#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h55 n ASP 19 N 0.00 7.01 -0.96 1.96 2.03 -1.26 -4.43 116.55 120.91 3h55 n ASP 19 Ca 0.00 -3.09 0.08 0.00 0.52 0.00 0.00 54.79 52.30 3h55 n ASP 19 Cb 0.00 -1.31 0.24 0.00 -0.72 0.00 0.00 41.12 39.33 3h55 n ASP 19 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3h55 n ASN 20 N 1.44 3.70 0.00 1.67 0.23 -1.26 -4.96 115.26 116.09 3h55 n ASN 20 Ca 0.54 -2.45 0.00 0.00 -0.53 0.00 0.00 54.58 52.14 3h55 n ASN 20 Cb 0.46 -0.42 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 3h55 n ASN 20 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h55 n GLY 21 N 0.33 0.62 3.92 4.83 0.00 -1.26 -4.97 105.19 108.66 3h55 n GLY 21 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 3h55 n GLY 21 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h55 s LEU 22 N 0.00 4.32 -1.21 0.99 1.43 -1.26 -4.64 118.68 118.31 3h55 s LEU 22 Ca 0.00 0.21 -0.00 0.00 -1.03 0.00 0.00 54.13 53.30 3h55 s LEU 22 Cb 0.00 -2.91 -0.00 0.00 0.03 0.00 0.00 46.19 43.30 3h55 s LEU 22 CO 0.00 0.12 0.93 0.18 0.23 0.00 0.00 176.35 177.81 3h55 n LEU 23 N -0.09 -3.92 0.28 1.79 4.32 -1.26 -4.23 117.00 113.89 3h55 n LEU 23 Ca -0.06 -0.67 0.18 0.00 -0.02 0.00 0.00 56.01 55.44 3h55 n LEU 23 Cb 0.52 -3.03 0.74 0.00 -1.62 0.00 0.00 43.42 40.03 3h55 n LEU 23 CO 0.50 0.37 1.01 1.56 -1.22 0.00 0.00 177.39 179.62 3h55 h GLN 24 N -1.85 0.00 -5.93 3.23 1.08 -1.90 0.14 115.11 109.88 3h55 h GLN 24 Ca -0.60 0.00 -0.55 0.00 -1.45 0.00 0.00 58.65 56.05 3h55 h GLN 24 Cb 1.34 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 28.63 3h55 h GLN 24 CO 0.51 0.00 -0.74 0.95 -0.95 0.00 0.00 178.83 178.61 3h55 s THR 25 N -3.72 2.16 0.47 -0.54 -4.23 -1.26 -4.32 115.64 104.20 3h55 s THR 25 Ca 0.01 -2.30 -0.25 0.00 -1.18 0.00 0.00 61.69 57.96 3h55 s THR 25 Cb 0.09 -2.28 -0.08 0.00 1.34 0.00 0.00 72.50 71.58 3h55 s THR 25 CO 0.53 -0.43 1.42 -2.65 -0.54 0.00 0.00 174.62 172.96 3h55 n PRO 26 N -0.57 2.18 -2.15 3.99 -0.02 -1.26 -4.87 135.00 132.30 3h55 n PRO 26 Ca -0.06 0.78 -0.42 0.00 -2.02 0.00 0.00 63.50 61.78 3h55 n PRO 26 Cb 0.61 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 3h55 n PRO 26 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3h55 s PRO 27 N -2.51 4.34 -0.09 0.52 0.04 -1.26 -4.78 135.00 131.25 3h55 s PRO 27 Ca 0.63 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.80 3h55 s PRO 27 Cb -0.44 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 30.88 3h55 s PRO 27 CO 0.56 -0.35 -0.08 -1.64 0.04 0.00 0.00 177.00 175.54 3h55 s MET 28 N 0.15 2.96 0.00 4.56 -1.94 -1.26 -2.05 119.30 121.73 3h55 s MET 28 Ca 0.60 -0.58 0.00 0.00 -1.71 0.00 0.00 55.69 54.00 3h55 s MET 28 Cb -0.38 -2.63 0.00 0.00 2.01 0.00 0.00 34.83 33.83 3h55 s MET 28 CO 0.37 0.53 0.00 0.41 -0.01 0.00 0.00 175.02 176.32 3h55 n GLY 29 N 2.63 -0.66 3.04 -0.03 0.00 -0.64 -1.57 105.19 107.97 3h55 n GLY 29 Ca -0.18 -0.46 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 3h55 n GLY 29 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3h55 s TRP 30 N -3.40 0.99 -0.02 1.61 -0.00 0.50 -0.83 118.94 117.79 3h55 s TRP 30 Ca 0.00 -0.21 0.05 0.00 -0.00 0.00 0.00 56.10 55.94 3h55 s TRP 30 Cb 0.00 -0.66 -0.01 0.00 -0.00 0.00 0.00 33.47 32.80 3h55 s TRP 30 CO 0.00 -0.04 -0.17 -1.17 -0.00 0.00 0.00 176.95 175.57 3h55 s LEU 31 N -0.13 2.01 0.35 5.86 0.20 1.00 -0.70 118.68 127.26 3h55 s LEU 31 Ca 0.02 -0.31 0.18 0.00 0.69 0.00 0.00 54.13 54.71 3h55 s LEU 31 Cb -0.06 -0.87 0.53 0.00 -0.43 0.00 0.00 46.19 45.37 3h55 s LEU 31 CO -0.00 0.19 1.66 0.00 -0.29 0.00 0.00 176.35 177.92 3h55 h ALA 32 N 5.82 0.91 0.85 5.97 0.00 -1.75 -3.37 119.26 127.69 3h55 h ALA 32 Ca -0.36 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.13 3h55 h ALA 32 Cb 1.16 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.89 3h55 h ALA 32 CO 0.48 0.52 -0.41 2.35 0.00 0.00 0.00 179.25 182.20 3h55 h TRP 33 N 0.00 -1.06 -0.68 0.00 2.91 -1.88 -1.81 115.95 113.43 3h55 h TRP 33 Ca -0.00 -0.02 0.12 0.00 1.13 0.00 0.00 58.89 60.11 3h55 h TRP 33 Cb 1.02 0.35 -0.08 0.00 -0.51 0.00 0.00 29.16 29.93 3h55 h TRP 33 CO 0.00 -0.66 0.25 1.49 -1.03 0.00 0.00 178.44 178.49 3h55 h GLU 34 N -1.19 0.40 0.13 2.65 4.22 -1.87 0.30 114.58 119.23 3h55 h GLU 34 Ca -0.12 -0.02 -0.30 0.00 0.08 0.00 0.00 59.36 59.00 3h55 h GLU 34 Cb 0.87 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 3h55 h GLU 34 CO 0.19 0.26 -1.48 -0.09 -2.18 0.00 0.00 179.01 175.71 3h55 h ARG 35 N 0.41 0.28 0.00 1.92 9.65 -1.69 -3.40 114.38 121.55 3h55 h ARG 35 Ca 0.36 -0.49 0.00 0.00 -1.10 0.00 0.00 59.98 58.75 3h55 h ARG 35 Cb 0.50 0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.26 3h55 h ARG 35 CO -0.36 1.17 -0.94 1.19 2.80 0.00 0.00 179.97 183.83 3h55 n PHE 36 N -3.50 0.00 -1.57 2.20 3.72 -0.68 -5.06 117.46 112.57 3h55 n PHE 36 Ca -0.15 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 3h55 n PHE 36 Cb 1.05 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 39.48 3h55 n PHE 36 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3h55 n ARG 37 N -1.53 0.00 -1.84 -1.08 5.12 0.10 -2.84 116.66 114.60 3h55 n ARG 37 Ca -0.00 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.59 3h55 n ARG 37 Cb 0.18 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.52 3h55 n ARG 37 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3h55 s ASN 39 N -2.23 6.42 -0.01 0.00 2.47 -1.13 -4.83 114.94 115.63 3h55 s ASN 39 Ca 0.55 0.05 0.06 0.00 0.42 0.00 0.00 52.86 53.94 3h55 s ASN 39 Cb 0.45 -2.55 0.16 0.00 -1.45 0.00 0.00 41.25 37.86 3h55 s ASN 39 CO -0.16 -1.51 1.13 2.30 -3.72 0.00 0.00 177.10 175.14 3h55 n ILE 40 N 6.64 1.07 -2.60 -5.21 -5.35 -1.26 0.01 119.36 112.67 3h55 n ILE 40 Ca 0.08 -1.07 -0.43 0.00 -0.27 0.00 0.00 62.75 61.05 3h55 n ILE 40 Cb 0.49 0.45 0.00 0.00 -1.74 0.00 0.00 39.64 38.84 3h55 n ILE 40 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3h55 n ASN 41 N -0.10 4.99 0.19 7.28 2.85 -1.26 -4.76 115.26 124.45 3h55 n ASN 41 Ca 0.06 -2.98 0.14 0.00 -0.11 0.00 0.00 54.58 51.68 3h55 n ASN 41 Cb 0.36 -1.59 0.43 0.00 1.24 0.00 0.00 39.78 40.21 3h55 n ASN 41 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3h55 h ASP 43 N 0.00 -0.20 0.49 0.00 3.32 -1.98 -2.91 116.42 115.15 3h55 h ASP 43 Ca 0.00 -0.29 -0.24 0.00 0.02 0.00 0.00 57.03 56.52 3h55 h ASP 43 Cb 0.69 0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3h55 h ASP 43 CO 0.00 0.22 -1.05 -0.33 -1.72 0.00 0.00 179.24 176.36 3h55 h GLU 44 N -0.66 0.33 -2.06 3.56 5.08 -1.96 -3.41 114.58 115.46 3h55 h GLU 44 Ca -0.02 -0.42 -0.53 0.00 -1.00 0.00 0.00 59.36 57.39 3h55 h GLU 44 Cb 0.48 0.14 -0.40 0.00 0.50 0.00 0.00 28.75 29.46 3h55 h GLU 44 CO 0.04 1.13 -1.05 -3.47 -1.00 0.00 0.00 179.01 174.66 3h55 n ASP 45 N -3.65 1.42 0.27 1.42 2.03 0.28 -4.97 116.55 113.35 3h55 n ASP 45 Ca -0.07 -3.06 0.14 0.00 0.52 0.00 0.00 54.79 52.32 3h55 n ASP 45 Cb 0.90 -0.62 0.78 0.00 -0.72 0.00 0.00 41.12 41.46 3h55 n ASP 45 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3h55 h PRO 46 N 3.36 0.00 0.00 -0.67 0.13 -1.68 -2.32 132.00 130.82 3h55 h PRO 46 Ca 0.10 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3h55 h PRO 46 Cb 0.85 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 3h55 h PRO 46 CO 0.56 0.09 -0.12 0.87 -0.23 0.00 0.00 178.00 179.17 3h55 h LYS 47 N 0.00 0.00 0.00 0.86 6.56 -1.93 -3.37 116.57 118.69 3h55 h LYS 47 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3h55 h LYS 47 Cb 0.25 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 3h55 h LYS 47 CO 0.01 0.02 0.00 0.09 -2.06 0.00 0.00 179.45 177.51 3h55 n ASN 48 N -3.06 0.84 -4.83 0.86 3.02 -1.06 -4.85 115.26 106.18 3h55 n ASN 48 Ca 0.03 -1.11 -0.32 0.00 -0.03 0.00 0.00 54.58 53.15 3h55 n ASN 48 Cb 0.54 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 3h55 n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h55 s ILE 50 N -2.47 3.37 0.18 0.00 -1.09 0.10 -4.63 121.20 116.66 3h55 s ILE 50 Ca 0.61 0.36 -0.23 0.00 -2.23 0.00 0.00 60.65 59.15 3h55 s ILE 50 Cb -0.11 -3.55 0.06 0.00 -1.58 0.00 0.00 42.46 37.28 3h55 s ILE 50 CO 0.28 -0.38 0.67 -0.94 -1.23 0.00 0.00 174.94 173.33 3h55 s SER 51 N 6.96 -0.46 0.21 3.58 1.04 -1.26 -4.89 113.70 118.87 3h55 s SER 51 Ca 0.82 -0.17 -0.17 0.00 0.48 0.00 0.00 55.95 56.92 3h55 s SER 51 Cb -0.23 0.61 0.20 0.00 0.10 0.00 0.00 66.02 66.70 3h55 s SER 51 CO 0.32 -1.03 1.60 -0.08 0.98 0.00 0.00 173.24 175.02 3h55 h GLU 52 N 2.00 -0.08 -0.45 4.02 4.81 -1.04 -2.13 114.58 121.71 3h55 h GLU 52 Ca -0.29 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.03 3h55 h GLU 52 Cb 1.29 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.61 3h55 h GLU 52 CO 0.33 -0.06 -0.06 0.37 -0.73 0.00 0.00 179.01 178.87 3h55 h GLN 53 N -0.09 0.05 -0.32 1.92 4.15 -1.94 -1.14 115.11 117.74 3h55 h GLN 53 Ca 0.28 -0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.76 3h55 h GLN 53 Cb 0.54 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.16 3h55 h GLN 53 CO -0.71 0.03 -0.02 1.25 -1.93 0.00 0.00 178.83 177.46 3h55 h LEU 54 N 0.05 -0.16 -0.45 -2.39 5.85 -1.65 -0.30 115.31 116.26 3h55 h LEU 54 Ca 0.22 0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.91 3h55 h LEU 54 Cb 0.33 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3h55 h LEU 54 CO -0.42 -0.04 -0.15 -0.26 -0.34 0.00 0.00 178.44 177.23 3h55 h PHE 55 N 0.07 1.02 -0.72 1.25 0.04 -1.20 -1.36 116.94 116.05 3h55 h PHE 55 Ca 0.16 -0.23 -0.01 0.00 2.80 0.00 0.00 57.97 60.68 3h55 h PHE 55 Cb 0.22 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 3h55 h PHE 55 CO -0.24 1.02 0.41 0.52 -0.60 0.00 0.00 178.31 179.41 3h55 h MET 56 N 0.74 0.99 -0.43 1.51 2.86 -0.95 0.18 114.93 119.83 3h55 h MET 56 Ca 0.11 -0.11 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 3h55 h MET 56 Cb 0.71 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 3h55 h MET 56 CO 0.05 0.73 -0.18 0.93 1.06 0.00 0.00 176.91 179.50 3h55 h GLU 57 N 0.99 0.83 -0.48 1.72 5.08 -0.87 -0.44 114.58 121.41 3h55 h GLU 57 Ca 0.26 -0.32 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 3h55 h GLU 57 Cb 0.01 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3h55 h GLU 57 CO -0.04 0.94 -0.20 0.52 -1.00 0.00 0.00 179.01 179.23 3h55 h MET 58 N 0.73 0.98 -0.41 2.33 2.86 -0.94 -2.37 114.93 118.12 3h55 h MET 58 Ca 0.11 -0.42 0.03 0.00 -2.06 0.00 0.00 59.70 57.36 3h55 h MET 58 Cb 0.70 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.29 3h55 h MET 58 CO 0.05 1.09 0.21 0.00 1.06 0.00 0.00 176.91 179.33 3h55 h ALA 59 N 0.87 0.51 -0.50 6.32 0.00 -0.36 -0.23 119.26 125.86 3h55 h ALA 59 Ca 0.11 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.11 3h55 h ALA 59 Cb 0.78 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 3h55 h ALA 59 CO 0.06 -0.14 0.11 -0.44 0.00 0.00 0.00 179.25 178.85 3h55 h ASP 60 N 0.43 0.03 -0.53 0.00 3.32 -0.97 -1.05 116.42 117.66 3h55 h ASP 60 Ca 0.17 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 3h55 h ASP 60 Cb 0.06 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3h55 h ASP 60 CO -0.11 0.04 0.10 0.03 -1.72 0.00 0.00 179.24 177.58 3h55 h ARG 61 N 0.25 0.87 -1.01 3.56 2.47 -0.97 -0.93 114.38 118.63 3h55 h ARG 61 Ca 0.25 -0.22 0.02 0.00 -1.26 0.00 0.00 59.98 58.77 3h55 h ARG 61 Cb 0.33 -0.11 -0.05 0.00 -1.65 0.00 0.00 29.97 28.49 3h55 h ARG 61 CO -0.32 0.84 0.66 0.52 0.56 0.00 0.00 179.97 182.23 3h55 h MET 62 N 0.75 1.28 0.01 0.04 2.86 -0.53 0.84 114.93 120.18 3h55 h MET 62 Ca 0.16 -0.08 -0.22 0.00 -2.06 0.00 0.00 59.70 57.51 3h55 h MET 62 Cb 0.38 -0.29 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 3h55 h MET 62 CO 0.01 0.85 -0.94 0.00 1.06 0.00 0.00 176.91 177.88 3h55 h ALA 63 N 1.39 0.40 0.00 6.32 0.00 -1.01 -1.12 119.26 125.24 3h55 h ALA 63 Ca 0.39 -0.73 -0.29 0.00 0.00 0.00 0.00 54.91 54.28 3h55 h ALA 63 Cb -0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3h55 h ALA 63 CO -0.10 0.86 -1.93 1.04 0.00 0.00 0.00 179.25 179.12 3h55 n GLN 64 N -3.70 0.65 -0.80 0.00 6.02 -0.37 -4.51 117.38 114.67 3h55 n GLN 64 Ca -0.06 0.15 0.02 0.00 -0.01 0.00 0.00 57.00 57.10 3h55 n GLN 64 Cb 0.84 -1.68 0.31 0.00 1.02 0.00 0.00 30.24 30.73 3h55 n GLN 64 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3h55 n ASP 65 N -2.87 4.60 0.00 1.08 8.00 0.26 -4.93 116.55 122.68 3h55 n ASP 65 Ca -0.21 -3.14 0.00 0.00 0.71 0.00 0.00 54.79 52.15 3h55 n ASP 65 Cb 1.03 -0.66 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 3h55 n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h55 n GLY 66 N -0.15 1.64 0.38 0.44 0.00 -1.26 -4.95 105.19 101.29 3h55 n GLY 66 Ca 0.31 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.16 3h55 n GLY 66 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3h55 h TRP 67 N 0.00 -0.92 -0.75 1.61 4.06 -1.78 -1.41 115.95 116.76 3h55 h TRP 67 Ca 0.00 -0.01 0.06 0.00 2.06 0.00 0.00 58.89 61.00 3h55 h TRP 67 Cb 0.00 0.32 -0.06 0.00 -1.00 0.00 0.00 29.16 28.42 3h55 h TRP 67 CO 0.00 -0.53 0.44 -0.09 -3.56 0.00 0.00 178.44 174.70 3h55 h ARG 68 N -0.87 0.77 0.00 0.49 2.43 -1.20 -1.26 114.38 114.73 3h55 h ARG 68 Ca -0.07 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 3h55 h ARG 68 Cb 0.71 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3h55 h ARG 68 CO 0.08 0.51 -0.11 -0.44 -1.51 0.00 0.00 179.97 178.49 3h55 h ASP 69 N 0.79 0.00 0.69 -3.80 3.32 -1.75 -1.84 116.42 113.84 3h55 h ASP 69 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 3h55 h ASP 69 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3h55 h ASP 69 CO -0.19 0.11 -0.35 0.23 -1.72 0.00 0.00 179.24 177.33 3h55 n MET 70 N -4.06 0.02 0.00 3.56 2.81 -0.54 -4.93 117.12 113.98 3h55 n MET 70 Ca -0.02 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 3h55 n MET 70 Cb 0.20 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 3h55 n MET 70 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h55 n GLY 71 N 1.49 1.33 3.55 3.03 0.00 -0.69 -5.02 105.19 108.88 3h55 n GLY 71 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3h55 n GLY 71 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h55 s TYR 72 N -1.90 2.19 -0.01 1.61 2.02 -0.79 -4.46 117.35 116.01 3h55 s TYR 72 Ca 0.00 0.11 0.05 0.00 -0.37 0.00 0.00 57.07 56.85 3h55 s TYR 72 Cb 0.00 -4.54 -0.07 0.00 -0.40 0.00 0.00 41.96 36.95 3h55 s TYR 72 CO 0.00 -2.10 0.09 0.25 -1.57 0.00 0.00 175.55 172.22 3h55 n THR 73 N 6.53 0.04 -3.24 -0.71 -2.24 -0.61 -3.35 114.28 110.70 3h55 n THR 73 Ca 0.06 -0.11 -0.39 0.00 -2.27 0.00 0.00 64.05 61.34 3h55 n THR 73 Cb 0.49 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 3h55 n THR 73 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3h55 s TYR 74 N -2.29 3.62 -0.32 4.78 2.02 -1.00 -0.11 117.35 124.03 3h55 s TYR 74 Ca -0.02 1.09 0.00 0.00 -0.37 0.00 0.00 57.07 57.78 3h55 s TYR 74 Cb 0.03 -2.59 0.08 0.00 -0.40 0.00 0.00 41.96 39.07 3h55 s TYR 74 CO 0.19 0.27 0.03 -1.17 -1.57 0.00 0.00 175.55 173.31 3h55 s LEU 75 N 0.15 4.29 -0.18 -1.29 2.96 0.29 -0.37 118.68 124.53 3h55 s LEU 75 Ca 0.30 -1.65 -0.05 0.00 -0.22 0.00 0.00 54.13 52.51 3h55 s LEU 75 Cb -0.17 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 3h55 s LEU 75 CO 0.15 -0.33 -0.01 0.20 -1.32 0.00 0.00 176.35 175.04 3h55 s ASN 76 N 1.27 4.92 0.14 3.68 0.01 0.13 -0.84 114.94 124.24 3h55 s ASN 76 Ca 0.00 -0.13 -0.29 0.00 -0.71 0.00 0.00 52.86 51.73 3h55 s ASN 76 Cb -0.20 -1.82 -0.07 0.00 0.41 0.00 0.00 41.25 39.57 3h55 s ASN 76 CO -0.04 0.13 0.93 -0.63 -1.51 0.00 0.00 177.10 175.97 3h55 s ILE 77 N 0.62 4.42 0.00 0.60 1.01 0.28 -2.27 121.20 125.87 3h55 s ILE 77 Ca -0.01 2.01 0.00 0.00 0.00 0.00 0.00 60.65 62.65 3h55 s ILE 77 Cb -0.14 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.04 3h55 s ILE 77 CO 0.02 0.38 0.00 -0.67 0.00 0.00 0.00 174.94 174.67 3h55 n ASP 78 N 2.43 0.00 -4.68 3.58 -0.08 -1.26 -3.25 116.55 113.29 3h55 n ASP 78 Ca 0.00 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 52.98 3h55 n ASP 78 Cb 0.49 0.00 0.16 0.00 2.34 0.00 0.00 41.12 44.10 3h55 n ASP 78 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3h55 s ASP 79 N -0.18 3.11 0.00 1.67 -1.08 -1.26 -4.17 116.67 114.75 3h55 s ASP 79 Ca 0.00 1.76 0.00 0.00 -0.52 0.00 0.00 52.55 53.79 3h55 s ASP 79 Cb 0.00 -2.37 0.00 0.00 -1.46 0.00 0.00 42.92 39.09 3h55 s ASP 79 CO 0.00 -2.91 0.00 0.00 0.52 0.00 0.00 175.17 172.78 3h55 n TRP 81 N -2.87 0.86 -2.56 0.00 4.27 -1.26 -4.93 117.44 110.95 3h55 n TRP 81 Ca 0.00 0.26 -0.40 0.00 -3.89 0.00 0.00 57.50 53.46 3h55 n TRP 81 Cb 0.00 -0.94 -0.05 0.00 -1.36 0.00 0.00 31.31 28.96 3h55 n TRP 81 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 3h55 s ILE 82 N -3.28 3.75 -0.16 -1.67 1.01 -1.26 -0.75 121.20 118.84 3h55 s ILE 82 Ca -0.02 1.69 0.17 0.00 0.00 0.00 0.00 60.65 62.49 3h55 s ILE 82 Cb 0.10 -4.07 -0.24 0.00 0.01 0.00 0.00 42.46 38.25 3h55 s ILE 82 CO 0.81 0.37 0.11 0.61 0.00 0.00 0.00 174.94 176.84 3h55 n GLY 83 N 1.52 -0.92 0.00 6.18 0.00 0.18 -4.26 105.19 107.89 3h55 n GLY 83 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3h55 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h55 n GLY 84 N 1.79 -0.27 3.25 -0.02 0.00 -1.13 -4.88 105.19 103.92 3h55 n GLY 84 Ca -0.27 -1.35 -0.27 0.00 0.00 0.00 0.00 46.02 44.13 3h55 n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h55 s ARG 85 N -2.00 1.55 0.32 1.61 0.52 -1.26 -0.65 118.95 119.04 3h55 s ARG 85 Ca 0.00 -0.89 -0.04 0.00 -0.52 0.00 0.00 55.73 54.28 3h55 s ARG 85 Cb 0.00 -1.60 0.07 0.00 0.52 0.00 0.00 34.95 33.94 3h55 s ARG 85 CO 0.00 0.42 0.44 -0.40 0.02 0.00 0.00 175.30 175.78 3h55 n ASP 86 N 2.11 0.13 0.32 0.23 5.68 0.39 -4.82 116.55 120.60 3h55 n ASP 86 Ca -0.16 -1.22 0.21 0.00 -0.50 0.00 0.00 54.79 53.11 3h55 n ASP 86 Cb 0.53 -0.32 1.10 0.00 -1.14 0.00 0.00 41.12 41.29 3h55 n ASP 86 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3h55 h ALA 87 N -1.61 1.10 -0.20 2.12 0.00 -2.02 0.13 119.26 118.79 3h55 h ALA 87 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3h55 h ALA 87 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3h55 h ALA 87 CO 0.11 0.01 0.00 0.43 0.00 0.00 0.00 179.25 179.80 3h55 n SER 88 N -3.23 2.44 0.00 0.00 7.64 -1.26 -4.92 113.62 114.28 3h55 n SER 88 Ca -0.03 -1.82 0.00 0.00 1.01 0.00 0.00 58.87 58.03 3h55 n SER 88 Cb 0.10 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 3h55 n SER 88 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3h55 n GLY 89 N 1.29 0.52 3.74 0.23 0.00 0.46 -5.02 105.19 106.41 3h55 n GLY 89 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3h55 n GLY 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h55 s ARG 90 N -0.02 4.50 0.24 1.61 0.52 -1.26 -4.67 118.95 119.88 3h55 s ARG 90 Ca 0.00 1.87 -0.30 0.00 -0.52 0.00 0.00 55.73 56.79 3h55 s ARG 90 Cb 0.00 -3.23 -0.09 0.00 0.52 0.00 0.00 34.95 32.15 3h55 s ARG 90 CO 0.00 -0.06 1.30 -1.17 0.02 0.00 0.00 175.30 175.39 3h55 s LEU 91 N -0.40 4.43 0.01 2.53 2.96 -1.26 -0.46 118.68 126.49 3h55 s LEU 91 Ca 0.52 2.47 0.06 0.00 -0.22 0.00 0.00 54.13 56.96 3h55 s LEU 91 Cb -0.33 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 42.72 3h55 s LEU 91 CO 0.37 -0.50 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.67 3h55 s MET 92 N -0.65 1.42 0.96 1.98 -1.94 0.17 -4.90 119.30 116.35 3h55 s MET 92 Ca 0.54 -0.78 -0.12 0.00 -1.71 0.00 0.00 55.69 53.62 3h55 s MET 92 Cb -0.37 -1.44 0.17 0.00 2.01 0.00 0.00 34.83 35.19 3h55 s MET 92 CO 0.42 0.38 1.12 -1.25 -0.01 0.00 0.00 175.02 175.68 3h55 s PRO 93 N -0.77 0.74 -0.04 2.03 0.04 -1.26 0.47 135.00 136.21 3h55 s PRO 93 Ca 0.07 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.20 3h55 s PRO 93 Cb -0.08 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 3h55 s PRO 93 CO 0.00 -2.49 1.68 0.34 0.04 0.00 0.00 177.00 176.58 3h55 s ASP 94 N -3.74 6.65 0.43 6.66 -1.08 0.07 -3.45 116.67 122.19 3h55 s ASP 94 Ca 0.65 2.28 0.13 0.00 -0.52 0.00 0.00 52.55 55.08 3h55 s ASP 94 Cb -0.17 -2.53 0.92 0.00 -1.46 0.00 0.00 42.92 39.68 3h55 s ASP 94 CO 0.55 -0.94 1.97 1.55 0.52 0.00 0.00 175.17 178.83 3h55 h PRO 95 N 9.61 0.09 0.15 4.34 0.13 -1.92 0.26 132.00 144.66 3h55 h PRO 95 Ca -0.40 -0.02 -0.29 0.00 -0.87 0.00 0.00 66.00 64.42 3h55 h PRO 95 Cb 1.18 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.31 3h55 h PRO 95 CO 0.95 0.25 -1.29 0.87 -0.23 0.00 0.00 178.00 178.56 3h55 h LYS 96 N 0.09 0.36 0.00 0.86 1.57 -1.96 -3.07 116.57 114.42 3h55 h LYS 96 Ca 0.02 -0.60 -0.12 0.00 -1.87 0.00 0.00 60.65 58.08 3h55 h LYS 96 Cb 0.33 0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 3h55 h LYS 96 CO 0.02 1.28 -1.26 0.00 -0.57 0.00 0.00 179.45 178.92 3h55 h ARG 97 N 0.11 0.00 -2.13 3.15 3.08 -1.85 -3.38 114.38 113.36 3h55 h ARG 97 Ca -0.16 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.30 3h55 h ARG 97 Cb 2.00 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.64 3h55 h ARG 97 CO 0.22 0.21 -0.77 1.19 -1.07 0.00 0.00 179.97 179.76 3h55 n PHE 98 N -2.84 2.33 0.23 3.04 3.72 0.89 -0.35 117.46 124.49 3h55 n PHE 98 Ca -0.06 -3.96 0.06 0.00 -0.05 0.00 0.00 57.45 53.44 3h55 n PHE 98 Cb 0.75 -0.49 0.53 0.00 -0.94 0.00 0.00 39.48 39.34 3h55 n PHE 98 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3h55 h PRO 99 N 4.07 0.00 0.00 -1.08 0.13 -1.72 -2.57 132.00 130.83 3h55 h PRO 99 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3h55 h PRO 99 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 3h55 h PRO 99 CO 0.71 0.16 -0.74 0.72 -0.23 0.00 0.00 178.00 178.63 3h55 n HIS 100 N -4.30 0.25 0.00 1.56 8.25 -1.26 -5.03 115.22 114.70 3h55 n HIS 100 Ca -0.02 0.07 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 3h55 n HIS 100 Cb 0.23 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.92 3h55 n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h55 n GLY 101 N 1.41 -0.32 0.18 -1.41 0.00 -0.97 -4.39 105.19 99.69 3h55 n GLY 101 Ca 0.04 -1.79 -0.17 0.00 0.00 0.00 0.00 46.02 44.09 3h55 n GLY 101 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h55 h ILE 102 N 0.00 1.34 -0.84 -0.61 1.08 -1.97 -3.10 117.51 113.41 3h55 h ILE 102 Ca 0.00 -1.97 0.15 0.00 -0.39 0.00 0.00 64.86 62.66 3h55 h ILE 102 Cb 0.00 2.23 -0.10 0.00 -3.07 0.00 0.00 36.82 35.88 3h55 h ILE 102 CO 0.00 0.60 0.41 -0.65 -0.69 0.00 0.00 178.15 177.82 3h55 h PRO 103 N 0.24 0.56 -0.44 2.37 0.11 -1.86 0.32 132.00 133.30 3h55 h PRO 103 Ca -0.06 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 66.10 3h55 h PRO 103 Cb 1.32 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 3h55 h PRO 103 CO 0.14 0.37 0.03 0.35 -0.21 0.00 0.00 178.00 178.68 3h55 h PHE 104 N 0.58 0.04 -0.42 0.65 3.57 -1.75 0.16 116.94 119.77 3h55 h PHE 104 Ca 0.46 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.92 3h55 h PHE 104 Cb 0.68 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 3h55 h PHE 104 CO -0.11 -0.06 -0.04 1.25 -2.23 0.00 0.00 178.31 177.13 3h55 h LEU 105 N 0.15 0.77 -0.12 0.59 5.85 -0.94 -0.38 115.31 121.23 3h55 h LEU 105 Ca 0.22 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.61 3h55 h LEU 105 Cb 0.30 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 3h55 h LEU 105 CO -0.33 0.92 0.08 0.00 -0.34 0.00 0.00 178.44 178.77 3h55 h ALA 106 N 0.88 0.15 -0.87 1.25 0.00 -0.15 -0.37 119.26 120.14 3h55 h ALA 106 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h55 h ALA 106 Cb 0.55 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 3h55 h ALA 106 CO 0.03 -0.36 0.51 -0.44 0.00 0.00 0.00 179.25 178.99 3h55 h ASP 107 N 0.16 1.05 -0.20 0.00 3.32 -0.59 0.48 116.42 120.64 3h55 h ASP 107 Ca 0.05 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3h55 h ASP 107 Cb -0.01 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 3h55 h ASP 107 CO -0.01 0.82 0.08 0.22 -1.72 0.00 0.00 179.24 178.62 3h55 h TYR 108 N 1.20 0.31 -0.53 4.55 3.20 -0.78 -1.42 116.97 123.49 3h55 h TYR 108 Ca 0.31 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.11 3h55 h TYR 108 Cb -0.03 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 3h55 h TYR 108 CO 0.01 0.35 0.13 0.28 -1.64 0.00 0.00 178.16 177.29 3h55 h VAL 109 N 0.17 1.24 -0.36 1.81 2.07 -0.75 -2.68 116.25 117.76 3h55 h VAL 109 Ca 0.07 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 3h55 h VAL 109 Cb 0.18 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3h55 h VAL 109 CO -0.01 0.32 0.05 0.45 0.02 0.00 0.00 177.57 178.41 3h55 h HIS 110 N 0.75 0.55 0.00 1.57 3.86 -0.86 -1.58 115.15 119.44 3h55 h HIS 110 Ca 0.17 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 3h55 h HIS 110 Cb 0.34 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 3h55 h HIS 110 CO 0.02 0.51 -0.04 0.66 0.86 0.00 0.00 177.93 179.94 3h55 h SER 111 N 0.53 0.00 -0.70 2.45 4.64 -0.91 -1.66 113.55 117.89 3h55 h SER 111 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3h55 h SER 111 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3h55 h SER 111 CO 0.00 0.04 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 3h55 n LEU 112 N -3.25 3.92 -0.35 5.97 4.77 -0.84 -4.93 117.00 122.29 3h55 n LEU 112 Ca -0.01 -1.96 -0.04 0.00 -0.03 0.00 0.00 56.01 53.97 3h55 n LEU 112 Cb 0.22 -0.49 -0.01 0.00 -2.33 0.00 0.00 43.42 40.81 3h55 n LEU 112 CO 0.26 0.93 -0.04 0.61 -1.33 0.00 0.00 177.39 177.82 3h55 n GLY 113 N 1.56 0.50 3.75 -0.72 0.00 -0.63 -4.83 105.19 104.83 3h55 n GLY 113 Ca 0.24 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 45.17 3h55 n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h55 s LEU 114 N -0.96 3.00 0.16 0.99 1.43 -0.66 -4.99 118.68 117.66 3h55 s LEU 114 Ca 0.00 -1.16 0.10 0.00 -1.03 0.00 0.00 54.13 52.04 3h55 s LEU 114 Cb 0.00 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 3h55 s LEU 114 CO 0.00 -0.61 -0.20 -0.54 0.23 0.00 0.00 176.35 175.23 3h55 s LYS 115 N -3.92 1.68 -0.12 1.70 1.02 0.84 -3.60 119.74 117.34 3h55 s LYS 115 Ca 0.37 -1.37 0.01 0.00 0.02 0.00 0.00 55.97 55.00 3h55 s LYS 115 Cb 0.04 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 3h55 s LYS 115 CO 0.21 0.43 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.76 3h55 s LEU 116 N -2.51 2.71 0.12 3.17 2.96 -1.26 -0.55 118.68 123.32 3h55 s LEU 116 Ca 0.20 -0.