#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6o s THR 15 N 0.00 5.13 -1.39 5.09 -4.23 -1.26 -4.24 115.64 114.73 3h6o s THR 15 Ca 0.00 -0.92 -0.01 0.00 -1.18 0.00 0.00 61.69 59.58 3h6o s THR 15 Cb 0.00 -3.82 0.01 0.00 1.34 0.00 0.00 72.50 70.03 3h6o s THR 15 CO 0.00 -0.34 0.09 0.00 -0.54 0.00 0.00 174.62 173.82 3h6o n GLN 16 N -1.48 -2.34 -3.86 3.99 10.64 -0.08 -2.36 117.38 121.90 3h6o n GLN 16 Ca -0.08 0.78 -0.28 0.00 -1.83 0.00 0.00 57.00 55.59 3h6o n GLN 16 Cb 0.57 -5.43 0.03 0.00 -0.86 0.00 0.00 30.24 24.55 3h6o n GLN 16 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3h6o n GLN 17 N -3.05 -5.61 0.13 2.61 1.13 -1.26 -4.77 117.38 106.56 3h6o n GLN 17 Ca -0.17 0.62 0.01 0.00 -1.94 0.00 0.00 57.00 55.52 3h6o n GLN 17 Cb 0.64 -5.47 0.06 0.00 0.11 0.00 0.00 30.24 25.58 3h6o n GLN 17 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3h6o h LEU 18 N -2.10 0.00 0.23 1.08 3.38 -1.76 -0.61 115.31 115.52 3h6o h LEU 18 Ca -0.58 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.37 3h6o h LEU 18 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3h6o h LEU 18 CO 0.65 0.57 -0.11 -0.74 0.09 0.00 0.00 178.44 178.89 3h6o h HIS 19 N 0.00 -0.28 -0.34 1.13 2.76 -1.90 -3.03 115.15 113.48 3h6o h HIS 19 Ca -0.01 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.18 3h6o h HIS 19 Cb 1.36 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 30.40 3h6o h HIS 19 CO 0.00 -0.08 0.23 0.00 -1.30 0.00 0.00 177.93 176.78 3h6o h ALA 20 N 0.30 1.86 0.00 5.26 0.00 -1.73 -2.27 119.26 122.68 3h6o h ALA 20 Ca -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3h6o h ALA 20 Cb 0.34 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3h6o h ALA 20 CO 0.05 0.10 -0.10 0.00 0.00 0.00 0.00 179.25 179.30 3h6o h ALA 21 N 1.80 1.37 -0.01 0.00 0.00 -1.01 -2.43 119.26 118.98 3h6o h ALA 21 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h6o h ALA 21 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3h6o h ALA 21 CO -0.03 0.13 -0.10 -1.33 0.00 0.00 0.00 179.25 177.92 3h6o n MET 22 N -3.74 1.06 -2.00 0.00 2.81 -0.85 -4.61 117.12 109.78 3h6o n MET 22 Ca -0.02 -0.49 -0.42 0.00 -1.81 0.00 0.00 57.70 54.96 3h6o n MET 22 Cb 0.21 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.20 3h6o n MET 22 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h6o s ALA 23 N -2.28 3.67 -0.83 3.04 0.00 -0.92 -4.90 121.76 119.55 3h6o s ALA 23 Ca 0.33 1.33 0.26 0.00 0.00 0.00 0.00 51.96 53.88 3h6o s ALA 23 Cb 0.20 -3.58 0.97 0.00 0.00 0.00 0.00 23.12 20.72 3h6o s ALA 23 CO 0.43 -0.75 1.81 -0.25 0.00 0.00 0.00 175.76 177.00 3h6o n ASP 24 N 2.95 0.44 -4.25 0.00 8.00 -1.26 -4.79 116.55 117.64 3h6o n ASP 24 Ca 0.09 0.55 -0.16 0.00 0.71 0.00 0.00 54.79 55.98 3h6o n ASP 24 Cb 0.40 -0.67 -0.11 0.00 -0.02 0.00 0.00 41.12 40.73 3h6o n ASP 24 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3h6o s THR 25 N -3.08 1.26 0.15 -3.53 -4.23 -1.26 -5.06 115.64 99.90 3h6o s THR 25 Ca 0.11 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 58.66 3h6o s THR 25 Cb 0.14 -1.68 -0.10 0.00 1.34 0.00 0.00 72.50 72.20 3h6o s THR 25 CO 0.53 -0.58 1.42 0.15 -0.54 0.00 0.00 174.62 175.60 3h6o h PHE 26 N 3.13 0.83 -0.17 3.99 3.04 -1.99 -1.05 116.94 124.72 3h6o h PHE 26 Ca -0.38 -0.33 0.05 0.00 3.98 0.00 0.00 57.97 61.29 3h6o h PHE 26 Cb 1.20 -0.14 -0.05 0.00 2.56 0.00 0.00 35.95 39.51 3h6o h PHE 26 CO 0.66 1.11 -0.15 1.25 -2.02 0.00 0.00 178.31 179.15 3h6o h LEU 27 N 0.47 -0.47 -1.47 0.59 5.85 -1.99 -0.16 115.31 118.12 3h6o h LEU 27 Ca -0.01 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 3h6o h LEU 27 Cb 1.23 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.48 3h6o h LEU 27 CO 0.13 -0.19 -0.27 -0.08 -0.34 0.00 0.00 178.44 177.69 3h6o h GLU 28 N -0.17 0.00 -0.11 1.25 4.57 -1.95 -0.97 114.58 117.20 3h6o h GLU 28 Ca 0.11 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 3h6o h GLU 28 Cb 0.32 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3h6o h GLU 28 CO -0.27 0.27 0.07 1.25 -1.18 0.00 0.00 179.01 179.15 3h6o h HIS 29 N 0.00 0.14 -0.29 0.92 2.76 -0.44 -1.99 115.15 116.24 3h6o h HIS 29 Ca -0.00 0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.20 3h6o h HIS 29 Cb 0.48 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.37 3h6o h HIS 29 CO 0.00 0.10 0.10 0.52 -1.30 0.00 0.00 177.93 177.34 3h6o h MET 30 N 0.14 0.22 0.00 5.26 2.86 -0.37 -2.66 114.93 120.37 3h6o h MET 30 Ca 0.04 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3h6o h MET 30 Cb -0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 3h6o h MET 30 CO -0.01 0.14 -0.01 0.00 1.06 0.00 0.00 176.91 178.10 3h6o n ARG 32 N -3.86 1.05 -1.83 0.00 1.74 -0.76 -4.93 116.66 108.07 3h6o n ARG 32 Ca -0.03 -0.71 -0.42 0.00 -0.77 0.00 0.00 57.85 55.92 3h6o n ARG 32 Cb 0.09 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.02 3h6o n ARG 32 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3h6o s LEU 33 N -2.44 4.37 -0.18 0.55 1.43 -0.93 -4.38 118.68 117.10 3h6o s LEU 33 Ca 0.24 2.79 -0.03 0.00 -1.03 0.00 0.00 54.13 56.10 3h6o s LEU 33 Cb 0.19 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.86 3h6o s LEU 33 CO 0.51 -0.89 0.03 -0.62 0.23 0.00 0.00 176.35 175.62 3h6o s ASP 34 N 0.92 2.77 0.47 2.29 3.68 -1.26 -5.01 116.67 120.52 3h6o s ASP 34 Ca 0.69 -0.74 0.32 0.00 2.13 0.00 0.00 52.55 54.94 3h6o s ASP 34 Cb -0.47 -0.58 1.65 0.00 -1.45 0.00 0.00 42.92 42.07 3h6o s ASP 34 CO 0.37 -0.29 1.96 0.16 0.13 0.00 0.00 175.17 177.50 3h6o h ILE 35 N 6.49 0.00 -0.21 4.11 3.07 -2.02 -0.47 117.51 128.48 3h6o h ILE 35 Ca -0.17 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 66.17 3h6o h ILE 35 Cb 1.12 0.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.49 3h6o h ILE 35 CO 0.33 0.00 0.00 0.47 -1.05 0.00 0.00 178.15 177.90 3h6o n ASP 36 N -2.64 2.23 -4.47 2.16 10.43 -1.26 -4.77 116.55 118.23 3h6o n ASP 36 Ca -0.01 -1.80 -0.43 0.00 2.57 0.00 0.00 54.79 55.12 3h6o n ASP 36 Cb 0.09 -0.13 -0.08 0.00 1.84 0.00 0.00 41.12 42.84 3h6o n ASP 36 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3h6o s SER 37 N -1.59 6.21 0.26 -2.24 0.15 -0.19 -4.97 113.70 111.33 3h6o s SER 37 Ca 0.34 -0.78 -0.24 0.00 0.70 0.00 0.00 55.95 55.98 3h6o s SER 37 Cb 0.19 -2.25 -0.09 0.00 -1.71 0.00 0.00 66.02 62.17 3h6o s SER 37 CO 0.28 -0.69 0.84 -2.16 1.20 0.00 0.00 173.24 172.72 3h6o s PRO 38 N 2.28 4.48 1.10 5.44 0.04 -1.26 -4.54 135.00 142.55 3h6o s PRO 38 Ca 0.13 1.15 -0.14 0.00 0.04 0.00 0.00 61.00 62.19 3h6o s PRO 38 Cb -0.18 -2.92 0.24 0.00 0.04 0.00 0.00 34.50 31.69 3h6o s PRO 38 CO 0.13 0.37 1.06 -1.25 0.04 0.00 0.00 177.00 177.36 3h6o s PRO 39 N -1.86 -0.42 1.01 0.56 0.04 -1.26 -0.90 135.00 132.18 3h6o s PRO 39 Ca 0.45 0.53 -0.16 0.00 0.04 0.00 0.00 61.00 61.86 3h6o s PRO 39 Cb -0.19 -1.64 0.21 0.00 0.04 0.00 0.00 34.50 32.92 3h6o s PRO 39 CO 0.24 -3.31 1.21 0.96 0.04 0.00 0.00 177.00 176.14 3h6o s ILE 40 N -2.77 1.88 0.12 0.56 -4.36 -1.26 -4.73 121.20 110.64 3h6o s ILE 40 Ca 0.67 0.00 -0.09 0.00 -0.26 0.00 0.00 60.65 60.97 3h6o s ILE 40 Cb -0.20 -2.80 -0.17 0.00 1.25 0.00 0.00 42.46 40.55 3h6o s ILE 40 CO 0.60 0.00 1.31 0.74 0.24 0.00 0.00 174.94 177.83 3h6o h THR 41 N -1.85 1.31 -3.68 8.37 2.02 -1.91 -3.46 112.91 113.71 3h6o h THR 41 Ca -0.46 -2.14 -0.52 0.00 0.77 0.00 0.00 66.41 64.07 3h6o h THR 41 Cb 1.28 2.16 0.04 0.00 -1.74 0.00 0.00 68.15 69.89 3h6o h THR 41 CO 0.44 0.66 0.61 0.00 0.37 0.00 0.00 175.52 177.59 3h6o s ALA 42 N -3.56 3.49 -0.23 6.16 0.00 -1.26 -5.03 121.76 121.33 3h6o s ALA 42 Ca -0.09 1.12 -0.00 0.00 0.00 0.00 0.00 51.96 52.99 3h6o s ALA 42 Cb 0.09 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.79 3h6o s ALA 42 CO 0.89 -0.49 -0.10 0.50 0.00 0.00 0.00 175.76 176.56 3h6o s ARG 43 N -1.11 2.81 0.22 0.00 3.00 -1.26 -4.91 118.95 117.70 3h6o s ARG 43 Ca 0.51 -0.98 0.16 0.00 -1.00 0.00 0.00 55.73 54.41 3h6o s ARG 43 Cb -0.37 -2.88 0.01 0.00 0.00 0.00 0.00 34.95 31.71 3h6o s ARG 43 CO 0.45 -0.37 1.27 -0.91 0.00 0.00 0.00 175.30 175.74 3h6o h ASN 44 N 7.97 0.00 -3.33 -2.12 2.35 -1.91 -3.46 115.58 115.08 3h6o h ASN 44 Ca -0.34 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 54.81 3h6o h ASN 44 Cb 1.11 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.38 3h6o h ASN 44 CO 0.57 0.51 0.40 -0.89 -1.65 0.00 0.00 177.43 176.36 3h6o s THR 45 N -2.96 4.87 0.37 2.81 2.01 -1.26 -0.55 115.64 120.93 3h6o s THR 45 Ca 0.02 1.45 -0.27 0.00 0.31 0.00 0.00 61.69 63.20 3h6o s THR 45 Cb 0.08 -4.07 -0.10 0.00 0.01 0.00 0.00 72.50 68.42 3h6o s THR 45 CO 0.76 -0.05 1.35 -0.83 -0.69 0.00 0.00 174.62 175.16 3h6o s GLY 46 N 1.38 2.96 -0.19 4.40 0.00 -0.55 -4.84 107.32 110.48 3h6o s GLY 46 Ca 0.33 1.33 -0.04 0.00 0.00 0.00 0.00 44.72 46.34 3h6o s GLY 46 CO 0.08 1.96 -0.03 -0.42 0.00 0.00 0.00 173.10 174.69 3h6o s ILE 47 N -1.18 3.72 -0.17 0.90 1.01 -1.26 -1.37 121.20 122.85 3h6o s ILE 47 Ca 0.53 -0.40 -0.04 0.00 0.00 0.00 0.00 60.65 60.74 3h6o s ILE 47 Cb -0.41 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 3h6o s ILE 47 CO 0.54 0.45 -0.02 -0.63 0.00 0.00 0.00 174.94 175.28 3h6o s ILE 48 N 0.87 3.93 -0.11 2.92 1.01 -0.54 -1.82 121.20 127.46 3h6o s ILE 48 Ca -0.00 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.35 3h6o s ILE 48 Cb -0.14 -2.74 0.00 0.00 0.01 0.00 0.00 42.46 39.59 3h6o s ILE 48 CO 0.02 0.47 -0.23 0.00 0.00 0.00 0.00 174.94 175.19 3h6o s THR 50 N 0.41 4.50 -0.10 0.00 2.01 -0.28 -0.00 115.64 122.19 3h6o s THR 50 Ca -0.17 1.88 -0.02 0.00 0.31 0.00 0.00 61.69 63.68 3h6o s THR 50 Cb -0.18 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 3h6o s THR 50 CO 0.07 0.39 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.76 3h6o s ILE 51 N -0.35 4.26 0.00 1.82 -1.09 -0.79 -2.28 121.20 122.77 3h6o s ILE 51 Ca 0.42 -0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.58 3h6o s ILE 51 Cb -0.23 -2.80 0.00 0.00 -1.58 0.00 0.00 42.46 37.85 3h6o s ILE 51 CO 0.27 0.59 0.00 0.61 -1.23 0.00 0.00 174.94 175.18 3h6o n GLY 52 N 2.38 3.78 0.34 6.18 0.00 -1.21 -4.74 105.19 111.91 3h6o n GLY 52 Ca -0.18 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.17 3h6o n GLY 52 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3h6o h PRO 53 N 0.00 0.29 0.00 1.61 0.11 -1.74 -2.08 132.00 130.18 3h6o h PRO 53 Ca 0.00 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 3h6o h PRO 53 Cb 0.00 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 3h6o h PRO 53 CO 0.00 0.19 -0.17 0.00 -0.21 0.00 0.00 178.00 177.81 3h6o h ALA 54 N 1.75 1.07 0.00 -0.75 0.00 -1.49 -3.38 119.26 116.46 3h6o h ALA 54 Ca 0.22 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 54 Cb 0.48 -0.03 -0.33 0.00 0.00 0.00 0.00 17.79 17.91 3h6o h ALA 54 CO -0.05 0.22 -0.94 -1.13 0.00 0.00 0.00 179.25 177.35 3h6o n SER 55 N -3.39 0.79 -0.00 0.00 3.41 -0.81 -4.88 113.62 108.74 3h6o n SER 55 Ca -0.00 -1.99 0.04 0.00 -0.26 0.00 0.00 58.87 56.65 3h6o n SER 55 Cb 0.37 -0.26 -0.06 0.00 -0.26 0.00 0.00 64.21 64.00 3h6o n SER 55 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3h6o n ARG 56 N 0.42 0.33 -1.93 4.33 0.63 -1.07 -4.48 116.66 114.89 3h6o n ARG 56 Ca 0.04 -0.07 -0.36 0.00 -0.92 0.00 0.00 57.85 56.54 3h6o n ARG 56 Cb 1.07 -1.19 0.04 0.00 0.45 0.00 0.00 32.46 32.83 3h6o n ARG 56 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3h6o s SER 57 N -2.97 5.01 0.20 6.15 1.04 -1.26 -4.82 113.70 117.04 3h6o s SER 57 Ca -0.03 2.45 -0.11 0.00 0.48 0.00 0.00 55.95 58.75 3h6o s SER 57 Cb 0.05 -2.60 0.21 0.00 0.10 0.00 0.00 66.02 63.78 3h6o s SER 57 CO 0.34 -1.72 1.79 0.58 0.98 0.00 0.00 173.24 175.21 3h6o h VAL 58 N 0.77 0.93 -0.21 5.02 2.07 -1.94 -1.84 116.25 121.06 3h6o h VAL 58 Ca -0.51 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 66.86 3h6o h VAL 58 Cb 1.31 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3h6o h VAL 58 CO 0.54 0.10 -0.06 -0.33 0.02 0.00 0.00 177.57 177.85 3h6o h GLU 59 N 0.57 -0.01 -0.36 1.57 3.07 -1.95 -1.77 114.58 115.72 3h6o h GLU 59 Ca 0.27 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 59.04 3h6o h GLU 59 Cb 0.20 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 3h6o h GLU 59 CO -0.19 -0.00 -0.18 1.15 -1.40 0.00 0.00 179.01 178.38 3h6o h THR 60 N -0.01 1.26 -0.63 1.13 2.02 -1.88 -3.14 112.91 111.66 3h6o h THR 60 Ca 0.10 -1.23 -0.09 0.00 0.77 0.00 0.00 66.41 65.96 3h6o h THR 60 Cb 0.16 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3h6o h THR 60 CO -0.22 0.41 0.04 -0.07 0.37 0.00 0.00 175.52 176.05 3h6o h LEU 61 N 0.59 1.05 -0.83 2.58 3.38 -0.90 0.39 115.31 121.57 3h6o h LEU 61 Ca 0.09 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.83 3h6o h LEU 61 Cb 0.64 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3h6o h LEU 61 CO 0.05 1.08 0.52 0.11 0.09 0.00 0.00 178.44 180.29 3h6o h LYS 62 N 1.00 0.96 -0.08 1.13 1.57 -1.32 -1.14 116.57 118.70 3h6o h LYS 62 Ca 0.18 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 3h6o h LYS 62 Cb 0.52 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3h6o h LYS 62 CO 0.02 0.63 -0.55 0.93 -0.57 0.00 0.00 179.45 179.92 3h6o h GLU 63 N 0.99 0.22 -0.81 3.15 4.39 -1.43 -0.87 114.58 120.22 3h6o h GLU 63 Ca 0.35 -0.14 0.02 0.00 0.34 0.00 0.00 59.36 59.92 3h6o h GLU 63 Cb 0.08 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 3h6o h GLU 63 CO -0.14 0.72 0.53 0.52 -1.16 0.00 0.00 179.01 179.48 3h6o h MET 64 N 0.17 1.02 0.15 2.33 2.86 -0.48 -0.80 114.93 120.18 3h6o h MET 64 Ca 0.00 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3h6o h MET 64 Cb 1.03 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.46 3h6o h MET 64 CO 0.08 0.68 -0.07 0.82 1.06 0.00 0.00 176.91 179.48 3h6o h ILE 65 N 1.06 1.00 -0.80 -1.22 2.04 -1.00 0.19 117.51 118.79 3h6o h ILE 65 Ca 0.31 -0.92 0.14 0.00 1.00 0.00 0.00 64.86 65.38 3h6o h ILE 65 Cb -0.07 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.51 3h6o h ILE 65 CO -0.09 0.21 0.52 0.11 0.00 0.00 0.00 178.15 178.91 3h6o h LYS 66 N -0.66 0.53 0.00 2.37 1.57 -1.16 -1.14 116.57 118.07 3h6o h LYS 66 Ca -0.02 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 3h6o h LYS 66 Cb 0.49 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3h6o h LYS 66 CO 0.03 0.35 -0.44 0.77 -0.57 0.00 0.00 179.45 179.59 3h6o h SER 67 N 0.54 0.00 0.00 0.86 0.02 -1.08 -3.47 113.55 110.43 3h6o h SER 67 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 3h6o h SER 67 Cb 0.74 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.28 3h6o h SER 67 CO -0.15 0.44 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 3h6o n GLY 68 N 0.16 -0.34 3.67 -3.77 0.00 -0.43 -4.34 105.19 100.12 3h6o n GLY 68 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3h6o n GLY 68 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h6o s MET 69 N 0.00 4.17 -0.13 1.61 0.00 0.01 -4.47 119.30 120.49 3h6o s MET 69 Ca 0.00 2.34 0.17 0.00 0.00 0.00 0.00 55.69 58.20 3h6o s MET 69 Cb 0.00 -3.96 -0.25 0.00 0.00 0.00 0.00 34.83 30.62 3h6o s MET 69 CO 0.00 -0.85 0.19 0.09 0.00 0.00 0.00 175.02 174.44 3h6o n ASN 70 N 6.94 0.50 -3.81 1.11 5.03 -0.76 -4.64 115.26 119.63 3h6o n ASN 70 Ca 0.18 0.00 -0.14 0.00 0.87 0.00 0.00 54.58 55.48 3h6o n ASN 70 Cb 0.42 1.26 -0.15 0.00 -1.02 0.00 0.00 39.78 40.29 3h6o n ASN 70 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3h6o s VAL 71 N -2.75 -0.01 -0.44 2.41 1.01 -1.08 -1.55 120.40 117.98 3h6o s VAL 71 Ca -0.08 0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.90 3h6o s VAL 71 Cb 0.08 -0.08 0.06 0.00 0.00 0.00 0.00 36.38 36.43 3h6o s VAL 71 CO 0.77 0.07 0.32 0.00 0.00 0.00 0.00 175.10 176.26 3h6o s ALA 72 N 0.75 3.45 0.05 5.51 0.00 -0.06 -0.79 121.76 130.67 3h6o s ALA 72 Ca -0.06 -2.00 -0.22 0.00 0.00 0.00 0.00 51.96 49.68 3h6o s ALA 72 Cb -0.09 -2.88 -0.06 0.00 0.00 0.00 0.00 23.12 20.08 3h6o s ALA 72 CO -0.02 -1.62 0.65 0.50 0.00 0.00 0.00 175.76 175.27 3h6o s ARG 73 N 1.59 4.37 -0.20 0.00 3.52 1.00 -0.97 118.95 128.26 3h6o s ARG 73 Ca 0.04 0.87 0.01 0.00 -0.13 0.00 0.00 55.73 56.52 3h6o s ARG 73 Cb -0.22 -3.31 0.03 0.00 -1.56 0.00 0.00 34.95 29.89 3h6o s ARG 73 CO 0.06 0.45 -0.14 -0.51 -0.81 0.00 0.00 175.30 174.35 3h6o s LEU 74 N -0.55 2.34 -0.54 -0.88 1.43 -0.39 -1.89 118.68 118.20 3h6o s LEU 74 Ca 0.33 -0.83 -0.21 0.00 -1.03 0.00 0.00 54.13 52.39 3h6o s LEU 74 Cb -0.20 -1.36 0.06 0.00 0.03 0.00 0.00 46.19 44.72 3h6o s LEU 74 CO 0.20 -0.09 0.73 0.21 0.23 0.00 0.00 176.35 177.64 3h6o s ASN 75 N 1.33 6.24 -0.01 2.29 3.84 -1.26 -1.07 114.94 126.30 3h6o s ASN 75 Ca 0.00 -0.85 0.02 0.00 0.21 0.00 0.00 52.86 52.24 3h6o s ASN 75 Cb -0.15 -2.34 0.07 0.00 -0.55 0.00 0.00 41.25 38.28 3h6o s ASN 75 CO -0.10 -1.04 0.94 0.49 -2.79 0.00 0.00 177.10 174.61 3h6o n PHE 76 N 6.61 0.12 -0.06 0.43 3.01 0.07 -3.15 117.46 124.50 3h6o n PHE 76 Ca -0.05 -0.05 0.05 0.00 1.01 0.00 0.00 57.45 58.41 3h6o n PHE 76 Cb 0.45 -0.04 0.41 0.00 -0.01 0.00 0.00 39.48 40.30 3h6o n PHE 76 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3h6o h SER 77 N 0.41 0.52 -4.69 4.37 0.02 -1.81 -3.35 113.55 109.02 3h6o h SER 77 Ca 0.00 -0.01 -0.28 0.00 -0.84 0.00 0.00 61.79 60.66 3h6o h SER 77 Cb 0.23 -0.12 -0.15 0.00 0.14 0.00 0.00 62.40 62.50 3h6o h SER 77 CO 0.01 0.37 -0.65 -1.00 -1.14 0.00 0.00 176.83 174.42 3h6o s HIS 78 N -5.54 1.20 0.00 3.45 3.76 -1.19 -4.98 115.29 112.00 3h6o s HIS 78 Ca -0.09 -1.09 0.00 0.00 -0.15 0.00 0.00 55.06 53.73 3h6o s HIS 78 Cb 0.18 -0.69 0.00 0.00 1.11 0.00 0.00 32.58 33.18 3h6o s HIS 78 CO 0.74 -0.30 0.00 0.41 -0.85 0.00 0.00 174.74 174.75 3h6o n GLY 79 N -0.25 1.30 3.93 -2.22 0.00 -1.26 -4.85 105.19 101.84 3h6o n GLY 79 Ca -0.05 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 3h6o n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h6o s THR 80 N -1.89 2.21 0.27 2.61 -4.23 -1.26 -4.92 115.64 108.43 3h6o s THR 80 Ca 0.00 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 3h6o s THR 80 Cb 0.00 -2.96 0.08 0.00 1.34 0.00 0.00 72.50 70.95 3h6o s THR 80 CO 0.00 0.00 1.72 0.45 -0.54 0.00 0.00 174.62 176.25 3h6o h HIS 81 N -0.74 0.69 -0.13 3.99 -0.00 -1.98 -1.87 115.15 115.11 3h6o h HIS 81 Ca -0.44 -0.13 -0.01 0.00 -0.00 0.00 0.00 60.37 59.79 3h6o h HIS 81 Cb 1.31 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 28.53 3h6o h HIS 81 CO 0.14 0.75 0.05 1.49 -0.00 0.00 0.00 177.93 180.36 3h6o h GLU 82 N 0.56 0.19 0.20 2.45 4.81 -1.98 0.20 114.58 121.02 3h6o h GLU 82 Ca 0.09 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3h6o h GLU 82 Cb 0.60 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 3h6o h GLU 82 CO 0.04 0.29 -0.45 -0.92 -0.73 0.00 0.00 179.01 177.24 3h6o h TYR 83 N 0.05 -1.30 -0.76 0.92 3.20 -1.92 -1.87 116.97 115.30 3h6o h TYR 83 Ca 0.04 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 3h6o h TYR 83 Cb 0.17 0.54 -0.04 0.00 1.54 0.00 0.00 36.73 38.94 3h6o h TYR 83 CO -0.02 -0.54 0.46 0.45 -1.64 0.00 0.00 178.16 176.88 3h6o h HIS 84 N -0.71 0.99 -0.83 -3.82 3.86 -1.33 -1.84 115.15 111.46 3h6o h HIS 84 Ca -0.02 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.33 3h6o h HIS 84 Cb 0.68 -0.33 -0.09 0.00 1.06 0.00 0.00 27.41 28.74 3h6o h HIS 84 CO -0.38 0.65 0.43 0.00 0.86 0.00 0.00 177.93 179.50 3h6o h ALA 85 N 1.47 1.22 0.01 2.45 0.00 -0.33 -2.12 119.26 121.96 3h6o h ALA 85 Ca 0.27 0.07 -0.19 0.00 0.00 0.00 0.00 54.91 55.07 3h6o h ALA 85 Cb -0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3h6o h ALA 85 CO -0.05 -0.06 -0.87 1.49 0.00 0.00 0.00 179.25 179.76 3h6o h GLU 86 N 0.64 0.11 -0.12 0.00 4.81 -0.55 -1.56 114.58 117.92 3h6o h GLU 86 Ca 0.44 -0.13 0.02 0.00 -0.13 0.00 0.00 59.36 59.56 3h6o h GLU 86 Cb 0.57 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 3h6o h GLU 86 CO -0.34 0.91 0.02 1.15 -0.73 0.00 0.00 179.01 180.02 3h6o h THR 87 N 0.06 0.94 -0.49 0.32 2.02 -0.95 0.37 112.91 115.18 3h6o h THR 87 Ca -0.03 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 3h6o h THR 87 Cb 1.51 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 3h6o h THR 87 CO 0.12 0.01 0.23 0.40 0.37 0.00 0.00 175.52 176.65 3h6o h ILE 88 N 0.07 1.20 -0.60 3.11 2.04 -1.39 0.17 117.51 122.10 3h6o h ILE 88 Ca 0.05 -0.57 0.09 0.00 1.00 0.00 0.00 64.86 65.44 3h6o h ILE 88 Cb 0.05 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 36.72 3h6o h ILE 88 CO -0.08 0.22 0.23 0.50 0.00 0.00 0.00 178.15 179.02 3h6o h LYS 89 N 0.65 0.40 -0.01 2.37 3.64 -1.10 -1.19 116.57 121.32 3h6o h LYS 89 Ca 0.17 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.39 3h6o h LYS 89 Cb 0.14 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3h6o h LYS 89 CO -0.02 0.26 -0.64 -0.91 -2.27 0.00 0.00 179.45 175.88 3h6o h ASN 90 N 0.41 0.07 -0.38 4.20 2.35 -0.40 -1.09 115.58 120.74 3h6o h ASN 90 Ca 0.30 -0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 55.90 3h6o h ASN 90 Cb 0.36 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 3h6o h ASN 90 CO -0.30 0.69 -0.14 0.58 -1.65 0.00 0.00 177.43 176.61 3h6o h VAL 91 N 0.04 1.26 -0.10 2.81 2.07 -0.31 -1.88 116.25 120.15 3h6o h VAL 91 Ca -0.01 -1.24 -0.17 0.00 0.82 0.00 0.00 66.70 66.10 3h6o h VAL 91 Cb 1.13 1.07 0.01 0.00 -1.52 0.00 0.00 31.29 31.98 3h6o h VAL 91 CO 0.09 0.43 -0.61 0.03 0.02 0.00 0.00 177.57 177.52 3h6o h ARG 92 N 0.75 0.59 -0.28 1.57 3.08 -1.13 -0.61 114.38 118.35 3h6o h ARG 92 Ca 0.12 -0.50 0.06 0.00 0.07 0.00 0.00 59.98 59.73 3h6o h ARG 92 Cb 0.65 0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.75 3h6o h ARG 92 CO 0.05 1.12 -0.17 1.15 -1.07 0.00 0.00 179.97 181.05 3h6o h THR 93 N 0.22 0.52 -0.37 2.04 2.02 -1.19 1.00 112.91 117.14 3h6o h THR 93 Ca -0.05 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 3h6o h THR 93 Cb 1.26 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 3h6o h THR 93 CO 0.13 0.00 0.12 0.00 0.37 0.00 0.00 175.52 176.13 3h6o h ALA 94 N 1.04 0.48 -0.10 6.16 0.00 -1.34 -2.32 119.26 123.18 3h6o h ALA 94 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h6o h ALA 94 Cb 0.36 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3h6o h ALA 94 CO -0.36 0.12 0.06 1.15 0.00 0.00 0.00 179.25 180.21 3h6o h THR 95 N 0.44 1.09 0.00 0.00 2.02 -0.95 -3.04 112.91 112.48 3h6o h THR 95 Ca 0.12 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 67.04 3h6o h THR 95 Cb 0.25 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3h6o h THR 95 CO -0.00 0.08 0.00 -0.62 0.37 0.00 0.00 175.52 175.35 3h6o n GLU 96 N -4.97 0.03 0.06 6.66 -0.58 0.33 -2.60 120.64 119.58 3h6o n GLU 96 Ca -0.05 0.13 0.08 0.00 -0.42 0.00 0.00 57.16 56.89 3h6o n GLU 96 Cb 0.07 -1.50 0.35 0.00 -0.57 0.00 0.00 31.44 29.79 3h6o n GLU 96 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3h6o n SER 97 N -1.48 0.29 -0.00 1.62 3.41 -0.88 -2.54 113.62 114.04 3h6o n SER 97 Ca 0.06 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.36 3h6o n SER 97 Cb 0.24 -0.65 -0.13 0.00 -0.26 0.00 0.00 64.21 63.41 3h6o n SER 97 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3h6o n PHE 98 N -1.84 0.02 0.29 7.33 3.72 -1.07 -4.67 117.46 121.24 3h6o n PHE 98 Ca 0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.58 3h6o n PHE 98 Cb 0.13 -0.24 0.85 0.00 -0.94 0.00 0.00 39.48 39.28 3h6o n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h6o h ALA 99 N 2.54 1.18 -0.80 4.37 0.00 -1.66 -3.16 119.26 121.73 3h6o h ALA 99 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.05 3h6o h ALA 99 Cb 0.73 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.43 3h6o h ALA 99 CO 0.00 -0.18 0.38 0.66 0.00 0.00 0.00 179.25 180.11 3h6o h SER 100 N 0.00 0.43 -3.47 0.00 4.64 -1.83 -3.29 113.55 110.03 3h6o h SER 100 Ca 0.00 0.09 -0.71 0.00 -0.47 0.00 0.00 61.79 60.71 3h6o h SER 100 Cb 0.38 0.03 -0.32 0.00 -0.31 0.00 0.00 62.40 62.18 3h6o h SER 100 CO 0.00 0.18 -0.46 -0.62 -0.87 0.00 0.00 176.83 175.06 3h6o s ASP 101 N -5.40 5.46 0.32 4.97 2.15 -1.20 -4.96 116.67 118.01 3h6o s ASP 101 Ca -0.12 -2.07 0.24 0.00 0.43 0.00 0.00 52.55 51.03 3h6o s ASP 101 Cb 0.21 -1.91 1.17 0.00 -0.30 0.00 0.00 42.92 42.09 3h6o s ASP 101 CO 0.77 -0.59 1.73 -0.65 -0.17 0.00 0.00 175.17 176.26 3h6o h PRO 102 N 8.12 0.00 -0.60 4.34 0.11 -1.84 -1.79 132.00 140.34 3h6o h PRO 102 Ca -0.15 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.88 3h6o h PRO 102 Cb 1.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 3h6o h PRO 102 CO 0.77 0.00 0.06 0.82 -0.21 0.00 0.00 178.00 179.43 3h6o h ILE 103 N 0.00 1.26 0.00 4.15 2.04 -1.93 -3.32 117.51 119.72 3h6o h ILE 103 Ca 0.00 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.80 3h6o h ILE 103 Cb 0.16 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3h6o h ILE 103 CO 0.00 0.39 -0.89 0.18 0.00 0.00 0.00 178.15 177.83 3h6o n LEU 104 N -4.26 0.83 -4.75 1.44 4.77 -0.74 -4.69 117.00 109.61 3h6o n LEU 104 Ca 0.03 -0.48 -0.42 0.00 -0.03 0.00 0.00 56.01 55.11 3h6o n LEU 104 Cb 0.31 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 3h6o n LEU 104 CO 0.43 0.21 1.27 -0.47 -1.33 0.00 0.00 177.39 177.50 3h6o s TYR 105 N -2.73 2.75 -0.19 -1.77 5.04 -0.81 -5.01 117.35 114.62 3h6o s TYR 105 Ca 0.06 0.71 -0.02 0.00 -2.44 0.00 0.00 57.07 55.39 3h6o s TYR 105 Cb 0.14 -4.09 0.00 0.00 0.35 0.00 0.00 41.96 38.35 3h6o s TYR 105 CO 0.75 -3.74 -0.11 1.03 -1.34 0.00 0.00 175.55 172.14 3h6o s ARG 106 N -0.32 3.23 0.58 4.97 0.52 -1.26 -4.82 118.95 121.85 3h6o s ARG 106 Ca 0.65 -0.71 -0.19 0.00 -0.52 0.00 0.00 55.73 54.95 3h6o s ARG 106 Cb -0.48 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.15 3h6o s ARG 106 CO 0.46 -0.15 1.21 -2.14 0.02 0.00 0.00 175.30 174.70 3h6o s PRO 107 N 1.28 3.05 -0.08 3.54 0.02 -1.26 -4.99 135.00 136.56 3h6o s PRO 107 Ca 0.03 1.84 -0.01 0.00 0.02 0.00 0.00 61.00 62.89 3h6o s PRO 107 Cb -0.14 -1.99 0.03 0.00 0.02 0.00 0.00 34.50 32.42 3h6o s PRO 107 CO -0.06 -1.15 -0.01 0.08 -0.33 0.00 0.00 177.00 175.54 3h6o s VAL 108 N -1.57 0.48 0.51 3.83 1.01 -1.26 -4.85 120.40 118.55 3h6o s VAL 108 Ca 0.76 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 62.71 3h6o s VAL 108 Cb -0.31 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 3h6o s VAL 108 CO 0.34 0.28 0.87 0.00 0.00 0.00 0.00 175.10 176.58 3h6o s ALA 109 N 1.93 3.29 -0.20 5.51 0.00 -0.60 -4.93 121.76 126.75 3h6o s ALA 109 Ca 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.71 3h6o s ALA 109 Cb -0.12 -2.78 0.02 0.00 0.00 0.00 0.00 23.12 20.24 3h6o s ALA 109 CO -0.06 -0.39 -0.15 0.08 0.00 0.00 0.00 175.76 175.23 3h6o s VAL 110 N -2.81 2.35 -0.18 0.00 1.01 -1.26 -0.88 120.40 118.62 3h6o s VAL 110 Ca 0.51 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.50 3h6o s VAL 110 Cb -0.10 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 3h6o s VAL 110 CO 0.45 0.44 -0.02 0.00 0.00 0.00 0.00 175.10 175.97 3h6o s ALA 111 N 1.31 3.00 -0.29 5.51 0.00 -0.14 -0.71 121.76 130.44 3h6o s ALA 111 Ca 0.03 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 50.90 3h6o s ALA 111 Cb -0.14 -1.68 -0.02 0.00 0.00 0.00 0.00 23.12 21.28 3h6o s ALA 111 CO -0.10 -0.01 0.46 -1.17 0.00 0.00 0.00 175.76 174.94 3h6o s LEU 112 N 0.76 4.13 -0.27 0.00 0.20 -0.33 -1.26 118.68 121.90 3h6o s LEU 112 Ca -0.01 0.29 -0.08 0.00 0.69 0.00 0.00 54.13 55.02 3h6o s LEU 112 Cb -0.14 -2.56 -0.03 0.00 -0.43 0.00 0.00 46.19 43.03 3h6o s LEU 112 CO 0.02 -0.30 0.11 -0.62 -0.29 0.00 0.00 176.35 175.27 3h6o s ASP 113 N 1.63 5.35 0.56 3.68 -1.08 -0.24 -0.68 116.67 125.90 3h6o s ASP 113 Ca 0.18 -0.26 -0.15 0.00 -0.52 0.00 0.00 52.55 51.80 3h6o s ASP 113 Cb -0.16 -1.97 -0.06 0.00 -1.46 0.00 0.00 42.92 39.28 3h6o s ASP 113 CO 0.10 -0.08 1.01 0.42 0.52 0.00 0.00 175.17 177.15 3h6o s THR 114 N 1.63 4.46 0.08 1.71 -4.23 -1.02 -0.75 115.64 117.53 3h6o s THR 114 Ca 0.06 1.07 -0.18 0.00 -1.18 0.00 0.00 61.69 61.46 3h6o s THR 114 Cb -0.16 -3.70 -0.09 0.00 1.34 0.00 0.00 72.50 69.90 3h6o s THR 114 CO 0.05 -0.79 1.48 0.50 -0.54 0.00 0.00 174.62 175.32 3h6o h LYS 115 N 0.48 0.49 0.00 3.99 3.64 -1.93 -3.41 116.57 119.82 3h6o h LYS 115 Ca -0.46 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 58.74 3h6o h LYS 115 Cb 1.19 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3h6o h LYS 115 CO 0.61 0.70 0.00 0.41 -2.27 0.00 0.00 179.45 178.90 3h6o n GLY 116 N -0.16 -1.30 3.75 5.01 0.00 -1.26 -4.88 105.19 106.34 3h6o n GLY 116 Ca -0.04 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.03 3h6o n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h6o s PRO 117 N -1.67 2.77 0.09 1.61 0.04 -1.26 -4.78 135.00 131.80 3h6o s PRO 117 Ca 0.00 1.81 -0.08 0.00 0.04 0.00 0.00 61.00 62.77 3h6o s PRO 117 Cb 0.00 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.63 3h6o s PRO 117 CO 0.00 -1.36 0.17 -1.21 0.04 0.00 0.00 177.00 174.64 3h6o s GLU 118 N -3.49 0.86 -0.15 4.56 2.02 -1.26 -4.97 118.70 116.26 3h6o s GLU 118 Ca 0.77 -1.02 0.02 0.00 0.02 0.00 0.00 54.97 54.75 3h6o s GLU 118 Cb -0.30 0.33 0.01 0.00 0.10 0.00 0.00 34.13 34.27 3h6o s GLU 118 CO 0.36 -0.27 -0.20 0.42 0.02 0.00 0.00 175.26 175.59 3h6o s ILE 119 N -3.88 2.19 0.40 -1.63 1.01 -1.26 -4.94 121.20 113.08 3h6o s ILE 119 Ca 0.07 -0.93 0.06 0.00 0.00 0.00 0.00 60.65 59.85 3h6o s ILE 119 Cb 0.05 -1.89 -0.07 0.00 0.01 0.00 0.00 42.46 40.56 3h6o s ILE 119 CO -0.09 0.54 0.02 -0.13 0.00 0.00 0.00 174.94 175.28 3h6o s ARG 120 N 0.91 1.91 0.00 2.79 1.81 -1.26 -0.72 118.95 124.39 3h6o s ARG 120 Ca -0.05 -2.10 0.00 0.00 -1.72 0.00 0.00 55.73 51.87 3h6o s ARG 120 Cb -0.15 -1.44 0.00 0.00 -0.45 0.00 0.00 34.95 32.91 3h6o s ARG 120 CO -0.03 -0.12 0.00 0.25 -0.68 0.00 0.00 175.30 174.72 3h6o n THR 121 N -0.93 0.00 -1.41 0.02 -2.24 -1.26 -3.18 114.28 105.28 3h6o n THR 121 Ca -0.06 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.45 3h6o n THR 121 Cb 0.67 -0.12 0.22 0.00 -2.10 0.00 0.00 70.33 69.00 3h6o n THR 121 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h6o n ASP 153 N -0.26 -1.05 0.25 3.42 5.68 -1.07 -4.95 116.55 118.56 3h6o n ASP 153 Ca 0.00 -1.28 0.12 0.00 -0.50 0.00 0.00 54.79 53.13 3h6o n ASP 153 Cb 0.00 -0.95 0.73 0.00 -1.14 0.00 0.00 41.12 39.77 3h6o n ASP 153 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3h6o h GLU 154 N 0.00 0.00 0.29 0.11 -0.00 -2.06 -3.21 114.58 109.70 3h6o h GLU 154 Ca -0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 58.95 3h6o h GLU 154 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.90 3h6o h GLU 154 CO 0.27 0.00 -0.14 -2.95 -0.00 0.00 0.00 179.01 176.19 3h6o h ASN 155 N 0.00 -0.33 -3.56 3.06 7.08 -2.11 -3.46 115.58 116.27 3h6o h ASN 155 Ca 0.03 0.01 -0.65 0.00 -3.08 0.00 0.00 56.30 52.60 3h6o h ASN 155 Cb 0.12 0.08 -0.33 0.00 -2.08 0.00 0.00 38.32 36.12 3h6o h ASN 155 CO -0.00 -0.10 -0.87 0.27 -2.08 0.00 0.00 177.43 174.65 3h6o s ILE 156 N -3.02 1.90 -0.09 6.14 -5.25 -1.21 -5.13 121.20 114.54 3h6o s ILE 156 Ca -0.06 -0.94 0.04 0.00 -0.99 0.00 0.00 60.65 58.70 3h6o s ILE 156 Cb 0.01 -1.64 -0.00 0.00 2.95 0.00 0.00 42.46 43.77 3h6o s ILE 156 CO 0.17 0.53 -0.24 -0.22 -1.79 0.00 0.00 174.94 173.39 3h6o s LEU 157 N 0.23 2.06 -0.11 0.37 2.96 -1.26 -2.61 118.68 120.32 3h6o s LEU 157 Ca -0.13 -0.53 -0.04 0.00 -0.22 0.00 0.00 54.13 53.20 3h6o s LEU 157 Cb -0.16 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 3h6o s LEU 157 CO 0.07 0.17 0.05 0.86 -1.32 0.00 0.00 176.35 176.18 3h6o s TRP 158 N 0.24 3.30 0.20 5.38 -0.00 -1.26 -5.11 118.94 121.69 3h6o s TRP 158 Ca -0.15 0.27 0.07 0.00 -0.00 0.00 0.00 56.10 56.29 3h6o s TRP 158 Cb -0.17 -1.86 -0.05 0.00 -0.00 0.00 0.00 33.47 31.39 3h6o s TRP 158 CO 0.07 0.51 -0.12 -0.48 -0.00 0.00 0.00 176.95 176.94 3h6o s LEU 159 N -0.78 2.52 0.00 5.86 0.05 -1.26 -4.58 118.68 120.48 3h6o s LEU 159 Ca 0.12 -1.05 0.24 0.00 0.05 0.00 0.00 54.13 53.50 3h6o s LEU 159 Cb -0.12 -0.57 0.34 0.00 -2.05 0.00 0.00 46.19 43.80 3h6o s LEU 159 CO 0.03 -0.25 1.31 -0.90 -0.55 0.00 0.00 176.35 175.99 3h6o n ASP 160 N -0.37 1.62 -4.49 1.48 5.68 -1.19 -4.85 116.55 114.43 3h6o n ASP 160 Ca -0.08 -1.27 -0.43 0.00 -0.50 0.00 0.00 54.79 52.52 3h6o n ASP 160 Cb 0.61 0.31 -0.04 0.00 -1.14 0.00 0.00 41.12 40.86 3h6o n ASP 160 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3h6o s TYR 161 N -2.47 2.75 0.35 2.11 6.04 -1.26 -4.93 117.35 119.93 3h6o s TYR 161 Ca 0.22 -0.23 0.08 0.00 0.04 0.00 0.00 57.07 57.18 3h6o s TYR 161 Cb 0.19 -4.14 0.65 0.00 -1.04 0.00 0.00 41.96 37.62 3h6o s TYR 161 CO 0.54 -1.46 1.83 0.87 -1.54 0.00 0.00 175.55 175.78 3h6o h LYS 162 N 9.41 0.24 -0.65 4.97 1.57 -2.02 -2.95 116.57 127.14 3h6o h LYS 162 Ca -0.27 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 3h6o h LYS 162 Cb 1.07 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.36 3h6o h LYS 162 CO 1.12 0.47 0.00 0.09 -0.57 0.00 0.00 179.45 180.57 3h6o n ASN 163 N -4.17 3.36 0.01 0.86 3.02 -1.26 -4.55 115.26 112.53 3h6o n ASN 163 Ca -0.01 -2.38 0.04 0.00 -0.03 0.00 0.00 54.58 52.20 3h6o n ASN 163 Cb 0.35 -0.51 0.42 0.00 -0.61 0.00 0.00 39.78 39.43 3h6o n ASN 163 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3h6o h ILE 164 N 2.44 1.11 -0.22 2.41 2.10 -1.95 -2.49 117.51 120.91 3h6o h ILE 164 Ca 0.00 -0.27 -0.01 0.00 1.08 0.00 0.00 64.86 65.66 3h6o h ILE 164 Cb 1.13 0.59 -0.01 0.00 -1.09 0.00 0.00 36.82 37.45 3h6o h ILE 164 CO 0.20 0.12 0.09 0.00 -1.08 0.00 0.00 178.15 177.48 3h6o h LYS 166 N 0.21 0.05 0.00 0.00 -0.00 -1.81 -3.16 116.57 111.86 3h6o h LYS 166 Ca 0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.72 3h6o h LYS 166 Cb 0.18 -0.01 0.00 0.00 -0.00 0.00 0.00 32.23 32.40 3h6o h LYS 166 CO -0.01 0.05 0.00 1.55 -0.00 0.00 0.00 179.45 181.04 3h6o n VAL 167 N -5.06 0.78 -4.38 0.07 3.14 -1.04 -4.80 118.33 107.05 3h6o n VAL 167 Ca -0.06 0.14 -0.25 0.00 -2.96 0.00 0.00 64.34 61.21 3h6o n VAL 167 Cb 0.04 -1.01 -0.12 0.00 -1.06 0.00 0.00 33.84 31.69 3h6o n VAL 167 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 3h6o s VAL 168 N -3.21 2.14 0.11 1.55 -7.23 -1.06 -4.59 120.40 108.11 3h6o s VAL 168 Ca 0.06 -1.94 0.04 0.00 -1.81 0.00 0.00 61.98 58.34 3h6o s VAL 168 Cb 0.10 -1.