#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 1.91 -2.02 1.69 -4.23 -1.26 -4.01 115.64 107.72 3h6o s THR 15 Ca 0.00 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 3h6o s THR 15 Cb 0.00 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.34 3h6o s THR 15 CO 0.00 -0.28 0.00 1.67 -0.54 0.00 0.00 174.62 175.47 3h6o n GLN 16 N -0.65 -1.49 -3.93 3.99 7.27 0.18 -1.44 117.38 121.30 3h6o n GLN 16 Ca -0.05 1.12 -0.30 0.00 0.07 0.00 0.00 57.00 57.84 3h6o n GLN 16 Cb 0.63 -5.54 0.02 0.00 2.41 0.00 0.00 30.24 27.76 3h6o n GLN 16 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 3h6o n GLN 17 N -2.42 -5.19 0.17 3.69 1.13 -1.26 -4.74 117.38 108.75 3h6o n GLN 17 Ca -0.20 0.57 0.05 0.00 -1.94 0.00 0.00 57.00 55.48 3h6o n GLN 17 Cb 0.65 -5.40 0.23 0.00 0.11 0.00 0.00 30.24 25.83 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 -2.01 0.00 -0.14 1.08 3.38 -1.58 -0.83 115.31 115.20 3h6o h LEU 18 Ca -0.59 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.37 3h6o h LEU 18 Cb 1.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 3h6o h LEU 18 CO 0.67 0.41 0.02 -0.74 0.09 0.00 0.00 178.44 178.89 3h6o h HIS 19 N 0.00 0.25 -0.00 1.13 2.76 -1.91 -2.98 115.15 114.40 3h6o h HIS 19 Ca -0.00 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.10 3h6o h HIS 19 Cb 1.08 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.96 3h6o h HIS 19 CO 0.00 0.41 -0.17 0.00 -1.30 0.00 0.00 177.93 176.88 3h6o h ALA 20 N 0.81 1.72 -0.30 5.26 0.00 -1.74 -2.96 119.26 122.04 3h6o h ALA 20 Ca 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3h6o h ALA 20 Cb 0.30 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3h6o h ALA 20 CO 0.00 0.21 -0.04 0.00 0.00 0.00 0.00 179.25 179.42 3h6o h ALA 21 N 1.83 1.37 -0.01 0.00 0.00 -1.01 -3.00 119.26 118.43 3h6o h ALA 21 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3h6o h ALA 21 Cb 0.30 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h6o h ALA 21 CO 0.02 0.44 0.00 -1.33 0.00 0.00 0.00 179.25 178.38 3h6o n MET 22 N -4.26 1.18 -2.09 0.00 2.81 -1.12 -4.59 117.12 109.05 3h6o n MET 22 Ca 0.01 -0.26 -0.41 0.00 -1.81 0.00 0.00 57.70 55.23 3h6o n MET 22 Cb 0.26 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.29 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 -1.99 3.55 -0.30 3.04 0.00 -1.13 -4.92 121.76 120.01 3h6o s ALA 23 Ca 0.42 1.26 0.27 0.00 0.00 0.00 0.00 51.96 53.92 3h6o s ALA 23 Cb 0.20 -3.51 0.87 0.00 0.00 0.00 0.00 23.12 20.69 3h6o s ALA 23 CO 0.34 -0.66 1.78 -0.44 0.00 0.00 0.00 175.76 176.78 3h6o h ASP 24 N 4.25 0.00 -4.02 0.00 3.32 -1.92 -3.45 116.42 114.59 3h6o h ASP 24 Ca -0.47 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.15 3h6o h ASP 24 Cb 1.22 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.59 3h6o h ASP 24 CO 0.71 0.00 -0.76 0.42 -1.72 0.00 0.00 179.24 177.89 3h6o s THR 25 N -3.37 1.38 0.21 0.35 -4.23 -1.26 -5.04 115.64 103.68 3h6o s THR 25 Ca 0.05 -1.71 -0.08 0.00 -1.18 0.00 0.00 61.69 58.77 3h6o s THR 25 Cb 0.08 -1.54 0.16 0.00 1.34 0.00 0.00 72.50 72.54 3h6o s THR 25 CO 0.57 -0.39 1.79 0.15 -0.54 0.00 0.00 174.62 176.20 3h6o h PHE 26 N 3.54 1.20 -0.04 3.99 3.04 -1.98 -0.83 116.94 125.85 3h6o h PHE 26 Ca -0.40 -0.08 0.02 0.00 3.98 0.00 0.00 57.97 61.49 3h6o h PHE 26 Cb 1.20 -0.36 -0.02 0.00 2.56 0.00 0.00 35.95 39.32 3h6o h PHE 26 CO 0.65 0.90 -0.08 1.25 -2.02 0.00 0.00 178.31 179.00 3h6o h LEU 27 N 1.16 -0.25 -0.90 0.59 5.85 -1.98 0.35 115.31 120.12 3h6o h LEU 27 Ca 0.27 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.04 3h6o h LEU 27 Cb 0.19 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 3h6o h LEU 27 CO -0.03 -0.12 0.57 -0.08 -0.34 0.00 0.00 178.44 178.45 3h6o h GLU 28 N -0.13 1.21 -0.61 1.25 4.57 -1.95 -1.44 114.58 117.48 3h6o h GLU 28 Ca 0.05 -0.09 0.11 0.00 -1.18 0.00 0.00 59.36 58.25 3h6o h GLU 28 Cb 0.19 -0.26 -0.09 0.00 -0.16 0.00 0.00 28.75 28.43 3h6o h GLU 28 CO -0.12 0.82 0.14 1.25 -1.18 0.00 0.00 179.01 179.92 3h6o h HIS 29 N 1.23 0.22 0.17 0.92 2.76 -0.52 0.30 115.15 120.22 3h6o h HIS 29 Ca 0.33 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 3h6o h HIS 29 Cb -0.10 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 28.84 3h6o h HIS 29 CO -0.00 -0.03 -0.16 0.52 -1.30 0.00 0.00 177.93 176.96 3h6o h MET 30 N 0.27 -0.34 -0.60 5.26 2.86 -0.57 -3.00 114.93 118.81 3h6o h MET 30 Ca 0.32 0.02 0.12 0.00 -2.06 0.00 0.00 59.70 58.11 3h6o h MET 30 Cb 0.48 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 3h6o h MET 30 CO -0.40 -0.23 0.41 0.00 1.06 0.00 0.00 176.91 177.75 3h6o n ARG 32 N -4.45 0.02 -1.68 0.00 1.74 0.01 -4.90 116.66 107.39 3h6o n ARG 32 Ca 0.11 -0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.73 3h6o n ARG 32 Cb 0.46 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 3h6o n ARG 32 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h6o n LEU 33 N -1.49 3.28 -3.66 0.55 4.77 -0.85 -4.42 117.00 115.19 3h6o n LEU 33 Ca 0.07 1.12 -0.24 0.00 -0.03 0.00 0.00 56.01 56.93 3h6o n LEU 33 Cb 0.34 -1.45 -0.17 0.00 -2.33 0.00 0.00 43.42 39.80 3h6o n LEU 33 CO 0.30 -0.33 -0.34 -0.62 -1.33 0.00 0.00 177.39 175.06 3h6o s ASP 34 N 0.52 2.02 0.54 -1.43 3.68 -1.26 -5.01 116.67 115.73 3h6o s ASP 34 Ca 0.71 -0.40 0.32 0.00 2.13 0.00 0.00 52.55 55.31 3h6o s ASP 34 Cb -0.63 -0.27 1.50 0.00 -1.45 0.00 0.00 42.92 42.06 3h6o s ASP 34 CO 0.46 -0.30 2.05 0.16 0.13 0.00 0.00 175.17 177.66 3h6o h ILE 35 N 6.43 0.26 -0.29 4.11 3.07 -2.02 -1.63 117.51 127.44 3h6o h ILE 35 Ca -0.15 -0.54 0.00 0.00 1.55 0.00 0.00 64.86 65.72 3h6o h ILE 35 Cb 1.14 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 39.11 3h6o h ILE 35 CO 0.25 0.07 0.00 0.47 -1.05 0.00 0.00 178.15 177.90 3h6o n ASP 36 N -3.30 1.70 -4.36 2.16 10.43 -1.26 -4.75 116.55 117.17 3h6o n ASP 36 Ca -0.01 -1.94 -0.43 0.00 2.57 0.00 0.00 54.79 54.98 3h6o n ASP 36 Cb 0.27 -0.20 -0.09 0.00 1.84 0.00 0.00 41.12 42.94 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 -1.10 5.95 0.30 -2.24 0.15 -0.62 -4.95 113.70 111.20 3h6o s SER 37 Ca 0.24 -1.32 -0.29 0.00 0.70 0.00 0.00 55.95 55.27 3h6o s SER 37 Cb 0.12 -2.11 -0.10 0.00 -1.71 0.00 0.00 66.02 62.23 3h6o s SER 37 CO 0.17 -0.58 1.15 -2.84 1.20 0.00 0.00 173.24 172.34 3h6o s PRO 38 N 1.57 4.54 0.97 5.44 0.02 -1.26 -4.40 135.00 141.89 3h6o s PRO 38 Ca 0.04 1.90 -0.12 0.00 0.02 0.00 0.00 61.00 62.84 3h6o s PRO 38 Cb -0.23 -3.13 0.17 0.00 0.02 0.00 0.00 34.50 31.33 3h6o s PRO 38 CO 0.05 0.09 1.10 -1.25 -0.33 0.00 0.00 177.00 176.67 3h6o s PRO 39 N -1.58 0.65 0.94 5.54 0.04 -1.26 0.48 135.00 139.81 3h6o s PRO 39 Ca 0.46 0.46 -0.13 0.00 0.04 0.00 0.00 61.00 61.84 3h6o s PRO 39 Cb -0.34 -1.77 0.16 0.00 0.04 0.00 0.00 34.50 32.59 3h6o s PRO 39 CO 0.44 -2.57 1.14 0.96 0.04 0.00 0.00 177.00 177.01 3h6o s ILE 40 N -3.05 1.97 0.12 0.56 -4.36 -1.26 -4.77 121.20 110.41 3h6o s ILE 40 Ca 0.65 0.00 -0.15 0.00 -0.26 0.00 0.00 60.65 60.88 3h6o s ILE 40 Cb -0.17 -2.73 -0.03 0.00 1.25 0.00 0.00 42.46 40.78 3h6o s ILE 40 CO 0.56 0.00 1.57 0.74 0.24 0.00 0.00 174.94 178.05 3h6o h THR 41 N -1.61 1.26 -3.27 8.37 2.02 -1.94 -3.45 112.91 114.28 3h6o h THR 41 Ca -0.50 -0.96 -0.53 0.00 0.77 0.00 0.00 66.41 65.19 3h6o h THR 41 Cb 1.32 1.14 0.02 0.00 -1.74 0.00 0.00 68.15 68.90 3h6o h THR 41 CO 0.59 0.32 0.63 0.00 0.37 0.00 0.00 175.52 177.43 3h6o s ALA 42 N -5.04 3.50 -0.23 6.16 0.00 -1.26 -5.03 121.76 119.86 3h6o s ALA 42 Ca -0.13 1.03 -0.03 0.00 0.00 0.00 0.00 51.96 52.83 3h6o s ALA 42 Cb 0.10 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.75 3h6o s ALA 42 CO 0.78 -0.50 -0.06 0.50 0.00 0.00 0.00 175.76 176.48 3h6o s ARG 43 N 0.40 3.14 0.09 0.00 3.00 -1.26 -4.96 118.95 119.35 3h6o s ARG 43 Ca 0.58 -0.78 0.11 0.00 -1.00 0.00 0.00 55.73 54.64 3h6o s ARG 43 Cb -0.34 -2.96 -0.16 0.00 0.00 0.00 0.00 34.95 31.48 3h6o s ARG 43 CO 0.34 -0.28 1.08 -0.91 0.00 0.00 0.00 175.30 175.53 3h6o h ASN 44 N 8.06 0.00 -3.18 -2.12 2.35 -1.91 -3.45 115.58 115.32 3h6o h ASN 44 Ca -0.39 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 54.77 3h6o h ASN 44 Cb 1.14 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.44 3h6o h ASN 44 CO 0.60 0.87 0.66 -0.89 -1.65 0.00 0.00 177.43 177.02 3h6o s THR 45 N -2.74 4.74 0.40 2.81 2.01 -1.26 -0.22 115.64 121.38 3h6o s THR 45 Ca -0.01 1.80 -0.26 0.00 0.31 0.00 0.00 61.69 63.54 3h6o s THR 45 Cb 0.09 -4.23 -0.09 0.00 0.01 0.00 0.00 72.50 68.28 3h6o s THR 45 CO 0.81 -0.15 1.28 -0.83 -0.69 0.00 0.00 174.62 175.04 3h6o s GLY 46 N 1.29 2.92 -0.17 4.40 0.00 -0.68 -4.82 107.32 110.25 3h6o s GLY 46 Ca 0.40 1.19 -0.03 0.00 0.00 0.00 0.00 44.72 46.28 3h6o s GLY 46 CO 0.07 1.76 -0.06 -0.42 0.00 0.00 0.00 173.10 174.45 3h6o s ILE 47 N -1.28 3.48 -0.19 0.90 1.01 -1.26 -1.25 121.20 122.61 3h6o s ILE 47 Ca 0.56 -0.49 -0.02 0.00 0.00 0.00 0.00 60.65 60.70 3h6o s ILE 47 Cb -0.37 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 3h6o s ILE 47 CO 0.47 0.47 -0.09 -0.63 0.00 0.00 0.00 174.94 175.17 3h6o s ILE 48 N 0.78 3.13 -0.14 2.92 1.01 -0.73 -0.98 121.20 127.20 3h6o s ILE 48 Ca -0.02 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.06 3h6o s ILE 48 Cb -0.15 -2.38 0.01 0.00 0.01 0.00 0.00 42.46 39.95 3h6o s ILE 48 CO 0.02 0.47 -0.22 0.00 0.00 0.00 0.00 174.94 175.21 3h6o s THR 50 N 0.81 4.37 -0.03 0.00 2.01 -0.61 -0.19 115.64 122.00 3h6o s THR 50 Ca -0.08 1.69 -0.14 0.00 0.31 0.00 0.00 61.69 63.48 3h6o s THR 50 Cb -0.16 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 3h6o s THR 50 CO -0.01 0.05 0.37 -0.63 -0.69 0.00 0.00 174.62 173.70 3h6o s ILE 51 N 1.77 5.12 0.00 1.82 -1.09 -0.43 -1.87 121.20 126.52 3h6o s ILE 51 Ca 0.55 0.75 0.00 0.00 -2.23 0.00 0.00 60.65 59.72 3h6o s ILE 51 Cb -0.24 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 36.96 3h6o s ILE 51 CO 0.24 0.55 0.00 0.61 -1.23 0.00 0.00 174.94 175.11 3h6o n GLY 52 N 2.04 2.52 0.45 6.18 0.00 -1.23 -4.74 105.19 110.41 3h6o n GLY 52 Ca -0.14 -0.79 0.27 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 0.00 1.61 0.11 -1.63 -0.74 132.00 131.36 3h6o h PRO 53 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3h6o h PRO 53 Cb 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3h6o h PRO 53 CO 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 3h6o h ALA 54 N 1.59 1.00 0.00 -0.75 0.00 -1.19 -3.38 119.26 116.52 3h6o h ALA 54 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3h6o h ALA 54 Cb 1.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.37 3h6o h ALA 54 CO -0.00 0.00 -0.31 -1.13 0.00 0.00 0.00 179.25 177.80 3h6o n SER 55 N -2.90 0.12 -0.00 0.00 3.41 -0.34 -4.85 113.62 109.06 3h6o n SER 55 Ca 0.04 -1.72 -0.08 0.00 -0.26 0.00 0.00 58.87 56.85 3h6o n SER 55 Cb 0.49 -0.14 -0.13 0.00 -0.26 0.00 0.00 64.21 64.16 3h6o n SER 55 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3h6o h ARG 56 N 0.00 0.00 -7.01 4.33 2.43 -1.59 -3.38 114.38 109.17 3h6o h ARG 56 Ca 0.00 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.63 3h6o h ARG 56 Cb 1.24 0.00 0.11 0.00 -0.42 0.00 0.00 29.97 30.90 3h6o h ARG 56 CO 0.00 0.59 0.62 -1.54 -1.51 0.00 0.00 179.97 178.13 3h6o s SER 57 N -6.21 5.74 0.21 -3.80 1.04 -1.26 -4.79 113.70 104.63 3h6o s SER 57 Ca -0.03 2.73 -0.10 0.00 0.48 0.00 0.00 55.95 59.03 3h6o s SER 57 Cb 0.08 -2.64 0.27 0.00 0.10 0.00 0.00 66.02 63.83 3h6o s SER 57 CO 0.82 -1.25 1.76 0.58 0.98 0.00 0.00 173.24 176.13 3h6o h VAL 58 N 1.92 0.81 -0.81 5.02 2.07 -1.91 -1.72 116.25 121.63 3h6o h VAL 58 Ca -0.50 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 66.88 3h6o h VAL 58 Cb 1.27 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 3h6o h VAL 58 CO 0.60 0.08 0.53 -0.33 0.02 0.00 0.00 177.57 178.46 3h6o h GLU 59 N 0.45 1.02 -0.26 1.57 3.07 -1.94 -1.95 114.58 116.54 3h6o h GLU 59 Ca 0.30 -0.06 -0.09 0.00 -0.50 0.00 0.00 59.36 59.01 3h6o h GLU 59 Cb 0.34 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 3h6o h GLU 59 CO -0.28 0.68 -0.18 1.15 -1.40 0.00 0.00 179.01 178.98 3h6o h THR 60 N 1.05 1.31 -0.63 1.13 2.02 -1.75 -3.02 112.91 113.02 3h6o h THR 60 Ca 0.31 -1.30 0.04 0.00 0.77 0.00 0.00 66.41 66.23 3h6o h THR 60 Cb -0.06 1.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 3h6o h THR 60 CO -0.09 0.41 0.41 -0.07 0.37 0.00 0.00 175.52 176.56 3h6o h LEU 61 N 0.31 0.61 -0.81 2.58 3.38 -1.19 0.25 115.31 120.44 3h6o h LEU 61 Ca 0.05 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.05 3h6o h LEU 61 Cb 0.71 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 3h6o h LEU 61 CO 0.05 0.42 0.52 0.11 0.09 0.00 0.00 178.44 179.63 3h6o h LYS 62 N 0.71 0.99 -0.02 1.13 1.57 -1.23 -0.43 116.57 119.27 3h6o h LYS 62 Ca 0.26 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.81 3h6o h LYS 62 Cb 0.13 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 3h6o h LYS 62 CO -0.07 0.65 -0.73 0.93 -0.57 0.00 0.00 179.45 179.66 3h6o h GLU 63 N 1.01 0.16 -0.45 3.15 4.39 -1.04 -1.83 114.58 119.97 3h6o h GLU 63 Ca 0.32 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.90 3h6o h GLU 63 Cb 0.01 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 3h6o h GLU 63 CO -0.11 0.81 0.29 0.52 -1.16 0.00 0.00 179.01 179.36 3h6o h MET 64 N 0.10 0.57 -0.11 2.33 2.86 0.09 0.75 114.93 121.53 3h6o h MET 64 Ca -0.02 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 3h6o h MET 64 Cb 1.28 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 3h6o h MET 64 CO 0.11 0.38 0.07 0.82 1.06 0.00 0.00 176.91 179.34 3h6o h ILE 65 N 0.59 1.06 -0.52 -1.22 2.04 -0.98 -0.97 117.51 117.52 3h6o h ILE 65 Ca 0.17 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3h6o h ILE 65 Cb -0.06 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3h6o h ILE 65 CO -0.04 0.06 0.26 0.11 0.00 0.00 0.00 178.15 178.54 3h6o h LYS 66 N 0.11 0.71 0.00 2.37 1.57 -1.16 -2.20 116.57 117.98 3h6o h LYS 66 Ca 0.04 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3h6o h LYS 66 Cb 0.04 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.20 3h6o h LYS 66 CO -0.01 0.54 -0.07 0.77 -0.57 0.00 0.00 179.45 180.12 3h6o h SER 67 N 0.72 0.00 0.00 0.86 0.02 -0.57 -3.47 113.55 111.11 3h6o h SER 67 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3h6o h SER 67 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3h6o h SER 67 CO -0.03 0.07 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 3h6o n GLY 68 N 0.15 0.30 3.70 -3.77 0.00 -0.73 -4.21 105.19 100.63 3h6o n GLY 68 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3h6o n GLY 68 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3h6o n MET 69 N 0.00 2.81 -0.03 1.61 0.00 -0.45 -4.52 117.12 116.55 3h6o n MET 69 Ca 0.00 1.02 0.02 0.00 0.00 0.00 0.00 57.70 58.74 3h6o n MET 69 Cb 0.00 -2.90 -0.11 0.00 0.00 0.00 0.00 33.22 30.22 3h6o n MET 69 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3h6o n ASN 70 N 4.88 1.75 -3.82 6.12 4.13 -0.15 -4.59 115.26 123.58 3h6o n ASN 70 Ca 0.17 0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.28 3h6o n ASN 70 Cb 0.36 1.33 -0.16 0.00 -1.54 0.00 0.00 39.78 39.78 3h6o n ASN 70 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3h6o s VAL 71 N -2.73 0.09 -0.34 2.41 1.01 -0.95 -1.66 120.40 118.23 3h6o s VAL 71 Ca -0.06 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.89 3h6o s VAL 71 Cb 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 36.38 36.27 3h6o s VAL 71 CO 0.57 0.10 0.22 0.00 0.00 0.00 0.00 175.10 175.99 3h6o s ALA 72 N 0.77 3.43 -0.22 5.51 0.00 -0.25 -0.83 121.76 130.18 3h6o s ALA 72 Ca -0.07 -1.41 -0.13 0.00 0.00 0.00 0.00 51.96 50.34 3h6o s ALA 72 Cb -0.10 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.38 3h6o s ALA 72 CO -0.02 -0.99 0.28 0.50 0.00 0.00 0.00 175.76 175.53 3h6o s ARG 73 N 1.68 4.13 -0.18 0.00 3.52 0.73 -0.39 118.95 128.45 3h6o s ARG 73 Ca 0.05 -0.02 -0.05 0.00 -0.13 0.00 0.00 55.73 55.59 3h6o s ARG 73 Cb -0.17 -3.53 -0.03 0.00 -1.56 0.00 0.00 34.95 29.66 3h6o s ARG 73 CO 0.09 0.02 -0.00 -0.51 -0.81 0.00 0.00 175.30 174.09 3h6o s LEU 74 N 1.15 3.36 -0.44 -0.88 1.02 0.20 -1.31 118.68 121.78 3h6o s LEU 74 Ca 0.14 -0.12 -0.15 0.00 0.02 0.00 0.00 54.13 54.02 3h6o s LEU 74 Cb -0.14 -1.84 0.05 0.00 0.02 0.00 0.00 46.19 44.28 3h6o s LEU 74 CO 0.06 0.12 0.34 0.21 0.02 0.00 0.00 176.35 177.10 3h6o s ASN 75 N 0.66 6.08 -0.02 2.29 3.84 -1.26 -0.23 114.94 126.29 3h6o s ASN 75 Ca -0.00 -1.16 0.02 0.00 0.21 0.00 0.00 52.86 51.93 3h6o s ASN 75 Cb -0.14 -2.15 0.10 0.00 -0.55 0.00 0.00 41.25 38.51 3h6o s ASN 75 CO 0.02 -0.55 0.82 0.49 -2.79 0.00 0.00 177.10 175.09 3h6o n PHE 76 N 5.16 0.22 0.10 0.43 3.01 0.13 -3.54 117.46 122.96 3h6o n PHE 76 Ca -0.12 -0.08 -0.01 