#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 1.49 -1.68 1.69 -4.23 -1.26 -3.92 115.64 107.72 3h6o s THR 15 Ca 0.00 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.37 3h6o s THR 15 Cb 0.00 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.79 3h6o s THR 15 CO 0.00 -0.59 0.00 1.67 -0.54 0.00 0.00 174.62 175.16 3h6o n GLN 16 N -0.34 -1.55 -2.99 3.99 7.27 0.11 -1.80 117.38 122.07 3h6o n GLN 16 Ca -0.08 0.94 -0.21 0.00 0.07 0.00 0.00 57.00 57.71 3h6o n GLN 16 Cb 0.61 -5.35 0.01 0.00 2.41 0.00 0.00 30.24 27.92 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 -2.36 -3.82 0.21 3.69 1.13 -1.26 -4.77 117.38 110.20 3h6o n GLN 17 Ca -0.18 0.75 0.08 0.00 -1.94 0.00 0.00 57.00 55.72 3h6o n GLN 17 Cb 0.58 -5.52 0.47 0.00 0.11 0.00 0.00 30.24 25.88 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 -0.96 0.00 0.44 1.08 3.38 -1.68 0.28 115.31 117.84 3h6o h LEU 18 Ca -0.47 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 3h6o h LEU 18 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 3h6o h LEU 18 CO 0.53 0.27 -0.21 -0.74 0.09 0.00 0.00 178.44 178.39 3h6o h HIS 19 N 0.00 -0.55 -0.69 1.13 2.76 -1.90 -2.94 115.15 112.97 3h6o h HIS 19 Ca -0.00 -0.01 0.13 0.00 -2.20 0.00 0.00 60.37 58.28 3h6o h HIS 19 Cb 0.69 0.18 -0.04 0.00 1.55 0.00 0.00 27.41 29.79 3h6o h HIS 19 CO 0.00 -0.23 0.46 0.00 -1.30 0.00 0.00 177.93 176.86 3h6o h ALA 20 N -0.40 2.07 -0.36 5.26 0.00 -1.69 -1.66 119.26 122.48 3h6o h ALA 20 Ca -0.06 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3h6o h ALA 20 Cb 0.56 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3h6o h ALA 20 CO 0.10 -0.24 0.24 0.00 0.00 0.00 0.00 179.25 179.35 3h6o h ALA 21 N 1.67 1.93 -0.00 0.00 0.00 -0.82 -2.21 119.26 119.83 3h6o h ALA 21 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3h6o h ALA 21 Cb 0.71 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3h6o h ALA 21 CO -0.10 0.02 -0.01 -1.33 0.00 0.00 0.00 179.25 177.83 3h6o n MET 22 N -4.48 0.11 -1.83 0.00 2.81 -0.63 -4.59 117.12 108.52 3h6o n MET 22 Ca 0.04 -0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.51 3h6o n MET 22 Cb 0.19 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.18 3h6o n MET 22 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3h6o s ALA 23 N -2.89 3.79 -1.03 3.04 0.00 -0.83 -4.90 121.76 118.92 3h6o s ALA 23 Ca 0.18 1.51 0.23 0.00 0.00 0.00 0.00 51.96 53.88 3h6o s ALA 23 Cb 0.19 -3.64 1.01 0.00 0.00 0.00 0.00 23.12 20.69 3h6o s ALA 23 CO 0.52 -0.90 1.75 -0.25 0.00 0.00 0.00 175.76 176.88 3h6o n ASP 24 N 2.98 0.00 -4.13 0.00 8.00 -1.26 -4.80 116.55 117.33 3h6o n ASP 24 Ca 0.11 0.45 -0.10 0.00 0.71 0.00 0.00 54.79 55.97 3h6o n ASP 24 Cb 0.37 -0.48 -0.10 0.00 -0.02 0.00 0.00 41.12 40.89 3h6o n ASP 24 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3h6o s THR 25 N -2.97 0.51 0.19 -3.53 -4.23 -1.26 -5.05 115.64 99.31 3h6o s THR 25 Ca 0.12 -1.81 -0.05 0.00 -1.18 0.00 0.00 61.69 58.77 3h6o s THR 25 Cb 0.15 -1.52 -0.01 0.00 1.34 0.00 0.00 72.50 72.46 3h6o s THR 25 CO 0.42 -0.87 1.56 0.15 -0.54 0.00 0.00 174.62 175.34 3h6o h PHE 26 N 3.17 0.86 0.11 3.99 3.04 -1.99 -1.68 116.94 124.45 3h6o h PHE 26 Ca -0.35 -0.24 0.01 0.00 3.98 0.00 0.00 57.97 61.37 3h6o h PHE 26 Cb 1.16 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.46 3h6o h PHE 26 CO 0.58 0.98 -0.18 1.25 -2.02 0.00 0.00 178.31 178.92 3h6o h LEU 27 N 0.61 -0.49 -1.58 0.59 5.85 -1.99 -0.80 115.31 117.50 3h6o h LEU 27 Ca 0.06 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 3h6o h LEU 27 Cb 0.89 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 3h6o h LEU 27 CO 0.08 -0.26 0.01 -0.08 -0.34 0.00 0.00 178.44 177.85 3h6o h GLU 28 N -0.35 0.27 -0.36 1.25 4.57 -1.96 -0.05 114.58 117.96 3h6o h GLU 28 Ca 0.02 -0.04 0.04 0.00 -1.18 0.00 0.00 59.36 58.21 3h6o h GLU 28 Cb 0.36 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 3h6o h GLU 28 CO -0.09 0.29 0.12 1.25 -1.18 0.00 0.00 179.01 179.40 3h6o h HIS 29 N 0.27 0.20 0.19 0.92 2.76 -0.74 -1.24 115.15 117.52 3h6o h HIS 29 Ca 0.07 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 3h6o h HIS 29 Cb 0.17 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.10 3h6o h HIS 29 CO 0.00 0.08 -0.09 0.52 -1.30 0.00 0.00 177.93 177.14 3h6o h MET 30 N 0.26 -0.24 -0.32 5.26 2.86 -0.04 -2.47 114.93 120.24 3h6o h MET 30 Ca 0.16 0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.91 3h6o h MET 30 Cb 0.15 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 3h6o h MET 30 CO -0.17 -0.15 0.38 0.00 1.06 0.00 0.00 176.91 178.03 3h6o n ARG 32 N -3.64 0.38 -1.77 0.00 1.74 -0.49 -4.93 116.66 107.95 3h6o n ARG 32 Ca 0.05 -0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.46 3h6o n ARG 32 Cb 0.53 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.45 3h6o n ARG 32 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3h6o s LEU 33 N -2.79 4.36 -0.18 0.55 1.43 -0.64 -4.43 118.68 116.99 3h6o s LEU 33 Ca 0.15 2.86 -0.02 0.00 -1.03 0.00 0.00 54.13 56.10 3h6o s LEU 33 Cb 0.18 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.84 3h6o s LEU 33 CO 0.66 -0.93 -0.00 -0.62 0.23 0.00 0.00 176.35 175.68 3h6o s ASP 34 N 0.94 2.84 0.56 2.29 3.68 -1.26 -5.00 116.67 120.71 3h6o s ASP 34 Ca 0.70 -0.73 0.34 0.00 2.13 0.00 0.00 52.55 54.99 3h6o s ASP 34 Cb -0.48 -0.74 1.61 0.00 -1.45 0.00 0.00 42.92 41.86 3h6o s ASP 34 CO 