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.02 3h6o s VAL 168 CO 0.41 -0.15 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.32 3h6o s GLU 169 N -2.60 0.93 0.05 4.82 8.01 -1.26 -4.85 118.70 123.80 3h6o s GLU 169 Ca 0.18 -1.23 -0.33 0.00 0.01 0.00 0.00 54.97 53.60 3h6o s GLU 169 Cb -0.08 -0.64 -0.12 0.00 -4.31 0.00 0.00 34.13 28.98 3h6o s GLU 169 CO 0.08 0.10 1.80 1.33 0.01 0.00 0.00 175.26 178.58 3h6o n VAL 170 N 0.42 0.38 0.00 2.63 0.24 -1.26 -0.13 118.33 120.61 3h6o n VAL 170 Ca -0.15 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3h6o n VAL 170 Cb 0.58 -1.89 0.00 0.00 -1.47 0.00 0.00 33.84 31.06 3h6o n VAL 170 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h6o n GLY 171 N 4.10 2.30 3.77 7.63 0.00 -1.26 -5.09 105.19 116.63 3h6o n GLY 171 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3h6o n GLY 171 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6o s SER 172 N -0.65 5.64 0.01 1.61 0.01 0.81 -4.99 113.70 116.14 3h6o s SER 172 Ca 0.00 2.24 0.01 0.00 1.31 0.00 0.00 55.95 59.51 3h6o s SER 172 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 3h6o s SER 172 CO 0.00 -1.28 0.04 -0.54 0.41 0.00 0.00 173.24 171.88 3h6o s LYS 173 N -3.24 2.90 -0.09 12.44 1.02 -1.26 -4.41 119.74 127.11 3h6o s LYS 173 Ca 0.73 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 56.15 3h6o s LYS 173 Cb -0.26 -2.75 0.02 0.00 -0.52 0.00 0.00 37.83 34.32 3h6o s LYS 173 CO 0.29 0.63 -0.08 0.42 -0.92 0.00 0.00 175.35 175.68 3h6o s ILE 174 N -1.17 0.99 -0.02 2.17 1.01 0.10 -3.88 121.20 120.40 3h6o s ILE 174 Ca 0.22 -0.31 -0.02 0.00 0.00 0.00 0.00 60.65 60.54 3h6o s ILE 174 Cb -0.12 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.33 3h6o s ILE 174 CO 0.13 0.35 0.12 -0.31 0.00 0.00 0.00 174.94 175.22 3h6o s TYR 175 N 1.34 3.40 0.05 3.97 4.12 -0.06 -0.15 117.35 130.02 3h6o s TYR 175 Ca -0.02 0.29 0.07 0.00 0.02 0.00 0.00 57.07 57.42 3h6o s TYR 175 Cb -0.14 -1.79 -0.03 0.00 -1.52 0.00 0.00 41.96 38.49 3h6o s TYR 175 CO -0.04 0.60 -0.18 0.08 0.02 0.00 0.00 175.55 176.03 3h6o s VAL 176 N -1.20 1.47 -0.94 0.71 1.01 -0.34 -0.68 120.40 120.43 3h6o s VAL 176 Ca 0.23 -1.20 -0.08 0.00 0.00 0.00 0.00 61.98 60.93 3h6o s VAL 176 Cb -0.12 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 3h6o s VAL 176 CO 0.14 0.07 0.77 -0.67 0.00 0.00 0.00 175.10 175.41 3h6o n ASP 177 N 1.70 -6.44 -3.65 3.32 4.64 0.98 -1.63 116.55 115.47 3h6o n ASP 177 Ca -0.18 -0.62 -0.21 0.00 -1.38 0.00 0.00 54.79 52.40 3h6o n ASP 177 Cb 0.54 -4.27 0.04 0.00 -1.04 0.00 0.00 41.12 36.39 3h6o n ASP 177 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3h6o n ASP 178 N -2.50 -1.88 -0.03 1.67 9.92 -1.24 -2.11 116.55 120.38 3h6o n ASP 178 Ca -0.08 -0.81 -0.00 0.00 -0.53 0.00 0.00 54.79 53.36 3h6o n ASP 178 Cb 0.58 -4.16 -0.00 0.00 -0.64 0.00 0.00 41.12 36.90 3h6o n ASP 178 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3h6o n GLY 179 N -1.53 0.22 0.08 0.44 0.00 -1.24 -4.86 105.19 98.30 3h6o n GLY 179 Ca -0.27 -0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 3h6o n GLY 179 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h6o h LEU 180 N 0.00 0.11 -9.05 0.99 5.85 -1.25 -3.44 115.31 108.52 3h6o h LEU 180 Ca -0.01 -0.11 -0.68 0.00 0.84 0.00 0.00 57.88 57.93 3h6o h LEU 180 Cb 0.65 -0.03 -0.20 0.00 0.37 0.00 0.00 40.66 41.44 3h6o h LEU 180 CO 0.01 1.03 -0.80 -0.63 -0.34 0.00 0.00 178.44 177.71 3h6o s ILE 181 N -2.84 2.84 -0.01 4.05 1.01 -0.65 -4.71 121.20 120.90 3h6o s ILE 181 Ca -0.01 -1.38 0.01 0.00 0.00 0.00 0.00 60.65 59.27 3h6o s ILE 181 Cb 0.10 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.30 3h6o s ILE 181 CO 0.83 0.18 -0.04 -0.55 0.00 0.00 0.00 174.94 175.37 3h6o s SER 182 N -1.89 0.50 0.03 3.58 0.15 -0.88 -1.20 113.70 113.99 3h6o s SER 182 Ca 0.17 -0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.77 3h6o s SER 182 Cb -0.11 -0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.09 3h6o s SER 182 CO 0.08 0.02 -0.08 -0.76 1.20 0.00 0.00 173.24 173.71 3h6o s LEU 183 N 0.11 2.16 -0.18 3.45 1.43 0.79 -1.15 118.68 125.29 3h6o s LEU 183 Ca -0.01 -0.38 0.10 0.00 -1.03 0.00 0.00 54.13 52.81 3h6o s LEU 183 Cb -0.04 -0.30 -0.18 0.00 0.03 0.00 0.00 46.19 45.70 3h6o s LEU 183 CO -0.00 -0.06 -0.02 1.67 0.23 0.00 0.00 176.35 178.16 3h6o n GLN 184 N 2.04 1.06 0.00 1.70 7.27 -1.26 0.03 117.38 128.23 3h6o n GLN 184 Ca -0.18 0.03 0.00 0.00 0.07 0.00 0.00 57.00 56.92 3h6o n GLN 184 Cb 0.56 -1.42 0.00 0.00 2.41 0.00 0.00 30.24 31.79 3h6o n GLN 184 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 3h6o n GLU 198 N -2.77 0.00 -4.03 3.69 1.02 -0.30 -4.85 120.64 113.40 3h6o n GLU 198 Ca -0.30 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.53 3h6o n GLU 198 Cb 0.99 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 32.25 3h6o n GLU 198 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3h6o s ASN 199 N 0.00 3.28 0.66 1.62 0.02 -1.15 -4.96 114.94 114.41 3h6o s ASN 199 Ca 0.00 -0.80 0.00 0.00 -1.02 0.00 0.00 52.86 51.04 3h6o s ASN 199 Cb 0.00 -1.30 0.00 0.00 0.02 0.00 0.00 41.25 39.97 3h6o s ASN 199 CO 0.00 -0.10 0.00 0.61 0.02 0.00 0.00 177.10 177.63 3h6o n GLY 200 N 4.67 -0.25 0.00 0.66 0.00 -1.26 -2.07 105.19 106.93 3h6o n GLY 200 Ca -0.16 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.06 3h6o n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6o n GLY 201 N 5.00 2.29 2.35 -0.02 0.00 -1.26 -4.71 105.19 108.84 3h6o n GLY 201 Ca 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.30 3h6o n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h6o n GLY 208 N 0.00 -2.79 3.53 -0.02 0.00 -1.26 -5.10 105.19 99.55 3h6o n GLY 208 Ca 0.00 0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 3h6o n GLY 208 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h6o s VAL 209 N -0.30 3.76 -0.01 1.61 1.01 0.10 -0.01 120.40 126.56 3h6o s VAL 209 Ca -0.04 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.59 3h6o s VAL 209 Cb 0.00 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 3h6o s VAL 209 CO 0.10 0.54 -0.24 0.20 0.00 0.00 0.00 175.10 175.70 3h6o s ASN 210 N -0.15 3.27 -0.75 3.32 -0.87 0.14 -4.40 114.94 115.51 3h6o s ASN 210 Ca 0.02 -0.45 0.03 0.00 -1.57 0.00 0.00 52.86 50.90 3h6o s ASN 210 Cb -0.13 -0.42 0.22 0.00 -0.02 0.00 0.00 41.25 40.89 3h6o s ASN 210 CO 0.03 0.31 0.70 0.18 -2.57 0.00 0.00 177.10 175.75 3h6o n LEU 211 N 2.23 3.74 -4.67 0.60 4.77 -1.26 -0.89 117.00 121.52 3h6o n LEU 211 Ca -0.16 -5.28 -0.54 0.00 -0.03 0.00 0.00 56.01 50.00 3h6o n LEU 211 Cb 0.51 -0.83 -0.06 0.00 -2.33 0.00 0.00 43.42 40.71 3h6o n LEU 211 CO 0.24 1.82 1.21 -0.81 -1.33 0.00 0.00 177.39 178.52 3h6o n PRO 212 N 1.60 1.34 -1.06 3.23 -0.04 -1.25 -2.04 135.00 136.78 3h6o n PRO 212 Ca 0.24 0.49 -0.02 0.00 -0.04 0.00 0.00 63.50 64.17 3h6o n PRO 212 Cb 0.37 -2.19 -0.01 0.00 -0.04 0.00 0.00 33.50 31.64 3h6o n PRO 212 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h6o n GLY 213 N 3.67 0.51 3.80 0.55 0.00 -1.26 -4.70 105.19 107.76 3h6o n GLY 213 Ca 0.23 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3h6o n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o s ALA 214 N -1.86 3.63 -0.85 4.61 0.00 -0.87 -4.99 121.76 121.43 3h6o s ALA 214 Ca 0.00 -0.95 -0.23 0.00 0.00 0.00 0.00 51.96 50.78 3h6o s ALA 214 Cb 0.00 -1.52 0.07 0.00 0.00 0.00 0.00 23.12 21.66 3h6o s ALA 214 CO 0.00 0.75 1.23 0.00 0.00 0.00 0.00 175.76 177.74 3h6o s ALA 215 N -1.36 2.95 -0.18 0.00 0.00 -1.26 -4.78 121.76 117.13 3h6o s ALA 215 Ca 0.28 -2.05 -0.26 0.00 0.00 0.00 0.00 51.96 49.93 3h6o s ALA 215 Cb -0.12 -4.21 -0.01 0.00 0.00 0.00 0.00 23.12 18.78 3h6o s ALA 215 CO 0.21 -3.21 0.88 0.08 0.00 0.00 0.00 175.76 173.71 3h6o s VAL 216 N 4.48 4.83 -0.33 0.00 1.01 -1.26 -4.87 120.40 124.26 3h6o s VAL 216 Ca 0.35 1.72 0.12 0.00 0.00 0.00 0.00 61.98 64.17 3h6o s VAL 216 Cb -0.07 -4.18 0.73 0.00 0.00 0.00 0.00 36.38 32.86 3h6o s VAL 216 CO 0.01 -0.02 1.64 -0.90 0.00 0.00 0.00 175.10 175.82 3h6o n ASP 217 N 5.49 5.13 -4.61 3.32 5.68 -1.26 -4.96 116.55 125.34 3h6o n ASP 217 Ca 0.06 -2.88 -0.34 0.00 -0.50 0.00 0.00 54.79 51.13 3h6o n ASP 217 Cb 0.48 -0.68 0.12 0.00 -1.14 0.00 0.00 41.12 39.90 3h6o n ASP 217 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3h6o n LEU 218 N 0.43 3.02 -4.76 -2.12 4.77 -1.26 -4.93 117.00 112.16 3h6o n LEU 218 Ca 0.27 0.54 -0.36 0.00 -0.03 0.00 0.00 56.01 56.43 3h6o n LEU 218 Cb 1.14 -1.41 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 3h6o n LEU 218 CO 0.31 -2.27 0.83 -2.16 -1.33 0.00 0.00 177.39 172.77 3h6o s PRO 219 N -3.83 3.06 0.29 3.23 0.04 -1.26 -4.91 135.00 131.62 3h6o s PRO 219 Ca 0.69 1.77 0.02 0.00 0.04 0.00 0.00 61.00 63.52 3h6o s PRO 219 Cb -0.29 -1.95 0.70 0.00 0.04 0.00 0.00 34.50 33.00 3h6o s PRO 219 CO 0.55 -1.12 1.68 0.00 0.04 0.00 0.00 177.00 178.15 3h6o h ALA 220 N 0.95 1.33 -3.71 8.56 0.00 -1.92 -3.41 119.26 121.06 3h6o h ALA 220 Ca -0.50 0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.25 3h6o h ALA 220 Cb 1.29 0.22 -0.31 0.00 0.00 0.00 0.00 17.79 18.99 3h6o h ALA 220 CO 0.55 -0.39 -0.75 0.14 0.00 0.00 0.00 179.25 178.80 3h6o s VAL 221 N -5.92 0.35 1.10 0.00 -7.23 -1.26 -4.68 120.40 102.76 3h6o s VAL 221 Ca -0.12 -0.11 -0.18 0.00 -1.81 0.00 0.00 61.98 59.76 3h6o s VAL 221 Cb 0.25 -0.35 0.24 0.00 0.56 0.00 0.00 36.38 37.09 3h6o s VAL 221 CO 0.77 0.14 1.19 -0.94 -0.31 0.00 0.00 175.10 175.95 3h6o s SER 222 N 0.36 1.89 0.15 4.85 1.04 -1.26 -4.89 113.70 115.83 3h6o s SER 222 Ca -0.04 0.53 -0.15 0.00 0.48 0.00 0.00 55.95 56.78 3h6o s SER 222 Cb -0.07 -0.74 0.02 0.00 0.10 0.00 0.00 66.02 65.34 3h6o s SER 222 CO -0.00 -3.52 1.71 -0.33 0.98 0.00 0.00 173.24 172.08 3h6o h GLU 223 N -2.17 0.68 -0.54 4.02 3.07 -2.00 -2.83 114.58 114.81 3h6o h GLU 223 Ca -0.45 -0.11 0.02 0.00 -0.50 0.00 0.00 59.36 58.32 3h6o h GLU 223 Cb 1.28 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 3h6o h GLU 223 CO 0.38 0.60 0.33 -0.22 -1.40 0.00 0.00 179.01 178.70 3h6o h LYS 224 N 0.61 0.64 -0.98 2.33 3.64 -1.98 -2.52 116.57 118.31 3h6o h LYS 224 Ca 0.16 -0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.65 3h6o h LYS 224 Cb 0.16 -0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 31.74 3h6o h LYS 224 CO -0.02 0.42 0.59 -0.44 -2.27 0.00 0.00 179.45 177.74 3h6o h ASP 225 N 0.66 0.80 -0.15 4.20 3.32 -1.88 -1.41 116.42 121.97 3h6o h ASP 225 Ca 0.22 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.33 3h6o h ASP 225 Cb 0.01 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3h6o h ASP 225 CO -0.09 0.35 0.04 0.40 -1.72 0.00 0.00 179.24 178.22 3h6o h ILE 226 N 0.83 1.20 0.00 0.35 2.04 -1.21 0.67 117.51 121.38 3h6o h ILE 226 Ca 0.53 -0.62 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 3h6o h ILE 226 Cb 0.70 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 3h6o h ILE 226 CO -0.33 0.19 -0.22 1.56 0.00 0.00 0.00 178.15 179.34 3h6o h GLN 227 N 0.05 0.00 -0.13 2.37 7.50 -1.46 -1.76 115.11 121.67 3h6o h GLN 227 Ca 0.05 0.00 -0.17 0.00 0.50 0.00 0.00 58.65 59.03 3h6o h GLN 227 Cb 0.26 0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.79 3h6o h GLN 227 CO 0.00 0.22 -0.56 -0.44 -1.50 0.00 0.00 178.83 176.55 3h6o h ASP 228 N 0.00 0.72 -0.39 1.46 3.32 -0.84 -0.87 116.42 119.82 3h6o h ASP 228 Ca -0.00 -0.63 -0.04 0.00 0.02 0.00 0.00 57.03 56.38 3h6o h ASP 228 Cb 0.78 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 3h6o h ASP 228 CO 0.03 1.23 0.07 -0.07 -1.72 0.00 0.00 179.24 178.78 3h6o h LEU 229 N 0.26 0.61 -0.56 1.55 3.38 -0.86 -0.31 115.31 119.39 3h6o h LEU 229 Ca -0.03 -0.25 0.11 0.00 0.09 0.00 0.00 57.88 57.79 3h6o h LEU 229 Cb 1.20 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 3h6o h LEU 229 CO 0.12 0.71 0.01 0.50 0.09 0.00 0.00 178.44 179.86 3h6o h LYS 230 N 0.49 0.12 -0.72 1.13 3.64 -1.35 0.54 116.57 120.42 3h6o h LYS 230 Ca 0.12 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3h6o h LYS 230 Cb 0.35 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 3h6o h LYS 230 CO 0.01 0.08 0.45 0.35 -2.27 0.00 0.00 179.45 178.07 3h6o h PHE 231 N 0.13 0.93 -0.72 1.91 3.57 -0.97 -1.51 116.94 120.27 3h6o h PHE 231 Ca 0.29 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.81 3h6o h PHE 231 Cb 0.44 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3h6o h PHE 231 CO -0.33 0.61 0.47 0.78 -2.23 0.00 0.00 178.31 177.61 3h6o h GLY 232 N 0.98 1.02 0.98 2.40 0.00 0.14 0.21 103.07 108.79 3h6o h GLY 232 Ca 0.26 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3h6o h GLY 232 CO -0.05 0.35 -0.06 -2.08 0.00 0.00 0.00 176.54 174.69 3h6o h VAL 233 N 0.95 0.87 -0.87 4.60 2.07 -0.67 -0.58 116.25 122.62 3h6o h VAL 233 Ca 0.27 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.95 3h6o h VAL 233 Cb -0.08 0.87 -0.10 0.00 -1.52 0.00 0.00 31.29 30.46 3h6o h VAL 233 CO -0.07 0.00 0.45 -0.33 0.02 0.00 0.00 177.57 177.64 3h6o h GLU 234 N -0.17 0.60 -0.12 1.57 5.08 -0.82 -1.72 114.58 119.00 3h6o h GLU 234 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3h6o h GLU 234 Cb 0.14 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3h6o h GLU 234 CO 0.02 0.40 0.00 1.04 -1.00 0.00 0.00 179.01 179.47 3h6o n GLN 235 N -4.87 1.61 -3.66 2.33 1.13 0.68 -4.95 117.38 109.64 3h6o n GLN 235 Ca 0.18 -0.90 -0.24 0.00 -1.94 0.00 0.00 57.00 54.09 3h6o n GLN 235 Cb 0.46 -1.40 0.06 0.00 0.11 0.00 0.00 30.24 29.48 3h6o n GLN 235 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3h6o n ASP 236 N 0.12 -4.96 -4.75 1.08 2.03 -0.29 -4.97 116.55 104.82 3h6o n ASP 236 Ca 0.17 -0.63 -0.34 0.00 0.52 0.00 0.00 54.79 54.50 3h6o n ASP 236 Cb 0.29 -4.69 0.07 0.00 -0.72 0.00 0.00 41.12 36.07 3h6o n ASP 236 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3h6o s VAL 237 N -3.35 2.75 -0.08 5.18 -7.23 -0.84 -4.94 120.40 111.90 3h6o s VAL 237 Ca 0.48 0.37 0.14 0.00 -1.81 0.00 0.00 61.98 61.16 3h6o s VAL 237 Cb -0.22 -2.92 -0.18 0.00 0.56 0.00 0.00 36.38 33.61 3h6o s VAL 237 CO 0.76 -0.20 0.76 0.44 -0.31 0.00 0.00 175.10 176.56 3h6o h ASP 238 N -0.03 0.00 -5.06 4.85 3.32 -1.28 -3.46 116.42 114.76 3h6o h ASP 238 Ca -0.47 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.50 3h6o h ASP 238 Cb 1.27 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.67 3h6o h ASP 238 CO 0.52 0.79 -0.12 0.00 -1.72 0.00 0.00 179.24 178.72 3h6o s MET 239 N -2.76 0.96 -0.12 3.56 0.23 -1.17 -2.21 119.30 117.79 3h6o s MET 239 Ca -0.04 -0.51 0.03 0.00 -1.03 0.00 0.00 55.69 54.14 3h6o s MET 239 Cb 0.08 0.42 0.00 0.00 -1.53 0.00 0.00 34.83 33.81 3h6o s MET 239 CO 0.82 -0.34 -0.23 0.08 -2.03 0.00 0.00 175.02 