#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hr7 s ILE 23 N 0.00 4.30 0.22 5.09 -4.36 -1.26 -4.98 121.20 120.21 1hr7 s ILE 23 Ca 0.00 1.96 -0.32 0.00 -0.26 0.00 0.00 60.65 62.03 1hr7 s ILE 23 Cb 0.00 -4.25 -0.12 0.00 1.25 0.00 0.00 42.46 39.34 1hr7 s ILE 23 CO 0.00 0.32 1.70 -2.84 0.24 0.00 0.00 174.94 174.36 1hr7 s PRO 24 N -0.20 4.13 0.49 0.37 0.02 -1.26 -5.06 135.00 133.49 1hr7 s PRO 24 Ca 0.47 2.59 0.08 0.00 0.02 0.00 0.00 61.00 64.16 1hr7 s PRO 24 Cb -0.25 -3.07 0.08 0.00 0.02 0.00 0.00 34.50 31.27 1hr7 s PRO 24 CO 0.31 -0.73 0.65 0.41 -0.33 0.00 0.00 177.00 177.31 1hr7 n GLY 25 N 3.76 2.04 3.53 0.52 0.00 -1.26 -4.97 105.19 108.81 1hr7 n GLY 25 Ca 0.15 -2.22 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 1hr7 n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hr7 s THR 26 N -2.09 5.25 0.21 2.61 2.01 -1.26 -4.53 115.64 117.84 1hr7 s THR 26 Ca 0.49 -0.14 -0.24 0.00 0.31 0.00 0.00 61.69 62.12 1hr7 s THR 26 Cb -0.04 -3.74 -0.08 0.00 0.01 0.00 0.00 72.50 68.65 1hr7 s THR 26 CO 0.31 -0.03 0.79 -0.13 -0.69 0.00 0.00 174.62 174.88 1hr7 s ARG 27 N 1.80 4.50 0.10 4.92 1.81 -0.35 -4.86 118.95 126.88 1hr7 s ARG 27 Ca 0.08 1.12 0.06 0.00 -1.72 0.00 0.00 55.73 55.27 1hr7 s ARG 27 Cb -0.17 -3.10 -0.03 0.00 -0.45 0.00 0.00 34.95 31.19 1hr7 s ARG 27 CO 0.11 0.48 -0.16 0.99 -0.68 0.00 0.00 175.30 176.04 1hr7 s THR 28 N -1.31 1.36 -0.20 0.02 2.01 -1.26 -1.46 115.64 114.80 1hr7 s THR 28 Ca 0.40 -1.54 -0.23 0.00 0.31 0.00 0.00 61.69 60.63 1hr7 s THR 28 Cb -0.21 -1.39 0.06 0.00 0.01 0.00 0.00 72.50 70.97 1hr7 s THR 28 CO 0.25 -0.26 0.63 -0.44 -0.69 0.00 0.00 174.62 174.10 1hr7 s SER 29 N -2.09 -0.64 -0.13 3.53 0.01 -0.71 -5.00 113.70 108.67 1hr7 s SER 29 Ca 0.05 1.15 -0.01 0.00 1.31 0.00 0.00 55.95 58.45 1hr7 s SER 29 Cb -0.08 1.15 -0.02 0.00 0.21 0.00 0.00 66.02 67.28 1hr7 s SER 29 CO 0.03 -0.28 -0.11 -0.75 0.41 0.00 0.00 173.24 172.54 1hr7 s LYS 30 N 0.06 3.37 0.63 12.44 2.20 -1.26 0.41 119.74 137.58 1hr7 s LYS 30 Ca -0.02 -0.64 -0.10 0.00 -0.36 0.00 0.00 55.97 54.84 1hr7 s LYS 30 Cb -0.04 -2.68 -0.02 0.00 -1.51 0.00 0.00 37.83 33.58 1hr7 s LYS 30 CO 0.02 0.27 1.02 -1.17 -0.36 0.00 0.00 175.35 175.12 1hr7 s LEU 31 N 0.23 3.19 0.42 5.43 2.96 0.67 -4.96 118.68 126.62 1hr7 s LEU 31 Ca -0.07 1.26 0.11 0.00 -0.22 0.00 0.00 54.13 55.21 1hr7 s LEU 31 Cb -0.15 -4.23 0.96 0.00 0.50 0.00 0.00 46.19 43.27 1hr7 s LEU 31 CO 0.05 -0.97 2.01 1.55 -1.32 0.00 0.00 176.35 177.67 1hr7 h PRO 32 N -0.34 0.45 -0.03 0.98 0.13 -1.98 -1.22 132.00 129.99 1hr7 h PRO 32 Ca -0.45 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1hr7 h PRO 32 Cb 1.21 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1hr7 h PRO 32 CO 0.62 0.30 0.00 0.27 -0.23 0.00 0.00 178.00 178.96 1hr7 n ASN 33 N -4.47 0.19 0.00 1.44 0.23 -1.26 -4.89 115.26 106.50 1hr7 n ASN 33 Ca 0.07 -1.83 0.00 0.00 -0.53 0.00 0.00 54.58 52.29 1hr7 n ASN 33 Cb 0.25 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 1hr7 n ASN 33 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hr7 n GLY 34 N 0.64 3.03 3.64 4.83 0.00 -0.46 -3.06 105.19 113.81 1hr7 n GLY 34 Ca 0.05 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.58 1hr7 n GLY 34 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1hr7 n LEU 35 N 0.00 2.45 -4.83 0.99 7.94 -0.28 -4.22 117.00 119.05 1hr7 n LEU 35 Ca 0.00 1.09 -0.37 0.00 -1.11 0.00 0.00 56.01 55.62 1hr7 n LEU 35 Cb 0.00 -1.31 -0.06 0.00 0.53 0.00 0.00 43.42 42.58 1hr7 n LEU 35 CO 0.00 -0.61 -0.06 -0.89 -1.11 0.00 0.00 177.39 174.72 1hr7 s THR 36 N 1.00 5.33 -0.30 1.96 2.01 -1.02 -0.24 115.64 124.38 1hr7 s THR 36 Ca 0.83 0.45 -0.01 0.00 0.31 0.00 0.00 61.69 63.27 1hr7 s THR 36 Cb -0.82 -3.54 0.06 0.00 0.01 0.00 0.00 72.50 68.21 1hr7 s THR 36 CO 0.44 0.55 0.00 -0.63 -0.69 0.00 0.00 174.62 174.29 1hr7 s ILE 37 N -0.64 2.91 -0.12 1.82 -1.09 0.16 -0.29 121.20 123.96 1hr7 s ILE 37 Ca 0.17 -1.48 0.00 0.00 -2.23 0.00 0.00 60.65 57.12 1hr7 s ILE 37 Cb -0.13 -2.71 -0.02 0.00 -1.58 0.00 0.00 42.46 38.02 1hr7 s ILE 37 CO 0.06 -0.15 -0.13 0.00 -1.23 0.00 0.00 174.94 173.49 1hr7 s ALA 38 N 1.22 2.62 0.04 9.38 0.00 -0.56 -1.75 121.76 132.71 1hr7 s ALA 38 Ca -0.04 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1hr7 s ALA 38 Cb -0.20 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 1hr7 s ALA 38 CO -0.02 0.29 -0.04 -0.08 0.00 0.00 0.00 175.76 175.91 1hr7 s THR 39 N 0.21 0.25 -0.14 0.00 -1.32 -0.53 -1.23 115.64 112.86 1hr7 s THR 39 Ca -0.08 -1.20 -0.04 0.00 -1.21 0.00 0.00 61.69 59.15 1hr7 s THR 39 Cb -0.15 -0.69 0.06 0.00 -1.51 0.00 0.00 72.50 70.21 1hr7 s THR 39 CO 0.05 -0.61 0.10 -0.70 -2.21 0.00 0.00 174.62 171.25 1hr7 s GLU 40 N -2.17 0.05 0.20 7.08 2.12 -0.70 -1.21 118.70 124.07 1hr7 s GLU 40 Ca -0.08 0.08 -0.30 0.00 0.36 0.00 0.00 54.97 55.03 1hr7 s GLU 40 Cb -0.05 -1.42 -0.08 0.00 0.26 0.00 0.00 34.13 32.84 1hr7 s GLU 40 CO -0.03 -0.58 1.15 -0.47 -0.54 0.00 0.00 175.26 174.79 1hr7 s TYR 41 N 2.18 3.50 -0.28 5.30 5.04 -1.26 -2.15 117.35 129.67 1hr7 s TYR 41 Ca 0.03 1.53 -0.01 0.00 -2.44 0.00 0.00 57.07 56.18 1hr7 s TYR 41 Cb -0.15 -3.36 0.05 0.00 0.35 0.00 0.00 41.96 38.85 1hr7 s TYR 41 CO -0.08 -0.91 -0.04 0.42 -1.34 0.00 0.00 175.55 173.60 1hr7 s ILE 42 N -0.30 2.80 0.63 3.14 -1.09 -0.67 -4.78 121.20 120.93 1hr7 s ILE 42 Ca 0.50 -1.34 -0.18 0.00 -2.23 0.00 0.00 60.65 57.40 1hr7 s ILE 42 Cb -0.31 -2.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.98 1hr7 s ILE 42 CO 0.37 -0.01 1.16 -2.65 -1.23 0.00 0.00 174.94 172.58 1hr7 n PRO 43 N 4.60 1.03 -3.48 2.79 -0.02 -1.26 -3.69 135.00 134.97 1hr7 n PRO 43 Ca -0.14 0.40 -0.18 0.00 -2.02 0.00 0.00 63.50 61.56 1hr7 n PRO 43 Cb 0.44 -2.39 0.08 0.00 -0.02 0.00 0.00 33.50 31.62 1hr7 n PRO 43 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1hr7 n ASN 44 N -1.43 -2.36 -4.07 2.55 5.03 -1.26 -5.02 115.26 108.69 1hr7 n ASN 44 Ca 0.15 -0.63 -0.07 0.00 0.87 0.00 0.00 54.58 54.89 1hr7 n ASN 44 Cb 0.48 -5.00 -0.10 0.00 -1.02 0.00 0.00 39.78 34.14 1hr7 n ASN 44 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1hr7 s THR 45 N -3.39 0.21 -0.02 3.41 -4.23 -1.24 -5.04 115.64 105.34 1hr7 s THR 45 Ca 0.06 -1.70 0.02 0.00 -1.18 0.00 0.00 61.69 58.89 1hr7 s THR 45 Cb -0.03 -1.39 0.03 0.00 1.34 0.00 0.00 72.50 72.46 1hr7 s THR 45 CO 0.74 -0.94 0.80 -1.20 -0.54 0.00 0.00 174.62 173.48 1hr7 n SER 46 N 0.25 0.77 -4.19 3.99 7.64 -1.26 -4.55 113.62 116.26 1hr7 n SER 46 Ca -0.15 -1.69 -0.11 0.00 1.01 0.00 0.00 58.87 57.92 1hr7 n SER 46 Cb 0.60 -0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 63.61 1hr7 n SER 46 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1hr7 s SER 47 N -0.78 0.81 0.34 6.43 1.04 -1.26 -0.20 113.70 120.08 1hr7 s SER 47 Ca 0.04 -1.17 -0.11 0.00 0.48 0.00 0.00 55.95 55.19 1hr7 s SER 47 Cb 0.03 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.37 1hr7 s SER 47 CO 0.00 -0.63 0.63 0.00 0.98 0.00 0.00 173.24 174.22 1hr7 s ALA 48 N -3.83 -0.18 -0.05 5.32 0.00 -0.29 -1.72 121.76 121.02 1hr7 s ALA 48 Ca 0.22 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.20 1hr7 s ALA 48 Cb 0.07 0.92 0.01 0.00 0.00 0.00 0.00 23.12 24.12 1hr7 s ALA 48 CO 0.02 -0.90 -0.09 0.99 0.00 0.00 0.00 175.76 175.77 1hr7 s THR 49 N -2.96 0.86 -0.03 0.00 2.01 -0.68 -1.98 115.64 112.86 1hr7 s THR 49 Ca 0.21 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 61.92 1hr7 s THR 49 Cb -0.03 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 1hr7 s THR 49 CO 0.14 0.29 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.50 1hr7 s VAL 50 N 0.61 1.37 -0.05 3.82 1.01 -0.48 -2.11 120.40 124.57 1hr7 s VAL 50 Ca -0.11 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.07 1hr7 s VAL 50 Cb -0.14 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.10 1hr7 s VAL 50 CO 0.02 0.39 0.23 -0.83 0.00 0.00 0.00 175.10 174.91 1hr7 s GLY 51 N -0.18 -0.11 -0.23 4.51 0.00 -0.02 0.03 107.32 111.33 1hr7 s GLY 51 Ca 0.01 0.37 -0.05 0.00 0.00 0.00 0.00 44.72 45.05 1hr7 s GLY 51 CO 0.01 0.24 0.00 -1.50 0.00 0.00 0.00 173.10 171.84 1hr7 s ILE 52 N -0.63 3.77 -0.15 0.90 1.10 0.49 -0.33 121.20 126.35 1hr7 s ILE 52 Ca -0.07 -0.36 -0.02 0.00 -0.51 0.00 0.00 60.65 59.68 1hr7 s ILE 52 Cb -0.04 -2.73 -0.02 0.00 0.15 0.00 0.00 42.46 39.81 1hr7 s ILE 52 CO 0.02 0.40 -0.07 -0.36 -2.11 0.00 0.00 174.94 172.81 1hr7 s PHE 53 N 1.45 2.94 -0.10 3.50 0.40 0.47 -1.70 117.98 124.95 1hr7 s PHE 53 Ca 0.05 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 1hr7 s PHE 53 Cb -0.15 -1.92 0.01 0.00 0.51 0.00 0.00 43.02 41.47 1hr7 s PHE 53 CO -0.00 -0.12 -0.21 0.08 0.70 0.00 0.00 175.22 175.67 1hr7 s VAL 54 N 0.41 1.83 -1.00 -0.44 1.01 0.32 -0.61 120.40 121.92 1hr7 s VAL 54 Ca -0.06 -0.87 -0.23 0.00 0.00 0.00 0.00 61.98 60.81 1hr7 s VAL 54 Cb -0.15 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1hr7 s VAL 54 CO 0.04 0.51 1.74 -0.62 0.00 0.00 0.00 175.10 176.77 1hr7 s ASP 55 N 0.54 5.77 0.00 3.32 2.15 0.13 -1.56 116.67 127.02 1hr7 s ASP 55 Ca -0.15 -1.18 0.00 0.00 0.43 0.00 0.00 52.55 51.65 1hr7 s ASP 55 Cb -0.17 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 1hr7 s ASP 55 CO 0.05 -2.20 0.00 0.00 -0.17 0.00 0.00 175.17 172.86 1hr7 n ALA 56 N 11.69 0.28 -0.88 3.66 0.00 -0.66 -4.99 120.51 129.61 1hr7 n ALA 56 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1hr7 n ALA 56 Cb 0.48 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.93 1hr7 n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hr7 n GLY 57 N 0.00 -1.08 0.17 0.00 0.00 -1.24 -3.82 105.19 99.22 1hr7 n GLY 57 Ca 0.00 -1.05 0.13 0.00 0.00 0.00 0.00 46.02 45.11 1hr7 n GLY 57 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1hr7 h SER 58 N -0.02 0.00 0.35 1.61 4.64 -1.52 -2.99 113.55 115.63 1hr7 h SER 58 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hr7 h SER 58 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1hr7 h SER 58 CO 0.00 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 173.85 1hr7 n ARG 59 N -2.49 0.23 -0.42 4.77 1.85 -0.38 -1.88 116.66 118.35 1hr7 n ARG 59 Ca 0.02 0.13 0.12 0.00 -1.00 0.00 0.00 57.85 57.11 1hr7 n ARG 59 Cb 0.28 -1.50 0.33 0.00 -1.05 0.00 0.00 32.46 30.53 1hr7 n ARG 59 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1hr7 n ALA 60 N -1.30 2.50 -2.21 2.89 0.00 -1.13 -4.78 120.51 116.48 1hr7 n ALA 60 Ca 0.08 -1.35 -0.21 0.00 0.00 0.00 0.00 53.44 51.97 1hr7 n ALA 60 Cb 0.14 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 1hr7 n ALA 60 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1hr7 s GLU 61 N -1.14 2.51 0.37 0.00 2.02 -0.79 -5.08 118.70 116.59 1hr7 s GLU 61 Ca 0.50 -1.57 0.00 0.00 0.02 0.00 0.00 54.97 53.93 1hr7 s GLU 61 Cb 0.27 -2.39 -0.00 0.00 0.10 0.00 0.00 34.13 32.11 1hr7 s GLU 61 CO 0.32 -0.27 0.02 0.27 0.02 0.00 0.00 175.26 175.62 1hr7 n ASN 62 N -1.62 2.77 -0.33 -0.19 0.23 -1.26 -4.86 115.26 110.01 1hr7 n ASN 62 Ca 0.04 -2.64 0.04 0.00 -0.53 0.00 0.00 54.58 51.49 1hr7 n ASN 62 Cb 0.62 0.33 0.18 0.00 -2.08 0.00 0.00 39.78 38.83 1hr7 n ASN 62 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1hr7 h VAL 63 N 1.24 0.96 0.00 3.53 2.07 -1.99 0.31 116.25 122.37 1hr7 h VAL 63 Ca -0.30 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1hr7 h VAL 63 Cb 0.94 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1hr7 h VAL 63 CO 0.50 0.17 -0.78 0.11 0.02 0.00 0.00 177.57 177.59 1hr7 h LYS 64 N 0.94 0.00 0.06 1.57 1.79 -2.04 -3.33 116.57 115.56 1hr7 h LYS 64 Ca 0.42 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.64 1hr7 h LYS 64 Cb 0.33 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 1hr7 h LYS 64 CO -0.23 0.00 -1.26 -0.97 -1.08 0.00 0.00 179.45 175.91 1hr7 h ASN 65 N 0.00 0.18 -0.61 0.86 -1.24 -1.81 -3.48 115.58 109.49 1hr7 h ASN 65 Ca 0.00 -0.22 -0.69 0.00 0.71 0.00 0.00 56.30 56.09 1hr7 h ASN 65 Cb 0.99 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 39.98 1hr7 h ASN 65 CO 0.00 1.18 0.69 -3.20 -1.29 0.00 0.00 177.43 174.81 1hr7 n ASN 66 N -3.38 0.89 0.00 1.15 4.05 0.10 -2.18 115.26 115.90 1hr7 n ASN 66 Ca -0.08 0.86 0.00 0.00 0.45 0.00 0.00 54.58 55.82 1hr7 n ASN 66 Cb 1.00 -0.72 0.00 0.00 1.23 0.00 0.00 39.78 41.29 1hr7 n ASN 66 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1hr7 n GLY 67 N 3.97 0.77 0.12 8.20 0.00 -1.26 -4.48 105.19 112.52 1hr7 n GLY 67 Ca 0.30 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.21 1hr7 n GLY 67 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hr7 h THR 68 N 0.00 1.18 -0.22 2.61 2.02 -1.74 -2.30 112.91 114.46 1hr7 h THR 68 Ca 0.00 -0.56 0.05 0.00 0.77 0.00 0.00 66.41 66.67 1hr7 h THR 68 Cb 0.00 1.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 1hr7 h THR 68 CO 0.00 0.18 -0.09 0.00 0.37 0.00 0.00 175.52 175.98 1hr7 h ALA 69 N 0.90 0.10 -0.31 6.16 0.00 -1.88 0.98 119.26 125.22 1hr7 h ALA 69 Ca 0.07 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1hr7 h ALA 69 Cb 0.21 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1hr7 h ALA 69 CO -0.00 -0.50 0.19 1.25 0.00 0.00 0.00 179.25 180.18 1hr7 h HIS 70 N -0.05 0.35 -0.58 0.00 6.17 -1.76 -2.08 115.15 117.20 1hr7 h HIS 70 Ca 0.11 0.01 0.10 0.00 0.71 0.00 0.00 60.37 61.31 1hr7 h HIS 70 Cb 0.22 -0.12 -0.08 0.00 2.52 0.00 0.00 27.41 29.96 1hr7 h HIS 70 CO -0.26 0.21 0.14 0.35 0.71 0.00 0.00 177.93 179.09 1hr7 h PHE 71 N 0.38 0.24 -0.99 5.26 3.04 -0.72 0.00 116.94 124.16 1hr7 h PHE 71 Ca 0.12 0.03 0.10 0.00 3.98 0.00 0.00 57.97 62.20 1hr7 h PHE 71 Cb -0.02 -0.02 -0.08 0.00 2.56 0.00 0.00 35.95 38.40 1hr7 h PHE 71 CO -0.07 0.01 0.63 -0.07 -2.02 0.00 0.00 178.31 176.79 1hr7 h LEU 72 N 0.29 0.96 -0.84 0.59 3.38 -0.46 -1.85 115.31 117.37 1hr7 h LEU 72 Ca 0.30 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 1hr7 h LEU 72 Cb 0.41 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 1hr7 h LEU 72 CO -0.36 0.56 0.51 -0.61 0.09 0.00 0.00 178.44 178.62 1hr7 h GLN 73 N 1.05 1.14 -0.49 1.13 4.15 -0.31 0.44 115.11 122.23 1hr7 h GLN 73 Ca 0.46 -0.10 -0.06 0.00 0.77 0.00 0.00 58.65 59.72 1hr7 h GLN 73 Cb 0.35 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1hr7 h GLN 73 CO -0.22 0.80 0.09 0.45 -1.93 0.00 0.00 178.83 178.02 1hr7 h HIS 74 N 1.15 0.85 -0.12 3.99 3.86 -1.07 -3.17 115.15 120.64 1hr7 h HIS 74 Ca 0.30 -0.11 -0.10 0.00 -1.16 0.00 0.00 60.37 59.30 1hr7 h HIS 74 Cb -0.05 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 1hr7 h HIS 74 CO -0.00 0.78 -0.37 -0.07 0.86 0.00 0.00 177.93 179.12 1hr7 h LEU 75 N 0.68 0.27 -0.25 2.43 4.07 -0.88 -3.10 115.31 118.52 1hr7 h LEU 75 Ca 0.15 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1hr7 h LEU 75 Cb 0.38 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1hr7 h LEU 75 CO 0.01 0.62 0.07 0.00 -1.08 0.00 0.00 178.44 178.07 1hr7 n ALA 76 N -2.48 0.87 0.23 1.53 0.00 0.09 -0.24 120.51 120.51 1hr7 n ALA 76 Ca -0.01 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.55 1hr7 n ALA 76 Cb 0.45 -0.92 0.15 0.00 0.00 0.00 0.00 19.45 19.13 1hr7 n ALA 76 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1hr7 n PHE 77 N -1.58 0.34 1.00 0.00 3.01 -1.17 -4.49 117.46 114.56 1hr7 n PHE 77 Ca -0.00 -0.24 0.12 0.00 1.01 0.00 0.00 57.45 58.33 1hr7 n PHE 77 Cb 0.08 -0.01 0.32 0.00 -0.01 0.00 0.00 39.48 39.86 1hr7 n PHE 77 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1hr7 n LYS 78 N 0.98 2.01 0.00 -1.08 4.76 0.66 -4.71 118.16 120.79 1hr7 n LYS 78 Ca 0.13 -1.51 0.00 0.00 -2.87 0.00 0.00 58.31 54.06 1hr7 n LYS 78 Cb 0.46 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.21 1hr7 n LYS 78 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hr7 