0.37 -0.25 2.09 0.16 0.13 0.00 0.00 175.17 177.67 3h6o h ILE 35 N 6.47 0.18 -0.40 4.11 3.07 -2.02 -1.76 117.51 127.17 3h6o h ILE 35 Ca -0.19 -0.45 0.00 0.00 1.55 0.00 0.00 64.86 65.77 3h6o h ILE 35 Cb 1.11 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 39.03 3h6o h ILE 35 CO 0.35 0.05 0.00 0.47 -1.05 0.00 0.00 178.15 177.97 3h6o n ASP 36 N -3.24 2.25 -4.28 2.16 10.43 -1.26 -4.76 116.55 117.84 3h6o n ASP 36 Ca -0.01 -2.03 -0.43 0.00 2.57 0.00 0.00 54.79 54.88 3h6o n ASP 36 Cb 0.24 -0.29 -0.07 0.00 1.84 0.00 0.00 41.12 42.84 3h6o n ASP 36 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3h6o s SER 37 N -0.96 5.94 0.40 -2.24 0.15 -0.66 -4.92 113.70 111.42 3h6o s SER 37 Ca 0.27 -1.72 -0.24 0.00 0.70 0.00 0.00 55.95 54.96 3h6o s SER 37 Cb 0.15 -2.11 -0.09 0.00 -1.71 0.00 0.00 66.02 62.26 3h6o s SER 37 CO 0.18 -0.73 1.07 -2.16 1.20 0.00 0.00 173.24 172.80 3h6o s PRO 38 N 1.50 4.13 1.19 5.44 0.05 -1.25 -4.32 135.00 141.75 3h6o s PRO 38 Ca 0.04 1.55 -0.19 0.00 0.05 0.00 0.00 61.00 62.45 3h6o s PRO 38 Cb -0.27 -2.55 0.28 0.00 0.05 0.00 0.00 34.50 32.02 3h6o s PRO 38 CO 0.02 -0.18 1.11 -1.25 0.05 0.00 0.00 177.00 176.75 3h6o s PRO 39 N -2.49 -1.16 1.02 0.56 0.04 -1.26 0.09 135.00 131.80 3h6o s PRO 39 Ca 0.58 -0.05 -0.17 0.00 0.04 0.00 0.00 61.00 61.40 3h6o s PRO 39 Cb -0.23 -1.60 0.24 0.00 0.04 0.00 0.00 34.50 32.94 3h6o s PRO 39 CO 0.29 -3.67 1.34 0.96 0.04 0.00 0.00 177.00 175.96 3h6o s ILE 40 N -3.01 1.96 -0.04 0.56 -4.36 -1.26 -4.71 121.20 110.34 3h6o s ILE 40 Ca 0.71 0.00 -0.25 0.00 -0.26 0.00 0.00 60.65 60.85 3h6o s ILE 40 Cb -0.10 -2.96 -0.22 0.00 1.25 0.00 0.00 42.46 40.43 3h6o s ILE 40 CO 0.56 0.00 1.10 0.74 0.24 0.00 0.00 174.94 177.58 3h6o h THR 41 N -1.86 1.51 -3.45 8.37 2.02 -1.94 -3.46 112.91 114.10 3h6o h THR 41 Ca -0.44 -1.72 -0.52 0.00 0.77 0.00 0.00 66.41 64.50 3h6o h THR 41 Cb 1.22 2.58 0.05 0.00 -1.74 0.00 0.00 68.15 70.25 3h6o h THR 41 CO 0.31 0.47 0.69 0.00 0.37 0.00 0.00 175.52 177.35 3h6o s ALA 42 N -3.44 3.56 -0.21 6.16 0.00 -1.26 -5.00 121.76 121.57 3h6o s ALA 42 Ca -0.16 1.21 -0.04 0.00 0.00 0.00 0.00 51.96 52.97 3h6o s ALA 42 Cb 0.01 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3h6o s ALA 42 CO 0.72 -0.62 -0.03 0.50 0.00 0.00 0.00 175.76 176.33 3h6o s ARG 43 N -0.44 3.47 0.07 0.00 3.00 -1.26 -4.94 118.95 118.86 3h6o s ARG 43 Ca 0.57 -0.58 0.18 0.00 -1.00 0.00 0.00 55.73 54.89 3h6o s ARG 43 Cb -0.39 -3.03 -0.12 0.00 0.00 0.00 0.00 34.95 31.40 3h6o s ARG 43 CO 0.42 -0.11 0.84 0.09 0.00 0.00 0.00 175.30 176.54 3h6o n ASN 44 N 4.56 0.84 -4.67 -2.12 3.02 -1.26 -4.87 115.26 110.76 3h6o n ASN 44 Ca -0.18 0.36 -0.43 0.00 -0.03 0.00 0.00 54.58 54.31 3h6o n ASN 44 Cb 0.51 0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.88 3h6o n ASN 44 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3h6o s THR 45 N -2.98 4.75 0.30 3.41 2.01 -1.26 -1.22 115.64 120.66 3h6o s THR 45 Ca -0.03 1.99 -0.29 0.00 0.31 0.00 0.00 61.69 63.67 3h6o s THR 45 Cb 0.09 -4.29 -0.10 0.00 0.01 0.00 0.00 72.50 68.20 3h6o s THR 45 CO 0.81 -0.06 1.42 -0.83 -0.69 0.00 0.00 174.62 175.26 3h6o s GLY 46 N 1.15 2.65 -0.28 4.40 0.00 -0.56 -4.87 107.32 109.80 3h6o s GLY 46 Ca 0.46 1.37 -0.08 0.00 0.00 0.00 0.00 44.72 46.47 3h6o s GLY 46 CO 0.13 2.18 0.11 -0.42 0.00 0.00 0.00 173.10 175.09 3h6o s ILE 47 N -0.60 4.41 -0.24 0.90 1.01 -1.26 -1.66 121.20 123.75 3h6o s ILE 47 Ca 0.55 -0.34 -0.09 0.00 0.00 0.00 0.00 60.65 60.77 3h6o s ILE 47 Cb -0.43 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 3h6o s ILE 47 CO 0.51 0.19 0.12 -0.63 0.00 0.00 0.00 174.94 175.12 3h6o s ILE 48 N 1.60 4.88 -0.17 2.92 1.01 -0.81 -1.14 121.20 129.49 3h6o s ILE 48 Ca 0.05 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.72 3h6o s ILE 48 Cb -0.16 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 39.04 3h6o s ILE 48 CO 0.05 0.34 -0.18 0.00 0.00 0.00 0.00 174.94 175.15 3h6o s THR 50 N 1.07 3.76 0.05 0.00 2.01 -0.21 -0.85 115.64 121.46 3h6o s THR 50 Ca -0.01 1.31 -0.09 0.00 0.31 0.00 0.00 61.69 63.21 3h6o s THR 50 Cb -0.14 -3.84 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 3h6o s THR 50 CO -0.06 0.13 0.36 -0.63 -0.69 0.00 0.00 174.62 173.73 3h6o s ILE 51 N 0.80 5.16 0.00 1.82 -1.09 -0.45 -1.81 121.20 125.62 3h6o s ILE 51 Ca 0.59 0.38 0.00 0.00 -2.23 0.00 0.00 60.65 59.39 3h6o s ILE 51 Cb -0.32 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 3h6o s ILE 51 CO 0.31 0.33 0.00 0.61 -1.23 0.00 0.00 174.94 174.96 3h6o n GLY 52 N 1.03 1.90 0.32 6.18 0.00 -1.22 -4.75 105.19 108.64 3h6o n GLY 52 Ca -0.09 -0.83 0.19 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.60 -1.18 132.00 130.94 3h6o h PRO 53 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 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 -0.11 0.00 -0.21 0.00 0.00 178.00 177.68 3h6o h ALA 54 N 1.95 1.00 0.00 -0.75 0.00 -0.94 -3.39 119.26 117.14 3h6o h ALA 54 Ca 0.01 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3h6o h ALA 54 Cb 0.07 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.70 3h6o h ALA 54 CO -0.00 0.13 -0.53 -1.13 0.00 0.00 0.00 179.25 177.72 3h6o n SER 55 N -3.22 0.11 -0.04 0.00 3.41 -0.50 -4.91 113.62 108.47 3h6o n SER 55 Ca 0.01 -1.81 0.02 0.00 -0.26 0.00 0.00 58.87 56.83 3h6o n SER 55 Cb 0.39 -0.09 -0.16 0.00 -0.26 0.00 0.00 64.21 64.09 3h6o n SER 55 