0.00 1.01 0.00 0.00 57.45 58.25 3h6o n PHE 76 Cb 0.45 -0.10 0.26 0.00 -0.01 0.00 0.00 39.48 40.08 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 0.54 0.24 -4.51 4.37 0.02 -1.82 -3.36 113.55 109.03 3h6o h SER 77 Ca 0.00 -0.09 -0.27 0.00 -0.84 0.00 0.00 61.79 60.59 3h6o h SER 77 Cb 0.48 -0.07 -0.17 0.00 0.14 0.00 0.00 62.40 62.78 3h6o h SER 77 CO 0.04 0.58 -0.72 -1.00 -1.14 0.00 0.00 176.83 174.60 3h6o s HIS 78 N -4.26 0.94 0.00 3.45 3.76 -1.23 -4.99 115.29 112.96 3h6o s HIS 78 Ca -0.05 -0.75 0.00 0.00 -0.15 0.00 0.00 55.06 54.11 3h6o s HIS 78 Cb 0.14 -0.53 0.00 0.00 1.11 0.00 0.00 32.58 33.30 3h6o s HIS 78 CO 0.76 -0.07 0.00 0.41 -0.85 0.00 0.00 174.74 174.99 3h6o n GLY 79 N 0.40 3.16 3.87 -2.22 0.00 -1.26 -4.83 105.19 104.31 3h6o n GLY 79 Ca -0.15 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.55 4.76 0.28 2.61 -4.23 -1.26 -4.95 115.64 111.31 3h6o s THR 80 Ca 0.00 0.66 0.02 0.00 -1.18 0.00 0.00 61.69 61.19 3h6o s THR 80 Cb 0.00 -3.75 0.27 0.00 1.34 0.00 0.00 72.50 70.36 3h6o s THR 80 CO 0.00 -0.59 1.76 0.45 -0.54 0.00 0.00 174.62 175.70 3h6o h HIS 81 N 1.07 0.85 -0.53 3.99 -0.00 -1.98 -0.55 115.15 118.01 3h6o h HIS 81 Ca -0.47 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 59.93 3h6o h HIS 81 Cb 1.19 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 28.33 3h6o h HIS 81 CO 0.61 0.17 0.30 1.49 -0.00 0.00 0.00 177.93 180.50 3h6o h GLU 82 N 0.64 0.73 -0.07 2.45 4.81 -1.98 0.31 114.58 121.47 3h6o h GLU 82 Ca 0.51 -0.08 0.02 0.00 -0.13 0.00 0.00 59.36 59.68 3h6o h GLU 82 Cb 0.78 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 3h6o h GLU 82 CO -0.39 0.56 -0.04 -0.92 -0.73 0.00 0.00 179.01 177.49 3h6o h TYR 83 N 0.71 -0.09 -0.62 0.92 3.20 -1.79 -1.58 116.97 117.73 3h6o h TYR 83 Ca 0.19 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 3h6o h TYR 83 Cb 0.03 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 3h6o h TYR 83 CO -0.02 -0.06 0.15 0.45 -1.64 0.00 0.00 178.16 177.04 3h6o h HIS 84 N -0.03 1.03 -0.77 -3.82 3.86 -0.93 -1.85 115.15 112.63 3h6o h HIS 84 Ca 0.04 -0.12 0.08 0.00 -1.16 0.00 0.00 60.37 59.21 3h6o h HIS 84 Cb 0.10 -0.29 -0.06 0.00 1.06 0.00 0.00 27.41 28.21 3h6o h HIS 84 CO -0.15 0.87 0.44 0.00 0.86 0.00 0.00 177.93 179.95 3h6o h ALA 85 N 1.05 1.06 -0.31 2.45 0.00 -0.23 -0.64 119.26 122.64 3h6o h ALA 85 Ca 0.19 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 3h6o h ALA 85 Cb 0.35 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h6o h ALA 85 CO 0.00 0.11 -0.27 1.49 0.00 0.00 0.00 179.25 180.58 3h6o h GLU 86 N 0.78 0.63 0.03 0.00 4.81 -1.08 -1.78 114.58 117.97 3h6o h GLU 86 Ca 0.35 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3h6o h GLU 86 Cb 0.26 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3h6o h GLU 86 CO -0.21 0.84 -0.01 1.15 -0.73 0.00 0.00 179.01 180.04 3h6o h THR 87 N 0.55 1.07 -0.92 0.32 2.02 -0.59 0.15 112.91 115.51 3h6o h THR 87 Ca 0.07 -0.32 0.09 0.00 0.77 0.00 0.00 66.41 67.02 3h6o h THR 87 Cb 0.74 1.29 -0.07 0.00 -1.74 0.00 0.00 68.15 68.37 3h6o h THR 87 CO 0.06 0.08 0.56 0.40 0.37 0.00 0.00 175.52 176.99 3h6o h ILE 88 N -0.18 0.96 -0.25 3.11 2.04 -1.15 0.15 117.51 122.19 3h6o h ILE 88 Ca -0.00 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 3h6o h ILE 88 Cb 0.17 -0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.17 3h6o h ILE 88 CO 0.01 0.17 0.04 0.50 0.00 0.00 0.00 178.15 178.87 3h6o h LYS 89 N 0.95 0.41 -0.65 2.37 3.64 -1.01 -0.54 116.57 121.74 3h6o h LYS 89 Ca 0.43 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.69 3h6o h LYS 89 Cb 0.34 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 3h6o h LYS 89 CO -0.23 0.55 0.35 -0.91 -2.27 0.00 0.00 179.45 176.94 3h6o h ASN 90 N 0.22 0.80 -0.55 4.20 4.21 -0.01 -0.67 115.58 123.78 3h6o h ASN 90 Ca 0.07 -0.06 -0.10 0.00 1.21 0.00 0.00 56.30 57.42 3h6o h ASN 90 Cb 0.33 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 3h6o h ASN 90 CO 0.01 0.65 -0.06 0.58 -1.29 0.00 0.00 177.43 177.32 3h6o h VAL 91 N 0.91 1.27 -0.37 2.81 2.07 -0.41 -1.97 116.25 120.55 3h6o h VAL 91 Ca 0.23 -1.20 -0.13 0.00 0.82 0.00 0.00 66.70 66.41 3h6o h VAL 91 Cb 0.03 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3h6o h VAL 91 CO -0.04 0.43 -0.30 0.03 0.02 0.00 0.00 177.57 177.71 3h6o h ARG 92 N 0.92 0.79 -0.06 1.57 3.08 -0.58 -1.35 114.38 118.76 3h6o h ARG 92 Ca 0.15 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 3h6o h ARG 92 Cb 0.61 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 3h6o h ARG 92 CO 0.04 0.99 0.03 1.15 -1.07 0.00 0.00 179.97 181.11 3h6o h THR 93 N 0.67 1.06 -0.69 2.04 2.02 -1.03 0.21 112.91 117.19 3h6o h THR 93 Ca 0.08 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 3h6o h THR 93 Cb 0.84 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 3h6o h THR 93 CO 0.07 0.05 0.38 0.00 0.37 0.00 0.00 175.52 176.39 3h6o h ALA 94 N 0.96 0.88 0.05 6.16 0.00 -1.33 -1.66 119.26 124.32 3h6o h ALA 94 Ca 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 94 Cb 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3h6o h ALA 94 CO -0.00 0.39 -0.02 1.15 0.00 0.00 0.00 179.25 180.77 3h6o h THR 95 N 0.94 1.07 0.00 0.00 2.02 -1.07 -3.15 112.91 112.72 3h6o h THR 95 Ca 0.24 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3h6o h THR 95 Cb 0.03 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3h6o h THR 95 CO -0.04 0.09 0.00 -0.62 0.37 0.00 0.00 175.52 175.33 3h6o n GLU 96 N -5.04 0.09 0.07 6.66 -0.58 0.05 -2.33 120.64 119.55 3h6o n GLU 96 Ca -0.08 0.18 0.08 0.00 -0.42 0.00 0.00 57.16 56.92 3h6o n GLU 96 Cb 0.12 -1.62 0.35 0.00 -0.57 0.00 0.00 31.44 29.72 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 -1.78 0.29 -0.93 1.62 3.41 -0.63 -1.35 113.62 114.25 3h6o n SER 97 Ca 0.05 0.59 0.10 0.00 -0.26 0.00 0.00 58.87 59.35 3h6o n SER 97 Cb 0.30 -0.65 0.15 0.00 -0.26 0.00 0.00 64.21 63.75 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 0.28 0.30 7.33 3.72 -0.99 -4.67 117.46 121.59 3h6o n PHE 98 Ca 0.02 -0.16 0.15 0.00 -0.05 0.00 0.00 57.45 57.40 3h6o n PHE 98 Cb 0.13 -0.00 0.53 0.00 -0.94 0.00 0.00 39.48 39.20 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 3.91 1.00 -0.31 4.37 0.00 -1.35 -3.23 119.26 123.66 3h6o h ALA 99 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3h6o h ALA 99 Cb 0.87 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3h6o h ALA 99 CO 0.00 0.00 0.21 0.66 0.00 0.00 0.00 179.25 180.12 3h6o h SER 100 N 0.00 0.25 -3.62 0.00 4.64 -1.83 -3.31 113.55 109.68 3h6o h SER 100 Ca 0.00 -0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.63 3h6o h SER 100 Cb 0.61 -0.06 -0.36 0.00 -0.31 0.00 0.00 62.40 62.28 3h6o h SER 100 CO 0.00 0.18 -0.58 -0.62 -0.87 0.00 0.00 176.83 174.94 3h6o s ASP 101 N -6.71 5.10 0.58 4.97 2.15 -1.22 -4.98 116.67 116.56 3h6o s ASP 101 Ca -0.07 -2.17 0.33 0.00 0.43 0.00 0.00 52.55 51.08 3h6o s ASP 101 Cb 0.18 -1.77 1.81 0.00 -0.30 0.00 0.00 42.92 42.83 3h6o s ASP 101 CO 0.71 -0.48 2.19 -0.65 -0.17 0.00 0.00 175.17 176.78 3h6o h PRO 102 N 7.80 0.00 -0.42 4.34 0.11 -1.82 0.11 132.00 142.12 3h6o h PRO 102 Ca -0.10 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 3h6o h PRO 102 Cb 1.03 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3h6o h PRO 102 CO 0.65 0.04 -0.10 0.82 -0.21 0.00 0.00 178.00 179.21 3h6o h ILE 103 N 0.00 1.25 0.00 4.15 2.04 -1.93 -3.18 117.51 119.84 3h6o h ILE 103 Ca -0.00 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.73 3h6o h ILE 103 Cb 0.17 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 3h6o h ILE 103 CO 0.01 0.39 -1.31 0.18 0.00 0.00 0.00 178.15 177.41 3h6o n LEU 104 N -4.17 0.68 -4.66 1.44 4.77 -0.86 -4.66 117.00 109.53 3h6o n LEU 104 Ca 0.01 -0.34 -0.49 0.00 -0.03 0.00 0.00 56.01 55.16 3h6o n LEU 104 Cb 0.35 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.39 3h6o n LEU 104 CO 0.42 0.17 1.25 0.00 -1.33 0.00 0.00 177.39 177.90 3h6o n TYR 105 N -1.74 2.13 -3.72 -1.77 9.36 -0.03 -4.97 117.16 116.43 3h6o n TYR 105 Ca 0.01 0.28 -0.38 0.00 3.32 0.00 0.00 57.90 61.14 3h6o n TYR 105 Cb 0.40 -2.53 -0.12 0.00 -0.63 0.00 0.00 39.34 36.46 3h6o n TYR 105 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 3h6o s ARG 106 N 2.13 3.17 0.64 2.98 0.52 -1.26 -4.79 118.95 122.34 3h6o s ARG 106 Ca 0.86 -0.81 -0.18 0.00 -0.52 0.00 0.00 55.73 55.08 3h6o s ARG 106 Cb -0.78 -3.44 -0.01 0.00 0.52 0.00 0.00 34.95 31.23 3h6o s ARG 106 CO 0.47 -0.44 1.25 -2.14 0.02 0.00 0.00 175.30 174.46 3h6o s PRO 107 N 1.54 2.65 -0.05 3.54 0.02 -1.26 -5.01 135.00 136.42 3h6o s PRO 107 Ca 0.03 1.93 -0.00 0.00 0.02 0.00 0.00 61.00 62.98 3h6o s PRO 107 Cb -0.17 -1.87 0.02 0.00 0.02 0.00 0.00 34.50 32.50 3h6o s PRO 107 CO 0.04 -1.49 -0.02 0.08 -0.33 0.00 0.00 177.00 175.28 3h6o s VAL 108 N -1.56 0.44 0.56 3.83 1.01 -1.26 -4.87 120.40 118.55 3h6o s VAL 108 Ca 0.79 -0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.76 3h6o s VAL 108 Cb -0.34 -0.52 0.03 0.00 0.00 0.00 0.00 36.38 35.55 3h6o s VAL 108 CO 0.38 0.23 0.81 0.00 0.00 0.00 0.00 175.10 176.52 3h6o s ALA 109 N 1.37 3.67 -0.13 5.51 0.00 -0.67 -4.90 121.76 126.62 3h6o s ALA 109 Ca -0.04 -1.13 -0.00 0.00 0.00 0.00 0.00 51.96 50.78 3h6o s ALA 109 Cb -0.13 -2.24 0.03 0.00 0.00 0.00 0.00 23.12 20.78 3h6o s ALA 109 CO -0.02 -0.78 -0.08 0.08 0.00 0.00 0.00 175.76 174.95 3h6o s VAL 110 N -2.83 1.13 -0.14 0.00 1.01 -1.26 -1.09 120.40 117.21 3h6o s VAL 110 Ca 0.56 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 62.09 3h6o s VAL 110 Cb -0.10 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 3h6o s VAL 110 CO 0.40 0.31 -0.13 0.00 0.00 0.00 0.00 175.10 175.68 3h6o s ALA 111 N 1.65 2.59 -0.27 5.51 0.00 0.48 -1.07 121.76 130.66 3h6o s ALA 111 Ca 0.04 -0.96 -0.13 0.00 0.00 0.00 0.00 51.96 50.91 3h6o s ALA 111 Cb -0.13 -1.25 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 3h6o s ALA 111 CO -0.08 0.12 0.31 -1.17 0.00 0.00 0.00 175.76 174.93 3h6o s LEU 112 N 0.57 4.03 -0.29 0.00 0.20 -0.78 -0.63 118.68 121.78 3h6o s LEU 112 Ca -0.08 0.18 -0.06 0.00 0.69 0.00 0.00 54.13 54.87 3h6o s LEU 112 Cb -0.16 -2.32 0.02 0.00 -0.43 0.00 0.00 46.19 43.30 3h6o s LEU 112 CO 0.03 -0.13 0.06 -0.62 -0.29 0.00 0.00 176.35 175.40 3h6o s ASP 113 N 1.67 5.00 0.60 3.68 -1.08 0.67 -0.54 116.67 126.68 3h6o s ASP 113 Ca 0.12 -0.81 -0.15 0.00 -0.52 0.00 0.00 52.55 51.19 3h6o s ASP 113 Cb -0.16 -1.84 -0.03 0.00 -1.46 0.00 0.00 42.92 39.43 3h6o s ASP 113 CO 0.10 -0.20 1.06 0.42 0.52 0.00 0.00 175.17 177.07 3h6o s THR 114 N 1.45 3.80 0.03 1.71 -4.23 -0.97 0.20 115.64 117.63 3h6o s THR 114 Ca 0.01 0.83 -0.27 0.00 -1.18 0.00 0.00 61.69 61.08 3h6o s THR 114 Cb -0.17 -3.37 -0.17 0.00 1.34 0.00 0.00 72.50 70.13 3h6o s THR 114 CO 0.01 -0.53 1.39 0.50 -0.54 0.00 0.00 174.62 175.46 3h6o h LYS 115 N 0.32 -0.51 0.00 3.99 3.64 -1.93 -3.42 116.57 118.66 3h6o h LYS 115 Ca -0.47 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3h6o h LYS 115 Cb 1.22 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 3h6o h LYS 115 CO 0.57 -0.23 0.00 0.41 -2.27 0.00 0.00 179.45 177.93 3h6o n GLY 116 N -0.74 -2.63 3.75 5.01 0.00 -1.26 -4.87 105.19 104.45 3h6o n GLY 116 Ca -0.10 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 3h6o n GLY 116 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h6o s PRO 117 N -0.77 4.61 0.07 1.61 0.02 -1.26 -4.81 135.00 134.48 3h6o s PRO 117 Ca 0.00 1.77 0.01 0.00 0.02 0.00 0.00 61.00 62.80 3h6o s PRO 117 Cb 0.00 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 3h6o s PRO 117 CO 0.00 0.14 -0.05 -1.21 -0.33 0.00 0.00 177.00 175.55 3h6o s GLU 118 N -0.92 0.67 -0.10 5.54 2.02 -1.26 -4.98 118.70 119.68 3h6o s GLU 118 Ca 0.47 -1.17 0.01 0.00 0.02 0.00 0.00 54.97 54.30 3h6o s GLU 118 Cb -0.31 -0.03 -0.02 0.00 0.10 0.00 0.00 34.13 33.88 3h6o s GLU 118 CO 0.38 -0.05 -0.14 0.42 0.02 0.00 0.00 175.26 175.89 3h6o s ILE 119 N -3.34 3.01 0.08 -1.63 1.01 -1.26 -4.90 121.20 114.17 3h6o s ILE 119 Ca 0.06 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 60.06 3h6o s ILE 119 Cb 0.04 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 3h6o s ILE 119 CO -0.06 0.55 -0.16 -0.13 0.00 0.00 0.00 174.94 175.14 3h6o s ARG 120 N -0.03 0.91 0.77 2.79 1.81 -1.26 -0.81 118.95 123.12 3h6o s ARG 120 Ca -0.03 -1.01 -0.05 0.00 -1.72 0.00 0.00 55.73 52.92 3h6o s ARG 120 Cb -0.14 -0.99 0.13 0.00 -0.45 0.00 0.00 34.95 33.49 3h6o s ARG 120 CO 0.04 0.23 1.06 0.95 -0.68 0.00 0.00 175.30 176.90 3h6o s THR 121 N -1.22 2.16 -0.08 0.02 -4.23 -0.38 -2.12 115.64 109.78 3h6o s THR 121 Ca 0.01 -0.40 -0.03 0.00 -1.18 0.00 0.00 61.69 60.08 3h6o s THR 121 Cb -0.10 -2.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.97 3h6o s THR 121 CO 0.03 0.00 -0.06 1.23 -0.54 0.00 0.00 174.62 175.28 3h6o h GLY 122 N -0.77 0.00 -7.52 3.99 0.00 -1.56 -3.31 103.07 93.89 3h6o h GLY 122 Ca -0.40 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.23 3h6o h GLY 122 CO 0.44 0.00 -0.32 -0.42 0.00 0.00 0.00 176.54 176.24 3h6o s ILE 142 N -1.63 3.84 0.64 2.60 1.01 -0.97 -1.51 121.20 125.18 3h6o s ILE 142 Ca -0.05 -3.11 -0.06 0.00 0.00 0.00 0.00 60.65 57.43 3h6o s ILE 142 Cb 0.01 -3.48 0.03 0.00 0.01 0.00 0.00 42.46 39.03 3h6o s ILE 142 CO 0.08 -0.91 0.95 0.28 0.00 0.00 0.00 174.94 175.33 3h6o s THR 143 N -0.28 3.11 -0.43 2.92 -1.32 -0.22 -2.33 115.64 117.08 3h6o s THR 143 Ca 0.19 -0.08 0.10 0.00 -1.21 0.00 0.00 61.69 60.68 3h6o s THR 143 Cb -0.18 -3.28 0.37 0.00 -1.51 0.00 0.00 72.50 67.90 3h6o s THR 143 CO -0.05 -0.29 0.86 0.18 -2.21 0.00 0.00 174.62 173.11 3h6o n LEU 144 N -2.73 2.32 -3.25 9.08 4.77 -0.78 -3.33 117.00 123.07 3h6o n LEU 144 Ca 0.06 -5.06 -0.00 0.00 -0.03 0.00 0.00 56.01 50.98 3h6o n LEU 144 Cb 0.59 0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.85 3h6o n LEU 144 CO 0.53 2.21 0.10 0.00 -1.33 0.00 0.00 177.39 178.90 3h6o n ASP 153 N 5.41 0.00 0.02 0.00 5.75 -0.23 -5.01 116.55 122.49 3h6o n ASP 153 Ca -0.03 -0.79 0.06 0.00 -0.01 0.00 0.00 54.79 54.03 3h6o n ASP 153 Cb 0.51 0.00 0.47 0.00 -1.03 0.00 0.00 41.12 41.07 3h6o n ASP 153 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 3h6o h GLU 154 N 0.00 0.43 0.00 0.11 -0.00 -2.05 -3.31 114.58 109.76 3h6o h GLU 154 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.36 59.33 3h6o h GLU 154 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 28.75 28.65 3h6o h GLU 154 CO 0.00 0.29 0.00 0.27 -0.00 0.00 0.00 179.01 179.57 3h6o n ASN 155 N -4.48 0.00 -4.52 3.06 0.23 -1.26 -4.95 115.26 103.33 3h6o n ASN 155 Ca 0.04 0.43 -0.32 0.00 -0.53 0.00 0.00 54.58 54.19 3h6o n ASN 155 Cb 0.13 -0.24 -0.12 0.00 -2.08 0.00 0.00 39.78 37.47 3h6o n ASN 155 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 3h6o s ILE 156 N -1.03 3.29 -0.03 1.53 2.07 -1.25 -4.78 121.20 121.01 3h6o s ILE 156 Ca 0.00 -0.77 0.05 0.00 -1.41 0.00 0.00 60.65 58.52 3h6o s ILE 156 Cb 0.00 -2.36 -0.01 0.00 0.13 0.00 0.00 42.46 40.23 3h6o s ILE 156 CO 0.00 0.50 -0.17 -0.22 -1.91 0.00 0.00 174.94 173.14 3h6o s LEU 157 N -1.05 1.97 -0.11 8.50 2.96 -1.26 -1.07 118.68 128.63 3h6o s LEU 157 Ca 0.14 -0.32 -0.03 0.00 -0.22 0.00 0.00 54.13 53.69 3h6o s LEU 157 Cb -0.11 -0.90 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 3h6o s LEU 157 CO 0.03 0.18 0.02 0.86 -1.32 0.00 0.00 176.35 176.12 3h6o s TRP 158 N -0.20 3.19 0.06 5.38 -0.00 -1.26 -1.06 118.94 125.05 3h6o s TRP 158 Ca 0.02 0.13 0.07 0.00 -0.00 0.00 0.00 56.10 56.32 3h6o s TRP 158 Cb -0.09 -1.87 -0.03 0.00 -0.00 0.00 0.00 33.47 31.49 3h6o s TRP 158 CO 0.00 0.37 -0.19 -0.51 -0.00 0.00 0.00 176.95 176.63 3h6o s LEU 159 N -0.53 2.22 0.15 5.86 1.43 -1.21 -1.33 118.68 125.27 3h6o s LEU 159 Ca 0.09 -0.57 0.27 0.00 -1.03 0.00 0.00 54.13 52.89 3h6o s LEU 159 Cb -0.12 -0.84 0.93 0.00 0.03 0.00 0.00 46.19 46.19 3h6o s LEU 159 CO 0.02 0.08 1.82 -0.90 0.23 0.00 0.00 176.35 177.61 3h6o n ASP 160 N 1.57 0.59 -4.58 2.29 5.68 -0.90 -4.72 116.55 116.48 3h6o n ASP 160 Ca -0.18 0.56 -0.42 0.00 -0.50 0.00 0.00 54.79 54.24 3h6o n ASP 160 Cb 0.54 -0.71 -0.05 0.00 -1.14 0.00 0.00 41.12 39.76 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 -3.07 3.06 0.02 2.11 6.04 -1.26 -4.94 117.35 119.30 3h6o s TYR 161 Ca 0.12 0.47 0.09 0.00 0.04 0.00 0.00 57.07 57.79 3h6o s TYR 161 Cb 0.14 -3.56 -0.23 0.00 -1.04 0.00 0.00 41.96 37.28 3h6o s TYR 161 CO 0.58 -0.85 0.91 0.87 -1.54 0.00 0.00 175.55 175.52 3h6o h LYS 162 N 8.66 0.02 -0.92 4.97 1.57 -2.00 -3.29 116.57 125.58 3h6o h LYS 162 Ca -0.24 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.46 3h6o h LYS 162 Cb 1.09 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.38 3h6o h LYS 162 CO 0.94 0.73 