n GLY 79 N 1.27 4.16 3.64 0.72 0.00 -1.26 -3.80 105.19 109.92 1hr7 n GLY 79 Ca 0.17 -1.30 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 1hr7 n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hr7 s THR 80 N -1.11 1.85 -2.00 2.61 -4.23 0.19 -0.85 115.64 112.11 1hr7 s THR 80 Ca 0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.57 1hr7 s THR 80 Cb 0.00 -2.87 0.16 0.00 1.34 0.00 0.00 72.50 71.13 1hr7 s THR 80 CO 0.00 0.00 0.72 0.00 -0.54 0.00 0.00 174.62 174.80 1hr7 n GLN 81 N -1.00 0.31 0.00 3.99 6.02 -0.16 -2.48 117.38 124.06 1hr7 n GLN 81 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 1hr7 n GLN 81 Cb 0.67 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.65 1hr7 n GLN 81 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1hr7 n ASN 82 N -0.78 2.43 -3.79 1.08 3.02 -1.26 -5.06 115.26 110.90 1hr7 n ASN 82 Ca 0.04 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.41 1hr7 n ASN 82 Cb 0.02 0.34 -0.17 0.00 -0.61 0.00 0.00 39.78 39.36 1hr7 n ASN 82 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1hr7 s ARG 83 N -1.29 0.24 0.85 3.52 0.52 -1.03 -5.11 118.95 116.65 1hr7 s ARG 83 Ca 0.00 0.14 -0.12 0.00 -0.52 0.00 0.00 55.73 55.23 1hr7 s ARG 83 Cb 0.00 -0.51 0.10 0.00 0.52 0.00 0.00 34.95 35.06 1hr7 s ARG 83 CO 0.00 -0.19 1.11 -1.25 0.02 0.00 0.00 175.30 174.99 1hr7 s PRO 84 N 1.30 1.66 0.05 3.54 0.04 -1.26 0.56 135.00 140.89 1hr7 s PRO 84 Ca -0.06 0.56 -0.14 0.00 0.04 0.00 0.00 61.00 61.39 1hr7 s PRO 84 Cb -0.13 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 1hr7 s PRO 84 CO -0.02 -1.90 1.23 0.37 0.04 0.00 0.00 177.00 176.72 1hr7 h GLN 85 N -1.29 -0.26 0.00 4.56 4.15 -1.84 -1.00 115.11 119.43 1hr7 h GLN 85 Ca -0.49 0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1hr7 h GLN 85 Cb 1.29 0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.04 1hr7 h GLN 85 CO 0.59 -0.17 0.24 0.37 -1.93 0.00 0.00 178.83 177.93 1hr7 h GLN 86 N -0.27 0.00 0.04 1.69 4.15 -1.92 0.34 115.11 119.14 1hr7 h GLN 86 Ca 0.01 0.00 -0.25 0.00 0.77 0.00 0.00 58.65 59.18 1hr7 h GLN 86 Cb 0.30 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.00 1hr7 h GLN 86 CO -0.16 0.00 -1.04 0.78 -1.93 0.00 0.00 178.83 176.48 1hr7 h GLY 87 N 0.00 0.50 0.64 2.39 0.00 -1.54 -2.58 103.07 102.48 1hr7 h GLY 87 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 47.33 46.37 1hr7 h GLY 87 CO 0.00 0.84 -0.08 -2.22 0.00 0.00 0.00 176.54 175.08 1hr7 h ILE 88 N 0.23 0.95 0.15 2.60 2.04 -0.54 -2.29 117.51 120.66 1hr7 h ILE 88 Ca -0.11 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.04 1hr7 h ILE 88 Cb 1.70 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 39.12 1hr7 h ILE 88 CO 0.18 0.16 -0.38 -0.33 0.00 0.00 0.00 178.15 177.79 1hr7 h GLU 89 N -0.59 -0.61 -0.67 2.37 5.08 -1.59 -2.04 114.58 116.53 1hr7 h GLU 89 Ca -0.02 0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1hr7 h GLU 89 Cb 0.44 0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1hr7 h GLU 89 CO 0.04 -0.40 0.45 1.25 -1.00 0.00 0.00 179.01 179.34 1hr7 h LEU 90 N -0.63 0.51 -0.08 1.33 7.12 -1.53 -0.98 115.31 121.04 1hr7 h LEU 90 Ca 0.02 0.01 -0.04 0.00 0.13 0.00 0.00 57.88 58.00 1hr7 h LEU 90 Cb 0.64 -0.10 -0.00 0.00 -0.53 0.00 0.00 40.66 40.68 1hr7 h LEU 90 CO -0.20 0.31 -0.09 -0.08 -0.13 0.00 0.00 178.44 178.25 1hr7 h GLU 91 N 0.57 0.21 -0.27 1.25 4.81 -0.88 -2.47 114.58 117.79 1hr7 h GLU 91 Ca 0.31 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1hr7 h GLU 91 Cb 0.45 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1hr7 h GLU 91 CO -0.10 0.65 0.17 0.82 -0.73 0.00 0.00 179.01 179.82 1hr7 h ILE 92 N -0.22 1.09 -0.29 2.32 1.08 -0.97 -2.70 117.51 117.82 1hr7 h ILE 92 Ca 0.01 -0.22 -0.03 0.00 -0.39 0.00 0.00 64.86 64.24 1hr7 h ILE 92 Cb 0.62 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 35.10 1hr7 h ILE 92 CO 0.02 0.09 0.05 -0.33 -0.69 0.00 0.00 178.15 177.30 1hr7 h GLU 93 N 0.35 0.43 -0.17 2.37 4.39 -1.24 -0.33 114.58 120.38 1hr7 h GLU 93 Ca 0.10 -0.07 -0.12 0.00 0.34 0.00 0.00 59.36 59.61 1hr7 h GLU 93 Cb 0.00 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1hr7 h GLU 93 CO -0.02 0.41 -0.41 -0.91 -1.16 0.00 0.00 179.01 176.92 1hr7 h ASN 94 N 0.42 0.40 0.00 1.42 2.35 -1.11 -2.99 115.58 116.07 1hr7 h ASN 94 Ca 0.10 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1hr7 h ASN 94 Cb 0.20 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1hr7 h ASN 94 CO -0.00 0.77 -0.10 2.30 -1.65 0.00 0.00 177.43 178.76 1hr7 n ILE 95 N -4.02 0.00 -2.67 2.81 -5.35 -1.12 -4.97 119.36 104.04 1hr7 n ILE 95 Ca -0.02 -0.35 -0.05 0.00 -0.27 0.00 0.00 62.75 62.07 1hr7 n ILE 95 Cb 0.50 1.04 0.01 0.00 -1.74 0.00 0.00 39.64 39.45 1hr7 n ILE 95 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hr7 n GLY 96 N 1.30 0.60 3.76 3.28 0.00 -0.71 -4.71 105.19 108.72 1hr7 n GLY 96 Ca 0.15 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1hr7 n GLY 96 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hr7 n SER 97 N 0.61 2.26 -3.84 1.61 7.64 -0.22 -4.65 113.62 117.04 1hr7 n SER 97 Ca -0.00 -2.61 -0.13 0.00 1.01 0.00 0.00 58.87 57.14 1hr7 n SER 97 Cb 0.51 -0.29 -0.15 0.00 -1.01 0.00 0.00 64.21 63.28 1hr7 n SER 97 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1hr7 s HIS 98 N -2.55 0.03 -0.05 1.43 3.76 -0.22 -4.58 115.29 113.12 1hr7 s HIS 98 Ca 0.50 0.04 0.06 0.00 -0.15 0.00 0.00 55.06 55.50 1hr7 s HIS 98 Cb -0.04 -0.09 -0.01 0.00 1.11 0.00 0.00 32.58 33.55 1hr7 s HIS 98 CO 0.32 -0.03 -0.22 -1.17 -0.85 0.00 0.00 174.74 172.78 1hr7 s LEU 99 N 0.35 2.02 0.27 0.89 2.96 -1.26 -1.20 118.68 122.70 1hr7 s LEU 99 Ca -0.03 -0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 53.27 1hr7 s LEU 99 Cb -0.04 -1.21 0.01 0.00 0.50 0.00 0.00 46.19 45.44 1hr7 s LEU 99 CO -0.01 0.22 0.60 0.20 -1.32 0.00 0.00 176.35 176.04 1hr7 s ASN 100 N -0.16 -0.16 0.16 3.68 0.01 -0.60 -5.03 114.94 112.83 1hr7 s ASN 100 Ca -0.02 -0.78 -0.25 0.00 -0.71 0.00 0.00 52.86 51.11 1hr7 s ASN 100 Cb -0.12 0.66 0.06 0.00 0.41 0.00 0.00 41.25 42.26 1hr7 s ASN 100 CO 0.02 -1.25 0.96 0.00 -1.51 0.00 0.00 177.10 175.33 1hr7 s ALA 101 N -3.94 -1.63 0.01 0.60 0.00 -1.26 -1.11 121.76 114.43 1hr7 s ALA 101 Ca 0.17 0.07 -0.28 0.00 0.00 0.00 0.00 51.96 51.92 1hr7 s ALA 101 Cb -0.03 0.65 0.10 0.00 0.00 0.00 0.00 23.12 23.83 1hr7 s ALA 101 CO 0.08 -1.05 0.82 1.52 0.00 0.00 0.00 175.76 177.13 1hr7 s TYR 102 N -3.19 -0.41 -0.05 0.00 -0.85 -0.57 -5.01 117.35 107.26 1hr7 s TYR 102 Ca 0.13 0.34 0.04 0.00 -0.52 0.00 0.00 57.07 57.06 1hr7 s TYR 102 Cb -0.02 0.53 0.00 0.00 0.38 0.00 0.00 41.96 42.85 1hr7 s TYR 102 CO 0.03 -0.60 -0.16 0.99 -1.52 0.00 0.00 175.55 174.29 1hr7 s THR 103 N -2.93 1.38 0.22 -3.49 2.01 -1.26 -1.42 115.64 110.15 1hr7 s THR 103 Ca 0.02 -0.66 0.00 0.00 0.31 0.00 0.00 61.69 61.36 1hr7 s THR 103 Cb -0.01 -1.21 -0.00 0.00 0.01 0.00 0.00 72.50 71.29 1hr7 s THR 103 CO -0.08 0.40 0.02 -1.54 -0.69 0.00 0.00 174.62 172.74 1hr7 n SER 104 N 3.39 2.26 0.19 3.53 3.41 -0.19 -5.00 113.62 121.21 1hr7 n SER 104 Ca -0.20 -2.03 0.14 0.00 -0.26 0.00 0.00 58.87 56.53 1hr7 n SER 104 Cb 0.53 0.24 0.53 0.00 -0.26 0.00 0.00 64.21 65.25 1hr7 n SER 104 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1hr7 h ARG 105 N 0.00 0.00 0.00 4.33 3.08 -1.94 -2.85 114.38 117.00 1hr7 h ARG 105 Ca -0.18 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.72 1hr7 h ARG 105 Cb 0.58 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1hr7 h ARG 105 CO 0.30 0.00 -1.59 0.39 -1.07 0.00 0.00 179.97 178.00 1hr7 n GLU 106 N -2.65 2.32 -4.16 0.04 1.02 -1.26 -1.24 120.64 114.70 1hr7 n GLU 106 Ca 0.02 -0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.05 1hr7 n GLU 106 Cb 0.31 -1.23 -0.10 0.00 -0.02 0.00 0.00 31.44 30.40 1hr7 n GLU 106 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1hr7 s ASN 107 N -3.98 0.52 -0.08 1.62 -0.87 -1.25 -1.66 114.94 109.24 1hr7 s ASN 107 Ca -0.04 -1.19 0.04 0.00 -1.57 0.00 0.00 52.86 50.10 1hr7 s ASN 107 Cb 0.03 0.25 0.00 0.00 -0.02 0.00 0.00 41.25 41.51 1hr7 s ASN 107 CO 0.37 -0.68 -0.21 -0.89 -2.57 0.00 0.00 177.10 173.11 1hr7 s THR 108 N -3.95 1.77 -0.02 1.60 2.01 -0.60 -1.02 115.64 115.42 1hr7 s THR 108 Ca 0.23 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.36 1hr7 s THR 108 Cb 0.07 -1.53 0.03 0.00 0.01 0.00 0.00 72.50 71.08 1hr7 s THR 108 CO 0.01 0.50 0.03 -0.69 -0.69 0.00 0.00 174.62 173.78 1hr7 s VAL 109 N 0.26 -0.05 -0.02 3.82 1.01 -0.51 -0.52 120.40 124.39 1hr7 s VAL 109 Ca -0.13 0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1hr7 s VAL 109 Cb -0.16 -0.08 -0.00 0.00 0.00 0.00 0.00 36.38 36.14 1hr7 s VAL 109 CO 0.06 0.07 -0.13 -0.31 0.00 0.00 0.00 175.10 174.79 1hr7 s TYR 110 N 0.89 1.27 0.11 5.22 1.51 -0.69 -1.52 117.35 124.15 1hr7 s TYR 110 Ca -0.07 -0.29 -0.11 0.00 -1.01 0.00 0.00 57.07 55.58 1hr7 s TYR 110 Cb -0.11 -0.85 0.01 0.00 -0.11 0.00 0.00 41.96 40.91 1hr7 s TYR 110 CO -0.03 -0.08 0.28 1.52 -1.11 0.00 0.00 175.55 176.14 1hr7 s TYR 111 N -0.09 0.05 0.09 2.71 1.13 -0.27 -0.38 117.35 120.59 1hr7 s TYR 111 Ca 0.01 -0.43 0.03 0.00 -1.41 0.00 0.00 57.07 55.26 1hr7 s TYR 111 Cb -0.08 0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.81 1hr7 s TYR 111 CO 0.00 -0.63 -0.08 0.00 -2.51 0.00 0.00 175.55 172.33 1hr7 s ALA 112 N -3.85 1.01 -0.08 9.51 0.00 0.10 -1.56 121.76 126.89 1hr7 s ALA 112 Ca 0.06 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 50.84 1hr7 s ALA 112 Cb 0.03 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.24 1hr7 s ALA 112 CO -0.10 -0.11 -0.17 0.15 0.00 0.00 0.00 175.76 175.53 1hr7 s LYS 113 N -3.07 2.28 0.27 0.00 1.02 -0.34 -1.38 119.74 118.52 1hr7 s LYS 113 Ca 0.06 -0.61 -0.19 0.00 0.02 0.00 0.00 55.97 55.25 1hr7 s LYS 113 Cb -0.01 -1.81 0.02 0.00 -0.52 0.00 0.00 37.83 35.52 1hr7 s LYS 113 CO -0.02 0.08 0.66 -1.54 -0.92 0.00 0.00 175.35 173.61 1hr7 s SER 114 N 0.58 -0.24 0.66 2.83 1.04 -0.84 -1.05 113.70 116.68 1hr7 s SER 114 Ca -0.15 -0.65 -0.17 0.00 0.48 0.00 0.00 55.95 55.46 1hr7 s SER 114 Cb -0.17 0.69 -0.00 0.00 0.10 0.00 0.00 66.02 66.64 1hr7 s SER 114 CO 0.05 -1.28 1.22 -0.76 0.98 0.00 0.00 173.24 173.45 1hr7 s LEU 115 N -2.93 3.51 0.44 2.42 1.43 -1.26 -1.13 118.68 121.15 1hr7 s LEU 115 Ca 0.13 2.42 0.17 0.00 -1.03 0.00 0.00 54.13 55.81 1hr7 s LEU 115 Cb -0.05 -4.60 1.09 0.00 0.03 0.00 0.00 46.19 42.67 1hr7 s LEU 115 CO 0.06 -1.93 1.95 0.06 0.23 0.00 0.00 176.35 176.71 1hr7 h GLN 116 N 0.35 0.35 -0.63 1.70 3.07 -0.88 -1.80 115.11 117.26 1hr7 h GLN 116 Ca -0.49 -0.02 0.02 0.00 0.09 0.00 0.00 58.65 58.25 1hr7 h GLN 116 Cb 1.30 -0.08 -0.03 0.00 0.08 0.00 0.00 27.48 28.75 1hr7 h GLN 116 CO 0.53 0.23 0.42 0.93 0.09 0.00 0.00 178.83 181.02 1hr7 h GLU 117 N 0.36 0.77 -0.28 0.06 3.07 -1.90 -2.72 114.58 113.94 1hr7 h GLU 117 Ca 0.33 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 1hr7 h GLU 117 Cb 0.79 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 1hr7 h GLU 117 CO -0.09 0.51 0.00 -0.25 -1.40 0.00 0.00 179.01 177.78 1hr7 n ASP 118 N -4.45 1.55 -0.03 1.42 8.00 -0.68 -4.43 116.55 117.93 1hr7 n ASP 118 Ca 0.07 -1.96 -0.09 0.00 0.71 0.00 0.00 54.79 53.52 1hr7 n ASP 118 Cb 0.09 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 40.97 1hr7 n ASP 118 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1hr7 h ILE 119 N 1.73 0.85 -0.62 0.53 1.08 -1.54 -0.62 117.51 118.91 1hr7 h ILE 119 Ca 0.00 -0.01 0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1hr7 h ILE 119 Cb 0.39 0.82 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 1hr7 h ILE 119 CO 0.00 0.01 0.40 1.55 -0.69 0.00 0.00 178.15 179.41 1hr7 h PRO 120 N 0.03 0.78 -0.48 2.37 0.13 -1.84 0.36 132.00 133.35 1hr7 h PRO 120 Ca 0.08 -0.05 0.10 0.00 -0.87 0.00 0.00 66.00 65.27 1hr7 h PRO 120 Cb 0.12 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.04 1hr7 h PRO 120 CO -0.16 0.51 0.33 -0.22 -0.23 0.00 0.00 178.00 178.24 1hr7 h LYS 121 N 0.80 0.20 -0.16 0.86 1.63 -1.73 -1.12 116.57 117.05 1hr7 h LYS 121 Ca 0.24 -0.01 -0.19 0.00 -0.85 0.00 0.00 60.65 59.84 1hr7 h LYS 121 Cb -0.04 -0.05 0.01 0.00 -0.60 0.00 0.00 32.23 31.55 1hr7 h LYS 121 CO -0.07 0.13 -0.64 0.00 -3.45 0.00 0.00 179.45 175.42 1hr7 h ALA 122 N 1.76 0.29 -0.53 5.00 0.00 0.59 -2.10 119.26 124.27 1hr7 h ALA 122 Ca 0.22 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1hr7 h ALA 122 Cb 0.62 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1hr7 h ALA 122 CO -0.04 0.57 -0.09 0.28 0.00 0.00 0.00 179.25 179.97 1hr7 h VAL 123 N 0.42 1.27 0.57 0.00 2.07 -0.50 -0.95 116.25 119.13 1hr7 h VAL 123 Ca -0.03 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.22 1hr7 h VAL 123 Cb 1.27 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1hr7 h VAL 123 CO 0.13 0.44 -0.45 -0.78 0.02 0.00 0.00 177.57 176.94 1hr7 h ASP 124 N 0.88 -1.18 -0.72 0.57 3.58 -1.24 -1.35 116.42 116.96 1hr7 h ASP 124 Ca 0.14 0.08 0.05 0.00 0.42 0.00 0.00 57.03 57.72 1hr7 h ASP 124 Cb 0.66 0.37 -0.04 0.00 1.72 0.00 0.00 39.33 42.04 1hr7 h ASP 124 CO 0.05 -0.64 0.48 0.40 -2.88 0.00 0.00 179.24 176.64 1hr7 h ILE 125 N -0.99 1.07 -0.07 2.25 2.04 -1.33 -0.43 117.51 120.04 1hr7 h ILE 125 Ca -0.07 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1hr7 h ILE 125 Cb 0.84 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1hr7 h ILE 125 CO 0.01 0.15 0.02 -0.07 0.00 0.00 0.00 178.15 178.25 1hr7 h LEU 126 N 0.82 0.11 -0.86 1.44 3.38 -0.86 -1.31 115.31 118.02 1hr7 h LEU 126 Ca 0.30 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1hr7 h LEU 126 Cb 0.15 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1hr7 h LEU 126 CO -0.09 0.32 0.55 0.77 0.09 0.00 0.00 178.44 180.07 1hr7 h SER 127 N -0.11 1.01 -0.28 -0.43 4.64 -0.95 -0.68 113.55 116.75 1hr7 h SER 127 Ca 0.02 -0.04 0.02 0.00 -0.47 0.00 0.00 61.79 61.32 1hr7 h SER 127 Cb 0.25 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1hr7 h SER 127 CO 0.00 0.75 0.14 -0.78 -0.87 0.00 0.00 176.83 176.07 1hr7 h ASP 128 N 1.18 0.20 0.35 4.97 3.58 -0.89 -0.11 116.42 125.70 1hr7 h ASP 128 Ca 0.31 0.01 -0.13 0.00 0.42 0.00 0.00 57.03 57.65 1hr7 h ASP 128 Cb -0.10 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1hr7 h ASP 128 CO -0.06 0.15 -0.53 0.40 -2.88 0.00 0.00 179.24 176.32 1hr7 h ILE 129 N 0.29 1.36 0.17 2.25 2.04 -0.94 -0.59 117.51 122.09 1hr7 h ILE 129 Ca 0.11 -1.81 -0.30 0.00 1.00 0.00 0.00 64.86 63.87 1hr7 h ILE 129 Cb 0.04 1.90 0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1hr7 h ILE 129 CO -0.08 0.53 -1.32 0.25 0.00 0.00 0.00 178.15 177.53 1hr7 h LEU 130 N 0.15 0.56 0.00 1.44 5.85 -0.90 -3.38 115.31 119.03 1hr7 h LEU 130 Ca 0.00 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.12 1hr7 h LEU 130 Cb 0.99 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1hr7 h LEU 130 CO 0.08 1.47 -1.17 0.35 -0.34 0.00 0.00 178.44 178.84 1hr7 n THR 131 N -3.59 0.00 -1.87 1.05 -2.24 -0.07 -4.73 114.28 102.82 1hr7 n THR 131 Ca -0.11 -0.18 -0.12 0.00 -2.27 0.00 0.00 64.05 61.37 1hr7 n THR 131 Cb 1.05 0.44 0.09 0.00 -2.10 0.00 0.00 70.33 69.82 1hr7 n THR 131 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hr7 n LYS 132 N -1.65 2.78 -2.52 -0.78 5.02 -0.23 -5.03 118.16 115.75 1hr7 n LYS 132 Ca -0.01 -3.81 -0.42 0.00 -2.02 0.00 0.00 58.31 52.05 1hr7 n LYS 132 Cb 0.17 -2.00 -0.03 0.00 -0.02 0.00 0.00 35.03 33.14 1hr7 n LYS 132 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1hr7 s SER 133 N -3.45 7.21 0.18 4.39 1.04 -1.22 -0.99 113.70 120.87 1hr7 s SER 133 Ca 0.46 1.97 -0.14 0.00 0.48 0.00 0.00 55.95 58.72 1hr7 s SER 133 Cb 0.39 -2.59 0.17 0.00 0.10 0.00 0.00 