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3h6o n ARG 56 N 0.15 0.70 -1.76 4.33 0.63 -0.89 -4.28 116.66 115.54 3h6o n ARG 56 Ca -0.04 -0.12 -0.34 0.00 -0.92 0.00 0.00 57.85 56.43 3h6o n ARG 56 Cb 0.80 -1.50 0.05 0.00 0.45 0.00 0.00 32.46 32.26 3h6o n ARG 56 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3h6o s SER 57 N -4.84 4.91 0.16 6.15 1.04 -1.26 -4.81 113.70 115.05 3h6o s SER 57 Ca -0.09 2.20 -0.16 0.00 0.48 0.00 0.00 55.95 58.38 3h6o s SER 57 Cb 0.10 -2.57 0.07 0.00 0.10 0.00 0.00 66.02 63.72 3h6o s SER 57 CO 0.85 -1.77 1.74 0.58 0.98 0.00 0.00 173.24 175.61 3h6o h VAL 58 N 0.22 0.84 -0.66 5.02 2.07 -1.93 -0.08 116.25 121.74 3h6o h VAL 58 Ca -0.48 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 66.97 3h6o h VAL 58 Cb 1.27 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 3h6o h VAL 58 CO 0.53 0.04 0.43 -0.33 0.02 0.00 0.00 177.57 178.26 3h6o h GLU 59 N 0.22 0.85 -0.10 1.57 3.07 -1.94 -0.88 114.58 117.36 3h6o h GLU 59 Ca 0.17 -0.05 -0.18 0.00 -0.50 0.00 0.00 59.36 58.80 3h6o h GLU 59 Cb 0.18 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 27.89 3h6o h GLU 59 CO -0.21 0.56 -0.68 1.15 -1.40 0.00 0.00 179.01 178.43 3h6o h THR 60 N 0.88 1.36 -0.61 1.13 2.02 -1.85 -3.04 112.91 112.80 3h6o h THR 60 Ca 0.24 -2.04 -0.03 0.00 0.77 0.00 0.00 66.41 65.35 3h6o h THR 60 Cb -0.09 2.02 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 3h6o h THR 60 CO -0.06 0.62 0.26 -0.07 0.37 0.00 0.00 175.52 176.64 3h6o h LEU 61 N 0.32 0.80 -0.34 2.58 3.38 -0.77 -0.53 115.31 120.74 3h6o h LEU 61 Ca -0.02 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.90 3h6o h LEU 61 Cb 1.25 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 3h6o h LEU 61 CO 0.12 0.70 0.10 0.11 0.09 0.00 0.00 178.44 179.56 3h6o h LYS 62 N 0.87 0.23 -0.15 1.13 1.57 -1.05 -0.29 116.57 118.89 3h6o h LYS 62 Ca 0.21 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.84 3h6o h LYS 62 Cb 0.14 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 3h6o h LYS 62 CO -0.02 0.15 -0.48 0.93 -0.57 0.00 0.00 179.45 179.46 3h6o h GLU 63 N 0.24 0.38 -0.96 3.15 4.39 -1.45 -0.59 114.58 119.74 3h6o h GLU 63 Ca 0.16 -0.21 0.08 0.00 0.34 0.00 0.00 59.36 59.72 3h6o h GLU 63 Cb 0.15 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.74 3h6o h GLU 63 CO -0.18 0.78 0.61 0.52 -1.16 0.00 0.00 179.01 179.58 3h6o h MET 64 N 0.30 1.04 -0.09 2.33 2.86 -0.68 0.24 114.93 120.93 3h6o h MET 64 Ca 0.02 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3h6o h MET 64 Cb 0.96 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 3h6o h MET 64 CO 0.08 0.69 -0.09 0.82 1.06 0.00 0.00 176.91 179.47 3h6o h ILE 65 N 1.07 1.36 0.00 -1.22 2.04 -0.47 -0.38 117.51 119.92 3h6o h ILE 65 Ca 0.43 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 3h6o h ILE 65 Cb 0.23 1.96 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 3h6o h ILE 65 CO -0.19 0.35 -0.12 0.11 0.00 0.00 0.00 178.15 178.30 3h6o h LYS 66 N -0.18 0.00 0.00 2.37 1.57 -0.83 -2.21 116.57 117.29 3h6o h LYS 66 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3h6o h LYS 66 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.91 3h6o h LYS 66 CO 0.02 0.12 -0.39 0.77 -0.57 0.00 0.00 179.45 179.40 3h6o h SER 67 N 0.00 0.00 0.00 0.86 0.02 -0.49 -3.48 113.55 110.46 3h6o h SER 67 Ca -0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 3h6o h SER 67 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 3h6o h SER 67 CO 0.02 0.04 0.00 0.61 -1.14 0.00 0.00 176.83 176.36 3h6o n GLY 68 N 1.26 0.26 3.70 -3.77 0.00 -0.83 -4.12 105.19 101.70 3h6o n GLY 68 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3h6o n GLY 68 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h6o s MET 69 N 0.00 4.25 -0.09 1.61 0.00 -0.18 -4.46 119.30 120.42 3h6o s MET 69 Ca 0.00 2.20 0.13 0.00 0.00 0.00 0.00 55.69 58.02 3h6o s MET 69 Cb 0.00 -3.42 -0.19 0.00 0.00 0.00 0.00 34.83 31.22 3h6o s MET 69 CO 0.00 -0.61 0.14 0.09 0.00 0.00 0.00 175.02 174.64 3h6o n ASN 70 N 4.83 1.70 -3.87 1.11 4.13 -0.29 -4.64 115.26 118.23 3h6o n ASN 70 Ca 0.14 0.00 -0.23 0.00 1.68 0.00 0.00 54.58 56.17 3h6o n ASN 70 Cb 0.41 1.12 -0.17 0.00 -1.54 0.00 0.00 39.78 39.60 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 -2.56 0.68 -0.39 2.41 1.01 -0.94 -0.88 120.40 119.74 3h6o s VAL 71 Ca -0.06 -0.13 -0.23 0.00 0.00 0.00 0.00 61.98 61.56 3h6o s VAL 71 Cb 0.06 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.71 3h6o s VAL 71 CO 0.57 0.29 0.76 0.00 0.00 0.00 0.00 175.10 176.71 3h6o s ALA 72 N 1.44 3.40 -0.19 5.51 0.00 -0.16 -0.16 121.76 131.59 3h6o s ALA 72 Ca -0.02 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 50.98 3h6o s ALA 72 Cb -0.13 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 3h6o s ALA 72 CO -0.03 -1.58 0.47 0.50 0.00 0.00 0.00 175.76 175.12 3h6o s ARG 73 N 3.08 4.21 -0.31 0.00 3.52 -0.03 0.05 118.95 129.47 3h6o s ARG 73 Ca 0.30 0.35 -0.09 0.00 -0.13 0.00 0.00 55.73 56.15 3h6o s ARG 73 Cb -0.13 -3.54 -0.00 0.00 -1.56 0.00 0.00 34.95 29.72 3h6o s ARG 73 CO 0.18 -0.07 0.15 -0.51 -0.81 0.00 0.00 175.30 174.24 3h6o s LEU 74 N 1.38 4.12 -0.31 -0.88 1.43 0.13 -1.34 118.68 123.20 3h6o s LEU 74 Ca 0.23 -0.58 -0.22 0.00 -1.03 0.00 0.00 54.13 52.53 3h6o s LEU 74 Cb -0.15 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.08 3h6o s LEU 74 CO 0.09 -0.21 0.72 0.21 0.23 0.00 0.00 176.35 