO 341 CO -1.00 0.00 -1.59 1.04 -0.21 0.00 0.00 178.00 176.24 1hr6 n GLN 342 N -2.49 0.53 -0.08 1.05 6.02 0.19 -4.70 117.38 117.90 1hr6 n GLN 342 Ca -0.01 -0.12 -0.14 0.00 -0.01 0.00 0.00 57.00 56.71 1hr6 n GLN 342 Cb 0.43 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 30.12 1hr6 n GLN 342 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hr6 h ALA 343 N 2.23 -0.83 -0.41 -1.58 0.00 -1.03 -1.03 119.26 116.61 1hr6 h ALA 343 Ca 0.00 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1hr6 h ALA 343 Cb 0.78 1.08 -0.09 0.00 0.00 0.00 0.00 17.79 19.56 1hr6 h ALA 343 CO 0.00 -1.07 -0.24 0.28 0.00 0.00 0.00 179.25 178.23 1hr6 h VAL 344 N -0.48 0.35 -0.77 0.00 2.07 -1.84 -0.75 116.25 114.84 1hr6 h VAL 344 Ca 0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.54 1hr6 h VAL 344 Cb 0.63 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1hr6 h VAL 344 CO -0.52 0.00 0.33 -0.08 0.02 0.00 0.00 177.57 177.32 1hr6 h GLU 345 N -0.16 1.13 -0.38 1.57 4.81 -1.79 0.14 114.58 119.90 1hr6 h GLU 345 Ca 0.20 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1hr6 h GLU 345 Cb 0.47 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 1hr6 h GLU 345 CO -0.51 0.91 0.08 0.28 -0.73 0.00 0.00 179.01 179.04 1hr6 h VAL 346 N 1.10 0.82 0.03 0.32 2.07 -0.05 0.83 116.25 121.36 1hr6 h VAL 346 Ca 0.26 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 1hr6 h VAL 346 Cb 0.18 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1hr6 h VAL 346 CO -0.03 0.04 -0.01 0.40 0.02 0.00 0.00 177.57 177.99 1hr6 h ILE 347 N 0.21 1.17 -0.84 4.57 2.04 -0.77 -2.71 117.51 121.19 1hr6 h ILE 347 Ca 0.18 -0.61 0.15 0.00 1.00 0.00 0.00 64.86 65.58 1hr6 h ILE 347 Cb 0.21 1.58 -0.10 0.00 -0.74 0.00 0.00 36.82 37.77 1hr6 h ILE 347 CO -0.23 0.16 0.41 0.00 0.00 0.00 0.00 178.15 178.48 1hr6 h ALA 348 N 0.66 1.25 -0.33 1.87 0.00 -0.37 -0.74 119.26 121.61 1hr6 h ALA 348 Ca -0.00 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1hr6 h ALA 348 Cb 0.29 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1hr6 h ALA 348 CO 0.01 -0.14 0.18 1.96 0.00 0.00 0.00 179.25 181.26 1hr6 h GLN 349 N 0.57 0.37 -0.83 0.00 4.20 -0.70 -0.28 115.11 118.44 1hr6 h GLN 349 Ca 0.46 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 59.15 1hr6 h GLN 349 Cb 0.69 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1hr6 h GLN 349 CO -0.39 0.24 0.49 1.96 -0.67 0.00 0.00 178.83 180.47 1hr6 h GLN 350 N 0.38 1.12 -0.34 1.46 1.08 -0.85 0.21 115.11 118.17 1hr6 h GLN 350 Ca 0.13 -0.10 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 1hr6 h GLN 350 Cb 0.01 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.20 1hr6 h GLN 350 CO -0.07 0.79 -0.32 0.52 -0.95 0.00 0.00 178.83 178.80 1hr6 h MET 351 N 1.14 0.82 -0.37 1.46 2.86 -0.90 -3.03 114.93 116.90 1hr6 h MET 351 Ca 0.30 -0.43 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1hr6 h MET 351 Cb -0.04 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1hr6 h MET 351 CO -0.05 1.06 0.19 -0.92 1.06 0.00 0.00 176.91 178.25 1hr6 h TYR 352 N 0.60 0.52 0.00 -0.22 3.20 -0.61 -2.79 116.97 117.67 1hr6 h TYR 352 Ca 0.06 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1hr6 h TYR 352 Cb 0.90 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.01 1hr6 h TYR 352 CO 0.07 0.42 0.00 0.09 -1.64 0.00 0.00 178.16 177.10 1hr6 n ASN 353 N -4.74 0.00 0.11 -2.11 3.02 0.71 -1.18 115.26 111.07 1hr6 n ASN 353 Ca -0.00 0.06 0.04 0.00 -0.03 0.00 0.00 54.58 54.65 1hr6 n ASN 353 Cb 0.09 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1hr6 n ASN 353 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1hr6 h THR 354 N 0.00 0.52 0.00 3.41 1.35 -1.45 -3.42 112.91 113.32 1hr6 h THR 354 Ca 0.00 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 1hr6 h THR 354 Cb 0.04 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1hr6 h THR 354 CO 0.00 0.29 0.00 2.22 -0.25 0.00 0.00 175.52 177.78 1hr6 n PHE 355 N -3.02 0.00 1.38 4.73 -1.74 -0.99 -4.47 117.46 113.36 1hr6 n PHE 355 Ca -0.02 0.00 0.10 0.00 -0.56 0.00 0.00 57.45 56.97 1hr6 n PHE 355 Cb 0.72 0.00 0.40 0.00 1.52 0.00 0.00 39.48 42.12 1hr6 n PHE 355 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1hr6 n ALA 356 N -1.18 2.54 -3.65 1.98 0.00 -0.32 -4.69 120.51 115.18 1hr6 n ALA 356 Ca 0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 1hr6 n ALA 356 Cb 0.00 -1.13 -0.10 0.00 0.00 0.00 0.00 19.45 18.22 1hr6 n ALA 356 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1hr6 s ASN 357 N -1.56 5.43 0.66 0.00 3.84 -1.23 -4.95 114.94 117.14 1hr6 s ASN 357 Ca 0.31 -1.92 0.31 0.00 0.21 0.00 0.00 52.86 51.77 1hr6 s ASN 357 Cb 0.16 -1.90 1.71 0.00 -0.55 0.00 0.00 41.25 40.67 1hr6 s ASN 357 CO 0.25 -0.59 1.97 0.07 -2.79 0.00 0.00 177.10 176.02 1hr6 h LYS 358 N 8.22 0.00 -0.01 0.43 2.10 -1.96 -0.88 116.57 124.47 1hr6 h LYS 358 Ca -0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.48 1hr6 h LYS 358 Cb 1.