66.02 64.10 1hr7 s SER 133 CO -0.01 -0.33 1.70 0.58 0.98 0.00 0.00 173.24 176.17 1hr7 h VAL 134 N 4.26 0.69 -5.73 5.02 2.07 -1.27 -3.46 116.25 117.84 1hr7 h VAL 134 Ca -0.42 -0.06 -0.34 0.00 0.82 0.00 0.00 66.70 66.69 1hr7 h VAL 134 Cb 1.21 0.50 0.15 0.00 -1.52 0.00 0.00 31.29 31.63 1hr7 h VAL 134 CO 0.77 0.03 -0.79 0.18 0.02 0.00 0.00 177.57 177.78 1hr7 n LEU 135 N -5.16 -3.95 -4.74 2.57 4.77 -1.26 -4.92 117.00 104.31 1hr7 n LEU 135 Ca 0.05 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 54.94 1hr7 n LEU 135 Cb 0.24 -3.04 -0.01 0.00 -2.33 0.00 0.00 43.42 38.28 1hr7 n LEU 135 CO 0.19 0.37 1.06 -0.67 -1.33 0.00 0.00 177.39 177.01 1hr7 n ASP 136 N -3.12 3.39 -0.19 -1.43 2.03 -1.26 -4.85 116.55 111.11 1hr7 n ASP 136 Ca -0.28 1.20 -0.02 0.00 0.52 0.00 0.00 54.79 56.21 1hr7 n ASP 136 Cb 0.67 -1.56 0.18 0.00 -0.72 0.00 0.00 41.12 39.69 1hr7 n ASP 136 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 1hr7 h ASN 137 N 3.16 0.87 -0.42 1.67 -0.26 -1.99 -0.38 115.58 118.24 1hr7 h ASN 137 Ca -0.48 -0.10 -0.03 0.00 -0.56 0.00 0.00 56.30 55.12 1hr7 h ASN 137 Cb 1.26 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 38.27 1hr7 h ASN 137 CO 0.66 0.76 0.13 -1.28 -1.06 0.00 0.00 177.43 176.65 1hr7 h SER 138 N 0.95 0.61 -0.13 5.81 0.87 -2.00 -2.58 113.55 117.07 1hr7 h SER 138 Ca 0.23 -0.20 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1hr7 h SER 138 Cb 0.13 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 1hr7 h SER 138 CO -0.03 0.65 0.06 0.00 -0.53 0.00 0.00 176.83 176.98 1hr7 h ALA 139 N 0.98 0.15 -0.88 6.23 0.00 -1.80 -1.71 119.26 122.23 1hr7 h ALA 139 Ca 0.14 0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.23 1hr7 h ALA 139 Cb 0.26 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.96 1hr7 h ALA 139 CO -0.00 -0.38 0.58 0.82 0.00 0.00 0.00 179.25 180.26 1hr7 h ILE 140 N 0.14 0.72 0.13 0.00 2.04 -0.91 -1.58 117.51 118.05 1hr7 h ILE 140 Ca 0.05 -0.16 -0.22 0.00 1.00 0.00 0.00 64.86 65.54 1hr7 h ILE 140 Cb 0.02 0.22 0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1hr7 h ILE 140 CO -0.04 0.09 -0.93 -0.33 0.00 0.00 0.00 178.15 176.93 1hr7 h GLU 141 N 0.47 0.40 -0.01 2.37 4.39 -1.02 -3.25 114.58 117.93 1hr7 h GLU 141 Ca 0.45 -0.61 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1hr7 h GLU 141 Cb 1.03 0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1hr7 h GLU 141 CO -0.18 1.27 -0.09 0.00 -1.16 0.00 0.00 179.01 178.85 1hr7 h ARG 142 N -0.16 0.01 0.00 2.33 3.08 -0.76 -2.70 114.38 116.19 1hr7 h ARG 142 Ca -0.15 -0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.81 1hr7 h ARG 142 Cb 1.70 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.73 1hr7 h ARG 142 CO 0.18 0.10 -0.43 1.49 -1.07 0.00 0.00 179.97 180.24 1hr7 h GLU 143 N 0.01 0.00 -0.92 0.04 4.57 -1.40 -3.27 114.58 113.61 1hr7 h GLU 143 Ca 0.00 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.36 1hr7 h GLU 143 Cb 0.17 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.68 1hr7 h GLU 143 CO 0.01 0.43 0.59 0.00 -1.18 0.00 0.00 179.01 178.86 1hr7 h ARG 144 N 0.00 0.54 -0.23 1.92 3.08 -1.51 -0.74 114.38 117.44 1hr7 h ARG 144 Ca -0.00 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.87 1hr7 h ARG 144 Cb 1.23 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.16 1hr7 h ARG 144 CO 0.06 0.36 -0.42 0.22 -1.07 0.00 0.00 179.97 179.11 1hr7 h ASP 145 N 0.55 0.76 -0.51 7.04 1.82 -1.73 -2.66 116.42 121.69 1hr7 h ASP 145 Ca 0.48 -0.54 0.02 0.00 -0.39 0.00 0.00 57.03 56.61 1hr7 h ASP 145 Cb 0.99 -0.22 -0.03 0.00 0.68 0.00 0.00 39.33 40.75 1hr7 h ASP 145 CO -0.22 1.16 0.31 0.58 -1.61 0.00 0.00 179.24 179.45 1hr7 h VAL 146 N 0.39 1.05 -0.53 2.25 2.07 -1.30 -1.67 116.25 118.51 1hr7 h VAL 146 Ca 0.01 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 1hr7 h VAL 146 Cb 1.02 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1hr7 h VAL 146 CO 0.09 0.11 0.19 0.40 0.02 0.00 0.00 177.57 178.38 1hr7 h ILE 147 N 0.61 1.20 -0.08 4.57 1.08 -1.38 -0.32 117.51 123.20 1hr7 h ILE 147 Ca 0.21 -0.67 -0.01 0.00 -0.39 0.00 0.00 64.86 63.99 1hr7 h ILE 147 Cb 0.02 0.60 -0.00 0.00 -3.07 0.00 0.00 36.82 34.37 1hr7 h ILE 147 CO -0.09 0.26 0.00 0.40 -0.69 0.00 0.00 178.15 178.03 1hr7 h ILE 148 N 0.77 1.24 -0.39 -0.67 1.08 -1.09 0.11 117.51 118.55 1hr7 h ILE 148 Ca 0.18 -0.75 0.08 0.00 -0.39 0.00 0.00 64.86 63.98 1hr7 h ILE 148 Cb 0.19 1.60 -0.08 0.00 -3.07 0.00 0.00 36.82 35.47 1hr7 h ILE 148 CO -0.01 0.21 -0.12 -0.09 -0.69 0.00 0.00 178.15 177.44 1hr7 h ARG 149 N -0.14 -0.03 -0.47 2.37 9.65 -1.00 0.66 114.38 125.40 1hr7 h ARG 149 Ca 0.02 0.00 0.07 0.00 -1.10 0.00 0.00 59.98 58.98 1hr7 h ARG 149 Cb 0.33 0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.85 1hr7 h ARG 149 CO 0.00 -0.02 0.12 1.49 2.80 0.00 0.00 179.97 184.36 1hr7 h GLU 150 N -0.04 0.26 -0.57 0.20 4.81 -0.78 -1.13 114.58 117.33 1hr7 h GLU 150 Ca 0.19 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1hr7 h GLU 150 Cb 0.33 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1hr7 h GLU 150 CO -0.42 0.17 0.22 1.03 -0.73 0.00 0.00 179.01 179.28 1hr7 h SER 151 N 0.27 0.76 -0.47 1.04 0.87 0.69 -2.30 113.55 114.41 1hr7 h SER 151 Ca 0.23 -0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.63 1hr7 h SER 151 Cb 0.28 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 1hr7 h SER 151 CO -0.28 0.70 0.09 -0.33 -0.53 0.00 0.00 176.83 176.48 1hr7 h GLU 152 N 0.82 0.83 -0.35 2.24 5.08 0.25 -2.33 114.58 121.13 1hr7 h GLU 152 Ca 0.19 -0.19 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 1hr7 h GLU 152 Cb 0.18 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1hr7 h GLU 152 CO -0.02 0.78 -0.38 0.93 -1.00 0.00 0.00 179.01 179.32 1hr7 h GLU 153 N 0.80 0.83 -0.23 2.33 4.39 -0.87 -2.92 114.58 118.89 1hr7 h GLU 153 Ca 0.17 -0.43 -0.05 0.00 0.34 0.00 0.00 59.36 59.40 1hr7 h GLU 153 Cb 0.35 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1hr7 h GLU 153 CO 0.01 1.06 -0.07 0.28 -1.16 0.00 0.00 179.01 179.13 1hr7 h VAL 154 N 0.68 1.18 0.00 3.13 2.07 -1.14 -1.33 116.25 120.83 1hr7 h VAL 154 Ca 0.06 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1hr7 h VAL 154 Cb 0.95 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1hr7 h VAL 154 CO 0.09 0.25 0.00 0.47 0.02 0.00 0.00 177.57 178.40 1hr7 n ASP 155 N -4.29 0.51 -0.82 0.57 8.00 -0.90 -1.03 116.55 118.59 1hr7 n ASP 155 Ca 0.00 0.71 0.12 0.00 0.71 0.00 0.00 54.79 56.33 1hr7 n ASP 155 Cb 0.25 -0.79 0.26 0.00 -0.02 0.00 0.00 41.12 40.82 1hr7 n ASP 155 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hr7 n LYS 156 N -2.16 2.12 -3.55 -1.24 5.02 -0.50 -4.65 118.16 113.21 1hr7 n LYS 156 Ca -0.00 -1.65 -0.41 0.00 -2.02 0.00 0.00 58.31 54.23 1hr7 n LYS 156 Cb 0.08 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.56 1hr7 n LYS 156 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1hr7 s MET 157 N -1.90 3.07 0.39 1.97 -1.94 -0.20 -4.96 119.30 115.72 1hr7 s MET 157 Ca 0.33 -2.57 0.13 0.00 -1.71 0.00 0.00 55.69 51.87 1hr7 s MET 157 Cb 0.20 -4.05 0.95 0.00 2.01 0.00 0.00 34.83 33.95 1hr7 s MET 157 CO 0.31 -1.23 1.87 1.88 -0.01 0.00 0.00 175.02 177.84 1hr7 h TYR 158 N 7.26 0.67 -0.37 -0.03 0.05 -1.82 -0.37 116.97 122.36 1hr7 h TYR 158 Ca 0.05 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.79 1hr7 h TYR 158 Cb 0.98 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.50 1hr7 h TYR 158 CO 0.85 0.22 0.00 0.38 -1.05 0.00 0.00 178.16 178.56 1hr7 h ASP 159 N 0.54 0.64 -0.60 3.88 2.03 -1.94 -0.92 116.42 120.04 1hr7 h ASP 159 Ca 0.45 -0.31 0.00 0.00 -0.73 0.00 0.00 57.03 56.45 1hr7 h ASP 159 Cb 0.93 -0.17 -0.03 0.00 -0.83 0.00 0.00 39.33 39.23 1hr7 h ASP 159 CO -0.19 0.79 0.38 -0.33 -1.03 0.00 0.00 179.24 178.86 1hr7 h GLU 160 N 0.47 0.80 -0.05 4.15 4.39 -1.44 -1.43 114.58 121.46 1hr7 h GLU 160 Ca 0.11 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1hr7 h GLU 160 Cb 0.46 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1hr7 h GLU 160 CO 0.02 0.55 0.03 0.28 -1.16 0.00 0.00 179.01 178.72 1hr7 h VAL 161 N 0.81 1.08 -0.66 3.13 2.07 -1.16 -0.36 116.25 121.16 1hr7 h VAL 161 Ca 0.22 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.56 1hr7 h VAL 161 Cb -0.06 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1hr7 h VAL 161 CO -0.04 0.07 0.37 0.58 0.02 0.00 0.00 177.57 178.57 1hr7 h VAL 162 N -0.01 0.98 -0.03 2.57 2.07 -0.95 -1.95 116.25 118.93 1hr7 h VAL 162 Ca 0.02 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.18 1hr7 h VAL 162 Cb 0.09 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1hr7 h VAL 162 CO -0.00 0.13 -0.54 -0.26 0.02 0.00 0.00 177.57 176.91 1hr7 h PHE 163 N 0.69 0.10 -0.45 1.57 0.04 -1.05 -1.27 116.94 116.57 1hr7 h PHE 163 Ca 0.29 -0.04 -0.14 0.00 2.80 0.00 0.00 57.97 60.89 1hr7 h PHE 163 Cb 0.17 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1hr7 h PHE 163 CO -0.08 0.61 -0.28 -0.44 -0.60 0.00 0.00 178.31 177.53 1hr7 h ASP 164 N 0.06 1.03 -0.62 2.17 3.32 -0.55 -2.14 116.42 119.68 1hr7 h ASP 164 Ca -0.00 -0.42 -0.10 0.00 0.02 0.00 0.00 57.03 56.53 1hr7 h ASP 164 Cb 0.98 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1hr7 h ASP 164 CO 0.08 1.22 0.01 0.45 -1.72 0.00 0.00 179.24 179.28 1hr7 h HIS 165 N 0.83 1.18 -0.68 4.55 3.86 -1.23 -1.66 115.15 122.00 1hr7 h HIS 165 Ca 0.09 -0.20 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 1hr7 h HIS 165 Cb 0.86 -0.31 -0.03 0.00 1.06 0.00 0.00 27.41 28.99 1hr7 h HIS 165 CO 0.06 1.03 0.38 1.25 0.86 0.00 0.00 177.93 181.51 1hr7 h LEU 166 N 0.99 0.83 -0.63 2.43 5.85 -1.14 -0.97 115.31 122.68 1hr7 h LEU 166 Ca 0.18 -0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.72 1hr7 h LEU 166 Cb 0.55 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1hr7 h LEU 166 CO 0.03 0.66 -0.25 0.45 -0.34 0.00 0.00 178.44 178.98 1hr7 h HIS 167 N 0.94 0.93 -0.04 1.25 3.86 -0.97 -0.59 115.15 120.53 1hr7 h HIS 167 Ca 0.24 -0.23 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1hr7 h HIS 167 Cb 0.00 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 28.26 1hr7 h HIS 167 CO 0.01 0.98 0.02 1.49 0.86 0.00 0.00 177.93 181.28 1hr7 h GLU 168 N 0.70 0.06 0.00 2.45 4.81 -0.35 -1.09 114.58 121.16 1hr7 h GLU 168 Ca 0.09 -0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.12 1hr7 h GLU 168 Cb 0.78 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.13 1hr7 h GLU 168 CO 0.06 0.15 -0.91 -0.84 -0.73 0.00 0.00 179.01 176.74 1hr7 h ILE 169 N -0.05 1.53 -0.15 2.32 3.07 -1.21 -2.90 117.51 120.12 1hr7 h ILE 169 Ca 0.01 -3.17 -0.22 0.00 1.55 0.00 0.00 64.86 63.03 1hr7 h ILE 169 Cb 0.12 2.75 0.01 0.00 -0.27 0.00 0.00 36.82 39.43 1hr7 h ILE 169 CO -0.00 0.87 -0.78 0.74 -1.05 0.00 0.00 178.15 177.93 1hr7 h THR 170 N 0.00 1.28 -2.04 0.16 2.02 -1.11 -3.22 112.91 109.99 1hr7 h THR 170 Ca -0.01 -1.97 -0.69 0.00 0.77 0.00 0.00 66.41 64.51 1hr7 h THR 170 Cb 1.70 1.99 -0.35 0.00 -1.74 0.00 0.00 68.15 69.75 1hr7 h THR 170 CO 0.12 0.63 0.16 -1.22 0.37 0.00 0.00 175.52 175.57 1hr7 n TYR 171 N -3.94 3.34 -1.63 3.16 4.01 -0.42 -0.59 117.16 121.09 1hr7 n TYR 171 Ca -0.08 -3.05 -0.53 0.00 -0.16 0.00 0.00 57.90 54.09 1hr7 n TYR 171 Cb 0.75 -0.74 -0.06 0.00 -0.31 0.00 0.00 39.34 38.98 1hr7 n TYR 171 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1hr7 n LYS 172 N -0.31 1.27 -3.48 -0.72 3.00 -1.09 -1.86 118.16 114.95 1hr7 n LYS 172 Ca 0.42 0.46 -0.25 0.00 -0.00 0.00 0.00 58.31 58.94 1hr7 n LYS 172 Cb 0.38 -2.13 0.00 0.00 0.00 0.00 0.00 35.03 33.28 1hr7 n LYS 172 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1hr7 n ASP 173 N 3.43 -3.98 -4.43 3.14 8.00 -1.26 -4.97 116.55 116.48 1hr7 n ASP 173 Ca 0.20 -0.48 -0.22 0.00 0.71 0.00 0.00 54.79 55.00 1hr7 n ASP 173 Cb 0.19 -3.26 -0.10 0.00 -0.02 0.00 0.00 41.12 37.92 1hr7 n ASP 173 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1hr7 s GLN 174 N -6.14 1.56 0.16 -1.24 -0.21 -0.78 -5.04 119.66 107.97 1hr7 s GLN 174 Ca 0.46 -1.76 -0.16 0.00 0.02 0.00 0.00 55.36 53.91 1hr7 s GLN 174 Cb -0.24 -1.33 0.07 0.00 1.00 0.00 0.00 33.01 32.51 1hr7 s GLN 174 CO 0.56 0.14 1.74 -1.35 -2.12 0.00 0.00 175.29 174.26 1hr7 h PRO 175 N 2.30 0.23 0.00 2.91 0.11 -1.87 -1.66 132.00 134.02 1hr7 h PRO 175 Ca -0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1hr7 h PRO 175 Cb 1.24 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1hr7 h PRO 175 CO 0.65 0.15 0.00 1.25 -0.21 0.00 0.00 178.00 179.85 1hr7 h LEU 176 N 0.24 0.00 -0.01 2.35 5.85 -1.87 -2.16 115.31 119.71 1hr7 h LEU 176 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1hr7 h LEU 176 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1hr7 h LEU 176 CO -0.20 0.00 -0.01 0.61 -0.34 0.00 0.00 178.44 178.50 1hr7 n GLY 177 N -0.92 -1.34 3.90 3.75 0.00 -0.62 -4.84 105.19 105.12 1hr7 n GLY 177 Ca -0.02 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 1hr7 n GLY 177 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hr7 s ARG 178 N -2.70 3.65 0.90 1.61 0.52 -0.81 -3.02 118.95 119.09 1hr7 s ARG 178 Ca 0.24 0.10 -0.14 0.00 -0.52 0.00 0.00 55.73 55.42 1hr7 s ARG 178 Cb 0.20 -2.56 0.16 0.00 0.52 0.00 0.00 34.95 33.26 1hr7 s ARG 178 CO 0.49 0.11 1.26 0.95 0.02 0.00 0.00 175.30 178.12 1hr7 s THR 179 N -2.23 2.02 -0.08 0.02 -4.23 -1.26 -4.97 115.64 104.91 1hr7 s THR 179 Ca 0.46 -0.04 0.05 0.00 -1.18 0.00 0.00 61.69 60.98 1hr7 s THR 179 Cb -0.10 -2.98 -0.24 0.00 1.34 0.00 0.00 72.50 70.51 1hr7 s THR 179 CO 0.32 0.00 0.53 -0.38 -0.54 0.00 0.00 174.62 174.55 1hr7 n ILE 180 N -3.56 1.68 0.06 2.99 5.41 -1.26 -4.10 119.36 120.57 1hr7 n ILE 180 Ca 0.13 -0.74 -0.12 0.00 1.00 0.00 0.00 62.75 63.02 1hr7 n ILE 180 Cb 0.60 -1.31 -0.02 0.00 -0.71 0.00 0.00 39.64 38.21 1hr7 n ILE 180 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1hr7 h LEU 181 N 0.03 0.53 0.00 1.39 4.07 -1.95 -3.39 115.31 115.99 1hr7 h LEU 181 Ca -0.35 -0.39 0.00 0.00 0.08 0.00 0.00 57.88 57.23 1hr7 h LEU 181 Cb 2.03 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 43.61 1hr7 h LEU 181 CO 0.08 1.16 0.00 0.61 -1.08 0.00 0.00 178.44 179.21 1hr7 n GLY 182 N 0.77 -0.92 3.80 0.83 0.00 -1.26 -4.32 105.19 104.10 1hr7 n GLY 182 Ca -0.06 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 43.98 1hr7 n GLY 182 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1hr7 s PRO 183 N -1.83 3.07 0.35 1.61 0.02 -1.26 -4.87 135.00 132.09 1hr7 s PRO 183 Ca 0.00 1.18 0.04 0.00 0.02 0.00 0.00 61.00 62.24 1hr7 s PRO 183 Cb 0.00 -2.00 0.68 0.00 0.02 0.00 0.00 34.50 33.20 1hr7 s PRO 183 CO 0.00 -1.01 1.98 0.82 -0.33 0.00 0.00 177.00 178.45 1hr7 h ILE 184 N 0.01 1.08 -0.30 2.83 1.08 -1.98 -1.18 117.51 119.05 1hr7 h ILE 184 Ca -0.46 -0.28 0.07 0.00 -0.39 0.00 0.00 64.86 63.80 1hr7 h ILE 184 Cb 1.22 0.19 -0.08 0.00 -3.07 0.00 0.00 36.82 35.08 1hr7 h ILE 184 CO 0.56 0.15 -0.28 0.50 -0.69 0.00 0.00 178.15 178.39 1hr7 h LYS 185 N 0.82 -0.26 -0.16 2.37 3.64 -1.99 -1.59 116.57 119.40 1hr7 h LYS 185 Ca 0.29 0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.55 1hr7 h LYS 185 Cb 0.11 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1hr7 h LYS 185 CO -0.09 -0.17 -0.47 -0.91 -2.27 0.00 0.00 179.45 175.54 1hr7 h ASN 186 N -0.27 0.44 0.08 4.20 4.21 -1.70 -2.70 115.58 119.85 1hr7 h ASN 186 Ca 0.15 -0.21 -0.01 0.00 1.21 0.00 0.00 56.30 57.44 1hr7 h ASN 186 Cb 0.51 -0.13 -0.00 0.00 -1.12 0.00 0.00 38.32 37.58 1hr7 h ASN 186 CO -0.45 0.85 -0.04 0.40 -1.29 0.00 0.00 177.43 176.90 1hr7 h ILE 187 N 0.33 0.62 0.00 2.81 2.04 -0.54 -0.73 117.51 122.04 1hr7 h ILE 187 Ca 0.02 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1hr7 h ILE 187 Cb 0.95 