177.39 3h6o s ASN 75 N 1.60 6.57 -0.03 2.29 3.84 -1.26 -0.90 114.94 127.04 3h6o s ASN 75 Ca 0.04 0.51 0.12 0.00 0.21 0.00 0.00 52.86 53.74 3h6o s ASN 75 Cb -0.17 -2.37 0.41 0.00 -0.55 0.00 0.00 41.25 38.57 3h6o s ASN 75 CO 0.06 -0.57 1.30 0.49 -2.79 0.00 0.00 177.10 175.59 3h6o n PHE 76 N 6.09 0.75 0.23 0.43 3.01 -0.12 -3.67 117.46 124.18 3h6o n PHE 76 Ca 0.02 -0.33 0.10 0.00 1.01 0.00 0.00 57.45 58.24 3h6o n PHE 76 Cb 0.48 -0.09 0.55 0.00 -0.01 0.00 0.00 39.48 40.42 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 2.52 0.00 -4.88 4.37 0.02 -1.85 -3.37 113.55 110.37 3h6o h SER 77 Ca 0.00 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 3h6o h SER 77 Cb 0.78 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.18 3h6o h SER 77 CO 0.07 0.22 -0.66 -1.00 -1.14 0.00 0.00 176.83 174.32 3h6o s HIS 78 N -3.95 1.00 0.00 3.45 3.76 -1.24 -5.01 115.29 113.30 3h6o s HIS 78 Ca -0.01 -1.08 0.00 0.00 -0.15 0.00 0.00 55.06 53.81 3h6o s HIS 78 Cb 0.12 -0.58 0.00 0.00 1.11 0.00 0.00 32.58 33.23 3h6o s HIS 78 CO 0.63 -0.32 0.00 0.41 -0.85 0.00 0.00 174.74 174.61 3h6o n GLY 79 N -0.14 -0.96 3.94 -2.22 0.00 -1.26 -4.88 105.19 99.67 3h6o n GLY 79 Ca -0.07 -1.40 -0.28 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.49 2.07 0.14 2.61 -4.23 -1.26 -4.89 115.64 107.58 3h6o s THR 80 Ca 0.00 -0.16 -0.13 0.00 -1.18 0.00 0.00 61.69 60.22 3h6o s THR 80 Cb 0.00 -2.90 -0.00 0.00 1.34 0.00 0.00 72.50 70.93 3h6o s THR 80 CO 0.00 0.00 1.57 0.45 -0.54 0.00 0.00 174.62 176.10 3h6o h HIS 81 N -1.20 0.92 -0.08 3.99 -0.00 -1.98 -1.27 115.15 115.53 3h6o h HIS 81 Ca -0.43 -0.18 -0.08 0.00 -0.00 0.00 0.00 60.37 59.68 3h6o h HIS 81 Cb 1.26 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 28.43 3h6o h HIS 81 CO -0.59 0.91 -0.33 1.05 -0.00 0.00 0.00 177.93 178.97 3h6o h GLU 82 N 0.67 0.16 -0.16 2.45 4.11 -1.98 0.25 114.58 120.07 3h6o h GLU 82 Ca 0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.49 3h6o h GLU 82 Cb 0.57 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3h6o h GLU 82 CO 0.03 0.47 0.07 -0.92 0.07 0.00 0.00 179.01 178.74 3h6o h TYR 83 N 0.14 0.24 -0.07 2.06 3.20 -1.89 -2.41 116.97 118.24 3h6o h TYR 83 Ca 0.02 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.74 3h6o h TYR 83 Cb 0.66 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 3h6o h TYR 83 CO 0.01 0.29 -0.54 0.45 -1.64 0.00 0.00 178.16 176.73 3h6o h HIS 84 N 0.12 0.24 -0.35 -3.82 3.86 -0.54 -2.34 115.15 112.33 3h6o h HIS 84 Ca 0.05 -0.08 -0.09 0.00 -1.16 0.00 0.00 60.37 59.09 3h6o h HIS 84 Cb 0.14 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 3h6o h HIS 84 CO -0.02 0.69 -0.17 0.00 0.86 0.00 0.00 177.93 179.29 3h6o h ALA 85 N 1.30 1.07 -0.07 2.45 0.00 -0.50 -1.83 119.26 121.67 3h6o h ALA 85 Ca 0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 3h6o h ALA 85 Cb 1.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3h6o h ALA 85 CO 0.08 0.57 -0.65 1.49 0.00 0.00 0.00 179.25 180.74 3h6o h GLU 86 N 0.57 0.30 0.12 0.00 4.81 -1.23 -1.40 114.58 117.74 3h6o h GLU 86 Ca 0.09 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 3h6o h GLU 86 Cb 0.61 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.03 3h6o h GLU 86 CO 0.04 0.85 -0.06 1.15 -0.73 0.00 0.00 179.01 180.26 3h6o h THR 87 N 0.21 0.93 -0.82 0.32 2.02 -1.19 -0.80 112.91 113.58 3h6o h THR 87 Ca -0.01 -0.15 0.06 0.00 0.77 0.00 0.00 66.41 67.08 3h6o h THR 87 Cb 1.19 1.02 -0.06 0.00 -1.74 0.00 0.00 68.15 68.56 3h6o h THR 87 CO 0.11 0.04 0.50 0.40 0.37 0.00 0.00 175.52 176.93 3h6o h ILE 88 N -0.22 1.03 0.11 3.11 2.04 -1.35 0.06 117.51 122.29 3h6o h ILE 88 Ca -0.02 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3h6o h ILE 88 Cb 0.18 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 3h6o h ILE 88 CO 0.03 0.17 -0.11 0.50 0.00 0.00 0.00 178.15 178.73 3h6o h LYS 89 N 0.92 -0.24 -0.95 2.37 3.64 -1.17 -1.90 116.57 119.24 3h6o h LYS 89 Ca 0.36 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.81 3h6o h LYS 89 Cb 0.17 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.99 3h6o h LYS 89 CO -0.17 -0.16 0.62 -0.91 -2.27 0.00 0.00 179.45 176.56 3h6o h ASN 90 N -0.25 1.00 -0.54 4.20 2.35 -0.57 0.15 115.58 121.91 3h6o h ASN 90 Ca 0.00 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 3h6o h ASN 90 Cb 0.24 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3h6o h ASN 90 CO -0.03 0.66 0.03 0.58 -1.65 0.00 0.00 177.43 177.02 3h6o h VAL 91 N 1.15 1.26 -0.16 2.81 2.07 -0.84 -1.64 116.25 120.90 3h6o h VAL 91 Ca 0.39 -1.06 -0.22 0.00 0.82 0.00 0.00 66.70 66.63 3h6o h VAL 91 Cb 0.10 0.87 0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3h6o h VAL 91 CO -0.14 0.38 -0.78 0.03 0.02 0.00 0.00 177.57 177.09 3h6o h ARG 92 N 0.82 0.80 -0.32 1.57 3.08 -0.83 -0.92 114.38 118.58 3h6o h ARG 92 Ca 0.16 -0.65 0.05 0.00 0.07 0.00 0.00 59.98 59.61 3h6o h ARG 92 Cb 0.49 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.63 3h6o h ARG 92 CO 0.02 1.25 0.02 1.15 -1.07 0.00 0.00 179.97 181.35 3h6o h THR 93 N 0.55 0.79 -0.65 2.04 2.02 -0.60 -0.53 112.91 116.54 3h6o h THR 93 Ca -0.05 -0.04 -0.07 0.00 0.77 0.00 0.00 66.41 67.02 3h6o h THR 93 Cb 1.40 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.45 3h6o h THR 93 CO 0.16 0.02 0.12 0.00 0.37 0.00 0.00 175.52 176.19 3h6o h ALA 94 N 1.27 0.86 -0.18 6.16 0.00 -1.25 -2.44 119.26 123.68 3h6o h