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1hr6 h LYS 358 CO 0.75 0.00 -0.57 -0.25 -2.00 0.00 0.00 179.45 177.38 1hr6 n ASP 359 N -2.98 1.56 -1.67 7.07 8.00 -1.26 -4.34 116.55 122.92 1hr6 n ASP 359 Ca -0.01 -1.28 -0.08 0.00 0.71 0.00 0.00 54.79 54.12 1hr6 n ASP 359 Cb 0.36 0.64 0.08 0.00 -0.02 0.00 0.00 41.12 42.18 1hr6 n ASP 359 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1hr6 n LEU 360 N -0.50 3.30 -4.67 0.64 4.77 -0.36 -5.08 117.00 115.11 1hr6 n LEU 360 Ca 0.07 -3.92 -0.32 0.00 -0.03 0.00 0.00 56.01 51.81 1hr6 n LEU 360 Cb 0.38 -0.23 0.16 0.00 -2.33 0.00 0.00 43.42 41.40 1hr6 n LEU 360 CO 0.29 1.55 0.68 -1.14 -1.33 0.00 0.00 177.39 177.44 1hr6 n ARG 361 N -0.68 -0.30 -2.35 3.23 3.00 -1.07 -4.68 116.66 113.81 1hr6 n ARG 361 Ca 0.26 -0.02 -0.42 0.00 -0.00 0.00 0.00 57.85 57.67 1hr6 n ARG 361 Cb 0.88 -2.38 -0.03 0.00 0.00 0.00 0.00 32.46 30.94 1hr6 n ARG 361 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1hr6 s LEU 362 N -6.21 4.26 0.45 6.15 1.43 -1.26 -5.00 118.68 118.50 1hr6 s LEU 362 Ca 0.68 1.89 -0.12 0.00 -1.03 0.00 0.00 54.13 55.55 1hr6 s LEU 362 Cb -0.25 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.36 1hr6 s LEU 362 CO 0.56 -0.70 0.84 0.42 0.23 0.00 0.00 176.35 177.71 1hr6 s THR 363 N 2.78 4.73 0.25 5.49 -4.23 -1.26 -4.91 115.64 118.49 1hr6 s THR 363 Ca 0.59 0.74 -0.03 0.00 -1.18 0.00 0.00 61.69 61.81 1hr6 s THR 363 Cb -0.26 -3.75 0.22 0.00 1.34 0.00 0.00 72.50 70.05 1hr6 s THR 363 CO 0.21 -0.63 1.74 -0.33 -0.54 0.00 0.00 174.62 175.07 1hr6 h GLU 364 N 0.97 0.48 -0.40 3.99 4.39 -1.99 -0.40 114.58 121.63 1hr6 h GLU 364 Ca -0.47 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.17 1hr6 h GLU 364 Cb 1.19 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1hr6 h GLU 364 CO 0.63 0.32 0.11 -0.44 -1.16 0.00 0.00 179.01 178.47 1hr6 h ASP 365 N 0.49 0.59 0.62 1.42 3.32 -1.98 0.25 116.42 121.13 1hr6 h ASP 365 Ca 0.43 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1hr6 h ASP 365 Cb 0.64 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1hr6 h ASP 365 CO -0.39 0.65 -0.33 -0.33 -1.72 0.00 0.00 179.24 177.11 1hr6 h GLU 366 N 0.50 -0.85 -0.36 3.56 5.08 -1.72 -1.49 114.58 119.29 1hr6 h GLU 366 Ca 0.13 0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.57 1hr6 h GLU 366 Cb 0.28 0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1hr6 h GLU 366 CO -0.00 -0.57 0.17 0.28 -1.00 0.00 0.00 179.01 177.89 1hr6 h VAL 367 N -0.89 0.96 -0.80 3.13 2.07 -1.02 -0.15 116.25 119.57 1hr6 h VAL 367 Ca -0.08 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.35 1hr6 h VAL 367 Cb 0.70 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1hr6 h VAL 367 CO 0.11 0.06 0.50 -1.28 0.02 0.00 0.00 177.57 176.99 1hr6 h SER 368 N 0.35 0.83 -0.18 0.57 0.87 -0.42 0.11 113.55 115.68 1hr6 h SER 368 Ca 0.15 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 1hr6 h SER 368 Cb 0.08 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1hr6 h SER 368 CO -0.12 0.56 -0.11 -0.09 -0.53 0.00 0.00 176.83 176.55 1hr6 h ARG 369 N 0.97 0.38 -0.50 2.24 2.43 -0.92 -2.11 114.38 116.87 1hr6 h ARG 369 Ca 0.32 -0.18 0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1hr6 h ARG 369 Cb 0.03 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 1hr6 h ARG 369 CO -0.12 0.71 0.27 0.00 -1.51 0.00 0.00 179.97 179.32 1hr6 h ALA 370 N 0.66 0.64 -0.08 2.80 0.00 -0.68 -0.46 119.26 122.16 1hr6 h ALA 370 Ca 0.04 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1hr6 h ALA 370 Cb 0.61 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1hr6 h ALA 370 CO 0.03 -0.07 -0.18 0.87 0.00 0.00 0.00 179.25 179.90 1hr6 h LYS 371 N 0.52 -0.24 -0.47 0.00 1.57 -0.74 -0.78 116.57 116.43 1hr6 h LYS 371 Ca 0.22 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 1hr6 h LYS 371 Cb 0.10 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 1hr6 h LYS 371 CO -0.14 -0.16 0.19 -0.91 -0.57 0.00 0.00 179.45 177.86 1hr6 h ASN 372 N -0.25 0.61 0.71 0.86 2.35 -0.79 -1.28 115.58 117.79 1hr6 h ASN 372 Ca 0.08 