173.32 3h6o s VAL 240 N -2.97 2.10 -0.70 5.16 1.01 0.42 -1.19 120.40 124.22 3h6o s VAL 240 Ca -0.02 -0.99 -0.19 0.00 0.00 0.00 0.00 61.98 60.78 3h6o s VAL 240 Cb 0.00 -1.82 0.11 0.00 0.00 0.00 0.00 36.38 34.68 3h6o s VAL 240 CO -0.06 0.55 0.86 -0.36 0.00 0.00 0.00 175.10 176.10 3h6o s PHE 241 N 0.58 3.01 -0.21 5.22 0.08 0.14 -0.39 117.98 126.42 3h6o s PHE 241 Ca -0.13 -1.05 -0.28 0.00 0.12 0.00 0.00 56.93 55.59 3h6o s PHE 241 Cb -0.17 -4.12 0.00 0.00 -0.57 0.00 0.00 43.02 38.16 3h6o s PHE 241 CO 0.03 -1.40 0.96 0.00 -0.10 0.00 0.00 175.22 174.72 3h6o s ALA 242 N 2.79 3.62 0.36 5.36 0.00 0.08 -2.42 121.76 131.54 3h6o s ALA 242 Ca 0.19 0.12 -0.26 0.00 0.00 0.00 0.00 51.96 52.02 3h6o s ALA 242 Cb -0.17 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 3h6o s ALA 242 CO 0.02 -0.91 1.03 -1.12 0.00 0.00 0.00 175.76 174.78 3h6o s SER 243 N 1.21 7.00 -1.10 0.00 0.01 -1.26 -1.14 113.70 118.42 3h6o s SER 243 Ca 0.42 2.03 -0.01 0.00 1.31 0.00 0.00 55.95 59.70 3h6o s SER 243 Cb -0.16 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.48 3h6o s SER 243 CO 0.09 -0.32 0.92 0.33 0.41 0.00 0.00 173.24 174.67 3h6o n PHE 244 N 0.33 -2.05 -2.91 2.43 7.35 -1.24 -4.72 117.46 116.65 3h6o n PHE 244 Ca 0.03 0.86 -0.42 0.00 -0.76 0.00 0.00 57.45 57.16 3h6o n PHE 244 Cb 0.49 -4.76 -0.04 0.00 0.35 0.00 0.00 39.48 35.51 3h6o n PHE 244 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 3h6o s ILE 245 N -3.32 4.86 -0.05 -2.13 -1.09 -1.14 -4.91 121.20 113.42 3h6o s ILE 245 Ca 0.07 1.54 0.08 0.00 -2.23 0.00 0.00 60.65 60.11 3h6o s ILE 245 Cb -0.03 -4.10 -0.12 0.00 -1.58 0.00 0.00 42.46 36.63 3h6o s ILE 245 CO 0.66 -0.04 0.10 0.54 -1.23 0.00 0.00 174.94 174.97 3h6o n ARG 246 N 5.79 1.53 -3.99 2.79 1.74 -1.26 -4.10 116.66 119.15 3h6o n ARG 246 Ca 0.05 -0.04 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 3h6o n ARG 246 Cb 0.48 -1.20 -0.05 0.00 -1.02 0.00 0.00 32.46 30.66 3h6o n ARG 246 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3h6o s LYS 247 N -2.39 1.50 0.25 5.56 -2.85 -1.26 -3.93 119.74 116.63 3h6o s LYS 247 Ca -0.04 -1.24 -0.05 0.00 -1.00 0.00 0.00 55.97 53.64 3h6o s LYS 247 Cb 0.04 0.46 0.28 0.00 -2.06 0.00 0.00 37.83 36.55 3h6o s LYS 247 CO 0.34 -0.62 1.88 0.00 0.10 0.00 0.00 175.35 177.05 3h6o h ALA 248 N 2.28 1.22 -0.06 0.59 0.00 -1.86 -3.00 119.26 118.44 3h6o h ALA 248 Ca -0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 3h6o h ALA 248 Cb 1.25 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h6o h ALA 248 CO 0.37 0.63 -0.07 0.66 0.00 0.00 0.00 179.25 180.85 3h6o h SER 249 N 1.20 0.07 -0.62 0.00 4.64 -1.97 -0.52 113.55 116.36 3h6o h SER 249 Ca 0.30 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.63 3h6o h SER 249 Cb 0.01 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 3h6o h SER 249 CO -0.05 0.15 0.40 0.44 -0.87 0.00 0.00 176.83 176.91 3h6o h ASP 250 N 0.08 0.69 -0.67 4.97 3.32 -1.94 -1.04 116.42 121.83 3h6o h ASP 250 Ca 0.02 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 3h6o h ASP 250 Cb 0.17 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 3h6o h ASP 250 CO 0.01 0.49 0.17 0.58 -1.72 0.00 0.00 179.24 178.78 3h6o h VAL 251 N 0.82 1.26 -0.24 -1.35 2.07 -1.18 -2.44 116.25 115.19 3h6o h VAL 251 Ca 0.23 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.73 3h6o h VAL 251 Cb -0.07 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3h6o h VAL 251 CO -0.06 0.36 -0.18 0.45 0.02 0.00 0.00 177.57 178.16 3h6o h HIS 252 N 1.03 0.45 -0.30 1.57 3.86 -1.06 -1.11 115.15 119.60 3h6o h HIS 252 Ca 0.22 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.32 3h6o h HIS 252 Cb 0.35 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 3h6o h HIS 252 CO 0.03 0.58 0.06 0.93 0.86 0.00 0.00 177.93 180.38 3h6o h GLU 253 N 0.38 0.49 -0.57 2.45 5.08 -0.86 0.07 114.58 121.61 3h6o h GLU 253 Ca 0.07 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3h6o h GLU 253 Cb 0.54 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 3h6o h GLU 253 CO 0.03 0.57 0.33 0.28 -1.00 0.00 0.00 179.01 179.23 3h6o h VAL 254 N 0.32 1.18 -0.33 3.13 2.07 -1.22 -0.98 116.25 120.42 3h6o h VAL 254 Ca 0.09 -0.43 0.06 0.00 0.82 0.00 0.00 66.70 67.23 3h6o h VAL 254 Cb 0.32 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 3h6o h VAL 254 CO 0.00 0.19 0.02 -0.09 0.02 0.00 0.00 177.57 177.71 3h6o h ARG 255 N 0.78 0.11 -0.35 1.57 9.65 -1.12 -1.69 114.38 123.33 3h6o h ARG 255 Ca 0.20 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.07 3h6o h ARG 255 Cb 0.02 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 3h6o h ARG 255 CO -0.04 0.07 0.21 -0.22 2.80 0.00 0.00 179.97 182.80 3h6o h LYS 256 N 0.11 0.48 -0.40 0.20 3.64 -0.68 -0.95 116.57 118.98 3h6o h LYS 256 Ca 0.16 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3h6o h LYS 256 Cb 0.20 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3h6o h LYS 256 CO -0.25 0.37 0.10 0.28 -2.27 0.00 0.00 179.45 177.69 3h6o h VAL 257 N 0.46 1.23 -0.97 2.00 2.07 -1.01 -1.91 116.25 118.12 3h6o h VAL 257 Ca 0.13 -0.78 0.08 0.00 0.82 0.00 0.00 66.70 66.95 3h6o h VAL 257 Cb 0.02 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 3h6o h VAL 257 CO -0.02 0.27 0.61 -0.07 0.02 0.00 0.00 177.57 178.38 3h6o h LEU 258 N 0.51 0.95 0.00 2.57 3.38 -1.26 -3.47 115.31 117.99 3h6o h LEU 258 Ca 0.13 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3h6o h LEU 258 Cb 0.31 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3h6o h LEU 258 CO 0.00 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.72 3h6o n GLY 259 N -1.35 -0.41 0.20 0.83 0.00 -0.37 -2.55 105.19 101.55 3h6o n GLY 259 Ca 0.16 -1.09 -0.17 0.00 0.00 0.00 0.00 46.02 44.92 3h6o n GLY 259 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h6o h GLU 260 N 0.00 0.67 -0.04 1.61 4.22 -1.88 -2.64 114.58 116.53 3h6o h GLU 260 Ca 0.00 -0.63 -0.07 0.00 0.08 0.00 0.00 59.36 58.73 3h6o h GLU 260 Cb 0.00 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3h6o h GLU 260 CO 0.00 1.24 -0.32 0.87 -2.18 0.00 0.00 179.01 178.62 3h6o h LYS 261 N 0.42 0.08 -0.85 1.92 1.79 -1.99 -2.66 116.57 115.28 3h6o h LYS 261 Ca -0.08 -0.03 -0.39 0.00 -2.18 0.00 0.00 60.65 57.97 3h6o h LYS 261 Cb 1.53 -0.01 -0.23 0.00 -1.58 0.00 0.00 32.23 31.94 3h6o h LYS 261 CO 0.17 0.39 0.46 0.41 -1.08 0.00 0.00 179.45 179.81 3h6o n GLY 262 N -0.55 4.26 0.25 3.86 0.00 -1.06 -4.69 105.19 107.27 3h6o n GLY 262 Ca -0.02 -1.07 -0.01 0.00 0.00 0.00 0.00 46.02 44.92 3h6o n GLY 262 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3h6o h LYS 263 N 1.56 0.44 -0.01 1.61 2.10 -1.10 -2.54 116.57 118.63 3h6o h LYS 263 Ca 0.47 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 3h6o h LYS 263 Cb 2.58 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 33.87 3h6o h LYS 263 CO 0.92 0.58 -0.08 0.09 -2.00 0.00 0.00 179.45 178.95 3h6o n ASN 264 N -4.21 1.33 -4.68 7.07 3.02 -1.26 -4.85 115.26 111.68 3h6o n ASN 264 Ca 0.00 -1.30 -0.42 0.00 -0.03 0.00 0.00 54.58 52.83 3h6o n ASN 264 Cb 0.32 0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.50 3h6o n ASN 264 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h6o s ILE 265 N -2.16 4.22 0.04 2.41 1.01 -0.96 -4.99 121.20 120.77 3h6o s ILE 265 Ca 0.34 1.53 -0.30 0.00 0.00 0.00 0.00 60.65 62.22 3h6o s ILE 265 Cb 0.20 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.64 3h6o s ILE 265 CO 0.39 -0.03 1.09 -0.54 0.00 0.00 0.00 174.94 175.85 3h6o s LYS 266 N 2.50 4.51 -0.27 2.79 -0.14 -0.94 -4.87 119.74 123.32 3h6o s LYS 266 Ca 0.56 1.60 -0.16 0.00 -1.36 0.00 0.00 55.97 56.61 3h6o s LYS 266 Cb -0.25 -3.40 -0.03 0.00 -1.68 0.00 0.00 37.83 32.48 3h6o s LYS 266 CO 0.21 -0.13 0.43 0.42 -0.76 0.00 0.00 175.35 175.52 3h6o s ILE 267 N 0.93 5.13 -0.26 2.17 1.01 -1.26 -0.44 121.20 128.48 3h6o s ILE 267 Ca 0.55 0.66 -0.06 0.00 0.00 0.00 0.00 60.65 61.80 3h6o s ILE 267 Cb -0.25 -3.76 -0.01 0.00 0.01 0.00 0.00 42.46 38.45 3h6o s ILE 267 CO 0.29 0.11 0.03 -0.63 0.00 0.00 0.00 174.94 174.74 3h6o s ILE 268 N 2.17 3.82 -0.16 2.92 -1.09 0.47 -0.67 121.20 128.65 3h6o s ILE 268 Ca 0.17 -0.51 -0.27 0.00 -2.23 0.00 0.00 60.65 57.81 3h6o s ILE 268 Cb -0.16 -2.85 -0.01 0.00 -1.58 0.00 0.00 42.46 37.86 3h6o s ILE 268 CO 0.10 0.26 0.92 -0.44 -1.23 0.00 0.00 174.94 174.54 3h6o s SER 269 N 1.51 7.06 -0.32 3.58 0.01 -0.30 -0.74 113.70 124.50 3h6o s SER 269 Ca 0.04 1.31 -0.28 0.00 1.31 0.00 0.00 55.95 58.34 3h6o s SER 269 Cb -0.16 -2.50 0.01 0.00 0.21 0.00 0.00 66.02 63.59 3h6o s SER 269 CO 0.01 -0.46 1.01 -0.54 0.41 0.00 0.00 173.24 173.67 3h6o s LYS 270 N 2.29 4.03 -0.30 12.44 1.02 -0.29 -0.12 119.74 138.81 3h6o s LYS 270 Ca 0.42 0.94 -0.17 0.00 0.02 0.00 0.00 55.97 57.18 3h6o s LYS 270 Cb -0.17 -3.74 -0.02 0.00 -0.52 0.00 0.00 37.83 33.38 3h6o s LYS 270 CO 0.13 -0.86 0.48 0.42 -0.92 0.00 0.00 175.35 174.60 3h6o s ILE 271 N 3.50 5.07 0.00 2.17 -1.09 -0.29 -2.90 121.20 127.66 3h6o s ILE 271 Ca 0.42 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.45 3h6o s ILE 271 Cb -0.13 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 36.90 3h6o s ILE 271 CO 0.15 -0.01 0.25 -0.62 -1.23 0.00 0.00 174.94 173.47 3h6o n GLU 272 N 5.57 -0.36 -3.93 2.79 1.02 -1.26 -2.42 120.64 122.06 3h6o n GLU 272 Ca -0.05 -0.26 -0.09 0.00 -0.02 0.00 0.00 57.16 56.74 3h6o n GLU 272 Cb 0.50 -0.72 -0.03 0.00 -0.02 0.00 0.00 31.44 31.16 3h6o n GLU 272 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3h6o s ASN 273 N -0.02 -0.08 0.53 1.62 4.22 -1.26 -2.99 114.94 116.96 3h6o s ASN 273 Ca 0.00 -0.86 0.19 0.00 -2.14 0.00 0.00 52.86 50.05 3h6o s ASN 273 Cb 0.00 0.68 1.34 0.00 1.28 0.00 0.00 41.25 44.55 3h6o s ASN 273 CO 0.00 -1.29 2.12 -0.74 -2.04 0.00 0.00 177.10 175.14 3h6o h HIS 274 N 2.12 0.00 0.10 1.54 -0.00 -1.92 -2.28 115.15 114.71 3h6o h HIS 274 Ca -0.24 0.00 -0.19 0.00 -0.00 0.00 0.00 60.37 59.94 3h6o h HIS 274 Cb 1.25 0.00 0.02 0.00 -0.00 0.00 0.00 27.41 28.68 3h6o h HIS 274 CO 0.58 0.00 -0.79 1.49 -0.00 0.00 0.00 177.93 179.21 3h6o h GLU 275 N 0.00 0.36 -0.97 5.26 4.81 -1.90 -1.33 114.58 120.82 3h6o h GLU 275 Ca 0.07 -0.52 0.17 0.00 -0.13 0.00 0.00 59.36 58.95 3h6o h GLU 275 Cb 0.27 0.18 -0.10 0.00 0.63 0.00 0.00 28.75 29.73 3h6o h GLU 275 CO -0.00 1.21 0.57 0.78 -0.73 0.00 0.00 179.01 180.84 3h6o h GLY 276 N -0.23 1.68 0.52 1.92 0.00 -1.60 0.94 103.07 106.29 3h6o h GLY 276 Ca -0.13 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 3h6o h GLY 276 CO 0.15 -0.04 -0.04 -2.08 0.00 0.00 0.00 176.54 174.54 3h6o h VAL 277 N 0.75 1.18 -0.39 4.60 2.07 -1.41 -2.16 116.25 120.89 3h6o h VAL 277 Ca 0.54 -1.03 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 3h6o h VAL 277 Cb 0.80 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 3h6o h VAL 277 CO -0.37 0.25 0.07 -0.09 0.02 0.00 0.00 177.57 177.45 3h6o h ARG 278 N -0.58 0.58 -0.93 1.57 2.43 -0.83 -2.44 114.38 114.18 3h6o h ARG 278 Ca -0.01 -0.11 -0.47 0.00 -0.81 0.00 0.00 59.98 58.58 3h6o h ARG 278 Cb 0.49 -0.09 -0.28 0.00 -0.42 0.00 0.00 29.97 29.66 3h6o h ARG 278 CO 0.02 0.56 0.58 0.54 -1.51 0.00 0.00 179.97 180.15 3h6o n ARG 279 N -4.31 2.31 -0.08 0.20 1.74 0.29 -4.71 116.66 112.10 3h6o n ARG 279 Ca 0.02 -3.03 -0.00 0.00 -0.77 0.00 0.00 57.85 54.07 3h6o n ARG 279 Cb 0.21 -2.15 0.27 0.00 -1.02 0.00 0.00 32.46 29.77 3h6o n ARG 279 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3h6o h PHE 280 N 1.11 0.71 -0.18 -1.55 3.57 -0.87 -2.96 116.94 116.76 3h6o h PHE 280 Ca 0.58 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.97 3h6o h PHE 280 Cb 2.75 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 41.27 3h6o h PHE 280 CO 1.54 0.58 -0.16 -0.44 -2.23 0.00 0.00 178.31 177.60 3h6o h ASP 281 N 0.69 0.45 -0.17 0.41 3.32 -1.85 0.17 116.42 119.44 3h6o h ASP 281 Ca 0.16 -0.46 -0.04 0.00 0.02 0.00 0.00 57.03 56.71 3h6o h ASP 281 Cb 0.19 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 3h6o h ASP 281 CO -0.01 0.82 0.01 1.05 -1.72 0.00 0.00 179.24 179.39 3h6o h GLU 282 N 0.09 0.40 -0.16 3.56 4.11 -1.94 -1.87 114.58 118.77 3h6o h GLU 282 Ca 0.03 -0.07 -0.05 0.00 0.07 0.00 0.00 59.36 59.34 3h6o h GLU 282 Cb 0.68 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 3h6o h GLU 282 CO 0.04 0.43 -0.10 0.82 0.07 0.00 0.00 179.01 180.27 3h6o h ILE 283 N 0.39 1.32 -0.57 -1.06 2.04 -1.28 -2.81 117.51 115.54 3h6o h ILE 283 Ca 0.09 -1.18 -0.00 0.00 1.00 0.00 0.00 64.86 64.76 3h6o h ILE 283 Cb 0.25 1.75 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 3h6o h ILE 283 CO 0.01 0.35 0.34 0.25 0.00 0.00 0.00 178.15 179.10 3h6o h LEU 284 N 0.02 0.69 -0.95 1.44 5.85 -0.55 -1.21 115.31 120.60 3h6o h LEU 284 Ca 0.03 -0.06 0.10 0.00 0.84 0.00 0.00 57.88 58.79 3h6o h LEU 284 Cb 0.59 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 3h6o h LEU 284 CO 0.03 0.56 0.59 -0.08 -0.34 0.00 0.00 178.44 179.19 3h6o h GLU 285 N 0.77 0.94 0.00 1.25 4.22 -1.34 -2.82 114.58 117.60 3h6o h GLU 285 Ca 0.21 -0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.58 3h6o h GLU 285 Cb -0.01 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 3h6o h GLU 285 CO -0.04 0.62 -0.59 0.00 -2.18 0.00 0.00 179.01 176.83 3h6o h ALA 286 N 1.50 0.72 -1.75 2.92 0.00 -1.18 -3.47 119.26 118.00 3h6o h ALA 286 Ca 0.46 -0.05 -0.45 0.00 0.00 0.00 0.00 54.91 54.87 3h6o h ALA 286 Cb 0.40 0.01 0.06 0.00 0.00 0.00 0.00 17.79 18.25 3h6o h ALA 286 CO -0.24 0.05 0.04 -1.12 0.00 0.00 0.00 179.25 177.98 3h6o s SER 287 N -5.76 4.94 0.03 0.00 0.01 -0.50 -4.90 113.70 107.52 3h6o s SER 287 Ca 0.03 -0.06 0.22 0.00 1.31 0.00 0.00 55.95 57.45 3h6o s SER 287 Cb 0.08 -0.65 -0.12 0.00 0.21 0.00 0.00 66.02 65.55 3h6o s SER 287 CO 0.74 -1.42 0.85 0.47 0.41 0.00 0.00 173.24 174.30 3h6o n ASP 288 N -2.56 0.53 -3.56 2.44 8.00 0.15 -4.95 116.55 116.60 3h6o n ASP 288 Ca 0.10 -0.26 -0.01 0.00 0.71 0.00 0.00 54.79 55.33 3h6o n ASP 288 Cb 0.60 1.15 0.01 0.00 -0.02 0.00 0.00 41.12 42.86 3h6o n ASP 288 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3h6o s GLY 289 N -3.83 -0.01 -0.01 0.44 0.00 -1.05 -4.05 107.32 98.81 3h6o s GLY 289 Ca 0.01 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.61 3h6o s GLY 289 CO 0.84 3.42 -0.04 -0.42 0.00 0.00 0.00 173.10 176.90 3h6o s ILE 290 N -2.16 0.36 -0.22 0.90 -1.09 -0.28 -1.15 121.20 117.56 3h6o s ILE 290 Ca 0.24 -0.18 -0.07 0.00 -2.23 0.00 0.00 60.65 58.42 3h6o s ILE 290 Cb -0.01 -0.32 -0.03 0.00 -1.58 0.00 0.00 42.46 40.51 3h6o s ILE 290 CO 0.03 0.11 0.05 -0.32 -1.23 0.00 0.00 174.94 173.58 3h6o s MET 291 N 0.02 3.73 -1.04 2.79 -2.45 0.83 -0.00 119.30 123.17 3h6o s MET 291 Ca 0.00 -0.45 -0.23 0.00 -1.25 0.00 0.00 55.69 53.76 3h6o s MET 291 Cb -0.03 -3.22 0.03 0.00 1.25 0.00 0.00 34.83 32.85 3h6o s MET 291 CO -0.00 -0.00 1.60 0.08 1.05 0.00 0.00 175.02 177.75 3h6o s VAL 292 N 1.09 3.84 -1.29 10.11 1.01 0.12 -1.14 120.40 134.15 3h6o s VAL 292 Ca 0.04 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.99 3h6o s VAL 292 Cb -0.14 -4.85 0.04 0.00 0.00 0.00 0.00 36.38 31.43 3h6o s VAL 292 CO 0.03 -1.72 1.79 0.00 0.00 0.00 0.00 175.10 175.20 3h6o n ALA 293 N 10.04 3.38 0.24 5.51 0.00 -1.01 -2.31 120.51 136.36 3h6o n ALA 293 Ca 0.37 -3.73 0.09 0.00 0.00 0.00 0.00 53.44 50.17 3h6o n ALA 293 Cb 0.49 -3.59 0.59 0.00 0.00 0.00 0.00 19.45 16.95 3h6o n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6o h ARG 294 N 7.81 0.00 0.00 0.00 3.08 -1.82 -2.35 114.38 121.10 3h6o h ARG 294 Ca 0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.47 3h6o h ARG 294 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.92 3h6o h ARG 294 CO 1.45 0.18 0.00 0.41 -1.07 0.00 0.00 179.97 180.94 3h6o n GLY 295 N -0.71 -3.06 0.35 0.04 0.00 -1.26 -1.03 105.19 99.52 3h6o n GLY 295 Ca -0.02 0.20 0.03 0.00 0.00 0.00 0.00 46.02 46.23 3h6o n GLY 295 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h6o h ASP 296 N 0.00 0.81 -0.53 1.61 3.32 -1.87 -1.60 116.42 118.16 3h6o h ASP 296 Ca 0.00 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.08 3h6o h ASP 296 Cb 0.00 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 3h6o h ASP 296 CO 0.00 0.55 0.35 0.25 -1.72 0.00 0.00 179.24 178.67 3h6o h LEU 297 N 0.93 0.49 -0.70 1.55 5.85 -1.32 -1.11 115.31 121.01 3h6o h LEU 297 Ca 0.31 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.02 3h6o h LEU 297 Cb 0.06 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.98 3h6o h LEU 297 CO -0.09 0.34 0.00 1.23 -0.34 0.00 0.00 178.44 179.58 3h6o h GLY 298 N 0.57 0.00 1.14 3.75 0.00 -0.05 -1.91 103.07 106.58 3h6o h GLY 298 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.21 3h6o h GLY 298 CO -0.06 0.00 -1.50 -2.22 0.00 0.00 0.00 176.54 172.76 3h6o h ILE 299 N 0.00 1.22 -0.15 2.60 2.04 -1.16 -3.37 117.51 118.70 3h6o h ILE 299 Ca 0.00 -2.65 -0.10 0.00 1.00 0.00 0.00 64.86 63.11 3h6o h ILE 299 Cb 0.59 3.