ALA 94 Ca 0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3h6o h ALA 94 Cb 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3h6o h ALA 94 CO -0.24 0.60 -0.06 1.15 0.00 0.00 0.00 179.25 180.70 3h6o h THR 95 N 0.98 1.30 0.00 0.00 2.02 -0.96 -2.96 112.91 113.28 3h6o h THR 95 Ca 0.20 -1.07 0.00 0.00 0.77 0.00 0.00 66.41 66.30 3h6o h THR 95 Cb 0.41 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 3h6o h THR 95 CO 0.01 0.32 0.00 -0.62 0.37 0.00 0.00 175.52 175.60 3h6o n GLU 96 N -4.63 0.09 0.00 6.66 -0.58 -0.22 -2.61 120.64 119.35 3h6o n GLU 96 Ca -0.05 0.11 0.07 0.00 -0.42 0.00 0.00 57.16 56.87 3h6o n GLU 96 Cb 0.29 -1.50 0.31 0.00 -0.57 0.00 0.00 31.44 29.97 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 -1.44 0.00 -0.73 1.62 3.41 -0.92 -1.52 113.62 114.04 3h6o n SER 97 Ca 0.07 0.34 0.08 0.00 -0.26 0.00 0.00 58.87 59.10 3h6o n SER 97 Cb 0.23 -0.42 0.11 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.42 0.16 0.23 7.33 3.72 -1.07 -4.73 117.46 121.68 3h6o n PHE 98 Ca 0.04 -0.11 0.10 0.00 -0.05 0.00 0.00 57.45 57.43 3h6o n PHE 98 Cb 0.14 -0.00 0.55 0.00 -0.94 0.00 0.00 39.48 39.22 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 3.22 1.16 -0.90 4.37 0.00 -1.43 -3.26 119.26 122.42 3h6o h ALA 99 Ca 0.00 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 99 Cb 0.73 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 3h6o h ALA 99 CO 0.00 0.27 0.58 0.66 0.00 0.00 0.00 179.25 180.76 3h6o h SER 100 N 0.00 0.79 -3.70 0.00 4.64 -1.85 -3.29 113.55 110.14 3h6o h SER 100 Ca -0.00 0.03 -0.70 0.00 -0.47 0.00 0.00 61.79 60.65 3h6o h SER 100 Cb 0.58 -0.13 -0.34 0.00 -0.31 0.00 0.00 62.40 62.20 3h6o h SER 100 CO 0.03 0.45 -0.45 -0.62 -0.87 0.00 0.00 176.83 175.36 3h6o s ASP 101 N -5.88 5.32 0.59 4.97 -1.08 -1.23 -4.96 116.67 114.41 3h6o s ASP 101 Ca -0.11 -2.32 0.29 0.00 -0.52 0.00 0.00 52.55 49.89 3h6o s ASP 101 Cb 0.21 -1.86 1.64 0.00 -1.46 0.00 0.00 42.92 41.45 3h6o s ASP 101 CO 0.79 -0.50 2.07 -0.65 0.52 0.00 0.00 175.17 177.40 3h6o h PRO 102 N 7.73 0.00 -0.30 4.34 0.11 -1.83 -0.62 132.00 141.43 3h6o h PRO 102 Ca -0.09 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.94 3h6o h PRO 102 Cb 1.02 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3h6o h PRO 102 CO 0.72 0.00 -0.13 0.82 -0.21 0.00 0.00 178.00 179.20 3h6o h ILE 103 N 0.00 1.23 0.00 4.15 2.04 -1.93 -3.27 117.51 119.74 3h6o h ILE 103 Ca 0.10 -1.04 -0.24 0.00 1.00 0.00 0.00 64.86 64.67 3h6o h ILE 103 Cb 0.59 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.78 3h6o h ILE 103 CO -0.00 0.34 -2.20 0.18 0.00 0.00 0.00 178.15 176.47 3h6o n LEU 104 N -4.19 0.07 -4.71 1.44 4.77 -0.63 -4.66 117.00 109.08 3h6o n LEU 104 Ca 0.01 0.03 -0.64 0.00 -0.03 0.00 0.00 56.01 55.38 3h6o n LEU 104 Cb 0.33 0.32 -0.09 0.00 -2.33 0.00 0.00 43.42 41.65 3h6o n LEU 104 CO 0.41 0.32 1.12 0.00 -1.33 0.00 0.00 177.39 177.91 3h6o n TYR 105 N -2.61 1.70 -3.67 -1.77 9.36 -0.33 -4.95 117.16 114.89 3h6o n TYR 105 Ca -0.22 0.97 -0.37 0.00 3.32 0.00 0.00 57.90 61.59 3h6o n TYR 105 Cb 0.96 -2.28 -0.12 0.00 -0.63 0.00 0.00 39.34 37.28 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 2.71 3.84 0.39 2.98 0.52 -1.26 -4.80 118.95 123.33 3h6o s ARG 106 Ca 1.01 -0.38 -0.27 0.00 -0.52 0.00 0.00 55.73 55.57 3h6o s ARG 106 Cb -1.35 -3.51 -0.09 0.00 0.52 0.00 0.00 34.95 30.52 3h6o s ARG 106 CO 0.74 -0.16 1.37 -2.14 0.02 0.00 0.00 175.30 175.12 3h6o s PRO 107 N 1.65 4.03 -0.11 3.54 0.02 -1.26 -5.01 135.00 137.85 3h6o s PRO 107 Ca 0.07 2.31 0.01 0.00 0.02 0.00 0.00 61.00 63.41 3h6o s PRO 107 Cb -0.15 -2.85 0.02 0.00 0.02 0.00 0.00 34.50 31.53 3h6o s PRO 107 CO 0.08 -0.50 -0.12 0.08 -0.33 0.00 0.00 177.00 176.20 3h6o s VAL 108 N -1.19 1.32 0.56 3.83 1.01 -1.26 -4.85 120.40 119.81 3h6o s VAL 108 Ca 0.55 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 3h6o s VAL 108 Cb -0.41 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 3h6o s VAL 108 CO 0.54 0.41 0.90 0.00 0.00 0.00 0.00 175.10 176.95 3h6o s ALA 109 N 1.24 3.27 -0.16 5.51 0.00 -0.06 -4.91 121.76 126.65 3h6o s ALA 109 Ca -0.02 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3h6o s ALA 109 Cb -0.14 -2.73 0.02 0.00 0.00 0.00 0.00 23.12 20.27 3h6o s ALA 109 CO -0.05 -0.62 -0.18 0.08 0.00 0.00 0.00 175.76 175.00 3h6o s VAL 110 N -2.96 1.86 -0.17 0.00 1.01 -1.26 -0.99 120.40 117.89 3h6o s VAL 110 Ca 0.52 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.64 3h6o s VAL 110 Cb -0.11 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 3h6o s VAL 110 CO 0.47 0.51 -0.06 0.00 0.00 0.00 0.00 175.10 176.03 3h6o s ALA 111 N 1.29 2.86 -0.45 5.51 0.00 0.11 -1.52 121.76 129.56 3h6o s ALA 111 Ca 0.03 -0.96 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 3h6o s ALA 111 Cb -0.13 -1.55 0.04 0.00 0.00 0.00 0.00 23.12 21.48 3h6o s ALA 111 CO -0.10 -0.02 0.45 -1.17 0.00 0.00 0.00 175.76 174.92 3h6o s LEU 112 N 0.77 5.08 -0.28 0.00 0.20 -0.64 0.20 118.68 124.02 3h6o s LEU 112 Ca -0.02 -0.89 -0.17 0.00 0.69 0.00 0.00 54.13 53.74 3h6o s LEU 112 Cb -0.15 -2.33 -0.03 0.00 -0.43 0.00 0.00 46.19 43.26 3h6o s LEU 112 CO 0.02 -0.64 0.45 -0.62 -0.29 0.00 0.00 176.35 175.27 3h6o s ASP 113 N 2.14 6.33 0.39 3.68 3.68 -0.08 -1.01 116.67 131.81 3h6o s ASP 113 Ca 0.10 0.32 -0.22 0.00 2.13 0.00 0.00 52.55 54.88 3h6o s ASP 113 Cb -0.19 -2.25 -0.11 0.00 -1.45 0.00 0.00 42.92 