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.65 1hr6 h ASN 372 Cb 0.36 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1hr6 h ASN 372 CO -0.22 0.55 -0.54 1.56 -1.65 0.00 0.00 177.43 177.13 1hr6 h GLN 373 N 0.67 0.00 0.22 0.81 4.20 -0.56 -0.97 115.11 119.49 1hr6 h GLN 373 Ca 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 1hr6 h GLN 373 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1hr6 h GLN 373 CO -0.02 0.54 -0.11 1.25 -0.67 0.00 0.00 178.83 179.83 1hr6 h LEU 374 N 0.00 -0.26 -0.65 1.46 5.85 -0.54 -1.18 115.31 119.99 1hr6 h LEU 374 Ca -0.01 -0.27 0.14 0.00 0.84 0.00 0.00 57.88 58.58 1hr6 h LEU 374 Cb 1.04 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 42.03 1hr6 h LEU 374 CO 0.07 0.22 0.01 0.11 -0.34 0.00 0.00 178.44 178.51 1hr6 h LYS 375 N -0.82 0.12 0.09 1.25 1.57 -1.20 -1.62 116.57 115.96 1hr6 h LYS 375 Ca -0.03 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1hr6 h LYS 375 Cb 0.51 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1hr6 h LYS 375 CO 0.05 0.08 -0.18 1.03 -0.57 0.00 0.00 179.45 179.87 1hr6 h SER 376 N 0.13 -0.49 0.20 0.86 0.87 -1.12 -0.26 113.55 113.73 1hr6 h SER 376 Ca 0.34 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.88 1hr6 h SER 376 Cb 0.57 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 1hr6 h SER 376 CO -0.55 -0.25 -0.33 0.77 -0.53 0.00 0.00 176.83 175.94 1hr6 h SER 377 N -0.33 0.21 0.49 6.23 4.64 -0.72 0.18 113.55 124.25 1hr6 h SER 377 Ca 0.03 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 1hr6 h SER 377 Cb 0.36 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1hr6 h SER 377 CO -0.11 0.53 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.08 1hr6 h LEU 378 N 0.18 -0.55 -1.28 5.97 3.38 -1.04 -1.98 115.31 119.98 1hr6 h LEU 378 Ca 0.02 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1hr6 h LEU 378 Cb 0.68 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 1hr6 h LEU 378 CO 0.05 -0.17 0.50 -0.07 0.09 0.00 0.00 178.44 178.83 1hr6 h LEU 379 N -1.01 0.82 -0.31 1.67 3.38 -1.01 -1.61 115.31 117.23 1hr6 h LEU 379 Ca -0.07 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.69 1hr6 h LEU 379 Cb 0.59 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1hr6 h LEU 379 CO 0.11 0.58 -0.71 0.24 0.09 0.00 0.00 178.44 178.75 1hr6 h MET 380 N 0.96 0.61 -0.61 1.13 2.86 -1.00 -2.93 114.93 115.95 1hr6 h MET 380 Ca 0.29 -0.48 -0.06 0.00 -2.06 0.00 0.00 59.70 57.39 1hr6 h MET 380 Cb -0.03 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1hr6 h MET 380 CO -0.07 1.10 0.13 -0.97 1.06 0.00 0.00 176.91 178.16 1hr6 h ASN 381 N 0.43 0.91 0.04 1.22 -0.00 -0.99 -1.95 115.58 115.24 1hr6 h ASN 381 Ca -0.03 -0.18 0.00 0.00 -0.00 0.00 0.00 56.30 56.08 1hr6 h ASN 381 Cb 1.31 -0.24 0.00 0.00 -0.00 0.00 0.00 38.32 39.39 1hr6 h ASN 381 CO 0.14 0.89 0.00 0.18 -0.00 0.00 0.00 177.43 178.64 1hr6 n LEU 382 N -4.25 0.00 0.23 0.34 4.32 -0.64 -2.55 117.00 114.46 1hr6 n LEU 382 Ca 0.04 0.06 0.12 0.00 -0.02 0.00 0.00 56.01 56.21 1hr6 n LEU 382 Cb 0.25 -0.06 0.43 0.00 -1.62 0.00 0.00 43.42 42.42 1hr6 n LEU 382 CO 0.41 -0.04 0.83 -0.33 -1.22 0.00 0.00 177.39 177.04 1hr6 h GLU 383 N 0.00 0.00 -6.23 3.23 5.08 -1.30 -3.42 114.58 111.94 1hr6 h GLU 383 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 1hr6 h GLU 383 Cb 0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1hr6 h GLU 383 CO 0.00 0.14 0.19 0.45 -1.00 0.00 0.00 179.01 178.80 1hr6 s SER 384 N -6.07 7.18 0.16 1.42 0.15 -1.06 -4.97 113.70 110.51 1hr6 s SER 384 Ca 0.02 1.42 -0.16 0.00 0.70 0.00 0.00 55.95 57.93 1hr6 s SER 384 Cb 0.09 -2.48 0.03 0.00 -1.71 0.00 0.00 66.02 61.95 1hr6 s SER 384 CO 0.63 -0.11 1.82 0.11 1.20 0.00 0.00 173.24 176.88 1hr6 h LYS 385 N 6.39 0.55 -0.78 5.44 1.57 -1.90 -0.20 116.57 127.64 1hr6 h LYS 385 Ca -0.42 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.40 1hr6 h LYS 385 Cb 1.21 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 33.34 1hr6 h LYS 385 CO 0.74 0.36 0.51 -0.07 -0.57 0.00 0.00 179.45 180.42 1hr6 h LEU 386 N 0.57 0.71 -0.14 2.94 4.07 -1.95 0.35 115.31 121.85 1hr6 h LEU 386 Ca 0.16 0.01 -0.19 0.00 0.08 0.00 0.00 57.88 57.94 1hr6 h LEU 386 Cb -0.05 -0.14 0.01 0.00 1.08 0.00 0.00 40.66 41.55 1hr6 h LEU 386 CO -0.04 0.45 -0.65 0.58 -1.08 0.00 0.00 178.44 177.69 1hr6 h VAL 387 N 0.80 1.31 -0.78 1.22 2.07 -1.60 -1.35 116.25 117.92 1hr6 h VAL 387 Ca 0.34 -1.89 0.04 0.00 0.82 0.00 0.00 66.70 66.01 1hr6 h VAL 387 Cb 0.30 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 