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 1hr7 h ILE 187 CO 0.08 0.03 -1.02 0.29 0.00 0.00 0.00 178.15 177.54 1hr7 n LYS 188 N -3.91 0.37 0.00 2.37 5.02 -0.66 -4.40 118.16 116.95 1hr7 n LYS 188 Ca -0.03 0.02 0.05 0.00 -2.02 0.00 0.00 58.31 56.33 1hr7 n LYS 188 Cb 0.12 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.49 1hr7 n LYS 188 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1hr7 n SER 189 N -2.13 1.20 -4.73 4.39 3.41 -0.63 -5.01 113.62 110.11 1hr7 n SER 189 Ca 0.01 -1.10 -0.42 0.00 -0.26 0.00 0.00 58.87 57.11 1hr7 n SER 189 Cb 0.47 0.44 -0.03 0.00 -0.26 0.00 0.00 64.21 64.83 1hr7 n SER 189 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1hr7 s ILE 190 N -1.25 2.46 0.28 -1.33 -1.09 -0.38 -5.00 121.20 114.89 1hr7 s ILE 190 Ca 0.08 0.35 0.10 0.00 -2.23 0.00 0.00 60.65 58.95 1hr7 s ILE 190 Cb 0.07 -3.23 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 1hr7 s ILE 190 CO 0.22 0.04 -0.06 0.42 -1.23 0.00 0.00 174.94 174.34 1hr7 s THR 191 N 0.64 3.10 0.52 2.92 -4.23 -1.26 -4.99 115.64 112.34 1hr7 s THR 191 Ca 0.67 -2.06 0.31 0.00 -1.18 0.00 0.00 61.69 59.43 1hr7 s THR 191 Cb -0.45 -2.69 0.49 0.00 1.34 0.00 0.00 72.50 71.19 1hr7 s THR 191 CO 0.37 -0.37 1.86 -0.09 -0.54 0.00 0.00 174.62 175.86 1hr7 h ARG 192 N 1.98 0.05 -0.11 3.99 2.43 -1.94 0.36 114.38 121.14 1hr7 h ARG 192 Ca -0.43 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 1hr7 h ARG 192 Cb 1.25 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1hr7 h ARG 192 CO 0.61 0.03 0.01 1.15 -1.51 0.00 0.00 179.97 180.26 1hr7 h THR 193 N 0.05 1.23 -0.67 0.20 2.02 -1.99 -1.08 112.91 112.67 1hr7 h THR 193 Ca 0.47 -0.73 0.12 0.00 0.77 0.00 0.00 66.41 67.03 1hr7 h THR 193 Cb 1.77 1.51 -0.08 0.00 -1.74 0.00 0.00 68.15 69.60 1hr7 h THR 193 CO -0.03 0.21 0.24 0.44 0.37 0.00 0.00 175.52 176.74 1hr7 h ASP 194 N -0.06 0.20 0.70 4.18 3.32 -0.69 -0.98 116.42 123.08 1hr7 h ASP 194 Ca 0.03 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 1hr7 h ASP 194 Cb 0.31 0.09 0.01 0.00 0.22 0.00 0.00 39.33 39.96 1hr7 h ASP 194 CO 0.00 0.10 -0.34 -0.07 -1.72 0.00 0.00 179.24 177.21 1hr7 h LEU 195 N 0.39 -0.80 -1.96 1.55 3.38 -1.18 -2.01 115.31 114.68 1hr7 h LEU 195 Ca 0.35 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1hr7 h LEU 195 Cb 0.49 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1hr7 h LEU 195 CO -0.37 -0.54 0.03 0.11 0.09 0.00 0.00 178.44 177.76 1hr7 h LYS 196 N -0.99 0.05 -0.24 1.13 1.57 -1.00 -1.62 116.57 115.47 1hr7 h LYS 196 Ca -0.10 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1hr7 h LYS 196 Cb 0.74 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 1hr7 h LYS 196 CO 0.16 0.04 -0.10 -0.44 -0.57 0.00 0.00 179.45 178.54 1hr7 h ASP 197 N 0.06 0.50 -0.45 0.86 3.32 -1.03 -0.91 116.42 118.76 1hr7 h ASP 197 Ca 0.02 -0.40 0.02 0.00 0.02 0.00 0.00 57.03 56.69 1hr7 h ASP 197 Cb 0.00 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1hr7 h ASP 197 CO -0.00 0.78 0.26 0.22 -1.72 0.00 0.00 179.24 178.78 1hr7 h TYR 198 N 0.21 0.49 0.03 4.55 5.03 -0.70 -0.49 116.97 126.09 1hr7 h TYR 198 Ca 0.06 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.39 1hr7 h TYR 198 Cb 0.59 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.70 1hr7 h TYR 198 CO 0.06 0.28 -0.06 0.82 -1.32 0.00 0.00 178.16 177.93 1hr7 h ILE 199 N 0.52 0.85 -0.68 1.81 2.04 -1.20 -1.34 117.51 119.51 1hr7 h ILE 199 Ca 0.18 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.05 1hr7 h ILE 199 Cb 0.03 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1hr7 h ILE 199 CO -0.09 0.00 0.45 0.74 0.00 0.00 0.00 178.15 179.25 1hr7 h THR 200 N -0.13 1.17 -0.35 -0.27 2.02 -0.84 -1.37 112.91 113.14 1hr7 h THR 200 Ca 0.01 -0.31 -0.15 0.00 0.77 0.00 0.00 66.41 66.73 1hr7 h THR 200 Cb 0.14 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1hr7 h THR 200 CO -0.04 0.17 -0.38 0.50 0.37 0.00 0.00 175.52 176.13 1hr7 h LYS 201 N 0.91 0.87 0.00 6.66 3.64 -0.96 -3.39 116.57 124.31 1hr7 h LYS 201 Ca 0.25 -0.47 -0.32 0.00 -1.27 0.00 0.00 60.65 58.84 1hr7 h LYS 201 Cb -0.09 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 31.69 1hr7 h LYS 201 CO -0.06 1.12 -2.32 0.09 -2.27 0.00 0.00 179.45 176.01 1hr7 n ASN 202 N -4.11 0.09 -4.58 4.20 3.02 -0.52 -4.79 115.26 108.58 1hr7 n ASN 202 Ca -0.03 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.12 1hr7 n ASN 202 Cb 0.54 1.10 -0.01 0.00 -0.61 0.00 0.00 39.78 40.80 1hr7 n ASN 202 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1hr7 s TYR 203 N -2.60 2.61 -0.04 3.10 1.51 -0.52 -4.88 117.35 116.53 1hr7 s TYR 203 Ca -0.10 -1.20 0.06 0.00 -1.01 0.00 0.00 57.07 54.83 1hr7 s TYR 203 Cb 0.07 -4.62 -0.02 0.00 -0.11 0.00 0.00 41.96 37.28 1hr7 s TYR 203 CO 0.82 -1.71 -0.21 0.15 -1.11 0.00 0.00 175.55 173.49 1hr7 s LYS 204 N 4.69 2.42 0.37 -0.62 -0.14 -1.26 -4.42 119.74 120.78 1hr7 s LYS 204 Ca 0.56 -0.84 0.15 0.00 -1.36 0.00 0.00 55.97 54.48 1hr7 s LYS 204 Cb 0.03 -2.21 1.01 0.00 -1.68 0.00 0.00 37.83 34.98 1hr7 s LYS 204 CO 0.08 0.51 1.76 0.78 -0.76 0.00 0.00 175.35 177.72 1hr7 h GLY 205 N 5.66 1.47 1.47 -3.33 0.00 -1.34 0.18 103.07 107.18 1hr7 h GLY 205 Ca -0.40 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1hr7 h GLY 205 CO 0.49 -0.16 0.00 2.09 0.00 0.00 0.00 176.54 178.95 1hr7 n ASP 206 N -4.72 0.00 -0.38 0.19 5.75 -1.17 -1.13 116.55 115.10 1hr7 n ASP 206 Ca 0.26 -0.13 0.07 0.00 -0.01 0.00 0.00 54.79 54.97 1hr7 n ASP 206 Cb 0.82 -0.24 0.15 0.00 -1.03 0.00 0.00 41.12 40.82 1hr7 n ASP 206 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1hr7 n ARG 207 N -1.24 2.30 -4.06 0.11 1.74 0.61 -4.42 116.66 111.71 1hr7 n ARG 207 Ca 0.11 -2.39 -0.09 0.00 -0.77 0.00 0.00 57.85 54.71 1hr7 n ARG 207 Cb 0.15 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 1hr7 n ARG 207 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hr7 s MET 208 N -2.27 0.53 -0.04 5.56 0.23 -1.06 -0.69 119.30 121.56 1hr7 s MET 208 Ca 0.28 -0.96 0.04 0.00 -1.03 0.00 0.00 55.69 54.02 1hr7 s MET 208 Cb 0.23 0.02 0.00 0.00 -1.53 0.00 0.00 34.83 33.55 1hr7 s MET 208 CO 0.06 -0.05 -0.14 0.08 -2.03 0.00 0.00 175.02 172.94 1hr7 s VAL 209 N -2.62 1.19 -0.32 5.16 1.01 0.22 -2.43 120.40 122.62 1hr7 s VAL 209 Ca -0.03 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 1hr7 s VAL 209 Cb -0.01 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1hr7 s VAL 209 CO -0.04 0.35 0.13 -0.22 0.00 0.00 0.00 175.10 175.31 1hr7 s LEU 210 N 0.15 4.11 -0.03 3.92 2.96 0.60 -0.39 118.68 130.00 1hr7 s LEU 210 Ca -0.05 -0.73 0.04 0.00 -0.22 0.00 0.00 54.13 53.18 1hr7 s LEU 210 Cb -0.11 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1hr7 s LEU 210 CO 0.02 -0.23 -0.15 0.00 -1.32 0.00 0.00 176.35 174.66 1hr7 s ALA 211 N 1.54 2.63 0.03 5.97 0.00 0.55 -1.50 121.76 130.98 1hr7 s ALA 211 Ca 0.03 -1.03 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 1hr7 s ALA 211 Cb -0.18 -0.91 -0.02 0.00 0.00 0.00 0.00 23.12 22.02 1hr7 s ALA 211 CO 0.04 0.56 0.04 0.20 0.00 0.00 0.00 175.76 176.60 1hr7 s GLY 212 N -0.87 0.23 0.03 0.00 0.00 -0.37 -0.84 107.32 105.51 1hr7 s GLY 212 Ca 0.12 -0.63 -0.19 0.00 0.00 0.00 0.00 44.72 44.02 1hr7 s GLY 212 CO 0.01 -0.74 0.42 0.00 0.00 0.00 0.00 173.10 172.79 1hr7 s ALA 213 N -2.33 -1.05 0.00 3.20 0.00 -0.90 -1.72 121.76 118.96 1hr7 s ALA 213 Ca -0.08 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.29 1hr7 s ALA 213 Cb -0.03 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1hr7 s ALA 213 CO -0.04 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.71 1hr7 n GLY 214 N 0.66 0.40 3.56 0.00 0.00 -0.92 -1.69 105.19 107.20 1hr7 n GLY 214 Ca -0.19 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.63 1hr7 n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hr7 n ALA 215 N -0.10 3.11 -3.39 4.61 0.00 -0.70 -1.68 120.51 122.36 1hr7 n ALA 215 Ca 0.00 -3.62 -0.22 0.00 0.00 0.00 0.00 53.44 49.61 1hr7 n ALA 215 Cb 0.00 -3.57 -0.16 0.00 0.00 0.00 0.00 19.45 15.72 1hr7 n ALA 215 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1hr7 s VAL 216 N 6.09 0.81 -0.42 0.00 1.01 -1.26 -4.77 120.40 121.86 1hr7 s VAL 216 Ca 0.58 -0.32 -0.20 0.00 0.00 0.00 0.00 61.98 62.05 1hr7 s VAL 216 Cb 0.03 -0.76 0.02 0.00 0.00 0.00 0.00 36.38 35.67 1hr7 s VAL 216 CO 0.09 0.27 0.58 -0.62 0.00 0.00 0.00 175.10 175.43 1hr7 s ASP 217 N 0.60 6.30 0.17 3.32 -1.08 -1.26 -4.65 116.67 120.07 1hr7 s ASP 217 Ca -0.10 -0.34 -0.16 0.00 -0.52 0.00 0.00 52.55 51.43 1hr7 s ASP 217 Cb -0.13 -2.29 0.12 0.00 -1.46 0.00 0.00 42.92 39.16 1hr7 s ASP 217 CO 0.02 -0.68 1.68 -0.74 0.52 0.00 0.00 175.17 175.96 1hr7 h HIS 218 N 8.76 -0.11 0.42 -5.34 -0.00 -1.99 -1.09 115.15 115.81 1hr7 h HIS 218 Ca -0.26 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.13 1hr7 h HIS 218 Cb 1.10 0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 28.62 1hr7 h HIS 218 CO 0.70 -0.13 -0.28 0.93 -0.00 0.00 0.00 177.93 179.16 1hr7 h GLU 219 N 0.06 -0.65 -0.80 5.26 3.07 -2.00 -1.79 114.58 117.73 1hr7 h GLU 219 Ca 0.21 0.04 0.09 0.00 -0.50 0.00 0.00 59.36 59.20 1hr7 h GLU 219 Cb 0.31 0.15 -0.07 0.00 -0.84 0.00 0.00 28.75 28.30 1hr7 h GLU 219 CO -0.39 -0.43 0.45 0.87 -1.40 0.00 0.00 179.01 178.11 1hr7 h LYS 220 N -0.67 0.76 -0.03 2.33 1.57 -1.95 -0.98 116.57 117.59 1hr7 h LYS 220 Ca -0.04 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1hr7 h LYS 220 Cb 0.56 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1hr7 h LYS 220 CO 0.04 0.50 -0.11 1.25 -0.57 0.00 0.00 179.45 180.56 1hr7 h LEU 221 N 0.78 0.05 -0.32 2.94 5.85 -0.97 -1.50 115.31 122.13 1hr7 h LEU 221 Ca 0.38 -0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.91 1hr7 h LEU 221 Cb 0.32 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 1hr7 h LEU 221 CO -0.23 0.16 -0.53 0.58 -0.34 0.00 0.00 178.44 178.08 1hr7 h VAL 222 N 0.05 1.28 0.38 1.05 2.07 -0.30 -1.22 116.25 119.56 1hr7 h VAL 222 Ca 0.01 -1.72 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 1hr7 h VAL 222 Cb 0.23 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1hr7 h VAL 222 CO 0.01 0.56 -0.18 1.56 0.02 0.00 0.00 177.57 179.54 1hr7 h GLN 223 N 0.67 -0.49 -0.41 1.57 4.20 -0.86 -1.06 115.11 118.72 1hr7 h GLN 223 Ca 0.02 0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.83 1hr7 h GLN 223 Cb 1.14 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 29.01 1hr7 h GLN 223 CO 0.12 -0.29 0.28 1.88 -0.67 0.00 0.00 178.83 180.15 1hr7 h TYR 224 N -0.58 0.29 0.15 2.96 0.05 -1.32 0.68 116.97 119.20 1hr7 h TYR 224 Ca -0.05 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 1hr7 h TYR 224 Cb 0.43 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.08 1hr7 h TYR 224 CO -0.03 0.15 -0.07 0.00 -1.05 0.00 0.00 178.16 177.15 1hr7 h ALA 225 N 1.78 -0.21 -0.37 3.88 0.00 -0.53 0.50 119.26 124.31 1hr7 h ALA 225 Ca 0.18 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1hr7 h ALA 225 Cb 0.37 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1hr7 h ALA 225 CO -0.04 -0.57 0.18 0.37 0.00 0.00 0.00 179.25 179.19 1hr7 h GLN 226 N -0.29 0.36 -0.17 0.00 5.75 0.08 0.57 115.11 121.41 1hr7 h GLN 226 Ca -0.02 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.47 1hr7 h GLN 226 Cb 0.23 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1hr7 h GLN 226 CO 0.03 0.24 0.06 -0.22 -2.65 0.00 0.00 178.83 176.29 1hr7 h LYS 227 N 0.37 0.14 0.00 1.69 3.64 -0.65 0.17 116.57 121.93 1hr7 h LYS 227 Ca 0.16 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1hr7 h LYS 227 Cb 0.07 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1hr7 h LYS 227 CO -0.12 0.09 -1.03 0.66 -2.27 0.00 0.00 179.45 176.79 1hr7 n TYR 228 N -5.05 0.14 -0.12 1.91 4.01 0.14 -4.43 117.16 113.76 1hr7 n TYR 228 Ca -0.03 0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1hr7 n TYR 228 Cb 0.07 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 38.79 1hr7 n TYR 228 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1hr7 n PHE 229 N -1.80 0.00 0.09 -0.72 3.72 0.20 -4.76 117.46 114.19 1hr7 n PHE 229 Ca 0.02 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.48 1hr7 n PHE 229 Cb 0.41 0.00 0.50 0.00 -0.94 0.00 0.00 39.48 39.44 1hr7 n PHE 229 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1hr7 h GLY 230 N 0.00 0.38 1.41 1.37 0.00 -0.53 -2.01 103.07 103.70 1hr7 h GLY 230 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1hr7 h GLY 230 CO 0.00 0.14 0.00 -2.39 0.00 0.00 0.00 176.54 174.29 1hr7 n HIS 231 N -4.50 0.00 -2.53 5.60 1.44 -1.26 -4.76 115.22 109.21 1hr7 n HIS 231 Ca 0.01 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.30 1hr7 n HIS 231 Cb 0.07 -0.21 -0.03 0.00 0.12 0.00 0.00 29.99 29.95 1hr7 n HIS 231 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1hr7 s VAL 232 N -2.41 4.31 0.22 0.61 1.01 -0.76 -4.98 120.40 118.40 1hr7 s VAL 232 Ca 0.11 1.68 -0.32 0.00 0.00 0.00 0.00 61.98 63.45 1hr7 s VAL 232 Cb 0.07 -4.08 -0.12 0.00 0.00 0.00 0.00 36.38 32.25 1hr7 s VAL 232 CO 0.14 0.14 1.68 -2.65 0.00 0.00 0.00 175.10 174.42 1hr7 n PRO 233 N 3.80 2.69 -2.24 2.72 -0.02 -1.26 -4.46 135.00 136.23 1hr7 n PRO 233 Ca 0.07 0.97 -0.32 0.00 -2.02 0.00 0.00 63.50 62.20 1hr7 n PRO 233 Cb 0.48 -2.79 -0.02 0.00 -0.02 0.00 0.00 33.50 31.15 1hr7 n PRO 233 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1hr7 s LYS 234 N 0.75 3.76 0.83 -0.52 2.20 -1.26 -1.48 119.74 124.01 1hr7 s LYS 234 Ca 0.73 0.97 -0.12 0.00 -0.36 0.00 0.00 55.97 57.20 1hr7 s LYS 234 Cb -0.52 -2.11 0.09 0.00 -1.51 0.00 0.00 37.83 33.78 1hr7 s LYS 234 CO 0.37 -0.43 1.12 -1.12 -0.36 0.00 0.00 175.35 174.92 1hr7 s SER 235 N -3.18 4.27 -0.01 1.43 0.01 -1.26 -4.87 113.70 110.09 1hr7 s SER 235 Ca 0.59 1.12 -0.24 0.00 1.31 0.00 0.00 55.95 58.74 1hr7 s SER 235 Cb -0.11 -1.79 -0.19 0.00 0.21 0.00 0.00 66.02 64.14 1hr7 s SER 235 CO 0.36 -2.09 1.23 -0.33 0.41 0.00 0.00 173.24 172.83 1hr7 h GLU 236 N -1.17 0.15 -2.53 12.44 4.39 -2.01 -3.35 114.58 122.50 1hr7 h GLU 236 Ca -0.48 -0.10 -0.65 0.00 0.34 0.00 0.00 59.36 58.47 1hr7 h GLU 236 Cb 1.29 0.01 -0.39 0.00 -0.10 0.00 0.00 28.75 29.57 1hr7 h GLU 236 CO 0.61 0.67 -0.27 0.43 -1.16 0.00 0.00 179.01 179.29 1hr7 n SER 237 N -4.68 4.26 -4.62 1.42 7.64 -1.26 -5.08 113.62 111.30 1hr7 n SER 237 Ca -0.08 -3.39 -0.40 0.00 1.01 0.00 0.00 58.87 56.01 1hr7 n SER 237 Cb 0.34 -0.83 0.03 0.00 -1.01 0.00 0.00 64.21 62.73 1hr7 n SER 237 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1hr7 n PRO 238 N 1.18 1.24 -3.84 1.43 -0.02 -1.26 -5.01 135.00 128.72 1hr7 n PRO 238 Ca 0.27 0.45 -0.13 0.00 -2.02 0.00 0.00 63.50 62.08 1hr7 n PRO 238 Cb 0.38 -2.11 -0.14 0.00 -0.02 0.00 0.00 33.50 31.61 1hr7 n PRO 238 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1hr7 s VAL 239 N -1.37 -0.01 0.38 -1.45 -7.23 -1.26 -5.10 120.40 104.35 1hr7 s VAL 239 Ca 0.67 0.05 -0.27 0.00 -1.81 0.00 0.00 61.98 60.63 1hr7 s VAL 239 Cb -0.50 -0.05 -0.11 0.00 0.56 0.00 0.00 36.38 36.29 1hr7 s VAL 239 CO 0.54 0.02 1.29 -2.65 -0.31 0.00 0.00 175.10 173.99 1hr7 n PRO 240 N 3.35 2.08 -0.17 4.82 -0.02 -1.26 -4.85 135.00 138.95 1hr7 n PRO 240 Ca -0.16 0.73 0.29 0.00 -2.02 0.00 0.00 63.50 62.34 1hr7 n PRO 240 Cb 0.58 -2.38 0.60 0.00 -0.02 0.00 0.00 33.50 32.28 1hr7 n PRO 240 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1hr7 h LEU 241 N 2.37 0.00 0.00 2.45 3.38 -1.89 -1.99 115.31 119.63 1hr7 h LEU 241 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1hr7 h LEU 241 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1hr7 h LEU 241 CO 0.61 0.00 -1.38 0.61 0.09 0.00 0.00 178.44 178.38 1hr7 n GLY 242 N -1.67 -1.06 3.76 0.83 0.00 -1.25 -4.24 105.19 