38.92 3h6o s ASP 113 CO 0.11 -0.27 0.93 0.42 0.13 0.00 0.00 175.17 176.49 3h6o s THR 114 N 2.21 4.36 0.08 1.71 -4.23 -0.70 -0.94 115.64 118.14 3h6o s THR 114 Ca 0.18 1.54 -0.23 0.00 -1.18 0.00 0.00 61.69 62.01 3h6o s THR 114 Cb -0.16 -3.71 -0.14 0.00 1.34 0.00 0.00 72.50 69.84 3h6o s THR 114 CO 0.10 -0.19 1.66 0.50 -0.54 0.00 0.00 174.62 176.16 3h6o h LYS 115 N 2.27 0.07 -0.32 3.99 3.64 -1.92 -3.40 116.57 120.89 3h6o h LYS 115 Ca -0.48 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 58.93 3h6o h LYS 115 Cb 1.18 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 3h6o h LYS 115 CO 0.62 0.14 -0.06 0.41 -2.27 0.00 0.00 179.45 178.29 3h6o n GLY 116 N -0.86 -1.42 3.77 5.01 0.00 -1.26 -4.88 105.19 105.54 3h6o n GLY 116 Ca -0.06 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 3h6o n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h6o s PRO 117 N -1.25 4.30 0.13 1.61 0.04 -1.26 -4.82 135.00 133.75 3h6o s PRO 117 Ca 0.00 1.83 -0.00 0.00 0.04 0.00 0.00 61.00 62.86 3h6o s PRO 117 Cb 0.00 -2.87 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 3h6o s PRO 117 CO 0.00 -0.10 0.03 -1.21 0.04 0.00 0.00 177.00 175.75 3h6o s GLU 118 N -1.99 0.94 -0.19 4.56 2.02 -1.26 -5.00 118.70 117.79 3h6o s GLU 118 Ca 0.52 -1.44 -0.00 0.00 0.02 0.00 0.00 54.97 54.07 3h6o s GLU 118 Cb -0.31 0.07 0.01 0.00 0.10 0.00 0.00 34.13 34.00 3h6o s GLU 118 CO 0.39 -0.20 -0.15 0.42 0.02 0.00 0.00 175.26 175.74 3h6o s ILE 119 N -3.90 2.48 0.07 -1.63 1.01 -1.26 -4.92 121.20 113.05 3h6o s ILE 119 Ca 0.22 -0.80 0.08 0.00 0.00 0.00 0.00 60.65 60.15 3h6o s ILE 119 Cb 0.07 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 3h6o s ILE 119 CO 0.01 0.51 -0.20 -0.13 0.00 0.00 0.00 174.94 175.13 3h6o s ARG 120 N 1.27 1.91 0.67 2.79 1.81 -1.26 -1.02 118.95 125.11 3h6o s ARG 120 Ca 0.04 -1.08 -0.03 0.00 -1.72 0.00 0.00 55.73 52.94 3h6o s ARG 120 Cb -0.14 -2.12 0.08 0.00 -0.45 0.00 0.00 34.95 32.32 3h6o s ARG 120 CO -0.08 0.51 0.94 0.95 -0.68 0.00 0.00 175.30 176.94 3h6o s THR 121 N -0.98 2.35 0.00 0.02 -4.23 -0.88 -2.11 115.64 109.81 3h6o s THR 121 Ca 0.15 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.16 3h6o s THR 121 Cb -0.10 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.88 3h6o s THR 121 CO 0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 3h6o n GLY 122 N -2.74 1.29 3.82 3.99 0.00 -0.92 -3.35 105.19 107.27 3h6o n GLY 122 Ca 0.11 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 3h6o n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6o s LEU 123 N 0.00 4.48 0.00 0.99 1.43 -1.00 -1.78 118.68 122.80 3h6o s LEU 123 Ca 0.00 1.23 0.00 0.00 -1.03 0.00 0.00 54.13 54.33 3h6o s LEU 123 Cb 0.00 -3.00 0.00 0.00 0.03 0.00 0.00 46.19 43.22 3h6o s LEU 123 CO 0.00 0.23 0.00 -0.38 0.23 0.00 0.00 176.35 176.43 3h6o n ILE 124 N 1.48 0.00 0.00 -0.59 -0.00 -1.26 -0.73 119.36 118.25 3h6o n ILE 124 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.66 3h6o n ILE 124 Cb 0.51 -0.85 0.00 0.00 -0.00 0.00 0.00 39.64 39.30 3h6o n ILE 124 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3h6o n ALA 130 N -1.47 -2.04 -2.76 -1.39 0.00 -1.26 -4.20 120.51 107.40 3h6o n ALA 130 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 3h6o n ALA 130 Cb 0.00 -0.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.92 3h6o n ALA 130 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3h6o s GLU 131 N -4.65 0.51 -0.04 0.00 2.02 -1.26 -4.12 118.70 111.17 3h6o s GLU 131 Ca 0.00 -0.33 0.01 0.00 0.02 0.00 0.00 54.97 54.66 3h6o s GLU 131 Cb 0.00 -0.46 -0.03 0.00 0.10 0.00 0.00 34.13 33.74 3h6o s GLU 131 CO 0.00 0.12 -0.02 0.54 0.02 0.00 0.00 175.26 175.92 3h6o s VAL 132 N -0.39 4.06 -0.19 2.63 0.11 0.10 -4.93 120.40 121.78 3h6o s VAL 132 Ca 0.00 -0.51 -0.19 0.00 -2.93 0.00 0.00 61.98 58.36 3h6o s VAL 132 Cb -0.04 -2.75 -0.03 0.00 -1.53 0.00 0.00 36.38 32.03 3h6o s VAL 132 CO -0.00 0.48 0.54 -0.70 -3.33 0.00 0.00 175.10 172.09 3h6o s GLU 133 N -1.23 4.20 -0.19 1.54 2.56 -1.26 0.38 118.70 124.70 3h6o s GLU 133 Ca 0.16 0.45 -0.12 0.00 0.00 0.00 0.00 54.97 55.47 3h6o s GLU 133 Cb -0.11 -3.56 -0.05 0.00 2.00 0.00 0.00 34.13 32.41 3h6o s GLU 133 CO 0.06 -0.15 0.20 -0.48 -0.56 0.00 0.00 175.26 174.34 3h6o s LEU 134 N 1.64 4.20 -0.17 2.70 2.34 -0.70 -4.83 118.68 123.86 3h6o s LEU 134 Ca 0.25 0.32 -0.19 0.00 0.06 0.00 0.00 54.13 54.57 3h6o s LEU 134 Cb -0.15 -2.21 -0.03 0.00 -0.56 0.00 0.00 46.19 43.23 3h6o s LEU 134 CO 0.10 0.12 0.54 -0.54 -1.06 0.00 0.00 176.35 175.51 3h6o s LYS 135 N 0.58 4.25 -0.09 1.48 -0.14 -1.26 -2.40 119.74 122.16 3h6o s LYS 135 Ca 0.11 0.50 -0.36 0.00 -1.36 0.00 0.00 55.97 54.86 3h6o s LYS 135 Cb -0.12 -3.52 -0.13 0.00 -1.68 0.00 0.00 37.83 32.37 3h6o s LYS 135 CO 0.02 -0.07 1.75 1.63 -0.76 0.00 0.00 175.35 177.92 3h6o n LYS 136 N 4.48 1.82 -0.02 1.68 5.02 -1.26 -0.87 118.16 129.01 3h6o n LYS 136 Ca -0.04 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 3h6o n LYS 136 Cb 0.51 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 33.08 3h6o n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h6o n GLY 137 N 4.04 0.31 3.85 0.72 0.00 0.22 -5.00 105.19 109.33 3h6o n GLY 137 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3h6o n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o s ALA 138 N -2.10 2.66 0.23 4.61 0.00 -0.05 -4.72 121.76 122.38 3h6o s ALA 138 Ca 