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 3h55 s LEU 116 Cb -0.09 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 3h55 s LEU 116 CO 0.11 0.19 -0.03 -0.83 -1.32 0.00 0.00 176.35 174.47 3h55 s GLY 117 N 0.17 1.84 0.30 7.98 0.00 -0.02 -0.13 107.32 117.46 3h55 s GLY 117 Ca -0.08 -1.21 0.03 0.00 0.00 0.00 0.00 44.72 43.46 3h55 s GLY 117 CO 0.05 -1.20 0.13 -1.50 0.00 0.00 0.00 173.10 170.57 3h55 s ILE 118 N -1.38 0.51 -0.02 0.90 2.07 -0.07 -0.55 121.20 122.65 3h55 s ILE 118 Ca 0.25 -2.00 0.03 0.00 -1.41 0.00 0.00 60.65 57.52 3h55 s ILE 118 Cb -0.11 -2.56 -0.01 0.00 0.13 0.00 0.00 42.46 39.92 3h55 s ILE 118 CO 0.17 0.00 -0.11 -0.47 -1.91 0.00 0.00 174.94 172.62 3h55 s TYR 119 N -3.58 1.07 0.22 3.50 5.04 -1.20 -1.22 117.35 121.19 3h55 s TYR 119 Ca 0.35 -0.23 -0.04 0.00 -2.44 0.00 0.00 57.07 54.70 3h55 s TYR 119 Cb 0.06 -0.72 -0.03 0.00 0.35 0.00 0.00 41.96 41.63 3h55 s TYR 119 CO 0.16 -0.05 0.25 0.00 -1.34 0.00 0.00 175.55 174.57 3h55 s ALA 120 N -0.11 0.74 -0.07 3.97 0.00 -0.54 -4.94 121.76 120.80 3h55 s ALA 120 Ca 0.02 -1.45 0.01 0.00 0.00 0.00 0.00 51.96 50.53 3h55 s ALA 120 Cb -0.06 1.29 0.02 0.00 0.00 0.00 0.00 23.12 24.37 3h55 s ALA 120 CO 0.00 -0.68 -0.06 0.34 0.00 0.00 0.00 175.76 175.36 3h55 s ASP 121 N -3.12 1.55 -1.00 0.00 -1.08 -1.26 -0.93 116.67 110.82 3h55 s ASP 121 Ca 0.34 -0.20 -0.23 0.00 -0.52 0.00 0.00 52.55 51.93 3h55 s ASP 121 Cb 0.04 -0.63 0.03 0.00 -1.46 0.00 0.00 42.92 40.89 3h55 s ASP 121 CO 0.12 -0.07 1.59 -0.32 0.52 0.00 0.00 175.17 177.00 3h55 s MET 122 N 1.22 3.34 0.00 4.34 -2.45 0.83 0.01 119.30 126.59 3h55 s MET 122 Ca -0.05 -0.95 0.00 0.00 -1.25 0.00 0.00 55.69 53.43 3h55 s MET 122 Cb -0.14 -5.29 0.00 0.00 1.25 0.00 0.00 34.83 30.65 3h55 s MET 122 CO -0.02 -2.52 0.00 0.41 1.05 0.00 0.00 175.02 173.94 3h55 n GLY 123 N 6.81 -2.00 0.25 2.11 0.00 -1.05 -4.46 105.19 106.86 3h55 n GLY 123 Ca 0.36 -1.28 -0.06 0.00 0.00 0.00 0.00 46.02 45.04 3h55 n GLY 123 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3h55 h ASN 124 N 0.00 0.66 -5.21 1.61 2.35 -1.42 -3.02 115.58 110.54 3h55 h ASN 124 Ca 0.00 -0.23 -0.10 0.00 -0.55 0.00 0.00 56.30 55.42 3h55 h ASN 124 Cb 0.00 -0.18 -0.14 0.00 0.05 0.00 0.00 38.32 38.05 3h55 h ASN 124 CO 0.00 0.87 -0.49 -0.36 -1.65 0.00 0.00 177.43 175.80 3h55 s PHE 125 N -4.58 0.33 0.95 1.19 0.40 -1.26 -1.60 117.98 113.40 3h55 s PHE 125 Ca -0.08 -0.80 -0.12 0.00 -0.60 0.00 0.00 56.93 55.33 3h55 s PHE 125 Cb 0.13 -0.19 0.16 0.00 0.51 0.00 0.00 43.02 43.63 3h55 s PHE 125 CO 0.82 -0.50 1.09 0.95 0.70 0.00 0.00 175.22 178.28 3h55 s THR 126 N -3.90 2.35 0.54 0.64 -4.23 0.14 -4.49 115.64 106.69 3h55 s THR 126 Ca 0.07 0.11 0.22 0.00 -1.18 0.00 0.00 61.69 60.91 3h55 s THR 126 Cb 0.06 -2.60 0.32 0.00 1.34 0.00 0.00 72.50 71.63 3h55 s THR 126 CO -0.09 -0.15 2.11 0.00 -0.54 0.00 0.00 174.62 175.95 3h55 n MET 128 N -4.32 1.76 -0.41 0.00 2.81 -1.26 -4.93 117.12 110.76 3h55 n MET 128 Ca 0.01 -1.15 0.00 0.00 -1.81 0.00 0.00 57.70 54.75 3h55 n MET 128 Cb 0.26 -1.37 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 3h55 n MET 128 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h55 n GLY 129 N 1.12 0.79 3.86 3.03 0.00 0.42 -5.05 105.19 109.36 3h55 n GLY 129 Ca 0.15 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3h55 n GLY 129 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h55 s TYR 130 N -2.00 3.57 -0.03 1.61 2.02 -1.26 -4.71 117.35 116.56 3h55 s TYR 130 Ca 0.00 1.31 -0.39 0.00 -0.37 0.00 0.00 57.07 57.62 3h55 s TYR 130 Cb 0.00 -2.71 -0.17 0.00 -0.40 0.00 0.00 41.96 38.68 3h55 s TYR 130 CO 0.00 -0.56 1.36 -2.30 -1.57 0.00 0.00 175.55 172.48 3h55 n PRO 131 N -2.35 0.83 -2.88 -1.71 -0.02 -1.26 0.23 135.00 127.85 3h55 n PRO 131 Ca 0.06 0.30 -0.26 0.00 -2.02 0.00 0.00 63.50 61.58 3h55 n PRO 131 Cb 0.54 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 3h55 n PRO 131 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3h55 s GLY 132 N 1.02 1.47 -0.88 -1.23 0.00 -0.63 -4.35 107.32 102.73 3h55 s GLY 132 Ca 0.89 -0.72 -0.15 0.00 0.00 0.00 0.00 44.72 44.74 3h55 s GLY 132 CO 0.54 -0.57 0.90 -1.59 0.00 0.00 0.00 173.10 172.38 3h55 s THR 133 N -2.62 5.35 0.87 0.90 2.01 0.10 -4.84 115.64 117.42 3h55 s THR 133 Ca 0.46 -2.24 -0.12 0.00 0.31 0.00 0.00 61.69 60.10 3h55 s THR 133 Cb -0.10 -4.58 0.12 0.00 0.01 0.00 0.00 72.50 67.95 3h55 s THR 133 CO 0.41 -1.19 1.12 0.42 -0.69 0.00 0.00 174.62 174.70 3h55 s THR 134 N 0.89 2.34 0.26 -0.82 -4.23 -1.21 -2.52 115.64 110.35 3h55 s THR 134 Ca 0.23 0.11 -0.02 0.00 -1.18 0.00 0.00 61.69 60.83 3h55 s THR 134 Cb -0.08 -2.86 0.25 0.00 1.34 0.00 0.00 72.50 71.15 3h55 s THR 134 CO -0.09 -0.14 1.70 -0.07 -0.54 0.00 0.00 174.62 175.48 3h55 h LEU 135 N -1.37 0.19 0.00 4.79 3.38 -1.95 0.15 115.31 120.50 3h55 h LEU 135 Ca -0.49 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3h55 h LEU 135 Cb 1.31 0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3h55 h LEU 135 CO 0.61 0.01 0.00 -0.90 0.09 0.00 0.00 178.44 178.26 3h55 n ASP 136 N -5.08 0.00 -0.09 -0.43 5.75 -1.26 -2.83 116.55 112.61 3h55 n ASP 136 Ca 0.17 -0.57 0.04 0.00 -0.01 0.00 0.00 54.79 54.42 3h55 n ASP 136 Cb 0.51 -0.06 -0.02 0.00 -1.03 0.00 0.00 41.12 40.51 3h55 n ASP 136 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3h55 n LYS 137 N -1.06 3.34 -0.02 0.11 4.76 0.47 -4.75 118.16 121.01 3h55 n LYS 137 Ca 0.16 -0.27 -0.09 0.00 -2.87 0.00 0.00 58.31 55.24 3h55 n LYS 137 Cb 0.10 -0.94 -0.02 0.00 -1.84 0.00 0.00 35.03 32.33 3h55 n LYS 137 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3h55 h VAL 138 N 0.45 0.52 0.02 -0.18 2.07 -1.30 0.35 116.25 118.18 3h55 h VAL 138 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3h55 h VAL 138 Cb 0.23 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3h55 h VAL 138 CO 0.00 0.00 -0.01 0.58 0.02 0.00 0.00 177.57 178.16 3h55 h VAL 139 N -0.20 1.21 -0.60 2.57 2.07 -1.85 -1.35 116.25 118.09 3h55 h VAL 139 Ca 0.11 -0.70 0.08 0.00 0.82 0.00 0.00 66.70 67.01 3h55 h VAL 139 Cb 0.37 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 3h55 h VAL 139 CO -0.30 0.18 0.26 -0.61 0.02 0.00 0.00 177.57 177.12 3h55 h GLN 140 N -0.33 0.47 -0.42 1.57 4.15 -1.84 -0.74 115.11 117.96 3h55 h GLN 140 Ca -0.00 -0.03 -0.14 0.00 0.77 0.00 0.00 58.65 59.25 3h55 h GLN 140 Cb 0.31 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 3h55 h GLN 140 CO 0.00 0.31 -0.29 -0.44 -1.93 0.00 0.00 178.83 176.48 3h55 h ASP 141 N 0.48 0.97 -0.57 -0.69 3.45 -0.85 -0.62 116.42 118.58 3h55 h ASP 141 Ca 0.29 -0.40 0.02 0.00 0.43 0.00 0.00 57.03 57.38 3h55 h ASP 141 Cb 0.30 -0.27 -0.04 0.00 -0.56 0.00 0.00 39.33 38.77 3h55 h ASP 141 CO -0.25 1.18 0.36 0.00 -1.57 0.00 0.00 179.24 178.95 3h55 h ALA 142 N 0.88 0.74 -0.71 3.45 0.00 -0.90 -0.72 119.26 122.00 3h55 h ALA 142 Ca 0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3h55 h ALA 142 Cb 0.86 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3h55 h ALA 142 CO 0.08 0.09 0.23 1.96 0.00 0.00 0.00 179.25 181.61 3h55 h GLN 143 N 0.71 1.08 -0.21 0.00 4.20 -0.89 -1.84 115.11 118.16 3h55 h GLN 143 Ca 0.23 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 3h55 h GLN 143 Cb -0.00 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 3h55 h GLN 143 CO -0.09 0.92 0.09 1.15 -0.67 0.00 0.00 178.83 180.23 3h55 h THR 144 N 1.05 1.15 -0.84 -0.54 2.02 -0.73 -0.64 112.91 114.38 3h55 h THR 144 Ca 0.23 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 3h55 h THR 144 Cb 0.28 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 3h55 h THR 144 CO -0.01 0.15 0.50 -0.26 0.37 0.00 0.00 175.52 176.27 3h55 h PHE 145 N 0.20 1.11 -0.53 3.16 0.04 -0.95 -0.44 116.94 119.52 3h55 h PHE 145 Ca 0.07 -0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.73 3h55 h PHE 145 Cb 0.15 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 3h55 h PHE 145 CO -0.02 0.74 -0.07 0.00 -0.60 0.00 0.00 178.31 178.37 3h55 h ALA 146 N 1.27 0.72 -0.67 2.45 0.00 -1.20 -1.67 119.26 120.16 3h55 h ALA 146 Ca 0.30 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3h55 h ALA 146 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3h55 h ALA 146 CO -0.06 0.60 0.29 0.93 0.00 0.00 0.00 179.25 181.02 3h55 h GLU 147 N 0.86 0.96 0.00 0.00 5.08 -0.69 -1.35 114.58 119.43 3h55 h GLU 147 Ca 0.14 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3h55 h GLU 147 Cb 0.62 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3h55 h GLU 147 CO 0.04 0.77 0.00 0.91 -1.00 0.00 0.00 179.01 179.73 3h55 n TRP 148 N -4.32 0.65 -2.56 4.33 8.01 -0.21 -4.90 117.44 118.43 3h55 n TRP 148 Ca 0.06 0.24 -0.10 0.00 -1.31 0.00 0.00 57.50 56.39 3h55 n TRP 148 Cb 0.15 -0.89 0.01 0.00 -2.01 0.00 0.00 31.31 28.58 3h55 n TRP 148 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3h55 n LYS 149 N -2.08 -2.11 -1.99 -0.99 5.02 -0.51 -4.47 118.16 111.03 3h55 n LYS 149 Ca 0.03 0.43 -0.37 0.00 -2.02 0.00 0.00 58.31 56.38 3h55 n LYS 149 Cb 0.25 -4.29 0.03 0.00 -0.02 0.00 0.00 35.03 30.99 3h55 n LYS 149 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3h55 s VAL 150 N -2.79 2.54 -0.34 -0.18 1.01 -0.69 -4.81 120.40 115.15 3h55 s VAL 150 Ca 0.13 0.37 0.09 0.00 0.00 0.00 0.00 61.98 62.57 3h55 s VAL 150 Cb -0.06 -3.17 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 3h55 s VAL 150 CO 0.15 -0.04 0.35 0.47 0.00 0.00 0.00 175.10 176.04 3h55 n ASP 151 N -1.21 1.03 -3.70 3.32 8.00 0.81 -4.80 116.55 120.00 3h55 n ASP 151 Ca 0.11 -0.54 -0.14 0.00 0.71 0.00 0.00 54.79 54.94 3h55 n ASP 151 Cb 0.48 1.11 -0.09 0.00 -0.02 0.00 0.00 41.12 42.60 3h55 n ASP 151 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3h55 s MET 152 N -2.08 0.61 -0.09 -1.24 1.75 -1.05 -1.07 119.30 116.13 3h55 s MET 152 Ca 0.02 0.57 0.03 0.00 -1.25 0.00 0.00 55.69 55.05 3h55 s MET 152 Cb 0.07 0.30 0.01 0.00 2.84 0.00 0.00 34.83 38.04 3h55 s MET 152 CO 0.39 -0.10 -0.17 -1.17 -0.65 0.00 0.00 175.02 173.32 3h55 s LEU 153 N 0.01 1.84 -0.35 4.11 2.96 0.29 -0.89 118.68 126.65 3h55 s LEU 153 Ca -0.02 -0.44 -0.13 0.00 -0.22 0.00 0.00 54.13 53.32 3h55 s LEU 153 Cb -0.03 -1.13 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 3h55 s LEU 153 CO 0.02 0.07 0.24 -0.75 -1.32 0.00 0.00 176.35 174.61 3h55 s LYS 154 N 0.67 3.43 -0.43 1.98 2.20 -0.36 -0.49 119.74 126.75 3h55 s LYS 154 Ca -0.13 -0.69 -0.10 0.00 -0.36 0.00 0.00 55.97 54.69 3h55 s LYS 154 Cb -0.16 -3.81 0.08 0.00 -1.51 0.00 0.00 37.83 32.43 3h55 s LYS 154 CO 0.03 -0.48 0.28 -1.17 -0.36 0.00 0.00 175.35 173.66 3h55 s LEU 155 N 1.71 5.25 0.81 5.43 2.96 -0.02 -1.47 118.68 133.35 3h55 s LEU 155 Ca 0.06 -1.54 -0.12 0.00 -0.22 0.00 0.00 54.13 52.31 3h55 s LEU 155 Cb -0.18 -2.00 0.08 0.00 0.50 0.00 0.00 46.19 44.59 3h55 s LEU 155 CO 0.10 -0.56 1.16 -0.62 -1.32 0.00 0.00 176.35 175.11 3h55 s ASP 156 N 2.21 4.48 -0.08 3.68 -1.08 -0.11 -2.00 116.67 123.78 3h55 s ASP 156 Ca 0.03 0.89 0.11 0.00 -0.52 0.00 0.00 52.55 53.07 3h55 s ASP 156 Cb -0.23 -1.46 0.18 0.00 -1.46 0.00 0.00 42.92 39.95 3h55 s ASP 156 CO 0.02 -1.93 1.09 0.61 0.52 0.00 0.00 175.17 175.48 3h55 n GLY 157 N -3.02 3.06 3.72 2.66 0.00 -1.26 -0.12 105.19 110.23 3h55 n GLY 157 Ca 0.08 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 3h55 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h55 n PHE 159 N -3.31 -2.10 -4.25 0.00 3.01 -1.26 -4.19 117.46 105.36 3h55 n PHE 159 Ca 0.12 0.87 -0.14 0.00 1.01 0.00 0.00 57.45 59.30 3h55 n PHE 159 Cb 0.52 -3.83 -0.10 0.00 -0.01 0.00 0.00 39.48 36.05 3h55 n PHE 159 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3h55 s SER 160 N -3.53 0.83 0.33 4.37 1.04 -1.25 -1.42 113.70 114.08 3h55 s SER 160 Ca 0.54 -1.31 0.03 0.00 0.48 0.00 0.00 55.95 55.69 3h55 s SER 160 Cb -0.28 0.22 -0.02 0.00 0.10 0.00 0.00 66.02 66.05 3h55 s SER 160 CO 0.85 -0.72 0.50 0.42 0.98 0.00 0.00 173.24 175.27 3h55 s THR 161 N -3.87 4.69 0.29 2.02 -4.23 -1.26 -4.99 115.64 108.28 3h55 s THR 161 Ca 0.33 -0.74 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 3h55 s THR 161 Cb 0.07 -3.68 0.28 0.00 1.34 0.00 0.00 72.50 70.52 3h55 s THR 161 CO 0.09 -0.36 1.86 -0.65 -0.54 0.00 0.00 174.62 175.03 3h55 h PRO 162 N 0.83 1.00 -0.01 3.99 0.11 -1.98 -2.08 132.00 133.85 3h55 h PRO 162 Ca -0.49 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.44 3h55 h PRO 162 Cb 1.24 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3h55 h PRO 162 CO 0.58 0.66 -0.55 1.05 -0.21 0.00 0.00 178.00 179.53 3h55 h GLU 163 N 1.03 0.04 -0.35 1.05 9.09 -1.98 -1.11 114.58 122.34 3h55 h GLU 163 Ca 0.46 -0.02 -0.06 0.00 0.05 0.00 0.00 59.36 59.79 3h55 h GLU 163 Cb 0.37 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.46 3h55 h GLU 163 CO -0.22 0.58 0.00 0.93 0.05 0.00 0.00 179.01 180.36 3h55 h GLU 164 N 0.03 0.62 -0.68 1.06 5.08 -1.85 -2.21 114.58 116.63 3h55 h GLU 164 Ca -0.00 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.12 3h55 h GLU 164 Cb 0.99 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 3h55 h GLU 164 CO 0.07 0.73 0.26 0.00 -1.00 0.00 0.00 179.01 179.08 3h55 h ARG 165 N 0.43 1.02 -0.23 2.33 3.08 -1.27 0.29 114.38 120.02 3h55 h ARG 165 Ca 0.10 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3h55 h ARG 165 Cb 0.45 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3h55 h ARG 165 CO 0.02 0.85 0.08 0.00 -1.07 0.00 0.00 179.97 179.85 3h55 h ALA 166 N 1.12 1.72 0.15 0.04 0.00 -1.08 -1.78 119.26 119.43 3h55 h ALA 166 Ca 0.23 -0.07 -0.28 0.00 0.00 0.00 0.00 54.91 54.79 3h55 h ALA 166 Cb 0.22 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.92 3h55 h ALA 166 CO -0.02 0.23 -1.33 1.96 0.00 0.00 0.00 179.25 180.09 3h55 h GLN 167 N 0.32 0.33 -0.31 0.00 4.20 -1.17 -3.41 115.11 115.07 3h55 h GLN 167 Ca 0.08 -0.56 -0.16 0.00 0.06 0.00 0.00 58.65 58.07 3h55 h GLN 167 Cb 0.08 0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3h55 h GLN 167 CO -0.01 1.27 -0.43 0.78 -0.67 0.00 0.00 178.83 179.77 3h55 h GLY 168 N 0.07 0.92 0.82 3.46 0.00 0.03 -2.25 103.07 106.12 3h55 h GLY 168 Ca -0.26 -1.01 -0.04 0.00 0.00 0.00 0.00 47.33 46.02 3h55 h GLY 168 CO 0.13 0.90 -0.01 -0.97 0.00 0.00 0.00 176.54 176.60 3h55 h TYR 169 N 0.62 0.42 -0.84 5.60 0.05 -1.58 -0.66 116.97 120.59 3h55 h TYR 169 Ca 0.04 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 3h55 h TYR 169 Cb 1.02 -0.11 -0.04 0.00 1.01 0.00 0.00 36.73 38.62 3h55 h TYR 169 CO 0.07 0.59 0.48 -1.35 -1.05 0.00 0.00 178.16 176.90 3h55 h PRO 170 N 0.14 1.16 -0.94 4.88 0.11 -1.78 -2.10 132.00 133.46 3h55 h PRO 170 Ca 0.06 -0.12 0.03 0.00 0.11 0.00 0.00 66.00 66.08 3h55 h PRO 170 Cb 0.43 -0.23 -0.06 0.00 0.11 0.00 0.00 31.00 31.25 3h55 h PRO 170 CO 0.01 0.83 0.61 -0.22 -0.21 0.00 0.00 178.00 179.03 3h55 h LYS 171 N 1.16 1.16 -0.21 1.05 3.64 -1.26 -1.80 116.57 120.31 3h55 h LYS 171 Ca 0.30 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.47 3h55 h LYS 171 Cb -0.01 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.55 3h55 h LYS 171 CO -0.05 0.76 -0.43 1.98 -2.27 0.00 0.00 179.45 179.45 3h55 h MET 172 N 1.19 0.66 -0.82 1.90 4.05 -0.91 -0.25 114.93 120.75 3h55 h MET 172 Ca 0.37 -0.43 0.07 0.00 -0.28 0.00 0.00 59.70 59.44 3h55 h MET 172 Cb -0.00 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 30.79 3h55 h MET 172 CO -0.12 1.05 0.49 0.00 0.23 0.00 0.00 176.91 178.56 3h55 h ALA 173 N 0.61 1.14 -0.39 0.39 0.00 -1.18 0.75 119.26 120.57 3h55 h ALA 173 Ca 0.01 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3h55 h ALA 173 Cb 1.