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.66 3h6o h ILE 299 CO 0.00 0.81 -0.31 -0.33 0.00 0.00 0.00 178.15 178.32 3h6o h GLU 300 N 0.10 0.47 -6.28 2.37 4.39 -1.26 -3.46 114.58 110.91 3h6o h GLU 300 Ca -0.27 -0.31 -0.58 0.00 0.34 0.00 0.00 59.36 58.54 3h6o h GLU 300 Cb 2.12 0.04 -0.11 0.00 -0.10 0.00 0.00 28.75 30.71 3h6o h GLU 300 CO 0.25 0.92 -0.67 0.96 -1.16 0.00 0.00 179.01 179.31 3h6o s ILE 301 N -3.99 3.42 0.21 3.13 -4.36 -0.73 -4.58 121.20 114.29 3h6o s ILE 301 Ca -0.13 -1.78 -0.32 0.00 -0.26 0.00 0.00 60.65 58.16 3h6o s ILE 301 Cb 0.06 -2.78 -0.14 0.00 1.25 0.00 0.00 42.46 40.85 3h6o s ILE 301 CO 0.79 -0.27 1.33 -2.65 0.24 0.00 0.00 174.94 174.39 3h6o n PRO 302 N -0.54 1.73 0.25 0.37 -0.02 -1.26 -4.54 135.00 130.99 3h6o n PRO 302 Ca -0.08 0.62 0.10 0.00 -2.02 0.00 0.00 63.50 62.11 3h6o n PRO 302 Cb 0.57 -2.22 0.65 0.00 -0.02 0.00 0.00 33.50 32.48 3h6o n PRO 302 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h6o h ALA 303 N 3.99 1.52 0.00 3.55 0.00 -1.93 -0.38 119.26 126.02 3h6o h ALA 303 Ca -0.44 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3h6o h ALA 303 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3h6o h ALA 303 CO 0.74 0.16 0.00 -0.85 0.00 0.00 0.00 179.25 179.31 3h6o n GLU 304 N -4.00 0.10 0.00 0.00 0.00 -1.26 -2.69 120.64 112.79 3h6o n GLU 304 Ca -0.02 0.38 0.11 0.00 0.00 0.00 0.00 57.16 57.62 3h6o n GLU 304 Cb 0.22 -1.71 -0.02 0.00 0.00 0.00 0.00 31.44 29.94 3h6o n GLU 304 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3h6o n LYS 305 N -1.90 0.94 -0.18 3.44 5.02 -0.15 -4.62 118.16 120.71 3h6o n LYS 305 Ca 0.02 -0.78 0.00 0.00 -2.02 0.00 0.00 58.31 55.54 3h6o n LYS 305 Cb 0.17 -1.48 0.26 0.00 -0.02 0.00 0.00 35.03 33.96 3h6o n LYS 305 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h6o h VAL 306 N 1.89 1.19 -0.00 -0.18 2.07 -1.57 -2.24 116.25 117.42 3h6o h VAL 306 Ca 0.00 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 3h6o h VAL 306 Cb 0.70 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3h6o h VAL 306 CO 0.00 0.19 -0.30 2.19 0.02 0.00 0.00 177.57 179.68 3h6o h PHE 307 N 0.94 0.01 0.13 1.57 -5.15 -1.82 -0.66 116.94 111.96 3h6o h PHE 307 Ca 0.25 -0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 58.01 3h6o h PHE 307 Cb -0.05 -0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.12 3h6o h PHE 307 CO 0.00 0.30 -0.06 -0.07 -2.00 0.00 0.00 178.31 176.48 3h6o h LEU 308 N 0.01 -0.15 -0.85 2.10 3.38 -1.72 -1.65 115.31 116.43 3h6o h LEU 308 Ca -0.00 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.82 3h6o h LEU 308 Cb 0.53 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 3h6o h LEU 308 CO 0.04 0.13 0.52 0.00 0.09 0.00 0.00 178.44 179.22 3h6o h ALA 309 N 0.39 1.16 -0.02 1.53 0.00 -1.38 -0.15 119.26 120.80 3h6o h ALA 309 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h6o h ALA 309 Cb 0.35 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3h6o h ALA 309 CO 0.03 0.27 0.01 0.37 0.00 0.00 0.00 179.25 179.93 3h6o h GLN 310 N 0.96 0.02 -0.15 0.00 4.15 -0.99 -1.28 115.11 117.82 3h6o h GLN 310 Ca 0.37 -0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.59 3h6o h GLN 310 Cb 0.17 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.85 3h6o h GLN 310 CO -0.17 0.07 -0.70 0.87 -1.93 0.00 0.00 178.83 176.97 3h6o h LYS 311 N -0.03 0.64 -0.20 1.69 1.57 -1.19 -0.87 116.57 118.17 3h6o h LYS 311 Ca 0.01 -0.49 0.03 0.00 -1.87 0.00 0.00 60.65 58.33 3h6o h LYS 311 Cb 0.05 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 3h6o h LYS 311 CO -0.00 1.11 -0.01 1.98 -0.57 0.00 0.00 179.45 181.96 3h6o h MET 312 N 0.45 0.05 -0.45 3.15 4.05 -0.95 -0.70 114.93 120.53 3h6o h MET 312 Ca -0.03 -0.00 -0.14 0.00 -0.28 0.00 0.00 59.70 59.25 3h6o h MET 312 Cb 1.30 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 32.07 3h6o h MET 312 CO 0.14 0.03 -0.26 0.52 0.23 0.00 0.00 176.91 177.57 3h6o h MET 313 N 0.05 0.97 -0.21 0.39 2.86 -1.08 -1.57 114.93 116.33 3h6o h MET 313 Ca 0.10 -0.44 -0.02 0.00 -2.06 0.00 0.00 59.70 57.28 3h6o h MET 313 Cb 0.12 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 3h6o h MET 313 CO -0.17 1.11 0.06 0.82 1.06 0.00 0.00 176.91 179.79 3h6o h ILE 314 N 0.81 1.20 -0.04 -1.22 2.04 -1.04 0.63 117.51 119.89 3h6o h ILE 314 Ca 0.09 -0.63 0.04 0.00 1.00 0.00 0.00 64.86 65.36 3h6o h ILE 314 Cb 0.84 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 38.08 3h6o h ILE 314 CO 0.07 0.20 -0.25 1.23 0.00 0.00 0.00 178.15 179.40 3h6o h GLY 315 N 0.17 -0.35 1.89 5.37 0.00 -1.06 0.47 103.07 109.55 3h6o h GLY 315 Ca 0.07 0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.65 3h6o h GLY 315 CO -0.00 -0.21 -0.18 3.21 0.00 0.00 0.00 176.54 179.37 3h6o h ARG 316 N -0.37 0.14 -0.20 4.80 3.08 -1.18 0.72 114.38 121.38 3h6o h ARG 316 Ca 0.07 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.00 3h6o h ARG 316 Cb 0.47 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3h6o h ARG 316 CO -0.25 0.32 -0.23 0.00 -1.07 0.00 0.00 179.97 178.73 3h6o h ASN 318 N 0.18 0.88 -0.36 0.00 -0.26 -0.51 0.96 115.58 116.48 3h6o h ASN 318 Ca 0.03 -0.06 -0.04 0.00 -0.56 0.00 0.00 56.30 55.66 3h6o h ASN 318 Cb 0.79 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.81 3h6o h ASN 318 CO 0.06 0.70 0.10 -0.09 -1.06 0.00 0.00 177.43 177.14 3h6o h ARG 319 N 1.00 0.64 0.00 0.81 2.43 -0.76 -2.82 114.38 115.68 3h6o h ARG 319 Ca 0.26 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3h6o h ARG 319 Cb 0.01 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3h6o h ARG 319 CO -0.04 0.59 -0.69 0.00 -1.51 0.00 0.00 179.97 178.31 3h6o n ALA 320 N -2.47 3.34 -1.76 2.80 0.00 -0.77 -4.97 120.51 116.67 3h6o n ALA 320 Ca 0.03 -0.34 -0.09 0.00 0.00 0.00 0.00 53.44 53.04 3h6o n ALA 320 Cb 0.20 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 3h6o n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h6o n GLY 321 N 1.41 0.50 3.71 0.00 0.00 0.26 -5.04 105.19 106.03 3h6o n GLY 321 Ca 0.04 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 3h6o n GLY 321 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6o s LYS 322 N -3.70 2.98 0.21 1.61 1.02 -0.77 -4.91 119.74 116.17 3h6o s LYS 322 Ca 0.00 -0.45 -0.32 0.00 0.02 0.00 0.00 55.97 55.22 3h6o s LYS 322 Cb 0.00 -2.80 -0.14 0.00 -0.52 0.00 0.00 37.83 34.37 3h6o s LYS 322 CO 0.00 0.68 1.45 -2.30 -0.92 0.00 0.00 175.35 174.26 3h6o n PRO 323 N 1.79 2.02 -4.75 -1.68 -0.02 -1.26 -4.41 135.00 126.69 3h6o n PRO 323 Ca -0.17 0.72 -0.26 0.00 -2.02 0.00 0.00 63.50 61.78 3h6o n PRO 323 Cb 0.53 -2.41 -0.16 0.00 -0.02 0.00 0.00 33.50 31.44 3h6o n PRO 323 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h6o s VAL 324 N 0.25 1.35 -0.14 -1.45 0.11 -1.26 -1.13 120.40 118.12 3h6o s VAL 324 Ca 0.72 -0.64 -0.03 0.00 -2.93 0.00 0.00 61.98 59.11 3h6o s VAL 324 Cb -0.67 -1.19 -0.03 0.00 -1.53 0.00 0.00 36.38 32.97 3h6o s VAL 324 CO 0.46 0.40 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.95 3h6o s ILE 325 N 0.33 3.83 -0.22 7.04 1.01 1.00 -2.01 121.20 132.18 3h6o s ILE 325 Ca -0.10 -0.39 -0.14 0.00 0.00 0.00 0.00 60.65 60.02 3h6o s ILE 325 Cb -0.14 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 3h6o s ILE 325 CO 0.03 0.51 0.34 0.00 0.00 0.00 0.00 174.94 175.82 3h6o s ALA 327 N 1.30 1.49 0.00 0.00 0.00 -0.98 -2.10 121.76 121.47 3h6o s ALA 327 Ca 0.16 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.78 3h6o s ALA 327 Cb -0.14 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.93 3h6o s ALA 327 CO 0.07 0.05 0.00 2.41 0.00 0.00 0.00 175.76 178.29 3h6o n THR 328 N 0.35 -1.18 -1.77 0.00 -1.04 -1.26 -3.38 114.28 106.00 3h6o n THR 328 Ca -0.14 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.74 3h6o n THR 328 Cb 0.58 -1.31 -0.03 0.00 -1.82 0.00 0.00 70.33 67.75 3h6o n THR 328 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h6o n GLN 329 N 1.24 -0.95 -0.21 -2.82 6.02 -1.26 -4.77 117.38 114.62 3h6o n GLN 329 Ca 0.00 0.80 -0.08 0.00 -0.01 0.00 0.00 57.00 57.71 3h6o n GLN 329 Cb 0.00 -4.93 0.03 0.00 1.02 0.00 0.00 30.24 26.36 3h6o n GLN 329 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 3h6o h MET 330 N 0.00 0.97 -1.12 -1.09 2.86 -1.89 -3.26 114.93 111.40 3h6o h MET 330 Ca -0.28 -0.24 -0.45 0.00 -2.06 0.00 0.00 59.70 56.67 3h6o h MET 330 Cb 1.01 -0.12 -0.41 0.00 0.06 0.00 0.00 31.60 32.14 3h6o h MET 330 CO 0.37 0.90 -0.99 1.28 1.06 0.00 0.00 176.91 179.53 3h6o n LEU 331 N -4.33 2.91 -0.10 1.22 4.77 -1.26 -4.55 117.00 115.65 3h6o n LEU 331 Ca 0.03 -4.27 0.08 0.00 -0.03 0.00 0.00 56.01 51.81 3h6o n LEU 331 Cb 0.26 0.05 0.42 0.00 -2.33 0.00 0.00 43.42 41.82 3h6o n LEU 331 CO 0.41 1.80 1.19 -0.08 -1.33 0.00 0.00 177.39 179.38 3h6o h GLU 332 N 2.75 0.57 0.00 3.23 4.57 -1.97 -1.50 114.58 122.22 3h6o h GLU 332 Ca 0.08 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 3h6o h GLU 332 Cb 1.12 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.58 3h6o h GLU 332 CO 0.62 0.38 0.00 0.66 -1.18 0.00 0.00 179.01 179.48 3h6o h SER 333 N 0.59 0.00 0.00 1.04 4.64 -1.93 -2.86 113.55 115.02 3h6o h SER 333 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3h6o h SER 333 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 3h6o h SER 333 CO -0.07 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.12 3h6o n MET 334 N -2.82 0.97 -0.08 4.77 2.81 -0.57 -0.96 117.12 121.24 3h6o n MET 334 Ca 0.01 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.83 3h6o n MET 334 Cb 0.26 -1.46 0.10 0.00 -0.71 0.00 0.00 33.22 31.41 3h6o n MET 334 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3h6o h ILE 335 N 0.00 1.27 0.00 2.02 2.04 -1.68 -3.31 117.51 117.85 3h6o h ILE 335 Ca 0.00 -1.31 -0.28 0.00 1.00 0.00 0.00 64.86 64.27 3h6o h ILE 335 Cb 0.00 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 3h6o h ILE 335 CO 0.00 0.44 -2.03 0.29 0.00 0.00 0.00 178.15 176.84 3h6o n LYS 336 N -4.12 1.51 -4.18 2.37 4.01 -1.13 0.00 118.16 116.63 3h6o n LYS 336 Ca 0.00 -0.00 -0.28 0.00 -0.51 0.00 0.00 58.31 57.52 3h6o n LYS 336 Cb 0.42 -1.39 -0.08 0.00 -0.51 0.00 0.00 35.03 33.48 3h6o n LYS 336 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3h6o s LYS 337 N -2.36 2.41 0.00 1.97 3.01 -0.14 -4.91 119.74 119.72 3h6o s LYS 337 Ca -0.08 -1.00 0.29 0.00 -1.01 0.00 0.00 55.97 54.17 3h6o s LYS 337 Cb 0.05 -2.42 1.34 0.00 -1.01 0.00 0.00 37.83 35.79 3h6o s LYS 337 CO 0.61 0.49 1.96 -0.35 0.51 0.00 0.00 175.35 178.58 3h6o n PRO 338 N 0.24 0.20 -3.77 -1.68 -0.04 -1.26 -4.13 135.00 124.56 3h6o n PRO 338 Ca -0.11 0.01 -0.11 0.00 -0.04 0.00 0.00 63.50 63.26 3h6o n PRO 338 Cb 0.54 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 3h6o n PRO 338 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3h6o s ARG 339 N -2.79 0.82 0.57 0.54 1.70 -1.26 -4.91 118.95 113.60 3h6o s ARG 339 Ca 0.20 -0.60 -0.03 0.00 -0.47 0.00 0.00 55.73 54.83 3h6o s ARG 339 Cb 0.19 0.35 0.02 0.00 -0.57 0.00 0.00 34.95 34.94 3h6o s ARG 339 CO 0.48 -0.26 0.83 -1.25 -1.08 0.00 0.00 175.30 174.02 3h6o s PRO 340 N -2.83 2.73 0.92 3.89 0.04 -1.26 -4.64 135.00 133.84 3h6o s PRO 340 Ca -0.03 -0.37 -0.12 0.00 0.04 0.00 0.00 61.00 60.52 3h6o s PRO 340 Cb 0.00 -2.38 0.14 0.00 0.04 0.00 0.00 34.50 32.31 3h6o s PRO 340 CO -0.05 -0.70 1.12 0.95 0.04 0.00 0.00 177.00 178.36 3h6o s THR 341 N -2.87 2.19 0.24 1.26 -4.23 -1.26 -4.89 115.64 106.09 3h6o s THR 341 Ca 0.54 0.06 0.02 0.00 -1.18 0.00 0.00 61.69 61.14 3h6o s THR 341 Cb -0.10 -2.72 -0.01 0.00 1.34 0.00 0.00 72.50 71.01 3h6o s THR 341 CO 0.41 -0.08 1.61 0.03 -0.54 0.00 0.00 174.62 176.05 3h6o h ARG 342 N -1.58 0.38 -0.51 3.99 2.47 -1.99 -2.28 114.38 114.86 3h6o h ARG 342 Ca -0.51 -0.21 -0.02 0.00 -1.26 0.00 0.00 59.98 57.97 3h6o h ARG 342 Cb 1.32 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.63 3h6o h ARG 342 CO 0.60 0.78 0.21 0.00 0.56 0.00 0.00 179.97 182.12 3h6o h ALA 343 N 1.19 1.43 -0.12 0.04 0.00 -1.99 -1.75 119.26 118.07 3h6o h ALA 343 Ca 0.02 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3h6o h ALA 343 Cb 0.95 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3h6o h ALA 343 CO 0.08 0.44 -0.36 0.93 0.00 0.00 0.00 179.25 180.34 3h6o h GLU 344 N 0.71 0.46 -0.91 0.00 5.08 -1.76 -1.46 114.58 116.70 3h6o h GLU 344 Ca 0.17 -0.33 0.03 0.00 -1.00 0.00 0.00 59.36 58.23 3h6o h GLU 344 Cb 0.12 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 3h6o h GLU 344 CO -0.02 0.95 0.60 0.78 -1.00 0.00 0.00 179.01 180.32 3h6o h GLY 345 N 0.05 1.31 1.18 -3.84 0.00 -1.36 -2.33 103.07 98.08 3h6o h GLY 345 Ca -0.01 -0.46 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 3h6o h GLY 345 CO 0.08 0.42 0.18 0.23 0.00 0.00 0.00 176.54 177.44 3h6o h SER 346 N 1.18 0.96 -0.43 0.19 0.87 -1.31 -2.40 113.55 112.62 3h6o h SER 346 Ca 0.35 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.67 3h6o h SER 346 Cb -0.05 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 3h6o h SER 346 CO -0.10 0.92 0.06 -0.78 -0.53 0.00 0.00 176.83 176.39 3h6o h ASP 347 N 0.98 0.70 0.23 6.23 3.58 -0.90 -1.51 116.42 125.74 3h6o h ASP 347 Ca 0.21 -0.27 -0.01 0.00 0.42 0.00 0.00 57.03 57.38 3h6o h ASP 347 Cb 0.32 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.18 3h6o h ASP 347 CO -0.00 0.79 -0.11 0.58 -2.88 0.00 0.00 179.24 177.62 3h6o h VAL 348 N 0.58 0.83 -0.69 2.25 2.07 -1.37 -1.68 116.25 118.25 3h6o h VAL 348 Ca 0.13 -0.36 0.08 0.00 0.82 0.00 0.00 66.70 67.37 3h6o h VAL 348 Cb 0.40 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 3h6o h VAL 348 CO 0.01 0.08 0.36 0.00 0.02 0.00 0.00 177.57 178.04 3h6o h ALA 349 N 0.24 0.94 0.00 1.67 0.00 -1.41 -2.24 119.26 118.46 3h6o h ALA 349 Ca -0.03 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3h6o h ALA 349 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3h6o h ALA 349 CO 0.05 -0.00 -0.42 -0.91 0.00 0.00 0.00 179.25 177.97 3h6o h ASN 350 N 0.64 0.00 -0.05 0.00 2.35 -1.22 -0.98 115.58 116.31 3h6o h ASN 350 Ca 0.32 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.95 3h6o h ASN 350 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3h6o h ASN 350 CO -0.23 0.42 -0.36 0.00 -1.65 0.00 0.00 177.43 175.61 3h6o h ALA 351 N 1.58 0.91 -0.18 -0.83 0.00 -0.72 0.34 119.26 120.36 3h6o h ALA 351 Ca -0.00 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.33 3h6o h ALA 351 Cb 0.86 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3h6o h ALA 351 CO 0.05 0.63 -0.51 0.28 0.00 0.00 0.00 179.25 179.70 3h6o h VAL 352 N 0.46 1.32 -0.79 0.00 2.07 -1.19 -0.55 116.25 117.57 3h6o h VAL 352 Ca 0.05 -1.75 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 3h6o h VAL 352 Cb 0.85 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 3h6o h VAL 352 CO 0.07 0.55 0.38 -0.07 0.02 0.00 0.00 177.57 178.52 3h6o h LEU 353 N 0.36 1.02 -1.12 2.57 3.38 -1.08 -1.84 115.31 118.60 3h6o h LEU 353 Ca -0.01 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 57.93 3h6o h LEU 353 Cb 1.13 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.55 3h6o h LEU 353 CO 0.11 0.86 0.60 0.44 0.09 0.00 0.00 178.44 180.54 3h6o h ASP 354 N 1.12 0.89 0.00 -0.43 3.32 -0.30 -3.46 116.42 117.56 3h6o h ASP 354 Ca 0.27 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3h6o h ASP 354 Cb 0.10 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3h6o h ASP 354 CO -0.04 0.54 0.00 0.61 -1.72 0.00 0.00 179.24 178.63 3h6o n GLY 355 N -1.39 1.93 3.72 2.75 0.00 -0.69 -4.69 105.19 106.82 3h6o n GLY 355 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3h6o n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o