1hr6 h VAL 387 CO -0.12 0.59 0.49 -0.08 0.02 0.00 0.00 177.57 178.47 1hr6 h GLU 388 N 0.38 0.91 0.56 1.57 4.81 0.04 -1.46 114.58 121.40 1hr6 h GLU 388 Ca -0.04 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 1hr6 h GLU 388 Cb 1.28 -0.21 0.01 0.00 0.63 0.00 0.00 28.75 30.46 1hr6 h GLU 388 CO 0.14 0.60 -0.27 1.25 -0.73 0.00 0.00 179.01 180.00 1hr6 h LEU 389 N 0.94 -0.64 -0.57 1.64 5.85 -0.23 -1.08 115.31 121.21 1hr6 h LEU 389 Ca 0.32 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.07 1hr6 h LEU 389 Cb 0.06 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1hr6 h LEU 389 CO -0.13 -0.42 0.33 -0.08 -0.34 0.00 0.00 178.44 177.81 1hr6 h GLU 390 N -0.82 0.64 -0.86 1.25 4.81 -1.09 0.83 114.58 119.34 1hr6 h GLU 390 Ca -0.08 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1hr6 h GLU 390 Cb 0.61 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1hr6 h GLU 390 CO 0.13 0.42 0.52 0.22 -0.73 0.00 0.00 179.01 179.57 1hr6 h ASP 391 N 0.66 1.02 -0.26 1.04 3.58 -1.21 -0.91 116.42 120.34 1hr6 h ASP 391 Ca 0.23 -0.06 -0.06 0.00 0.42 0.00 0.00 57.03 57.56 1hr6 h ASP 391 Cb 0.05 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 1hr6 h ASP 391 CO -0.11 0.78 -0.07 -0.03 -2.88 0.00 0.00 179.24 176.93 1hr6 h MET 392 N 1.18 0.50 -0.54 0.28 4.05 -0.31 -1.66 114.93 118.43 1hr6 h MET 392 Ca 0.31 -0.20 0.01 0.00 -0.28 0.00 0.00 59.70 59.54 1hr6 h MET 392 Cb -0.06 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.69 1hr6 h MET 392 CO -0.06 0.73 0.35 0.78 0.23 0.00 0.00 176.91 178.94 1hr6 h GLY 393 N 0.25 0.76 1.73 1.39 0.00 -0.54 -1.70 103.07 104.96 1hr6 h GLY 393 Ca 0.06 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 1hr6 h GLY 393 CO 0.03 0.26 -0.53 3.21 0.00 0.00 0.00 176.54 179.51 1hr6 h ARG 394 N 0.71 0.28 -0.44 4.80 3.08 -1.14 0.25 114.38 121.93 1hr6 h ARG 394 Ca 0.20 -0.17 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1hr6 h ARG 394 Cb -0.06 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1hr6 h ARG 394 CO -0.05 0.74 -0.10 1.96 -1.07 0.00 0.00 179.97 181.45 1hr6 h GLN 395 N 0.22 0.85 -0.27 0.04 4.20 -1.06 -0.76 115.11 118.34 1hr6 h GLN 395 Ca 0.01 -0.32 -0.16 0.00 0.06 0.00 0.00 58.65 58.24 1hr6 h GLN 395 Cb 1.00 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.73 1hr6 h GLN 395 CO 0.08 0.96 -0.44 0.28 -0.67 0.00 0.00 178.83 179.04 1hr6 h VAL 396 N 0.68 1.30 -0.98 -0.54 2.07 -1.21 0.40 116.25 117.97 1hr6 h VAL 396 Ca 0.11 -1.63 0.06 0.00 0.82 0.00 0.00 66.70 66.06 1hr6 h VAL 396 Cb 0.64 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 1hr6 h VAL 396 CO 0.04 0.52 0.64 0.25 0.02 0.00 0.00 177.57 179.04 1hr6 h LEU 397 N 0.52 1.01 0.05 2.57 5.85 -0.83 0.24 115.31 124.72 1hr6 h LEU 397 Ca 0.02 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.66 1hr6 h LEU 397 Cb 1.04 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1hr6 h LEU 397 CO 0.10 0.65 -0.41 -0.03 -0.34 0.00 0.00 178.44 178.41 1hr6 h MET 398 N 1.15 0.11 0.00 1.25 4.05 -0.88 -3.41 114.93 117.19 1hr6 h MET 398 Ca 0.42 -0.19 -0.04 0.00 -0.28 0.00 0.00 59.70 59.62 1hr6 h MET 398 Cb 0.17 0.07 -0.08 0.00 -0.80 0.00 0.00 31.60 30.96 1hr6 h MET 398 CO -0.16 1.09 -0.48 -2.39 0.23 0.00 0.00 176.91 175.20 1hr6 n HIS 399 N -4.41 0.00 -3.97 1.39 1.44 0.11 -5.02 115.22 104.76 1hr6 n HIS 399 Ca -0.13 -0.55 -0.28 0.00 -2.01 0.00 0.00 57.72 54.75 1hr6 n HIS 399 Cb 0.62 -0.12 -0.01 0.00 0.12 0.00 0.00 29.99 30.61 1hr6 n HIS 399 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1hr6 n GLY 400 N -0.42 -0.33 3.58 -1.39 0.00 0.84 -4.95 105.19 102.53 1hr6 n GLY 400 Ca 0.08 0.15 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 1hr6 n GLY 400 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1hr6 s ARG 401 N -6.56 0.55 -0.25 1.61 1.70 -1.25 -4.96 118.95 109.78 1hr6 s ARG 401 Ca 0.27 0.13 -0.01 0.00 -0.47 0.00 0.00 55.73 55.65 1hr6 s ARG 401 Cb -0.14 0.26 0.03 0.00 -0.57 0.00 0.00 34.95 34.53 1hr6 s ARG 401 CO 0.88 -0.17 -0.06 0.21 -1.08 0.00 0.00 175.30 175.07 1hr6 s LYS 402 N -1.13 2.74 0.13 3.89 2.20 -1.26 -3.90 119.74 122.41 1hr6 s LYS 402 Ca -0.01 -1.04 -0.31 0.00 -0.36 0.00 0.00 55.97 54.25 1hr6 s LYS 402 Cb -0.00 -2.99 -0.10 0.00 -1.51 0.00 0.00 37.83 33.22 1hr6 s LYS 402 CO 0.01 -0.44 1.68 -1.50 -0.36 0.00 0.00 175.35 174.74 1hr6 s ILE 403 N 1.30 2.67 0.53 5.43 2.07 -1.26 -4.95 121.20 126.98 1hr6 s ILE 403 Ca -0.01 0.31 -0.20 0.00 -1.41 0.00 0.00 60.65 59.34 1hr6 s ILE 403 Cb -0.17 -3.20 -0.06 0.00 