0.06 0.09 -0.57 0.00 0.00 179.45 180.71 3h6o n ASN 163 N -3.19 2.64 -0.05 0.86 3.02 -1.26 -4.45 115.26 112.83 3h6o n ASN 163 Ca -0.11 -2.33 -0.08 0.00 -0.03 0.00 0.00 54.58 52.03 3h6o n ASN 163 Cb 1.01 -0.57 0.08 0.00 -0.61 0.00 0.00 39.78 39.69 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 0.88 1.28 0.00 2.41 2.10 -2.00 -2.94 117.51 119.25 3h6o h ILE 164 Ca 0.06 -1.49 -0.05 0.00 1.08 0.00 0.00 64.86 64.46 3h6o h ILE 164 Cb 1.13 1.41 -0.01 0.00 -1.09 0.00 0.00 36.82 38.26 3h6o h ILE 164 CO 0.20 0.48 -0.22 0.00 -1.08 0.00 0.00 178.15 177.53 3h6o h LYS 166 N 0.00 0.00 0.00 0.00 -0.00 -1.86 -3.32 116.57 111.39 3h6o h LYS 166 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 3h6o h LYS 166 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.71 3h6o h LYS 166 CO 0.03 0.63 -1.08 1.55 -0.00 0.00 0.00 179.45 180.58 3h6o n VAL 167 N -3.32 0.51 -3.27 0.07 3.14 -0.90 -4.96 118.33 109.60 3h6o n VAL 167 Ca 0.01 -0.50 -0.19 0.00 -2.96 0.00 0.00 64.34 60.70 3h6o n VAL 167 Cb 0.76 -0.25 -0.01 0.00 -1.06 0.00 0.00 33.84 33.29 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 -3.36 2.78 0.13 1.55 -7.23 -0.65 -4.61 120.40 109.00 3h6o s VAL 168 Ca -0.01 -1.16 -0.05 0.00 -1.81 0.00 0.00 61.98 58.95 3h6o s VAL 168 Cb 0.11 -2.93 -0.02 0.00 0.56 0.00 0.00 36.38 34.09 3h6o s VAL 168 CO 0.80 0.00 0.16 -1.61 -0.31 0.00 0.00 175.10 174.14 3h6o s GLU 169 N -4.27 0.96 0.23 4.82 8.01 -1.26 -4.94 118.70 122.25 3h6o s GLU 169 Ca 0.52 -1.23 -0.32 0.00 0.01 0.00 0.00 54.97 53.96 3h6o s GLU 169 Cb -0.07 0.31 -0.13 0.00 -4.31 0.00 0.00 34.13 29.93 3h6o s GLU 169 CO 0.31 -0.31 1.57 1.33 0.01 0.00 0.00 175.26 178.17 3h6o n VAL 170 N -0.11 0.54 0.00 2.63 0.24 -1.26 -1.28 118.33 119.09 3h6o n VAL 170 Ca -0.09 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 3h6o n VAL 170 Cb 0.63 -1.74 0.00 0.00 -1.47 0.00 0.00 33.84 31.26 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 2.85 2.74 3.76 7.63 0.00 0.18 -4.97 105.19 117.38 3h6o n GLY 171 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 3h6o n GLY 171 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h6o s SER 172 N -1.46 5.97 0.04 1.61 0.15 -0.41 -4.67 113.70 114.94 3h6o s SER 172 Ca 0.00 2.55 -0.09 0.00 0.70 0.00 0.00 55.95 59.11 3h6o s SER 172 Cb 0.00 -2.62 -0.05 0.00 -1.71 0.00 0.00 66.02 61.63 3h6o s SER 172 CO 0.00 -1.08 0.35 -1.59 1.20 0.00 0.00 173.24 172.12 3h6o s LYS 173 N -2.60 3.69 -0.08 5.44 0.00 -1.26 -2.15 119.74 122.78 3h6o s LYS 173 Ca 0.64 0.09 -0.00 0.00 0.00 0.00 0.00 55.97 56.69 3h6o s LYS 173 Cb -0.35 -3.04 0.02 0.00 0.00 0.00 0.00 37.83 34.46 3h6o s LYS 173 CO 0.43 0.60 -0.04 0.42 0.00 0.00 0.00 175.35 176.76 3h6o s ILE 174 N -1.34 0.66 -0.01 3.79 1.01 0.12 -3.71 121.20 121.73 3h6o s ILE 174 Ca 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.86 3h6o s ILE 174 Cb -0.14 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 3h6o s ILE 174 CO 0.17 0.29 0.04 -0.31 0.00 0.00 0.00 174.94 175.13 3h6o s TYR 175 N 1.57 3.19 0.01 3.97 4.12 0.84 -0.07 117.35 130.97 3h6o s TYR 175 Ca 0.00 0.15 0.05 0.00 0.02 0.00 0.00 57.07 57.29 3h6o s TYR 175 Cb -0.13 -1.71 -0.02 0.00 -1.52 0.00 0.00 41.96 38.58 3h6o s TYR 175 CO -0.04 0.51 -0.14 0.08 0.02 0.00 0.00 175.55 175.97 3h6o s VAL 176 N -1.13 1.13 -0.64 0.71 1.01 0.07 -0.99 120.40 120.56 3h6o s VAL 176 Ca 0.21 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 3h6o s VAL 176 Cb -0.12 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.31 3h6o s VAL 176 CO 0.11 0.19 0.64 -0.67 0.00 0.00 0.00 175.10 175.38 3h6o n ASP 177 N 2.38 -6.46 -4.01 3.32 4.64 0.34 -1.80 116.55 114.96 3h6o n ASP 177 Ca -0.16 -0.23 -0.29 0.00 -1.38 0.00 0.00 54.79 52.73 3h6o n ASP 177 Cb 0.55 -3.46 -0.01 0.00 -1.04 0.00 0.00 41.12 37.15 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 -1.39 -2.06 -0.36 1.67 8.00 -1.23 -2.01 116.55 119.17 3h6o n ASP 178 Ca -0.09 -0.96 -0.05 0.00 0.71 0.00 0.00 54.79 54.41 3h6o n ASP 178 Cb 0.59 -3.18 -0.02 0.00 -0.02 0.00 0.00 41.12 38.49 3h6o n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h6o n GLY 179 N -1.72 0.73 0.06 0.44 0.00 -1.23 -4.94 105.19 98.54 3h6o n GLY 179 Ca -0.13 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 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 0.02 -9.37 0.99 5.85 -0.73 -3.44 115.31 108.63 3h6o h LEU 180 Ca -0.10 -0.52 -0.67 0.00 0.84 0.00 0.00 57.88 57.43 3h6o h LEU 180 Cb 0.37 -0.01 -0.13 0.00 0.37 0.00 0.00 40.66 41.26 3h6o h LEU 180 CO 0.14 0.53 -0.60 -0.63 -0.34 0.00 0.00 178.44 177.54 3h6o s ILE 181 N -4.14 4.47 0.01 4.05 1.01 -0.79 -4.68 121.20 121.13 3h6o s ILE 181 Ca -0.16 -0.27 0.08 0.00 0.00 0.00 0.00 60.65 60.30 3h6o s ILE 181 Cb 0.02 -2.92 -0.02 0.00 0.01 0.00 0.00 42.46 39.54 3h6o s ILE 181 CO 0.68 0.54 -0.25 -0.55 0.00 0.00 0.00 174.94 175.37 3h6o s SER 182 N -1.10 2.91 -0.00 3.58 0.15 -0.77 -0.75 113.70 117.71 3h6o s SER 182 Ca 0.16 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.32 3h6o s SER 182 Cb -0.11 -0.29 -0.00 0.00 -1.71 0.00 0.00 66.02 63.90 3h6o s SER 182 CO 0.05 0.27 -0.03 -0.76 1.20 0.00 0.00 173.24 173.97 3h6o s LEU 183 N -0.86 2.00 -0.17 3.45 1.43 0.89 -1.44 118.68 123.98 3h6o s LEU 183 Ca 0.10 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 3h6o s LEU 183 Cb -0.09 -0.18 0.01 0.00 0.03 0.00 0.00 46.19 45.96 3h6o s LEU 183 CO 0.00 0.04 -0.19 -1.58 0.23 0.00 0.00 176.35 174.85 3h6o s GLN 184 N -0.07 3.04 -0.01 1.70 0.74 -1.04 0.12 119.66 124.15 3h6o s GLN 184 Ca 0.01 -0.82 -0.30 0.00 0.05 0.00 0.00 55.36 54.30 3h6o s GLN 184 Cb -0.01 -2.55 -0.06 0.00 1.10 0.00 0.00 33.01 31.49 3h6o s GLN 184 CO -0.00 -0.12 1.47 0.08 -0.55 0.00 0.00 175.29 176.17 3h6o s VAL 185 N 1.09 3.62 -0.14 1.34 1.01 -0.91 -1.86 120.40 124.55 3h6o s VAL 185 Ca -0.00 0.97 0.18 0.00 0.00 0.00 0.00 61.98 63.13 3h6o s VAL 185 Cb -0.14 -3.62 -0.25 0.00 0.00 0.00 0.00 36.38 32.37 3h6o s VAL 185 CO -0.07 -0.02 0.32 2.29 0.00 0.00 0.00 175.10 177.61 3h6o n LYS 186 N 5.74 0.67 -3.70 2.72 0.00 0.11 0.51 118.16 124.22 3h6o n LYS 186 Ca 0.14 0.01 -0.11 0.00 -0.00 0.00 0.00 58.31 58.36 3h6o n LYS 186 Cb 0.43 -1.59 -0.10 0.00 -0.00 0.00 0.00 35.03 33.77 3h6o n LYS 186 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 3h6o s GLN 187 N -2.78 0.43 -0.05 -1.58 0.00 -1.03 -4.89 119.66 109.76 3h6o s GLN 187 Ca -0.08 0.80 -0.03 0.00 -0.00 0.00 0.00 55.36 56.04 3h6o s GLN 187 Cb 0.08 0.02 -0.04 0.00 0.00 0.00 0.00 33.01 33.07 3h6o s GLN 187 CO 0.84 -0.15 0.13 0.15 0.00 0.00 0.00 175.29 176.27 3h6o s LYS 188 N 1.27 3.31 0.00 9.60 3.01 -1.26 -1.06 119.74 134.61 3h6o s LYS 188 Ca -0.08 -0.31 0.00 0.00 -1.01 0.00 0.00 55.97 54.56 3h6o s LYS 188 Cb -0.08 -3.04 0.00 0.00 -1.01 0.00 0.00 37.83 33.71 3h6o s LYS 188 CO -0.12 0.70 0.00 0.41 0.51 0.00 0.00 175.35 176.85 3h6o n GLY 189 N 1.40 5.45 0.07 -3.33 0.00 0.20 -5.01 105.19 103.97 3h6o n GLY 189 Ca -0.15 -1.52 -0.02 0.00 0.00 0.00 0.00 46.02 44.34 3h6o n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o h ALA 190 N 1.00 -0.34 -0.04 4.61 0.00 -2.00 -3.40 119.26 119.08 3h6o h ALA 190 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3h6o h ALA 190 Cb 0.00 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.75 3h6o h ALA 190 CO 0.00 -0.33 -0.62 -3.47 0.00 0.00 0.00 179.25 174.82 3h6o n ASP 191 N -3.05 1.74 -3.92 0.00 2.03 -1.26 -4.91 116.55 107.18 3h6o n ASP 191 Ca -0.02 -3.53 -0.14 0.00 0.52 0.00 0.00 54.79 51.63 3h6o n ASP 191 Cb 0.06 -0.48 -0.14 0.00 -0.72 0.00 0.00 41.12 39.84 3h6o n ASP 191 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3h6o s PHE 192 N -2.67 0.27 -0.06 -0.67 5.36 -1.26 -1.87 117.98 117.08 3h6o s PHE 192 Ca 0.38 -0.06 0.04 0.00 -0.96 0.00 0.00 56.93 56.33 3h6o s PHE 192 Cb 0.38 -0.17 -0.00 0.00 -0.34 0.00 0.00 43.02 42.88 3h6o s PHE 192 CO -0.08 -0.01 -0.19 -0.51 -1.46 0.00 0.00 175.22 172.97 3h6o s LEU 193 N -0.11 1.92 -0.24 6.12 1.43 -0.98 -0.63 118.68 126.19 3h6o s LEU 193 Ca 0.01 -0.40 -0.07 0.00 -1.03 0.00 0.00 54.13 52.63 3h6o s LEU 193 Cb -0.01 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 45.09 3h6o s LEU 193 CO -0.00 0.15 0.07 0.54 0.23 0.00 0.00 176.35 177.34 3h6o s VAL 194 N 0.17 4.45 0.25 -1.59 0.11 -0.22 -2.29 120.40 121.28 3h6o s VAL 194 Ca -0.08 -0.13 0.11 0.00 -2.93 0.00 0.00 61.98 58.94 3h6o s VAL 194 Cb -0.14 -3.07 -0.05 0.00 -1.53 0.00 0.00 36.38 31.60 3h6o s VAL 194 CO 0.04 0.36 -0.18 0.42 -3.33 0.00 0.00 175.10 172.40 3h6o s THR 195 N 1.38 2.24 -0.15 5.04 -4.23 -1.26 0.07 115.64 118.73 3h6o s THR 195 Ca 0.05 -2.32 -0.02 0.00 -1.18 0.00 0.00 61.69 58.22 3h6o s THR 195 Cb -0.15 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 71.47 3h6o s THR 195 CO 0.04 -0.44 -0.08 -1.83 -0.54 0.00 0.00 174.62 171.76 3h6o s GLU 196 N -3.50 3.51 0.10 3.99 -1.05 -0.77 -4.88 118.70 116.09 3h6o s GLU 196 Ca 0.27 -0.61 -0.31 0.00 -0.15 0.00 0.00 54.97 54.18 3h6o s GLU 196 Cb -0.04 -2.79 -0.07 0.00 -0.44 0.00 0.00 34.13 30.79 3h6o s GLU 196 CO 0.12 0.18 1.27 0.08 0.95 0.00 0.00 175.26 177.87 3h6o s VAL 197 N 0.47 3.69 -0.16 1.83 1.01 -1.26 -2.51 120.40 123.47 3h6o s VAL 197 Ca -0.06 1.24 -0.13 0.00 0.00 0.00 0.00 61.98 63.03 3h6o s VAL 197 Cb -0.15 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 3h6o s VAL 197 CO 0.04 0.11 -0.21 -0.62 0.00 0.00 0.00 175.10 174.41 3h6o n GLU 198 N 3.71 0.49 -4.72 2.72 1.02 -0.52 -4.93 120.64 118.40 3h6o n GLU 198 Ca 0.09 0.43 -0.33 0.00 -0.02 0.00 0.00 57.16 57.33 3h6o n GLU 198 Cb 0.45 -1.61 -0.15 0.00 -0.02 0.00 0.00 31.44 30.11 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 -5.92 3.89 0.00 1.62 0.02 -1.23 -4.97 114.94 108.35 3h6o s ASN 199 Ca -0.21 -0.37 0.00 0.00 -1.02 0.00 0.00 52.86 51.26 3h6o s ASN 199 Cb 0.03 -1.59 0.00 0.00 0.02 0.00 0.00 41.25 39.71 3h6o s ASN 199 CO 0.32 0.14 0.00 0.61 0.02 0.00 0.00 177.10 178.19 3h6o n GLY 200 N 3.68 1.83 0.39 0.66 0.00 -1.26 -1.85 105.19 108.64 3h6o n GLY 200 Ca -0.18 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.02 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 0.91 0.00 -0.02 0.00 -1.26 -4.50 105.19 105.31 3h6o n GLY 201 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 204 N -0.16 -1.55 3.88 -0.02 0.00 -1.26 -5.08 105.19 101.00 3h6o n GLY 204 Ca 0.00 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.48 3h6o n GLY 204 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6o s SER 205 N -3.46 6.31 -1.61 1.61 0.01 -1.26 -4.57 113.70 110.72 3h6o s SER 205 Ca 0.00 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.63 3h6o s SER 205 Cb 0.00 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.24 3h6o s SER 205 CO 0.00 0.31 0.00 2.29 0.41 0.00 0.00 173.24 176.25 3h6o n LYS 206 N 1.31 -1.46 -2.90 12.44 -0.00 -0.57 -4.97 118.16 122.00 3h6o n LYS 206 Ca -0.14 0.92 -0.32 0.00 -0.00 0.00 0.00 58.31 58.76 3h6o n LYS 206 Cb 0.53 -5.43 -0.06 0.00 -0.00 0.00 0.00 35.03 30.08 3h6o n LYS 206 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3h6o s LYS 207 N -4.82 4.08 0.22 -1.58 -0.14 -1.26 -4.52 119.74 111.71 3h6o s LYS 207 Ca 0.00 0.88 -0.30 0.00 -1.36 0.00 0.00 55.97 55.19 3h6o s LYS 207 Cb 0.00 -2.29 -0.09 0.00 -1.68 0.00 0.00 37.83 33.78 3h6o s LYS 207 CO 0.00 0.02 1.14 0.20 -0.76 0.00 0.00 175.35 175.94 3h6o s GLY 208 N -2.38 2.88 -0.08 -3.33 0.00 -1.26 -1.25 107.32 101.89 3h6o s GLY 208 Ca 0.58 0.90 0.02 0.00 0.00 0.00 0.00 44.72 46.22 3h6o s GLY 208 CO 0.18 1.67 -0.15 0.14 0.00 0.00 0.00 173.10 174.94 3h6o s VAL 209 N -0.54 2.98 -0.00 1.40 1.01 0.01 0.13 120.40 125.38 3h6o s VAL 209 Ca 0.49 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.81 3h6o s VAL 209 Cb -0.32 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 3h6o s VAL 209 CO 0.38 0.57 -0.24 0.20 0.00 0.00 0.00 175.10 176.01 3h6o s ASN 210 N -0.30 3.25 -0.68 3.32 -0.87 -0.16 -4.22 114.94 115.27 3h6o s ASN 210 Ca 0.02 -0.46 0.05 0.00 -1.57 0.00 0.00 52.86 50.90 3h6o s ASN 210 Cb -0.13 -0.41 0.19 0.00 -0.02 0.00 0.00 41.25 40.88 3h6o s ASN 210 CO 0.03 0.30 0.55 0.18 -2.57 0.00 0.00 177.10 175.58 3h6o n LEU 211 N 2.19 3.07 -4.65 0.60 7.99 -1.26 -0.11 117.00 124.82 3h6o n LEU 211 Ca -0.16 -5.24 -0.46 0.00 -0.01 0.00 0.00 56.01 50.14 3h6o n LEU 211 Cb 0.51 -0.69 -0.03 0.00 -0.11 0.00 0.00 43.42 43.10 3h6o n LEU 211 CO 0.24 1.83 0.99 -0.81 -1.51 0.00 0.00 177.39 178.12 3h6o n PRO 212 N 1.74 1.87 -0.97 3.23 -0.04 -1.24 -2.21 135.00 137.37 3h6o n PRO 212 Ca 0.22 0.67 0.00 0.00 -0.04 0.00 0.00 63.50 64.35 3h6o n PRO 212 Cb 0.37 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 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 2.37 0.40 3.91 0.55 0.00 -1.26 -4.63 105.19 106.52 3h6o n GLY 213 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.91 3.94 -0.93 4.61 0.00 -0.94 -4.99 121.76 121.54 3h6o s ALA 214 Ca 0.00 -0.73 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 3h6o s ALA 214 Cb 0.00 -1.93 0.09 0.00 0.00 0.00 0.00 23.12 21.28 3h6o s ALA 214 CO 0.00 0.75 1.25 0.00 0.00 0.00 0.00 175.76 177.76 3h6o s ALA 215 N -1.42 3.05 0.06 0.00 0.00 -1.26 -4.73 121.76 117.46 3h6o s ALA 215 Ca 0.32 -2.42 -0.31 0.00 0.00 0.00 0.00 51.96 49.55 3h6o s ALA 215 Cb -0.13 -4.23 -0.06 0.00 0.00 0.00 0.00 23.12 18.70 3h6o s ALA 215 CO 0.22 -3.23 1.28 0.08 0.00 0.00 0.00 175.76 174.11 3h6o s VAL 216 N 3.86 3.81 -1.03 0.00 1.01 -1.26 -4.87 120.40 121.92 3h6o s VAL 216 Ca 0.37 1.28 0.18 0.00 0.00 0.00 0.00 61.98 63.80 3h6o s VAL 216 Cb -0.04 -3.82 0.73 0.00 0.00 0.00 0.00 36.38 33.26 3h6o s VAL 216 CO -0.07 0.08 1.64 -0.90 0.00 0.00 0.00 175.10 175.85 3h6o n ASP 217 N 4.24 4.88 -4.60 3.32 5.75 -1.26 -4.98 116.55 123.91 3h6o n ASP 217 Ca 0.10 -2.51 -0.43 0.00 -0.01 0.00 0.00 54.79 51.94 3h6o n ASP 217 Cb 0.45 -0.60 -0.01 0.00 -1.03 0.00 0.00 41.12 39.93 3h6o n ASP 217 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3h6o n LEU 218 N 1.06 2.05 -4.70 -2.12 4.77 -1.26 -4.88 117.00 111.91 3h6o n LEU 218 Ca 0.26 1.14 -0.40 0.00 -0.03 0.00 0.00 56.01 56.98 3h6o n LEU 218 Cb 0.93 -1.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.73 3h6o n LEU 218 CO 0.25 -1.41 0.88 -2.65 -1.33 0.00 0.00 177.39 173.14 3h6o n PRO 219 N 0.57 1.80 -0.33 3.23 -0.02 -1.26 -4.89 135.00 134.09 3h6o n PRO 219 Ca 0.09 0.65 0.07 0.00 -2.02 0.00 0.00 63.50 62.29 3h6o n PRO 219 Cb 0.34 -2.42 0.16 0.00 -0.02 0.00 0.00 33.50 31.57 3h6o n PRO 219 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h6o h ALA 220 N 1.80 0.73 -3.43 3.55 0.00 -1.92 -3.38 119.26 116.61 3h6o h ALA 220 Ca -0.49 0.36 -0.58 0.00 0.00 0.00 0.00 54.91 54.20 3h6o h ALA 220 Cb 1.30 0.68 -0.38 0.00 0.00 0.00 0.00 17.79 19.40 3h6o h ALA 220 CO 0.58 -0.42 -0.79 0.08 0.00 0.00 0.00 179.25 178.70 3h6o s VAL 221 N -6.20 1.33 1.18 0.00 1.01 -1.26 -4.73 120.40 111.73 3h6o s VAL 221 Ca -0.14 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 60.79 3h6o s VAL 221 Cb 0.26 -1.52 0.27 0.00 0.00 0.00 0.00 36.38 35.40 3h6o s VAL 221 CO 0.77 0.07 1.06 -0.94 0.00 0.00 0.00 175.10 176.06 3h6o s SER 222 N 1.52 1.03 0.10 3.32 1.04 -1.26 -4.79 113.70 114.66 3h6o s SER 222 Ca -0.02 0.98 -0.19 0.00 0.48 0.00 0.00 55.95 57.20 3h6o s SER 222 Cb -0.16 -1.47 -0.08 0.00 0.10 0.00 0.00 66.02 64.41 3h6o s SER 222 CO -0.07 -4.10 1.65 -0.33 0.98 0.00 0.00 173.24 171.37 3h6o h GLU 223 N -2.56 0.32 -0.56 4.02 5.08 -1.98 -1.80 114.58 117.11 3h6o h GLU 223 Ca -0.51 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 57.77 3h6o h GLU 223 Cb 1.32 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 3h6o h GLU 223 CO 0.43 0.36 0.24 -0.22 -1.00 0.00 0.00 179.01 178.82 3h6o h LYS 224 N 0.21 0.80 -0.76 2.33 3.64 -1.97 -2.95 116.57 117.88 3h6o h LYS 224 Ca 0.07 -0.11 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3h6o h LYS 224 Cb 0.15 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 3h6o h LYS 224 CO -0.01 0.65 0.49 -0.44 -2.27 0.00 0.00 179.45 177.87 3h6o h ASP 225 N 0.80 0.81 -0.37 4.20 3.32 -1.76 -2.14 116.42 121.28 3h6o h ASP 225 Ca 0.19 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.29 3h6o h ASP 225 Cb 0.14 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.45 3h6o h ASP 225 CO -0.02 0.57 0.07 0.40 -1.72 0.00 0.00 179.24 178.54 3h6o h ILE 226 N 0.96 0.81 -0.54 0.35 1.08 -1.17 -0.90 117.51 118.10 3h6o h ILE 226 Ca 0.30 -0.07 -0.08 0.00 -0.39 0.00 0.00 64.86 64.62 3h6o h ILE 226 Cb -0.03 0.60 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 3h6o h ILE 226 CO -0.10 0.04 0.01 1.56 -0.69 0.00 0.00 178.15 178.98 3h6o h GLN 227 N 0.20 0.91 -0.20 2.37 4.20 -1.47 -2.77 115.11 118.35 3h6o h GLN 227 Ca 0.18 -0.26 -0.20 0.00 0.06 0.00 0.00 58.65 58.43 3h6o