101.57 1hr7 n GLY 242 Ca 0.20 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1hr7 n GLY 242 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hr7 s SER 243 N -3.82 5.45 -0.19 1.61 1.04 -0.75 -4.88 113.70 112.17 1hr7 s SER 243 Ca 0.01 2.48 -0.40 0.00 0.48 0.00 0.00 55.95 58.52 1hr7 s SER 243 Cb 0.15 -2.61 -0.17 0.00 0.10 0.00 0.00 66.02 63.49 1hr7 s SER 243 CO 0.87 -1.42 1.54 -0.81 0.98 0.00 0.00 173.24 174.40 1hr7 n PRO 244 N -1.15 0.84 -0.11 4.02 -0.04 -1.26 -4.90 135.00 132.40 1hr7 n PRO 244 Ca 0.11 0.31 -0.06 0.00 -0.04 0.00 0.00 63.50 63.82 1hr7 n PRO 244 Cb 0.48 -1.93 0.02 0.00 -0.04 0.00 0.00 33.50 32.03 1hr7 n PRO 244 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1hr7 h ARG 245 N 5.70 0.30 0.00 0.54 9.65 -1.98 -3.48 114.38 125.10 1hr7 h ARG 245 Ca -0.47 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 1hr7 h ARG 245 Cb 1.34 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.86 1hr7 h ARG 245 CO 0.88 0.20 0.00 0.41 2.80 0.00 0.00 179.97 184.26 1hr7 n GLY 246 N -1.22 -0.60 3.72 2.80 0.00 -1.26 -5.12 105.19 103.51 1hr7 n GLY 246 Ca 0.02 0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 1hr7 n GLY 246 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1hr7 s PRO 247 N -0.02 4.33 0.30 1.61 0.02 -1.26 -4.96 135.00 135.02 1hr7 s PRO 247 Ca 0.00 2.10 -0.30 0.00 0.02 0.00 0.00 61.00 62.82 1hr7 s PRO 247 Cb 0.00 -3.22 -0.11 0.00 0.02 0.00 0.00 34.50 31.19 1hr7 s PRO 247 CO 0.00 -0.40 1.51 -0.51 -0.33 0.00 0.00 177.00 177.27 1hr7 s LEU 248 N 0.74 4.36 0.80 -5.54 1.02 -1.26 -4.97 118.68 113.82 1hr7 s LEU 248 Ca 0.63 2.87 -0.14 0.00 0.02 0.00 0.00 54.13 57.51 1hr7 s LEU 248 Cb -0.37 -3.64 0.06 0.00 0.02 0.00 0.00 46.19 42.25 1hr7 s LEU 248 CO 0.33 -0.82 1.04 -2.65 0.02 0.00 0.00 176.35 174.27 1hr7 n PRO 249 N 1.82 0.20 -4.84 1.29 -0.02 -1.26 -5.02 135.00 127.17 1hr7 n PRO 249 Ca 0.06 0.14 -0.27 0.00 -2.02 0.00 0.00 63.50 61.40 1hr7 n PRO 249 Cb 0.39 -2.30 -0.17 0.00 -0.02 0.00 0.00 33.50 31.40 1hr7 n PRO 249 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1hr7 s VAL 250 N -2.08 1.50 -0.22 -1.45 0.11 -1.26 -5.02 120.40 111.98 1hr7 s VAL 250 Ca 0.71 -0.70 -0.29 0.00 -2.93 0.00 0.00 61.98 58.78 1hr7 s VAL 250 Cb -0.30 -1.33 0.00 0.00 -1.53 0.00 0.00 36.38 33.23 1hr7 s VAL 250 CO 0.53 0.44 1.13 0.12 -3.33 0.00 0.00 175.10 173.98 1hr7 s PHE 251 N 0.49 3.13 -0.18 1.54 2.19 -1.26 -4.55 117.98 119.34 1hr7 s PHE 251 Ca -0.15 1.27 -0.05 0.00 0.33 0.00 0.00 56.93 58.32 1hr7 s PHE 251 Cb -0.16 -3.41 -0.03 0.00 -1.31 0.00 0.00 43.02 38.10 1hr7 s PHE 251 CO 0.06 -0.97 0.00 0.00 1.83 0.00 0.00 175.22 176.14 1hr7 s ARG 253 N 0.64 4.59 0.01 0.00 1.70 -1.26 -4.27 118.95 120.36 1hr7 s ARG 253 Ca -0.00 1.61 -0.29 0.00 -0.47 0.00 0.00 55.73 56.58 1hr7 s ARG 253 Cb -0.14 -3.03 0.11 0.00 -0.57 0.00 0.00 34.95 31.32 1hr7 s ARG 253 CO 0.02 0.22 1.18 0.20 -1.08 0.00 0.00 175.30 175.85 1hr7 s GLY 254 N -1.18 -0.36 -0.01 3.88 0.00 -1.22 -4.97 107.32 103.45 1hr7 s GLY 254 Ca 0.47 0.63 -0.05 0.00 0.00 0.00 0.00 44.72 45.77 1hr7 s GLY 254 CO 0.34 0.13 0.12 -1.83 0.00 0.00 0.00 173.10 171.86 1hr7 s GLU 255 N -2.67 0.34 -0.12 2.90 -1.05 -1.26 -0.01 118.70 116.83 1hr7 s GLU 255 Ca 0.13 -0.21 -0.03 0.00 -0.15 0.00 0.00 54.97 54.70 1hr7 s GLU 255 Cb 0.03 0.14 0.05 0.00 -0.44 0.00 0.00 34.13 33.91 1hr7 s GLU 255 CO -0.02 -0.07 0.07 0.50 0.95 0.00 0.00 175.26 176.68 1hr7 s ARG 256 N -0.86 0.10 -0.27 -4.83 3.52 -0.47 -4.97 118.95 111.17 1hr7 s ARG 256 Ca -0.09 0.07 -0.10 0.00 -0.13 0.00 0.00 55.73 55.47 1hr7 s ARG 256 Cb -0.05 -1.32 -0.04 0.00 -1.56 0.00 0.00 34.95 31.97 1hr7 s ARG 256 CO 0.01 -0.52 0.16 -0.06 -0.81 0.00 0.00 175.30 174.08 1hr7 s PHE 257 N 2.11 3.19 -0.62 5.12 0.08 -1.26 -1.59 117.98 125.02 1hr7 s PHE 257 Ca 0.03 -0.01 -0.04 0.00 0.12 0.00 0.00 56.93 57.03 1hr7 s PHE 257 Cb -0.14 -2.34 0.16 0.00 -0.57 0.00 0.00 43.02 40.12 1hr7 s PHE 257 CO -0.06 -0.20 0.44 0.42 -0.10 0.00 0.00 175.22 175.72 1hr7 s ILE 258 N 1.71 3.84 0.19 0.64 1.01 0.53 -4.98 121.20 124.14 1hr7 s ILE 258 Ca 0.07 -2.82 -0.31 0.00 0.00 0.00 0.00 60.65 57.58 1hr7 s ILE 258 Cb -0.16 -3.50 -0.11 0.00 0.01 0.00 0.00 42.46 38.71 1hr7 s ILE 258 CO 0.09 -0.87 1.59 -0.75 0.00 0.00 0.00 174.94 175.00 1hr7 s LYS 259 N 0.08 4.20 -0.45 2.79 2.20 -1.26 -2.30 119.74 125.00 1hr7 s LYS 259 Ca 0.16 2.42 0.06 0.00 -0.36 0.00 0.00 55.97 58.25 1hr7 s LYS 259 Cb -0.20 -3.13 0.18 0.00 -1.51 0.00 0.00 37.83 33.17 1hr7 s LYS 259 CO -0.04 -0.62 0.60 -2.00 -0.36 0.00 0.00 175.35 172.93 1hr7 s GLU 260 N 0.96 0.91 0.00 4.03 2.56 -0.78 -4.84 118.70 121.54 1hr7 s GLU 260 Ca 0.70 -0.92 0.08 0.00 0.00 0.00 0.00 54.97 54.84 1hr7 s GLU 260 Cb -0.45 -0.27 0.50 0.00 2.00 0.00 0.00 34.13 35.91 1hr7 s GLU 260 CO 0.33 -1.27 1.01 0.09 -0.56 0.00 0.00 175.26 174.86 1hr7 n ASN 261 N 3.58 0.00 0.01 -1.70 3.02 -1.26 -2.88 115.26 116.02 1hr7 n ASN 261 Ca 0.16 -0.94 0.11 0.00 -0.03 0.00 0.00 54.58 53.88 1hr7 n ASN 261 Cb 0.54 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.65 1hr7 n ASN 261 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1hr7 n THR 262 N -0.72 0.07 -2.61 3.41 -2.24 -1.26 -4.94 114.28 106.00 1hr7 n THR 262 Ca 0.06 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 1hr7 n THR 262 Cb 0.03 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 68.67 1hr7 n THR 262 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1hr7 s LEU 263 N -3.70 4.39 0.27 3.22 1.43 -1.14 -4.95 118.68 118.20 1hr7 s LEU 263 Ca 0.03 1.82 -0.00 0.00 -1.03 0.00 0.00 54.13 54.95 1hr7 s LEU 263 Cb 0.15 -3.58 0.37 0.00 0.03 0.00 0.00 46.19 43.16 1hr7 s LEU 263 CO 0.84 -0.30 1.74 -0.65 0.23 0.00 0.00 176.35 178.21 1hr7 h PRO 264 N 6.54 0.65 -6.52 1.29 0.11 -1.92 -3.43 132.00 128.71 1hr7 h PRO 264 Ca -0.42 -0.21 -0.64 0.00 0.11 0.00 0.00 66.00 64.85 1hr7 h PRO 264 Cb 1.22 -0.06 -0.15 0.00 0.11 0.00 0.00 31.00 32.11 1hr7 h PRO 264 CO 0.76 0.75 -0.75 0.95 -0.21 0.00 0.00 178.00 179.51 1hr7 s THR 265 N -4.75 3.12 -0.06 -1.15 -4.23 -1.26 -0.38 115.64 106.92 1hr7 s THR 265 Ca -0.08 -1.58 0.03 0.00 -1.18 0.00 0.00 61.69 58.87 1hr7 s THR 265 Cb 0.14 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.45 1hr7 s THR 265 CO 0.80 -0.03 -0.12 -0.89 -0.54 0.00 0.00 174.62 173.84 1hr7 s THR 266 N -1.51 3.23 -0.14 3.99 2.01 0.11 -4.69 115.64 118.65 1hr7 s THR 266 Ca 0.23 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.60 1hr7 s THR 266 Cb -0.09 -2.29 0.01 0.00 0.01 0.00 0.00 72.50 70.14 1hr7 s THR 266 CO 0.14 0.59 -0.21 -1.00 -0.69 0.00 0.00 174.62 173.45 1hr7 s HIS 267 N -0.66 2.55 -0.04 4.92 3.76 0.13 -0.33 115.29 125.61 1hr7 s HIS 267 Ca 0.10 -1.29 0.04 0.00 -0.15 0.00 0.00 55.06 53.76 1hr7 s HIS 267 Cb -0.11 -1.75 -0.00 0.00 1.11 0.00 0.00 32.58 31.83 1hr7 s HIS 267 CO 0.01 -0.60 -0.16 0.42 -0.85 0.00 0.00 174.74 173.56 1hr7 s ILE 268 N 0.88 1.36 -0.09 0.60 1.09 0.89 -0.52 121.20 125.40 1hr7 s ILE 268 Ca -0.06 -0.68 0.02 0.00 -1.10 0.00 0.00 60.65 58.83 1hr7 s ILE 268 Cb -0.15 -1.17 0.01 0.00 -1.06 0.00 0.00 42.46 40.09 1hr7 s ILE 268 CO -0.03 0.39 -0.16 0.00 -0.10 0.00 0.00 174.94 175.04 1hr7 s ALA 269 N 0.00 1.66 -0.12 9.38 0.00 -0.33 0.60 121.76 132.96 1hr7 s ALA 269 Ca -0.03 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.28 1hr7 s ALA 269 Cb -0.11 -0.74 0.01 0.00 0.00 0.00 0.00 23.12 22.29 1hr7 s ALA 269 CO 0.02 0.08 -0.20 0.42 0.00 0.00 0.00 175.76 176.08 1hr7 s ILE 270 N 0.71 1.83 0.06 0.00 1.01 -0.30 -1.67 121.20 122.84 1hr7 s ILE 270 Ca -0.12 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.67 1hr7 s ILE 270 Cb -0.16 -1.62 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 1hr7 s ILE 270 CO 0.03 0.51 -0.04 0.00 0.00 0.00 0.00 174.94 175.43 1hr7 s ALA 271 N 0.75 0.56 0.13 9.38 0.00 -0.70 -1.02 121.76 130.86 1hr7 s ALA 271 Ca -0.10 -1.12 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1hr7 s ALA 271 Cb -0.16 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 1hr7 s ALA 271 CO 0.01 -0.29 -0.04 -0.51 0.00 0.00 0.00 175.76 174.93 1hr7 s LEU 272 N -2.65 2.35 0.14 0.00 1.02 -0.60 -1.30 118.68 117.64 1hr7 s LEU 272 Ca 0.04 -1.07 -0.33 0.00 0.02 0.00 0.00 54.13 52.78 1hr7 s LEU 272 Cb 0.04 -0.07 -0.13 0.00 0.02 0.00 0.00 46.19 46.05 1hr7 s LEU 272 CO -0.07 -0.50 1.66 1.21 0.02 0.00 0.00 176.35 178.67 1hr7 n GLU 273 N -0.12 2.33 0.00 1.70 2.13 -1.26 -2.32 120.64 123.09 1hr7 n GLU 273 Ca -0.10 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.56 1hr7 n GLU 273 Cb 0.62 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.68 1hr7 n GLU 273 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hr7 n GLY 274 N 3.68 0.73 3.02 8.31 0.00 0.35 -4.70 105.19 116.58 1hr7 n GLY 274 Ca 0.17 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1hr7 n GLY 274 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hr7 s VAL 275 N 3.44 0.49 0.62 1.61 0.11 -1.26 -4.56 120.40 120.85 1hr7 s VAL 275 Ca 0.00 -0.70 -0.03 0.00 -2.93 0.00 0.00 61.98 58.32 1hr7 s VAL 275 Cb 0.00 -0.50 0.04 0.00 -1.53 0.00 0.00 36.38 34.40 1hr7 s VAL 275 CO 0.00 -0.16 0.89 -0.94 -3.33 0.00 0.00 175.10 171.56 1hr7 s SER 276 N -0.94 5.08 0.42 3.54 1.04 -1.25 -3.69 113.70 117.91 1hr7 s SER 276 Ca -0.05 0.25 0.12 0.00 0.48 0.00 0.00 55.95 56.75 1hr7 s SER 276 Cb -0.06 -1.04 0.96 0.00 0.10 0.00 0.00 66.02 65.98 1hr7 s SER 276 CO 0.00 -1.35 1.99 -0.50 0.98 0.00 0.00 173.24 174.36 1hr7 h TRP 277 N -0.25 0.50 -0.14 5.02 4.06 -1.42 -2.48 115.95 121.23 1hr7 h TRP 277 Ca -0.43 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.53 1hr7 h TRP 277 Cb 1.30 -0.16 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 1hr7 h TRP 277 CO 0.36 0.25 0.00 -1.13 -3.56 0.00 0.00 178.44 174.36 1hr7 n SER 278 N -4.47 2.96 -4.67 -3.49 3.41 -1.26 -4.92 113.62 101.17 1hr7 n SER 278 Ca 0.09 -1.94 -0.43 0.00 -0.26 0.00 0.00 58.87 56.33 1hr7 n SER 278 Cb 0.31 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.17 1hr7 n SER 278 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hr7 n ALA 279 N 1.25 0.94 0.24 7.33 0.00 -0.93 -4.84 120.51 124.50 1hr7 n ALA 279 Ca 0.16 0.37 0.09 0.00 0.00 0.00 0.00 53.44 54.06 1hr7 n ALA 279 Cb 0.57 -2.20 0.60 0.00 0.00 0.00 0.00 19.45 18.42 1hr7 n ALA 279 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1hr7 h PRO 280 N 2.40 0.00 -0.58 0.00 0.11 -1.93 -2.25 132.00 129.76 1hr7 h PRO 280 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1hr7 h PRO 280 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1hr7 h PRO 280 CO 0.62 0.19 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 1hr7 n ASP 281 N -3.80 3.15 -0.29 -2.05 5.75 -1.26 -4.64 116.55 113.41 1hr7 n ASP 281 Ca -0.02 -2.04 -0.04 0.00 -0.01 0.00 0.00 54.79 52.68 1hr7 n ASP 281 Cb 0.29 -0.40 0.01 0.00 -1.03 0.00 0.00 41.12 39.99 1hr7 n ASP 281 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 1hr7 h TYR 282 N 3.34 -1.10 -0.15 2.11 3.20 -1.69 -0.85 116.97 121.83 1hr7 h TYR 282 Ca 0.00 0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.84 1hr7 h TYR 282 Cb 0.81 0.59 -0.01 0.00 1.54 0.00 0.00 36.73 39.66 1hr7 h TYR 282 CO 0.41 -0.40 -0.42 0.74 -1.64 0.00 0.00 178.16 176.85 1hr7 h PHE 283 N -0.10 0.41 -0.15 -3.82 0.04 -1.85 -2.49 116.94 108.99 1hr7 h PHE 283 Ca 0.27 -0.12 -0.05 0.00 2.80 0.00 0.00 57.97 60.87 1hr7 h PHE 283 Cb 0.57 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.61 1hr7 h PHE 283 CO -0.77 0.71 -0.14 0.28 -0.60 0.00 0.00 178.31 177.80 1hr7 h VAL 284 N 0.29 1.18 -0.35 -0.55 2.07 -1.57 0.21 116.25 117.54 1hr7 h VAL 284 Ca 0.03 -0.81 -0.10 0.00 0.82 0.00 0.00 66.70 66.64 1hr7 h VAL 284 Cb 0.86 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 1hr7 h VAL 284 CO 0.07 0.25 -0.16 0.00 0.02 0.00 0.00 177.57 177.75 1hr7 h ALA 285 N 1.64 0.49 -0.20 1.67 0.00 -0.81 -1.45 119.26 120.60 1hr7 h ALA 285 Ca 0.05 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1hr7 h ALA 285 Cb 0.39 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1hr7 h ALA 285 CO 0.02 0.41 -0.36 -0.07 0.00 0.00 0.00 179.25 179.25 1hr7 h LEU 286 N 0.51 0.46 -0.76 0.00 3.38 -0.98 -1.83 115.31 116.09 1hr7 h LEU 286 Ca 0.08 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1hr7 h LEU 286 Cb 0.69 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1hr7 h LEU 286 CO 0.05 0.78 0.06 0.00 0.09 0.00 0.00 178.44 179.41 1hr7 h ALA 287 N 1.25 0.97 -0.09 1.53 0.00 -0.75 -1.64 119.26 120.53 1hr7 h ALA 287 Ca 0.04 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.54 1hr7 h ALA 287 Cb 0.80 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1hr7 h ALA 287 CO 0.06 0.64 -0.55 1.15 0.00 0.00 0.00 179.25 180.55 1hr7 h THR 288 N 0.93 1.36 -0.67 0.00 2.02 -1.00 -1.55 112.91 114.01 1hr7 h THR 288 Ca 0.18 -1.85 -0.04 0.00 0.77 0.00 0.00 66.41 65.46 1hr7 h THR 288 Cb 0.46 1.90 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 1hr7 h THR 288 CO 0.02 0.55 0.26 -0.61 0.37 0.00 0.00 175.52 176.11 1hr7 h GLN 289 N 0.21 1.01 -0.02 6.66 4.15 -0.82 -2.62 115.11 123.67 1hr7 h GLN 289 Ca 0.00 -0.19 -0.10 0.00 0.77 0.00 0.00 58.65 59.13 1hr7 h GLN 289 Cb 1.03 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 1hr7 h GLN 289 CO 0.09 0.85 -0.46 0.00 -1.93 0.00 0.00 178.83 177.37 1hr7 h ALA 290 N 1.11 1.20 -0.06 3.38 0.00 -1.06 0.41 119.26 124.25 1hr7 h ALA 290 Ca 0.22 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1hr7 h ALA 290 Cb 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1hr7 h ALA 290 CO -0.02 0.59 -0.39 0.82 0.00 0.00 0.00 179.25 180.25 1hr7 h ILE 291 N 0.04 1.30 0.17 0.00 2.04 -0.91 -2.97 117.51 117.16 1hr7 h ILE 291 Ca -0.00 -1.43 -0.25 0.00 1.00 0.00 0.00 64.86 64.18 1hr7 h ILE 291 Cb 0.83 1.69 0.02 0.00 -0.74 0.00 0.00 36.82 38.62 1hr7 h ILE 291 CO 0.06 0.42 -1.12 0.58 0.00 0.00 0.00 178.15 178.09 1hr7 h VAL 292 N 0.11 1.35 -0.71 1.67 2.07 -1.31 -3.49 116.25 115.94 1hr7 h VAL 292 Ca 0.01 -2.55 0.00 0.00 0.82 0.00 0.00 66.70 64.98 1hr7 h VAL 292 Cb 0.75 3.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.58 1hr7 h VAL 292 CO 0.06 0.74 0.00 0.61 0.02 0.00 0.00 177.57 179.00 1hr7 n GLY 293 N 1.70 0.54 3.60 2.17 0.00 0.11 -4.95 105.19 108.36 1hr7 n GLY 293 Ca -0.17 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.69 1hr7 n GLY 293 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hr7 s ASN 294 N -4.00 3.47 -0.23 1.61 0.01 -1.26 -3.15 114.94 111.39 1hr7 s ASN 294 Ca 0.00 -1.44 -0.26 0.00 -0.71 0.00 0.00 52.86 50.44 1hr7 s ASN 294 Cb 0.00 -0.09 0.07 0.00 0.41 0.00 0.00 41.25 41.64 1hr7 s ASN 294 CO 0.00 -0.60 0.74 0.86 -1.51 0.00 0.00 177.10 176.59 1hr7 s TRP 295 N -2.92 -0.74 -0.05 2.20 -0.00 -0.50 -4.48 118.94 112.44 1hr7 s TRP 295 Ca 0.29 1.71 0.01 0.00 -0.00 0.00 0.00 56.10 58.12 1hr7 s TRP 295 Cb 0.08 0.30 0.02 0.00 -0.00 0.00 0.00 33.47 33.87 1hr7 s TRP 295 CO 0.14 -0.41 -0.05 0.34 -0.00 0.00 0.00 176.95 176.97 1hr7 s ASP 296 N 0.05 1.04 0.39 5.86 -1.08 -0.49 -1.00 116.67 121.45 1hr7 s ASP 296 Ca -0.02 -0.15 0.20 0.00 -0.52 0.00 0.00 52.55 52.07 1hr7 s ASP 296 Cb -0.04 -0.49 1.18 0.00 -1.46 0.00 0.00 42.92 42.11 1hr7 s ASP 296 CO 0.02 -0.05 1.71 -0.09 0.52 0.00 0.00 175.17 177.28 1hr7 h ARG 297 N 7.17 0.30 0.06 4.34 2.43 -1.28 0.24 114.38 127.63 1hr7 h ARG 297 Ca -0.37 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 58.51 1hr7 h ARG 297 Cb 1.16 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 1hr7 h ARG 297 CO 0.47 0.20 -1.44 0.00 -1.51 0.00 0.00 179.97 177.68 1hr7 h ALA 298 N 1.66 0.28 0.00 2.80 0.00 -1.97 -3.42 119.26 118.62 1hr7 h ALA 298 Ca 0.69 -1.