0.13 0.00 0.00 42.46 39.16 1hr6 s ILE 403 CO -0.04 0.01 1.12 -2.16 -1.91 0.00 0.00 174.94 171.96 1hr6 s PRO 404 N 2.03 3.42 0.15 3.50 0.04 -1.26 -4.93 135.00 137.96 1hr6 s PRO 404 Ca 0.75 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 63.21 1hr6 s PRO 404 Cb -0.44 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.13 1hr6 s PRO 404 CO 0.33 -0.79 1.70 0.28 0.04 0.00 0.00 177.00 178.55 1hr6 h VAL 405 N 1.27 0.72 -0.75 -0.36 2.07 -2.00 -2.50 116.25 114.69 1hr6 h VAL 405 Ca -0.50 -0.02 0.17 0.00 0.82 0.00 0.00 66.70 67.17 1hr6 h VAL 405 Cb 1.26 0.65 -0.13 0.00 -1.52 0.00 0.00 31.29 31.55 1hr6 h VAL 405 CO 0.57 0.01 0.03 0.78 0.02 0.00 0.00 177.57 178.99 1hr6 h ASN 406 N 0.06 -0.29 -0.49 0.57 -0.26 -1.99 -0.56 115.58 112.62 1hr6 h ASN 406 Ca 0.16 0.19 -0.02 0.00 -0.56 0.00 0.00 56.30 56.07 1hr6 h ASN 406 Cb 0.23 0.32 -0.02 0.00 -1.06 0.00 0.00 38.32 37.80 1hr6 h ASN 406 CO -0.30 -0.16 0.23 -0.08 -1.06 0.00 0.00 177.43 176.06 1hr6 h GLU 407 N 0.12 0.70 -0.06 0.81 4.81 -1.84 -1.02 114.58 118.11 1hr6 h GLU 407 Ca 0.42 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1hr6 h GLU 407 Cb 0.74 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 1hr6 h GLU 407 CO -0.64 0.59 0.04 1.98 -0.73 0.00 0.00 179.01 180.25 1hr6 h MET 408 N 0.64 0.08 0.06 1.92 4.05 -0.93 -1.11 114.93 119.64 1hr6 h MET 408 Ca 0.17 -0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.59 1hr6 h MET 408 Cb 0.12 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 1hr6 h MET 408 CO -0.02 0.07 -0.10 0.82 0.23 0.00 0.00 176.91 177.91 1hr6 h ILE 409 N 0.07 0.76 -0.15 1.77 2.04 -0.99 -2.49 117.51 118.52 1hr6 h ILE 409 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1hr6 h ILE 409 Cb 0.01 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 1hr6 h ILE 409 CO -0.00 0.00 -0.15 0.28 0.00 0.00 0.00 178.15 178.28 1hr6 h SER 410 N -0.20 -0.46 -0.37 1.72 0.02 -1.06 0.99 113.55 114.18 1hr6 h SER 410 Ca 0.02 0.09 0.11 0.00 -0.84 0.00 0.00 61.79 61.17 1hr6 h SER 410 Cb 0.22 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1hr6 h SER 410 CO -0.06 -0.19 0.30 0.11 -1.14 0.00 0.00 176.83 175.85 1hr6 h LYS 411 N -0.17 0.00 0.02 3.45 1.57 -1.05 -1.26 116.57 119.12 1hr6 h LYS 411 Ca 0.10 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1hr6 h LYS 411 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1hr6 h LYS 411 CO -0.25 0.00 -0.33 0.82 -0.57 0.00 0.00 179.45 179.12 1hr6 h ILE 412 N 0.00 1.61 -0.18 1.86 2.04 -0.71 -3.33 117.51 118.79 1hr6 h ILE 412 Ca 0.18 -2.35 0.05 0.00 1.00 0.00 0.00 64.86 63.74 1hr6 h ILE 412 Cb 0.77 3.19 -0.01 0.00 -0.74 0.00 0.00 36.82 40.03 1hr6 h ILE 412 CO -0.00 0.59 0.18 -0.33 0.00 0.00 0.00 178.15 178.58 1hr6 h GLU 413 N -0.90 0.00 -0.00 2.37 5.08 -0.22 -0.26 114.58 120.65 1hr6 h GLU 413 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1hr6 h GLU 413 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1hr6 h GLU 413 CO -0.01 0.00 -0.08 -0.25 -1.00 0.00 0.00 179.01 177.68 1hr6 n ASP 414 N -3.99 0.54 -4.77 1.42 8.00 -0.54 -4.87 116.55 112.35 1hr6 n ASP 414 Ca 0.02 -0.78 -0.40 0.00 0.71 0.00 0.00 54.79 54.34 1hr6 n ASP 414 Cb 0.30 -0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.34 1hr6 n ASP 414 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1hr6 s LEU 415 N -2.33 4.29 0.12 0.64 1.43 -0.11 -5.03 118.68 117.70 1hr6 s LEU 415 Ca 0.33 2.58 0.07 0.00 -1.03 0.00 0.00 54.13 56.08 1hr6 s LEU 415 Cb 0.20 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1hr6 s LEU 415 CO 0.44 -0.68 -0.16 -0.54 0.23 0.00 0.00 176.35 175.64 1hr6 s LYS 416 N -2.07 1.08 0.30 1.70 1.02 -1.26 -5.03 119.74 115.48 1hr6 s LYS 416 Ca 0.54 -1.24 0.00 0.00 0.02 0.00 0.00 55.97 55.29 1hr6 s LYS 416 Cb -0.37 -1.08 0.70 0.00 -0.52 0.00 0.00 37.83 36.56 1hr6 s LYS 416 CO 0.47 0.22 1.52 -2.30 -0.92 0.00 0.00 175.35 174.35 1hr6 n PRO 417 N 0.64 -0.08 0.06 -1.68 -0.02 -1.26 0.42 135.00 133.08 1hr6 n PRO 417 Ca -0.16 1.47 0.04 0.00 -2.02 0.00 0.00 63.50 62.83 1hr6 n PRO 417 Cb 0.56 -2.31 0.46 0.00 -0.02 0.00 0.00 33.50 32.20 1hr6 n PRO 417 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1hr6 h ASP 418 N 0.00 0.35 0.10 2.55 3.32 -1.97 0.11 116.42 120.88 1hr6 h ASP 418 Ca 0.57 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.60 1hr6 h ASP 418 Cb 1.13 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1hr6 h ASP 418 CO -0.93 0.29 -0.05 0.44 -1.72 0.00 0.00 179.24 177.27 1hr6 h ASP 419 N 0.41 -0.11 -0.76 6.45 3.32 -0.44 