h GLN 227 Cb 0.21 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.89 3h6o h GLN 227 CO -0.23 0.90 -0.67 -0.44 -0.67 0.00 0.00 178.83 177.71 3h6o h ASP 228 N 0.85 0.89 -0.50 1.46 3.32 -0.97 -2.39 116.42 119.08 3h6o h ASP 228 Ca 0.16 -0.53 -0.04 0.00 0.02 0.00 0.00 57.03 56.63 3h6o h ASP 228 Cb 0.48 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 3h6o h ASP 228 CO 0.02 1.32 0.16 -0.07 -1.72 0.00 0.00 179.24 178.96 3h6o h LEU 229 N 0.56 0.76 -0.80 1.55 3.38 -1.11 0.56 115.31 120.22 3h6o h LEU 229 Ca -0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3h6o h LEU 229 Cb 1.28 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 3h6o h LEU 229 CO 0.14 0.73 0.39 0.50 0.09 0.00 0.00 178.44 180.28 3h6o h LYS 230 N 0.80 1.15 -0.35 1.13 3.64 -1.42 -1.48 116.57 120.04 3h6o h LYS 230 Ca 0.18 -0.17 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 3h6o h LYS 230 Cb 0.25 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3h6o h LYS 230 CO -0.01 0.89 -0.05 0.35 -2.27 0.00 0.00 179.45 178.36 3h6o h PHE 231 N 1.13 0.73 -0.64 1.91 3.57 -1.00 -1.73 116.94 120.91 3h6o h PHE 231 Ca 0.27 -0.15 0.13 0.00 3.53 0.00 0.00 57.97 61.76 3h6o h PHE 231 Cb 0.11 -0.18 -0.10 0.00 2.79 0.00 0.00 35.95 38.57 3h6o h PHE 231 CO 0.01 0.80 0.07 0.78 -2.23 0.00 0.00 178.31 177.74 3h6o h GLY 232 N 0.46 0.76 0.96 2.40 0.00 -0.69 0.22 103.07 107.18 3h6o h GLY 232 Ca 0.09 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 3h6o h GLY 232 CO 0.03 -0.18 -0.06 -2.08 0.00 0.00 0.00 176.54 174.25 3h6o h VAL 233 N 0.18 0.90 -0.85 4.60 2.07 -1.10 -1.91 116.25 120.14 3h6o h VAL 233 Ca 0.34 -0.10 0.10 0.00 0.82 0.00 0.00 66.70 67.86 3h6o h VAL 233 Cb 0.55 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 31.22 3h6o h VAL 233 CO -0.50 0.02 0.50 -0.33 0.02 0.00 0.00 177.57 177.29 3h6o h GLU 234 N -0.22 0.80 -0.30 1.57 5.08 -0.80 -1.76 114.58 118.97 3h6o h GLU 234 Ca -0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3h6o h GLU 234 Cb 0.17 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.24 3h6o h GLU 234 CO 0.03 0.53 0.00 1.04 -1.00 0.00 0.00 179.01 179.61 3h6o n GLN 235 N -4.72 1.69 -3.15 2.33 1.13 0.72 -4.94 117.38 110.44 3h6o n GLN 235 Ca 0.14 -1.08 -0.23 0.00 -1.94 0.00 0.00 57.00 53.90 3h6o n GLN 235 Cb 0.28 -1.24 0.05 0.00 0.11 0.00 0.00 30.24 29.44 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 0.37 -6.22 -4.73 1.08 2.03 -0.66 -4.95 116.55 103.47 3h6o n ASP 236 Ca 0.10 -0.35 -0.37 0.00 0.52 0.00 0.00 54.79 54.70 3h6o n ASP 236 Cb 0.25 -4.99 0.06 0.00 -0.72 0.00 0.00 41.12 35.72 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 -3.22 2.15 0.01 5.18 -7.23 -0.78 -4.95 120.40 111.56 3h6o s VAL 237 Ca 0.37 0.09 0.03 0.00 -1.81 0.00 0.00 61.98 60.66 3h6o s VAL 237 Cb -0.16 -3.02 -0.25 0.00 0.56 0.00 0.00 36.38 33.51 3h6o s VAL 237 CO 0.46 -0.02 0.87 0.44 -0.31 0.00 0.00 175.10 176.53 3h6o h ASP 238 N 0.57 0.20 -4.98 4.85 3.32 -1.45 -3.45 116.42 115.47 3h6o h ASP 238 Ca -0.51 -0.30 -0.12 0.00 0.02 0.00 0.00 57.03 56.13 3h6o h ASP 238 Cb 1.33 -0.07 -0.20 0.00 0.22 0.00 0.00 39.33 40.61 3h6o h ASP 238 CO 0.53 1.25 -0.26 0.00 -1.72 0.00 0.00 179.24 179.05 3h6o s MET 239 N -2.63 0.68 -0.14 3.56 0.23 -1.16 -2.55 119.30 117.29 3h6o s MET 239 Ca -0.06 -0.17 -0.02 0.00 -1.03 0.00 0.00 55.69 54.40 3h6o s MET 239 Cb 0.08 0.30 -0.02 0.00 -1.53 0.00 0.00 34.83 33.66 3h6o s MET 239 CO 0.83 -0.19 -0.08 0.08 -2.03 0.00 0.00 175.02 173.64 3h6o s VAL 240 N -1.31 3.55 -0.43 5.16 1.01 -0.11 -1.87 120.40 126.39 3h6o s VAL 240 Ca -0.13 -0.49 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 3h6o s VAL 240 Cb -0.05 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.84 3h6o s VAL 240 CO 0.04 0.51 0.43 -0.36 0.00 0.00 0.00 175.10 175.73 3h6o s PHE 241 N 0.27 3.18 -0.32 5.22 0.08 0.30 -0.91 117.98 125.79 3h6o s PHE 241 Ca -0.06 -0.49 -0.15 0.00 0.12 0.00 0.00 56.93 56.35 3h6o s PHE 241 Cb -0.15 -2.94 -0.02 0.00 -0.57 0.00 0.00 43.02 39.34 3h6o s PHE 241 CO 0.04 -0.73 0.37 0.00 -0.10 0.00 0.00 175.22 174.80 3h6o s ALA 242 N 2.05 3.51 0.41 5.36 0.00 0.41 -2.29 121.76 131.22 3h6o s ALA 242 Ca 0.10 -1.08 -0.23 0.00 0.00 0.00 0.00 51.96 50.75 3h6o s ALA 242 Cb -0.18 -2.80 -0.09 0.00 0.00 0.00 0.00 23.12 20.05 3h6o s ALA 242 CO 0.12 -0.96 1.05 -1.12 0.00 0.00 0.00 175.76 174.85 3h6o s SER 243 N 1.71 6.68 -1.47 0.00 0.01 -1.26 -1.03 113.70 118.34 3h6o s SER 243 Ca 0.13 2.02 -0.12 0.00 1.31 0.00 0.00 55.95 59.30 3h6o s SER 243 Cb -0.16 -2.58 0.06 0.00 0.21 0.00 0.00 66.02 63.54 3h6o s SER 243 CO 0.11 -0.54 1.02 0.33 0.41 0.00 0.00 173.24 174.57 3h6o n PHE 244 N -0.23 -2.48 -2.18 2.43 7.35 -1.22 -4.74 117.46 116.40 3h6o n PHE 244 Ca 0.06 0.91 -0.42 0.00 -0.76 0.00 0.00 57.45 57.23 3h6o n PHE 244 Cb 0.50 -4.34 -0.03 0.00 0.35 0.00 0.00 39.48 35.96 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 -3.28 3.73 -0.33 -2.13 -1.09 -1.08 -4.90 121.20 112.13 3h6o s ILE 245 Ca 0.61 1.02 0.08 0.00 -2.23 0.00 0.00 60.65 60.14 3h6o s ILE 245 Cb -0.29 -3.66 -0.10 0.00 -1.58 0.00 0.00 42.46 36.83 3h6o s ILE 245 CO 0.76 -0.04 0.32 0.54 -1.23 0.00 0.00 174.94 175.29 3h6o n ARG 246 N 6.13 3.57 -3.77 2.79 1.74 -1.26 -4.36 116.66 121.49 3h6o n ARG 246 Ca 0.15 -0.01 -0.01 0.00 -0.77 0.00 0.00 57.85 57.20 3h6o n ARG 246 Cb 0.43 -0.95 -0.00 0.00 -1.02 0.00 0.00 32.46 30.93 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 -1.92 0.90 0.09 5.56 -2.85 -1.26 -4.10 119.74 116.15 3h6o s LYS 247 Ca 0.02 -0.53 -0.18 0.00 -1.00 0.00 0.00 55.97 54.28 3h6o s LYS 247 Cb 0.06 0.28 -0.07 0.00 -2.06 0.00 0.00 37.83 36.04 3h6o s LYS 247 CO 0.34 -0.41 1.55 0.00 0.10 0.00 0.00 175.35 176.93 3h6o h ALA 248 N 2.00 0.35 -0.15 0.59 0.00 -1.86 -2.53 119.26 117.65 3h6o h ALA 248 Ca -0.27 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.49 3h6o h ALA 248 Cb 1.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3h6o h ALA 248 CO 0.29 0.05 0.22 0.66 0.00 0.00 0.00 179.25 180.47 3h6o h SER 249 N 0.25 0.00 -0.37 0.00 4.64 -1.97 0.26 113.55 116.36 3h6o h SER 249 Ca 0.08 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.24 3h6o h SER 249 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 3h6o h SER 249 CO 0.01 0.00 -0.40 0.44 -0.87 0.00 0.00 176.83 176.01 3h6o h ASP 250 N 0.00 0.99 0.08 4.97 3.32 -1.87 -2.02 116.42 121.90 3h6o h ASP 250 Ca 0.07 -0.46 -0.13 0.00 0.02 0.00 0.00 57.03 56.53 3h6o h ASP 250 Cb 0.51 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 3h6o h ASP 250 CO -0.00 1.26 -0.43 0.58 -1.72 0.00 0.00 179.24 178.93 3h6o h VAL 251 N 0.75 1.31 -0.28 -1.35 2.07 -1.02 -1.76 116.25 115.97 3h6o h VAL 251 Ca 0.06 -1.60 -0.15 0.00 0.82 0.00 0.00 66.70 65.83 3h6o h VAL 251 Cb 1.00 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 3h6o h VAL 251 CO 0.10 0.49 -0.43 0.45 0.02 0.00 0.00 177.57 178.20 3h6o h HIS 252 N 0.36 0.85 -0.56 1.57 3.86 -1.31 -0.53 115.15 119.38 3h6o h HIS 252 Ca 0.03 -0.26 -0.05 0.00 -1.16 0.00 0.00 60.37 58.93 3h6o h HIS 252 Cb 0.90 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 29.17 3h6o h HIS 252 CO 0.03 1.01 0.14 1.49 0.86 0.00 0.00 177.93 181.46 3h6o h GLU 253 N 0.57 0.89 -0.15 2.45 4.57 -1.29 0.17 114.58 121.80 3h6o h GLU 253 Ca 0.04 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 58.00 3h6o h GLU 253 Cb 0.97 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 3h6o h GLU 253 CO 0.09 0.83 0.06 0.28 -1.18 0.00 0.00 179.01 179.09 3h6o h VAL 254 N 0.80 1.16 -0.64 0.32 2.07 -1.09 -1.49 116.25 117.37 3h6o h VAL 254 Ca 0.18 -0.49 0.11 0.00 0.82 0.00 0.00 66.70 67.32 3h6o h VAL 254 Cb 0.33 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 31.24 3h6o h VAL 254 CO 0.00 0.15 0.22 -0.09 0.02 0.00 0.00 177.57 177.87 3h6o h ARG 255 N 0.07 0.37 -0.70 1.57 9.65 -0.99 -0.25 114.38 124.10 3h6o h ARG 255 Ca 0.05 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.84 3h6o h ARG 255 Cb 0.18 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.65 3h6o h ARG 255 CO -0.00 0.25 0.19 0.87 2.80 0.00 0.00 179.97 184.07 3h6o h LYS 256 N 0.39 1.11 -0.40 0.20 1.57 -0.52 0.16 116.57 119.07 3h6o h LYS 256 Ca 0.33 -0.26 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 3h6o h LYS 256 Cb 0.44 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3h6o h LYS 256 CO -0.34 0.97 -0.16 0.28 -0.57 0.00 0.00 179.45 179.62 3h6o h VAL 257 N 1.04 1.28 -0.61 0.50 2.07 -0.66 -2.42 116.25 117.45 3h6o h VAL 257 Ca 0.22 -1.28 -0.06 0.00 0.82 0.00 0.00 66.70 66.40 3h6o h VAL 257 Cb 0.35 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 3h6o h VAL 257 CO -0.00 0.43 0.14 -0.07 0.02 0.00 0.00 177.57 178.09 3h6o h LEU 258 N 0.62 0.90 0.00 2.57 3.38 -0.98 -3.48 115.31 118.32 3h6o h LEU 258 Ca 0.09 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3h6o h LEU 258 Cb 0.71 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3h6o h LEU 258 CO 0.05 0.88 0.00 0.61 0.09 0.00 0.00 178.44 180.07 3h6o n GLY 259 N -0.77 0.92 0.29 0.83 0.00 0.55 -1.97 105.19 105.03 3h6o n GLY 259 Ca 0.04 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 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 0.96 -0.37 1.61 4.22 -1.87 -2.05 114.58 117.07 3h6o h GLU 260 Ca 0.00 -0.37 -0.01 0.00 0.08 0.00 0.00 59.36 59.06 3h6o h GLU 260 Cb 0.00 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3h6o h GLU 260 CO 0.00 1.04 0.20 0.87 -2.18 0.00 0.00 179.01 178.94 3h6o h LYS 261 N 0.84 0.50 -0.49 1.92 6.56 -1.98 -3.13 116.57 120.79 3h6o h LYS 261 Ca 0.12 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.67 3h6o h LYS 261 Cb 0.71 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.26 3h6o h LYS 261 CO 0.05 0.37 0.00 0.41 -2.06 0.00 0.00 179.45 178.23 3h6o n GLY 262 N -1.36 3.18 0.21 3.86 0.00 -0.83 -4.67 105.19 105.58 3h6o n GLY 262 Ca 0.02 -0.88 0.15 0.00 0.00 0.00 0.00 46.02 45.31 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 3.25 0.00 -0.03 1.61 2.10 -1.33 0.32 116.57 122.48 3h6o h LYS 263 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3h6o h LYS 263 Cb 1.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 3h6o h LYS 263 CO 0.28 0.00 -0.05 0.09 -2.00 0.00 0.00 179.45 177.78 3h6o n ASN 264 N -2.60 2.84 -4.70 7.07 3.02 -1.26 -4.88 115.26 114.75 3h6o n ASN 264 Ca -0.00 -1.92 -0.42 0.00 -0.03 0.00 0.00 54.58 52.21 3h6o n ASN 264 Cb 0.17 0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.36 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 -1.98 4.69 0.19 2.41 1.01 0.10 -4.94 121.20 122.68 3h6o s ILE 265 Ca 0.26 1.95 -0.30 0.00 0.00 0.00 0.00 60.65 62.56 3h6o s ILE 265 Cb 0.19 -4.25 -0.08 0.00 0.01 0.00 0.00 42.46 38.33 3h6o s ILE 265 CO 0.32 0.06 1.00 -0.54 0.00 0.00 0.00 174.94 175.77 3h6o s LYS 266 N 1.68 4.73 -0.25 2.79 -0.14 -1.06 -4.89 119.74 122.61 3h6o s LYS 266 Ca 0.51 1.56 -0.09 0.00 -1.36 0.00 0.00 55.97 56.60 3h6o s LYS 266 Cb -0.21 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.61 3h6o s LYS 266 CO 0.22 0.30 0.12 0.42 -0.76 0.00 0.00 175.35 175.65 3h6o s ILE 267 N -0.64 4.78 -0.29 2.17 1.01 -1.26 -0.93 121.20 126.03 3h6o s ILE 267 Ca 0.45 -0.02 -0.06 0.00 0.00 0.00 0.00 60.65 61.02 3h6o s ILE 267 Cb -0.27 -3.24 0.01 0.00 0.01 0.00 0.00 42.46 38.97 3h6o s ILE 267 CO 0.33 0.32 0.07 -0.63 0.00 0.00 0.00 174.94 175.04 3h6o s ILE 268 N 1.49 3.89 0.06 2.92 -1.09 -0.09 -0.76 121.20 127.61 3h6o s ILE 268 Ca 0.06 -0.73 -0.27 0.00 -2.23 0.00 0.00 60.65 57.48 3h6o s ILE 268 Cb -0.15 -3.02 -0.05 0.00 -1.58 0.00 0.00 42.46 37.66 3h6o s ILE 268 CO 0.06 0.07 0.85 -0.44 -1.23 0.00 0.00 174.94 174.26 3h6o s SER 269 N 1.48 7.32 -0.30 3.58 0.01 -0.87 -0.44 113.70 124.48 3h6o s SER 269 Ca 0.02 1.58 -0.14 0.00 1.31 0.00 0.00 55.95 58.72 3h6o s SER 269 Cb -0.17 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 3h6o s SER 269 CO 0.02 -0.05 0.30 -0.54 0.41 0.00 0.00 173.24 173.38 3h6o s LYS 270 N 0.11 3.83 -0.31 12.44 1.02 -0.20 -0.33 119.74 136.30 3h6o s LYS 270 Ca 0.43 -0.26 -0.16 0.00 0.02 0.00 0.00 55.97 56.00 3h6o s LYS 270 Cb -0.21 -3.71 -0.02 0.00 -0.52 0.00 0.00 37.83 33.36 3h6o s LYS 270 CO 0.26 -0.33 0.42 0.42 -0.92 0.00 0.00 175.35 175.20 3h6o s ILE 271 N 1.93 5.12 0.00 2.17 -1.09 -0.81 -2.63 121.20 125.88 3h6o s ILE 271 Ca 0.11 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 3h6o s ILE 271 Cb -0.16 -3.81 0.00 0.00 -1.58 0.00 0.00 42.46 36.91 3h6o s ILE 271 CO 0.11 -0.01 0.09 -0.62 -1.23 0.00 0.00 174.94 173.28 3h6o n GLU 272 N 5.48 -0.01 -3.97 2.79 1.02 -1.26 -2.34 120.64 122.34 3h6o n GLU 272 Ca -0.07 -0.10 -0.09 0.00 -0.02 0.00 0.00 57.16 56.88 3h6o n GLU 272 Cb 0.50 -0.52 -0.04 0.00 -0.02 0.00 0.00 31.44 31.36 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 -0.01 -0.00 0.24 1.62 4.22 -1.26 -2.92 114.94 116.83 3h6o s ASN 273 Ca 0.00 -0.96 -0.07 0.00 -2.14 0.00 0.00 52.86 49.70 3h6o s ASN 273 Cb 0.00 0.64 0.23 0.00 1.28 0.00 0.00 41.25 43.39 3h6o s ASN 273 CO 0.00 -1.23 1.88 -0.74 -2.04 0.00 0.00 177.10 174.97 3h6o h HIS 274 N 2.18 1.25 -0.65 1.54 -0.00 -1.92 -2.72 115.15 114.84 3h6o h HIS 274 Ca -0.26 -0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.04 3h6o h HIS 274 Cb 1.25 -0.41 -0.03 0.00 -0.00 0.00 0.00 27.41 28.22 3h6o h HIS 274 CO 0.59 0.83 0.12 1.49 -0.00 0.00 0.00 177.93 180.97 3h6o h GLU 275 N 1.31 1.04 0.00 5.26 4.81 -1.90 0.14 114.58 125.24 3h6o h GLU 275 Ca 0.34 -0.26 -0.09 0.00 -0.13 0.00 0.00 59.36 59.22 3h6o h GLU 275 Cb -0.05 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 3h6o h GLU 275 CO -0.06 0.94 -0.42 0.78 -0.73 0.00 0.00 179.01 179.52 3h6o h GLY 276 N 1.05 0.00 0.50 1.92 0.00 -1.65 0.18 103.07 105.07 3h6o h GLY 276 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 3h6o h GLY 276 CO 0.01 0.00 -0.02 -2.08 0.00 0.00 0.00 176.54 174.45 3h6o h VAL 277 N 0.00 1.41 -0.70 4.60 2.07 -1.12 -2.87 116.25 119.65 3h6o h VAL 277 Ca -0.00 -1.25 0.09 0.00 0.82 0.00 0.00 66.70 66.36 3h6o h VAL 277 Cb 0.88 2.22 -0.07 0.00 -1.52 0.00 0.00 31.29 32.81 3h6o h VAL 277 CO 0.05 0.33 0.34 0.03 0.02 0.00 0.00 177.57 178.35 3h6o h ARG 278 N -0.47 0.57 -0.82 1.57 3.08 -0.57 -2.80 114.38 114.94 3h6o h ARG 278 Ca 0.00 -0.03 -0.37 0.00 0.07 0.00 0.00 59.98 59.65 3h6o h ARG 278 Cb 0.55 -0.13 -0.22 0.00 0.08 0.00 0.00 29.97 30.25 3h6o h ARG 278 CO 0.00 0.38 0.43 0.54 -1.07 0.00 0.00 179.97 180.25 3h6o n ARG 279 N -4.87 2.74 -0.23 0.04 1.74 0.60 -4.67 116.66 112.01 3h6o n ARG 279 Ca 0.11 -3.06 -0.03 0.00 -0.77 0.00 0.00 57.85 54.10 3h6o n ARG 279 Cb 0.26 -2.15 0.16 0.00 -1.02 0.00 0.00 32.46 29.71 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 1.60 1.04 -0.52 -1.55 3.57 -1.25 -2.70 116.94 117.13 3h6o h PHE 280 Ca 0.45 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.87 3h6o h PHE 280 Cb 2.53 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 40.92 3h6o h PHE 280 CO 1.41 0.76 0.16 -0.44 -2.23 0.00 0.00 178.31 177.97 3h6o h ASP 281 N 1.04 0.76 -0.33 0.41 3.32 -1.85 0.14 116.42 119.91 3h6o h ASP 281 Ca 0.26 -0.21 -0.18 0.00 0.02 0.00 0.00 57.03 56.92 3h6o h ASP 281 Cb 0.10 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 3h6o h ASP 281 CO -0.03 0.76 -0.49 1.05 -1.72 0.00 0.00 179.24 178.81 3h6o h GLU 282 N 0.71 0.91 -0.63 3.56 4.11 -1.93 -2.00 114.58 119.32 3h6o h GLU 282 Ca 0.17 -0.54 0.00 0.00 0.07 0.00 0.00 59.36 59.07 3h6o h GLU 282 Cb 0.27 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 3h6o h GLU 282 CO -0.01 1.18 0.41 0.82 0.07 0.00 0.00 179.01 181.48 3h6o h ILE 283 N 0.71 1.17 -0.46 -1.06 2.04 -1.27 -2.34 117.51 116.30 3h6o h ILE 283 Ca 0.03 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 3h6o h ILE 283 Cb 1.09 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3h6o h ILE 283 CO 0.11 0.16 0.17 0.25 0.00 0.00 0.00 178.15 178.85 3h6o h LEU 284 N 0.85 0.65 -0.88 1.44 5.85 -0.71 -1.94 115.31 120.57 3h6o h LEU 284 Ca 0.23 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.82 3h6o h LEU 284 Cb -0.08 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 3h6o h LEU 284 CO -0.05 0.66 0.55 -0.08 -0.34 0.00 0.00 178.44 179.18 3h6o h GLU 285 N 0.61 0.98 0.00 1.25 4.22 -1.08 -2.20 114.58 118.36 3h6o h GLU 285 Ca 0.15 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.53 3h6o h GLU 285 Cb 0.22 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3h6o h GLU 285 CO -0.01 0.65 0.00 0.00 -2.18 0.00 0.00 179.01 177.47 3h6o h ALA 286 N 1.41 1.00 -1.89 2.92 0.00 -1.24 -3.47 119.26 117.99 3h6o h ALA 286 Ca 0.38 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.84 3h6o h ALA 286 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3h6o h ALA 286 CO -0.17 0.00 -0.36 -1.12 0.00 0.00 0.00 