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3h55 h ALA 173 CO 0.10 0.19 -0.26 0.00 0.00 0.00 0.00 179.25 179.27 3h55 h ALA 174 N 1.41 0.56 -0.57 0.00 0.00 -1.24 -2.18 119.26 117.25 3h55 h ALA 174 Ca 0.37 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3h55 h ALA 174 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3h55 h ALA 174 CO -0.20 0.58 0.06 0.00 0.00 0.00 0.00 179.25 179.69 3h55 h ALA 175 N 0.80 0.76 -0.47 0.00 0.00 -0.53 -1.60 119.26 118.22 3h55 h ALA 175 Ca 0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3h55 h ALA 175 Cb 0.84 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3h55 h ALA 175 CO 0.07 0.54 0.20 -0.07 0.00 0.00 0.00 179.25 179.99 3h55 h LEU 176 N 0.86 0.64 -0.35 0.00 3.38 -0.86 -2.93 115.31 116.05 3h55 h LEU 176 Ca 0.17 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 58.00 3h55 h LEU 176 Cb 0.46 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 3h55 h LEU 176 CO 0.02 0.62 0.19 -1.13 0.09 0.00 0.00 178.44 178.22 3h55 h ASN 177 N 0.62 0.29 0.09 -0.43 -0.73 -1.23 -2.70 115.58 111.48 3h55 h ASN 177 Ca 0.16 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.33 3h55 h ASN 177 Cb 0.17 -0.05 -0.00 0.00 0.27 0.00 0.00 38.32 38.71 3h55 h ASN 177 CO -0.02 0.21 -0.02 0.00 -0.37 0.00 0.00 177.43 177.23 3h55 h ALA 178 N 1.17 1.39 0.00 1.57 0.00 -1.16 -1.38 119.26 120.86 3h55 h ALA 178 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3h55 h ALA 178 Cb 0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h55 h ALA 178 CO -0.09 0.03 -0.05 1.79 0.00 0.00 0.00 179.25 180.94 3h55 h THR 179 N 0.00 0.15 0.00 0.00 1.35 -1.30 -3.46 112.91 109.64 3h55 h THR 179 Ca -0.00 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 3h55 h THR 179 Cb 0.08 1.47 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 3h55 h THR 179 CO 0.00 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 3h55 n GLY 180 N -0.16 2.45 3.71 5.82 0.00 -0.52 -5.03 105.19 111.47 3h55 n GLY 180 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3h55 n GLY 180 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3h55 s ARG 181 N -0.19 4.38 -0.09 1.61 3.52 -1.26 -5.02 118.95 121.90 3h55 s ARG 181 Ca 0.00 0.69 -0.29 0.00 -0.13 0.00 0.00 55.73 56.00 3h55 s ARG 181 Cb 0.00 -3.45 -0.07 0.00 -1.56 0.00 0.00 34.95 29.87 3h55 s ARG 181 CO 0.00 0.08 1.99 -2.14 -0.81 0.00 0.00 175.30 174.42 3h55 s PRO 182 N 0.82 3.74 -0.14 5.12 0.02 -1.26 -4.78 135.00 138.51 3h55 s PRO 182 Ca 0.32 2.26 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 3h55 s PRO 182 Cb -0.17 -4.21 0.04 0.00 0.02 0.00 0.00 34.50 30.18 3h55 s PRO 182 CO 0.14 -1.40 -0.02 0.42 -0.33 0.00 0.00 177.00 175.81 3h55 s ILE 183 N 5.90 0.73 0.23 2.83 1.01 -1.26 -4.76 121.20 125.89 3h55 s ILE 183 Ca 0.90 -0.36 -0.31 0.00 0.00 0.00 0.00 60.65 60.87 3h55 s ILE 183 Cb -0.36 -0.98 -0.11 0.00 0.01 0.00 0.00 42.46 41.02 3h55 s ILE 183 CO 0.37 0.10 1.61 0.00 0.00 0.00 0.00 174.94 177.02 3h55 s ALA 184 N 1.80 3.80 -0.30 9.38 0.00 -0.23 -4.83 121.76 131.38 3h55 s ALA 184 Ca 0.02 1.50 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 3h55 s ALA 184 Cb -0.15 -3.64 0.04 0.00 0.00 0.00 0.00 23.12 19.37 3h55 s ALA 184 CO -0.07 -0.89 0.02 0.12 0.00 0.00 0.00 175.76 174.94 3h55 s PHE 185 N 0.61 3.20 -0.31 0.00 5.36 -1.26 -0.55 117.98 125.03 3h55 s PHE 185 Ca 0.68 -1.60 -0.10 0.00 -0.96 0.00 0.00 56.93 54.95 3h55 s PHE 185 Cb -0.47 -2.15 -0.01 0.00 -0.34 0.00 0.00 43.02 40.05 3h55 s PHE 185 CO 0.39 -0.74 0.16 0.45 -1.46 0.00 0.00 175.22 174.01 3h55 s SER 186 N 1.33 5.59 -0.09 6.13 0.15 0.36 -0.50 113.70 126.67 3h55 s SER 186 Ca -0.02 -0.46 -0.01 0.00 0.70 0.00 0.00 55.95 56.16 3h55 s SER 186 Cb -0.19 -2.01 -0.03 0.00 -1.71 0.00 0.00 66.02 62.08 3h55 s SER 186 CO -0.01 -0.18 -0.04 0.00 1.20 0.00 0.00 173.24 174.22 3h55 n SER 188 N 2.38 3.22 -0.26 0.00 7.64 -0.84 -0.95 113.62 124.80 3h55 n SER 188 Ca -0.18 -1.94 -0.03 0.00 1.01 0.00 0.00 58.87 57.73 3h55 n SER 188 Cb 0.53 -0.20 0.03 0.00 -1.01 0.00 0.00 64.21 63.56 3h55 n SER 188 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 3h55 h TRP 189 N 4.07 -0.92 -0.10 1.43 7.01 -1.81 -2.37 115.95 123.25 3h55 h TRP 189 Ca 0.00 0.08 -0.06 0.00 2.11 0.00 0.00 58.89 61.02 3h55 h TRP 189 Cb 0.92 0.51 -0.01 0.00 -2.10 0.00 0.00 29.16 28.48 3h55 h TRP 189 CO 0.20 -0.39 -0.24 -1.00 -2.79 0.00 0.00 178.44 174.22 3h55 h PRO 190 N -0.10 0.16 -0.75 2.65 0.13 -1.85 -2.52 132.00 129.73 3h55 h PRO 190 Ca 0.28 -0.05 0.10 0.00 -0.87 0.00 0.00 66.00 65.46 3h55 h PRO 190 Cb 0.57 -0.02 -0.05 0.00 0.13 0.00 0.00 31.00 31.63 3h55 h PRO 190 CO -0.79 0.40 0.49 0.00 -0.23 0.00 0.00 178.00 177.88 3h55 h ALA 191 N 1.61 1.84 -0.00 -0.56 0.00 -0.82 0.66 119.26 121.99 3h55 h ALA 191 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h55 h ALA 191 Cb 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h55 h ALA 191 CO 0.04 -0.00 -0.01 0.66 0.00 0.00 0.00 179.25 179.93 3h55 n TYR 192 N -4.50 0.00 -0.69 0.00 4.01 -0.95 -3.47 117.16 111.56 3h55 n TYR 192 Ca 0.13 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.94 3h55 n TYR 192 Cb 0.35 -0.48 0.16 0.00 -0.31 0.00 0.00 39.34 39.06 3h55 n TYR 192 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3h55 n GLU 193 N -1.48 2.45 -0.10 -0.72 -0.58 -0.71 -4.97 120.64 114.53 3h55 n GLU 193 Ca 0.08 -2.39 0.00 0.00 -0.42 0.00 0.00 57.16 54.43 3h55 n GLU 193 Cb 0.33 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 3h55 n GLU 193 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h55 n GLY 194 N -0.59 1.19 2.98 0.62 0.00 -1.10 -4.43 105.19 103.87 3h55 n GLY 194 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3h55 n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h55 n GLY 195 N -2.00 0.89 3.15 -0.02 0.00 0.14 -4.98 105.19 102.36 3h55 n GLY 195 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3h55 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h55 s LEU 196 N 0.00 2.44 0.71 0.99 1.43 -1.26 -4.92 118.68 118.07 3h55 s LEU 196 Ca 0.00 -0.88 -0.16 0.00 -1.03 0.00 0.00 54.13 52.06 3h55 s LEU 196 Cb 0.00 -0.12 0.03 0.00 0.03 0.00 0.00 46.19 46.12 3h55 s LEU 196 CO 0.00 -0.38 1.26 -2.84 0.23 0.00 0.00 176.35 174.62 3h55 s PRO 197 N -3.20 2.18 0.14 1.29 0.02 -1.24 -1.47 135.00 132.72 3h55 s PRO 197 Ca 0.06 1.94 0.27 0.00 0.02 0.00 0.00 61.00 63.29 3h55 s PRO 197 Cb 0.01 -1.82 0.94 0.00 0.02 0.00 0.00 34.50 33.65 3h55 s PRO 197 CO -0.03 -1.85 1.82 -0.35 -0.33 0.00 0.00 177.00 176.26 3h55 n PRO 198 N -2.47 0.18 0.05 5.54 -0.04 -1.26 -4.81 135.00 132.18 3h55 n PRO 198 Ca 0.15 0.14 -0.06 0.00 -0.04 0.00 0.00 63.50 63.69 3h55 n PRO 198 Cb 0.49 -1.70 0.12 0.00 -0.04 0.00 0.00 33.50 32.36 3h55 n PRO 198 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h55 h ARG 199 N 0.00 0.37 -5.28 0.54 3.08 -1.81 -3.41 114.38 107.87 3h55 h ARG 199 Ca 0.00 -0.22 -0.61 0.00 0.07 0.00 0.00 59.98 59.22 3h55 h ARG 199 Cb 0.66 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 30.61 3h55 h ARG 199 CO 0.00 0.81 -0.40 0.08 -1.07 0.00 0.00 179.97 179.39 3h55 s VAL 200 N -3.95 5.32 -0.41 2.04 1.01 -0.54 -5.02 120.40 118.86 3h55 s VAL 200 Ca -0.05 0.38 -0.09 0.00 0.00 0.00 0.00 61.98 62.21 3h55 s VAL 200 Cb 0.12 -3.57 0.07 0.00 0.00 0.00 0.00 36.38 33.00 3h55 s VAL 200 CO 0.81 0.35 0.24 -1.10 0.00 0.00 0.00 175.10 175.40 3h55 s GLN 201 N 0.85 2.61 0.26 2.72 -0.21 -1.26 -3.64 119.66 120.99 3h55 s GLN 201 Ca 0.12 -1.41 0.12 0.00 0.02 0.00 0.00 55.36 54.21 3h55 s GLN 201 Cb -0.13 -3.75 0.26 0.00 1.00 0.00 0.00 33.01 30.39 3h55 s GLN 201 CO 0.04 -0.91 1.54 1.88 -2.12 0.00 0.00 175.29 175.71 3h55 h TYR 202 N 8.39 0.00 -0.61 0.91 0.05 -1.98 -1.82 116.97 121.92 3h55 h TYR 202 Ca -0.23 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.47 3h55 h TYR 202 Cb 1.08 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 3h55 h TYR 202 CO 0.61 0.65 0.08 0.66 -1.05 0.00 0.00 178.16 179.11 3h55 h SER 203 N 0.00 0.98 0.15 3.88 4.64 -1.97 -1.17 113.55 120.06 3h55 h SER 203 Ca -0.01 -0.27 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3h55 h SER 203 Cb 1.25 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3h55 h SER 203 CO 0.08 1.00 -0.07 0.25 -0.87 0.00 0.00 176.83 177.22 3h55 h LEU 204 N 0.92 -0.17 -0.59 5.97 5.85 -1.96 -2.92 115.31 122.42 3h55 h LEU 204 Ca 0.18 -0.10 0.11 0.00 0.84 0.00 0.00 57.88 58.91 3h55 h LEU 204 Cb 0.45 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.44 3h55 h LEU 204 CO 0.01 -0.00 0.11 -0.07 -0.34 0.00 0.00 178.44 178.15 3h55 h LEU 205 N -0.33 -0.03 -2.23 2.25 3.38 -1.27 -1.19 115.31 115.89 3h55 h LEU 205 Ca -0.02 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 3h55 h LEU 205 Cb 0.27 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 3h55 h LEU 205 CO 0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.56 3h55 h ALA 206 N 1.48 1.76 0.00 1.53 0.00 -1.18 0.55 119.26 123.40 3h55 h ALA 206 Ca 0.31 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 3h55 h ALA 206 Cb 0.46 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3h55 h ALA 206 CO -0.41 0.00 -0.24 -0.44 0.00 0.00 0.00 179.25 178.17 3h55 h ASP 207 N 0.00 0.00 0.00 0.00 3.32 -1.02 0.31 116.42 119.02 3h55 h ASP 207 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h55 h ASP 207 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h55 h ASP 207 CO 0.00 0.24 -0.45 2.30 -1.72 0.00 0.00 179.24 179.61 3h55 n ILE 208 N -3.17 0.00 -4.20 0.35 -5.35 -0.64 -4.45 119.36 101.89 3h55 n ILE 208 Ca 0.03 -0.33 -0.17 0.00 -0.27 0.00 0.00 62.75 62.01 3h55 n ILE 208 Cb 0.61 0.87 -0.12 0.00 -1.74 0.00 0.00 39.64 39.26 3h55 n ILE 208 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3h55 h ASN 210 N 4.63 0.00 -4.69 0.00 -0.26 -0.94 0.27 115.58 114.59 3h55 h ASN 210 Ca -0.38 0.00 0.03 0.00 -0.56 0.00 0.00 56.30 55.39 3h55 h ASN 210 Cb 1.19 0.00 -0.17 0.00 -1.06 0.00 0.00 38.32 38.28 3h55 h ASN 210 CO 0.42 0.47 0.37 -1.48 -1.06 0.00 0.00 177.43 176.15 3h55 s LEU 211 N -6.14 -0.49 -0.04 1.61 2.34 -1.08 -1.15 118.68 113.73 3h55 s LEU 211 Ca 0.01 0.28 -0.03 0.00 0.06 0.00 0.00 54.13 54.45 3h55 s LEU 211 Cb 0.08 2.24 0.02 0.00 -0.56 0.00 0.00 46.19 47.97 3h55 s LEU 211 CO 0.77 -0.63 0.11 -1.66 -1.06 0.00 0.00 176.35 173.88 3h55 s TRP 212 N -2.30 -0.12 -0.41 3.48 -2.14 -0.83 -1.08 118.94 115.55 3h55 s TRP 212 Ca -0.02 0.31 -0.29 0.00 2.66 0.00 0.00 56.10 58.77 3h55 s TRP 212 Cb -0.01 0.00 0.02 0.00 -3.10 0.00 0.00 33.47 30.39 3h55 s TRP 212 CO -0.03 -0.08 1.16 1.03 -2.66 0.00 0.00 176.95 176.38 3h55 s ARG 213 N 0.31 3.82 0.13 3.25 1.81 -0.13 -0.91 118.95 127.23 3h55 s ARG 213 Ca -0.02 0.80 0.12 0.00 -1.72 0.00 0.00 55.73 54.91 3h55 s ARG 213 Cb -0.03 -3.87 -0.12 0.00 -0.45 0.00 0.00 34.95 30.48 3h55 s ARG 213 CO -0.01 -1.25 1.14 -0.91 -0.68 0.00 0.00 175.30 173.59 3h55 h ASN 214 N 9.07 0.00 -2.23 0.23 4.21 -1.89 -2.13 115.58 122.84 3h55 h ASN 214 Ca -0.23 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.23 3h55 h ASN 214 Cb 1.07 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.25 3h55 h ASN 214 CO 1.09 0.78 -0.05 0.00 -1.29 0.00 0.00 177.43 177.96 3h55 n TYR 215 N -3.18 -0.23 -1.56 1.19 9.36 -1.26 -3.69 117.16 117.79 3h55 n TYR 215 Ca -0.04 -0.34 -0.37 0.00 3.32 0.00 0.00 57.90 60.47 3h55 n TYR 215 Cb 0.88 0.05 0.07 0.00 -0.63 0.00 0.00 39.34 39.71 3h55 n TYR 215 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 3h55 n ASP 216 N -2.62 1.01 -4.71 2.98 