0.00 -0.22 -0.18 0.00 0.00 0.00 0.00 51.96 51.57 3h6o s ALA 138 Cb 0.00 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.96 3h6o s ALA 138 CO 0.00 -1.32 0.69 0.99 0.00 0.00 0.00 175.76 176.12 3h6o s THR 139 N -3.23 4.65 -0.04 0.00 2.01 -1.26 -1.74 115.64 116.03 3h6o s THR 139 Ca 0.59 1.13 -0.02 0.00 0.31 0.00 0.00 61.69 63.70 3h6o s THR 139 Cb -0.13 -3.79 0.03 0.00 0.01 0.00 0.00 72.50 68.63 3h6o s THR 139 CO 0.53 0.14 0.09 -0.22 -0.69 0.00 0.00 174.62 174.47 3h6o s LEU 140 N -2.17 1.01 -0.22 4.42 2.96 -0.40 -4.72 118.68 119.56 3h6o s LEU 140 Ca 0.44 0.17 -0.12 0.00 -0.22 0.00 0.00 54.13 54.40 3h6o s LEU 140 Cb -0.15 0.17 -0.05 0.00 0.50 0.00 0.00 46.19 46.66 3h6o s LEU 140 CO 0.20 -0.12 0.21 -1.59 -1.32 0.00 0.00 176.35 173.73 3h6o s LYS 141 N 0.97 4.13 -0.03 1.98 -2.85 -0.78 -0.73 119.74 122.43 3h6o s LYS 141 Ca -0.08 -0.14 -0.23 0.00 -1.00 0.00 0.00 55.97 54.53 3h6o s LYS 141 Cb -0.11 -3.51 -0.05 0.00 -2.06 0.00 0.00 37.83 32.11 3h6o s LYS 141 CO -0.04 0.10 0.67 0.42 0.10 0.00 0.00 175.35 176.59 3h6o s ILE 142 N 0.94 4.95 0.03 3.79 -1.09 -0.20 -0.54 121.20 129.09 3h6o s ILE 142 Ca 0.11 1.39 0.06 0.00 -2.23 0.00 0.00 60.65 59.97 3h6o s ILE 142 Cb -0.13 -4.01 -0.02 0.00 -1.58 0.00 0.00 42.46 36.72 3h6o s ILE 142 CO 0.04 0.33 -0.17 0.28 -1.23 0.00 0.00 174.94 174.20 3h6o s THR 143 N 0.30 1.32 -2.66 2.92 -1.32 0.06 -1.70 115.64 114.57 3h6o s THR 143 Ca 0.35 -1.02 0.22 0.00 -1.21 0.00 0.00 61.69 60.03 3h6o s THR 143 Cb -0.18 -1.17 0.21 0.00 -1.51 0.00 0.00 72.50 69.85 3h6o s THR 143 CO 0.18 0.13 1.22 0.18 -2.21 0.00 0.00 174.62 174.12 3h6o n LEU 144 N 2.00 2.92 -4.61 9.08 4.77 -0.56 -2.43 117.00 128.17 3h6o n LEU 144 Ca -0.17 -1.09 -0.43 0.00 -0.03 0.00 0.00 56.01 54.29 3h6o n LEU 144 Cb 0.54 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 3h6o n LEU 144 CO 0.23 0.52 1.26 -0.62 -1.33 0.00 0.00 177.39 177.45 3h6o s ASP 145 N -1.76 6.35 0.00 -1.43 2.15 -1.26 -4.91 116.67 115.81 3h6o s ASP 145 Ca 0.27 1.01 0.02 0.00 0.43 0.00 0.00 52.55 54.29 3h6o s ASP 145 Cb 0.19 -2.54 0.08 0.00 -0.30 0.00 0.00 42.92 40.35 3h6o s ASP 145 CO 0.28 -1.38 1.01 0.59 -0.17 0.00 0.00 175.17 175.50 3h6o n ASN 146 N 8.72 0.00 0.20 -0.34 3.02 -1.26 -1.97 115.26 123.64 3h6o n ASN 146 Ca 0.17 0.44 0.06 0.00 -0.03 0.00 0.00 54.58 55.22 3h6o n ASN 146 Cb 0.47 -0.45 0.42 0.00 -0.61 0.00 0.00 39.78 39.61 3h6o n ASN 146 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h6o h ALA 147 N 2.07 1.15 -0.52 5.41 0.00 -2.00 -2.38 119.26 123.00 3h6o h ALA 147 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3h6o h ALA 147 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3h6o h ALA 147 CO 0.00 0.41 0.00 2.48 0.00 0.00 0.00 179.25 182.14 3h6o n TYR 148 N -3.71 0.69 -0.13 0.00 0.18 -0.83 -4.55 117.16 108.81 3h6o n TYR 148 Ca -0.01 -0.34 0.06 0.00 1.88 0.00 0.00 57.90 59.49 3h6o n TYR 148 Cb 0.43 0.00 0.38 0.00 -0.38 0.00 0.00 39.34 39.77 3h6o n TYR 148 CO 0.00 0.00 0.00 1.98 -2.08 0.00 0.00 176.86 176.76 3h6o h MET 149 N 3.10 0.66 0.00 -3.48 -1.53 -1.56 -2.38 114.93 109.74 3h6o h MET 149 Ca 0.00 -0.04 -0.00 0.00 -3.44 0.00 0.00 59.70 56.22 3h6o h MET 149 Cb 0.71 -0.15 -0.00 0.00 -0.55 0.00 0.00 31.60 31.61 3h6o h MET 149 CO 0.00 0.44 -0.24 0.39 0.14 0.00 0.00 176.91 177.64 3h6o n GLU 150 N -4.47 1.41 -2.56 0.39 1.02 -1.26 -2.37 120.64 112.80 3h6o n GLU 150 Ca 0.09 -2.90 -0.12 0.00 -0.02 0.00 0.00 57.16 54.20 3h6o n GLU 150 Cb 0.20 -1.54 0.03 0.00 -0.02 0.00 0.00 31.44 30.11 3h6o n GLU 150 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3h6o n LYS 151 N -1.28 2.23 -2.53 3.49 5.02 -0.90 -4.68 118.16 119.51 3h6o n LYS 151 Ca 0.17 -3.74 -0.40 0.00 -2.02 0.00 0.00 58.31 52.32 3h6o n LYS 151 Cb 0.67 -1.75 -0.05 0.00 -0.02 0.00 0.00 35.03 33.88 3h6o n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h6o n ASP 153 N 1.06 -0.23 0.00 0.00 5.68 0.80 -4.30 116.55 119.56 3h6o n ASP 153 Ca -0.00 -1.26 0.07 0.00 -0.50 0.00 0.00 54.79 53.09 3h6o n ASP 153 Cb 0.46 0.41 0.33 0.00 -1.14 0.00 0.00 41.12 41.17 3h6o n ASP 153 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3h6o n GLU 154 N -0.08 0.07 -0.10 0.11 -0.00 -1.26 -2.91 120.64 116.47 3h6o n GLU 154 Ca -0.00 0.22 -0.12 0.00 -0.00 0.00 0.00 57.16 57.26 3h6o n GLU 154 Cb 0.09 -1.50 -0.12 0.00 -0.00 0.00 0.00 31.44 29.90 3h6o n GLU 154 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3h6o n ASN 155 N -1.43 1.39 -3.84 -1.84 3.02 -1.26 -4.69 115.26 106.62 3h6o n ASN 155 Ca 0.05 -0.05 -0.16 0.00 -0.03 0.00 0.00 54.58 54.38 3h6o n ASN 155 Cb 0.15 0.35 -0.16 0.00 -0.61 0.00 0.00 39.78 39.52 3h6o n ASN 155 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h6o s ILE 156 N -2.43 0.16 -0.06 2.41 -1.09 -1.14 -1.87 121.20 117.17 3h6o s ILE 156 Ca -0.18 0.05 0.01 0.00 -2.23 0.00 0.00 60.65 58.29 3h6o s ILE 156 Cb 0.06 -0.23 0.02 0.00 -1.58 0.00 0.00 42.46 40.73 3h6o s ILE 156 CO 0.63 0.12 -0.05 -0.22 -1.23 0.00 0.00 174.94 174.19 3h6o s LEU 157 N 0.77 1.20 -0.12 2.97 2.96 0.30 -0.14 118.68 126.62 3h6o s LEU 157 Ca -0.08 -0.15 -0.09 0.00 -0.22 0.00 0.00 54.13 53.59 3h6o s LEU 157 Cb -0.11 -0.52 -0.04 0.00 0.50 0.00 0.00 46.19 46.02 3h6o s LEU 157 CO -0.01 -0.08 0.18 0.86 -1.32 0.00 0.00 176.35 175.98 3h6o s TRP 158 N 1.18 3.58 0.29 5.38 -0.00 -1.26 -0.76 118.94 127.35 3h6o s TRP 158 Ca -0.07 0.57 0.10 0.00 -0.00 0.00 0.00 56.10 56.71 