179.25 177.60 3h6o s SER 287 N -4.65 6.04 0.08 0.00 0.01 -0.75 -4.90 113.70 109.54 3h6o s SER 287 Ca 0.10 -0.13 0.24 0.00 1.31 0.00 0.00 55.95 57.46 3h6o s SER 287 Cb 0.12 -1.37 0.28 0.00 0.21 0.00 0.00 66.02 65.26 3h6o s SER 287 CO 0.59 -0.35 1.25 0.47 0.41 0.00 0.00 173.24 175.61 3h6o n ASP 288 N -1.58 0.64 0.00 2.44 8.00 0.06 -4.95 116.55 121.16 3h6o n ASP 288 Ca -0.02 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.45 3h6o n ASP 288 Cb 0.58 0.36 0.00 0.00 -0.02 0.00 0.00 41.12 42.04 3h6o n ASP 288 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h6o n GLY 289 N 1.37 -1.29 2.93 0.44 0.00 -1.09 -4.14 105.19 103.41 3h6o n GLY 289 Ca 0.03 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.97 3h6o n GLY 289 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h6o s ILE 290 N -2.46 0.01 -0.17 -0.61 -1.09 -0.21 -2.05 121.20 114.62 3h6o s ILE 290 Ca 0.00 -0.06 -0.02 0.00 -2.23 0.00 0.00 60.65 58.34 3h6o s ILE 290 Cb 0.00 -0.10 -0.01 0.00 -1.58 0.00 0.00 42.46 40.77 3h6o s ILE 290 CO 0.00 -0.03 -0.10 -0.32 -1.23 0.00 0.00 174.94 173.26 3h6o s MET 291 N -0.08 3.38 -0.97 2.79 -2.45 0.55 0.01 119.30 122.52 3h6o s MET 291 Ca -0.01 -0.66 -0.24 0.00 -1.25 0.00 0.00 55.69 53.53 3h6o s MET 291 Cb -0.01 -2.79 0.05 0.00 1.25 0.00 0.00 34.83 33.33 3h6o s MET 291 CO 0.00 0.04 1.42 0.08 1.05 0.00 0.00 175.02 177.60 3h6o s VAL 292 N 0.82 3.90 -1.40 10.11 1.01 0.17 -1.93 120.40 133.08 3h6o s VAL 292 Ca -0.03 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.24 3h6o s VAL 292 Cb -0.15 -5.03 0.08 0.00 0.00 0.00 0.00 36.38 31.27 3h6o s VAL 292 CO 0.01 -1.92 2.10 0.00 0.00 0.00 0.00 175.10 175.29 3h6o n ALA 293 N 8.94 5.34 0.16 5.51 0.00 -0.99 -2.61 120.51 136.86 3h6o n ALA 293 Ca 0.28 -3.99 0.06 0.00 0.00 0.00 0.00 53.44 49.79 3h6o n ALA 293 Cb 0.51 -3.40 0.53 0.00 0.00 0.00 0.00 19.45 17.09 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 6.06 0.20 0.08 0.00 3.08 -1.81 -1.93 114.38 120.06 3h6o h ARG 294 Ca 0.52 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.55 3h6o h ARG 294 Cb 0.66 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 3h6o h ARG 294 CO 1.79 0.17 -0.22 0.78 -1.07 0.00 0.00 179.97 181.42 3h6o h GLY 295 N 0.31 -1.14 1.25 0.04 0.00 -1.86 0.14 103.07 101.80 3h6o h GLY 295 Ca 0.05 0.54 -0.16 0.00 0.00 0.00 0.00 47.33 47.77 3h6o h GLY 295 CO -0.01 -0.37 -0.44 -0.55 0.00 0.00 0.00 176.54 175.17 3h6o h ASP 296 N -0.34 0.88 -0.77 0.19 3.45 -1.86 -2.84 116.42 115.14 3h6o h ASP 296 Ca -0.01 -0.42 0.17 0.00 0.43 0.00 0.00 57.03 57.20 3h6o h ASP 296 Cb 0.33 -0.25 -0.12 0.00 -0.56 0.00 0.00 39.33 38.73 3h6o h ASP 296 CO -0.10 1.19 0.18 0.25 -1.57 0.00 0.00 179.24 179.19 3h6o h LEU 297 N 0.65 -0.01 -0.40 1.55 5.85 -1.22 0.47 115.31 122.21 3h6o h LEU 297 Ca 0.04 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.92 3h6o h LEU 297 Cb 1.02 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3h6o h LEU 297 CO 0.10 -0.06 0.00 0.61 -0.34 0.00 0.00 178.44 178.75 3h6o n GLY 298 N -1.36 -1.29 0.11 3.75 0.00 0.48 -0.93 105.19 105.95 3h6o n GLY 298 Ca 0.15 0.03 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 3h6o n GLY 298 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h6o h ILE 299 N 0.00 1.23 0.13 -0.61 2.04 -0.81 -3.38 117.51 116.11 3h6o h ILE 299 Ca 0.00 -2.87 -0.29 0.00 1.00 0.00 0.00 64.86 62.70 3h6o h ILE 299 Cb 0.40 2.79 0.03 0.00 -0.74 0.00 0.00 36.82 39.30 3h6o h ILE 299 CO 0.00 0.83 -1.21 -0.33 0.00 0.00 0.00 178.15 177.44 3h6o h GLU 300 N 0.07 0.59 -6.38 2.37 4.39 -0.66 -3.46 114.58 111.49 3h6o h GLU 300 Ca -0.21 -0.81 -0.61 0.00 0.34 0.00 0.00 59.36 58.06 3h6o h GLU 300 Cb 2.00 0.27 -0.14 0.00 -0.10 0.00 0.00 28.75 30.78 3h6o h GLU 300 CO 0.17 1.37 -0.72 0.96 -1.16 0.00 0.00 179.01 179.62 3h6o s ILE 301 N -2.92 3.04 0.07 3.13 -4.36 -0.10 -4.63 121.20 115.42 3h6o s ILE 301 Ca -0.10 -1.87 -0.37 0.00 -0.26 0.00 0.00 60.65 58.05 3h6o s ILE 301 Cb 0.05 -2.54 -0.17 0.00 1.25 0.00 0.00 42.46 41.05 3h6o s ILE 301 CO 0.92 -0.21 1.37 -2.65 0.24 0.00 0.00 174.94 174.62 3h6o n PRO 302 N -0.23 1.18 -0.34 0.37 -0.02 -1.26 -4.51 135.00 130.19 3h6o n PRO 302 Ca -0.09 0.43 0.22 0.00 -2.02 0.00 0.00 63.50 62.04 3h6o n PRO 302 Cb 0.57 -2.08 0.47 0.00 -0.02 0.00 0.00 33.50 32.44 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 4.77 2.08 0.00 3.55 0.00 -1.93 0.58 119.26 128.31 3h6o h ALA 303 Ca -0.48 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3h6o h ALA 303 Cb 1.33 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3h6o h ALA 303 CO 0.79 -0.55 0.00 -0.85 0.00 0.00 0.00 179.25 178.64 3h6o n GLU 304 N -4.77 0.08 0.00 0.00 0.00 -1.26 -2.59 120.64 112.10 3h6o n GLU 304 Ca 0.28 0.23 0.10 0.00 0.00 0.00 0.00 57.16 57.76 3h6o n GLU 304 Cb 0.89 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.77 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 -1.40 1.01 -0.24 3.44 5.02 0.19 -4.60 118.16 121.57 3h6o n LYS 305 Ca 0.04 -0.46 -0.01 0.00 -2.02 0.00 0.00 58.31 55.86 3h6o n LYS 305 Cb 0.13 -1.41 0.19 0.00 -0.02 0.00 0.00 35.03 33.92 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 1.10 1.22 -0.08 -0.18 2.07 -1.57 -1.36 116.25 117.45 3h6o h VAL 306 Ca 0.00 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 3h6o h VAL 306 Cb 0.57 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 3h6o h VAL 306 CO 0.00 0.23 -0.07 2.19 0.02 0.00 0.00 177.57 179.94 3h6o h PHE 307 N 1.07 0.12 0.08 1.57 -5.15 -1.81 0.27 116.94 113.09 3h6o h PHE 307 Ca 0.28 -0.01 -0.00 0.00 -0.20 0.00 0.00 57.97 58.04 3h6o h PHE 307 Cb -0.04 -0.04 0.00 0.00 0.22 0.00 0.00 35.95 36.10 3h6o h PHE 307 CO 0.00 0.19 -0.04 -0.07 -2.00 0.00 0.00 178.31 176.40 3h6o h LEU 308 N 0.12 -0.09 -0.98 2.10 3.38 -1.57 -1.03 115.31 117.24 3h6o h LEU 308 Ca 0.03 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.71 3h6o h LEU 308 Cb 0.20 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.92 3h6o h LEU 308 CO 0.01 0.29 0.64 0.00 0.09 0.00 0.00 178.44 179.47 3h6o h ALA 309 N 0.40 1.32 0.33 1.53 0.00 -1.24 -1.14 119.26 120.46 3h6o h ALA 309 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3h6o h ALA 309 Cb 0.41 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3h6o h ALA 309 CO 0.02 0.51 -0.16 0.37 0.00 0.00 0.00 179.25 179.99 3h6o h GLN 310 N 1.22 -0.42 -0.22 0.00 4.15 -0.88 -2.04 115.11 116.93 3h6o h GLN 310 Ca 0.40 0.03 -0.09 0.00 0.77 0.00 0.00 58.65 59.76 3h6o h GLN 310 Cb 0.04 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 3h6o h GLN 310 CO -0.14 -0.25 -0.26 0.87 -1.93 0.00 0.00 178.83 177.12 3h6o h LYS 311 N -0.49 0.41 -0.21 1.69 1.57 -1.07 -0.91 116.57 117.56 3h6o h LYS 311 Ca -0.04 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 3h6o h LYS 311 Cb 0.37 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3h6o h LYS 311 CO 0.07 0.65 0.03 1.98 -0.57 0.00 0.00 179.45 181.62 3h6o h MET 312 N 0.37 0.36 -0.30 3.15 4.05 -1.21 -1.10 114.93 120.24 3h6o h MET 312 Ca 0.05 -0.10 -0.15 0.00 -0.28 0.00 0.00 59.70 59.23 3h6o h MET 312 Cb 0.66 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.42 3h6o h MET 312 CO 0.05 0.50 -0.40 0.52 0.23 0.00 0.00 176.91 177.82 3h6o h MET 313 N 0.15 0.80 0.21 0.39 2.86 -1.16 -0.89 114.93 117.31 3h6o h MET 313 Ca 0.06 -0.46 -0.01 0.00 -2.06 0.00 0.00 59.70 57.23 3h6o h MET 313 Cb 0.32 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3h6o h MET 313 CO 0.00 1.09 -0.11 0.82 1.06 0.00 0.00 176.91 179.78 3h6o h ILE 314 N 0.57 0.78 -0.59 -1.22 2.04 -1.18 -0.59 117.51 117.32 3h6o h ILE 314 Ca 0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.98 3h6o h ILE 314 Cb 0.99 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 37.79 3h6o h ILE 314 CO 0.09 0.00 0.25 1.23 0.00 0.00 0.00 178.15 179.72 3h6o h GLY 315 N -0.29 0.84 1.68 5.37 0.00 -1.15 0.19 103.07 109.71 3h6o h GLY 315 Ca -0.03 -0.14 -0.12 0.00 0.00 0.00 0.00 47.33 47.04 3h6o h GLY 315 CO 0.05 0.02 -0.40 3.21 0.00 0.00 0.00 176.54 179.41 3h6o h ARG 316 N 0.45 0.35 -0.17 4.80 3.08 -0.97 0.27 114.38 122.20 3h6o h ARG 316 Ca 0.29 -0.17 -0.22 0.00 0.07 0.00 0.00 59.98 59.95 3h6o h ARG 316 Cb 0.32 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.37 3h6o h ARG 316 CO -0.27 0.70 -0.75 0.00 -1.07 0.00 0.00 179.97 178.59 3h6o h ASN 318 N 0.54 0.66 -0.16 0.00 -0.26 -0.51 -0.04 115.58 115.81 3h6o h ASN 318 Ca -0.04 0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.65 3h6o h ASN 318 Cb 1.37 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 38.49 3h6o h ASN 318 CO 0.15 0.44 -0.07 -0.09 -1.06 0.00 0.00 177.43 176.80 3h6o h ARG 319 N 0.79 0.48 0.00 0.81 2.43 -0.78 -3.17 114.38 114.94 3h6o h ARG 319 Ca 0.29 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3h6o h ARG 319 Cb 0.10 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3h6o h ARG 319 CO -0.14 0.56 -0.61 0.00 -1.51 0.00 0.00 179.97 178.27 3h6o n ALA 320 N -2.48 3.48 -1.54 2.80 0.00 -0.53 -4.95 120.51 117.29 3h6o n ALA 320 Ca 0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 53.44 53.04 3h6o n ALA 320 Cb 0.28 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 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 1.46 0.55 3.64 0.00 0.00 -0.13 -5.05 105.19 105.66 3h6o n GLY 321 Ca 0.05 -0.74 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 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 -3.20 2.75 0.31 1.61 1.02 -0.62 -4.95 119.74 116.66 3h6o s LYS 322 Ca 0.00 -0.59 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 3h6o s LYS 322 Cb 0.00 -2.63 -0.12 0.00 -0.52 0.00 0.00 37.83 34.56 3h6o s LYS 322 CO 0.00 0.64 1.44 -2.30 -0.92 0.00 0.00 175.35 174.22 3h6o n PRO 323 N 1.76 2.36 -4.76 -1.68 -0.02 -1.26 -4.37 135.00 127.03 3h6o n PRO 323 Ca -0.16 0.84 -0.26 0.00 -2.02 0.00 0.00 63.50 61.89 3h6o n PRO 323 Cb 0.53 -2.52 -0.16 0.00 -0.02 0.00 0.00 33.50 31.32 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 -0.52 1.38 -0.17 -1.45 0.11 -1.26 -1.04 120.40 117.44 3h6o s VAL 324 Ca 0.61 -0.64 -0.04 0.00 -2.93 0.00 0.00 61.98 58.98 3h6o s VAL 324 Cb -0.55 -1.22 -0.03 0.00 -1.53 0.00 0.00 36.38 33.05 3h6o s VAL 324 CO 0.55 0.41 -0.02 -0.63 -3.33 0.00 0.00 175.10 172.08 3h6o s ILE 325 N 0.43 3.91 -0.16 7.04 1.01 0.10 -1.08 121.20 132.46 3h6o s ILE 325 Ca -0.12 -0.34 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 3h6o s ILE 325 Cb -0.15 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 3h6o s ILE 325 CO 0.04 0.47 0.44 0.00 0.00 0.00 0.00 174.94 175.89 3h6o s ALA 327 N 0.98 0.93 0.00 0.00 0.00 -1.07 -2.02 121.76 120.58 3h6o s ALA 327 Ca 0.23 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.42 3h6o s ALA 327 Cb -0.15 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.87 3h6o s ALA 327 CO 0.09 0.14 0.00 2.41 0.00 0.00 0.00 175.76 178.39 3h6o n THR 328 N 1.81 -0.60 -2.02 0.00 -1.04 -1.26 -3.39 114.28 107.78 3h6o n THR 328 Ca -0.19 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.65 3h6o n THR 328 Cb 0.55 -0.69 -0.03 0.00 -1.82 0.00 0.00 70.33 68.33 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 2.10 -1.28 -0.07 -2.82 6.02 -1.26 -4.77 117.38 115.30 3h6o n GLN 329 Ca 0.00 0.92 -0.07 0.00 -0.01 0.00 0.00 57.00 57.84 3h6o n GLN 329 Cb 0.00 -5.27 0.11 0.00 1.02 0.00 0.00 30.24 26.10 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 0.74 -0.70 -1.09 2.86 -1.89 -3.18 114.93 111.66 3h6o h MET 330 Ca -0.38 -0.29 -0.41 0.00 -2.06 0.00 0.00 59.70 56.56 3h6o h MET 330 Cb 1.22 -0.04 -0.41 0.00 0.06 0.00 0.00 31.60 32.43 3h6o h MET 330 CO 0.48 0.89 -0.97 1.28 1.06 0.00 0.00 176.91 179.66 3h6o n LEU 331 N -4.12 3.22 -0.32 1.22 4.77 -1.26 -4.58 117.00 115.94 3h6o n LEU 331 Ca 0.00 -3.98 0.18 0.00 -0.03 0.00 0.00 56.01 52.18 3h6o n LEU 331 Cb 0.43 0.06 0.43 0.00 -2.33 0.00 0.00 43.42 42.00 3h6o n LEU 331 CO 0.44 1.62 1.21 -0.08 -1.33 0.00 0.00 177.39 179.25 3h6o h GLU 332 N 2.46 0.54 0.00 3.23 4.57 -1.95 -0.91 114.58 122.53 3h6o h GLU 332 Ca 0.11 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.24 3h6o h GLU 332 Cb 1.35 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.81 3h6o h GLU 332 CO 0.50 0.36 -0.08 0.66 -1.18 0.00 0.00 179.01 179.27 3h6o h SER 333 N 0.56 0.00 0.00 1.04 4.64 -1.92 -2.38 113.55 115.48 3h6o h SER 333 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 3h6o h SER 333 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3h6o h SER 333 CO -0.31 0.08 0.00 0.23 -0.87 0.00 0.00 176.83 175.96 3h6o n MET 334 N -3.38 0.79 -0.26 4.77 2.81 -0.34 -1.16 117.12 120.35 3h6o n MET 334 Ca -0.01 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.84 3h6o n MET 334 Cb 0.24 -1.49 0.12 0.00 -0.71 0.00 0.00 33.22 31.38 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 1.25 0.00 2.02 2.04 -1.59 -3.33 117.51 117.89 3h6o h ILE 335 Ca 0.00 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.13 3h6o h ILE 335 Cb 0.00 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 3h6o h ILE 335 CO 0.00 0.30 -1.20 0.29 0.00 0.00 0.00 178.15 177.55 3h6o n LYS 336 N -4.30 0.96 -4.94 2.37 4.01 -0.99 0.84 118.16 116.11 3h6o n LYS 336 Ca 0.07 -0.06 -0.30 0.00 -0.51 0.00 0.00 58.31 57.51 3h6o n LYS 336 Cb 0.16 -1.14 -0.15 0.00 -0.51 0.00 0.00 35.03 33.39 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 -2.42 1.85 0.00 1.97 3.01 -0.31 -4.91 119.74 118.93 3h6o s LYS 337 Ca -0.02 -1.08 0.24 0.00 -1.01 0.00 0.00 55.97 54.09 3h6o s LYS 337 Cb 0.05 -2.00 1.34 0.00 -1.01 0.00 0.00 37.83 36.22 3h6o s LYS 337 CO 0.33 0.52 1.78 -0.35 0.51 0.00 0.00 175.35 178.14 3h6o n PRO 338 N 1.84 0.62 -3.89 -1.68 -0.04 -1.26 -4.07 135.00 126.52 3h6o n PRO 338 Ca -0.17 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.21 3h6o n PRO 338 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 3h6o n PRO 338 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3h6o s ARG 339 N -2.17 0.44 0.57 0.54 0.52 -1.26 -4.95 118.95 112.64 3h6o s ARG 339 Ca 0.32 -0.41 -0.02 0.00 -0.52 0.00 0.00 55.73 55.10 3h6o s ARG 339 Cb 0.16 0.18 0.03 0.00 0.52 0.00 0.00 34.95 35.84 3h6o s ARG 339 CO 0.30 -0.10 0.83 -1.25 0.02 0.00 0.00 175.30 175.10 3h6o s PRO 340 N -1.32 2.62 0.84 3.54 0.04 -1.26 -4.62 135.00 134.83 3h6o s PRO 340 Ca -0.14 -0.49 -0.12 0.00 0.04 0.00 0.00 61.00 60.29 3h6o s PRO 340 Cb -0.08 -2.40 0.10 0.00 0.04 0.00 0.00 34.50 32.17 3h6o s PRO 340 CO 0.01 -0.75 1.14 0.95 0.04 0.00 0.00 177.00 178.39 3h6o s THR 341 N -2.87 2.30 0.27 1.26 -4.23 -1.26 -4.92 115.64 106.20 3h6o s THR 341 Ca 0.56 0.10 0.07 0.00 -1.18 0.00 0.00 61.69 61.23 3h6o s THR 341 Cb -0.10 -2.94 -0.01 0.00 1.34 0.00 0.00 72.50 70.78 3h6o s THR 341 CO 0.41 -0.13 1.63 0.03 -0.54 0.00 0.00 174.62 176.02 3h6o h ARG 342 N -1.23 0.17 0.00 3.99 2.47 -2.00 -2.31 114.38 115.47 3h6o h ARG 342 Ca -0.48 -0.11 -0.07 0.00 -1.26 0.00 0.00 59.98 58.07 3h6o h ARG 342 Cb 1.31 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.64 3h6o h ARG 342 CO 0.63 0.67 -0.31 0.00 0.56 0.00 0.00 179.97 181.52 3h6o h ALA 343 N 1.31 1.28 -0.05 0.04 0.00 -1.99 -2.27 119.26 117.59 3h6o h ALA 343 Ca 0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 3h6o h ALA 343 Cb 0.99 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.74 3h6o h ALA 343 CO 0.08 0.39 -0.42 0.93 0.00 0.00 0.00 179.25 180.23 3h6o h GLU 344 N 0.00 0.38 0.00 0.00 5.08 -1.67 -0.77 114.58 117.60 3h6o h GLU 344 Ca -0.00 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 3h6o h GLU 344 Cb 0.63 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 3h6o h GLU 344 CO 0.04 0.99 -0.29 0.78 -1.00 0.00 0.00 179.01 179.53 3h6o h GLY 345 N -0.12 0.00 0.89 -3.84 0.00 -1.51 -2.46 103.07 96.03 3h6o h GLY 345 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.26 3h6o h GLY 345 CO 0.09 0.00 -0.29 0.23 0.00 0.00 0.00 176.54 176.56 3h6o h SER 346 N 0.00 -0.70 -0.96 0.19 0.87 -1.36 -2.75 113.55 108.84 3h6o h SER 346 Ca -0.00 -0.01 0.13 0.00 -1.23 0.00 0.00 61.79 60.67 3h6o h SER 346 Cb 0.73 0.18 -0.08 0.00 -0.44 0.00 0.00 62.40 62.79 3h6o h SER 346 CO 0.04 -0.42 0.61 -0.78 -0.53 0.00 0.00 176.83 175.75 3h6o h ASP 347 N -0.94 0.82 -0.01 6.23 3.58 -0.91 0.29 116.42 125.48 3h6o h ASP 347 Ca -0.08 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.41 3h6o h ASP 347 Cb 0.67 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 3h6o h ASP 347 CO 0.14 0.42 -0.01 0.58 -2.88 0.00 0.00 179.24 177.49 3h6o h VAL 348 N 0.87 1.39 -0.46 2.25 2.07 -1.50 -1.02 116.25 119.85 3h6o h VAL 348 Ca 0.48 -1.17 0.07 0.00 0.82 0.00 0.00 66.70 66.90 3h6o h VAL 348 Cb 0.60 2.16 -0.06 0.00 -1.52 0.00 0.00 31.29 32.47 3h6o h VAL 348 CO -0.25 0.31 0.14 0.00 0.02 0.00 0.00 177.57 177.79 3h6o h