s ALA 356 N -1.93 3.46 0.13 4.61 0.00 -0.24 -4.89 121.76 122.90 3h6o s ALA 356 Ca 0.00 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 52.77 3h6o s ALA 356 Cb 0.00 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 3h6o s ALA 356 CO 0.00 -0.48 1.58 -0.44 0.00 0.00 0.00 175.76 176.42 3h6o h ASP 357 N 6.55 0.70 -4.28 0.00 3.32 -1.71 -3.44 116.42 117.56 3h6o h ASP 357 Ca -0.42 -0.30 -0.44 0.00 0.02 0.00 0.00 57.03 55.89 3h6o h ASP 357 Cb 1.21 -0.19 -0.20 0.00 0.22 0.00 0.00 39.33 40.37 3h6o h ASP 357 CO 0.82 0.83 -0.78 0.00 -1.72 0.00 0.00 179.24 178.38 3h6o s ILE 359 N -1.55 2.42 0.07 0.00 -4.36 -0.47 -2.10 121.20 115.21 3h6o s ILE 359 Ca 0.03 -2.35 0.05 0.00 -0.26 0.00 0.00 60.65 58.12 3h6o s ILE 359 Cb -0.08 -2.26 -0.03 0.00 1.25 0.00 0.00 42.46 41.34 3h6o s ILE 359 CO 0.03 -0.38 -0.14 -0.32 0.24 0.00 0.00 174.94 174.37 3h6o s MET 360 N -3.41 0.81 -0.06 0.37 1.75 -0.89 -1.46 119.30 116.41 3h6o s MET 360 Ca 0.28 -0.97 0.04 0.00 -1.25 0.00 0.00 55.69 53.80 3h6o s MET 360 Cb -0.05 -0.79 0.00 0.00 2.84 0.00 0.00 34.83 36.83 3h6o s MET 360 CO 0.14 0.17 -0.18 -0.51 -0.65 0.00 0.00 175.02 173.99 3h6o s LEU 361 N -1.80 1.90 0.00 4.11 1.43 0.03 -4.51 118.68 119.85 3h6o s LEU 361 Ca -0.02 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 3h6o s LEU 361 Cb -0.09 -1.06 0.00 0.00 0.03 0.00 0.00 46.19 45.06 3h6o s LEU 361 CO 0.02 0.13 0.00 -1.20 0.23 0.00 0.00 176.35 175.54 3h6o n SER 362 N 3.36 0.00 0.20 2.29 7.64 -1.26 -1.12 113.62 124.73 3h6o n SER 362 Ca -0.19 0.00 0.15 0.00 1.01 0.00 0.00 58.87 59.84 3h6o n SER 362 Cb 0.53 0.00 0.78 0.00 -1.01 0.00 0.00 64.21 64.50 3h6o n SER 362 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3h6o h GLY 363 N 0.00 0.00 0.12 0.23 0.00 -1.96 0.12 103.07 101.58 3h6o h GLY 363 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 3h6o h GLY 363 CO 0.00 0.00 0.52 0.83 0.00 0.00 0.00 176.54 177.89 3h6o h GLU 364 N 0.00 0.64 0.00 4.80 3.07 -1.89 0.54 114.58 121.74 3h6o h GLU 364 Ca 0.08 -0.04 -0.17 0.00 -0.50 0.00 0.00 59.36 58.73 3h6o h GLU 364 Cb 0.40 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.13 3h6o h GLU 364 CO -0.00 0.43 -1.88 0.25 -1.40 0.00 0.00 179.01 176.40 3h6o n THR 365 N -4.84 0.64 -0.03 1.13 -2.24 -0.57 -3.71 114.28 104.66 3h6o n THR 365 Ca 0.21 -0.52 -0.13 0.00 -2.27 0.00 0.00 64.05 61.34 3h6o n THR 365 Cb 0.53 -0.35 -0.09 0.00 -2.10 0.00 0.00 70.33 68.31 3h6o n THR 365 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h6o h ALA 366 N 0.95 0.05 0.00 6.98 0.00 -0.36 -3.32 119.26 123.55 3h6o h ALA 366 Ca -0.25 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3h6o h ALA 366 Cb 1.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3h6o h ALA 366 CO 0.01 -0.16 0.00 0.36 0.00 0.00 0.00 179.25 179.47 3h6o n LYS 367 N -4.77 -0.35 -1.09 0.00 2.85 -0.83 -1.48 118.16 112.49 3h6o n LYS 367 Ca -0.08 -0.24 -0.30 0.00 -1.05 0.00 0.00 58.31 56.63 3h6o n LYS 367 Cb 0.29 -0.73 0.13 0.00 -0.65 0.00 0.00 35.03 34.07 3h6o n LYS 367 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3h6o s GLY 368 N -0.02 1.65 0.44 2.58 0.00 0.12 -4.79 107.32 107.30 3h6o s GLY 368 Ca 0.00 0.17 0.23 0.00 0.00 0.00 0.00 44.72 45.12 3h6o s GLY 368 CO 0.00 0.61 1.63 -0.55 0.00 0.00 0.00 173.10 174.79 3h6o h ASP 369 N -1.53 0.00 -2.09 1.64 3.32 -0.63 -3.39 116.42 113.74 3h6o h ASP 369 Ca -0.47 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.00 3h6o h ASP 369 Cb 1.26 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.41 3h6o h ASP 369 CO 0.51 0.02 -0.88 -1.22 -1.72 0.00 0.00 179.24 175.95 3h6o n TYR 370 N -3.10 1.44 -0.01 4.55 4.01 -1.24 -4.94 117.16 117.85 3h6o n TYR 370 Ca 0.04 -3.83 -0.12 0.00 -0.16 0.00 0.00 57.90 53.83 3h6o n TYR 370 Cb 0.52 -0.44 -0.07 0.00 -0.31 0.00 0.00 39.34 39.04 3h6o n TYR 370 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3h6o h PRO 371 N 4.08 0.12 -0.44 -0.72 0.13 -1.75 -3.00 132.00 130.42 3h6o h PRO 371 Ca 0.13 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 65.10 3h6o h PRO 371 Cb 0.78 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 3h6o h PRO 371 CO 0.63 0.26 -0.24 -0.07 -0.23 0.00 0.00 178.00 178.35 3h6o h LEU 372 N -0.04 0.95 -1.29 1.56 3.38 -1.92 -2.69 115.31 115.26 3h6o h LEU 372 Ca 0.03 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 3h6o h LEU 372 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3h6o h LEU 372 CO -0.00 1.14 -0.23 -0.33 0.09 0.00 0.00 178.44 179.11 3h6o h GLU 373 N 0.79 0.18 -0.28 1.13 3.07 -1.93 -1.85 114.58 115.70 3h6o h GLU 373 Ca 0.10 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.79 3h6o h GLU 373 Cb 0.81 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.69 3h6o h GLU 373 CO 0.07 0.42 -0.31 0.00 -1.40 0.00 0.00 179.01 177.78 3h6o h ALA 374 N 1.60 0.94 0.16 3.43 0.00 -1.33 -1.22 119.26 122.84 3h6o h ALA 374 Ca 0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3h6o h ALA 374 Cb 0.51 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3h6o h ALA 374 CO 0.04 0.61 -0.08 0.28 0.00 0.00 0.00 179.25 180.10 3h6o h VAL 375 N 0.50 0.96 -0.90 0.00 2.07 -1.22 -2.83 116.25 114.83 3h6o h VAL 375 Ca 0.06 -1.00 0.12 0.00 0.82 0.00 0.00 66.70 66.69 3h6o h VAL 375 Cb 0.78 1.52 -0.07 0.00 -1.52 0.00 0.00 31.29 32.01 3h6o h VAL 375 CO 0.06 0.22 0.58 0.03 0.02 0.00 0.00 177.57 178.48 3h6o h ARG 376 N -0.74 0.80 -0.18 1.57 3.08 -1.36 -1.06 114.38 116.50 3h6o h ARG 376 Ca -0.02 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3h6o h ARG 376 Cb 0.52 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 3h6o h ARG 376 CO 0.04 0.53 -0.15 1.98 -1.07 0.00 0.00 179.97 181.29 3h6o h MET 377 N 0.82 0.42 -0.73 0.04 4.05 -1.29 -1.47 114.93 116.77 3h6o h MET 377 Ca 0.43 -0.21 0.07 0.00 -0.28 0.00 0.00 59.70 59.70 3h6o h MET 377 Cb 0.52 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.27 3h6o h MET 377 CO -0.19 0.77 0.41 1.96 0.23 0.00 0.00 176.91 180.09 3h6o h GLN 378 N 0.07 0.73 -0.32 0.39 4.20 -1.17 -1.75 115.11 117.26 3h6o h GLN 378 Ca 0.03 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.73 3h6o h GLN 378 Cb 0.68 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 3h6o h GLN 378 CO 0.04 0.48 0.13 1.25 -0.67 0.00 0.00 178.83 180.06 3h6o h HIS 379 N 0.75 0.24 -0.20 2.96 2.76 -1.12 -0.30 115.15 120.23 3h6o h HIS 379 Ca 0.33 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.51 3h6o h HIS 379 Cb 0.22 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 3h6o h HIS 379 CO -0.07 0.12 0.10 -0.07 -1.30 0.00 0.00 177.93 176.71 3h6o h LEU 380 N 0.28 0.27 -0.03 0.26 3.38 -0.96 -2.78 115.31 115.72 3h6o h LEU 380 Ca 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3h6o h LEU 380 Cb 0.09 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3h6o h LEU 380 CO -0.12 0.31 -0.01 0.40 0.09 0.00 0.00 178.44 179.10 3h6o h ILE 381 N 0.21 1.29 -0.69 1.22 2.04 -1.18 -2.38 117.51 118.01 3h6o h ILE 381 Ca 0.07 -0.89 0.08 0.00 1.00 0.00 0.00 64.86 65.12 3h6o h ILE 381 Cb 0.11 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 37.95 3h6o h ILE 381 CO -0.01 0.24 0.36 0.00 0.00 0.00 0.00 178.15 178.74 3h6o h ALA 382 N 0.65 0.94 -0.87 1.87 0.00 -1.11 0.27 119.26 121.00 3h6o h ALA 382 Ca 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3h6o h ALA 382 Cb 0.39 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3h6o h ALA 382 CO 0.00 -0.01 0.45 -0.09 0.00 0.00 0.00 179.25 179.60 3h6o h ARG 383 N 0.63 1.24 -0.47 0.00 2.43 -1.48 0.21 114.38 116.94 3h6o h ARG 383 Ca 0.33 -0.16 -0.13 0.00 -0.81 0.00 0.00 59.98 59.20 3h6o h ARG 383 Cb 0.30 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 3h6o h ARG 383 CO -0.24 0.93 -0.23 0.93 -1.51 0.00 0.00 179.97 179.86 3h6o h GLU 384 N 1.23 0.98 -0.27 0.20 4.39 -0.70 -3.17 114.58 117.24 3h6o h GLU 384 Ca 0.30 -0.42 -0.19 0.00 0.34 0.00 0.00 59.36 59.39 3h6o h GLU 384 Cb 0.08 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3h6o h GLU 384 CO -0.04 1.10 -0.58 0.00 -1.16 0.00 0.00 179.01 178.33 3h6o h ALA 385 N 0.88 0.45 -0.74 3.43 0.00 -0.07 -3.11 119.26 120.11 3h6o h ALA 385 Ca 0.11 -0.53 0.11 0.00 0.00 0.00 0.00 54.91 54.61 3h6o h ALA 385 Cb 0.80 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.44 3h6o h ALA 385 CO 0.07 0.68 0.34 0.93 0.00 0.00 0.00 179.25 181.27 3h6o h GLU 386 N 0.66 0.53 -0.00 0.00 5.08 -0.66 -0.35 114.58 119.84 3h6o h GLU 386 Ca 0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3h6o h GLU 386 Cb 1.19 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 3h6o h GLU 386 CO 0.13 0.35 -0.17 0.00 -1.00 0.00 0.00 179.01 178.32 3h6o h ALA 387 N 1.48 1.72 -0.00 3.43 0.00 -1.54 -3.15 119.26 121.19 3h6o h ALA 387 Ca 0.38 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3h6o h ALA 387 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3h6o h ALA 387 CO -0.32 0.21 -0.21 0.00 0.00 0.00 0.00 179.25 178.94 3h6o n ALA 388 N -2.51 2.95 -1.78 0.00 0.00 -0.18 -4.53 120.51 114.46 3h6o n ALA 388 Ca -0.02 -0.31 -0.41 0.00 0.00 0.00 0.00 53.44 52.69 3h6o n ALA 388 Cb 0.24 -1.24 -0.01 0.00 0.00 0.00 0.00 19.45 18.44 3h6o n ALA 388 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3h6o s ILE 389 N -2.59 2.19 -1.25 0.00 1.01 -0.97 -4.91 121.20 114.68 3h6o s ILE 389 Ca 0.24 0.19 -0.10 0.00 0.00 0.00 0.00 60.65 60.98 3h6o s ILE 389 Cb 0.19 -3.12 0.18 0.00 0.01 0.00 0.00 42.46 39.72 3h6o s ILE 389 CO 0.52 0.05 1.78 0.00 0.00 0.00 0.00 174.94 177.29 3h6o n TYR 390 N 0.52 3.20 -0.33 3.97 9.36 -1.26 -4.80 117.16 127.81 3h6o n TYR 390 Ca 0.01 -2.87 0.08 0.00 3.32 0.00 0.00 57.90 58.44 3h6o n TYR 390 Cb 0.40 -1.93 0.24 0.00 -0.63 0.00 0.00 39.34 37.42 3h6o n TYR 390 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3h6o h HIS 391 N 5.92 0.98 -0.48 2.98 3.86 -1.91 -1.78 115.15 124.73 3h6o h HIS 391 Ca 0.37 0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.70 3h6o h HIS 391 Cb 0.66 -0.30 -0.10 0.00 1.06 0.00 0.00 27.41 28.74 3h6o h HIS 391 CO 1.21 0.31 -0.27 1.25 0.86 0.00 0.00 177.93 181.29 3h6o h LEU 392 N 0.81 -0.92 0.15 2.43 5.85 -1.87 0.36 115.31 122.12 3h6o h LEU 392 Ca 0.49 0.19 -0.30 0.00 0.84 0.00 0.00 57.88 59.10 3h6o h LEU 392 Cb 0.60 0.47 0.01 0.00 0.37 0.00 0.00 40.66 42.11 3h6o h LEU 392 CO -0.31 -0.28 -1.38 -0.61 -0.34 0.00 0.00 178.44 175.51 3h6o h GLN 393 N -0.17 0.31 -0.09 1.25 4.15 -1.86 -2.91 115.11 115.81 3h6o h GLN 393 Ca 0.21 -0.54 0.03 0.00 0.77 0.00 0.00 58.65 59.13 3h6o h GLN 393 Cb 0.51 0.20 -0.04 0.00 0.21 0.00 0.00 27.48 28.36 3h6o h GLN 393 CO -0.57 1.23 -0.14 1.25 -1.93 0.00 0.00 178.83 178.67 3h6o h LEU 394 N 0.09 -0.42 -0.51 -2.39 5.85 -0.84 -0.03 115.31 117.06 3h6o h LEU 394 Ca -0.19 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 3h6o h LEU 394 Cb 2.02 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 43.23 3h6o h LEU 394 CO 0.20 -0.19 0.23 0.15 -0.34 0.00 0.00 178.44 178.49 3h6o h PHE 395 N -0.19 0.75 -0.60 1.25 -0.00 -0.42 -0.62 116.94 117.12 3h6o h PHE 395 Ca 0.08 -0.05 0.09 0.00 -0.00 0.00 0.00 57.97 58.10 3h6o h PHE 395 Cb 0.30 -0.23 -0.07 0.00 -0.00 0.00 0.00 35.95 35.95 3h6o h PHE 395 CO -0.24 0.61 0.21 0.93 -0.00 0.00 0.00 178.31 179.82 3h6o h GLU 396 N 0.68 0.37 -0.29 1.11 5.08 -1.28 -0.23 114.58 120.01 3h6o h GLU 396 Ca 0.17 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.37 3h6o h GLU 396 Cb 0.16 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 3h6o h GLU 396 CO -0.02 0.24 -0.35 0.93 -1.00 0.00 0.00 179.01 178.82 3h6o h GLU 397 N 0.38 0.75 -0.48 2.33 5.08 -0.82 -0.78 114.58 121.04 3h6o h GLU 397 Ca 0.30 -0.42 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3h6o h GLU 397 Cb 0.38 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3h6o h GLU 397 CO -0.31 1.04 0.27 -0.07 -1.00 0.00 0.00 179.01 178.94 3h6o h LEU 398 N 0.51 0.60 -0.87 1.33 3.38 -0.92 0.90 115.31 120.24 3h6o h LEU 398 Ca 0.04 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 3h6o h LEU 398 Cb 0.93 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 3h6o h LEU 398 CO 0.08 0.51 -0.38 0.08 0.09 0.00 0.00 178.44 178.83 3h6o h ARG 399 N 0.64 0.00 -0.07 1.13 0.11 -0.98 -2.31 114.38 112.89 3h6o h ARG 399 Ca 0.17 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.06 3h6o h ARG 399 Cb 0.05 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.12 3h6o h ARG 399 CO -0.03 0.38 -0.76 0.00 0.10 0.00 0.00 179.97 179.66 3h6o h ARG 400 N 0.00 0.45 -1.07 0.08 3.08 -0.93 -3.35 114.38 112.63 3h6o h ARG 400 Ca -0.00 -0.38 -0.42 0.00 0.07 0.00 0.00 59.98 59.24 3h6o h ARG 400 Cb 0.93 0.08 -0.23 0.00 0.08 0.00 0.00 29.97 30.84 3h6o h ARG 400 CO 0.05 1.02 0.54 1.28 -1.07 0.00 0.00 179.97 181.79 3h6o n LEU 401 N -3.83 6.18 -3.93 3.04 4.77 0.29 -4.88 117.00 118.64 3h6o n LEU 401 Ca -0.05 -3.29 -0.13 0.00 -0.03 0.00 0.00 56.01 52.52 3h6o n LEU 401 Cb 0.73 -0.83 -0.13 0.00 -2.33 0.00 0.00 43.42 40.85 3h6o n LEU 401 CO 0.49 1.04 -0.38 0.00 -1.33 0.00 0.00 177.39 177.21 3h6o s ALA 402 N -2.58 0.18 0.41 -1.18 0.00 -1.14 -4.97 121.76 112.49 3h6o s ALA 402 Ca 0.44 -0.21 -0.08 0.00 0.00 0.00 0.00 51.96 52.11 3h6o s ALA 402 Cb 0.36 -0.00 -0.05 0.00 0.00 0.00 0.00 23.12 23.43 3h6o s ALA 402 CO 0.06 0.00 0.73 -1.25 0.00 0.00 0.00 175.76 175.30 3h6o s PRO 403 N -0.39 3.68 -0.99 0.00 0.05 -1.26 -4.98 135.00 131.11 3h6o s PRO 403 Ca -0.03 0.30 -0.23 0.00 0.05 0.00 0.00 61.00 61.09 3h6o s PRO 403 Cb -0.03 -2.43 0.03 0.00 0.05 0.00 0.00 34.50 32.11 3h6o s PRO 403 CO -0.00 -0.04 1.57 0.42 0.05 0.00 0.00 177.00 179.00 3h6o s ILE 404 N -2.43 3.81 0.53 0.56 1.01 -1.26 -4.97 121.20 118.45 3h6o s ILE 404 Ca 0.49 -0.67 0.06 0.00 0.00 0.00 0.00 60.65 60.52 3h6o s ILE 404 Cb -0.10 -4.81 0.05 0.00 0.01 0.00 0.00 42.46 37.61 3h6o s ILE 404 CO 0.35 -1.70 0.73 0.42 0.00 0.00 0.00 174.94 174.74 3h6o s THR 405 N 6.21 2.59 -2.29 2.92 -4.23 -1.26 -5.02 115.64 114.57 3h6o s THR 405 Ca 0.52 -0.86 0.22 0.00 -1.18 0.00 0.00 61.69 60.39 3h6o s THR 405 Cb -0.02 -2.73 0.48 0.00 1.34 0.00 0.00 72.50 71.57 3h6o s THR 405 CO -0.08 0.00 1.45 -1.20 -0.54 0.00 0.00 174.62 174.25 3h6o n SER 406 N -2.20 3.22 -4.61 3.99 7.64 -1.26 -4.94 113.62 115.46 3h6o n SER 406 Ca 0.11 -1.96 -0.43 0.00 1.01 0.00 0.00 58.87 57.60 3h6o n SER 406 Cb 0.60 -0.29 -0.02 0.00 -1.01 0.00 0.00 64.21 63.48 3h6o n SER 406 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3h6o s ASP 407 N -1.33 6.42 0.21 6.43 2.15 -1.26 -4.91 116.67 124.38 3h6o s ASP 407 Ca 0.39 0.96 -0.09 0.00 0.43 0.00 0.00 52.55 54.25 3h6o s ASP 407 Cb 0.22 -2.54 0.27 0.00 -0.30 0.00 0.00 42.92 40.57 3h6o s ASP 407 CO 0.30 -1.34 1.80 -0.65 -0.17 0.00 0.00 175.17 175.11 3h6o h PRO 408 N 10.36 0.64 -0.67 4.34 0.11 -1.92 -2.52 132.00 142.35 3h6o h PRO 408 Ca -0.27 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.81 3h6o h PRO 408 Cb 1.11 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.04 3h6o h PRO 408 CO 1.07 0.42 0.44 1.79 -0.21 0.00 0.00 178.00 181.51 3h6o h THR 409 N 0.66 1.16 -0.42 -1.15 1.35 -1.90 0.19 112.91 112.80 3h6o h THR 409 Ca 0.31 -0.30 -0.15 0.00 -0.55 0.00 0.00 66.41 65.73 3h6o h THR 409 Cb 0.24 0.20 -0.01 0.00 -1.73 0.00 0.00 68.15 66.85 3h6o h THR 409 CO -0.21 0.16 -0.31 -0.33 -0.25 0.00 0.00 175.52 174.59 3h6o h GLU 410 N 0.88 0.95 -0.62 4.72 5.08 -1.79 -0.52 114.58 123.27 3h6o h GLU 410 Ca 0.25 -0.46 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 3h6o h GLU 410 Cb -0.07 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3h6o h GLU 410 CO -0.06 1.12 0.04 0.00 -1.00 0.00 0.00 179.01 179.11 3h6o h ALA 411 N 0.81 0.83 -0.46 3.43 0.00 -1.17 -2.12 119.26 120.58 3h6o h ALA 411 Ca 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3h6o h ALA 411 Cb 0.90 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3h6o h ALA 411 CO 0.08 0.65 0.18 1.15 0.00 0.00 0.00 179.25 181.30 3h6o h THR 412 N 0.98 1.21 0.10 0.00 2.02 -0.91 -1.72 112.91 114.59 3h6o h THR 412 Ca 0.18 -0.67 0.01 0.00 0.77 0.00 0.00 66.41 66.70 3h6o h THR 412 Cb 0.51 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 3h6o h THR 412 CO 0.02 0.25 -0.14 0.00 0.37 0.00 0.00 175.52 176.02 3h6o h ALA 413 N 1.02 -0.24 -0.21 6.16 0.00 -0.97 -1.46 119.26 123.55 3h6o h ALA 413 Ca 0.15 