8.00 -1.26 -4.88 116.55 115.06 3h55 n ASP 216 Ca 0.01 0.76 -0.43 0.00 0.71 0.00 0.00 54.79 55.84 3h55 n ASP 216 Cb 0.08 -1.44 -0.02 0.00 -0.02 0.00 0.00 41.12 39.71 3h55 n ASP 216 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3h55 n ASP 217 N -1.40 3.41 -4.76 -2.24 9.92 -1.26 -4.91 116.55 115.30 3h55 n ASP 217 Ca 0.14 1.13 -0.40 0.00 -0.53 0.00 0.00 54.79 55.13 3h55 n ASP 217 Cb 0.48 -1.52 -0.03 0.00 -0.64 0.00 0.00 41.12 39.41 3h55 n ASP 217 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 3h55 s ILE 218 N 0.14 3.16 0.31 0.53 2.07 -1.26 -5.06 121.20 121.09 3h55 s ILE 218 Ca 0.67 1.16 0.10 0.00 -1.41 0.00 0.00 60.65 61.17 3h55 s ILE 218 Cb -0.57 -3.74 -0.05 0.00 0.13 0.00 0.00 42.46 38.24 3h55 s ILE 218 CO 0.47 0.27 -0.01 -1.10 -1.91 0.00 0.00 174.94 172.66 3h55 s GLN 219 N -1.53 2.10 -1.28 3.50 -1.52 -1.26 -4.99 119.66 114.67 3h55 s GLN 219 Ca 0.47 -1.65 -0.16 0.00 -1.95 0.00 0.00 55.36 52.07 3h55 s GLN 219 Cb -0.35 -1.99 -0.01 0.00 -0.22 0.00 0.00 33.01 30.44 3h55 s GLN 219 CO 0.46 0.23 2.15 -3.47 -0.25 0.00 0.00 175.29 174.41 3h55 n ASP 220 N -0.90 3.52 -3.62 5.90 2.03 -1.26 -4.68 116.55 117.53 3h55 n ASP 220 Ca -0.05 -2.80 -0.16 0.00 0.52 0.00 0.00 54.79 52.30 3h55 n ASP 220 Cb 0.61 -1.52 -0.07 0.00 -0.72 0.00 0.00 41.12 39.42 3h55 n ASP 220 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 3h55 s SER 221 N 3.67 -0.45 0.25 1.67 1.04 -1.26 -4.01 113.70 114.60 3h55 s SER 221 Ca 0.50 0.43 -0.04 0.00 0.48 0.00 0.00 55.95 57.32 3h55 s SER 221 Cb 0.14 0.44 0.29 0.00 0.10 0.00 0.00 66.02 66.99 3h55 s SER 221 CO -0.04 -0.54 1.77 -0.25 0.98 0.00 0.00 173.24 175.16 3h55 h TRP 222 N 3.36 0.95 -0.80 5.02 -0.00 -1.87 -2.73 115.95 119.88 3h55 h TRP 222 Ca -0.28 -0.11 0.13 0.00 -0.00 0.00 0.00 58.89 58.62 3h55 h TRP 222 Cb 1.16 -0.27 -0.09 0.00 -0.00 0.00 0.00 29.16 29.96 3h55 h TRP 222 CO 0.44 0.82 0.39 2.35 -0.00 0.00 0.00 178.44 182.44 3h55 h TRP 223 N 0.86 0.69 -0.43 2.65 7.01 -1.96 -0.87 115.95 123.91 3h55 h TRP 223 Ca 0.18 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.16 3h55 h TRP 223 Cb 0.38 -0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.23 3h55 h TRP 223 CO 0.02 0.18 0.07 1.03 -2.79 0.00 0.00 178.44 176.96 3h55 h SER 224 N 0.60 0.68 -0.20 2.65 0.87 -1.78 -0.68 113.55 115.70 3h55 h SER 224 Ca 0.42 -0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 3h55 h SER 224 Cb 0.56 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 3h55 h SER 224 CO -0.34 0.77 0.12 0.58 -0.53 0.00 0.00 176.83 177.43 3h55 h VAL 225 N 0.57 1.03 -0.77 2.23 2.07 -1.17 -1.69 116.25 118.53 3h55 h VAL 225 Ca 0.13 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 3h55 h VAL 225 Cb 0.37 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.87 3h55 h VAL 225 CO 0.01 0.05 0.35 -0.07 0.02 0.00 0.00 177.57 177.92 3h55 h LEU 226 N 0.25 1.01 -0.52 2.57 3.38 -1.07 0.70 115.31 121.63 3h55 h LEU 226 Ca 0.07 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3h55 h LEU 226 Cb -0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3h55 h LEU 226 CO -0.03 0.87 0.31 -1.28 0.09 0.00 0.00 178.44 178.39 3h55 h SER 227 N 1.09 0.63 -0.04 -0.43 0.87 -0.83 0.23 113.55 115.08 3h55 h SER 227 Ca 0.26 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 3h55 h SER 227 Cb 0.14 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 3h55 h SER 227 CO -0.03 0.51 -0.02 0.40 -0.53 0.00 0.00 176.83 177.16 3h55 h ILE 228 N 0.70 1.34 -0.37 2.23 2.04 -1.10 -2.58 117.51 119.76 3h55 h ILE 228 Ca 0.19 -1.05 0.08 0.00 1.00 0.00 0.00 64.86 65.07 3h55 h ILE 228 Cb 0.01 1.97 -0.08 0.00 -0.74 0.00 0.00 36.82 37.98 3h55 h ILE 228 CO -0.03 0.28 -0.14 0.25 0.00 0.00 0.00 178.15 178.51 3h55 h LEU 229 N -0.33 -0.48 -0.78 1.44 6.46 -0.73 -1.26 115.31 119.64 3h55 h LEU 229 Ca 0.01 0.13 0.05 0.00 -0.12 0.00 0.00 57.88 57.94 3h55 h LEU 229 Cb 0.47 0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 40.63 3h55 h LEU 229 CO 0.01 -0.17 0.48 -1.13 -0.62 0.00 0.00 178.44 177.00 3h55 h ASN 230 N -0.06 0.76 -0.33 1.25 -1.24 -0.55 -0.68 115.58 114.74 3h55 h ASN 230 Ca 0.18 0.01 -0.05 0.00 0.71 0.00 0.00 56.30 57.15 3h55 h ASN 230 Cb 0.34 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.23 3h55 h ASN 230 CO -0.42 0.51 -0.00 -0.25 -1.29 0.00 0.00 177.43 175.98 3h55 h TRP 231 N 0.90 0.63 -0.42 0.67 7.01 -1.01 0.49 115.95 124.24 3h55 h TRP 231 Ca 0.33 -0.11 -0.07 0.00 2.11 0.00 0.00 58.89 61.15 3h55 h TRP 231 Cb 0.10 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 26.98 3h55 h TRP 231 CO -0.04 0.70 -0.02 0.74 -2.79 0.00 0.00 178.44 177.03 3h55 h PHE 232 N 0.39 0.72 -0.11 2.65 0.04 -0.96 -2.43 116.94 117.23 3h55 h PHE 232 Ca 0.09 -0.10 -0.14 0.00 2.80 0.00 0.00 57.97 60.63 3h55 h PHE 232 Cb 0.45 -0.20 0.01 0.00 2.20 0.00 0.00 35.95 38.41 3h55 h PHE 232 CO 0.04 0.69 -0.47 0.28 -0.60 0.00 0.00 178.31 178.25 3h55 h VAL 233 N 0.64 1.37 -0.68 -0.55 2.07 -1.01 -2.03 116.25 116.06 3h55 h VAL 233 Ca 0.13 -1.79 0.08 0.00 0.82 0.00 0.00 66.70 65.94 3h55 h VAL 233 Cb 0.43 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 3h55 h VAL 233 CO 0.02 0.54 0.45 -0.33 0.02 0.00 0.00 177.57 178.27 3h55 h GLU 234 N 0.12 0.58 -0.36 1.57 5.08 -0.83 -2.80 114.58 117.94 3h55 h GLU 234 Ca -0.03 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 3h55 h GLU 234 Cb 1.11 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 30.18 3h55 h GLU 234 CO 0.10 0.39 0.03 0.72 -1.00 0.00 0.00 179.01 179.24 3h55 n HIS 235 N -4.48 1.21 0.21 4.33 8.25 -0.92 -4.72 115.22 119.09 3h55 n HIS 235 Ca 0.11 -1.16 0.05 0.00 -0.26 0.00 0.00 57.72 56.46 3h55 n HIS 235 Cb 0.31 -0.43 0.47 0.00 1.12 0.00 0.00 29.99 31.45 3h55 n HIS 235 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 3h55 h GLN 236 N 1.62 0.00 -0.28 -0.41 3.07 -1.08 -1.49 115.11 116.53 3h55 h GLN 236 Ca 0.11 0.00 0.01 0.00 0.09 0.00 0.00 58.65 58.86 3h55 h GLN 236 Cb 1.65 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 29.19 3h55 h GLN 236 CO 0.35 0.26 0.19 -0.44 0.09 0.00 0.00 178.83 179.28 3h55 h ASP 237 N 0.00 0.30 0.09 0.06 3.32 -1.84 0.10 116.42 118.45 3h55 h ASP 237 Ca -0.00 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.85 3h55 h ASP 237 Cb 0.47 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3h55 h ASP 237 CO 0.03 0.22 -0.94 0.40 -1.72 0.00 0.00 179.24 177.22 3h55 h ILE 238 N 0.35 1.32 0.13 0.35 1.08 -1.77 -3.42 117.51 115.55 3h55 h ILE 238 Ca 0.11 -2.41 -0.31 0.00 -0.39 0.00 0.00 64.86 61.85 3h55 h ILE 238 Cb -0.00 2.94 -0.00 0.00 -3.07 0.00 0.00 36.82 36.69 3h55 h ILE 238 CO -0.02 0.65 -1.54 -0.07 -0.69 0.00 0.00 178.15 176.47 3h55 h LEU 239 N -0.53 0.43 -0.35 1.44 3.38 -1.11 -3.38 115.31 115.20 3h55 h LEU 239 Ca -0.20 -0.59 0.04 0.00 0.09 0.00 0.00 57.88 57.22 3h55 h LEU 239 Cb 1.54 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 42.10 3h55 h LEU 239 CO 0.05 1.49 0.12 -0.61 0.09 0.00 0.00 178.44 179.58 3h55 h GLN 240 N 0.08 0.25 0.00 1.13 -0.00 -1.05 -3.00 115.11 112.52 3h55 h GLN 240 Ca -0.25 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.37 3h55 h GLN 240 Cb 2.03 -0.06 -0.00 0.00 0.00 0.00 0.00 27.48 29.45 3h55 h GLN 240 CO 0.17 0.17 -0.09 -1.35 0.00 0.00 0.00 178.83 177.73 3h55 h PRO 241 N 0.26 0.00 0.00 -2.39 0.11 -1.78 -3.13 132.00 125.07 3h55 h PRO 241 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 3h55 h PRO 241 Cb 0.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3h55 h PRO 241 CO -0.17 0.09 0.00 1.33 -0.21 0.00 0.00 178.00 179.03 3h55 n VAL 242 N -3.20 0.58 -3.14 3.15 0.24 -1.13 -4.82 118.33 110.00 3h55 n VAL 242 Ca 0.01 -0.18 -0.37 0.00 -2.04 0.00 0.00 64.34 61.75 3h55 n VAL 242 Cb 0.38 -0.66 -0.06 0.00 -1.47 0.00 0.00 33.84 32.03 3h55 n VAL 242 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h55 s ALA 243 N -3.12 3.48 0.00 2.33 0.00 -1.18 -4.83 121.76 118.44 3h55 s ALA 243 Ca 0.10 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.20 3h55 s ALA 243 Cb 0.12 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.47 3h55 s ALA 243 CO 0.56 0.35 0.00 0.41 0.00 0.00 0.00 175.76 177.08 3h55 n GLY 244 N 1.12 -0.70 3.68 0.00 0.00 -0.59 -4.58 105.19 104.12 3h55 n GLY 244 Ca -0.05 -0.99 -0.55 0.00 0.00 0.00 0.00 46.02 44.43 3h55 n GLY 244 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3h55 n PRO 245 N -0.08 1.28 -0.10 1.61 -0.02 -1.26 -0.80 135.00 135.62 3h55 n PRO 245 Ca 0.00 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3h55 n PRO 245 Cb 0.00 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 3h55 n PRO 245 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h55 n GLY 246 N 3.79 1.02 3.05 -1.23 0.00 0.50 -4.89 105.19 107.43 3h55 n GLY 246 Ca 0.24 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.23 3h55 n GLY 246 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3h55 s HIS 247 N -2.48 -1.43 0.09 1.61 -3.43 0.02 -2.01 115.29 107.65 3h55 s HIS 247 Ca 0.00 0.53 0.06 0.00 -0.80 0.00 0.00 55.06 54.85 3h55 s HIS 247 Cb 0.00 0.10 -0.04 0.00 -1.43 0.00 0.00 32.58 31.21 3h55 s HIS 247 CO 0.00 -1.06 -0.07 -1.58 -2.00 0.00 0.00 174.74 170.03 3h55 s TRP 248 N 2.45 2.83 0.35 0.38 0.52 -0.30 -1.54 118.94 123.64 3h55 s TRP 248 Ca 0.11 -0.10 -0.26 0.00 0.02 0.00 0.00 56.10 55.87 3h55 s TRP 248 Cb -0.10 -1.49 -0.09 0.00 -1.15 0.00 0.00 33.47 30.64 3h55 s TRP 248 CO -0.22 0.43 1.08 -0.80 0.02 0.00 0.00 176.95 177.46 3h55 s ASN 249 N -2.13 6.92 -0.31 2.95 0.01 -1.26 -1.96 114.94 119.16 3h55 s ASN 249 Ca 0.22 2.16 0.02 0.00 -0.71 0.00 0.00 52.86 54.55 3h55 s ASN 249 Cb -0.11 -2.60 0.09 0.00 0.41 0.00 0.00 41.25 39.04 3h55 s ASN 249 CO 0.14 -0.38 0.05 -0.62 -1.51 0.00 0.00 177.10 174.78 3h55 s ASP 250 N -1.26 4.38 0.00 -1.22 2.15 -0.09 -4.43 116.67 116.19 3h55 s ASP 250 Ca 0.53 -1.81 0.29 0.00 0.43 0.00 0.00 52.55 51.98 3h55 s ASP 250 Cb -0.27 -1.30 1.71 0.00 -0.30 0.00 0.00 42.92 42.76 3h55 s ASP 250 CO 0.34 -0.36 2.08 -2.65 -0.17 0.00 0.00 175.17 174.40 3h55 n PRO 251 N 4.52 0.86 0.00 4.34 -0.02 -1.26 -3.64 135.00 139.80 3h55 n PRO 251 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 3h55 n PRO 251 Cb 0.42 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 3h55 n PRO 251 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3h55 n ASP 252 N -1.03 0.00 -4.74 2.55 -0.08 -1.26 -4.74 116.55 107.24 3h55 n ASP 252 Ca 0.21 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 53.15 3h55 n ASP 252 Cb 0.12 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.65 3h55 n ASP 252 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 3h55 s MET 253 N -0.69 2.47 0.30 -0.67 -1.94 -1.26 -4.86 119.30 112.65 3h55 s MET 253 Ca 0.00 1.64 -0.29 0.00 -1.71 0.00 0.00 55.69 55.34 3h55 s MET 253 Cb 0.00 -1.89 -0.09 0.00 2.01 0.00 0.00 34.83 34.86 3h55 s MET 253 CO 0.00 -1.56 1.10 -0.51 -0.01 0.00 0.00 175.02 174.04 3h55 s LEU 254 N -4.91 4.48 0.00 -0.03 1.43 -0.31 -4.96 118.68 114.39 3h55 s LEU 254 Ca 0.72 2.25 0.24 0.00 -1.03 0.00 0.00 54.13 56.31 3h55 s LEU 254 Cb -0.26 -3.71 0.23 0.00 0.03 0.00 0.00 46.19 42.47 3h55 s LEU 254 CO 0.42 -0.21 1.27 0.18 0.23 0.00 0.00 176.35 178.23 3h55 n LEU 255 N 0.98 2.51 -4.66 1.79 4.77 -1.26 -3.55 117.00 117.57 3h55 n LEU 255 Ca -0.00 -0.86 -0.42 0.00 -0.03 0.00 0.00 56.01 54.70 3h55 n LEU 255 Cb 0.45 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 3h55 n LEU 255 CO 0.53 0.43 1.55 -0.63 -1.33 0.00 0.00 177.39 177.94 3h55 s ILE 256 N -2.16 3.15 0.00 -0.08 1.01 -1.26 -1.88 121.20 119.98 3h55 s ILE 256 Ca 0.26 0.18 0.00 0.00 0.00 0.00 0.00 60.65 61.09 3h55 s ILE 256 Cb 0.20 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.55 3h55 s ILE 256 CO 0.39 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.92 3h55 n GLY 257 N 4.48 0.89 0.00 6.18 0.00 -1.26 -4.78 105.19 110.70 3h55 n GLY 257 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3h55 n GLY 257 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h55 n ASN 258 N 0.00 0.00 -0.04 1.61 3.02 -0.79 -4.74 115.26 114.32 3h55 n ASN 258 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 3h55 n ASN 258 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 3h55 n ASN 258 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3h55 n PHE 259 N 0.00 0.00 0.05 3.10 3.72 -1.26 -4.71 117.46 118.36 3h55 n PHE 259 Ca 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.41 3h55 n PHE 259 Cb 0.00 -0.48 -0.06 0.00 -0.94 0.00 0.00 39.48 37.99 3h55 n PHE 259 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3h55 h GLY 260 N 2.42 0.00 -5.94 1.37 0.00 -1.91 -3.47 103.07 95.55 3h55 h GLY 260 Ca -0.20 0.00 -0.64 0.00 0.00 0.00 0.00 47.33 46.49 3h55 h GLY 260 CO 0.01 0.00 -0.49 1.08 0.00 0.00 0.00 176.54 177.14 3h55 s LEU 261 N -5.87 4.29 1.04 3.11 1.43 -1.26 -4.38 118.68 117.04 3h55 s LEU 261 Ca -0.02 0.35 -0.15 0.00 -1.03 0.00 0.00 54.13 53.29 3h55 s LEU 261 Cb 0.09 -2.08 0.21 0.00 0.03 0.00 0.00 46.19 44.44 3h55 s LEU 261 CO 0.80 0.30 1.12 -0.94 0.23 0.00 0.00 176.35 177.86 3h55 s SER 262 N -0.37 2.28 0.14 2.29 1.04 -1.26 -4.79 113.70 113.03 3h55 s SER 262 Ca 0.12 0.90 -0.18 0.00 0.48 0.00 0.00 55.95 57.26 3h55 s SER 262 Cb -0.12 -1.38 0.01 0.00 0.10 0.00 0.00 66.02 64.63 3h55 s SER 262 CO 0.01 -3.31 1.73 0.25 0.98 0.00 0.00 173.24 172.90 3h55 h LEU 