ALA 349 N 0.51 0.55 -0.18 1.67 0.00 -1.10 -2.24 119.26 118.48 3h6o h ALA 349 Ca 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 3h6o h ALA 349 Cb 0.51 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3h6o h ALA 349 CO 0.00 -0.25 -0.35 -0.91 0.00 0.00 0.00 179.25 177.74 3h6o h ASN 350 N 0.30 0.39 -0.87 0.00 2.35 -0.97 0.61 115.58 117.40 3h6o h ASN 350 Ca 0.22 -0.15 0.05 0.00 -0.55 0.00 0.00 56.30 55.86 3h6o h ASN 350 Cb 0.25 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.45 3h6o h ASN 350 CO -0.25 0.72 0.55 0.00 -1.65 0.00 0.00 177.43 176.81 3h6o h ALA 351 N 1.30 1.17 -0.09 -0.83 0.00 -0.95 0.42 119.26 120.27 3h6o h ALA 351 Ca 0.04 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3h6o h ALA 351 Cb 0.77 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.30 3h6o h ALA 351 CO 0.06 0.36 -0.44 0.28 0.00 0.00 0.00 179.25 179.51 3h6o h VAL 352 N 1.04 1.38 -0.67 0.00 2.07 -0.74 -2.04 116.25 117.30 3h6o h VAL 352 Ca 0.36 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 66.09 3h6o h VAL 352 Cb 0.08 2.23 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 3h6o h VAL 352 CO -0.14 0.53 0.42 -0.07 0.02 0.00 0.00 177.57 178.33 3h6o h LEU 353 N 0.03 0.78 -1.24 2.57 3.38 -0.80 -1.81 115.31 118.23 3h6o h LEU 353 Ca -0.03 -0.03 0.08 0.00 0.09 0.00 0.00 57.88 57.99 3h6o h LEU 353 Cb 1.09 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 3h6o h LEU 353 CO 0.09 0.59 0.55 0.44 0.09 0.00 0.00 178.44 180.20 3h6o h ASP 354 N 0.92 0.79 0.00 -0.43 3.32 -0.09 -3.47 116.42 117.46 3h6o h ASP 354 Ca 0.24 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3h6o h ASP 354 Cb -0.07 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.32 3h6o h ASP 354 CO -0.05 0.49 0.00 0.61 -1.72 0.00 0.00 179.24 178.57 3h6o n GLY 355 N -1.42 1.73 3.75 2.75 0.00 -0.68 -4.68 105.19 106.65 3h6o n GLY 355 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.80 3.62 0.23 4.61 0.00 -0.78 -4.89 121.76 122.75 3h6o s ALA 356 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.32 3h6o s ALA 356 Cb 0.00 -3.56 0.24 0.00 0.00 0.00 0.00 23.12 19.80 3h6o s ALA 356 CO 0.00 -0.77 1.59 -0.44 0.00 0.00 0.00 175.76 176.14 3h6o h ASP 357 N 4.78 0.51 -4.68 0.00 3.32 -1.40 -3.46 116.42 115.48 3h6o h ASP 357 Ca -0.47 -0.24 -0.16 0.00 0.02 0.00 0.00 57.03 56.18 3h6o h ASP 357 Cb 1.22 -0.14 -0.22 0.00 0.22 0.00 0.00 39.33 40.40 3h6o h ASP 357 CO 0.76 0.89 -0.57 0.00 -1.72 0.00 0.00 179.24 178.60 3h6o s ILE 359 N -1.05 2.94 0.05 0.00 -4.36 -0.38 -1.82 121.20 116.59 3h6o s ILE 359 Ca -0.11 -1.96 0.03 0.00 -0.26 0.00 0.00 60.65 58.34 3h6o s ILE 359 Cb -0.07 -2.79 -0.03 0.00 1.25 0.00 0.00 42.46 40.83 3h6o s ILE 359 CO 0.01 -0.28 -0.09 -0.32 0.24 0.00 0.00 174.94 174.50 3h6o s MET 360 N -3.70 0.62 -0.02 0.37 1.75 -0.86 -1.78 119.30 115.69 3h6o s MET 360 Ca 0.34 -0.86 0.07 0.00 -1.25 0.00 0.00 55.69 53.98 3h6o s MET 360 Cb -0.03 -0.38 -0.02 0.00 2.84 0.00 0.00 34.83 37.24 3h6o s MET 360 CO 0.20 0.07 -0.23 -0.51 -0.65 0.00 0.00 175.02 173.89 3h6o s LEU 361 N -1.78 2.04 0.00 4.11 1.43 -0.34 -4.45 118.68 119.69 3h6o s LEU 361 Ca -0.06 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.62 3h6o s LEU 361 Cb -0.08 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.93 3h6o s LEU 361 CO 0.00 0.29 0.00 -1.20 0.23 0.00 0.00 176.35 175.67 3h6o n SER 362 N 2.52 0.00 0.00 2.29 7.64 -1.26 -1.57 113.62 123.23 3h6o n SER 362 Ca -0.16 0.00 0.23 0.00 1.01 0.00 0.00 58.87 59.95 3h6o n SER 362 Cb 0.52 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 64.43 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 1.15 0.23 0.00 -1.96 -0.33 103.07 102.16 3h6o h GLY 363 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 3h6o h GLY 363 CO 0.00 0.00 0.35 0.83 0.00 0.00 0.00 176.54 177.72 3h6o h GLU 364 N 0.00 0.30 0.00 4.80 3.07 -1.91 -0.52 114.58 120.31 3h6o h GLU 364 Ca 0.27 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 59.05 3h6o h GLU 364 Cb 1.38 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.21 3h6o h GLU 364 CO -0.00 0.20 -1.35 0.25 -1.40 0.00 0.00 179.01 176.71 3h6o n THR 365 N -4.46 0.24 -0.07 1.13 -2.24 -0.52 -3.83 114.28 104.54 3h6o n THR 365 Ca 0.08 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.53 3h6o n THR 365 Cb 0.37 -0.39 -0.06 0.00 -2.10 0.00 0.00 70.33 68.14 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 0.38 0.28 0.00 6.98 0.00 -0.36 -3.34 119.26 123.20 3h6o h ALA 366 Ca -0.10 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3h6o h ALA 366 Cb 0.95 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3h6o h ALA 366 CO 0.01 0.19 0.00 0.36 0.00 0.00 0.00 179.25 179.81 3h6o n LYS 367 N -4.48 0.00 -1.74 0.00 2.85 -0.68 -0.79 118.16 113.33 3h6o n LYS 367 Ca -0.05 -0.04 -0.30 0.00 -1.05 0.00 0.00 58.31 56.87 3h6o n LYS 367 Cb 0.39 -0.49 0.18 0.00 -0.65 0.00 0.00 35.03 34.45 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 0.00 1.70 0.17 2.58 0.00 -0.29 -4.77 107.32 106.70 3h6o s GLY 368 Ca 0.00 -1.00 0.25 0.00 0.00 0.00 0.00 44.72 43.97 3h6o s GLY 368 CO 0.00 -0.28 1.61 1.22 0.00 0.00 0.00 173.10 175.65 3h6o n ASP 369 N -3.87 0.76 -3.18 1.64 8.00 0.25 -4.42 116.55 115.72 3h6o n ASP 369 Ca 0.13 0.40 -0.19 0.00 0.71 0.00 0.00 54.79 55.83 3h6o n ASP 369 Cb 0.60 -0.43 -0.04 0.00 -0.02 0.00 0.00 41.12 41.23 3h6o n ASP 369 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3h6o n TYR 370 N -2.19 0.23 -0.11 1.24 4.01 -1.25 -4.97 117.16 114.11 3h6o n TYR 370 Ca 0.05 -3.79 -0.13 0.00 -0.16 0.00 0.00 57.90 53.87 3h6o n TYR 370 Cb 0.43 -0.41 -0.03 0.00 -0.31 0.00 0.00 39.34 39.02 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 3.15 0.78 -0.53 -0.72 0.13 -1.77 -1.86 132.00 131.18 3h6o h PRO 371 Ca 0.10 -0.38 -0.07 0.00 -0.87 0.00 0.00 66.00 64.78 3h6o h PRO 371 Cb 0.94 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 3h6o h PRO 371 CO 0.51 1.01 0.04 -0.07 -0.23 0.00 0.00 178.00 179.25 3h6o h LEU 372 N 0.56 0.83 -0.67 1.56 3.38 -1.93 -2.13 115.31 116.90 3h6o h LEU 372 Ca 0.07 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3h6o h LEU 372 Cb 0.82 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 3h6o h LEU 372 CO 0.07 0.87 0.16 -0.33 0.09 0.00 0.00 178.44 179.30 3h6o h GLU 373 N 0.81 1.08 -0.56 1.13 3.07 -1.93 -0.82 114.58 117.36 3h6o h GLU 373 Ca 0.16 -0.26 -0.02 0.00 -0.50 0.00 0.00 59.36 58.74 3h6o h GLU 373 Cb 0.43 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 3h6o h GLU 373 CO 0.02 0.96 0.25 0.00 -1.40 0.00 0.00 179.01 178.84 3h6o h ALA 374 N 1.07 0.72 0.11 3.43 0.00 -1.06 -0.98 119.26 122.56 3h6o h ALA 374 Ca 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3h6o h ALA 374 Cb 0.37 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3h6o h ALA 374 CO 0.00 0.30 -0.05 0.28 0.00 0.00 0.00 179.25 179.78 3h6o h VAL 375 N 0.76 0.92 -0.50 0.00 2.07 -1.17 -2.29 116.25 116.03 3h6o h VAL 375 Ca 0.19 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.61 3h6o h VAL 375 Cb 0.15 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3h6o h VAL 375 CO -0.02 0.03 0.34 0.03 0.02 0.00 0.00 177.57 177.97 3h6o h ARG 376 N -0.22 0.54 -0.24 1.57 3.08 -1.00 -1.96 114.38 116.15 3h6o h ARG 376 Ca -0.02 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 3h6o h ARG 376 Cb 0.17 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3h6o h ARG 376 CO 0.03 0.36 -0.44 1.98 -1.07 0.00 0.00 179.97 180.82 3h6o h MET 377 N 0.56 0.73 -0.52 0.04 4.05 -0.93 -1.97 114.93 116.89 3h6o h MET 377 Ca 0.20 -0.46 -0.02 0.00 -0.28 0.00 0.00 59.70 59.14 3h6o h MET 377 Cb 0.12 0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 3h6o h MET 377 CO -0.05 1.09 0.24 1.96 0.23 0.00 0.00 176.91 180.37 3h6o h GLN 378 N 0.46 0.74 -0.44 0.39 4.20 -1.10 -1.76 115.11 117.61 3h6o h GLN 378 Ca 0.01 -0.09 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 3h6o h GLN 378 Cb 1.05 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.67 3h6o h GLN 378 CO 0.10 0.59 0.12 1.25 -0.67 0.00 0.00 178.83 180.22 3h6o h HIS 379 N 0.74 0.72 -0.18 2.96 2.76 -1.20 -1.84 115.15 119.11 3h6o h HIS 379 Ca 0.18 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 58.25 3h6o h HIS 379 Cb 0.10 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 3h6o h HIS 379 CO 0.01 0.67 0.03 -0.07 -1.30 0.00 0.00 177.93 177.27 3h6o h LEU 380 N 0.57 0.29 -0.15 0.26 3.38 -0.96 -2.83 115.31 115.88 3h6o h LEU 380 Ca 0.14 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 3h6o h LEU 380 Cb 0.30 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3h6o h LEU 380 CO -0.00 0.47 -0.11 0.40 0.09 0.00 0.00 178.44 179.29 3h6o h ILE 381 N 0.10 1.33 -0.74 1.22 2.04 -1.37 -2.14 117.51 117.95 3h6o h ILE 381 Ca 0.06 -1.21 0.12 0.00 1.00 0.00 0.00 64.86 64.83 3h6o h ILE 381 Cb 0.30 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 38.13 3h6o h ILE 381 CO 0.00 0.35 0.49 0.00 0.00 0.00 0.00 178.15 179.00 3h6o h ALA 382 N 0.64 1.97 -0.03 1.87 0.00 -1.38 0.13 119.26 122.45 3h6o h ALA 382 Ca 0.03 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 3h6o h ALA 382 Cb 0.61 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.31 3h6o h ALA 382 CO 0.03 -0.16 -0.64 -0.09 0.00 0.00 0.00 179.25 178.39 3h6o h ARG 383 N 0.52 0.49 -0.17 0.00 2.43 -1.30 -0.86 114.38 115.49 3h6o h ARG 383 Ca 0.36 -0.49 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 3h6o h ARG 383 Cb 0.67 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 3h6o h ARG 383 CO -0.12 1.13 0.11 0.93 -1.51 0.00 0.00 179.97 180.50 3h6o h GLU 384 N 0.05 0.22 -0.36 0.20 4.39 -0.75 -3.06 114.58 115.26 3h6o h GLU 384 Ca -0.07 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 3h6o h GLU 384 Cb 1.33 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.91 3h6o h GLU 384 CO 0.13 0.14 -0.05 0.00 -1.16 0.00 0.00 179.01 178.07 3h6o h ALA 385 N 1.07 1.25 -0.70 3.43 0.00 -0.71 -2.52 119.26 121.08 3h6o h ALA 385 Ca 0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3h6o h ALA 385 Cb -0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3h6o h ALA 385 CO -0.02 0.50 0.27 0.93 0.00 0.00 0.00 179.25 180.92 3h6o h GLU 386 N 0.55 1.04 -0.24 0.00 5.08 -1.11 -1.73 114.58 118.17 3h6o h GLU 386 Ca 0.11 -0.18 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 3h6o h GLU 386 Cb 0.42 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 3h6o h GLU 386 CO 0.02 0.85 -0.14 0.00 -1.00 0.00 0.00 179.01 178.74 3h6o h ALA 387 N 1.28 1.32 0.00 3.43 0.00 -1.36 -3.06 119.26 120.87 3h6o h ALA 387 Ca 0.24 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h6o h ALA 387 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h6o h ALA 387 CO -0.02 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.69 3h6o n ALA 388 N -2.48 2.19 -1.77 0.00 0.00 -0.68 -4.62 120.51 113.16 3h6o n ALA 388 Ca 0.00 -0.11 -0.37 0.00 0.00 0.00 0.00 53.44 52.96 3h6o n ALA 388 Cb 0.32 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 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 -2.70 3.03 -1.21 0.00 1.01 -1.04 -4.92 121.20 115.37 3h6o s ILE 389 Ca 0.20 0.79 -0.11 0.00 0.00 0.00 0.00 60.65 61.53 3h6o s ILE 389 Cb 0.16 -3.41 0.19 0.00 0.01 0.00 0.00 42.46 39.41 3h6o s ILE 389 CO 0.39 0.01 1.55 0.00 0.00 0.00 0.00 174.94 176.89 3h6o n TYR 390 N -0.39 4.10 -0.00 3.97 9.36 -1.26 -4.81 117.16 128.13 3h6o n TYR 390 Ca 0.07 -3.17 0.09 0.00 3.32 0.00 0.00 57.90 58.21 3h6o n TYR 390 Cb 0.47 -1.97 0.50 0.00 -0.63 0.00 0.00 39.34 37.71 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 6.46 0.39 -0.14 2.98 3.86 -1.91 -2.17 115.15 124.62 3h6o h HIS 391 Ca 0.32 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.58 3h6o h HIS 391 Cb 0.77 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 29.05 3h6o h HIS 391 CO 1.10 0.22 -0.20 1.25 0.86 0.00 0.00 177.93 181.16 3h6o h LEU 392 N 0.40 -0.63 0.10 2.43 5.85 -1.87 0.99 115.31 122.57 3h6o h LEU 392 Ca 0.19 0.11 -0.26 0.00 0.84 0.00 0.00 57.88 58.75 3h6o h LEU 392 Cb 0.25 0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 3h6o h LEU 392 CO -0.05 -0.25 -1.23 -0.61 -0.34 0.00 0.00 178.44 175.97 3h6o h GLN 393 N -0.25 0.21 -0.07 1.25 4.15 -1.87 -2.96 115.11 115.56 3h6o h GLN 393 Ca 0.10 -0.35 0.00 0.00 0.77 0.00 0.00 58.65 59.17 3h6o h GLN 393 Cb 0.40 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.22 3h6o h GLN 393 CO -0.29 1.15 0.04 1.25 -1.93 0.00 0.00 178.83 179.06 3h6o h LEU 394 N 0.06 0.08 -0.50 -2.39 5.85 -1.16 0.34 115.31 117.58 3h6o h LEU 394 Ca -0.12 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.50 3h6o h LEU 394 Cb 1.93 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.93 3h6o h LEU 394 CO 0.18 0.07 -0.02 0.15 -0.34 0.00 0.00 178.44 178.48 3h6o h PHE 395 N 0.08 0.98 -0.42 1.25 3.04 -0.93 -1.65 116.94 119.29 3h6o h PHE 395 Ca 0.02 -0.18 0.07 0.00 3.98 0.00 0.00 57.97 61.87 3h6o h PHE 395 Cb 0.00 -0.25 -0.06 0.00 2.56 0.00 0.00 35.95 38.20 3h6o h PHE 395 CO -0.07 0.92 0.05 0.93 -2.02 0.00 0.00 178.31 178.12 3h6o h GLU 396 N 0.76 0.16 -0.07 1.11 5.08 -1.32 -2.26 114.58 118.04 3h6o h GLU 396 Ca 0.14 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.33 3h6o h GLU 396 Cb 0.54 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3h6o h GLU 396 CO 0.03 0.11 -0.65 0.93 -1.00 0.00 0.00 179.01 178.43 3h6o h GLU 397 N 0.17 0.28 -0.41 2.33 5.08 -0.82 -2.50 114.58 118.70 3h6o h GLU 397 Ca 0.21 -0.20 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 3h6o h GLU 397 Cb 0.27 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3h6o h GLU 397 CO -0.30 0.83 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.20 3h6o h LEU 398 N 0.20 0.95 -0.28 1.33 3.38 -1.07 -3.11 115.31 116.71 3h6o h LEU 398 Ca -0.01 -0.43 -0.14 0.00 0.09 0.00 0.00 57.88 57.39 3h6o h LEU 398 Cb 1.18 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3h6o h LEU 398 CO 0.10 1.18 -0.64 0.08 0.09 0.00 0.00 178.44 179.24 3h6o h ARG 399 N 0.74 0.00 0.00 1.13 0.11 -1.45 -0.73 114.38 114.18 3h6o h ARG 399 Ca 0.08 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.16 3h6o h ARG 399 Cb 0.85 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.93 3h6o h ARG 399 CO 0.07 0.64 0.00 0.54 0.10 0.00 0.00 179.97 181.33 3h6o n ARG 400 N -3.39 0.09 -0.04 0.08 1.74 -0.94 -1.80 116.66 112.40 3h6o n ARG 400 Ca 0.01 0.52 0.01 0.00 -0.77 0.00 0.00 57.85 57.61 3h6o n ARG 400 Cb 0.74 -1.76 -0.12 0.00 -1.02 0.00 0.00 32.46 30.31 3h6o n ARG 400 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h6o n LEU 401 N -1.94 0.00 -4.43 0.55 4.77 -0.97 -4.97 117.00 110.01 3h6o n LEU 401 Ca 0.00 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.51 3h6o n LEU 401 Cb 0.07 0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.21 3h6o n LEU 401 CO 0.09 0.16 1.99 0.00 -1.33 0.00 0.00 177.39 178.30 3h6o n ALA 402 N -2.26 0.48 -1.70 -1.18 0.00 -0.32 -4.88 120.51 110.65 3h6o n ALA 402 Ca -0.12 -0.19 -0.36 0.00 0.00 0.00 0.00 53.44 52.77 3h6o n ALA 402 Cb 0.66 -2.39 0.04 0.00 0.00 0.00 0.00 19.45 17.76 3h6o n ALA 402 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3h6o s PRO 403 N 7.56 2.91 -1.39 0.00 0.02 -1.26 -4.91 135.00 137.93 3h6o s PRO 403 Ca 1.22 1.78 -0.10 0.00 0.02 0.00 0.00 61.00 63.92 3h6o s PRO 403 Cb -1.12 -1.93 0.08 0.00 0.02 0.00 0.00 34.50 31.56 3h6o s PRO 403 CO 0.51 -1.24 2.24 -0.89 -0.33 0.00 0.00 177.00 177.29 3h6o n ILE 404 N -1.72 4.27 -1.48 2.83 5.41 -1.26 -4.94 119.36 122.46 3h6o n ILE 404 Ca 0.13 -3.72 -0.29 0.00 1.00 0.00 0.00 62.75 59.87 3h6o n ILE 404 Cb 0.50 -2.41 0.14 0.00 -0.71 0.00 0.00 39.64 37.16 3h6o n ILE 404 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3h6o s THR 405 N 1.14 1.99 -2.35 1.39 -4.23 -1.26 -4.96 115.64 107.36 3h6o s THR 405 Ca 0.49 0.00 0.27 0.00 -1.18 0.00 0.00 61.69 61.26 3h6o s THR 405 Cb 0.14 -2.71 0.38 0.00 1.34 0.00 0.00 72.50 71.64 3h6o s THR 405 CO -0.05 0.00 1.57 -1.54 -0.54 0.00 0.00 174.62 174.06 3h6o n SER 406 N -3.85 1.65 -4.61 3.99 3.41 -1.26 -4.94 113.62 108.01 3h6o n SER 406 Ca 0.07 -1.42 -0.43 0.00 -0.26 0.00 0.00 58.87 56.83 3h6o n SER 406 Cb 0.59 0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.58 3h6o n SER 406 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h6o s ASP 407 N -2.17 5.78 0.35 4.04 3.68 -1.26 -4.89 116.67 122.20 3h6o s ASP 407 Ca 0.31 1.86 0.08 0.00 2.13 0.00 0.00 52.55 56.93 3h6o s ASP 407 Cb 0.20 -2.52 0.65 0.00 -1.45 0.00 0.00 42.92 39.80 3h6o s ASP 407 CO 0.40 -1.71 1.84 -0.65 0.13 0.00 0.00 175.17 175.18 3h6o h PRO 408 N 13.53 0.27 -0.67 4.34 0.11 -1.92 -2.98 132.00 144.69 3h6o h PRO 408 Ca -0.40 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 3h6o h PRO 408 Cb 1.22 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 3h6o h PRO 408 CO 0.98 0.48 0.23 1.79 -0.21 0.00 0.00 178.00 181.26 3h6o h THR 409 N 0.25 1.24 -0.22 -1.15 1.35 -1.90 -0.76 112.91 111.72 3h6o h THR 409 Ca 0.04 -0.81 -0.20 0.00 -0.55 0.00 0.00 66.41 64.89 3h6o h THR 409 Cb 0.52 0.49 0.00 0.00 -1.73 0.00 0.00 68.15 67.44 3h6o h THR 409 CO 0.04 0.32 -0.66 -0.33 -0.25 0.00 0.00 175.52 174.63 3h6o h GLU 410 N 0.98 0.81 -0.91 4.72 5.08 -1.85 -1.60 114.58 121.81 3h6o h GLU 410 Ca 0.22 -0.58 -0.01 0.00 -1.00 0.00 0.00 59.36 57.99 3h6o h GLU 410 Cb 0.25 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 3h6o h GLU 410 CO -0.01 1.20 0.53 0.00 -1.00 0.00 0.00 179.01 179.74 3h6o h ALA 411 N 0.65 1.22 -0.30 3.43 0.00 -1.36 -1.07 119.26 121.83 3h6o h ALA 411 Ca -0.02 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 3h6o h ALA 411 Cb 1.27 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h6o h ALA 411 CO 0.14 0.65 -0.46 1.15 0.00 0.00 0.00 179.25 180.73 3h6o h THR 412 N 1.27 1.29 -0.46 0.00 2.02 -1.10 -2.18 112.91 113.74 3h6o h THR 412 Ca 0.33 -1.65 -0.03 0.00 0.77 0.00 0.00 66.41 65.82 3h6o h THR 412 Cb -0.03 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 3h6o h THR 412 CO -0.06 0.54 0.17 0.00 0.37 0.00 0.00 175.52 176.53 3h6o h ALA 413 N 0.85 0.60 -0.07 6.16 0.00 -1.06 -2.40 119.26 123.35 3h6o h ALA 413 Ca 0.04 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.57 3h6o h ALA 413 Cb 1.