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 3h6o h ALA 413 Cb 0.21 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3h6o h ALA 413 CO -0.01 -0.66 -0.43 -0.24 0.00 0.00 0.00 179.25 177.91 3h6o h VAL 414 N -0.29 1.31 -0.33 0.00 3.04 -1.36 -2.14 116.25 116.48 3h6o h VAL 414 Ca 0.02 -1.60 -0.06 0.00 -1.01 0.00 0.00 66.70 64.04 3h6o h VAL 414 Cb 0.29 1.61 -0.02 0.00 -2.01 0.00 0.00 31.29 31.16 3h6o h VAL 414 CO -0.06 0.50 -0.06 1.23 -1.01 0.00 0.00 177.57 178.17 3h6o h GLY 415 N 1.09 0.59 0.91 3.17 0.00 -1.25 -1.08 103.07 106.50 3h6o h GLY 415 Ca 0.03 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 3h6o h GLY 415 CO 0.08 0.35 -0.00 0.00 0.00 0.00 0.00 176.54 176.97 3h6o h ALA 416 N 1.43 0.47 -0.54 3.60 0.00 -0.73 -0.99 119.26 122.49 3h6o h ALA 416 Ca 0.10 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3h6o h ALA 416 Cb 0.42 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3h6o h ALA 416 CO 0.02 0.23 0.01 0.28 0.00 0.00 0.00 179.25 179.79 3h6o h VAL 417 N 0.42 1.26 0.29 0.00 2.07 -1.32 -0.86 116.25 118.11 3h6o h VAL 417 Ca 0.10 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 66.53 3h6o h VAL 417 Cb 0.46 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 3h6o h VAL 417 CO 0.02 0.39 -0.38 -0.08 0.02 0.00 0.00 177.57 177.54 3h6o h GLU 418 N 0.82 -0.69 -0.83 1.57 4.57 -1.14 -2.15 114.58 116.74 3h6o h GLU 418 Ca 0.15 0.05 0.19 0.00 -1.18 0.00 0.00 59.36 58.57 3h6o h GLU 418 Cb 0.52 0.16 -0.12 0.00 -0.16 0.00 0.00 28.75 29.15 3h6o h GLU 418 CO 0.03 -0.46 0.31 0.00 -1.18 0.00 0.00 179.01 177.70 3h6o h ALA 419 N -0.25 1.22 -0.73 2.92 0.00 -1.09 -1.64 119.26 119.69 3h6o h ALA 419 Ca -0.01 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3h6o h ALA 419 Cb 0.67 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3h6o h ALA 419 CO -0.12 -0.31 0.30 0.66 0.00 0.00 0.00 179.25 179.78 3h6o h SER 420 N 0.37 0.98 -0.40 0.00 4.64 -0.83 -2.04 113.55 116.27 3h6o h SER 420 Ca 0.49 -0.14 -0.13 0.00 -0.47 0.00 0.00 61.79 61.54 3h6o h SER 420 Cb 0.87 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 3h6o h SER 420 CO -0.50 0.87 -0.24 -0.26 -0.87 0.00 0.00 176.83 175.82 3h6o h PHE 421 N 1.05 1.04 -0.43 4.77 0.04 -0.75 -0.78 116.94 121.88 3h6o h PHE 421 Ca 0.25 -0.25 -0.09 0.00 2.80 0.00 0.00 57.97 60.67 3h6o h PHE 421 Cb 0.18 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 3h6o h PHE 421 CO 0.02 1.05 -0.10 -0.22 -0.60 0.00 0.00 178.31 178.46 3h6o h LYS 422 N 0.78 0.77 -0.34 1.51 1.63 -0.66 -3.02 116.57 117.25 3h6o h LYS 422 Ca 0.10 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.65 3h6o h LYS 422 Cb 0.79 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.36 3h6o h LYS 422 CO 0.07 0.84 0.00 0.00 -3.45 0.00 0.00 179.45 176.91 3h6o s SER 425 N -3.58 5.25 0.48 0.00 1.04 -0.59 -4.93 113.70 111.36 3h6o s SER 425 Ca 0.45 2.19 0.28 0.00 0.48 0.00 0.00 55.95 59.35 3h6o s SER 425 Cb -0.23 -2.58 1.00 0.00 0.10 0.00 0.00 66.02 64.31 3h6o s SER 425 CO 0.94 -1.54 1.85 1.23 0.98 0.00 0.00 173.24 176.70 3h6o h GLY 426 N 0.61 0.00 -2.95 7.32 0.00 -1.71 -3.42 103.07 102.91 3h6o h GLY 426 Ca -0.49 0.00 0.08 0.00 0.00 0.00 0.00 47.33 46.92 3h6o h GLY 426 CO 0.55 0.00 0.38 0.00 0.00 0.00 0.00 176.54 177.47 3h6o s ALA 427 N -3.57 -1.67 -0.29 3.60 0.00 -1.26 -4.24 121.76 114.33 3h6o s ALA 427 Ca 0.02 0.58 -0.03 0.00 0.00 0.00 0.00 51.96 52.53 3h6o s ALA 427 Cb 0.09 0.64 0.03 0.00 0.00 0.00 0.00 23.12 23.88 3h6o s ALA 427 CO 0.61 -0.80 0.00 0.42 0.00 0.00 0.00 175.76 175.98 3h6o s ILE 428 N -3.41 3.17 -0.15 0.00 1.01 0.91 -2.05 121.20 120.68 3h6o s ILE 428 Ca 0.06 -1.13 -0.16 0.00 0.00 0.00 0.00 60.65 59.41 3h6o s ILE 428 Cb -0.02 -2.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 3h6o s ILE 428 CO -0.07 0.02 0.41 -0.63 0.00 0.00 0.00 174.94 174.67 3h6o s ILE 429 N 1.33 5.22 -0.06 2.92 1.01 0.16 -0.86 121.20 130.91 3h6o s ILE 429 Ca -0.02 0.79 -0.01 0.00 0.00 0.00 0.00 60.65 61.41 3h6o s ILE 429 Cb -0.18 -3.75 0.03 0.00 0.01 0.00 0.00 42.46 38.57 3h6o s ILE 429 CO -0.01 0.32 0.00 -0.69 0.00 0.00 0.00 174.94 174.56 3h6o s VAL 430 N 0.77 0.31 0.15 2.92 1.01 0.30 -0.07 120.40 125.79 3h6o s VAL 430 Ca 0.22 0.13 -0.28 0.00 0.00 0.00 0.00 61.98 62.05 3h6o s VAL 430 Cb -0.14 -0.46 -0.07 0.00 0.00 0.00 0.00 36.38 35.71 3h6o s VAL 430 CO 0.08 0.23 0.86 -0.76 0.00 0.00 0.00 175.10 175.51 3h6o s LEU 431 N 1.76 4.56 -0.27 3.92 1.43 -1.05 -1.13 118.68 127.90 3h6o s LEU 431 Ca 0.01 1.73 -0.24 0.00 -1.03 0.00 0.00 54.13 54.60 3h6o s LEU 431 Cb -0.13 -3.44 0.08 0.00 0.03 0.00 0.00 46.19 42.74 3h6o s LEU 431 CO -0.04 0.09 0.79 0.28 0.23 0.00 0.00 176.35 177.70 3h6o s THR 432 N -0.67 0.00 -0.23 5.49 -1.32 -0.60 -4.87 115.64 113.45 3h6o s THR 432 Ca 0.40 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.72 3h6o s THR 432 Cb -0.23 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.63 3h6o s THR 432 CO 0.28 0.00 -0.15 0.29 -2.21 0.00 0.00 174.62 172.83 3h6o n LYS 433 N 2.83 0.56 0.10 7.08 5.02 -1.26 -4.02 118.16 128.47 3h6o n LYS 433 Ca -0.15 0.39 0.12 0.00 -2.02 0.00 0.00 58.31 56.65 3h6o n LYS 433 Cb 0.56 -1.59 0.18 0.00 -0.02 0.00 0.00 35.03 34.16 3h6o n LYS 433 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3h6o h SER 434 N -1.00 0.00 0.00 4.39 4.64 -1.98 -3.42 113.55 116.18 3h6o h SER 434 Ca -0.42 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 3h6o h SER 434 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3h6o h SER 434 CO -0.26 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.37 3h6o n GLY 435 N 1.27 2.80 0.27 -0.77 0.00 -1.26 -4.83 105.19 102.68 3h6o n GLY 435 Ca 0.03 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.10 3h6o n GLY 435 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3h6o h ARG 436 N 2.69 0.41 -0.91 1.61 2.43 -1.95 -1.08 114.38 117.58 3h6o h ARG 436 Ca 0.00 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3h6o h ARG 436 Cb 0.00 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.41 3h6o h ARG 436 CO 0.00 0.27 0.59 0.77 -1.51 0.00 0.00 179.97 180.09 3h6o h SER 437 N 0.42 1.01 -0.25 -3.80 0.02 -1.92 -1.25 113.55 107.78 3h6o h SER 437 Ca 0.40 -0.02 -0.15 0.00 -0.84 0.00 0.00 61.79 61.19 3h6o h SER 437 Cb 0.61 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3h6o h SER 437 CO -0.40 0.71 -0.38 0.00 -1.14 0.00 0.00 176.83 175.61 3h6o h ALA 438 N 1.36 0.70 -0.59 3.77 0.00 -1.74 -3.07 119.26 119.69 3h6o h ALA 438 Ca 0.35 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.84 3h6o h ALA 438 Cb -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3h6o h ALA 438 CO -0.10 0.66 0.37 0.45 0.00 0.00 0.00 179.25 180.63 3h6o h HIS 439 N 0.65 0.69 -0.91 0.00 3.86 -0.60 -1.10 115.15 117.74 3h6o h HIS 439 Ca 0.06 0.02 0.06 0.00 -1.16 0.00 0.00 60.37 59.35 3h6o h HIS 439 Cb 0.94 -0.23 -0.06 0.00 1.06 0.00 0.00 27.41 29.12 3h6o h HIS 439 CO 0.05 0.40 0.57 1.96 0.86 0.00 0.00 177.93 181.77 3h6o h GLN 440 N 0.73 1.01 -0.18 2.45 4.20 -1.24 -1.46 115.11 120.63 3h6o h GLN 440 Ca 0.23 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.83 3h6o h GLN 440 Cb -0.00 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.54 3h6o h GLN 440 CO -0.09 0.67 -0.10 0.28 -0.67 0.00 0.00 178.83 178.92 3h6o h VAL 441 N 1.04 1.32 -0.17 -0.54 2.07 -1.39 -3.20 116.25 115.38 3h6o h VAL 441 Ca 0.39 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 3h6o h VAL 441 Cb 0.16 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 3h6o h VAL 441 CO -0.17 0.35 0.08 0.00 0.02 0.00 0.00 177.57 177.85 3h6o h ALA 442 N 0.67 1.83 -0.61 1.67 0.00 -0.89 -2.13 119.26 119.82 3h6o h ALA 442 Ca 0.04 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.00 3h6o h ALA 442 Cb 0.59 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 3h6o h ALA 442 CO 0.03 0.14 0.41 -0.09 0.00 0.00 0.00 179.25 179.74 3h6o h ARG 443 N 0.23 0.44 -0.19 0.00 2.43 -1.27 -0.68 114.38 115.34 3h6o h ARG 443 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3h6o h ARG 443 Cb 0.02 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3h6o h ARG 443 CO -0.01 0.29 0.00 0.66 -1.51 0.00 0.00 179.97 179.41 3h6o n TYR 444 N -4.47 0.25 -3.44 2.20 4.01 -0.80 -4.96 117.16 109.95 3h6o n TYR 444 Ca 0.10 -0.12 -0.18 0.00 -0.16 0.00 0.00 57.90 57.53 3h6o n TYR 444 Cb 0.34 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.44 3h6o n TYR 444 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3h6o n ARG 445 N 0.28 -4.91 -2.22 -0.72 5.12 -0.26 -4.80 116.66 109.14 3h6o n ARG 445 Ca 0.15 0.80 -0.36 0.00 -1.93 0.00 0.00 57.85 56.51 3h6o n ARG 445 Cb 0.30 -5.66 0.00 0.00 -1.16 0.00 0.00 32.46 25.94 3h6o n ARG 445 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3h6o s PRO 446 N -5.23 3.44 0.19 5.56 0.04 -1.26 -4.94 135.00 132.80 3h6o s PRO 446 Ca 0.15 1.70 -0.12 0.00 0.04 0.00 0.00 61.00 62.77 3h6o s PRO 446 Cb -0.02 -2.13 0.11 0.00 0.04 0.00 0.00 34.50 32.50 3h6o s PRO 446 CO 0.75 -0.80 1.85 -0.09 0.04 0.00 0.00 177.00 178.76 3h6o h ARG 447 N 1.45 0.87 -6.94 4.56 2.43 -1.94 -3.45 114.38 111.35 3h6o h ARG 447 Ca -0.50 -0.06 -0.51 0.00 -0.81 0.00 0.00 59.98 58.11 3h6o h ARG 447 Cb 1.26 -0.19 0.05 0.00 -0.42 0.00 0.00 29.97 30.67 3h6o h ARG 447 CO 0.58 0.59 0.50 0.00 -1.51 0.00 0.00 179.97 180.12 3h6o s ALA 448 N -6.10 3.15 0.45 2.80 0.00 -1.26 -5.00 121.76 115.80 3h6o s ALA 448 Ca -0.13 0.95 -0.23 0.00 0.00 0.00 0.00 51.96 52.56 3h6o s ALA 448 Cb 0.14 -3.37 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 3h6o s ALA 448 CO 0.77 -0.52 1.13 -1.25 0.00 0.00 0.00 175.76 175.89 3h6o s PRO 449 N -2.32 3.81 -0.49 0.00 0.04 -1.26 -4.64 135.00 130.15 3h6o s PRO 449 Ca 0.57 1.69 -0.13 0.00 0.04 0.00 0.00 61.00 63.17 3h6o s PRO 449 Cb -0.30 -2.39 0.11 0.00 0.04 0.00 0.00 34.50 31.96 3h6o s PRO 449 CO 0.38 -0.48 0.41 0.42 0.04 0.00 0.00 177.00 177.76 3h6o s ILE 450 N -1.61 4.84 -0.63 0.56 1.01 0.41 -0.06 121.20 125.72 3h6o s ILE 450 Ca 0.63 -1.47 -0.27 0.00 0.00 0.00 0.00 60.65 59.54 3h6o s ILE 450 Cb -0.26 -4.06 0.03 0.00 0.01 0.00 0.00 42.46 38.18 3h6o s ILE 450 CO 0.32 -0.74 1.18 -0.63 0.00 0.00 0.00 174.94 175.07 3h6o s ILE 451 N 1.53 3.98 -0.37 2.92 1.01 -0.04 0.09 121.20 130.31 3h6o s ILE 451 Ca 0.04 0.63 -0.17 0.00 0.00 0.00 0.00 60.65 61.14 3h6o s ILE 451 Cb -0.27 -4.77 0.00 0.00 0.01 0.00 0.00 42.46 37.43 3h6o s ILE 451 CO 0.03 -1.49 0.47 0.00 0.00 0.00 0.00 174.94 173.95 3h6o s ALA 452 N 5.06 3.46 -0.25 9.38 0.00 -0.97 -0.54 121.76 137.90 3h6o s ALA 452 Ca 0.38 -1.16 -0.14 0.00 0.00 0.00 0.00 51.96 51.04 3h6o s ALA 452 Cb -0.09 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.00 3h6o s ALA 452 CO 0.21 -1.28 0.33 0.08 0.00 0.00 0.00 175.76 175.10 3h6o s VAL 453 N 2.28 5.22 0.01 0.00 1.01 -0.28 -0.04 120.40 128.61 3h6o s VAL 453 Ca 0.16 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.61 3h6o s VAL 453 Cb -0.16 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 3h6o s VAL 453 CO 0.13 0.22 0.03 0.28 0.00 0.00 0.00 175.10 175.77 3h6o s THR 454 N 1.70 0.10 -1.38 3.92 -1.32 -0.65 -1.55 115.64 116.45 3h6o s THR 454 Ca 0.14 -0.82 0.24 0.00 -1.21 0.00 0.00 61.69 60.04 3h6o s THR 454 Cb -0.15 -0.32 0.00 0.00 -1.51 0.00 0.00 72.50 70.52 3h6o s THR 454 CO 0.09 -0.45 1.25 0.54 -2.21 0.00 0.00 174.62 173.84 3h6o n ARG 455 N 1.55 0.44 -3.12 7.08 1.74 -1.26 -1.18 116.66 121.91 3h6o n ARG 455 Ca -0.23 -0.31 -0.42 0.00 -0.77 0.00 0.00 57.85 56.11 3h6o n ARG 455 Cb 0.55 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 30.43 3h6o n ARG 455 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3h6o s ASN 456 N -2.78 6.35 0.38 0.55 3.84 -1.26 -4.90 114.94 117.12 3h6o s ASN 456 Ca 0.15 -0.18 0.09 0.00 0.21 0.00 0.00 52.86 53.13 3h6o s ASN 456 Cb 0.18 -2.32 0.77 0.00 -0.55 0.00 0.00 41.25 39.33 3h6o s ASN 456 CO 0.68 -0.70 1.92 -0.65 -2.79 0.00 0.00 177.10 175.56 3h6o h PRO 457 N 8.73 0.29 -0.48 0.43 0.11 -1.95 -2.10 132.00 137.03 3h6o h PRO 457 Ca -0.26 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.67 3h6o h PRO 457 Cb 1.10 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3h6o h PRO 457 CO 0.87 0.39 -0.15 0.37 -0.21 0.00 0.00 178.00 179.26 3h6o h GLN 458 N 0.28 0.95 -0.28 1.05 4.15 -1.97 -1.88 115.11 117.40 3h6o h GLN 458 Ca 0.06 -0.38 0.03 0.00 0.77 0.00 0.00 58.65 59.13 3h6o h GLN 458 Cb 0.34 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.95 3h6o h GLN 458 CO 0.02 1.05 0.09 1.15 -1.93 0.00 0.00 178.83 179.20 3h6o h THR 459 N 0.80 0.91 -0.92 2.39 2.02 -1.74 -0.66 112.91 115.70 3h6o h THR 459 Ca 0.12 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.24 3h6o h THR 459 Cb 0.72 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 3h6o h THR 459 CO 0.05 0.04 0.61 0.00 0.37 0.00 0.00 175.52 176.59 3h6o h ALA 460 N 1.19 1.18 -0.13 6.16 0.00 -1.20 -1.56 119.26 124.89 3h6o h ALA 460 Ca 0.13 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 460 Cb 0.11 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.53 3h6o h ALA 460 CO -0.14 0.55 -0.53 0.00 0.00 0.00 0.00 179.25 179.13 3h6o h ARG 461 N 1.24 0.60 0.00 0.00 3.08 -1.11 -3.13 114.38 115.05 3h6o h ARG 461 Ca 0.34 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.93 3h6o h ARG 461 Cb -0.12 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3h6o h ARG 461 CO -0.08 1.09 0.00 1.96 -1.07 0.00 0.00 179.97 181.86 3h6o h GLN 462 N 0.24 0.00 0.00 0.04 4.20 -1.04 -3.21 115.11 115.34 3h6o h GLN 462 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3h6o h GLN 462 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 3h6o h GLN 462 CO 0.11 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.27 3h6o h ALA 463 N 2.22 1.00 0.00 3.87 0.00 -1.22 -2.72 119.26 122.41 3h6o h ALA 463 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h6o h ALA 463 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3h6o h ALA 463 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 3h6o n HIS 464 N -3.01 0.72 0.44 0.00 8.25 -1.21 -2.47 115.22 117.94 3h6o n HIS 464 Ca 0.01 0.34 0.10 0.00 -0.26 0.00 0.00 57.72 57.91 3h6o n HIS 464 Cb 0.33 -1.04 0.42 0.00 1.12 0.00 0.00 29.99 30.81 3h6o n HIS 464 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3h6o n LEU 465 N -2.21 0.40 -4.36 2.41 4.77 -1.03 -4.43 117.00 112.55 3h6o n LEU 465 Ca -0.00 0.60 -0.33 0.00 -0.03 0.00 0.00 56.01 56.25 3h6o n LEU 465 Cb 0.10 -0.54 -0.14 0.00 -2.33 0.00 0.00 43.42 40.51 3h6o n LEU 465 CO 0.13 -0.43 -0.44 -0.31 -1.33 0.00 0.00 177.39 175.01 3h6o s TYR 466 N -3.19 2.83 0.01 -1.77 2.02 -1.03 -4.58 117.35 111.64 3h6o s TYR 466 Ca 0.05 -0.70 -0.37 0.00 -0.37 0.00 0.00 57.07 55.68 3h6o s TYR 466 Cb 0.09 -1.88 -0.16 0.00 -0.40 0.00 0.00 41.96 39.61 3h6o s TYR 466 CO 0.34 -0.26 1.46 -2.13 -1.57 0.00 0.00 175.55 173.39 3h6o n ARG 467 N 3.70 1.26 0.00 -0.62 3.00 -1.26 -2.59 116.66 120.15 3h6o n ARG 467 Ca -0.18 0.46 0.00 0.00 -0.00 0.00 0.00 57.85 58.12 3h6o n ARG 467 Cb 0.52 -2.12 0.00 0.00 0.00 0.00 0.00 32.46 30.86 3h6o n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3h6o n GLY 468 N 3.01 3.32 3.62 5.14 0.00 0.29 -4.73 105.19 115.83 3h6o n GLY 468 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 3h6o n GLY 468 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h6o s ILE 469 N -2.39 4.36 -0.69 -0.61 1.01 -1.07 -0.44 121.20 121.37 3h6o s ILE 469 Ca 0.00 1.42 -0.17 0.00 0.00 0.00 0.00 60.65 61.90 3h6o s ILE 469 Cb 0.00 -4.51 0.15 0.00 0.01 0.00 0.00 42.46 38.11 3h6o s ILE 469 CO 0.00 -0.76 0.72 0.72 0.00 0.00 0.00 174.94 175.62 3h6o s PHE 470 N 4.05 3.30 0.16 3.97 -0.12 0.11 -4.66 117.98 124.79 3h6o s PHE 470 Ca 0.46 -1.40 -0.30 0.00 -0.05 0.00 0.00 56.93 55.64 3h6o s PHE 470 Cb -0.10 -3.93 -0.07 0.00 -0.63 0.00 0.00 43.02 38.29 3h6o s PHE 470 CO 0.24 -1.16 1.08 -1.25 -0.05 0.00 0.00 175.22 174.08 3h6o s PRO 471 N 1.66 4.61 -0.05 1.99 0.04 -1.26 -2.30 135.00 139.69 3h6o s PRO 471 Ca 0.14 1.67 0.02 0.00 0.04 0.00 0.00 61.00 62.86 3h6o s PRO 471 Cb -0.19 -3.30 0.01 0.00 0.04 0.00 0.00 34.50 31.06 3h6o s PRO 471 CO -0.01 0.10 -0.09 0.14 0.04 0.00 0.00 177.00 177.18 3h6o s VAL 472 N -0.16 0.82 -0.36 -0.36 -7.23 0.95 -4.54 120.40 109.51 3h6o s VAL 472 Ca 0.49 -0.32 -0.14 0.00 -1.81 