263 N -2.02 -0.00 -0.91 2.42 5.85 -1.99 -0.34 115.31 118.31 3h55 h LEU 263 Ca -0.50 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 3h55 h LEU 263 Cb 1.32 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 3h55 h LEU 263 CO 0.50 0.03 0.56 -0.33 -0.34 0.00 0.00 178.44 178.87 3h55 h GLU 264 N 0.15 1.23 -0.28 1.25 4.39 -1.92 -1.40 114.58 118.00 3h55 h GLU 264 Ca 0.12 -0.11 -0.11 0.00 0.34 0.00 0.00 59.36 59.61 3h55 h GLU 264 Cb 0.13 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 3h55 h GLU 264 CO -0.17 0.86 -0.30 1.96 -1.16 0.00 0.00 179.01 180.19 3h55 h GLN 265 N 1.26 0.58 -0.16 2.33 4.20 -1.50 0.03 115.11 121.84 3h55 h GLN 265 Ca 0.33 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 3h55 h GLN 265 Cb -0.07 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3h55 h GLN 265 CO -0.06 0.81 -0.00 0.77 -0.67 0.00 0.00 178.83 179.68 3h55 h SER 266 N 0.49 0.28 -0.90 1.46 0.02 -0.60 -0.20 113.55 114.11 3h55 h SER 266 Ca 0.06 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.71 3h55 h SER 266 Cb 0.77 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 63.19 3h55 h SER 266 CO 0.06 0.52 0.60 0.03 -1.14 0.00 0.00 176.83 176.90 3h55 h ARG 267 N 0.03 1.18 -0.05 3.45 3.08 -1.21 -2.66 114.38 118.19 3h55 h ARG 267 Ca 0.05 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 3h55 h ARG 267 Cb 0.38 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3h55 h ARG 267 CO 0.01 0.78 0.03 0.00 -1.07 0.00 0.00 179.97 179.71 3h55 h ALA 268 N 1.44 0.07 -0.80 0.04 0.00 -0.67 -2.09 119.26 117.25 3h55 h ALA 268 Ca 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3h55 h ALA 268 Cb -0.13 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3h55 h ALA 268 CO -0.07 -0.37 0.49 0.37 0.00 0.00 0.00 179.25 179.67 3h55 h GLN 269 N -0.03 1.09 -0.51 0.00 4.15 -0.94 -0.64 115.11 118.23 3h55 h GLN 269 Ca 0.02 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.35 3h55 h GLN 269 Cb 0.12 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 3h55 h GLN 269 CO -0.00 0.76 0.33 1.98 -1.93 0.00 0.00 178.83 179.97 3h55 h MET 270 N 1.10 0.67 -0.43 1.69 4.05 -1.41 -0.42 114.93 120.19 3h55 h MET 270 Ca 0.29 -0.04 -0.09 0.00 -0.28 0.00 0.00 59.70 59.57 3h55 h MET 270 Cb -0.05 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.58 3h55 h MET 270 CO -0.06 0.44 -0.10 0.00 0.23 0.00 0.00 176.91 177.43 3h55 h ALA 271 N 1.18 0.59 -0.14 0.39 0.00 -0.98 -2.18 119.26 118.11 3h55 h ALA 271 Ca 0.18 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 3h55 h ALA 271 Cb -0.07 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.57 3h55 h ALA 271 CO -0.04 0.47 -0.72 -0.07 0.00 0.00 0.00 179.25 178.89 3h55 h LEU 272 N 0.65 0.88 -1.19 0.00 3.38 -0.95 -1.21 115.31 116.88 3h55 h LEU 272 Ca 0.11 -0.63 0.01 0.00 0.09 0.00 0.00 57.88 57.45 3h55 h LEU 272 Cb 0.64 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3h55 h LEU 272 CO 0.04 1.37 0.53 -0.50 0.09 0.00 0.00 178.44 179.98 3h55 h TRP 273 N 0.45 1.03 -0.38 1.13 -0.00 -1.14 -2.02 115.95 115.02 3h55 h TRP 273 Ca -0.05 0.02 -0.07 0.00 -0.00 0.00 0.00 58.89 58.78 3h55 h TRP 273 Cb 1.36 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.16 30.16 3h55 h TRP 273 CO 0.09 0.65 -0.05 1.15 -0.00 0.00 0.00 178.44 180.29 3h55 h THR 274 N 1.10 1.27 0.00 1.49 2.02 -1.13 -1.14 112.91 116.52 3h55 h THR 274 Ca 0.30 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.37 3h55 h THR 274 Cb -0.11 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 3h55 h THR 274 CO -0.06 0.37 -0.06 -0.37 0.37 0.00 0.00 175.52 175.76 3h55 h VAL 275 N 0.53 0.15 -0.24 3.16 -1.51 -1.07 -2.58 116.25 114.69 3h55 h VAL 275 Ca 0.10 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 3h55 h VAL 275 Cb 0.55 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 3h55 h VAL 275 CO 0.03 0.06 0.00 0.18 -1.23 0.00 0.00 177.57 176.61 3h55 n LEU 276 N -3.18 1.59 -4.04 4.19 4.77 -0.77 -0.05 117.00 119.50 3h55 n LEU 276 Ca 0.01 -0.74 -0.30 0.00 -0.03 0.00 0.00 56.01 54.95 3h55 n LEU 276 Cb 0.35 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3h55 n LEU 276 CO 0.29 0.37 -0.10 0.00 -1.33 0.00 0.00 177.39 176.62 3h55 n ALA 277 N 0.32 -1.62 -2.10 -1.18 0.00 -0.97 -4.62 120.51 110.33 3h55 n ALA 277 Ca 0.13 -0.10 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 3h55 n ALA 277 Cb 0.28 -2.70 -0.03 0.00 0.00 0.00 0.00 19.45 17.00 3h55 n ALA 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h55 s ALA 278 N -3.60 3.28 0.33 0.00 0.00 -0.45 -4.72 121.76 116.59 3h55 s ALA 278 Ca 0.38 -0.10 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 3h55 s ALA 278 Cb -0.20 -2.81 -0.12 0.00 0.00 0.00 0.00 23.12 19.99 3h55 s ALA 278 CO 0.89 -0.06 1.30 -2.30 0.00 0.00 0.00 175.76 175.59 3h55 n PRO 279 N -1.35 2.10 -3.14 0.00 -0.02 -1.26 -4.80 135.00 126.53 3h55 n PRO 279 Ca 0.03 0.74 -0.44 0.00 -2.02 0.00 0.00 63.50 61.81 3h55 n PRO 279 Cb 0.54 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3h55 n PRO 279 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3h55 n LEU 280 N 1.00 5.83 -4.33 2.45 4.77 -0.87 -4.88 117.00 120.97 3h55 n LEU 280 Ca 0.06 -5.00 -0.45 0.00 -0.03 0.00 0.00 56.01 50.59 3h55 n LEU 280 Cb 0.35 -1.43 -0.07 0.00 -2.33 0.00 0.00 43.42 39.94 3h55 n LEU 280 CO 0.62 1.38 0.07 -0.76 -1.33 0.00 0.00 177.39 177.38 3h55 s LEU 281 N -1.35 5.87 0.77 2.23 1.43 -1.26 -1.61 118.68 124.76 3h55 s LEU 281 Ca 0.33 -1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 51.71 3h55 s LEU 281 Cb -0.04 -2.17 0.06 0.00 0.03 0.00 0.00 46.19 44.07 3h55 s LEU 281 CO -0.01 -0.75 1.09 -0.04 0.23 0.00 0.00 176.35 176.88 3h55 s MET 282 N 1.58 2.23 -0.41 1.70 -1.94 -0.01 -1.16 119.30 121.28 3h55 s MET 282 Ca 0.04 1.19 0.06 0.00 -1.71 0.00 0.00 55.69 55.26 3h55 s MET 282 Cb -0.27 -1.89 0.17 0.00 2.01 0.00 0.00 34.83 34.85 3h55 s MET 282 CO 0.04 -1.67 0.55 0.45 -0.01 0.00 0.00 175.02 174.38 3h55 s SER 283 N -3.35 -0.52 0.16 3.03 0.15 -1.23 -0.00 113.70 111.94 3h55 s SER 283 Ca 0.61 -1.29 -0.20 0.00 0.70 0.00 0.00 55.95 55.77 3h55 s SER 283 Cb -0.17 1.39 0.05 0.00 -1.71 0.00 0.00 66.02 65.58 3h55 s SER 283 CO 0.56 -0.18 0.54 0.28 1.20 0.00 0.00 173.24 175.64 3h55 s THR 284 N 1.48 0.02 -0.70 6.45 -1.32 -1.26 -3.97 115.64 116.33 3h55 s THR 284 Ca 0.19 -0.35 -0.27 0.00 -1.21 0.00 0.00 61.69 60.06 3h55 s THR 284 Cb -0.07 -1.21 0.02 0.00 -1.51 0.00 0.00 72.50 69.74 3h55 s THR 284 CO -0.06 -0.10 1.35 -0.62 -2.21 0.00 0.00 174.62 172.98 3h55 s ASP 285 N -2.80 6.07 0.23 8.08 -1.08 -1.26 -4.83 116.67 121.09 3h55 s ASP 285 Ca 0.04 -0.28 0.22 0.00 -0.52 0.00 0.00 52.55 52.01 3h55 s ASP 285 Cb -0.01 -2.56 0.95 0.00 -1.46 0.00 0.00 42.92 39.85 3h55 s ASP 285 CO -0.10 -1.87 1.67 0.18 0.52 0.00 0.00 175.17 175.57 3h55 n LEU 286 N 9.73 0.58 0.18 -1.34 4.77 -1.26 -1.83 117.00 127.83 3h55 n LEU 286 Ca 0.06 0.66 0.04 0.00 -0.03 0.00 0.00 56.01 56.74 3h55 n LEU 286 Cb 0.49 -0.59 0.28 0.00 -2.33 0.00 0.00 43.42 41.28 3h55 n LEU 286 CO 0.71 -0.57 0.63 0.03 -1.33 0.00 0.00 177.39 176.86 3h55 h ARG 287 N 0.00 0.00 0.00 3.23 3.08 -1.93 -3.34 114.38 115.42 3h55 h ARG 287 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3h55 h ARG 287 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3h55 h ARG 287 CO 0.00 0.42 0.00 0.25 -1.07 0.00 0.00 179.97 179.57 3h55 n THR 288 N -3.53 0.43 -1.70 2.04 -2.24 -0.92 -5.07 114.28 103.28 3h55 n THR 288 Ca -0.00 -0.54 -0.44 0.00 -2.27 0.00 0.00 64.05 60.80 3h55 n THR 288 Cb 0.55 0.91 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 3h55 n THR 288 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h55 n ILE 289 N -0.21 0.81 -1.51 2.28 3.06 -0.76 -4.96 119.36 118.07 3h55 n ILE 289 Ca 0.00 -0.20 -0.32 0.00 -2.50 0.00 0.00 62.75 59.73 3h55 n ILE 289 Cb 0.25 -1.67 0.06 0.00 0.54 0.00 0.00 39.64 38.82 3h55 n ILE 289 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3h55 s SER 290 N 0.48 4.97 0.24 9.51 1.04 -1.26 -4.88 113.70 123.80 3h55 s SER 290 Ca 0.68 1.80 -0.06 0.00 0.48 0.00 0.00 55.95 58.85 3h55 s SER 290 Cb -0.59 -2.52 0.29 0.00 0.10 0.00 0.00 66.02 63.29 3h55 s SER 290 CO 0.47 -1.72 1.89 0.00 0.98 0.00 0.00 173.24 174.86 3h55 h ALA 291 N -0.66 1.21 -0.65 5.32 0.00 -1.99 -1.33 119.26 121.16 3h55 h ALA 291 Ca -0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 3h55 h ALA 291 Cb 1.23 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3h55 h ALA 291 CO 0.54 0.46 0.34 0.37 0.00 0.00 0.00 179.25 180.96 3h55 h GLN 292 N 1.16 0.93 -0.04 0.00 4.15 -1.99 0.43 115.11 119.74 3h55 h GLN 292 Ca 0.36 -0.12 -0.16 0.00 0.77 0.00 0.00 58.65 59.50 3h55 h GLN 292 Cb 0.00 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 3h55 h GLN 292 CO -0.12 0.72 -0.70 -0.91 -1.93 0.00 0.00 178.83 175.89 3h55 h ASN 293 N 0.90 0.24 -0.45 -0.69 2.35 -1.90 -2.92 115.58 113.11 3h55 h ASN 293 Ca 0.23 -0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 3h55 h ASN 293 Cb 0.08 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3h55 h ASN 293 CO -0.03 0.86 0.14 -0.03 -1.65 0.00 0.00 177.43 176.72 3h55 h MET 294 N 0.14 0.69 -0.76 0.81 4.05 -0.88 -2.40 114.93 116.59 3h55 h MET 294 Ca -0.02 -0.15 0.12 0.00 -0.28 0.00 0.00 59.70 59.37 3h55 h MET 294 Cb 1.24 -0.10 -0.05 0.00 -0.80 0.00 0.00 31.60 31.89 3h55 h MET 294 CO 0.11 0.66 0.50 -0.44 0.23 0.00 0.00 176.91 177.97 3h55 h ASP 295 N 0.58 0.53 0.28 1.39 3.32 -0.88 0.06 116.42 121.69 3h55 h ASP 295 Ca 0.14 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 3h55 h ASP 295 Cb 0.26 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3h55 h ASP 295 CO -0.01 0.30 -0.14 0.40 -1.72 0.00 0.00 179.24 178.08 3h55 h ILE 296 N 0.57 0.73 0.00 0.35 2.04 -1.29 -2.90 117.51 117.01 3h55 h ILE 296 Ca 0.36 -0.66 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 3h55 h ILE 296 Cb 0.61 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3h55 h ILE 296 CO -0.13 0.13 -0.24 -0.07 0.00 0.00 0.00 178.15 177.84 3h55 h LEU 297 N -0.75 0.00 -2.95 1.44 3.38 -1.03 -2.90 115.31 112.50 3h55 h LEU 297 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3h55 h LEU 297 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3h55 h LEU 297 CO 0.06 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.83 3h55 n GLN 298 N -3.42 3.08 -1.63 1.13 6.02 -0.03 -4.93 117.38 117.61 3h55 n GLN 298 Ca -0.00 -2.56 -0.43 0.00 -0.01 0.00 0.00 57.00 54.00 3h55 n GLN 298 Cb 0.43 -1.59 -0.03 0.00 1.02 0.00 0.00 30.24 30.07 3h55 n GLN 298 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3h55 n ASN 299 N 0.97 3.64 -0.18 1.08 2.85 -1.09 -4.88 115.26 117.65 3h55 n ASN 299 Ca 0.21 0.56 -0.08 0.00 -0.11 0.00 0.00 54.58 55.16 3h55 n ASN 299 Cb 0.66 -1.52 0.06 0.00 1.24 0.00 0.00 39.78 40.22 3h55 n ASN 299 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3h55 h PRO 300 N 12.70 0.98 -0.40 1.20 0.11 -1.92 -1.84 132.00 142.83 3h55 h PRO 300 Ca -0.45 -0.31 -0.15 0.00 0.11 0.00 0.00 66.00 65.20 3h55 h PRO 300 Cb 1.24 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3h55 h PRO 300 CO 0.95 0.98 -0.36 1.25 -0.21 0.00 0.00 178.00 180.61 3h55 h LEU 301 N 0.89 0.99 -0.17 2.35 5.85 -1.91 -0.63 115.31 122.69 3h55 h LEU 301 Ca 0.16 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 58.47 3h55 h LEU 301 Cb 0.56 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3h55 h LEU 301 CO 0.03 1.24 -0.03 -0.03 -0.34 0.00 0.00 178.44 179.31 3h55 h MET 302 N 0.77 0.02 -0.49 1.25 4.05 -1.83 -0.57 114.93 118.13 3h55 h MET 302 Ca 0.07 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.46 3h55 h MET 302 Cb 0.95 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.72 3h55 h MET 302 CO 0.09 0.01 0.18 0.82 0.23 0.00 0.00 176.91 178.24 3h55 h ILE 303 N 0.02 1.22 -0.65 1.77 2.04 -1.28 -0.23 117.51 120.39 3h55 h ILE 303 Ca 0.08 -0.69 0.11 0.00 1.00 0.00 0.00 64.86 65.36 3h55 h ILE 303 Cb 0.12 0.76 -0.08 0.00 -0.74 0.00 0.00 36.82 36.87 3h55 h ILE 303 CO -0.16 0.26 0.21 0.50 0.00 0.00 0.00 178.15 178.95 3h55 h LYS 304 N 0.65 0.35 -0.17 2.37 3.64 -0.82 0.36 116.57 122.95 3h55 h LYS 304 Ca 0.16 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3h55 h LYS 304 Cb 0.22 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3h55 h LYS 304 CO -0.01 0.23 0.00 0.82 -2.27 0.00 0.00 179.45 178.23 3h55 h ILE 305 N 0.36 1.25 -0.91 2.00 2.04 -0.68 -2.52 117.51 119.05 3h55 h ILE 305 Ca 0.34 -0.83 0.04 0.00 1.00 0.00 0.00 64.86 65.41 3h55 h ILE 305 Cb 0.48 1.46 -0.06 0.00 -0.74 0.00 0.00 36.82 37.96 3h55 h ILE 305 CO -0.37 0.25 0.59 -1.13 0.00 0.00 0.00 178.15 177.48 3h55 h ASN 306 N 0.06 0.97 -0.25 1.72 -0.73 -0.33 -2.41 115.58 114.61 3h55 h ASN 306 Ca 0.05 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.22 3h55 h ASN 306 Cb 0.37 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 38.75 3h55 h ASN 306 CO 0.01 0.65 0.00 0.00 -0.37 0.00 0.00 177.43 177.72 3h55 n GLN 307 N -4.53 2.43 -1.68 6.67 1.13 0.12 -4.56 117.38 116.97 3h55 n GLN 307 Ca 0.12 -1.25 -0.46 0.00 -1.94 0.00 0.00 57.00 53.47 3h55 n GLN 307 Cb 0.11 -1.70 -0.04 0.00 0.11 0.00 0.00 30.24 28.72 3h55 n GLN 307 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3h55 n ASP 308 N 0.28 3.26 0.26 1.08 2.03 -0.91 -4.87 116.55 117.68 3h55 n ASP 308 Ca 0.11 1.07 0.15 0.00 0.52 0.00 0.00 54.79 