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.24 1hr7 h ALA 298 Cb 1.82 0.65 -0.03 0.00 0.00 0.00 0.00 17.79 20.23 1hr7 h ALA 298 CO -0.40 0.87 -1.05 0.82 0.00 0.00 0.00 179.25 179.48 1hr7 h ILE 299 N -0.56 0.77 0.00 0.00 1.08 -1.89 -3.51 117.51 113.40 1hr7 h ILE 299 Ca -0.35 -2.25 0.00 0.00 -0.39 0.00 0.00 64.86 61.88 1hr7 h ILE 299 Cb 1.59 2.27 0.00 0.00 -3.07 0.00 0.00 36.82 37.61 1hr7 h ILE 299 CO -0.06 0.44 0.00 0.61 -0.69 0.00 0.00 178.15 178.44 1hr7 n GLY 300 N 1.34 0.03 0.00 5.37 0.00 0.81 -4.50 105.19 108.23 1hr7 n GLY 300 Ca -0.05 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.36 1hr7 n GLY 300 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hr7 n THR 301 N 0.00 0.00 -0.73 2.61 -2.24 -1.26 -1.40 114.28 111.26 1hr7 n THR 301 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1hr7 n THR 301 Cb 0.00 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1hr7 n THR 301 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hr7 n GLY 302 N 1.42 0.66 3.33 3.38 0.00 -1.26 -4.70 105.19 108.02 1hr7 n GLY 302 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1hr7 n GLY 302 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hr7 s THR 303 N -2.18 1.85 0.30 2.61 2.01 -1.26 -5.04 115.64 113.92 1hr7 s THR 303 Ca 0.00 -1.87 0.09 0.00 0.31 0.00 0.00 61.69 60.23 1hr7 s THR 303 Cb 0.00 -1.82 0.02 0.00 0.01 0.00 0.00 72.50 70.70 1hr7 s THR 303 CO 0.00 -0.26 1.68 -1.13 -0.69 0.00 0.00 174.62 174.22 1hr7 h ASN 304 N 3.38 0.09 -3.29 3.53 -0.73 -2.04 -3.41 115.58 113.10 1hr7 h ASN 304 Ca -0.43 -0.04 -0.53 0.00 1.87 0.00 0.00 56.30 57.16 1hr7 h ASN 304 Cb 1.20 -0.03 -0.38 0.00 0.27 0.00 0.00 38.32 39.39 1hr7 h ASN 304 CO 0.49 0.58 -0.79 -0.44 -0.37 0.00 0.00 177.43 176.90 1hr7 s SER 305 N -6.88 2.62 0.51 1.15 0.01 -1.26 -5.13 113.70 104.71 1hr7 s SER 305 Ca -0.03 -0.57 -0.21 0.00 1.31 0.00 0.00 55.95 56.46 1hr7 s SER 305 Cb 0.13 -0.83 -0.07 0.00 0.21 0.00 0.00 66.02 65.47 1hr7 s SER 305 CO 0.76 -0.19 1.13 -2.84 0.41 0.00 0.00 173.24 172.51 1hr7 s PRO 306 N 1.70 3.54 0.79 12.44 0.02 -1.26 -5.06 135.00 147.17 1hr7 s PRO 306 Ca 0.02 1.64 -0.12 0.00 0.02 0.00 0.00 61.00 62.56 1hr7 s PRO 306 Cb -0.15 -2.15 0.06 0.00 0.02 0.00 0.00 34.50 32.29 1hr7 s PRO 306 CO -0.08 -0.70 1.11 -1.54 -0.33 0.00 0.00 177.00 175.46 1hr7 s SER 307 N -1.66 4.63 0.48 2.53 1.04 -1.26 -4.82 113.70 114.64 1hr7 s SER 307 Ca 0.69 1.19 0.17 0.00 0.48 0.00 0.00 55.95 58.48 1hr7 s SER 307 Cb -0.25 -1.91 1.17 0.00 0.10 0.00 0.00 66.02 65.14 1hr7 s SER 307 CO 0.29 -1.87 2.04 -0.65 0.98 0.00 0.00 173.24 174.03 1hr7 h PRO 308 N -1.02 0.20 -0.10 4.02 0.11 -1.99 -1.15 132.00 132.07 1hr7 h PRO 308 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1hr7 h PRO 308 Cb 1.28 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1hr7 h PRO 308 CO 0.61 0.13 0.01 1.25 -0.21 0.00 0.00 178.00 179.80 1hr7 h LEU 309 N 0.21 0.17 -1.01 2.35 5.85 -1.91 -1.14 115.31 119.82 1hr7 h LEU 309 Ca 0.18 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1hr7 h LEU 309 Cb 0.45 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1hr7 h LEU 309 CO -0.03 0.39 0.61 0.00 -0.34 0.00 0.00 178.44 179.07 1hr7 h ALA 310 N 0.78 1.27 -0.11 1.25 0.00 -1.67 -0.47 119.26 120.30 1hr7 h ALA 310 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1hr7 h ALA 310 Cb 0.30 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1hr7 h ALA 310 CO 0.00 0.65 0.03 0.28 0.00 0.00 0.00 179.25 180.22 1hr7 h VAL 311 N 1.31 1.18 -0.20 0.00 2.07 -1.14 -2.45 116.25 117.03 1hr7 h VAL 311 Ca 0.35 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1hr7 h VAL 311 Cb -0.11 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1hr7 h VAL 311 CO -0.07 0.16 0.12 0.00 0.02 0.00 0.00 177.57 177.80 1hr7 h ALA 312 N 0.85 0.25 -0.91 1.67 0.00 -0.88 -2.01 119.26 118.22 1hr7 h ALA 312 Ca 0.04 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1hr7 h ALA 312 Cb 0.22 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 1hr7 h ALA 312 CO -0.00 -0.26 0.58 0.00 0.00 0.00 0.00 179.25 179.57 1hr7 h ALA 313 N 1.05 1.82 0.00 0.00 0.00 -1.02 -0.41 119.26 120.70 1hr7 h ALA 313 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1hr7 h ALA 313 Cb -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1hr7 h ALA 313 CO -0.01 -0.07 -0.30 -1.13 0.00 0.00 0.00 179.25 177.74 1hr7 n SER 314 N -4.58 0.57 -4.85 0.00 3.41 -0.93 -0.85 113.62 106.38 1hr7 n SER 314 Ca 0.18 0.27 -0.30 0.00 -0.26 0.00 0.00 58.87 58.76 1hr7 n SER 314 Cb 0.48 -0.24 0.06 0.00 -0.26 0.00 0.00 64.21 64.25 1hr7 n SER 314 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1hr7 s GLN 315 N -3.09 2.73 -0.39 4.33 -0.21 -0.16 -3.82 119.66 119.05 1hr7 s GLN 315 Ca 0.10 0.61 -0.01 0.00 0.02 0.00 0.00 55.36 56.07 1hr7 s GLN 315 Cb 0.15 -1.99 0.00 0.00 1.00 0.00 0.00 33.01 32.17 1hr7 s GLN 315 CO 0.64 -1.16 0.27 0.27 -2.12 0.00 0.00 175.29 173.20 1hr7 n ASN 316 N -3.12 -2.13 0.00 5.90 6.94 -1.26 -1.10 115.26 120.49 1hr7 n ASN 316 Ca 0.07 -0.46 0.00 0.00 -0.02 0.00 0.00 54.58 54.17 1hr7 n ASN 316 Cb 0.56 -0.72 0.00 0.00 -2.36 0.00 0.00 39.78 37.26 1hr7 n ASN 316 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1hr7 n GLY 317 N -1.06 3.04 0.00 4.83 0.00 -1.26 -4.82 105.19 105.92 1hr7 n GLY 317 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1hr7 n GLY 317 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1hr7 n SER 318 N 0.20 -0.03 -0.12 1.61 3.41 -0.26 -4.95 113.62 113.47 1hr7 n SER 318 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 1hr7 n SER 318 Cb 0.00 0.07 -0.08 0.00 -0.26 0.00 0.00 64.21 63.94 1hr7 n SER 318 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1hr7 n LEU 319 N -0.09 1.16 -3.89 1.04 4.77 -0.03 -4.96 117.00 115.00 1hr7 n LEU 319 Ca 0.00 -0.57 -0.02 0.00 -0.03 0.00 0.00 56.01 55.39 1hr7 n LEU 319 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1hr7 n LEU 319 CO 0.00 0.26 0.88 0.00 -1.33 0.00 0.00 177.39 177.19 1hr7 s ALA 320 N -2.62 -1.79 -0.08 -1.18 0.00 -1.26 -4.51 121.76 110.32 1hr7 s ALA 320 Ca 0.10 -0.22 0.14 0.00 0.00 0.00 0.00 51.96 51.98 1hr7 s ALA 320 Cb 0.15 0.77 -0.21 0.00 0.00 0.00 0.00 23.12 23.83 1hr7 s ALA 320 CO 0.69 -1.08 0.63 0.09 0.00 0.00 0.00 175.76 176.09 1hr7 n ASN 321 N -1.15 0.76 -3.64 0.00 4.13 0.15 -4.72 115.26 110.79 1hr7 n ASN 321 Ca -0.02 0.36 -0.02 0.00 1.68 0.00 0.00 54.58 56.58 1hr7 n ASN 321 Cb 0.59 0.14 -0.02 0.00 -1.54 0.00 0.00 39.78 38.95 1hr7 n ASN 321 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1hr7 s SER 322 N -5.93 -0.01 0.02 6.41 1.04 -0.98 -0.86 113.70 113.40 1hr7 s SER 322 Ca -0.05 -0.00 -0.03 0.00 0.48 0.00 0.00 55.95 56.35 1hr7 s SER 322 Cb 0.08 0.01 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 1hr7 s SER 322 CO 0.82 -0.02 0.04 -0.72 0.98 0.00 0.00 173.24 174.34 1hr7 s TYR 323 N -2.03 0.21 -0.11 5.02 -0.85 -0.17 -1.54 117.35 117.89 1hr7 s TYR 323 Ca 0.12 -0.47 -0.04 0.00 -0.52 0.00 0.00 57.07 56.16 1hr7 s TYR 323 Cb -0.01 -0.16 0.05 0.00 0.38 0.00 0.00 41.96 42.22 1hr7 s TYR 323 CO -0.02 -0.27 0.22 1.41 -1.52 0.00 0.00 175.55 175.37 1hr7 s MET 324 N -1.87 0.11 0.37 -3.49 1.75 0.34 -1.42 119.30 115.09 1hr7 s MET 324 Ca -0.12 0.63 -0.25 0.00 -1.25 0.00 0.00 55.69 54.70 1hr7 s MET 324 Cb -0.06 -0.14 -0.09 0.00 2.84 0.00 0.00 34.83 37.37 1hr7 s MET 324 CO -0.02 -0.27 1.02 -1.12 -0.65 0.00 0.00 175.02 173.98 1hr7 s SER 325 N 2.12 6.95 0.05 1.11 0.01 -1.19 -0.60 113.70 122.17 1hr7 s SER 325 Ca -0.00 1.98 -0.03 0.00 1.31 0.00 0.00 55.95 59.21 1hr7 s SER 325 Cb -0.12 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 1hr7 s SER 325 CO -0.07 -0.35 0.03 0.72 0.41 0.00 0.00 173.24 173.98 1hr7 s PHE 326 N -1.64 0.38 -0.19 2.43 -0.12 -0.14 -4.92 117.98 113.78 1hr7 s PHE 326 Ca 0.55 -0.85 -0.05 0.00 -0.05 0.00 0.00 56.93 56.53 1hr7 s PHE 326 Cb -0.21 -0.27 0.09 0.00 -0.63 0.00 0.00 43.02 42.00 1hr7 s PHE 326 CO 0.27 -0.40 0.36 0.45 -0.05 0.00 0.00 175.22 175.84 1hr7 s SER 327 N -2.70 0.10 -0.07 1.98 0.15 -1.26 -0.98 113.70 110.92 1hr7 s SER 327 Ca 0.03 0.67 0.03 0.00 0.70 0.00 0.00 55.95 57.38 1hr7 s SER 327 Cb 0.05 1.07 -0.02 0.00 -1.71 0.00 0.00 66.02 65.41 1hr7 s SER 327 CO -0.09 -0.25 -0.15 -0.89 1.20 0.00 0.00 173.24 173.06 1hr7 s THR 328 N 2.53 3.01 0.17 6.45 2.01 0.26 -4.98 115.64 125.09 1hr7 s THR 328 Ca 0.02 -0.72 0.10 0.00 0.31 0.00 0.00 61.69 61.40 1hr7 s THR 328 Cb -0.13 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.14 1hr7 s THR 328 CO -0.12 0.57 -0.21 -0.44 -0.69 0.00 0.00 174.62 173.73 1hr7 s SER 329 N -0.41 2.95 0.22 3.53 0.01 -1.26 -0.72 113.70 118.02 1hr7 s SER 329 Ca 0.05 -0.84 0.01 0.00 1.31 0.00 0.00 55.95 56.47 1hr7 s SER 329 Cb -0.12 -0.19 -0.05 0.00 0.21 0.00 0.00 66.02 65.87 1hr7 s SER 329 CO 0.02 0.04 0.08 -0.31 0.41 0.00 0.00 173.24 173.48 1hr7 s TYR 330 N -1.79 1.37 0.35 2.43 2.02 0.15 -4.86 117.35 117.02 1hr7 s TYR 330 Ca 0.16 -1.18 0.04 0.00 -0.37 0.00 0.00 57.07 55.72 1hr7 s TYR 330 Cb -0.07 -0.78 0.68 0.00 -0.40 0.00 0.00 41.96 41.39 1hr7 s TYR 330 CO 0.07 -0.37 1.99 0.00 -1.57 0.00 0.00 175.55 175.68 1hr7 h ALA 331 N 2.51 1.61 0.00 3.71 0.00 -1.95 -1.16 119.26 123.97 1hr7 h ALA 331 Ca -0.37 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1hr7 h ALA 331 Cb 1.24 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1hr7 h ALA 331 CO 0.60 0.32 -0.00 -0.40 0.00 0.00 0.00 179.25 179.77 1hr7 n ASP 332 N -4.46 2.04 -3.53 0.00 5.68 -1.26 -4.42 116.55 110.60 1hr7 n ASP 332 Ca 0.08 -2.14 -0.02 0.00 -0.50 0.00 0.00 54.79 52.21 1hr7 n ASP 332 Cb 0.12 -0.06 0.01 0.00 -1.14 0.00 0.00 41.12 40.05 1hr7 n ASP 332 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1hr7 s SER 333 N -1.25 -0.05 0.08 -1.12 0.15 -1.20 -4.47 113.70 105.85 1hr7 s SER 333 Ca 0.04 -0.51 -0.26 0.00 0.70 0.00 0.00 55.95 55.93 1hr7 s SER 333 Cb 0.04 0.43 0.08 0.00 -1.71 0.00 0.00 66.02 64.86 1hr7 s SER 333 CO 0.00 -0.83 0.70 -0.83 1.20 0.00 0.00 173.24 173.48 1hr7 s GLY 334 N -3.28 -0.56 -0.06 9.45 0.00 -1.24 0.32 107.32 111.95 1hr7 s GLY 334 Ca 0.19 0.78 0.04 0.00 0.00 0.00 0.00 44.72 45.73 1hr7 s GLY 334 CO 0.03 0.33 -0.19 1.08 0.00 0.00 0.00 173.10 174.34 1hr7 s LEU 335 N -2.45 1.94 -0.04 0.66 1.43 0.10 0.13 118.68 120.46 1hr7 s LEU 335 Ca 0.01 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1hr7 s LEU 335 Cb -0.01 -1.10 0.01 0.00 0.03 0.00 0.00 46.19 45.12 1hr7 s LEU 335 CO -0.09 0.16 -0.07 0.86 0.23 0.00 0.00 176.35 177.44 1hr7 s TRP 336 N 0.12 0.86 -0.66 0.29 -0.00 -0.98 0.92 118.94 119.50 1hr7 s TRP 336 Ca -0.07 -0.24 0.00 0.00 -0.00 0.00 0.00 56.10 55.79 1hr7 s TRP 336 Cb -0.13 -0.68 0.00 0.00 -0.00 0.00 0.00 33.47 32.65 1hr7 s TRP 336 CO 0.04 -0.15 0.00 0.41 -0.00 0.00 0.00 176.95 177.24 1hr7 n GLY 337 N 3.68 -0.72 3.20 5.86 0.00 -0.15 -1.56 105.19 115.50 1hr7 n GLY 337 Ca -0.22 -0.40 -0.24 0.00 0.00 0.00 0.00 46.02 45.15 1hr7 n GLY 337 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1hr7 s MET 338 N -0.26 1.35 -0.18 1.61 1.75 -0.18 -0.97 119.30 122.41 1hr7 s MET 338 Ca 0.00 -0.77 0.01 0.00 -1.25 0.00 0.00 55.69 53.68 1hr7 s MET 338 Cb 0.00 -1.37 0.02 0.00 2.84 0.00 0.00 34.83 36.32 1hr7 s MET 338 CO 0.00 0.36 -0.19 -0.47 -0.65 0.00 0.00 175.02 174.08 1hr7 s TYR 339 N -0.63 2.80 -0.06 4.11 5.04 0.24 -1.15 117.35 127.70 1hr7 s TYR 339 Ca 0.06 -1.60 0.05 0.00 -2.44 0.00 0.00 57.07 53.14 1hr7 s TYR 339 Cb -0.08 -1.94 -0.02 0.00 0.35 0.00 0.00 41.96 40.28 1hr7 s TYR 339 CO 0.01 -0.79 -0.20 0.42 -1.34 0.00 0.00 175.55 173.65 1hr7 s ILE 340 N 1.30 2.54 -0.17 3.14 1.01 0.20 -0.51 121.20 128.71 1hr7 s ILE 340 Ca 0.05 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.81 1hr7 s ILE 340 Cb -0.13 -1.96 0.02 0.00 0.01 0.00 0.00 42.46 40.40 1hr7 s ILE 340 CO -0.12 0.57 -0.19 -0.69 0.00 0.00 0.00 174.94 174.51 1hr7 s VAL 341 N -0.40 1.99 0.36 2.92 1.01 -0.59 -0.08 120.40 125.61 1hr7 s VAL 341 Ca 0.04 -0.90 0.09 0.00 0.00 0.00 0.00 61.98 61.21 1hr7 s VAL 341 Cb -0.12 -1.81 -0.07 0.00 0.00 0.00 0.00 36.38 34.39 1hr7 s VAL 341 CO 0.02 0.53 -0.06 0.42 0.00 0.00 0.00 175.10 176.01 1hr7 s THR 342 N 1.31 2.25 -0.28 3.92 -4.23 0.55 -0.68 115.64 118.48 1hr7 s THR 342 Ca 0.05 -2.13 -0.25 0.00 -1.18 0.00 0.00 61.69 58.18 1hr7 s THR 342 Cb -0.13 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.98 1hr7 s THR 342 CO -0.12 -0.16 0.85 -0.62 -0.54 0.00 0.00 174.62 174.03 1hr7 s ASP 343 N -3.65 6.79 0.59 3.99 -1.08 -1.26 0.08 116.67 122.13 1hr7 s ASP 343 Ca 0.33 0.91 0.29 0.00 -0.52 0.00 0.00 52.55 53.56 1hr7 s ASP 343 Cb 0.03 -2.44 1.52 0.00 -1.46 0.00 0.00 42.92 40.57 1hr7 s ASP 343 CO 0.17 -0.61 1.95 0.28 0.52 0.00 0.00 175.17 177.48 1hr7 h SER 344 N 7.89 0.00 0.00 -0.34 0.02 -0.98 -1.90 113.55 118.24 1hr7 h SER 344 Ca -0.23 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.57 1hr7 h SER 344 Cb 1.09 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.60 1hr7 h SER 344 CO 0.90 0.00 -2.02 0.59 -1.14 0.00 0.00 176.83 175.16 1hr7 n ASN 345 N -3.74 0.68 -0.01 3.07 3.02 -1.26 -4.72 115.26 112.30 1hr7 n ASN 345 Ca 0.07 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.69 1hr7 n ASN 345 Cb 0.58 1.44 -0.11 0.00 -0.61 0.00 0.00 39.78 41.07 1hr7 n ASN 345 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1hr7 n GLU 346 N -2.38 0.90 -4.70 3.52 4.07 -1.05 -5.01 120.64 115.99 1hr7 n GLU 346 Ca -0.15 -0.10 -0.33 0.00 -0.06 0.00 0.00 57.16 56.51 1hr7 n GLU 346 Cb 0.76 -1.34 -0.13 0.00 -0.06 0.00 0.00 31.44 30.68 1hr7 n GLU 346 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 1hr7 s HIS 347 N -2.92 2.86 -0.55 4.31 3.76 -0.74 -5.00 115.29 117.02 1hr7 s HIS 347 Ca -0.02 -0.26 -0.20 0.00 -0.15 0.00 0.00 55.06 54.43 1hr7 s HIS 347 Cb 0.11 -1.77 0.07 0.00 1.11 0.00 0.00 32.58 32.09 1hr7 s HIS 347 CO 0.66 0.09 0.73 1.21 -0.85 0.00 0.00 174.74 176.57 1hr7 s ASN 348 N -0.28 6.23 0.28 1.40 3.84 -1.26 -4.87 114.94 120.28 1hr7 s ASN 348 Ca 0.03 -0.93 0.01 0.00 0.21 0.00 0.00 52.86 52.19 1hr7 s ASN 348 Cb -0.13 -2.33 0.59 0.00 -0.55 0.00 0.00 41.25 38.83 1hr7 s ASN 348 CO 0.03 -1.05 1.79 0.58 -2.79 0.00 0.00 177.10 175.66 1hr7 h VAL 349 N 5.91 0.80 -0.66 -5.21 2.07 -1.88 -0.86 116.25 116.42 1hr7 h VAL 349 Ca -0.28 -0.28 0.18 0.00 0.82 0.00 0.00 66.70 67.14 1hr7 h VAL 349 Cb 1.09 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1hr7 h VAL 349 CO 1.03 0.15 0.46 -0.09 0.02 0.00 0.00 177.57 179.14 1hr7 h ARG 350 N 0.80 0.09 -0.09 1.57 2.43 -1.81 -0.97 114.38 116.40 1hr7 h ARG 350 Ca 0.50 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.58 1hr7 h ARG 350 Cb 0.65 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1hr7 h ARG 350 CO -0.33 0.06 -0.29 -0.07 -1.51 0.00 0.00 179.97 177.83 1hr7 h LEU 351 N 0.09 0.42 -1.00 3.80 3.38 -1.48 -1.64 115.31 118.88 1hr7 h LEU 351 Ca 0.32 -0.61 -0.09 0.00 0.09 0.00 0.00 57.88 57.59 1hr7 h LEU 351 Cb 1.12 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1hr7 h LEU 351 CO -0.03 0.96 -0.24 -0.29 0.09 0.00 0.00 178.44 178.92 1hr7 h ILE 352 N -0.09 1.26 -0.56 1.22 6.09 -1.49 -2.69 117.51 121.24 1hr7 h ILE 352 Ca -0.01 -1.22 -0.10 0.00 -1.37 0.00 0.00 64.86 62.16 1hr7 h ILE 352 Cb 0.92 1.35 -0.02 0.00 0.47 0.00 0.00 36.82 39.54 1hr7 h ILE 352 CO 0.06 0.38 -0.05 0.58 -3.07 0.00 0.00 178.15 176.06 1hr7 h VAL 353 N 0.38 1.26 -0.80 2.19 2.07 -1.17 -1.95 116.25 118.23 1hr7 h VAL 353 Ca 0.06 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.44 1hr7 h VAL 353 Cb 0.63 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1hr7 h VAL 353 CO 0.05 0.42 0.50 0.78 0.02 0.00 0.00 177.57 179.34 1hr7 h ASN 354 N 0.92 0.81 -0.60 0.57 2.35 -1.00 -1.99 115.58 116.63 1hr7 h ASN 354 Ca 0.16 