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3h6o h ALA 413 CO 0.10 0.22 -0.82 -0.24 0.00 0.00 0.00 179.25 178.52 3h6o h VAL 414 N 0.60 1.35 -0.77 0.00 3.04 -1.20 -2.68 116.25 116.59 3h6o h VAL 414 Ca 0.15 -2.19 0.05 0.00 -1.01 0.00 0.00 66.70 63.70 3h6o h VAL 414 Cb 0.23 2.18 -0.05 0.00 -2.01 0.00 0.00 31.29 31.63 3h6o h VAL 414 CO -0.01 0.67 0.47 1.23 -1.01 0.00 0.00 177.57 178.92 3h6o h GLY 415 N 1.05 1.14 0.93 3.17 0.00 -1.40 -1.73 103.07 106.24 3h6o h GLY 415 Ca -0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 3h6o h GLY 415 CO 0.15 0.26 0.13 0.00 0.00 0.00 0.00 176.54 177.07 3h6o h ALA 416 N 1.35 0.34 -0.45 3.60 0.00 -1.33 0.52 119.26 123.29 3h6o h ALA 416 Ca 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3h6o h ALA 416 Cb 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3h6o h ALA 416 CO -0.15 -0.11 0.26 0.28 0.00 0.00 0.00 179.25 179.54 3h6o h VAL 417 N 0.29 1.15 -0.76 0.00 2.07 -1.34 0.15 116.25 117.81 3h6o h VAL 417 Ca 0.09 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3h6o h VAL 417 Cb 0.11 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 3h6o h VAL 417 CO -0.01 0.15 0.47 -0.08 0.02 0.00 0.00 177.57 178.12 3h6o h GLU 418 N 0.59 1.03 -0.74 1.57 4.57 -1.16 -1.69 114.58 118.76 3h6o h GLU 418 Ca 0.16 -0.09 -0.05 0.00 -1.18 0.00 0.00 59.36 58.20 3h6o h GLU 418 Cb 0.02 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.36 3h6o h GLU 418 CO -0.03 0.72 0.25 0.00 -1.18 0.00 0.00 179.01 178.77 3h6o h ALA 419 N 1.25 1.05 -0.58 2.92 0.00 -0.49 -0.95 119.26 122.46 3h6o h ALA 419 Ca 0.27 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3h6o h ALA 419 Cb -0.06 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 3h6o h ALA 419 CO -0.05 0.65 0.28 0.66 0.00 0.00 0.00 179.25 180.79 3h6o h SER 420 N 1.08 0.73 -0.16 0.00 4.64 -0.27 -1.80 113.55 117.76 3h6o h SER 420 Ca 0.24 -0.07 -0.17 0.00 -0.47 0.00 0.00 61.79 61.32 3h6o h SER 420 Cb 0.27 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3h6o h SER 420 CO -0.01 0.62 -0.53 -0.26 -0.87 0.00 0.00 176.83 175.77 3h6o h PHE 421 N 0.81 0.93 -0.57 4.77 0.04 -0.99 -1.08 116.94 120.85 3h6o h PHE 421 Ca 0.20 -0.33 -0.09 0.00 2.80 0.00 0.00 57.97 60.56 3h6o h PHE 421 Cb 0.08 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 3h6o h PHE 421 CO 0.01 1.12 0.01 -0.22 -0.60 0.00 0.00 178.31 178.62 3h6o h LYS 422 N 0.58 1.00 -0.25 1.51 1.63 -0.60 -3.09 116.57 117.35 3h6o h LYS 422 Ca 0.02 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.50 3h6o h LYS 422 Cb 1.11 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.65 3h6o h LYS 422 CO 0.11 0.99 0.00 0.00 -3.45 0.00 0.00 179.45 177.11 3h6o s SER 425 N -3.24 6.96 0.54 0.00 1.04 -0.81 -4.94 113.70 113.25 3h6o s SER 425 Ca 0.24 1.66 0.27 0.00 0.48 0.00 0.00 55.95 58.60 3h6o s SER 425 Cb -0.10 -2.52 1.55 0.00 0.10 0.00 0.00 66.02 65.05 3h6o s SER 425 CO 0.87 -0.31 2.14 1.23 0.98 0.00 0.00 173.24 178.14 3h6o h GLY 426 N 2.07 0.00 -3.80 7.32 0.00 -1.76 -3.42 103.07 103.49 3h6o h GLY 426 Ca -0.49 0.00 0.14 0.00 0.00 0.00 0.00 47.33 46.98 3h6o h GLY 426 CO 0.62 0.00 0.60 0.00 0.00 0.00 0.00 176.54 177.76 3h6o s ALA 427 N -4.41 -1.92 -0.24 3.60 0.00 -1.26 -4.24 121.76 113.29 3h6o s ALA 427 Ca -0.04 1.34 -0.06 0.00 0.00 0.00 0.00 51.96 53.20 3h6o s ALA 427 Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 3h6o s ALA 427 CO 0.58 -0.55 0.03 0.42 0.00 0.00 0.00 175.76 176.24 3h6o s ILE 428 N -2.35 3.98 -0.24 0.00 1.01 0.55 -1.26 121.20 122.89 3h6o s ILE 428 Ca 0.04 -0.29 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 3h6o s ILE 428 Cb -0.01 -2.84 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 3h6o s ILE 428 CO -0.05 0.37 0.14 -0.63 0.00 0.00 0.00 174.94 174.77 3h6o s ILE 429 N 1.56 5.20 -0.10 2.92 1.01 0.14 -0.35 121.20 131.58 3h6o s ILE 429 Ca 0.06 0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.84 3h6o s ILE 429 Cb -0.15 -3.42 0.02 0.00 0.01 0.00 0.00 42.46 38.92 3h6o s ILE 429 CO 0.01 0.35 -0.10 -0.69 0.00 0.00 0.00 174.94 174.51 3h6o s VAL 430 N 1.11 1.14 -0.18 2.92 1.01 -0.03 0.12 120.40 126.49 3h6o s VAL 430 Ca 0.07 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 3h6o s VAL 430 Cb -0.14 -1.10 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 3h6o s VAL 430 CO 0.05 0.37 1.00 -0.76 0.00 0.00 0.00 175.10 175.76 3h6o s LEU 431 N 1.28 4.16 -0.06 3.92 1.43 -0.95 -0.40 118.68 128.06 3h6o s LEU 431 Ca -0.02 1.41 -0.03 0.00 -1.03 0.00 0.00 54.13 54.45 3h6o s LEU 431 Cb -0.14 -3.50 0.03 0.00 0.03 0.00 0.00 46.19 42.61 3h6o s LEU 431 CO -0.04 -0.55 0.14 0.28 0.23 0.00 0.00 176.35 176.41 3h6o s THR 432 N 2.62 -0.04 -0.11 5.49 -1.32 -0.65 -4.88 115.64 116.74 3h6o s THR 432 Ca 0.45 0.15 -0.15 0.00 -1.21 0.00 0.00 61.69 60.93 3h6o s THR 432 Cb -0.16 -0.23 -0.13 0.00 -1.51 0.00 0.00 72.50 70.47 3h6o s THR 432 CO 0.11 0.06 0.43 0.11 -2.21 0.00 0.00 174.62 173.12 3h6o h LYS 433 N 7.02 -0.03 0.00 7.08 1.57 -1.95 -3.37 116.57 126.89 3h6o h LYS 433 Ca -0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 3h6o h LYS 433 Cb 1.15 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3h6o h LYS 433 CO 0.43 0.44 -0.45 -1.13 -0.57 0.00 0.00 179.45 178.17 3h6o n SER 434 N -4.73 0.47 0.00 0.86 3.41 -1.26 -4.62 113.62 107.75 3h6o n SER 434 Ca -0.05 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 3h6o n SER 434 Cb 0.23 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 3h6o n SER 434 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h6o n GLY 435 N 1.46 3.02 0.22 5.00 0.00 -1.26 -4.84 105.19 108.79 3h6o n GLY 435 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 3h6o n GLY 435 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3h6o h ARG 436 N 0.91 0.08 -0.88 1.61 3.08 -1.95 -0.14 114.38 117.11 3h6o h ARG 436 Ca 0.00 -0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.21 3h6o h ARG 436 Cb 0.00 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 29.93 3h6o h ARG 436 CO 0.00 0.05 0.44 0.77 -1.07 0.00 0.00 179.97 180.17 3h6o h SER 437 N 0.09 0.50 0.57 7.04 0.02 -1.93 -0.60 113.55 119.24 3h6o h SER 437 Ca 0.29 0.11 -0.23 0.00 -0.84 0.00 0.00 61.79 61.12 3h6o h SER 437 Cb 0.46 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 3h6o h SER 437 CO -0.52 0.17 -1.02 0.00 -1.14 0.00 0.00 176.83 174.32 3h6o h ALA 438 N 1.61 0.33 -0.63 3.77 0.00 -1.44 -3.10 119.26 119.79 3h6o h ALA 438 Ca 0.50 -0.79 0.05 0.00 0.00 0.00 0.00 54.91 54.67 3h6o h ALA 438 Cb 0.78 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 3h6o h ALA 438 CO -0.41 0.94 0.36 0.45 0.00 0.00 0.00 179.25 180.59 3h6o h HIS 439 N 0.12 0.67 -0.33 0.00 -0.00 -0.36 -1.26 115.15 113.99 3h6o h HIS 439 Ca -0.08 0.02 0.01 0.00 -0.00 0.00 0.00 60.37 60.32 3h6o h HIS 439 Cb 1.69 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 28.88 3h6o h HIS 439 CO 0.05 0.34 0.22 1.96 -0.00 0.00 0.00 177.93 180.50 3h6o h GLN 440 N 0.69 0.41 0.02 2.45 4.20 -1.12 -1.05 115.11 120.71 3h6o h GLN 440 Ca 0.27 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 3h6o h GLN 440 Cb 0.12 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.81 3h6o h GLN 440 CO -0.15 0.27 -0.01 0.28 -0.67 0.00 0.00 178.83 178.55 3h6o h VAL 441 N 0.42 1.40 -0.88 -0.54 2.07 -1.36 -3.27 116.25 114.09 3h6o h VAL 441 Ca 0.12 -1.36 0.20 0.00 0.82 0.00 0.00 66.70 66.48 3h6o h VAL 441 Cb -0.02 2.31 -0.06 0.00 -1.52 0.00 0.00 31.29 32.00 3h6o h VAL 441 CO -0.03 0.35 0.59 0.00 0.02 0.00 0.00 177.57 178.49 3h6o h ALA 442 N 0.32 2.21 -0.34 1.67 0.00 -0.93 -1.15 119.26 121.04 3h6o h ALA 442 Ca -0.00 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.02 3h6o h ALA 442 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3h6o h ALA 442 CO 0.00 -0.48 0.33 -0.09 0.00 0.00 0.00 179.25 179.02 3h6o h ARG 443 N 0.40 0.00 -0.11 0.00 2.43 -1.25 -1.15 114.38 114.70 3h6o h ARG 443 Ca 0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 3h6o h ARG 443 Cb 1.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 3h6o h ARG 443 CO -0.17 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 178.95 3h6o n TYR 444 N -3.89 0.11 -3.26 2.20 4.01 -0.44 -4.95 117.16 110.94 3h6o n TYR 444 Ca 0.05 -0.05 -0.15 0.00 -0.16 0.00 0.00 57.90 57.59 3h6o n TYR 444 Cb 0.50 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.60 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 1.23 -4.12 -0.98 -0.72 5.12 -0.44 -4.76 116.66 111.99 3h6o n ARG 445 Ca 0.16 0.82 -0.31 0.00 -1.93 0.00 0.00 57.85 56.58 3h6o n ARG 445 Cb 0.57 -5.67 0.13 0.00 -1.16 0.00 0.00 32.46 26.33 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 -4.78 1.57 0.06 5.56 0.04 -1.26 -4.93 135.00 131.25 3h6o s PRO 446 Ca 0.23 1.46 -0.17 0.00 0.04 0.00 0.00 61.00 62.56 3h6o s PRO 446 Cb -0.03 -1.80 -0.17 0.00 0.04 0.00 0.00 34.50 32.54 3h6o s PRO 446 CO 0.70 -2.20 1.25 -0.09 0.04 0.00 0.00 177.00 176.70 3h6o h ARG 447 N -1.40 0.57 -7.01 4.56 2.43 -1.93 -3.46 114.38 108.14 3h6o h ARG 447 Ca -0.44 -0.45 -0.52 0.00 -0.81 0.00 0.00 59.98 57.76 3h6o h ARG 447 Cb 1.26 0.09 0.09 0.00 -0.42 0.00 0.00 29.97 30.99 3h6o h ARG 447 CO 0.46 1.08 0.53 0.00 -1.51 0.00 0.00 179.97 180.53 3h6o s ALA 448 N -3.74 2.97 0.44 2.80 0.00 -1.26 -5.00 121.76 117.97 3h6o s ALA 448 Ca -0.12 1.08 -0.25 0.00 0.00 0.00 0.00 51.96 52.67 3h6o s ALA 448 Cb 0.06 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 3h6o s ALA 448 CO 0.84 -0.87 1.27 -1.25 0.00 0.00 0.00 175.76 175.74 3h6o s PRO 449 N -2.69 3.81 -0.47 0.00 0.04 -1.26 -4.68 135.00 129.74 3h6o s PRO 449 Ca 0.65 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 63.59 3h6o s PRO 449 Cb -0.33 -2.60 0.08 0.00 0.04 0.00 0.00 34.50 31.69 3h6o s PRO 449 CO 0.40 -0.59 0.39 0.42 0.04 0.00 0.00 177.00 177.66 3h6o s ILE 450 N -1.35 5.16 -0.63 0.56 1.01 0.38 -0.33 121.20 126.01 3h6o s ILE 450 Ca 0.61 -1.12 -0.25 0.00 0.00 0.00 0.00 60.65 59.89 3h6o s ILE 450 Cb -0.35 -4.10 0.05 0.00 0.01 0.00 0.00 42.46 38.06 3h6o s ILE 450 CO 0.44 -0.59 1.06 -0.63 0.00 0.00 0.00 174.94 175.22 3h6o s ILE 451 N 1.62 4.16 -0.45 2.92 1.01 0.53 0.31 121.20 131.31 3h6o s ILE 451 Ca 0.04 0.21 -0.21 0.00 0.00 0.00 0.00 60.65 60.68 3h6o s ILE 451 Cb -0.25 -4.70 0.03 0.00 0.01 0.00 0.00 42.46 37.55 3h6o s ILE 451 CO 0.06 -1.42 0.68 0.00 0.00 0.00 0.00 174.94 174.26 3h6o s ALA 452 N 4.54 3.33 -0.18 9.38 0.00 -0.72 -0.85 121.76 137.26 3h6o s ALA 452 Ca 0.31 -1.18 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 3h6o s ALA 452 Cb -0.12 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 3h6o s ALA 452 CO 0.16 -1.84 0.42 0.08 0.00 0.00 0.00 175.76 174.58 3h6o s VAL 453 N 2.95 5.19 -0.01 0.00 1.01 0.46 -1.42 120.40 128.58 3h6o s VAL 453 Ca 0.24 0.78 -0.09 0.00 0.00 0.00 0.00 61.98 62.92 3h6o s VAL 453 Cb -0.14 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.49 3h6o s VAL 453 CO 0.20 0.27 0.18 0.28 0.00 0.00 0.00 175.10 176.03 3h6o s THR 454 N 1.11 0.07 -1.92 3.92 -1.32 -1.01 -1.64 115.64 114.85 3h6o s THR 454 Ca 0.21 -0.57 0.26 0.00 -1.21 0.00 0.00 61.69 60.38 3h6o s THR 454 Cb -0.15 -0.46 0.27 0.00 -1.51 0.00 0.00 72.50 70.66 3h6o s THR 454 CO 0.08 -0.31 1.53 0.54 -2.21 0.00 0.00 174.62 174.25 3h6o n ARG 455 N 1.57 1.03 -3.22 7.08 1.74 -1.26 -1.51 116.66 122.08 3h6o n ARG 455 Ca -0.21 -0.65 -0.41 0.00 -0.77 0.00 0.00 57.85 55.81 3h6o n ARG 455 Cb 0.56 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.44 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 -2.42 6.37 0.21 0.55 3.84 -1.26 -4.91 114.94 117.32 3h6o s ASN 456 Ca 0.26 0.19 -0.10 0.00 0.21 0.00 0.00 52.86 53.41 3h6o s ASN 456 Cb 0.19 -2.28 0.16 0.00 -0.55 0.00 0.00 41.25 38.77 3h6o s ASN 456 CO 0.50 -0.43 1.85 -0.65 -2.79 0.00 0.00 177.10 175.58 3h6o h PRO 457 N 8.31 1.04 -0.14 0.43 0.11 -1.96 -1.91 132.00 137.88 3h6o h PRO 457 Ca -0.28 -0.10 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 3h6o h PRO 457 Cb 1.13 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 3h6o h PRO 457 CO 0.76 0.74 0.05 0.37 -0.21 0.00 0.00 178.00 179.71 3h6o h GLN 458 N 1.05 0.22 -0.76 1.05 4.15 -1.98 -1.11 115.11 117.73 3h6o h GLN 458 Ca 0.27 -0.05 0.16 0.00 0.77 0.00 0.00 58.65 59.80 3h6o h GLN 458 Cb -0.03 -0.03 -0.10 0.00 0.21 0.00 0.00 27.48 27.53 3h6o h GLN 458 CO -0.05 0.35 0.26 1.15 -1.93 0.00 0.00 178.83 178.62 3h6o h THR 459 N 0.05 0.58 -0.37 2.39 2.02 -1.83 -0.39 112.91 115.36 3h6o h THR 459 Ca 0.05 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 3h6o h THR 459 Cb 0.22 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3h6o h THR 459 CO -0.00 0.07 0.00 0.00 0.37 0.00 0.00 175.52 175.96 3h6o h ALA 460 N 1.59 0.50 -0.52 6.16 0.00 -1.00 -2.35 119.26 123.64 3h6o h ALA 460 Ca 0.43 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 3h6o h ALA 460 Cb 0.71 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 3h6o h ALA 460 CO -0.46 0.27 0.04 0.00 0.00 0.00 0.00 179.25 179.10 3h6o h ARG 461 N 0.48 0.89 0.00 0.00 3.08 -0.69 -3.17 114.38 114.97 3h6o h ARG 461 Ca 0.11 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.89 3h6o h ARG 461 Cb 0.46 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.42 3h6o h ARG 461 CO 0.02 0.90 0.00 1.04 -1.07 0.00 0.00 179.97 180.86 3h6o n GLN 462 N -4.34 0.21 0.19 0.04 6.02 -0.20 -3.37 117.38 115.94 3h6o n GLN 462 Ca 0.01 0.28 0.04 0.00 -0.01 0.00 0.00 57.00 57.33 3h6o n GLN 462 Cb 0.29 -1.80 0.39 0.00 1.02 0.00 0.00 30.24 30.15 3h6o n GLN 462 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3h6o h ALA 463 N 2.45 1.27 -0.11 -1.58 0.00 -1.39 -2.94 119.26 116.96 3h6o h ALA 463 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.62 3h6o h ALA 463 Cb 0.56 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3h6o h ALA 463 CO 0.00 0.44 0.36 0.45 0.00 0.00 0.00 179.25 180.50 3h6o h HIS 464 N 0.00 0.00 0.00 0.00 3.86 -1.72 -0.63 115.15 116.66 3h6o h HIS 464 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3h6o h HIS 464 Cb 0.68 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.15 3h6o h HIS 464 CO 0.00 0.00 0.00 1.28 0.86 0.00 0.00 177.93 180.07 3h6o n LEU 465 N -3.12 0.49 -4.51 2.43 4.77 -1.11 -4.42 117.00 111.53 3h6o n LEU 465 Ca 0.00 0.62 -0.35 0.00 -0.03 0.00 0.00 56.01 56.26 3h6o n LEU 465 Cb 0.44 -0.56 -0.12 0.00 -2.33 0.00 0.00 43.42 40.85 3h6o n LEU 465 CO 0.17 -0.49 -0.31 -0.31 -1.33 0.00 0.00 177.39 175.12 3h6o s TYR 466 N -3.24 3.10 0.06 -1.77 2.02 -0.24 -4.62 117.35 112.66 3h6o s TYR 466 Ca 0.05 -0.26 -0.37 0.00 -0.37 0.00 0.00 57.07 56.12 3h6o s TYR 466 Cb 0.09 -2.07 -0.16 0.00 -0.40 0.00 0.00 41.96 39.43 3h6o s TYR 466 CO 0.35 -0.09 1.43 -2.13 -1.57 0.00 0.00 175.55 173.54 3h6o n ARG 467 N 3.93 1.32 0.00 -0.62 3.00 -1.26 -2.40 116.66 120.63 3h6o n ARG 467 Ca -0.17 0.48 0.00 0.00 -0.00 0.00 0.00 57.85 58.16 3h6o n ARG 467 Cb 0.52 -2.15 0.00 0.00 0.00 0.00 0.00 32.46 30.83 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 2.86 2.31 3.67 5.14 0.00 0.70 -4.74 105.19 115.13 3h6o n GLY 468 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.58 4.74 -0.47 -0.61 1.01 -1.01 -0.47 121.20 121.82 3h6o s ILE 469 Ca 0.00 1.95 -0.06 0.00 0.00 0.00 0.00 60.65 62.54 3h6o s ILE 469 Cb 0.00 -4.28 0.12 0.00 0.01 0.00 0.00 42.46 38.31 3h6o s ILE 469 CO 0.00 -0.10 0.30 -0.36 0.00 0.00 0.00 174.94 174.79 3h6o s PHE 470 N 2.72 3.50 0.07 3.97 0.40 0.15 -4.64 117.98 124.16 3h6o s PHE 470 Ca 0.44 -2.19 -0.30 0.00 -0.60 0.00 0.00 56.93 54.28 3h6o s PHE 470 Cb -0.16 -3.37 -0.05 0.00 0.51 0.00 0.00 43.02 39.95 3h6o s PHE 470 CO 0.10 -0.97 1.03 -1.25 0.70 0.00 0.00 175.22 174.83 3h6o s PRO 471 N 1.11 4.59 -0.01 0.24 0.04 -1.26 -1.75 135.00 137.96 3h6o s PRO 471 Ca 0.08 1.54 0.08 0.00 0.04 0.00 0.00 61.00 62.74 3h6o s PRO 471 Cb -0.24 -3.38 -0.02 0.00 0.04 0.00 0.00 34.50 30.90 3h6o s PRO 471 CO -0.03 0.02 -0.25 0.14 0.04 0.00 0.00 177.00 176.93 3h6o s VAL 472 N 0.48 1.98 -0.43 -0.36 -7.23 -0.51 -4.49 120.40 109.84 3h6o s VAL 472 Ca 0.51 -1.10 -0.11 0.00 -1.81 0.00 0.00 61.98 59.47 3h6o s VAL 472 Cb -0.24 -1.65 0.08 0.00 0.56 0.00 0.00 36.38 35.12 3h6o s VAL 472 CO 0.30 0.53 0.29 -0.22 -0.31 0.00 0.00 175.10 175.69 3h6o s LEU 473 N -0.67 5.26 0.16 1.32 2.96 -1.26 -2.41 118.68 124.05 3h6o s LEU 473 Ca 0.10 -1.46 -0.30 0.00 -0.22 0.00 0.00 54.13 52.25 3h6o s LEU 473 Cb -0.10 -2.03 -0.07 0.00 0.50 0.00 0.00 46.19 44.49 3h6o s LEU 473 CO -0.01 -0.56 1.15 0.00 -1.32 0.00 0.00 176.35 175.62 3h6o n LYS 475 N 2.67 2.83 -1.64 0.00 5.02 -1.26 -4.51 118.16 121.27 3h6o n LYS 475 Ca 0.04 -0.38 -0.41 0.00 -2.02 0.00 0.00 58.31 55.54 3h6o n LYS 475 Cb 0.46 -0.90 0.01 0.00 -0.02 0.00 0.00 35.03 34.57 3h6o n LYS 475 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3h6o n ASP 476 N -0.47 1.75 -4.73 4.39 8.00 -1.26 -4.97 116.55 119.27 3h6o n ASP 476 Ca 0.02 1.07 -0.32 0.00 0.71 0.00 0.00 54.79 56.27 3h6o n ASP 476 Cb 0.11 -1.41 0.11 0.00 -0.02 0.00 0.00 41.12 39.91 3h6o n ASP 476 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 3h6o s PRO 477 N -2.07 1.85 -0.05 -0.24 0.02 -1.26 -4.94 135.00 128.30 3h6o s PRO 477 Ca 0.62 1.39 -0.30 0.00 0.02 0.00 0.00 61.00 62.73 3h6o s PRO 477 Cb -0.54 -1.83 -0.05 0.00 0.02 0.00 0.00 34.50 32.09 3h6o s PRO 477 CO 0.57 -1.98 1.61 0.08 -0.33 0.00 0.00 177.00 176.94 3h6o s VAL 478 N -2.67 3.61 0.60 3.83 1.01 -1.26 -4.98 120.40 120.54 3h6o s VAL 478 Ca 0.65 0.78 -0.17 0.00 0.00 0.00 0.00 61.98 63.24 3h6o s VAL 478 Cb -0.21 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 3h6o s VAL 478 CO 0.54 -0.06 1.13 -1.10 0.00 0.00 0.00 175.10 175.61 3h6o s GLN 479 N 3.79 3.07 0.11 2.72 -1.52 -1.26 -4.96 119.66 121.61 3h6o s GLN 479 Ca 0.71 1.53 -0.26 0.00 -1.95 0.00 0.00 55.36 55.38 3h6o s GLN 479 Cb -0.33 -1.97 -0.10 0.00 -0.22 0.00 0.00 33.01 30.39 3h6o s GLN 479 CO 0.28 -1.06 1.66 0.93 -0.25 0.00 0.00 175.29 176.85 3h6o h GLU 480 N 0.64 -0.40 -6.42 2.91 5.08 -1.99 -3.40 114.58 111.00 3h6o h GLU 480 Ca -0.49 0.03 -0.53 0.00 -1.00 0.00 0.00 59.36 57.37 3h6o h GLU 480 Cb 1.26 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 3h6o h GLU 480 CO 0.55 -0.26 0.23 0.00 -1.00 0.00 0.00 179.01 178.53 3h6o s ALA 481 N -6.10 3.34 0.04 3.43 0.00 -1.26 -4.99 121.76 116.22 3h6o s ALA 481 Ca -0.15 0.39 -0.22 0.00 0.00 0.00 0.00 51.96 51.98 3h6o s ALA 481 Cb 0.07 -3.08 -0.15 0.00 0.00 0.00 0.00 23.12 19.96 3h6o s ALA 481 CO 0.65 0.07 1.41 2.35 0.00 0.00 0.00 175.76 180.24 3h6o h TRP 482 N 5.43 0.25 -0.73 0.00 7.01 -1.99 -2.05 115.95 123.87 3h6o h TRP 482 Ca -0.44 -0.06 0.15 0.00 2.11 0.00 0.00 58.89 60.66 3h6o h TRP 482 Cb 1.21 -0.06 -0.11 0.00 -2.10 0.00 0.00 29.16 28.10 3h6o h TRP 482 CO 0.65 0.54 0.19 0.00 -2.79 0.00 0.00 178.44 177.03 3h6o h ALA 483 N 0.67 0.95 -0.59 2.65 0.00 -1.96 0.28 119.26 121.26 3h6o h ALA 483 Ca 0.03 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3h6o h ALA 483 Cb 0.47 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3h6o h ALA 483 CO 0.01 -0.32 0.04 0.93 0.00 0.00 0.00 179.25 179.92 3h6o h GLU 484 N 0.29 1.00 -0.82 0.00 5.08 -1.96 -1.24 114.58 116.94 3h6o h GLU 484 Ca 0.41 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 3h6o h GLU 484 Cb 0.68 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 3h6o h GLU 484 CO -0.48 0.96 0.45 0.22 -1.00 0.00 0.00 179.01 179.16 3h6o h ASP 485 N 0.93 1.01 0.24 1.42 3.58 -0.10 -0.60 116.42 122.90 3h6o h ASP 485 Ca 0.18 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 3h6o h ASP 485 Cb 0.48 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.28 3h6o h ASP 485 CO 0.02 0.80 -0.12 0.58 -2.88 0.00 0.00 179.24 177.65 3h6o h VAL 486 N 1.14 0.82 -0.52 2.25 2.07 -0.26 -3.05 116.25 118.70 3h6o h VAL 486 Ca 0.29 -0.54 0.04 0.00 0.82 0.00 0.00 66.70 67.31 3h6o h VAL 486 Cb 0.01 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3h6o h VAL 486 CO -0.05 0.12 0.35 0.44 0.02 0.00 0.00 177.57 178.44 3h6o h ASP 487 N -0.61 0.47 -0.74 0.57 5.19 -1.09 -2.15 116.42 118.06 3h6o h ASP 487 Ca -0.03 -0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.34 3h6o h ASP 487 Cb 0.44 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.81 3h6o h ASP 487 CO 0.05 0.32 0.35 0.25 -3.12 0.00 0.00 179.24 177.09 3h6o h LEU 488 N 0.54 0.98 -0.05 1.55 6.46 -1.07 -0.69 115.31 123.04 3h6o h LEU 488 Ca 0.22 -0.12 -0.21 0.00 -0.12 0.00 0.00 57.88 57.64 3h6o h LEU 488 Cb 0.18 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 3h6o h LEU 488 CO -0.06 0.84 -1.01 0.03 -0.62 0.00 0.00 178.44 177.63 3h6o h ARG 489 N 1.07 0.06 -0.53 1.25 3.08 -1.30 -2.03 114.38 115.99 3h6o h ARG 489 Ca 0.26 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 3h6o h ARG 489 Cb 0.13 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3h6o h ARG 489 CO -0.03 1.01 0.04 0.28 -1.07 0.00 0.00 179.97 180.19 3h6o h VAL 490 N 0.02 1.26 -0.33 2.04 2.07 -1.17 -1.94 116.25 118.20 3h6o h VAL 490 Ca -0.03 -1.04 -0.09 0.00 0.82 0.00 0.00 66.70 66.35 3h6o h VAL 490 Cb 1.74 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 3h6o h VAL 490 CO 0.14 0.37 -0.19 0.78 0.02 0.00 0.00 177.57 178.69 3h6o h ASN 491 N 0.79 0.61 -0.18 0.57 2.35 -1.15 -0.68 115.58 117.88 3h6o h ASN 491 Ca 0.15 -0.19 0.04 0.00 -0.55 0.00 0.00 56.30 55.75 3h6o h ASN 491 Cb 0.48 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.65 3h6o h ASN 491 CO 0.02 0.80 -0.06 0.15 -1.65 0.00 0.00 177.43 176.70 3h6o h PHE 492 N 0.54 -0.12 -0.95 1.19 3.57 -1.20 -1.14 116.94 118.84 3h6o h PHE 492 Ca 0.09 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.62 3h6o h PHE 492 Cb 0.63 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 3h6o h PHE 492 CO 0.03 -0.09 0.63 0.00 -2.23 0.00 0.00 178.31 176.64 3h6o h ALA 493 N 1.15 1.33 -0.73 2.41 0.00 -1.08 -1.29 119.26 121.05 3h6o h ALA 493 Ca 0.09 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3h6o h ALA 493 Cb 0.15 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 3h6o h ALA 493 CO -0.19 0.61 0.47 0.52 0.00 0.00 0.00 179.25 180.66 3h6o h MET 494 N 1.27 0.91 -0.04 0.00 2.86 -0.63 -1.95 114.93 117.36 3h6o h MET 494 Ca 0.35 -0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.81 3h6o h MET 494 Cb -0.13 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.31 3h6o h MET 494 CO -0.08 0.61 -0.54 -0.91 1.06 0.00 0.00 176.91 177.04 3h6o h ASN 495 N 0.94 0.14 0.04 1.22 2.35 -0.79 -2.00 115.58 117.48 3h6o h ASN 495 Ca 0.28 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3h6o h ASN 495 Cb -0.05 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3h6o h ASN 495 CO -0.09 0.65 -0.02 0.58 -1.65 0.00 0.00 177.43 176.91 3h6o h VAL 496 N 0.10 1.18 -0.77 2.81 2.07 -0.98 -0.51 116.25 120.15 3h6o h VAL 496 Ca -0.00 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.79 3h6o h VAL 496 Cb 0.99 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 3h6o h VAL 496 CO 0.08 0.19 0.50 1.23 0.02 0.00 0.00 177.57 179.59 3h6o h GLY 497 N -0.39 1.10 0.90 2.17 0.00 -1.30 0.62 103.07 106.17 3h6o h GLY 497 Ca -0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 3h6o h GLY 497 CO 0.01 0.36 0.08 0.50 0.00 0.00 0.00 176.54 177.48 3h6o h LYS 498 N 1.00 0.24 -0.02 4.80 1.57 -1.36 0.19 116.57 122.99 3h6o h LYS 498 Ca 0.29 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 3h6o h LYS 498 Cb -0.06 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 3h6o h LYS 498 CO -0.08 0.29 -0.23 0.00 -0.57 0.00 0.00 179.45 178.86 3h6o h ALA 499 N 0.94 1.58 -0.01 3.86 0.00 -0.65 -2.51 119.26 122.47 3h6o h ALA 499 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3h6o h ALA 499 Cb 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h6o h ALA 499 CO -0.01 0.32 -0.22 0.54 0.00 0.00 0.00 179.25 179.88 3h6o n ARG 500 N -4.25 0.99 -1.86 0.00 5.12 0.17 -4.96 116.66 111.87 3h6o n ARG 500 Ca -0.02 -0.59 -0.08 0.00 -1.93 0.00 0.00 57.85 55.23 3h6o n ARG 500 Cb 0.30 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.10 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 1.32 0.35 0.10 -0.13 0.00 -0.79 -4.93 105.19 101.11 3h6o n GLY 501 Ca 0.13 -0.58 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 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 0.28 -3.25 1.61 0.04 -0.90 -3.43 116.94 111.29 3h6o h PHE 502 Ca -0.19 -0.19 0.01 0.00 2.80 0.00 0.00 57.97 60.40 3h6o h PHE 502 Cb 0.95 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 39.02 3h6o h PHE 502 CO 0.22 1.09 0.11 -0.59 -0.60 0.00 0.00 178.31 178.54 3h6o s PHE 503 N -2.89 0.07 0.19 -0.55 -0.12 -1.16 -4.83 117.98 108.69 3h6o s PHE 503 Ca -0.02 -0.51 0.01 0.00 -0.05 0.00 0.00 56.93 56.36 3h6o s PHE 503 Cb 0.09 0.53 -0.05 0.00 -0.63 0.00 0.00 43.02 42.96 3h6o s PHE 503 CO 0.84 -1.19 0.04 -1.59 -0.05 0.00 0.00 175.22 173.27 3h6o s LYS 504 N -3.75 1.18 0.17 1.99 -2.85 -1.26 -3.86 119.74 111.36 3h6o s LYS 504 Ca 0.16 -1.60 -0.32 0.00 -1.00 0.00 0.00 55.97 53.22 3h6o s LYS 504 Cb -0.04 -0.21 -0.17 0.00 -2.06 0.00 0.00 37.83 35.35 3h6o s LYS 504 CO 0.09 -0.19 0.91 1.17 0.10 0.00 0.00 175.35 177.42 3h6o n LYS 505 N -0.29 0.58 0.00 1.78 4.81 -1.26 -1.96 118.16 121.82 3h6o n LYS 505 Ca -0.04 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 3h6o n LYS 505 Cb 0.64 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 34.17 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 1.80 3.28 3.68 3.14 0.00 0.52 -4.92 105.19 112.69 3h6o n GLY 506 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.77 3.10 -0.13 1.61 1.01 -0.83 -4.60 116.67 116.06 3h6o s ASP 507 Ca 0.00 1.65 -0.02 0.00 0.71 0.00 0.00 52.55 54.88 3h6o s ASP 507 Cb 0.00 -2.29 -0.03 0.00 1.01 0.00 0.00 42.92 41.61 3h6o s ASP 507 CO 0.00 -2.90 -0.05 0.68 0.21 0.00 0.00 175.17 173.11 3h6o s VAL 508 N -2.81 3.81 0.25 -1.27 -7.23 -1.26 -0.09 120.40 111.79 3h6o s VAL 508 Ca 0.64 -0.40 0.08 0.00 -1.81 0.00 0.00 61.98 60.49 3h6o s VAL 508 Cb -0.20 -2.64 -0.05 0.00 0.56 0.00 0.00 36.38 34.06 3h6o s VAL 508 CO 0.58 0.53 -0.12 0.68 -0.31 0.00 0.00 175.10 176.46 3h6o s VAL 509 N 0.02 1.81 -0.15 1.32 -7.23 0.08 -2.16 120.40 114.08 3h6o s VAL 509 Ca 0.00 -2.20 -0.09 0.00 -1.81 0.00 0.00 61.98 57.88 3h6o s VAL 509 Cb -0.13 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 3h6o s VAL 509 CO 0.03 -0.45 0.15 -0.63 -0.31 0.00 0.00 175.10 173.89 3h6o s ILE 510 N -2.92 5.45 -0.14 -0.62 -1.09 -0.39 -1.33 121.20 120.16 3h6o s ILE 510 Ca 0.26 0.23 0.02 0.00 -2.23 0.00 0.00 60.65 58.93 3h6o s ILE 510 Cb 0.01 -3.45 0.02 0.00 -1.58 0.00 0.00 42.46 37.45 3h6o s ILE 510 CO 0.10 0.54 -0.19 -0.69 -1.23 0.00 0.00 174.94 173.47 3h6o s VAL 511 N -0.40 1.85 -0.24 2.92 1.01 -0.01 0.24 120.40 125.76 3h6o s VAL 511 Ca 0.12 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 3h6o s VAL 511 Cb -0.12 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 3h6o s VAL 511 CO 0.02 0.51 0.08 -0.76 0.00 0.00 0.00 175.10 174.94 3h6o s LEU 512 N 1.06 3.53 0.38 3.92 1.43 0.12 -1.30 118.68 127.82 3h6o s LEU 512 Ca -0.03 -0.15 0.05 0.00 -1.03 0.00 0.00 54.13 52.97 3h6o s LEU 512 Cb -0.14 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 3h6o s LEU 512 CO -0.05 -0.00 0.18 0.42 0.23 0.00 0.00 176.35 177.13 3h6o s THR 513 N 1.44 0.36 0.43 5.49 -4.23 -0.29 -2.25 115.64 116.58 3h6o s THR 513 Ca 0.06 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.61 3h6o s THR 513 Cb -0.15 -2.39 -0.05 0.00 1.34 0.00 0.00 72.50 71.25 3h6o s THR 513 CO 0.04 0.00 0.02 -0.83 -0.54 0.00 0.00 174.62 173.31 3h6o s GLY 514 N -3.52 2.62 0.05 3.99 0.00 -1.26 -1.47 107.32 107.73 3h6o s GLY 514 Ca 0.30 -1.58 0.25 0.00 0.00 0.00 0.00 44.72 43.69 3h6o s GLY 514 CO 0.19 -2.07 1.42 -2.67 0.00 0.00 0.00 173.10 169.97 3h6o n TRP 515 N -1.02 0.25 -3.82 1.90 4.27 -1.19 -4.91 117.44 112.92 3h6o n TRP 515 Ca -0.09 0.07 -0.08 0.00 -3.89 0.00 0.00 57.50 53.51 3h6o n TRP 515 Cb 0.67 -0.45 -0.03 0.00 -1.36 0.00 0.00 31.31 30.13 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 -3.07 1.61 0.84 -2.67 1.70 -1.26 -5.17 118.95 110.92 3h6o s ARG 516 Ca 0.09 -0.97 -0.12 0.00 -0.47 0.00 0.00 55.73 54.26 3h6o s ARG 516 Cb 0.16 0.56 0.09 0.00 -0.57 0.00 0.00 34.95 35.19 3h6o s ARG 516 CO 0.69 -0.71 1.10 -2.14 -1.08 0.00 0.00 175.30 173.16 3h6o s PRO 517 N -3.92 1.77 0.00 3.89 0.02 -1.26 -4.86 135.00 130.64 3h6o s PRO 517 Ca 0.12 0.69 0.00 0.00 0.02 0.00 0.00 61.00 61.83 3h6o s PRO 517 Cb -0.03 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.61 3h6o s PRO 517 CO 0.04 -1.85 0.00 0.41 -0.33 0.00 0.00 177.00 175.26 3h6o n GLY 518 N -1.78 -1.05 3.75 0.52 0.00 -1.26 -4.97 105.19 100.40 3h6o n GLY 518 Ca 0.07 -1.55 -0.37 0.00 0.00 0.00 0.00 46.02 44.17 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 -2.45 5.23 0.00 1.61 0.01 -1.26 -4.23 113.70 112.62 3h6o s SER 519 Ca 0.00 2.61 0.00 0.00 1.31 0.00 0.00 55.95 59.87 3h6o s SER 519 Cb 0.00 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.61 3h6o s SER 519 CO 0.00 -1.58 0.00 0.61 0.41 0.00 0.00 173.24 172.68 3h6o n GLY 520 N 0.69 0.89 0.04 3.44 0.00 -1.26 -4.96 105.19 104.02 3h6o n GLY 520 Ca 0.12 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.22 0.01 -1.65 1.61 3.72 -1.26 -4.93 117.46 112.75 3h6o n PHE 521 Ca 0.00 -0.68 -0.44 0.00 -0.05 0.00 0.00 57.45 56.27 3h6o n PHE 521 Cb 0.00 -0.09 -0.04 0.00 -0.94 0.00 0.00 39.48 38.42 3h6o n PHE 521 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3h6o n THR 522 N -0.83 0.64 -1.61 4.37 -1.04 -1.26 -3.14 114.28 111.40 3h6o n THR 522 Ca 0.06 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 3h6o n THR 522 Cb 0.40 -2.20 0.00 0.00 -1.82 0.00 0.00 70.33 66.71 3h6o n THR 522 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3h6o n ASN 523 N 7.93 0.00 -3.90 8.00 6.94 -1.03 -3.59 115.26 129.60 3h6o n ASN 523 Ca 0.23 -1.00 -0.27 0.00 -0.02 0.00 0.00 54.58 53.52 3h6o n ASN 523 Cb 0.37 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.63 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 1.06 -0.14 5.53 2.01 -0.54 -4.94 115.64 118.62 3h6o s THR 524 Ca 0.00 -0.41 0.02 0.00 0.31 0.00 0.00 61.69 61.61 3h6o s THR 524 Cb 0.00 -1.14 0.01 0.00 0.01 0.00 0.00 72.50 71.38 3h6o s THR 524 CO 0.00 0.28 -0.21 -0.32 -0.69 0.00 0.00 174.62 173.69 3h6o s MET 525 N 1.68 3.06 -0.01 4.92 1.75 -1.26 -1.14 119.30 128.30 3h6o s MET 525 Ca 0.03 -0.83 0.06 0.00 -1.25 0.00 0.00 55.69 53.70 3h6o s MET 525 Cb -0.13 -2.48 -0.01 0.00 2.84 0.00 0.00 34.83 35.04 3h6o s MET 525 CO -0.08 -0.01 -0.18 1.03 -0.65 0.00 0.00 175.02 175.13 3h6o s ARG 526 N 0.82 1.43 -0.39 4.11 0.52 -0.42 -4.98 118.95 120.05 3h6o s ARG 526 Ca -0.06 -0.65 -0.15 0.00 -0.52 0.00 0.00 55.73 54.34 3h6o s ARG 526 Cb -0.15 -1.39 0.01 0.00 0.52 0.00 0.00 34.95 33.93 3h6o s ARG 526 CO -0.02 0.38 0.30 0.08 0.02 0.00 0.00 175.30 176.07 3h6o s VAL 527 N -0.45 5.25 0.13 3.52 1.01 -1.26 -0.83 120.40 127.76 3h6o s VAL 527 Ca 0.07 -0.50 0.09 0.00 0.00 0.00 0.00 61.98 61.63 3h6o s VAL 527 Cb -0.07 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 3h6o s VAL 527 CO -0.01 -0.25 -0.21 0.68 0.00 0.00 0.00 175.10 175.32 3h6o s VAL 528 N 1.75 1.81 0.41 2.92 -7.23 -0.44 -4.97 120.40 114.65 3h6o s VAL 528 Ca 0.06 -1.69 -0.13 0.00 -1.81 0.00 0.00 61.98 58.42 3h6o s VAL 528 Cb -0.18 -1.70 -0.07 0.00 0.56 0.00 0.00 36.38 34.99 3h6o s VAL 528 CO 0.11 -0.12 0.81 -2.16 -0.31 0.00 0.00 175.10 173.42 3h6o s PRO 529 N -2.20 3.87 -0.06 4.82 0.04 -1.26 -0.74 135.00 139.47 3h6o s PRO 529 Ca 0.10 0.62 -0.30 0.00 0.04 0.00 0.00 61.00 61.46 3h6o s PRO 529 Cb -0.09 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 3h6o s PRO 529 CO 0.05 -0.04 1.35 0.08 0.04 0.00 0.00 177.00 178.48 3h6o s VAL 530 N -2.33 3.96 -2.00 -0.36 1.01 0.87 -4.89 120.40 116.66 3h6o s VAL 530 Ca 0.54 1.27 0.18 0.00 0.00 0.00 0.00 61.98 63.97 3h6o s VAL 530 Cb -0.10 -3.82 0.52 0.00 0.00 0.00 0.00 36.38 32.98 3h6o s VAL 530 CO 0.28 -0.04 1.48 -0.81 0.00 0.00 0.00 175.10 176.01