56.64 3h55 n ASP 308 Cb 0.57 -1.44 0.86 0.00 -0.72 0.00 0.00 41.12 40.38 3h55 n ASP 308 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3h55 h PRO 309 N 6.34 0.00 0.00 -0.67 0.11 -1.92 -1.78 132.00 134.09 3h55 h PRO 309 Ca -0.45 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 3h55 h PRO 309 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3h55 h PRO 309 CO 0.90 0.00 -0.40 -0.07 -0.21 0.00 0.00 178.00 178.22 3h55 h LEU 310 N 0.00 0.00 0.07 2.35 3.38 -1.92 -3.47 115.31 115.72 3h55 h LEU 310 Ca 0.03 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.58 3h55 h LEU 310 Cb 0.16 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.95 3h55 h LEU 310 CO -0.00 0.40 -0.65 0.61 0.09 0.00 0.00 178.44 178.90 3h55 n GLY 311 N -0.27 -0.52 3.58 0.83 0.00 -0.67 -4.58 105.19 103.55 3h55 n GLY 311 Ca -0.02 0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3h55 n GLY 311 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h55 s ILE 312 N -3.20 4.93 0.27 -0.61 1.01 -1.26 -3.85 121.20 118.49 3h55 s ILE 312 Ca 0.46 0.65 -0.30 0.00 0.00 0.00 0.00 60.65 61.47 3h55 s ILE 312 Cb -0.22 -4.03 -0.10 0.00 0.01 0.00 0.00 42.46 38.12 3h55 s ILE 312 CO 0.57 -0.23 1.42 -1.58 0.00 0.00 0.00 174.94 175.12 3h55 s GLN 313 N 2.62 4.28 1.04 2.79 0.74 -1.26 -4.58 119.66 125.29 3h55 s GLN 313 Ca 0.24 2.30 -0.17 0.00 0.05 0.00 0.00 55.36 57.77 3h55 s GLN 313 Cb -0.15 -3.10 0.23 0.00 1.10 0.00 0.00 33.01 31.09 3h55 s GLN 313 CO 0.13 -0.38 1.25 0.20 -0.55 0.00 0.00 175.29 175.94 3h55 s GLY 314 N 0.18 1.71 0.06 2.59 0.00 0.92 -4.84 107.32 107.94 3h55 s GLY 314 Ca 0.57 -1.11 -0.00 0.00 0.00 0.00 0.00 44.72 44.18 3h55 s GLY 314 CO 0.46 -0.30 -0.04 0.50 0.00 0.00 0.00 173.10 173.72 3h55 s ARG 315 N -5.72 0.63 -0.13 2.90 0.52 -0.49 -4.79 118.95 111.86 3h55 s ARG 315 Ca 0.73 -1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 54.45 3h55 s ARG 315 Cb -0.06 0.11 -0.01 0.00 0.52 0.00 0.00 34.95 35.52 3h55 s ARG 315 CO 0.54 -0.09 1.03 0.50 0.02 0.00 0.00 175.30 177.31 3h55 s ARG 316 N -3.71 4.37 -0.01 3.54 3.52 -1.26 -0.39 118.95 125.01 3h55 s ARG 316 Ca 0.06 1.41 0.15 0.00 -0.13 0.00 0.00 55.73 57.21 3h55 s ARG 316 Cb 0.06 -3.57 -0.20 0.00 -1.56 0.00 0.00 34.95 29.68 3h55 s ARG 316 CO -0.08 -0.41 0.42 0.44 -0.81 0.00 0.00 175.30 174.86 3h55 n ILE 317 N 4.76 0.00 -3.75 4.11 -5.35 0.14 -4.94 119.36 114.34 3h55 n ILE 317 Ca 0.10 -0.28 -0.13 0.00 -0.27 0.00 0.00 62.75 62.17 3h55 n ILE 317 Cb 0.48 0.46 -0.10 0.00 -1.74 0.00 0.00 39.64 38.74 3h55 n ILE 317 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 3h55 s HIS 318 N -2.78 -0.34 -0.04 4.28 5.04 -0.98 -4.99 115.29 115.47 3h55 s HIS 318 Ca -0.02 0.77 -0.02 0.00 -1.54 0.00 0.00 55.06 54.26 3h55 s HIS 318 Cb 0.10 0.13 0.03 0.00 0.04 0.00 0.00 32.58 32.88 3h55 s HIS 318 CO 0.60 -0.26 0.05 0.21 -2.34 0.00 0.00 174.74 173.00 3h55 s LYS 319 N -0.28 0.02 0.17 2.88 2.20 -1.26 -0.77 119.74 122.71 3h55 s LYS 319 Ca -0.04 0.34 0.04 0.00 -0.36 0.00 0.00 55.97 55.94 3h55 s LYS 319 Cb -0.03 -0.58 -0.03 0.00 -1.51 0.00 0.00 37.83 35.67 3h55 s LYS 319 CO 0.02 -0.33 0.27 -1.21 -0.36 0.00 0.00 175.35 173.74 3h55 s GLU 320 N 2.14 3.33 0.50 4.03 0.41 -0.58 -5.00 118.70 123.53 3h55 s GLU 320 Ca 0.05 -0.69 0.32 0.00 -0.41 0.00 0.00 54.97 54.24 3h55 s GLU 320 Cb -0.12 -2.88 1.37 0.00 -1.78 0.00 0.00 34.13 30.72 3h55 s GLU 320 CO -0.03 0.49 1.95 1.57 -0.49 0.00 0.00 175.26 178.75 3h55 h LYS 321 N 1.98 0.00 0.00 1.61 2.10 -2.02 -1.48 116.57 118.76 3h55 h LYS 321 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 3h55 h LYS 321 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 3h55 h LYS 321 CO 0.66 0.00 0.00 -1.13 -2.00 0.00 0.00 179.45 176.98 3h55 n SER 322 N -2.90 0.00 -0.90 7.07 3.41 -1.26 -4.87 113.62 114.17 3h55 n SER 322 Ca 0.01 -0.59 -0.12 0.00 -0.26 0.00 0.00 58.87 57.91 3h55 n SER 322 Cb 0.27 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.17 3h55 n SER 322 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h55 n LEU 323 N -0.98 -0.86 -4.69 1.04 4.77 -0.56 -4.76 117.00 110.97 3h55 n LEU 323 Ca 0.13 0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 56.00 3h55 n LEU 323 Cb 0.06 -1.82 -0.06 0.00 -2.33 0.00 0.00 43.42 39.27 3h55 n LEU 323 CO 0.10 -0.60 0.26 -0.63 -1.33 0.00 0.00 177.39 175.18 3h55 s ILE 324 N -2.43 5.11 -0.01 -0.08 -1.09 -1.26 -1.07 121.20 120.37 3h55 s ILE 324 Ca 0.00 1.04 0.01 0.00 -2.23 0.00 0.00 60.65 59.47 3h55 s ILE 324 Cb 0.00 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 3h55 s ILE 324 CO 0.00 0.22 -0.00 -1.61 -1.23 0.00 0.00 174.94 172.32 3h55 s GLU 325 N 1.28 2.79 -0.14 2.79 2.02 0.92 -1.52 118.70 126.84 3h55 s GLU 325 Ca 0.27 -0.60 0.02 0.00 0.02 0.00 0.00 54.97 54.68 3h55 s GLU 325 Cb -0.16 -2.67 0.01 0.00 0.10 0.00 0.00 34.13 31.41 3h55 s GLU 325 CO 0.11 0.63 -0.21 0.08 0.02 0.00 0.00 175.26 175.89 3h55 s VAL 326 N -1.06 2.20 0.05 2.63 1.01 0.05 -0.22 120.40 125.07 3h55 s VAL 326 Ca 0.19 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3h55 s VAL 326 Cb -0.11 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3h55 s VAL 326 CO 0.09 0.54 -0.02 -0.31 0.00 0.00 0.00 175.10 175.40 3h55 s TYR 327 N 0.77 2.96 -0.02 5.22 1.51 -0.04 0.27 117.35 128.02 3h55 s TYR 327 Ca -0.08 -0.02 0.01 0.00 -1.01 0.00 0.00 57.07 55.97 3h55 s TYR 327 Cb -0.16 -1.57 0.02 0.00 -0.11 0.00 0.00 41.96 40.14 3h55 s TYR 327 CO -0.01 0.45 -0.00 1.41 -1.11 0.00 0.00 175.55 176.29 3h55 s MET 328 N -1.94 0.29 -0.13 -0.62 1.75 0.48 -1.22 119.30 117.92 3h55 s MET 328 Ca 0.22 0.04 0.02 0.00 -1.25 0.00 0.00 55.69 54.72 3h55 s MET 328 Cb -0.11 -0.44 0.01 0.00 2.84 0.00 0.00 34.83 37.13 3h55 s MET 328 CO 0.14 -0.10 -0.18 0.50 -0.65 0.00 0.00 175.02 174.73 3h55 s ARG 329 N 0.82 2.59 0.31 4.11 3.52 -0.06 -1.39 118.95 128.85 3h55 s ARG 329 Ca -0.08 -0.69 -0.29 0.00 -0.13 0.00 0.00 55.73 54.54 3h55 s ARG 329 Cb -0.12 -2.18 -0.10 0.00 -1.56 0.00 0.00 34.95 31.00 3h55 s ARG 329 CO -0.01 -0.08 1.18 -2.14 -0.81 0.00 0.00 175.30 173.43 3h55 s PRO 330 N 1.03 4.46 0.36 5.12 0.02 -1.26 -0.71 135.00 144.02 3h55 s PRO 330 Ca -0.04 1.95 0.04 0.00 0.02 0.00 0.00 61.00 62.97 3h55 s PRO 330 Cb -0.15 -3.08 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 3h55 s PRO 330 CO -0.04 0.00 0.07 -0.51 -0.33 0.00 0.00 177.00 176.19 3h55 s LEU 331 N -1.71 2.17 0.76 -5.54 1.43 -0.18 -4.60 118.68 111.00 3h55 s LEU 331 Ca 0.48 -1.47 -0.11 0.00 -1.03 0.00 0.00 54.13 52.00 3h55 s LEU 331 Cb -0.34 -0.36 0.05 0.00 0.03 0.00 0.00 46.19 45.57 3h55 s LEU 331 CO 0.45 -0.69 1.08 -0.94 0.23 0.00 0.00 176.35 176.48 3h55 s SER 332 N -3.55 4.69 -1.46 2.29 1.04 -1.26 -3.70 113.70 111.76 3h55 s SER 332 Ca 0.32 1.68 -0.03 0.00 0.48 0.00 0.00 55.95 58.40 3h55 s SER 332 Cb 0.07 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.75 3h55 s SER 332 CO 0.15 -1.89 0.34 0.59 0.98 0.00 0.00 173.24 173.41 3h55 n ASN 333 N -3.42 -5.54 -1.22 7.02 4.13 -1.26 -2.80 115.26 112.17 3h55 n ASN 333 Ca 0.08 -0.17 -0.16 0.00 1.68 0.00 0.00 54.58 56.02 3h55 n ASN 333 Cb 0.54 -4.45 -0.07 0.00 -1.54 0.00 0.00 39.78 34.26 3h55 n ASN 333 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 3h55 n LYS 334 N -3.34 -1.44 -2.44 3.52 5.02 -1.25 -4.81 118.16 113.42 3h55 n LYS 334 Ca -0.15 1.05 -0.26 0.00 -2.02 0.00 0.00 58.31 56.94 3h55 n LYS 334 Cb 0.63 -5.39 0.03 0.00 -0.02 0.00 0.00 35.03 30.29 3h55 n LYS 334 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h55 s ALA 335 N -2.42 3.36 0.04 7.82 0.00 -1.12 -4.46 121.76 124.98 3h55 s ALA 335 Ca 0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 3h55 s ALA 335 Cb 0.00 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.56 3h55 s ALA 335 CO 0.00 -0.81 0.02 -1.12 0.00 0.00 0.00 175.76 173.85 3h55 s SER 336 N -4.33 0.30 -0.14 0.00 0.01 0.17 -1.01 113.70 108.70 3h55 s SER 336 Ca 0.54 -0.70 -0.03 0.00 1.31 0.00 0.00 55.95 57.08 3h55 s SER 336 Cb -0.10 0.19 -0.03 0.00 0.21 0.00 0.00 66.02 66.29 3h55 s SER 336 CO 0.44 -0.50 -0.06 0.00 0.41 0.00 0.00 173.24 173.53 3h55 s ALA 337 N -2.86 2.93 -0.13 1.44 0.00 0.11 0.09 121.76 123.34 3h55 s ALA 337 Ca -0.03 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.11 3h55 s ALA 337 Cb 0.00 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 3h55 s ALA 337 CO -0.06 0.25 -0.17 -0.51 0.00 0.00 0.00 175.76 175.27 3h55 s LEU 338 N 0.27 2.46 -0.25 0.00 1.43 -0.41 -0.89 118.68 121.30 3h55 s LEU 338 Ca -0.04 -0.44 -0.03 0.00 -1.03 0.00 0.00 54.13 52.58 3h55 s LEU 338 Cb -0.14 -1.54 0.02 0.00 0.03 0.00 0.00 46.19 44.55 3h55 s LEU 338 CO 0.03 0.14 -0.02 -0.69 0.23 0.00 0.00 176.35 176.04 3h55 s VAL 339 N 0.50 3.24 -0.38 -1.59 1.01 -0.36 -0.61 120.40 122.22 3h55 s VAL 339 Ca -0.11 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.84 3h55 s VAL 339 Cb -0.16 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.61 3h55 s VAL 339 CO 0.05 0.21 0.53 -0.36 0.00 0.00 0.00 175.10 175.53 3h55 s PHE 340 N 1.40 3.15 -0.15 5.22 0.08 0.11 -0.86 117.98 126.92 3h55 s PHE 340 Ca 0.02 0.03 0.01 0.00 0.12 0.00 0.00 56.93 57.11 3h55 s PHE 340 Cb -0.16 -3.03 0.01 0.00 -0.57 0.00 0.00 43.02 39.27 3h55 s PHE 340 CO -0.03 -0.65 -0.19 0.12 -0.10 0.00 0.00 175.22 174.37 3h55 s PHE 341 N 2.46 2.73 -0.31 0.36 5.99 0.69 -0.67 117.98 129.22 3h55 s PHE 341 Ca 0.19 -1.30 -0.16 0.00 0.00 0.00 0.00 56.93 55.66 3h55 s PHE 341 Cb -0.15 -1.86 -0.02 0.00 0.00 0.00 0.00 43.02 40.98 3h55 s PHE 341 CO 0.15 -0.60 0.40 0.45 -0.00 0.00 0.00 175.22 175.61 3h55 s SER 342 N 0.92 6.24 0.00 6.13 0.15 -0.48 -0.06 113.70 126.60 3h55 s SER 342 Ca -0.04 0.03 0.18 0.00 0.70 0.00 0.00 55.95 56.82 3h55 s SER 342 Cb -0.15 -2.22 0.61 0.00 -1.71 0.00 0.00 66.02 62.55 3h55 s SER 342 CO -0.03 -0.30 1.46 0.00 1.20 0.00 0.00 173.24 175.56 3h55 s ARG 344 N -1.68 2.89 -0.16 0.00 0.52 -1.26 -4.82 118.95 114.43 3h55 s ARG 344 Ca 0.31 1.43 0.15 0.00 -0.52 0.00 0.00 55.73 57.10 3h55 s ARG 344 Cb 0.17 -1.96 0.43 0.00 0.52 0.00 0.00 34.95 34.11 3h55 s ARG 344 CO 0.24 -1.19 1.20 0.25 0.02 0.00 0.00 175.30 175.82 3h55 n THR 345 N -2.24 1.60 0.00 0.02 -2.24 -1.26 -2.82 114.28 107.34 3h55 n THR 345 Ca 0.11 -2.71 0.00 0.00 -2.27 0.00 0.00 64.05 59.18 3h55 n THR 345 Cb 0.52 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3h55 n THR 345 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h55 n ASP 346 N -0.63 0.00 -3.44 3.42 5.75 -1.26 -5.09 116.55 115.30 3h55 n ASP 346 Ca 0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.86 3h55 n ASP 346 Cb 0.84 -0.13 -0.01 0.00 -1.03 0.00 0.00 41.12 40.79 3h55 n ASP 346 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h55 s MET 347 N -0.70 1.95 0.35 0.11 0.23 -1.26 -4.97 119.30 115.01 3h55 s MET 347 Ca 0.00 -1.28 -0.26 0.00 -1.03 0.00 0.00 55.69 53.12 3h55 s MET 347 Cb 0.00 0.58 -0.13 0.00 -1.53 0.00 0.00 34.83 33.76 3h55 s MET 347 CO 0.00 -0.89 0.99 -2.30 -2.03 0.00 0.00 175.02 170.79 3h55 n PRO 348 N -0.49 1.33 -5.03 3.16 -0.02 -1.26 -4.27 135.00 128.42 3h55 n PRO 348 Ca -0.05 0.47 -0.31 0.00 -2.02 0.00 0.00 63.50 61.60 3h55 n PRO 348 Cb 0.60 -1.91 -0.17 0.00 -0.02 0.00 0.00 33.50 32.00 3h55 n PRO 348 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3h55 s TYR 349 N -1.17 2.34 -0.57 6.00 5.04 0.53 -4.95 117.35 124.57 3h55 s TYR 349 Ca 0.60 -0.97 -0.23 0.00 -2.44 0.00 0.00 57.07 54.03 3h55 s TYR 349 Cb -0.63 -1.59 0.05 0.00 0.35 0.00 0.00 41.96 40.14 3h55 s TYR 349 CO 0.59 -0.41 0.88 1.03 -1.34 0.00 0.00 175.55 176.30 3h55 s ARG 350 N 0.47 3.23 -0.32 4.97 0.52 -1.26 -1.03 118.95 125.53 3h55 s ARG 350 Ca -0.17 -0.54 -0.16 0.00 -0.52 0.00 0.00 55.73 54.34 3h55 s ARG 350 Cb -0.17 -4.11 -0.02 0.00 0.52 0.00 0.00 34.95 31.17 3h55 s ARG 350 CO 0.07 -1.51 0.43 -0.47 0.02 0.00 0.00 175.30 173.83 3h55 s TYR 351 N 3.70 3.21 -0.21 -0.53 5.04 0.22 -4.93 117.35 123.85 3h55 s TYR 351 Ca 0.25 0.22 -0.11 0.00 -2.44 0.00 0.00 57.07 54.99 3h55 s TYR 351 Cb -0.15 -2.74 -0.05 0.00 0.35 0.00 0.00 41.96 39.37 3h55 s TYR 351 CO 0.15 -0.40 0.18 -1.01 -1.34 0.00 0.00 175.55 173.13 3h55 s HIS 352 N 2.19 3.38 0.10 4.97 3.76 -1.26 -1.42 115.29 127.01 3h55 s HIS 352 Ca 0.16 0.35 -0.03 0.00 -0.15 0.00 0.00 55.06 55.38 3h55 s HIS 352 Cb -0.16 -2.25 0.01 0.00 1.11 0.00 0.00 32.58 31.29 3h55 s HIS 352 CO 0.12 0.18 0.19 0.45 -0.85 0.00 0.00 174.74 174.82 3h55 n SER 353 N 3.88 -0.54 -3.64 1.40 2.88 -0.68 -5.02 113.62 111.90 3h55 n SER 353 Ca -0.15 -1.45 -0.12 0.00 -1.33 0.00 0.00 58.87 55.82 3h55 n SER 353 Cb 0.52 0.93 -0.06 0.00 -0.75 0.00 0.00 64.21 64.85 3h55 n SER 353 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3h55 s SER 354 N -1.56 -0.28 0.38 -3.46 1.04 -1.26 -0.78 113.70 107.77 3h55 s SER 354 Ca 0.05 -0.11 0.07 0.00 0.48 0.00 0.00 55.95 56.44 3h55 s SER 354 Cb -0.01 0.45 0.76 0.00 0.10 0.00 0.00 66.02 67.32 3h55 s SER 354 CO 0.04 -0.74 1.96 -0.07 0.98 0.00 0.00 173.24 175.40 3h55 h LEU 355 N 2.73 0.39 -1.63 2.42 3.38 -1.72 -1.63 115.31 119.24 3h55 h LEU 355 Ca -0.32 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 3h55 h LEU 355 Cb 1.23 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 3h55 h LEU 355 CO 0.45 0.42 0.07 1.23 0.09 0.00 0.00 178.44 180.69 3h55 h GLY 356 N 0.68 0.33 2.00 0.83 0.00 -0.86 -0.79 103.07 105.26 3h55 h GLY 356 Ca 