0.00 0.00 61.98 60.20 3h6o s VAL 472 Cb -0.28 -0.77 -0.01 0.00 0.56 0.00 0.00 36.38 35.88 3h6o s VAL 472 CO 0.34 0.28 0.27 -0.22 -0.31 0.00 0.00 175.10 175.45 3h6o s LEU 473 N 0.59 4.68 -0.04 1.32 2.96 -1.26 -1.64 118.68 125.30 3h6o s LEU 473 Ca -0.10 -0.54 -0.30 0.00 -0.22 0.00 0.00 54.13 52.97 3h6o s LEU 473 Cb -0.13 -2.17 -0.02 0.00 0.50 0.00 0.00 46.19 44.37 3h6o s LEU 473 CO 0.02 -0.31 0.99 0.00 -1.32 0.00 0.00 176.35 175.73 3h6o n LYS 475 N 4.30 0.40 -2.08 0.00 4.76 -1.26 -4.58 118.16 119.70 3h6o n LYS 475 Ca 0.07 -0.31 -0.36 0.00 -2.87 0.00 0.00 58.31 54.84 3h6o n LYS 475 Cb 0.50 -1.49 0.02 0.00 -1.84 0.00 0.00 35.03 32.22 3h6o n LYS 475 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3h6o s ASP 476 N -2.83 5.43 0.71 4.39 1.11 -1.26 -5.00 116.67 119.23 3h6o s ASP 476 Ca 0.11 2.36 -0.13 0.00 0.18 0.00 0.00 52.55 55.07 3h6o s ASP 476 Cb 0.17 -2.60 0.03 0.00 1.07 0.00 0.00 42.92 41.59 3h6o s ASP 476 CO 0.77 -1.43 1.11 -2.84 1.18 0.00 0.00 175.17 173.96 3h6o s PRO 477 N -3.21 2.51 0.09 8.23 0.02 -1.26 -4.95 135.00 136.42 3h6o s PRO 477 Ca 0.74 1.33 -0.31 0.00 0.02 0.00 0.00 61.00 62.78 3h6o s PRO 477 Cb -0.29 -1.92 -0.09 0.00 0.02 0.00 0.00 34.50 32.22 3h6o s PRO 477 CO 0.33 -1.47 1.66 0.08 -0.33 0.00 0.00 177.00 177.27 3h6o s VAL 478 N -2.55 2.93 0.47 3.83 1.01 -1.26 -4.97 120.40 119.86 3h6o s VAL 478 Ca 0.65 0.43 -0.21 0.00 0.00 0.00 0.00 61.98 62.85 3h6o s VAL 478 Cb -0.20 -3.28 -0.09 0.00 0.00 0.00 0.00 36.38 32.82 3h6o s VAL 478 CO 0.48 0.00 1.04 -1.10 0.00 0.00 0.00 175.10 175.52 3h6o s GLN 479 N 2.49 3.85 0.12 2.72 -1.52 -1.26 -4.96 119.66 121.10 3h6o s GLN 479 Ca 0.74 1.38 -0.25 0.00 -1.95 0.00 0.00 55.36 55.29 3h6o s GLN 479 Cb -0.41 -2.15 -0.05 0.00 -0.22 0.00 0.00 33.01 30.18 3h6o s GLN 479 CO 0.33 -0.39 1.65 1.05 -0.25 0.00 0.00 175.29 177.68 3h6o h GLU 480 N 1.69 -0.31 -6.10 2.91 4.11 -1.99 -3.41 114.58 111.48 3h6o h GLU 480 Ca -0.49 0.02 -0.57 0.00 0.07 0.00 0.00 59.36 58.39 3h6o h GLU 480 Cb 1.22 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.49 3h6o h GLU 480 CO 0.59 -0.21 -0.03 0.00 0.07 0.00 0.00 179.01 179.43 3h6o s ALA 481 N -6.10 3.52 0.15 1.06 0.00 -1.26 -5.00 121.76 114.14 3h6o s ALA 481 Ca -0.15 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.71 3h6o s ALA 481 Cb 0.09 -2.70 0.00 0.00 0.00 0.00 0.00 23.12 20.52 3h6o s ALA 481 CO 0.66 0.23 1.55 2.35 0.00 0.00 0.00 175.76 180.55 3h6o h TRP 482 N 5.40 1.06 -0.49 0.00 7.01 -2.00 -2.59 115.95 124.34 3h6o h TRP 482 Ca -0.46 -0.24 0.10 0.00 2.11 0.00 0.00 58.89 60.39 3h6o h TRP 482 Cb 1.20 -0.25 -0.10 0.00 -2.10 0.00 0.00 29.16 27.91 3h6o h TRP 482 CO 0.66 1.04 -0.14 0.00 -2.79 0.00 0.00 178.44 177.21 3h6o h ALA 483 N 0.87 0.30 -0.06 2.65 0.00 -1.95 -1.48 119.26 119.59 3h6o h ALA 483 Ca 0.11 0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 3h6o h ALA 483 Cb 0.72 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3h6o h ALA 483 CO 0.05 -0.46 -0.49 0.93 0.00 0.00 0.00 179.25 179.29 3h6o h GLU 484 N -0.02 0.15 -0.55 0.00 5.08 -1.93 -2.44 114.58 114.87 3h6o h GLU 484 Ca 0.24 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3h6o h GLU 484 Cb 0.38 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 3h6o h GLU 484 CO -0.52 0.61 0.15 0.22 -1.00 0.00 0.00 179.01 178.48 3h6o h ASP 485 N 0.12 0.78 -0.08 1.42 3.58 -0.89 -0.64 116.42 120.70 3h6o h ASP 485 Ca 0.00 -0.13 -0.06 0.00 0.42 0.00 0.00 57.03 57.26 3h6o h ASP 485 Cb 0.91 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.76 3h6o h ASP 485 CO 0.07 0.75 -0.19 0.58 -2.88 0.00 0.00 179.24 177.58 3h6o h VAL 486 N 0.81 1.41 -0.83 2.25 2.07 -1.16 -3.07 116.25 117.73 3h6o h VAL 486 Ca 0.18 -1.50 0.06 0.00 0.82 0.00 0.00 66.70 66.26 3h6o h VAL 486 Cb 0.27 2.18 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 3h6o h VAL 486 CO -0.00 0.43 0.54 0.44 0.02 0.00 0.00 177.57 178.99 3h6o h ASP 487 N -0.19 0.83 -0.38 0.57 3.32 -1.28 -0.97 116.42 118.31 3h6o h ASP 487 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 3h6o h ASP 487 Cb 0.78 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 3h6o h ASP 487 CO 0.04 0.54 0.25 0.25 -1.72 0.00 0.00 179.24 178.60 3h6o h LEU 488 N 0.94 0.42 -0.74 1.55 6.46 -1.12 -0.05 115.31 122.77 3h6o h LEU 488 Ca 0.35 -0.01 -0.13 0.00 -0.12 0.00 0.00 57.88 57.97 3h6o h LEU 488 Cb 0.18 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 3h6o h LEU 488 CO -0.12 0.30 -0.60 0.03 -0.62 0.00 0.00 178.44 177.43 3h6o h ARG 489 N 0.50 0.10 -0.46 1.25 3.08 -1.34 -0.32 114.38 117.18 3h6o h ARG 489 Ca 0.14 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 3h6o h ARG 489 Cb -0.04 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3h6o h ARG 489 CO -0.04 0.67 -0.05 0.28 -1.07 0.00 0.00 179.97 179.76 3h6o h VAL 490 N 0.07 1.27 -0.48 2.04 2.07 -0.97 -1.96 116.25 118.29 3h6o h VAL 490 Ca -0.01 -1.14 -0.10 0.00 0.82 0.00 0.00 66.70 66.27 3h6o h VAL 490 Cb 1.08 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 3h6o h VAL 490 CO 0.08 0.39 -0.11 0.78 0.02 0.00 0.00 177.57 178.74 3h6o h ASN 491 N 0.70 0.88 -0.97 0.57 2.35 -0.81 -1.26 115.58 117.03 3h6o h ASN 491 Ca 0.13 -0.28 0.08 0.00 -0.55 0.00 0.00 56.30 55.68 3h6o h ASN 491 Cb 0.57 -0.24 -0.07 0.00 0.05 0.00 0.00 38.32 38.63 3h6o h ASN 491 CO 0.03 1.00 0.62 0.15 -1.65 0.00 0.00 177.43 177.58 3h6o h PHE 492 N 0.79 1.13 -0.47 1.19 3.57 -0.99 0.80 116.94 122.97 3h6o h PHE 492 Ca 0.13 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 3h6o h PHE 492 Cb 0.63 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3h6o h PHE 492 CO 0.04 0.53 -0.23 0.00 -2.23 0.00 0.00 178.31 176.42 3h6o h ALA 493 N 1.48 0.66 -0.47 2.41 0.00 -0.82 -1.08 119.26 121.43 3h6o h ALA 493 Ca 0.44 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h6o h ALA 493 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3h6o h ALA 493 CO -0.21 0.65 0.29 0.52 0.00 0.00 0.00 179.25 180.50 3h6o h MET 494 N 0.83 0.64 -0.58 0.00 2.86 -0.59 -1.53 114.93 116.55 3h6o h MET 494 Ca 0.10 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.60 3h6o h MET 494 Cb 0.81 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.31 3h6o h MET 494 CO 0.07 0.46 -0.00 -0.91 1.06 0.00 0.00 176.91 177.58 3h6o h ASN 495 N 0.63 1.01 -0.39 1.22 2.35 -0.75 -1.92 115.58 117.72 3h6o h ASN 495 Ca 0.17 -0.31 0.04 0.00 -0.55 0.00 0.00 56.30 55.65 3h6o h ASN 495 Cb -0.02 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.04 3h6o h ASN 495 CO -0.03 1.07 0.16 0.58 -1.65 0.00 0.00 177.43 177.56 3h6o h VAL 496 N 0.92 0.91 -0.53 2.81 2.07 -1.02 -1.23 116.25 120.18 3h6o h VAL 496 Ca 0.16 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.49 3h6o h VAL 496 Cb 0.56 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 3h6o h VAL 496 CO 0.03 0.06 -0.01 1.23 0.02 0.00 0.00 177.57 178.91 3h6o h GLY 497 N 0.33 1.01 0.94 2.17 0.00 -1.09 -0.73 103.07 105.70 3h6o h GLY 497 Ca 0.18 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 3h6o h GLY 497 CO -0.16 0.69 -0.00 0.50 0.00 0.00 0.00 176.54 177.57 3h6o h LYS 498 N 0.81 0.68 -0.37 4.80 1.57 -1.29 0.21 116.57 122.98 3h6o h LYS 498 Ca 0.15 -0.22 -0.11 0.00 -1.87 0.00 0.00 60.65 58.61 3h6o h LYS 498 Cb 0.54 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3h6o h LYS 498 CO 0.03 0.78 -0.20 0.00 -0.57 0.00 0.00 179.45 179.49 3h6o h ALA 499 N 0.88 0.95 -0.00 3.86 0.00 -1.17 -2.87 119.26 120.91 3h6o h ALA 499 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3h6o h ALA 499 Cb 0.47 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3h6o h ALA 499 CO 0.02 0.61 -0.14 0.54 0.00 0.00 0.00 179.25 180.28 3h6o n ARG 500 N -4.13 0.33 -1.02 0.00 5.12 -0.29 -4.94 116.66 111.74 3h6o n ARG 500 Ca 0.00 -0.10 -0.01 0.00 -1.93 0.00 0.00 57.85 55.82 3h6o n ARG 500 Cb 0.41 -1.50 -0.00 0.00 -1.16 0.00 0.00 32.46 30.21 3h6o n ARG 500 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3h6o n GLY 501 N 1.39 0.47 0.19 -0.13 0.00 -0.39 -4.93 105.19 101.77 3h6o n GLY 501 Ca 0.11 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.40 3h6o n GLY 501 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3h6o h PHE 502 N 0.00 0.18 -2.77 1.61 0.04 -0.93 -3.44 116.94 111.64 3h6o h PHE 502 Ca -0.02 -0.05 0.10 0.00 2.80 0.00 0.00 57.97 60.80 3h6o h PHE 502 Cb 0.07 -0.04 -0.05 0.00 2.20 0.00 0.00 35.95 38.13 3h6o h PHE 502 CO 0.03 0.55 0.34 -0.59 -0.60 0.00 0.00 178.31 178.04 3h6o s PHE 503 N -4.12 -0.11 0.24 -0.55 -0.12 -1.21 -4.86 117.98 107.24 3h6o s PHE 503 Ca -0.04 -0.33 0.02 0.00 -0.05 0.00 0.00 56.93 56.53 3h6o s PHE 503 Cb 0.14 0.71 -0.05 0.00 -0.63 0.00 0.00 43.02 43.18 3h6o s PHE 503 CO 0.76 -1.14 0.04 -1.59 -0.05 0.00 0.00 175.22 173.23 3h6o s LYS 504 N -3.37 1.35 0.20 1.99 -2.85 -1.26 -3.98 119.74 111.82 3h6o s LYS 504 Ca 0.13 -1.70 -0.31 0.00 -1.00 0.00 0.00 55.97 53.08 3h6o s LYS 504 Cb -0.04 -0.46 -0.16 0.00 -2.06 0.00 0.00 37.83 35.11 3h6o s LYS 504 CO 0.06 -0.18 1.04 1.17 0.10 0.00 0.00 175.35 177.54 3h6o n LYS 505 N -0.43 1.03 0.00 1.78 4.81 -1.26 -1.32 118.16 122.76 3h6o n LYS 505 Ca -0.03 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.77 3h6o n LYS 505 Cb 0.65 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 33.93 3h6o n LYS 505 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h6o n GLY 506 N 1.77 3.16 3.76 3.14 0.00 -0.83 -4.93 105.19 111.25 3h6o n GLY 506 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3h6o n GLY 506 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h6o s ASP 507 N -0.57 5.25 -0.01 1.61 1.01 -0.44 -4.57 116.67 118.95 3h6o s ASP 507 Ca 0.00 2.29 -0.20 0.00 0.71 0.00 0.00 52.55 55.34 3h6o s ASP 507 Cb 0.00 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.29 3h6o s ASP 507 CO 0.00 -1.54 0.58 0.54 0.21 0.00 0.00 175.17 174.96 3h6o s VAL 508 N -1.75 4.94 0.16 -1.27 0.11 -1.26 0.11 120.40 121.44 3h6o s VAL 508 Ca 0.75 1.21 0.05 0.00 -2.93 0.00 0.00 61.98 61.07 3h6o s VAL 508 Cb -0.27 -3.92 -0.04 0.00 -1.53 0.00 0.00 36.38 30.61 3h6o s VAL 508 CO 0.33 0.41 -0.12 0.68 -3.33 0.00 0.00 175.10 173.08 3h6o s VAL 509 N -0.13 1.34 -0.14 2.04 -7.23 0.26 -1.88 120.40 114.66 3h6o s VAL 509 Ca 0.31 -2.08 -0.07 0.00 -1.81 0.00 0.00 61.98 58.33 3h6o s VAL 509 Cb -0.18 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.84 3h6o s VAL 509 CO 0.17 -0.68 0.10 -0.63 -0.31 0.00 0.00 175.10 173.74 3h6o s ILE 510 N -3.14 5.13 -0.12 -0.62 -1.09 -0.87 -1.14 121.20 119.35 3h6o s ILE 510 Ca 0.18 0.07 0.01 0.00 -2.23 0.00 0.00 60.65 58.68 3h6o s ILE 510 Cb 0.01 -3.25 0.02 0.00 -1.58 0.00 0.00 42.46 37.66 3h6o s ILE 510 CO 0.02 0.56 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.45 3h6o s VAL 511 N -0.54 1.58 -0.22 2.92 1.01 0.22 0.35 120.40 125.73 3h6o s VAL 511 Ca 0.11 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 3h6o s VAL 511 Cb -0.12 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 3h6o s VAL 511 CO 0.02 0.46 -0.01 -0.76 0.00 0.00 0.00 175.10 174.81 3h6o s LEU 512 N 1.13 3.10 0.29 3.92 1.43 0.90 -1.01 118.68 128.45 3h6o s LEU 512 Ca -0.03 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 3h6o s LEU 512 Cb -0.14 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 3h6o s LEU 512 CO -0.05 0.01 0.11 0.42 0.23 0.00 0.00 176.35 177.08 3h6o s THR 513 N 1.31 0.57 0.58 5.49 -4.23 0.07 -2.53 115.64 116.90 3h6o s THR 513 Ca 0.04 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.63 3h6o s THR 513 Cb -0.15 -2.60 0.08 0.00 1.34 0.00 0.00 72.50 71.17 3h6o s THR 513 CO -0.00 0.00 0.65 0.61 -0.54 0.00 0.00 174.62 175.34 3h6o n GLY 514 N -0.55 2.30 0.14 3.99 0.00 -1.26 -0.85 105.19 108.95 3h6o n GLY 514 Ca -0.00 -2.26 0.12 0.00 0.00 0.00 0.00 46.02 43.87 3h6o n GLY 514 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3h6o n TRP 515 N -2.09 0.00 -3.68 1.61 4.27 -1.15 -4.84 117.44 111.55 3h6o n TRP 515 Ca 0.09 0.00 -0.08 0.00 -3.89 0.00 0.00 57.50 53.61 3h6o n TRP 515 Cb 0.63 -0.14 -0.02 0.00 -1.36 0.00 0.00 31.31 30.42 3h6o n TRP 515 CO 0.00 0.00 0.00 -0.98 -2.29 0.00 0.00 177.69 174.42 3h6o s ARG 516 N -2.78 1.50 0.97 -2.67 1.70 -1.26 -5.16 118.95 111.25 3h6o s ARG 516 Ca 0.16 -0.74 -0.13 0.00 -0.47 0.00 0.00 55.73 54.55 3h6o s ARG 516 Cb 0.18 0.57 0.17 0.00 -0.57 0.00 0.00 34.95 35.29 3h6o s ARG 516 CO 0.65 -0.68 1.13 -1.25 -1.08 0.00 0.00 175.30 174.08 3h6o s PRO 517 N -3.74 0.69 0.00 3.89 0.05 -1.26 -4.83 135.00 129.80 3h6o s PRO 517 Ca 0.08 0.29 0.00 0.00 0.05 0.00 0.00 61.00 61.42 3h6o s PRO 517 Cb -0.04 -1.79 0.00 0.00 0.05 0.00 0.00 34.50 32.73 3h6o s PRO 517 CO -0.01 -2.51 0.00 0.41 0.05 0.00 0.00 177.00 174.94 3h6o n GLY 518 N -1.82 -0.98 3.79 0.56 0.00 -1.26 -4.96 105.19 100.51 3h6o n GLY 518 Ca 0.07 -1.54 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 3h6o n GLY 518 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6o s SER 519 N -2.30 5.64 0.00 1.61 0.01 -1.26 -4.25 113.70 113.15 3h6o s SER 519 Ca 0.00 1.94 0.00 0.00 1.31 0.00 0.00 55.95 59.20 3h6o s SER 519 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3h6o s SER 519 CO 0.00 -1.26 0.00 0.61 0.41 0.00 0.00 173.24 173.00 3h6o n GLY 520 N -0.59 0.48 0.98 3.44 0.00 -1.26 -4.96 105.19 103.28 3h6o n GLY 520 Ca 0.10 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.20 3h6o n GLY 520 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h6o n PHE 521 N -2.00 1.04 -1.94 1.61 3.72 -1.26 -4.88 117.46 113.75 3h6o n PHE 521 Ca 0.00 -0.86 -0.42 0.00 -0.05 0.00 0.00 57.45 56.12 3h6o n PHE 521 Cb 0.00 -0.33 -0.03 0.00 -0.94 0.00 0.00 39.48 38.18 3h6o n PHE 521 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3h6o s THR 522 N -2.81 3.46 0.00 4.37 2.01 -1.26 -2.92 115.64 118.49 3h6o s THR 522 Ca 0.43 0.57 0.00 0.00 0.31 0.00 0.00 61.69 63.00 3h6o s THR 522 Cb 0.35 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.49 3h6o s THR 522 CO 0.10 -0.05 0.05 -0.46 -0.69 0.00 0.00 174.62 173.57 3h6o n ASN 523 N 7.17 0.00 -3.98 3.53 6.94 -0.77 -3.73 115.26 124.41 3h6o n ASN 523 Ca 0.18 -1.00 -0.29 0.00 -0.02 0.00 0.00 54.58 53.44 3h6o n ASN 523 Cb 0.42 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.68 3h6o n ASN 523 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 3h6o s THR 524 N 0.00 1.43 -0.15 5.53 2.01 -0.03 -4.93 115.64 119.50 3h6o s THR 524 Ca 0.00 -0.64 -0.01 0.00 0.31 0.00 0.00 61.69 61.35 3h6o s THR 524 Cb 0.00 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.08 3h6o s THR 524 CO 0.00 0.35 -0.10 -0.32 -0.69 0.00 0.00 174.62 173.86 3h6o s MET 525 N 1.53 3.46 0.03 4.92 1.75 -1.26 -0.75 119.30 128.98 3h6o s MET 525 Ca 0.03 -0.64 0.05 0.00 -1.25 0.00 0.00 55.69 53.89 3h6o s MET 525 Cb -0.14 -2.74 -0.02 0.00 2.84 0.00 0.00 34.83 34.77 3h6o s MET 525 CO -0.09 0.18 -0.15 1.03 -0.65 0.00 0.00 175.02 175.34 3h6o s ARG 526 N 0.46 1.01 -0.34 4.11 0.52 -0.18 -4.97 118.95 119.56 3h6o s ARG 526 Ca -0.08 -0.72 -0.10 0.00 -0.52 0.00 0.00 55.73 54.32 3h6o s ARG 526 Cb -0.15 -1.02 0.01 0.00 0.52 0.00 0.00 34.95 34.31 3h6o s ARG 526 CO 0.04 0.26 0.17 0.08 0.02 0.00 0.00 175.30 175.87 3h6o s VAL 527 N -0.74 4.49 0.06 3.52 1.01 -1.26 -0.61 120.40 126.86 3h6o s VAL 527 Ca 0.03 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.36 3h6o s VAL 527 Cb -0.07 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 3h6o s VAL 527 CO 0.01 -0.08 -0.12 0.68 0.00 0.00 0.00 175.10 175.58 3h6o s VAL 528 N 1.56 0.94 0.41 2.92 -7.23 -0.29 -4.96 120.40 113.76 3h6o s VAL 528 Ca 0.03 -1.22 -0.22 0.00 -1.81 0.00 0.00 61.98 58.76 3h6o s VAL 528 Cb -0.18 -0.93 -0.10 0.00 0.56 0.00 0.00 36.38 35.73 3h6o s VAL 528 CO 0.06 -0.25 0.98 -2.16 -0.31 0.00 0.00 175.10 173.41 3h6o s PRO 529 N -1.65 4.22 0.04 4.82 0.04 -1.26 -0.58 135.00 140.64 3h6o s PRO 529 Ca -0.04 1.25 -0.31 0.00 0.04 0.00 0.00 61.00 61.95 3h6o s PRO 529 Cb -0.10 -2.34 -0.06 0.00 0.04 0.00 0.00 34.50 32.04 3h6o s PRO 529 CO 0.02 -0.05 1.34 0.08 0.04 0.00 0.00 177.00 178.43 3h6o s VAL 530 N -1.96 3.70 -2.00 -0.36 1.01 0.12 -4.90 120.40 116.01 3h6o s VAL 530 Ca 0.60 1.15 0.27 0.00 0.00 0.00 0.00 61.98 64.01 3h6o s VAL 530 Cb -0.14 -3.74 0.78 0.00 0.00 0.00 0.00 36.38 33.28 3h6o s VAL 530 CO 0.18 0.04 1.98 -0.81 0.00 0.00 0.00 175.10 176.49