0.56 116.42 125.84 1hr6 h ASP 419 Ca 0.11 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1hr6 h ASP 419 Cb 0.01 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 1hr6 h ASP 419 CO -0.02 -0.08 0.29 0.40 -1.72 0.00 0.00 179.24 178.11 1hr6 h ILE 420 N -0.13 1.26 -0.46 0.35 1.08 -1.10 -1.81 117.51 116.69 1hr6 h ILE 420 Ca -0.01 -0.83 -0.10 0.00 -0.39 0.00 0.00 64.86 63.52 1hr6 h ILE 420 Cb 0.10 0.36 -0.01 0.00 -3.07 0.00 0.00 36.82 34.20 1hr6 h ILE 420 CO 0.02 0.34 -0.12 0.28 -0.69 0.00 0.00 178.15 177.98 1hr6 h SER 421 N 1.12 0.91 -0.28 1.72 0.02 -0.44 -0.76 113.55 115.84 1hr6 h SER 421 Ca 0.25 -0.36 0.02 0.00 -0.84 0.00 0.00 61.79 60.86 1hr6 h SER 421 Cb 0.24 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1hr6 h SER 421 CO -0.02 1.06 0.12 -0.09 -1.14 0.00 0.00 176.83 176.77 1hr6 h ARG 422 N 0.74 0.26 -0.61 3.45 2.43 0.44 -1.68 114.38 119.41 1hr6 h ARG 422 Ca 0.12 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1hr6 h ARG 422 Cb 0.67 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 1hr6 h ARG 422 CO 0.05 0.17 0.07 0.28 -1.51 0.00 0.00 179.97 179.03 1hr6 h VAL 423 N 0.27 1.26 -0.28 0.20 2.07 -1.21 -1.08 116.25 117.47 1hr6 h VAL 423 Ca 0.12 -1.04 0.02 0.00 0.82 0.00 0.00 66.70 66.62 1hr6 h VAL 423 Cb 0.05 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1hr6 h VAL 423 CO -0.09 0.38 0.14 0.00 0.02 0.00 0.00 177.57 178.02 1hr6 h ALA 424 N 1.12 0.34 0.00 1.67 0.00 -0.77 -1.13 119.26 120.50 1hr6 h ALA 424 Ca 0.18 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1hr6 h ALA 424 Cb 0.45 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1hr6 h ALA 424 CO 0.02 -0.25 -0.03 1.49 0.00 0.00 0.00 179.25 180.48 1hr6 h GLU 425 N 0.29 -0.05 -0.42 0.00 4.81 -1.05 -0.28 114.58 117.89 1hr6 h GLU 425 Ca 0.12 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.44 1hr6 h GLU 425 Cb 0.04 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.34 1hr6 h GLU 425 CO -0.08 -0.03 -0.13 1.98 -0.73 0.00 0.00 179.01 180.02 1hr6 h MET 426 N -0.05 -0.03 0.70 1.92 4.05 -0.78 0.73 114.93 121.47 1hr6 h MET 426 Ca 0.01 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.40 1hr6 h MET 426 Cb 0.06 0.01 0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1hr6 h MET 426 CO -0.03 -0.02 -0.33 0.82 0.23 0.00 0.00 176.91 177.58 1hr6 h ILE 427 N -0.03 0.07 0.00 1.77 1.08 -1.00 0.14 117.51 119.54 1hr6 h ILE 427 Ca 0.20 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1hr6 h ILE 427 Cb 0.34 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 34.19 1hr6 h ILE 427 CO -0.45 0.01 0.00 0.49 -0.69 0.00 0.00 178.15 177.51 1hr6 n PHE 428 N -5.41 0.64 0.88 1.37 3.72 -0.14 -1.59 117.46 116.93 1hr6 n PHE 428 Ca -0.12 0.28 0.12 0.00 -0.05 0.00 0.00 57.45 57.68 1hr6 n PHE 428 Cb 0.38 -0.95 0.22 0.00 -0.94 0.00 0.00 39.48 38.19 1hr6 n PHE 428 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1hr6 n THR 429 N -2.11 0.09 -2.35 4.37 -1.04 0.24 0.45 114.28 113.94 1hr6 n THR 429 Ca 0.01 -0.08 -0.04 0.00 -2.04 0.00 0.00 64.05 61.91 1hr6 n THR 429 Cb 0.15 0.16 0.01 0.00 -1.82 0.00 0.00 70.33 68.82 1hr6 n THR 429 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1hr6 n GLY 430 N 1.46 0.42 1.82 3.41 0.00 -0.62 -3.59 105.19 108.08 1hr6 n GLY 430 Ca 0.05 -0.63 -0.20 0.00 0.00 0.00 0.00 46.02 45.24 1hr6 n GLY 430 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hr6 n ASN 431 N 1.01 4.59 -4.83 1.61 3.02 0.47 -4.44 115.26 116.70 1hr6 n ASN 431 Ca -0.02 -3.76 -0.38 0.00 -0.03 0.00 0.00 54.58 50.38 1hr6 n ASN 431 Cb 0.52 -0.68 -0.06 0.00 -0.61 0.00 0.00 39.78 38.95 1hr6 n ASN 431 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1hr6 s VAL 432 N -4.00 5.03 -0.60 2.41 1.01 -1.25 -4.88 120.40 118.11 1hr6 s VAL 432 Ca 0.53 0.85 0.04 0.00 0.00 0.00 0.00 61.98 63.41 1hr6 s VAL 432 Cb 0.44 -3.72 0.16 0.00 0.00 0.00 0.00 36.38 33.26 1hr6 s VAL 432 CO 0.02 0.56 0.39 0.20 0.00 0.00 0.00 175.10 176.27 1hr6 s ASN 433 N -0.94 4.26 0.52 3.32 0.01 -1.26 -4.72 114.94 116.12 1hr6 s ASN 433 Ca 0.24 -3.43 -0.02 0.00 -0.71 0.00 0.00 52.86 48.94 1hr6 s ASN 433 Cb -0.17 -1.46 0.01 0.00 0.41 0.00 0.00 41.25 40.04 1hr6 s ASN 433 CO 0.13 -0.15 0.77 0.20 -1.51 0.00 0.00 177.10 176.54 1hr6 s ASN 434 N -0.81 5.64 0.32 -1.22 0.01 -1.26 -4.93 114.94 112.69 1hr6 s ASN 434 Ca 0.23 0.37 0.10 0.00 -0.71 0.00 0.00 52.86 52.85 1hr6 s ASN 434 Cb -0.12 -1.47 0.94 0.00 0.41 0.00 0.00 41.25 41.01 1hr6 s ASN 434 CO -0.11 -0.91 1.66 0.00 -1.51 0.00 0.00 177.10 176.24 