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3h55 h GLY 356 CO -0.00 0.14 0.00 1.46 0.00 0.00 0.00 176.54 178.14 3h55 h GLN 357 N 0.31 0.00 -0.50 4.80 4.20 -1.53 -3.09 115.11 119.29 3h55 h GLN 357 Ca 0.08 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.64 3h55 h GLN 357 Cb 0.10 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.79 3h55 h GLN 357 CO -0.01 0.00 0.12 1.28 -0.67 0.00 0.00 178.83 179.55 3h55 n LEU 358 N -2.37 4.95 -3.01 1.46 4.77 -0.36 -4.97 117.00 117.47 3h55 n LEU 358 Ca 0.04 -3.30 -0.18 0.00 -0.03 0.00 0.00 56.01 52.54 3h55 n LEU 358 Cb 0.39 -0.66 0.07 0.00 -2.33 0.00 0.00 43.42 40.89 3h55 n LEU 358 CO 0.28 0.88 0.17 0.59 -1.33 0.00 0.00 177.39 177.99 3h55 n ASN 359 N -0.53 -4.68 -4.89 -1.43 3.02 -0.99 -5.02 115.26 100.73 3h55 n ASN 359 Ca 0.33 -0.46 -0.32 0.00 -0.03 0.00 0.00 54.58 54.11 3h55 n ASN 359 Cb 1.16 -4.22 -0.05 0.00 -0.61 0.00 0.00 39.78 36.06 3h55 n ASN 359 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3h55 s PHE 360 N -3.27 3.46 0.34 3.10 0.08 -0.86 -5.03 117.98 115.81 3h55 s PHE 360 Ca 0.36 0.64 -0.26 0.00 0.12 0.00 0.00 56.93 57.79 3h55 s PHE 360 Cb -0.16 -2.07 -0.10 0.00 -0.57 0.00 0.00 43.02 40.12 3h55 s PHE 360 CO 0.59 0.40 0.98 0.99 -0.10 0.00 0.00 175.22 178.08 3h55 s THR 361 N -1.69 4.04 1.05 0.64 2.01 -1.26 -4.68 115.64 115.75 3h55 s THR 361 Ca 0.42 1.67 -0.12 0.00 0.31 0.00 0.00 61.69 63.97 3h55 s THR 361 Cb -0.12 -3.91 0.22 0.00 0.01 0.00 0.00 72.50 68.70 3h55 s THR 361 CO 0.24 0.11 1.07 -0.83 -0.69 0.00 0.00 174.62 174.52 3h55 s GLY 362 N -1.57 1.58 0.00 4.40 0.00 -1.26 -4.01 107.32 106.47 3h55 s GLY 362 Ca 0.52 -0.04 0.00 0.00 0.00 0.00 0.00 44.72 45.20 3h55 s GLY 362 CO 0.26 0.57 0.00 -1.14 0.00 0.00 0.00 173.10 172.79 3h55 n SER 363 N -4.50 0.00 -4.73 1.64 3.41 -1.26 -4.93 113.62 103.24 3h55 n SER 363 Ca 0.05 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 3h55 n SER 363 Cb 0.55 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 3h55 n SER 363 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3h55 s VAL 364 N -0.09 3.18 -0.15 -3.33 1.01 -1.26 -5.03 120.40 114.73 3h55 s VAL 364 Ca 0.00 0.94 -0.08 0.00 0.00 0.00 0.00 61.98 62.83 3h55 s VAL 364 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3h55 s VAL 364 CO 0.00 0.13 0.14 -0.63 0.00 0.00 0.00 175.10 174.74 3h55 s ILE 365 N 0.33 5.46 0.27 2.22 1.01 -1.26 -4.38 121.20 124.85 3h55 s ILE 365 Ca 0.59 0.21 0.11 0.00 0.00 0.00 0.00 60.65 61.55 3h55 s ILE 365 Cb -0.37 -3.43 -0.05 0.00 0.01 0.00 0.00 42.46 38.62 3h55 s ILE 365 CO 0.37 0.55 -0.10 -0.31 0.00 0.00 0.00 174.94 175.45 3h55 s TYR 366 N -0.46 2.51 0.02 3.97 2.02 0.10 -0.68 117.35 124.83 3h55 s TYR 366 Ca 0.12 -0.27 0.04 0.00 -0.37 0.00 0.00 57.07 56.59 3h55 s TYR 366 Cb -0.12 -1.10 -0.02 0.00 -0.40 0.00 0.00 41.96 40.32 3h55 s TYR 366 CO 0.02 0.66 -0.12 -2.00 -1.57 0.00 0.00 175.55 172.54 3h55 s GLU 367 N -3.57 0.84 -0.04 -0.62 2.12 0.19 -0.99 118.70 116.63 3h55 s GLU 367 Ca 0.31 -0.63 0.05 0.00 0.36 0.00 0.00 54.97 55.06 3h55 s GLU 367 Cb -0.06 -0.81 -0.01 0.00 0.26 0.00 0.00 34.13 33.52 3h55 s GLU 367 CO 0.17 0.20 -0.20 0.00 -0.54 0.00 0.00 175.26 174.90 3h55 s ALA 368 N -0.72 1.69 -0.19 6.30 0.00 0.88 -1.31 121.76 128.41 3h55 s ALA 368 Ca 0.01 -0.81 -0.04 0.00 0.00 0.00 0.00 51.96 51.12 3h55 s ALA 368 Cb -0.07 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3h55 s ALA 368 CO 0.01 0.34 -0.02 -1.14 0.00 0.00 0.00 175.76 174.94 3h55 s GLN 369 N -0.14 3.55 -0.09 0.00 0.74 0.01 -0.09 119.66 123.64 3h55 s GLN 369 Ca -0.01 -0.56 -0.29 0.00 0.05 0.00 0.00 55.36 54.55 3h55 s GLN 369 Cb -0.11 -3.01 -0.05 0.00 1.10 0.00 0.00 33.01 30.94 3h55 s GLN 369 CO 0.02 0.00 1.75 0.34 -0.55 0.00 0.00 175.29 176.85 3h55 s ASP 370 N 0.99 6.46 0.33 6.67 -1.08 0.23 -0.19 116.67 130.08 3h55 s ASP 370 Ca 0.01 2.14 0.03 0.00 -0.52 0.00 0.00 52.55 54.21 3h55 s ASP 370 Cb -0.14 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.36 3h55 s ASP 370 CO 0.01 -1.11 1.88 0.58 0.52 0.00 0.00 175.17 177.05 3h55 h VAL 371 N 5.85 1.20 0.16 1.11 2.07 -1.02 0.28 116.25 125.89 3h55 h VAL 371 Ca -0.40 -0.73 -0.36 0.00 0.82 0.00 0.00 66.70 66.04 3h55 h VAL 371 Cb 1.19 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3h55 h VAL 371 CO 0.96 0.26 -1.86 1.88 0.02 0.00 0.00 177.57 178.84 3h55 h TYR 372 N 0.60 0.60 0.00 1.57 0.05 -1.91 -3.40 116.97 114.48 3h55 h TYR 372 Ca 0.13 -0.44 -0.10 0.00 0.05 0.00 0.00 58.73 58.37 3h55 h TYR 372 Cb 0.27 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3h55 h TYR 372 CO 0.01 1.71 -1.27 -1.13 -1.05 0.00 0.00 178.16 176.44 3h55 n SER 373 N -3.53 0.84 0.00 3.88 3.41 -1.22 -4.96 113.62 112.04 3h55 n SER 373 Ca -0.28 0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3h55 n SER 373 Cb 1.06 0.29 0.00 0.00 -0.26 0.00 0.00 64.21 65.31 3h55 n SER 373 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h55 n GLY 374 N 1.31 1.80 3.76 5.00 0.00 0.08 -5.02 105.19 112.13 3h55 n GLY 374 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 3h55 n GLY 374 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h55 s ASP 375 N -3.38 5.86 -0.19 1.61 1.01 -1.26 -4.67 116.67 115.65 3h55 s ASP 375 Ca 0.00 2.64 -0.03 0.00 0.71 0.00 0.00 52.55 55.87 3h55 s ASP 375 Cb 0.00 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.29 3h55 s ASP 375 CO 0.00 -1.16 -0.07 -0.63 0.21 0.00 0.00 175.17 173.52 3h55 s ILE 376 N -1.34 3.29 -0.29 0.77 1.01 -1.26 -0.60 121.20 122.78 3h55 s ILE 376 Ca 0.64 -0.54 -0.07 0.00 0.00 0.00 0.00 60.65 60.68 3h55 s ILE 376 Cb -0.37 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.64 3h55 s ILE 376 CO 0.46 0.46 0.08 -0.63 0.00 0.00 0.00 174.94 175.31 3h55 s ILE 377 N 1.10 4.06 0.34 2.92 1.09 0.87 -4.98 121.20 126.60 3h55 s ILE 377 Ca 0.01 -0.57 0.09 0.00 -1.10 0.00 0.00 60.65 59.08 3h55 s ILE 377 Cb -0.15 -3.05 -0.05 0.00 -1.06 0.00 0.00 42.46 38.15 3h55 s ILE 377 CO -0.01 0.13 0.02 -0.55 -0.10 0.00 0.00 174.94 174.44 3h55 s SER 378 N 1.53 4.21 -0.96 3.58 0.15 -1.26 -0.08 113.70 120.86 3h55 s SER 378 Ca 0.04 -0.98 -0.06 0.00 0.70 0.00 0.00 55.95 55.64 3h55 s SER 378 Cb -0.17 -0.54 0.01 0.00 -1.71 0.00 0.00 66.02 63.61 3h55 s SER 378 CO 0.03 -0.25 0.84 0.61 1.20 0.00 0.00 173.24 175.67 3h55 n GLY 379 N -0.97 -0.11 3.49 9.45 0.00 -1.09 -4.98 105.19 110.98 3h55 n GLY 379 Ca -0.04 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 3h55 n GLY 379 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h55 s LEU 380 N -5.47 4.57 0.60 0.99 1.43 -0.17 -4.87 118.68 115.76 3h55 s LEU 380 Ca 0.40 -0.61 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 3h55 s LEU 380 Cb -0.18 -2.64 0.04 0.00 0.03 0.00 0.00 46.19 43.44 3h55 s LEU 380 CO 0.52 -1.00 0.86 -0.13 0.23 0.00 0.00 176.35 176.83 3h55 s ARG 381 N 3.15 2.52 0.33 1.70 0.52 -1.26 0.02 118.95 125.92 3h55 s ARG 381 Ca 0.22 -0.47 0.05 0.00 -0.52 0.00 0.00 55.73 55.01 3h55 s ARG 381 Cb -0.16 -2.36 0.70 0.00 0.52 0.00 0.00 34.95 33.65 3h55 s ARG 381 CO 0.16 -0.85 1.87 -0.44 0.02 0.00 0.00 175.30 176.05 3h55 h ASP 382 N -0.16 0.77 0.26 0.23 3.32 -1.90 -2.26 116.42 116.68 3h55 h ASP 382 Ca -0.44 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.65 3h55 h ASP 382 Cb 1.29 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3h55 h ASP 382 CO 0.57 0.41 -0.23 -1.84 -1.72 0.00 0.00 179.24 176.43 3h55 n GLU 383 N -4.57 0.81 -2.12 3.56 0.00 -1.26 -0.20 120.64 116.86 3h55 n GLU 383 Ca 0.17 -0.45 -0.42 0.00 0.00 0.00 0.00 57.16 56.46 3h55 n GLU 383 Cb 0.39 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.32 3h55 n GLU 383 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 3h55 s THR 384 N -2.50 3.69 0.08 3.84 2.01 -0.85 -4.98 115.64 116.93 3h55 s THR 384 Ca 0.25 0.92 -0.30 0.00 0.31 0.00 0.00 61.69 62.87 3h55 s THR 384 Cb 0.19 -3.59 -0.06 0.00 0.01 0.00 0.00 72.50 69.05 3h55 s THR 384 CO 0.51 -0.06 1.13 0.20 -0.69 0.00 0.00 174.62 175.72 3h55 s ASN 385 N 2.71 7.18 0.17 3.53 0.01 -1.26 -4.28 114.94 122.99 3h55 s ASN 385 Ca 0.68 1.97 0.06 0.00 -0.71 0.00 0.00 52.86 54.86 3h55 s ASN 385 Cb -0.31 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 38.72 3h55 s ASN 385 CO 0.26 -0.37 -0.12 0.72 -1.51 0.00 0.00 177.10 176.08 3h55 s PHE 386 N 0.71 1.48 -0.08 2.20 -0.12 0.04 -5.01 117.98 117.20 3h55 s PHE 386 Ca 0.55 -0.66 0.03 0.00 -0.05 0.00 0.00 56.93 56.81 3h55 s PHE 386 Cb -0.28 -0.72 0.01 0.00 -0.63 0.00 0.00 43.02 41.40 3h55 s PHE 386 CO 0.30 0.22 -0.18 0.99 -0.05 0.00 0.00 175.22 176.51 3h55 s THR 387 N -3.07 1.54 -0.07 -4.49 2.01 -1.26 -1.68 115.64 108.61 3h55 s THR 387 Ca 0.19 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.51 3h55 s THR 387 Cb 0.00 -1.36 -0.01 0.00 0.01 0.00 0.00 72.50 71.14 3h55 s THR 387 CO 0.04 0.44 -0.20 0.68 -0.69 0.00 0.00 174.62 174.89 3h55 s VAL 388 N 0.46 2.48 -0.38 3.82 -7.23 -0.51 -4.95 120.40 114.09 3h55 s VAL 388 Ca -0.15 -0.90 -0.17 0.00 -1.81 0.00 0.00 61.98 58.95 3h55 s VAL 388 Cb -0.16 -1.95 0.00 0.00 0.56 0.00 0.00 36.38 34.83 3h55 s VAL 388 CO 0.06 0.56 0.43 -0.63 -0.31 0.00 0.00 175.10 175.21 3h55 s ILE 389 N -0.15 5.09 -0.16 -0.62 1.01 -1.26 -0.61 121.20 124.50 3h55 s ILE 389 Ca -0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 3h55 s ILE 389 Cb -0.14 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 3h55 s ILE 389 CO 0.04 -0.27 -0.09 -0.63 0.00 0.00 0.00 174.94 173.99 3h55 s ILE 390 N 2.17 3.32 0.47 2.92 1.01 -0.20 -4.84 121.20 126.06 3h55 s ILE 390 Ca 0.14 -0.55 -0.19 0.00 0.00 0.00 0.00 60.65 60.04 3h55 s ILE 390 Cb -0.16 -2.44 -0.09 0.00 0.01 0.00 0.00 42.46 39.77 3h55 s ILE 390 CO 0.13 0.49 0.98 0.20 0.00 0.00 0.00 174.94 176.74 3h55 s ASN 391 N 0.66 6.68 0.43 3.58 0.01 -1.26 -0.35 114.94 124.70 3h55 s ASN 391 Ca -0.05 1.71 -0.26 0.00 -0.71 0.00 0.00 52.86 53.56 3h55 s ASN 391 Cb -0.15 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.89 3h55 s ASN 391 CO 0.02 -0.54 1.39 -2.16 -1.51 0.00 0.00 177.10 174.30 3h55 s PRO 392 N -3.46 3.79 -1.38 -0.60 0.04 -1.26 -1.14 135.00 130.98 3h55 s PRO 392 Ca 0.62 2.34 0.00 0.00 0.04 0.00 0.00 61.00 64.00 3h55 s PRO 392 Cb -0.11 -2.70 0.00 0.00 0.04 0.00 0.00 34.50 31.73 3h55 s PRO 392 CO 0.20 -0.70 0.00 -1.13 0.04 0.00 0.00 177.00 175.41 3h55 n SER 393 N -0.07 -4.13 -4.36 6.66 3.41 -0.94 -4.86 113.62 109.34 3h55 n SER 393 Ca 0.04 0.25 -0.29 0.00 -0.26 0.00 0.00 58.87 58.61 3h55 n SER 393 Cb 0.42 -3.63 -0.08 0.00 -0.26 0.00 0.00 64.21 60.67 3h55 n SER 393 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3h55 s GLY 394 N -2.13 2.86 0.15 5.00 0.00 -0.29 -3.31 107.32 109.59 3h55 s GLY 394 Ca 0.00 -0.74 0.04 0.00 0.00 0.00 0.00 44.72 44.02 3h55 s GLY 394 CO 0.00 -1.99 -0.08 -1.34 0.00 0.00 0.00 173.10 169.69 3h55 s VAL 395 N -3.06 1.04 -0.09 1.40 -7.23 -1.26 -1.38 120.40 109.82 3h55 s VAL 395 Ca 0.14 -2.03 0.04 0.00 -1.81 0.00 0.00 61.98 58.32 3h55 s VAL 395 Cb 0.01 -1.88 0.00 0.00 0.56 0.00 0.00 36.38 35.07 3h55 s VAL 395 CO 0.09 -0.71 -0.22 -0.69 -0.31 0.00 0.00 175.10 173.25 3h55 s VAL 396 N -3.41 1.94 -0.10 1.32 1.01 0.16 -4.75 120.40 116.56 3h55 s VAL 396 Ca 0.17 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.24 3h55 s VAL 396 Cb 0.04 -1.68 0.00 0.00 0.00 0.00 0.00 36.38 34.74 3h55 s VAL 396 CO 0.01 0.53 -0.22 -0.32 0.00 0.00 0.00 175.10 175.09 3h55 s MET 397 N 0.36 2.89 -0.06 2.72 1.75 -1.26 0.07 119.30 125.77 3h55 s MET 397 Ca -0.18 -0.82 0.03 0.00 -1.25 0.00 0.00 55.69 53.47 3h55 s MET 397 Cb -0.18 -2.21 -0.02 0.00 2.84 0.00 0.00 34.83 35.26 3h55 s MET 397 CO 0.08 0.15 -0.15 -1.58 -0.65 0.00 0.00 175.02 172.87 3h55 s TRP 398 N 0.42 2.70 -0.36 4.11 0.52 0.23 -0.35 118.94 126.21 3h55 s TRP 398 Ca -0.17 -0.25 -0.13 0.00 0.02 0.00 0.00 56.10 55.57 3h55 s TRP 398 Cb -0.18 -1.65 -0.01 0.00 -1.15 0.00 0.00 33.47 30.48 3h55 s TRP 398 CO 0.07 0.12 0.25 -0.47 0.02 0.00 0.00 176.95 176.94 3h55 s TYR 399 N -0.56 3.23 -0.09 -1.98 5.04 0.73 -1.29 117.35 122.43 3h55 s TYR 399 Ca 0.08 -0.32 0.02 0.00 -2.44 0.00 0.00 57.07 54.41 3h55 s TYR 399 Cb -0.11 -2.50 -0.02 0.00 0.35 0.00 0.00 41.96 39.68 3h55 s TYR 399 CO 0.01 -0.42 -0.15 -1.17 -1.34 0.00 0.00 175.55 172.48 3h55 s LEU 400 N 1.71 2.65 -0.05 6.97 2.96 0.11 -0.81 118.68 132.23 3h55 s LEU 400 Ca 0.06 -0.30 -0.11 0.00 -0.22 0.00 0.00 54.13 53.56 3h55 s LEU 400 Cb -0.18 -1.56 0.02 0.00 0.50 0.00 0.00 46.19 44.97 3h55 s LEU 400 CO 0.10 0.24 0.26 -0.72 -1.32 0.00 0.00 176.35 174.92 3h55 s TYR 401 N -0.12 -0.19 0.43 5.38 -0.85 -0.43 0.44 117.35 122.01 3h55 s TYR 401 Ca -0.02 0.40 -0.25 0.00 -0.52 0.00 0.00 57.07 56.68 3h55 s TYR 401 Cb -0.14 0.07 -0.08 0.00 0.38 0.00 0.00 41.96 42.20 3h55 s TYR 401 CO 0.04 -0.27 1.24 -2.14 -1.52 0.00 0.00 175.55 172.90 3h55 s PRO 402 N -0.71 3.86 0.02 -3.49 0.02 -1.26 -0.63 135.00 132.81 3h55 s PRO 402 Ca -0.08 1.99 0.08 0.00 0.02 0.00 0.00 61.00 63.01 3h55 s PRO 402 Cb -0.04 -2.61 -0.03 0.00 0.02 0.00 0.00 34.50 31.84 3h55 s PRO 402 CO 0.02 -0.53 -0.22 0.96 -0.33 0.00 0.00 177.00 176.90 3h55 s ILE 403 N -1.37 2.48 -2.89 2.83 -4.36 0.14 -4.82 121.20 113.22 3h55 s ILE 403 Ca 0.60 -1.20 0.25 0.00 -0.26 0.00 0.00 60.65 60.03 3h55 s ILE 403 Cb -0.34 -1.98 0.27 0.00 1.25 0.00 0.00 42.46 41.66 3h55 s ILE 403 CO 0.43 0.41 1.37 1.17 0.24 0.00 0.00 174.94 178.56