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.81 1hr7 h ASN 354 Cb 0.60 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 1hr7 h ASN 354 CO 0.04 0.54 -0.02 -0.33 -1.65 0.00 0.00 177.43 176.01 1hr7 h GLU 355 N 0.95 1.08 -0.69 0.81 4.39 -1.17 -1.49 114.58 118.46 1hr7 h GLU 355 Ca 0.33 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1hr7 h GLU 355 Cb 0.08 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 1hr7 h GLU 355 CO -0.14 1.06 0.30 0.82 -1.16 0.00 0.00 179.01 179.89 1hr7 h ILE 356 N 0.98 1.24 -0.55 3.13 2.04 -0.97 -1.47 117.51 121.92 1hr7 h ILE 356 Ca 0.17 -0.72 -0.10 0.00 1.00 0.00 0.00 64.86 65.21 1hr7 h ILE 356 Cb 0.59 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1hr7 h ILE 356 CO 0.03 0.29 -0.05 -0.07 0.00 0.00 0.00 178.15 178.36 1hr7 h LEU 357 N 0.97 0.96 -1.48 1.44 3.38 -1.25 -1.49 115.31 117.85 1hr7 h LEU 357 Ca 0.23 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1hr7 h LEU 357 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1hr7 h LEU 357 CO -0.02 1.04 0.02 0.50 0.09 0.00 0.00 178.44 180.06 1hr7 h LYS 358 N 0.88 0.35 -0.14 1.13 3.64 -0.93 0.15 116.57 121.66 1hr7 h LYS 358 Ca 0.15 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.29 1hr7 h LYS 358 Cb 0.58 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1hr7 h LYS 358 CO 0.04 0.37 -0.64 1.49 -2.27 0.00 0.00 179.45 178.43 1hr7 h GLU 359 N 0.35 0.68 -0.69 1.90 4.57 -0.65 -1.42 114.58 119.32 1hr7 h GLU 359 Ca 0.08 -0.54 -0.06 0.00 -1.18 0.00 0.00 59.36 57.66 1hr7 h GLU 359 Cb 0.21 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1hr7 h GLU 359 CO 0.00 1.16 0.19 -1.49 -1.18 0.00 0.00 179.01 177.69 1hr7 h TRP 360 N 0.36 1.13 0.00 0.92 6.55 -0.70 -2.15 115.95 122.05 1hr7 h TRP 360 Ca -0.04 -0.13 -0.04 0.00 0.95 0.00 0.00 58.89 59.63 1hr7 h TRP 360 Cb 1.28 -0.32 -0.01 0.00 -0.86 0.00 0.00 29.16 29.25 1hr7 h TRP 360 CO 0.10 0.92 -0.21 0.87 -1.05 0.00 0.00 178.44 179.07 1hr7 h LYS 361 N 1.02 0.00 -0.52 0.49 1.57 -0.65 -0.90 116.57 117.57 1hr7 h LYS 361 Ca 0.22 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.89 1hr7 h LYS 361 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1hr7 h LYS 361 CO -0.00 0.21 -0.08 -0.09 -0.57 0.00 0.00 179.45 178.91 1hr7 h ARG 362 N 0.00 0.96 -0.22 3.15 2.43 -0.61 -0.80 114.38 119.28 1hr7 h ARG 362 Ca -0.00 -0.33 -0.06 0.00 -0.81 0.00 0.00 59.98 58.78 1hr7 h ARG 362 Cb 0.42 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1hr7 h ARG 362 CO 0.03 0.99 -0.09 0.82 -1.51 0.00 0.00 179.97 180.21 1hr7 h ILE 363 N 0.86 1.30 -0.01 1.20 2.04 -1.02 -2.09 117.51 119.79 1hr7 h ILE 363 Ca 0.14 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1hr7 h ILE 363 Cb 0.62 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1hr7 h ILE 363 CO 0.04 0.34 -0.04 0.11 0.00 0.00 0.00 178.15 178.60 1hr7 h LYS 364 N 0.15 0.01 -0.01 2.37 1.57 -0.93 -1.31 116.57 118.43 1hr7 h LYS 364 Ca 0.05 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1hr7 h LYS 364 Cb 0.57 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1hr7 h LYS 364 CO 0.03 0.05 -0.01 -1.13 -0.57 0.00 0.00 179.45 177.82 1hr7 n SER 365 N -4.48 1.00 0.00 0.86 3.41 -0.33 -4.84 113.62 109.23 1hr7 n SER 365 Ca -0.03 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1hr7 n SER 365 Cb 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1hr7 n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hr7 n GLY 366 N 1.13 1.06 2.47 5.00 0.00 -0.49 -4.94 105.19 109.41 1hr7 n GLY 366 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1hr7 n GLY 366 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hr7 n LYS 367 N -2.00 2.88 -4.34 1.61 4.01 -0.81 -4.83 118.16 114.68 1hr7 n LYS 367 Ca 0.00 -1.82 -0.19 0.00 -0.51 0.00 0.00 58.31 55.79 1hr7 n LYS 367 Cb 0.00 -2.62 -0.14 0.00 -0.51 0.00 0.00 35.03 31.76 1hr7 n LYS 367 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 1hr7 s ILE 368 N 2.81 0.86 0.61 -0.18 -4.36 -1.26 -4.81 121.20 114.87 1hr7 s ILE 368 Ca 0.54 -0.72 -0.08 0.00 -0.26 0.00 0.00 60.65 60.14 1hr7 s ILE 368 Cb 0.14 -0.77 -0.00 0.00 1.25 0.00 0.00 42.46 43.08 1hr7 s ILE 368 CO -0.05 0.06 0.95 -0.94 0.24 0.00 0.00 174.94 175.20 1hr7 s SER 369 N -0.74 5.72 0.21 4.36 1.04 -1.26 -4.98 113.70 118.06 1hr7 s SER 369 Ca 0.01 0.93 -0.09 0.00 0.48 0.00 0.00 55.95 57.28 1hr7 s SER 369 Cb -0.06 -1.93 0.16 0.00 0.10 0.00 0.00 66.02 64.29 1hr7 s SER 369 CO 0.00 -1.04 1.82 0.44 0.98 0.00 0.00 173.24 175.44 1hr7 h ASP 370 N -0.26 1.00 -0.35 7.02 3.32 -2.00 -2.75 116.42 122.40 1hr7 h ASP 370 Ca -0.45 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 56.52 1hr7 h ASP 370 Cb 1.24 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 1hr7 h ASP 370 CO 0.62 0.83 0.15 0.00 -1.72 0.00 0.00 179.24 179.11 1hr7 h ALA 371 N 1.21 0.42 0.00 3.45 0.00 -1.99 -0.12 119.26 122.24 1hr7 h ALA 371 Ca 0.27 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1hr7 h ALA 371 Cb 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1hr7 h ALA 371 CO -0.04 -0.23 -0.26 1.05 0.00 0.00 0.00 179.25 179.77 1hr7 h GLU 372 N 0.32 0.00 -0.18 0.00 4.11 -1.91 0.13 114.58 117.06 1hr7 h GLU 372 Ca 0.15 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.52 1hr7 h GLU 372 Cb 0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1hr7 h GLU 372 CO -0.13 0.26 -0.16 0.28 0.07 0.00 0.00 179.01 179.33 1hr7 h VAL 373 N 0.00 1.33 -0.15 -1.06 2.07 -1.11 -1.91 116.25 115.42 1hr7 h VAL 373 Ca -0.00 -1.30 -0.10 0.00 0.82 0.00 0.00 66.70 66.11 1hr7 h VAL 373 Cb 0.77 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 1hr7 h VAL 373 CO 0.03 0.39 -0.36 0.78 0.02 0.00 0.00 177.57 178.43 1hr7 h ASN 374 N 0.07 0.33 0.08 0.57 -0.26 -0.76 -1.16 115.58 114.45 1hr7 h ASN 374 Ca 0.03 -0.13 -0.00 0.00 -0.56 0.00 0.00 56.30 55.64 1hr7 h ASN 374 Cb 0.68 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.85 1hr7 h ASN 374 CO 0.04 0.67 -0.04 -0.09 -1.06 0.00 0.00 177.43 176.95 1hr7 h ARG 375 N 0.27 -0.10 -0.65 0.81 2.43 -0.92 -1.15 114.38 115.07 1hr7 h ARG 375 Ca 0.03 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1hr7 h ARG 375 Cb 0.77 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.30 1hr7 h ARG 375 CO 0.06 0.06 0.38 0.00 -1.51 0.00 0.00 179.97 178.96 1hr7 h ALA 376 N 0.66 0.86 -0.63 2.80 0.00 -1.10 0.05 119.26 121.90 1hr7 h ALA 376 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1hr7 h ALA 376 Cb 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1hr7 h ALA 376 CO 0.02 0.09 0.13 0.87 0.00 0.00 0.00 179.25 180.36 1hr7 h LYS 377 N 0.72 1.01 -0.43 0.00 1.57 -1.01 0.52 116.57 118.95 1hr7 h LYS 377 Ca 0.28 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1hr7 h LYS 377 Cb 0.12 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1hr7 h LYS 377 CO -0.15 0.91 0.02 0.00 -0.57 0.00 0.00 179.45 179.66 1hr7 h ALA 378 N 1.18 0.58 -0.11 3.86 0.00 -0.69 0.16 119.26 124.24 1hr7 h ALA 378 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1hr7 h ALA 378 Cb 0.37 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1hr7 h ALA 378 CO 0.00 0.34 0.06 0.37 0.00 0.00 0.00 179.25 180.03 1hr7 h GLN 379 N 0.59 0.13 -0.42 0.00 4.15 -0.70 -1.31 115.11 117.54 1hr7 h GLN 379 Ca 0.12 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.54 1hr7 h GLN 379 Cb 0.45 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 1hr7 h GLN 379 CO 0.02 0.09 0.27 1.25 -1.93 0.00 0.00 178.83 178.53 1hr7 h LEU 380 N 0.13 0.47 -0.87 -2.39 5.85 -0.66 -0.64 115.31 117.20 1hr7 h LEU 380 Ca 0.04 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1hr7 h LEU 380 Cb -0.00 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 1hr7 h LEU 380 CO -0.02 0.34 0.55 0.11 -0.34 0.00 0.00 178.44 179.08 1hr7 h LYS 381 N 0.56 0.99 -0.30 1.25 1.57 -0.46 -1.39 116.57 118.79 1hr7 h LYS 381 Ca 0.16 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1hr7 h LYS 381 Cb -0.05 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.03 1hr7 h LYS 381 CO -0.04 0.66 0.01 0.00 -0.57 0.00 0.00 179.45 179.50 1hr7 h ALA 382 N 1.40 0.40 -0.65 3.86 0.00 -0.69 -0.31 119.26 123.27 1hr7 h ALA 382 Ca 0.37 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1hr7 h ALA 382 Cb 0.12 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1hr7 h ALA 382 CO -0.16 0.14 0.25 0.00 0.00 0.00 0.00 179.25 179.49 1hr7 h ALA 383 N 0.84 1.22 0.00 0.00 0.00 -0.80 -2.22 119.26 118.30 1hr7 h ALA 383 Ca 0.09 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 1hr7 h ALA 383 Cb 0.42 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1hr7 h ALA 383 CO 0.01 0.57 -1.17 -0.07 0.00 0.00 0.00 179.25 178.59 1hr7 h LEU 384 N 0.94 0.00 0.00 0.00 3.38 -1.17 -3.39 115.31 115.07 1hr7 h LEU 384 Ca 0.22 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.02 1hr7 h LEU 384 Cb 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1hr7 h LEU 384 CO -0.02 0.82 -1.64 0.18 0.09 0.00 0.00 178.44 177.87 1hr7 n LEU 385 N -3.15 2.58 0.24 1.67 4.77 -0.14 -4.41 117.00 118.56 1hr7 n LEU 385 Ca -0.06 -0.02 0.16 0.00 -0.03 0.00 0.00 56.01 56.06 1hr7 n LEU 385 Cb 0.91 -0.38 0.62 0.00 -2.33 0.00 0.00 43.42 42.24 1hr7 n LEU 385 CO 0.44 0.60 0.95 -0.07 -1.33 0.00 0.00 177.39 177.99 1hr7 h LEU 386 N -0.08 0.00 -0.15 2.23 3.38 -1.54 -2.06 115.31 117.09 1hr7 h LEU 386 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1hr7 h LEU 386 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1hr7 h LEU 386 CO -0.07 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.23 1hr7 h SER 387 N 0.00 0.00 0.00 -0.43 4.64 -1.74 -3.36 113.55 112.65 1hr7 h SER 387 Ca 0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.64 1hr7 h SER 387 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 1hr7 h SER 387 CO 0.00 0.00 2.99 0.18 -0.87 0.00 0.00 176.83 179.13 1hr7 n LEU 388 N -2.67 6.32 0.00 5.97 4.77 -0.78 -4.68 117.00 125.94 1hr7 n LEU 388 Ca 0.04 -3.83 0.00 0.00 -0.03 0.00 0.00 56.01 52.19 1hr7 n LEU 388 Cb 0.45 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1hr7 n LEU 388 CO 0.31 0.83 0.00 -0.67 -1.33 0.00 0.00 177.39 176.53 1hr7 n ASP 389 N 6.16 0.00 -3.83 -1.43 -0.08 -1.26 -4.89 116.55 111.23 1hr7 n ASP 389 Ca 0.53 0.09 -0.29 0.00 -1.51 0.00 0.00 54.79 53.61 1hr7 n ASP 389 Cb 0.37 -0.32 0.21 0.00 2.34 0.00 0.00 41.12 43.72 1hr7 n ASP 389 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1hr7 n GLY 390 N 1.95 -1.67 0.32 0.27 0.00 -1.26 -4.89 105.19 99.91 1hr7 n GLY 390 Ca 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.32 1hr7 n GLY 390 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1hr7 h SER 391 N -1.85 0.86 0.09 1.61 4.64 -1.95 -2.43 113.55 114.52 1hr7 h SER 391 Ca -0.42 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 60.78 1hr7 h SER 391 Cb 1.18 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1hr7 h SER 391 CO 0.29 0.76 -0.04 0.74 -0.87 0.00 0.00 176.83 177.71 1hr7 h THR 392 N 0.93 0.92 -0.32 2.95 2.02 -1.91 0.25 112.91 117.74 1hr7 h THR 392 Ca 0.22 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.35 1hr7 h THR 392 Cb 0.17 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1hr7 h THR 392 CO -0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.88 1hr7 h ALA 393 N 0.79 1.42 -0.18 6.16 0.00 -1.89 -0.67 119.26 124.88 1hr7 h ALA 393 Ca -0.01 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.56 1hr7 h ALA 393 Cb 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1hr7 h ALA 393 CO 0.02 0.41 -0.48 0.82 0.00 0.00 0.00 179.25 180.02 1hr7 h ILE 394 N 0.47 1.32 -0.64 0.00 2.04 -1.04 -1.76 117.51 117.90 1hr7 h ILE 394 Ca 0.10 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 64.24 1hr7 h ILE 394 Cb 0.30 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 1hr7 h ILE 394 CO 0.01 0.54 0.39 0.58 0.00 0.00 0.00 178.15 179.66 1hr7 h VAL 395 N 0.33 1.19 -0.59 1.67 2.07 -0.28 0.12 116.25 120.76 1hr7 h VAL 395 Ca -0.01 -0.41 0.09 0.00 0.82 0.00 0.00 66.70 67.20 1hr7 h VAL 395 Cb 1.10 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 31.10 1hr7 h VAL 395 CO 0.10 0.19 0.21 -0.08 0.02 0.00 0.00 177.57 178.01 1hr7 h GLU 396 N 0.87 0.37 -0.27 1.57 4.57 -1.01 0.29 114.58 120.97 1hr7 h GLU 396 Ca 0.23 -0.02 -0.13 0.00 -1.18 0.00 0.00 59.36 58.25 1hr7 h GLU 396 Cb -0.03 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.48 1hr7 h GLU 396 CO -0.04 0.25 -0.35 0.22 -1.18 0.00 0.00 179.01 177.90 1hr7 h ASP 397 N 0.38 0.77 0.84 1.04 3.58 -0.55 -2.10 116.42 120.39 1hr7 h ASP 397 Ca 0.30 -0.50 -0.04 0.00 0.42 0.00 0.00 57.03 57.21 1hr7 h ASP 397 Cb 0.37 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.21 1hr7 h ASP 397 CO -0.31 1.12 -0.46 0.40 -2.88 0.00 0.00 179.24 177.11 1hr7 h ILE 398 N 0.45 0.00 -0.10 2.25 2.04 -0.29 -2.09 117.51 119.77 1hr7 h ILE 398 Ca 0.03 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.94 1hr7 h ILE 398 Cb 0.94 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.96 1hr7 h ILE 398 CO 0.08 0.00 -0.27 1.23 0.00 0.00 0.00 178.15 179.19 1hr7 h GLY 399 N -1.20 -0.34 1.05 5.37 0.00 -0.52 -0.53 103.07 106.91 1hr7 h GLY 399 Ca -0.11 0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.49 1hr7 h GLY 399 CO 0.15 -0.21 0.26 -0.09 0.00 0.00 0.00 176.54 176.66 1hr7 h ARG 400 N -0.36 1.17 -0.39 4.80 2.43 -1.45 -0.23 114.38 120.35 1hr7 h ARG 400 Ca 0.09 -0.24 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 1hr7 h ARG 400 Cb 0.49 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1hr7 h ARG 400 CO -0.30 0.98 -0.17 1.96 -1.51 0.00 0.00 179.97 180.93 1hr7 h GLN 401 N 1.13 0.80 -0.17 0.20 4.20 -1.06 -2.20 115.11 118.01 1hr7 h GLN 401 Ca 0.25 -0.34 -0.13 0.00 0.06 0.00 0.00 58.65 58.49 1hr7 h GLN 401 Cb 0.28 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1hr7 h GLN 401 CO -0.01 0.96 -0.39 0.28 -0.67 0.00 0.00 178.83 179.00 1hr7 h VAL 402 N 0.60 1.34 0.00 -0.54 2.07 -0.95 0.13 116.25 118.90 1hr7 h VAL 402 Ca 0.09 -1.64 -0.02 0.00 0.82 0.00 0.00 66.70 65.95 1hr7 h VAL 402 Cb 0.71 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1hr7 h VAL 402 CO 0.05 0.50 -0.09 1.62 0.02 0.00 0.00 177.57 179.67 1hr7 h VAL 403 N 0.21 0.29 0.00 2.57 3.04 -1.08 0.15 116.25 121.44 1hr7 h VAL 403 Ca -0.00 -0.66 0.00 0.00 -1.01 0.00 0.00 66.70 65.03 1hr7 h VAL 403 Cb 1.00 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.79 1hr7 h VAL 403 CO 0.09 0.09 -1.20 0.35 -1.01 0.00 0.00 177.57 175.89 1hr7 n THR 404 N -3.30 0.00 0.00 3.17 -2.24 -0.83 -4.73 114.28 106.36 1hr7 n THR 404 Ca -0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1hr7 n THR 404 Cb 0.31 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 1hr7 n THR 404 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1hr7 n THR 405 N -1.69 0.00 -0.45 4.28 -1.04 0.44 -4.73 114.28 111.09 1hr7 n THR 405 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1hr7 n THR 405 Cb 0.32 0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 1hr7 n THR 405 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1hr7 n GLY 406 N 1.29 0.79 3.65 3.41 0.00 0.52 -3.75 105.19 111.10 1hr7 n GLY 406 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1hr7 n GLY 406 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hr7 s LYS 407 N -0.52 1.55 -0.24 1.61 -2.85 -1.25 -4.85 119.74 113.20 1hr7 s LYS 407 Ca 0.00 -0.99 0.02 0.00 -1.00 0.00 0.00 55.97 54.00 1hr7 s LYS 407 Cb 0.00 0.54 0.05 0.00 -2.06 0.00 0.00 37.83 36.36 1hr7 s LYS 407 CO 0.00 -0.68 -0.10 0.50 0.10 0.00 0.00 175.35 175.17 1hr7 s ARG 408 N -3.92 2.08 0.17 1.78 3.00 -1.26 -3.19 118.95 117.62 1hr7 s ARG 408 Ca 0.13 -1.12 -0.30 0.00 -1.00 0.00 0.00 55.73 53.44 