1hr6 h ALA 435 N 0.14 1.70 0.00 0.60 0.00 -1.90 0.58 119.26 120.37 1hr6 h ALA 435 Ca -0.45 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1hr6 h ALA 435 Cb 1.26 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1hr6 h ALA 435 CO 0.58 -0.51 0.00 0.41 0.00 0.00 0.00 179.25 179.72 1hr6 n GLY 436 N -1.32 -0.77 3.47 0.00 0.00 -1.23 -4.91 105.19 100.43 1hr6 n GLY 436 Ca 0.28 -0.07 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 1hr6 n GLY 436 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hr6 n ASN 437 N -1.27 -6.17 -4.83 1.61 5.15 0.20 -4.59 115.26 105.37 1hr6 n ASN 437 Ca 0.07 -0.62 -0.31 0.00 -0.60 0.00 0.00 54.58 53.12 1hr6 n ASN 437 Cb 0.12 -3.55 0.03 0.00 -0.53 0.00 0.00 39.78 35.84 1hr6 n ASN 437 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1hr6 s GLY 438 N -3.10 1.77 0.89 8.20 0.00 -1.26 -4.82 107.32 109.00 1hr6 s GLY 438 Ca 0.11 0.10 -0.12 0.00 0.00 0.00 0.00 44.72 44.81 1hr6 s GLY 438 CO 0.83 0.40 1.10 0.54 0.00 0.00 0.00 173.10 175.97 1hr6 s LYS 439 N -4.83 1.32 -0.19 2.90 -0.14 -0.60 -4.95 119.74 113.25 1hr6 s LYS 439 Ca 0.58 0.62 0.15 0.00 -1.36 0.00 0.00 55.97 55.96 1hr6 s LYS 439 Cb -0.13 -1.83 0.78 0.00 -1.68 0.00 0.00 37.83 34.96 1hr6 s LYS 439 CO 0.50 -2.15 1.69 0.41 -0.76 0.00 0.00 175.35 175.04 1hr6 n GLY 440 N -1.59 2.85 3.75 -3.33 0.00 -1.26 -4.83 105.19 100.78 1hr6 n GLY 440 Ca 0.07 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 1hr6 n GLY 440 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hr6 s ARG 441 N -2.40 4.72 0.80 1.61 3.52 -1.26 -1.86 118.95 124.08 1hr6 s ARG 441 Ca 0.53 1.67 -0.11 0.00 -0.13 0.00 0.00 55.73 57.69 1hr6 s ARG 441 Cb 0.38 -3.24 0.07 0.00 -1.56 0.00 0.00 34.95 30.60 1hr6 s ARG 441 CO 0.19 0.32 1.09 0.00 -0.81 0.00 0.00 175.30 176.09 1hr6 s ALA 442 N -1.06 2.12 -0.16 6.12 0.00 -1.26 -4.18 121.76 123.33 1hr6 s ALA 442 Ca 0.44 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.58 1hr6 s ALA 442 Cb -0.29 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1hr6 s ALA 442 CO 0.37 -1.87 -0.16 0.99 0.00 0.00 0.00 175.76 175.08 1hr6 s THR 443 N -2.92 2.55 -0.14 0.00 2.01 0.19 -0.82 115.64 116.50 1hr6 s THR 443 Ca 0.61 -0.80 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 1hr6 s THR 443 Cb -0.17 -2.08 0.04 0.00 0.01 0.00 0.00 72.50 70.30 1hr6 s THR 443 CO 0.56 0.52 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.29 1hr6 s VAL 444 N 0.92 0.86 -0.02 3.82 1.01 -0.04 0.42 120.40 127.37 1hr6 s VAL 444 Ca -0.03 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.57 1hr6 s VAL 444 Cb -0.15 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 1hr6 s VAL 444 CO -0.02 0.13 -0.17 0.54 0.00 0.00 0.00 175.10 175.58 1hr6 s VAL 445 N 1.75 1.38 0.09 2.92 0.11 0.33 -1.88 120.40 125.10 1hr6 s VAL 445 Ca 0.02 -0.73 -0.16 0.00 -2.93 0.00 0.00 61.98 58.19 1hr6 s VAL 445 Cb -0.15 -1.16 0.03 0.00 -1.53 0.00 0.00 36.38 33.57 1hr6 s VAL 445 CO -0.07 0.39 0.37 0.00 -3.33 0.00 0.00 175.10 172.46 1hr6 s MET 446 N -0.26 0.98 -0.12 1.54 0.23 -0.55 0.76 119.30 121.89 1hr6 s MET 446 Ca 0.03 -0.62 0.02 0.00 -1.03 0.00 0.00 55.69 54.09 1hr6 s MET 446 Cb -0.08 0.43 0.01 0.00 -1.53 0.00 0.00 34.83 33.66 1hr6 s MET 446 CO 0.00 -0.36 -0.16 -1.14 -2.03 0.00 0.00 175.02 171.33 1hr6 s GLN 447 N -3.33 2.33 0.00 3.16 0.74 0.62 -1.26 119.66 121.93 1hr6 s GLN 447 Ca 0.00 -0.60 0.00 0.00 0.05 0.00 0.00 55.36 54.81 1hr6 s GLN 447 Cb 0.01 -1.97 0.00 0.00 1.10 0.00 0.00 33.01 32.15 1hr6 s GLN 447 CO -0.08 -0.07 0.00 0.41 -0.55 0.00 0.00 175.29 175.00 1hr6 n GLY 448 N 4.22 0.46 3.69 2.59 0.00 -0.42 -1.74 105.19 113.99 1hr6 n GLY 448 Ca -0.19 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 1hr6 n GLY 448 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hr6 s ASP 449 N -4.00 7.24 0.18 1.61 2.15 -1.26 -4.13 116.67 118.46 1hr6 s ASP 449 Ca 0.00 1.53 -0.15 0.00 0.43 0.00 0.00 52.55 54.36 1hr6 s ASP 449 Cb 0.00 -2.56 0.16 0.00 -0.30 0.00 0.00 42.92 40.23 1hr6 s ASP 449 CO 0.00 -0.45 1.68 -0.09 -0.17 0.00 0.00 175.17 176.14 1hr6 h ARG 450 N 7.10 0.09 -0.70 4.34 9.65 -1.95 -1.80 114.38 131.11 1hr6 h ARG 450 Ca -0.31 -0.01 0.15 0.00 -1.10 0.00 0.00 59.98 58.72 1hr6 h ARG 450 Cb 1.15 -0.02 -0.12 0.00 -1.39 0.00 0.00 29.97 29.59 1hr6 h ARG 450 CO 0.86 0.06 -0.01 0.78 2.80 0.00 0.00 179.97 184.45 1hr6 h GLY 451 N 0.09 0.75 0.78 2.80 0.00 -1.94 -1.12 103.07 104.44 1hr6 h GLY 451 Ca 0.23 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1hr6 h GLY 451 CO -0.41 -0.25 0.48 1.76 0.00 0.00 0.00 176.54 178.12 1hr6 h SER 452 N 0.10 0.00 0.27 0.19 0.02 -1.72 -0.37 113.55 112.04 1hr6 h SER 452 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1hr6 h SER 452 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 1hr6 h SER 452 CO -0.62 0.00 -1.16 0.49 -1.14 0.00 0.00 176.83 174.40 1hr6 n PHE 453 N -2.10 0.16 -4.17 3.45 3.72 -0.42 -0.79 117.46 117.32 1hr6 n PHE 453 Ca -0.01 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 1hr6 n PHE 453 Cb 0.50 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 1hr6 n PHE 453 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hr6 n GLY 454 N 1.38 -1.31 3.56 1.37 0.00 -0.15 -4.49 105.19 105.55 1hr6 n GLY 454 Ca 0.02 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1hr6 n GLY 454 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hr6 s ASP 455 N -4.00 6.41 0.05 1.61 -1.08 -1.26 -4.83 116.67 113.56 1hr6 s ASP 455 Ca 0.00 -1.24 -0.26 0.00 -0.52 0.00 0.00 52.55 50.54 1hr6 s ASP 455 Cb 0.00 -2.57 -0.17 0.00 -1.46 0.00 0.00 42.92 38.72 1hr6 s ASP 455 CO 0.00 -1.59 1.52 0.58 0.52 0.00 0.00 175.17 176.19 1hr6 h VAL 456 N 6.65 0.88 -0.39 1.11 2.07 -1.99 -2.56 116.25 122.03 1hr6 h VAL 456 Ca 0.10 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1hr6 h VAL 456 Cb 1.02 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1hr6 h VAL 456 CO 1.40 0.08 0.12 -0.08 0.02 0.00 0.00 177.57 179.11 1hr6 h GLU 457 N -0.42 0.56 -0.50 1.57 4.81 -1.98 -2.19 114.58 116.43 1hr6 h GLU 457 Ca -0.03 -0.08 -0.10 0.00 -0.13 0.00 0.00 59.36 59.02 1hr6 h GLU 457 Cb 0.32 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1hr6 h GLU 457 CO 0.04 0.49 -0.09 -0.97 -0.73 0.00 0.00 179.01 177.76 1hr6 h ASN 458 N 0.55 0.89 -0.39 1.04 -1.24 -1.94 -1.04 115.58 113.45 1hr6 h ASN 458 Ca 0.13 -0.27 -0.11 0.00 0.71 0.00 0.00 56.30 56.76 1hr6 h ASN 458 Cb 0.16 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.96 1hr6 h ASN 458 CO -0.01 1.00 -0.18 0.58 -1.29 0.00 0.00 177.43 177.54 1hr6 h VAL 459 N 0.81 1.28 -0.72 2.57 2.07 -1.02 0.12 116.25 121.36 1hr6 h VAL 459 Ca 0.14 -1.30 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 1hr6 h VAL 459 Cb 0.61 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1hr6 h VAL 459 CO 0.04 0.43 0.23 -0.07 0.02 0.00 0.00 177.57 178.23 1hr6 h LEU 460 N 0.61 1.03 -0.33 2.57 3.38 -1.26 -2.19 115.31 119.12 1hr6 h LEU 460 Ca 0.09 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1hr6 h LEU 460 Cb 0.73 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1hr6 h LEU 460 CO 0.05 0.95 -0.17 0.11 0.09 0.00 0.00 178.44 179.48 1hr6 h LYS 461 N 1.06 0.69 -0.31 1.13 1.57 -1.05 -1.60 116.57 118.06 1hr6 h LYS 461 Ca 0.23 -0.31 0.09 0.00 -1.87 0.00 0.00 60.65 58.80 1hr6 h LYS 461 Cb 0.29 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1hr6 h LYS 461 CO -0.01 0.91 0.39 0.00 -0.57 0.00 0.00 179.45 180.17 1hr6 h ALA 462 N 0.77 1.95 -0.59 3.86 0.00 -0.21 0.88 119.26 125.91 1hr6 h ALA 462 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1hr6 h ALA 462 Cb 0.70 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1hr6 h ALA 462 CO 0.05 -0.55 0.00 0.66 0.00 0.00 0.00 179.25 179.41 1hr6 n TYR 463 N -3.59 0.78 -1.07 0.00 4.02 -0.88 -4.94 117.16 111.48 1hr6 n TYR 463 Ca 0.05 -0.43 -0.02 0.00 -0.01 0.00 0.00 57.90 57.48 1hr6 n TYR 463 Cb 0.54 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.85 1hr6 n TYR 463 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1hr6 n GLY 464 N 1.44 0.51 3.84 2.72 0.00 0.30 -4.90 105.19 109.10 1hr6 n GLY 464 Ca 0.21 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1hr6 n GLY 464 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hr6 s LEU 465 N -0.52 3.95 0.00 0.99 1.43 -0.66 -4.78 118.68 119.09 1hr6 s LEU 465 Ca 0.00 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.59 1hr6 s LEU 465 Cb 0.00 -4.33 0.00 0.00 0.03 0.00 0.00 46.19 41.89 1hr6 s LEU 465 CO 0.00 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1hr6 n GLY 466 N -0.67 -1.86 3.52 -3.19 0.00 0.17 -4.44 105.19 98.73 1hr6 n GLY 466 Ca 0.05 -1.37 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 1hr6 n GLY 466 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1hr6 s ASN 467 N -4.00 -0.50 0.00 1.61 2.47 -0.78 -4.27 114.94 109.47 1hr6 s ASN 467 Ca 0.00 -0.14 0.00 0.00 0.42 0.00 0.00 52.86 53.14 1hr6 s ASN 467 Cb 0.00 0.63 0.00 0.00 -1.45 0.00 0.00 41.25 40.43 1hr6 s ASN 467 CO 0.00 -1.06 0.00 -0.24 -3.72 0.00 0.00 177.10 172.08