1hr7 s ARG 408 Cb -0.03 -2.70 -0.08 0.00 0.00 0.00 0.00 34.95 32.15 1hr7 s ARG 408 CO 0.03 -0.53 1.29 -0.51 0.00 0.00 0.00 175.30 175.59 1hr7 s LEU 409 N 1.25 4.41 0.84 -0.88 1.43 -1.26 -4.99 118.68 119.48 1hr7 s LEU 409 Ca -0.06 2.33 -0.12 0.00 -1.03 0.00 0.00 54.13 55.26 1hr7 s LEU 409 Cb -0.18 -3.60 0.10 0.00 0.03 0.00 0.00 46.19 42.53 1hr7 s LEU 409 CO -0.06 -0.51 1.10 -0.94 0.23 0.00 0.00 176.35 176.17 1hr7 s SER 410 N 0.46 4.08 0.23 2.29 1.04 -1.26 -4.76 113.70 115.79 1hr7 s SER 410 Ca 0.57 1.29 -0.06 0.00 0.48 0.00 0.00 55.95 58.24 1hr7 s SER 410 Cb -0.35 -1.99 0.37 0.00 0.10 0.00 0.00 66.02 64.15 1hr7 s SER 410 CO 0.36 -2.23 1.79 -0.65 0.98 0.00 0.00 173.24 173.49 1hr7 h PRO 411 N -1.27 0.66 -0.62 4.02 0.11 -1.97 0.18 132.00 133.11 1hr7 h PRO 411 Ca -0.48 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1hr7 h PRO 411 Cb 1.28 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1hr7 h PRO 411 CO 0.59 0.43 0.13 0.93 -0.21 0.00 0.00 178.00 179.87 1hr7 h GLU 412 N 0.67 0.99 -0.36 1.05 3.07 -1.99 0.42 114.58 118.43 1hr7 h GLU 412 Ca 0.37 -0.23 -0.12 0.00 -0.50 0.00 0.00 59.36 58.88 1hr7 h GLU 412 Cb 0.38 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 1hr7 h GLU 412 CO -0.27 0.89 -0.28 0.93 -1.40 0.00 0.00 179.01 178.89 1hr7 h GLU 413 N 0.94 0.75 -0.42 2.33 5.08 -1.53 -1.96 114.58 119.77 1hr7 h GLU 413 Ca 0.20 -0.33 -0.09 0.00 -1.00 0.00 0.00 59.36 58.14 1hr7 h GLU 413 Cb 0.37 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1hr7 h GLU 413 CO 0.00 0.94 -0.09 0.28 -1.00 0.00 0.00 179.01 179.15 1hr7 h VAL 414 N 0.64 1.27 -0.21 3.13 2.07 -0.29 -1.75 116.25 121.13 1hr7 h VAL 414 Ca 0.08 -1.18 0.05 0.00 0.82 0.00 0.00 66.70 66.47 1hr7 h VAL 414 Cb 0.79 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 1hr7 h VAL 414 CO 0.07 0.40 -0.18 0.15 0.02 0.00 0.00 177.57 178.03 1hr7 h PHE 415 N 0.62 -0.45 -0.60 1.57 3.04 -0.78 -1.78 116.94 118.56 1hr7 h PHE 415 Ca 0.11 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.12 1hr7 h PHE 415 Cb 0.61 0.23 -0.04 0.00 2.56 0.00 0.00 35.95 39.32 1hr7 h PHE 415 CO 0.05 -0.25 0.36 1.49 -2.02 0.00 0.00 178.31 177.94 1hr7 h GLU 416 N -0.19 0.69 -0.03 1.11 4.57 -1.19 0.16 114.58 119.70 1hr7 h GLU 416 Ca 0.12 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.27 1hr7 h GLU 416 Cb 0.37 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1hr7 h GLU 416 CO -0.32 0.46 0.02 1.96 -1.18 0.00 0.00 179.01 179.95 1hr7 h GLN 417 N 0.72 0.00 0.05 1.92 1.08 -0.60 -2.14 115.11 116.14 1hr7 h GLN 417 Ca 0.24 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.24 1hr7 h GLN 417 Cb 0.03 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1hr7 h GLN 417 CO -0.10 0.00 -1.08 0.28 -0.95 0.00 0.00 178.83 176.98 1hr7 h VAL 418 N 0.00 1.15 -0.71 -0.54 2.07 -0.57 -3.37 116.25 114.27 1hr7 h VAL 418 Ca 0.01 -2.31 0.19 0.00 0.82 0.00 0.00 66.70 65.41 1hr7 h VAL 418 Cb 0.06 2.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.48 1hr7 h VAL 418 CO -0.00 0.55 0.50 -0.78 0.02 0.00 0.00 177.57 177.86 1hr7 h ASP 419 N -0.68 0.10 0.91 0.57 3.58 -0.49 -1.47 116.42 118.95 1hr7 h ASP 419 Ca -0.26 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.20 1hr7 h ASP 419 Cb 1.45 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 42.49 1hr7 h ASP 419 CO -0.04 0.05 -0.09 2.29 -2.88 0.00 0.00 179.24 178.57 1hr7 n LYS 420 N -4.38 0.00 -1.77 0.28 2.85 -0.83 -4.89 118.16 109.43 1hr7 n LYS 420 Ca 0.14 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.99 1hr7 n LYS 420 Cb 0.71 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.58 1hr7 n LYS 420 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1hr7 s ILE 421 N -3.00 2.01 0.37 0.58 1.01 -0.56 -5.01 121.20 116.60 1hr7 s ILE 421 Ca 0.13 0.01 0.08 0.00 0.00 0.00 0.00 60.65 60.88 1hr7 s ILE 421 Cb 0.19 -3.01 -0.06 0.00 0.01 0.00 0.00 42.46 39.59 1hr7 s ILE 421 CO 0.56 0.00 0.00 0.42 0.00 0.00 0.00 174.94 175.92 1hr7 s THR 422 N -0.68 2.31 0.24 2.92 -4.23 -1.26 -5.01 115.64 109.93 1hr7 s THR 422 Ca 0.57 -2.01 -0.06 0.00 -1.18 0.00 0.00 61.69 59.01 1hr7 s THR 422 Cb -0.47 -2.83 0.21 0.00 1.34 0.00 0.00 72.50 70.75 1hr7 s THR 422 CO 0.58 -0.12 1.86 0.50 -0.54 0.00 0.00 174.62 176.89 1hr7 h LYS 423 N 1.81 0.95 -0.82 3.99 3.64 -1.97 -2.12 116.57 122.05 1hr7 h LYS 423 Ca -0.43 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 58.86 1hr7 h LYS 423 Cb 1.25 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.82 1hr7 h LYS 423 CO 0.72 0.63 0.38 0.22 -2.27 0.00 0.00 179.45 179.13 1hr7 h ASP 424 N 0.98 1.09 -0.94 4.20 3.58 -1.99 -1.75 116.42 121.59 1hr7 h ASP 424 Ca 0.37 -0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.71 1hr7 h ASP 424 Cb 0.14 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 40.86 1hr7 h ASP 424 CO -0.16 0.93 0.61 0.44 -2.88 0.00 0.00 179.24 178.18 1hr7 h ASP 425 N 1.18 1.02 -0.07 2.28 3.32 -1.78 -0.39 116.42 121.98 1hr7 h ASP 425 Ca 0.28 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 1hr7 h ASP 425 Cb 0.14 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1hr7 h ASP 425 CO -0.03 0.70 -0.03 0.40 -1.72 0.00 0.00 179.24 178.56 1hr7 h ILE 426 N 1.19 1.31 -0.34 0.35 2.04 -1.15 -0.47 117.51 120.43 1hr7 h ILE 426 Ca 0.37 -0.99 0.04 0.00 1.00 0.00 0.00 64.86 65.28 1hr7 h ILE 426 Cb -0.01 1.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.87 1hr7 h ILE 426 CO -0.12 0.27 0.13 0.40 0.00 0.00 0.00 178.15 178.84 1hr7 h ILE 427 N -0.22 0.92 -0.10 -0.67 2.04 -1.13 0.17 117.51 118.53 1hr7 h ILE 427 Ca 0.02 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.82 1hr7 h ILE 427 Cb 0.45 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1hr7 h ILE 427 CO 0.01 0.05 -0.17 0.24 0.00 0.00 0.00 178.15 178.28 1hr7 h MET 428 N 0.29 -0.22 -0.59 2.37 2.86 -1.03 -1.35 114.93 117.27 1hr7 h MET 428 Ca 0.15 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 1hr7 h MET 428 Cb 0.11 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 1hr7 h MET 428 CO -0.14 -0.14 0.39 2.35 1.06 0.00 0.00 176.91 180.42 1hr7 h TRP 429 N -0.22 0.73 -0.58 -0.22 7.01 -0.62 -1.86 115.95 120.18 1hr7 h TRP 429 Ca 0.09 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.03 1hr7 h TRP 429 Cb 0.35 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.14 1hr7 h TRP 429 CO -0.27 0.45 0.07 0.00 -2.79 0.00 0.00 178.44 175.90 1hr7 h ALA 430 N 1.23 1.02 0.00 2.65 0.00 -0.67 -0.68 119.26 122.80 1hr7 h ALA 430 Ca 0.22 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1hr7 h ALA 430 Cb -0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1hr7 h ALA 430 CO -0.06 0.62 -0.09 -0.91 0.00 0.00 0.00 179.25 178.81 1hr7 h ASN 431 N 0.90 0.00 0.06 0.00 2.35 -0.86 0.18 115.58 118.20 1hr7 h ASN 431 Ca 0.18 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.66 1hr7 h ASN 431 Cb 0.43 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 1hr7 h ASN 431 CO 0.01 0.09 -1.47 0.22 -1.65 0.00 0.00 177.43 174.63 1hr7 h TYR 432 N 0.00 0.23 0.00 1.19 3.20 -0.87 -3.34 116.97 117.38 1hr7 h TYR 432 Ca -0.00 -0.17 0.00 0.00 3.14 0.00 0.00 58.73 61.70 1hr7 h TYR 432 Cb 0.51 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.77 1hr7 h TYR 432 CO 0.00 1.58 -0.58 0.00 -1.64 0.00 0.00 178.16 177.51 1hr7 h ARG 433 N -0.55 0.00 -0.06 1.82 2.47 -1.11 -3.37 114.38 113.58 1hr7 h ARG 433 Ca -0.35 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.37 1hr7 h ARG 433 Cb 1.60 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.92 1hr7 h ARG 433 CO -0.06 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.75 1hr7 n LEU 434 N -2.72 2.64 -3.96 3.04 4.77 0.61 -4.76 117.00 116.61 1hr7 n LEU 434 Ca 0.02 -2.95 -0.24 0.00 -0.03 0.00 0.00 56.01 52.81 1hr7 n LEU 434 Cb 0.52 -0.41 -0.17 0.00 -2.33 0.00 0.00 43.42 41.04 1hr7 n LEU 434 CO 0.37 0.68 -0.44 -1.58 -1.33 0.00 0.00 177.39 175.09 1hr7 s GLN 435 N -2.65 1.41 -1.52 3.23 2.00 -1.25 -4.69 119.66 116.18 1hr7 s GLN 435 Ca 0.31 -0.29 -0.08 0.00 -2.00 0.00 0.00 55.36 53.30 1hr7 s GLN 435 Cb 0.26 -1.28 0.06 0.00 0.80 0.00 0.00 33.01 32.85 1hr7 s GLN 435 CO 0.04 -0.07 0.59 0.09 -0.50 0.00 0.00 175.29 175.45 1hr7 n ASN 436 N 4.12 -1.74 -4.30 6.67 3.02 -1.26 -4.86 115.26 116.91 1hr7 n ASN 436 Ca -0.21 -0.99 -0.24 0.00 -0.03 0.00 0.00 54.58 53.11 1hr7 n ASN 436 Cb 0.51 -3.03 -0.12 0.00 -0.61 0.00 0.00 39.78 36.53 1hr7 n ASN 436 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1hr7 s LYS 437 N -6.69 1.16 0.53 3.52 -0.14 -1.26 -5.12 119.74 111.74 1hr7 s LYS 437 Ca 0.31 -1.21 -0.20 0.00 -1.36 0.00 0.00 55.97 53.51 1hr7 s LYS 437 Cb -0.17 -1.41 -0.06 0.00 -1.68 0.00 0.00 37.83 34.52 1hr7 s LYS 437 CO 0.90 0.32 1.15 -1.25 -0.76 0.00 0.00 175.35 175.71 1hr7 s PRO 438 N -2.06 3.38 0.07 -1.68 0.04 -1.26 -5.02 135.00 128.48 1hr7 s PRO 438 Ca 0.08 1.67 0.07 0.00 0.04 0.00 0.00 61.00 62.87 1hr7 s PRO 438 Cb -0.09 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1hr7 s PRO 438 CO 0.05 -0.84 -0.19 0.14 0.04 0.00 0.00 177.00 176.20 1hr7 s VAL 439 N -1.70 1.51 0.13 -0.36 -7.23 -1.26 -4.24 120.40 107.24 1hr7 s VAL 439 Ca 0.72 -1.34 0.08 0.00 -1.81 0.00 0.00 61.98 59.62 1hr7 s VAL 439 Cb -0.26 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.28 1hr7 s VAL 439 CO 0.29 -0.02 -0.19 -0.94 -0.31 0.00 0.00 175.10 173.94 1hr7 s SER 440 N -1.59 2.46 -0.04 4.85 1.04 -0.42 -3.40 113.70 116.59 1hr7 s SER 440 Ca 0.04 -0.76 -0.13 0.00 0.48 0.00 0.00 55.95 55.58 1hr7 s SER 440 Cb -0.09 -0.13 0.02 0.00 0.10 0.00 0.00 66.02 65.92 1hr7 s SER 440 CO 0.03 -0.01 0.31 -0.32 0.98 0.00 0.00 173.24 174.22 1hr7 s MET 441 N -2.32 0.58 -0.03 4.02 0.00 0.98 -1.72 119.30 120.81 1hr7 s MET 441 Ca 0.09 -0.02 0.02 0.00 0.00 0.00 0.00 55.69 55.79 1hr7 s MET 441 Cb -0.08 0.26 0.01 0.00 0.00 0.00 0.00 34.83 35.02 1hr7 s MET 441 CO 0.05 -0.14 -0.09 0.08 0.00 0.00 0.00 175.02 174.92 1hr7 s VAL 442 N -0.89 0.79 -0.06 10.11 1.01 -0.67 -1.37 120.40 129.31 1hr7 s VAL 442 Ca -0.10 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.55 1hr7 s VAL 442 Cb -0.05 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.64 1hr7 s VAL 442 CO 0.03 0.25 -0.09 0.00 0.00 0.00 0.00 175.10 175.29 1hr7 s ALA 443 N 0.27 1.05 -0.13 5.51 0.00 -0.62 -1.18 121.76 126.66 1hr7 s ALA 443 Ca -0.04 -0.29 0.02 0.00 0.00 0.00 0.00 51.96 51.64 1hr7 s ALA 443 Cb -0.09 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.49 1hr7 s ALA 443 CO 0.01 0.01 -0.17 -1.17 0.00 0.00 0.00 175.76 174.43 1hr7 s LEU 444 N 0.87 1.85 0.00 0.00 2.96 0.32 -0.34 118.68 124.34 1hr7 s LEU 444 Ca -0.11 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.30 1hr7 s LEU 444 Cb -0.15 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 45.31 1hr7 s LEU 444 CO 0.01 0.02 0.00 0.61 -1.32 0.00 0.00 176.35 175.68 1hr7 n GLY 445 N 4.26 0.07 3.56 7.98 0.00 -0.97 -0.69 105.19 119.39 1hr7 n GLY 445 Ca -0.19 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 43.76 1hr7 n GLY 445 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1hr7 s ASN 446 N -4.00 6.10 0.00 1.61 3.84 -1.26 -1.86 114.94 119.37 1hr7 s ASN 446 Ca 0.00 -0.86 0.30 0.00 0.21 0.00 0.00 52.86 52.51 1hr7 s ASN 446 Cb 0.00 -2.56 1.41 0.00 -0.55 0.00 0.00 41.25 39.55 1hr7 s ASN 446 CO 0.00 -1.86 1.99 1.07 -2.79 0.00 0.00 177.10 175.52 1hr7 n THR 447 N 6.89 0.00 0.26 -5.21 5.66 -1.26 -4.14 114.28 116.48 1hr7 n THR 447 Ca 0.23 -0.01 0.13 0.00 -3.05 0.00 0.00 64.05 61.36 1hr7 n THR 447 Cb 0.50 -0.43 0.68 0.00 -1.55 0.00 0.00 70.33 69.53 1hr7 n THR 447 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1hr7 h SER 448 N 0.07 0.00 0.04 1.09 4.64 -2.00 -2.76 113.55 114.62 1hr7 h SER 448 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hr7 h SER 448 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1hr7 h SER 448 CO 0.00 0.13 -0.60 1.07 -0.87 0.00 0.00 176.83 176.55 1hr7 n THR 449 N -3.46 0.00 -2.68 2.95 5.66 -1.26 -4.94 114.28 110.55 1hr7 n THR 449 Ca -0.01 -0.16 -0.43 0.00 -3.05 0.00 0.00 64.05 60.40 1hr7 n THR 449 Cb 0.29 1.04 -0.02 0.00 -1.55 0.00 0.00 70.33 70.09 1hr7 n THR 449 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1hr7 s VAL 450 N -2.65 4.75 0.64 1.08 1.01 -1.04 -2.22 120.40 121.96 1hr7 s VAL 450 Ca 0.16 2.03 -0.13 0.00 0.00 0.00 0.00 61.98 64.04 1hr7 s VAL 450 Cb 0.18 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1hr7 s VAL 450 CO 0.66 -0.05 1.05 -2.16 0.00 0.00 0.00 175.10 174.60 1hr7 s PRO 451 N 2.34 3.19 0.84 2.72 0.04 -1.26 -4.97 135.00 137.89 1hr7 s PRO 451 Ca 0.47 1.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.43 1hr7 s PRO 451 Cb -0.17 -2.02 0.10 0.00 0.04 0.00 0.00 34.50 32.44 1hr7 s PRO 451 CO 0.15 -0.90 1.13 1.21 0.04 0.00 0.00 177.00 178.63 1hr7 s ASN 452 N -3.42 3.66 0.17 6.66 3.84 -1.26 -4.89 114.94 119.70 1hr7 s ASN 452 Ca 0.60 2.08 -0.08 0.00 0.21 0.00 0.00 52.86 55.67 1hr7 s ASN 452 Cb -0.14 -2.55 0.03 0.00 -0.55 0.00 0.00 41.25 38.04 1hr7 s ASN 452 CO 0.47 -2.61 1.50 0.58 -2.79 0.00 0.00 177.10 174.25 1hr7 h VAL 453 N -1.40 1.28 0.00 -5.21 2.07 -1.95 -1.72 116.25 109.32 1hr7 h VAL 453 Ca -0.44 -1.59 -0.05 0.00 0.82 0.00 0.00 66.70 65.44 1hr7 h VAL 453 Cb 1.26 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 1hr7 h VAL 453 CO 0.46 0.52 -0.22 0.77 0.02 0.00 0.00 177.57 179.12 1hr7 h SER 454 N 0.66 0.00 0.17 0.57 4.64 -1.95 -0.75 113.55 116.89 1hr7 h SER 454 Ca 0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1hr7 h SER 454 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1hr7 h SER 454 CO 0.09 0.22 -0.08 0.22 -0.87 0.00 0.00 176.83 176.42 1hr7 h TYR 455 N 0.00 -0.22 -0.30 4.77 5.03 -1.86 -1.19 116.97 123.22 1hr7 h TYR 455 Ca -0.00 -0.01 0.05 0.00 2.58 0.00 0.00 58.73 61.35 1hr7 h TYR 455 Cb 0.69 0.07 -0.05 0.00 1.55 0.00 0.00 36.73 39.00 1hr7 h TYR 455 CO 0.00 0.09 -0.01 0.82 -1.32 0.00 0.00 178.16 177.74 1hr7 h ILE 456 N -0.52 0.78 -0.51 1.81 2.04 -0.76 -1.66 117.51 118.68 1hr7 h ILE 456 Ca -0.02 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 1hr7 h ILE 456 Cb 0.40 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1hr7 h ILE 456 CO 0.04 0.01 0.17 -0.33 0.00 0.00 0.00 178.15 178.04 1hr7 h GLU 457 N 0.08 0.75 0.31 2.37 5.08 -1.14 -0.62 114.58 121.42 1hr7 h GLU 457 Ca 0.14 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1hr7 h GLU 457 Cb 0.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1hr7 h GLU 457 CO -0.24 0.65 -0.15 1.49 -1.00 0.00 0.00 179.01 179.75 1hr7 h GLU 458 N 0.74 -0.41 -0.60 2.33 4.81 -0.54 -1.25 114.58 119.66 1hr7 h GLU 458 Ca 0.17 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1hr7 h GLU 458 Cb 0.20 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1hr7 h GLU 458 CO -0.01 -0.15 0.32 0.87 -0.73 0.00 0.00 179.01 179.31 1hr7 h LYS 459 N -0.62 0.83 -0.05 1.92 1.79 -1.16 0.66 116.57 119.94 1hr7 h LYS 459 Ca -0.04 -0.09 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 1hr7 h LYS 459 Cb 0.44 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1hr7 h LYS 459 CO 0.07 0.61 -0.04 1.25 -1.08 0.00 0.00 179.45 180.27 1hr7 h LEU 460 N 0.83 0.11 -0.25 2.94 5.85 -1.03 -3.22 115.31 120.55 1hr7 h LEU 460 Ca 0.21 -0.46 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1hr7 h LEU 460 Cb 0.03 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1hr7 h LEU 460 CO -0.03 0.55 -0.12 0.78 -0.34 0.00 0.00 178.44 179.28 1hr7 h ASN 461 N -0.32 0.00 0.00 1.25 2.35 -1.17 -3.47 115.58 114.21 1hr7 h ASN 461 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1hr7 h ASN 461 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1hr7 h ASN 461 CO 0.01 0.12 0.00 1.67 -1.65 0.00 0.00 177.43 177.58