3h6o s TRP 158 Cb -0.14 -2.04 -0.05 0.00 -0.00 0.00 0.00 33.47 31.24 3h6o s TRP 158 CO -0.01 0.64 -0.09 -0.51 -0.00 0.00 0.00 176.95 176.97 3h6o s LEU 159 N -0.77 2.88 -0.01 5.86 1.43 -1.02 -2.17 118.68 124.88 3h6o s LEU 159 Ca 0.15 -0.90 0.20 0.00 -1.03 0.00 0.00 54.13 52.56 3h6o s LEU 159 Cb -0.13 -1.35 0.59 0.00 0.03 0.00 0.00 46.19 45.33 3h6o s LEU 159 CO 0.04 -0.03 1.49 -0.90 0.23 0.00 0.00 176.35 177.18 3h6o n ASP 160 N -0.78 3.81 -4.35 2.29 5.68 -0.90 -4.71 116.55 117.59 3h6o n ASP 160 Ca -0.05 -2.02 -0.46 0.00 -0.50 0.00 0.00 54.79 51.75 3h6o n ASP 160 Cb 0.60 -0.45 -0.04 0.00 -1.14 0.00 0.00 41.12 40.10 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 -1.05 3.32 -0.86 2.11 6.04 -1.26 -4.91 117.35 120.74 3h6o s TYR 161 Ca 0.44 -1.41 0.16 0.00 0.04 0.00 0.00 57.07 56.31 3h6o s TYR 161 Cb 0.23 -3.91 0.68 0.00 -1.04 0.00 0.00 41.96 37.93 3h6o s TYR 161 CO 0.30 -1.13 1.50 1.63 -1.54 0.00 0.00 175.55 176.31 3h6o n LYS 162 N 5.30 0.05 -0.27 4.97 5.02 -1.26 -2.53 118.16 129.44 3h6o n LYS 162 Ca -0.02 0.31 0.08 0.00 -2.02 0.00 0.00 58.31 56.67 3h6o n LYS 162 Cb 0.43 -1.60 0.22 0.00 -0.02 0.00 0.00 35.03 34.07 3h6o n LYS 162 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3h6o n ASN 163 N -1.69 3.39 -0.19 4.39 2.85 -1.26 -4.71 115.26 118.02 3h6o n ASN 163 Ca 0.03 -2.07 0.10 0.00 -0.11 0.00 0.00 54.58 52.53 3h6o n ASN 163 Cb 0.17 -0.34 0.40 0.00 1.24 0.00 0.00 39.78 41.25 3h6o n ASN 163 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 3h6o h ILE 164 N 2.81 0.91 0.00 -1.44 2.10 -1.92 -1.09 117.51 118.87 3h6o h ILE 164 Ca 0.00 -0.22 -0.05 0.00 1.08 0.00 0.00 64.86 65.67 3h6o h ILE 164 Cb 0.88 0.22 -0.01 0.00 -1.09 0.00 0.00 36.82 36.82 3h6o h ILE 164 CO 0.02 0.12 -0.24 0.00 -1.08 0.00 0.00 178.15 176.97 3h6o h LYS 166 N 0.00 0.00 -0.01 0.00 -0.00 -1.56 -3.34 116.57 111.66 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 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.67 3h6o h LYS 166 CO 0.03 0.05 -0.09 1.33 -0.00 0.00 0.00 179.45 180.77 3h6o n VAL 167 N -3.13 0.00 -4.46 0.07 0.24 -0.97 -4.99 118.33 105.08 3h6o n VAL 167 Ca 0.02 -0.45 -0.24 0.00 -2.04 0.00 0.00 64.34 61.63 3h6o n VAL 167 Cb 0.44 1.20 -0.10 0.00 -1.47 0.00 0.00 33.84 33.91 3h6o n VAL 167 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3h6o s VAL 168 N -1.19 2.50 0.11 3.34 -7.23 -1.07 -4.46 120.40 112.40 3h6o s VAL 168 Ca 0.12 -2.37 0.03 0.00 -1.81 0.00 0.00 61.98 57.96 3h6o s VAL 168 Cb 0.10 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 3h6o s VAL 168 CO 0.20 -0.38 -0.09 -1.61 -0.31 0.00 0.00 175.10 172.91 3h6o s GLU 169 N -3.45 0.89 0.07 4.82 8.01 -1.26 -4.92 118.70 122.85 3h6o s GLU 169 Ca 0.29 -1.27 -0.36 0.00 0.01 0.00 0.00 54.97 53.64 3h6o s GLU 169 Cb -0.05 -0.46 -0.16 0.00 -4.31 0.00 0.00 34.13 29.14 3h6o s GLU 169 CO 0.15 0.05 1.43 1.33 0.01 0.00 0.00 175.26 178.23 3h6o n VAL 170 N 0.24 0.03 0.00 2.63 0.24 -1.26 0.11 118.33 120.32 3h6o n VAL 170 Ca -0.14 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 3h6o n VAL 170 Cb 0.59 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.95 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 3.28 3.76 7.63 0.00 0.20 -4.99 105.19 117.92 3h6o n GLY 171 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3h6o n GLY 171 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6o s SER 172 N -0.39 5.29 -0.03 1.61 0.01 0.12 -4.67 113.70 115.63 3h6o s SER 172 Ca 0.00 2.27 -0.01 0.00 1.31 0.00 0.00 55.95 59.52 3h6o s SER 172 Cb 0.00 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 3h6o s SER 172 CO 0.00 -1.52 0.06 -0.54 0.41 0.00 0.00 173.24 171.66 3h6o s LYS 173 N -3.44 3.06 -0.07 12.44 1.02 -1.26 -1.01 119.74 130.47 3h6o s LYS 173 Ca 0.74 -0.45 0.02 0.00 0.02 0.00 0.00 55.97 56.31 3h6o s LYS 173 Cb -0.27 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 34.20 3h6o s LYS 173 CO 0.33 0.67 -0.12 0.42 -0.92 0.00 0.00 175.35 175.73 3h6o s ILE 174 N -1.10 1.15 -0.12 2.17 1.01 0.19 -3.72 121.20 120.78 3h6o s ILE 174 Ca 0.20 -0.48 -0.01 0.00 0.00 0.00 0.00 60.65 60.36 3h6o s ILE 174 Cb -0.12 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.27 3h6o s ILE 174 CO 0.10 0.36 -0.08 -0.31 0.00 0.00 0.00 174.94 175.01 3h6o s TYR 175 N 0.72 2.92 0.03 3.97 4.12 -0.34 -0.13 117.35 128.63 3h6o s TYR 175 Ca -0.14 -0.32 0.09 0.00 0.02 0.00 0.00 57.07 56.72 3h6o s TYR 175 Cb -0.16 -1.84 -0.03 0.00 -1.52 0.00 0.00 41.96 38.42 3h6o s TYR 175 CO 0.03 0.01 -0.25 0.08 0.02 0.00 0.00 175.55 175.44 3h6o s VAL 176 N 0.00 2.04 -0.74 0.71 1.01 -0.03 -1.31 120.40 122.08 3h6o s VAL 176 Ca -0.01 -1.27 -0.01 0.00 0.00 0.00 0.00 61.98 60.69 3h6o s VAL 176 Cb -0.14 -1.73 0.00 0.00 0.00 0.00 0.00 36.38 34.51 3h6o s VAL 176 CO 0.03 0.41 0.69 -0.67 0.00 0.00 0.00 175.10 175.56 3h6o n ASP 177 N 1.99 -7.51 -4.12 3.32 4.64 0.14 -1.38 116.55 113.64 3h6o n ASP 177 Ca -0.17 -0.15 -0.32 0.00 -1.38 0.00 0.00 54.79 52.78 3h6o n ASP 177 Cb 0.52 -4.94 -0.05 0.00 -1.04 0.00 0.00 41.12 35.61 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 -1.82 -0.64 0.00 1.67 9.92 -1.24 -1.62 116.55 122.82 3h6o n ASP 178 Ca -0.03 -1.18 0.00 0.00 -0.53 0.00 0.00 54.79 53.05 3h6o n ASP 178 Cb 0.52 -2.19 0.00 0.00 -0.64 0.00 0.00 41.12 38.81 3h6o n ASP 178 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3h6o n GLY 179 N -2.26 0.55 0.19 0.44 0.00 -1.23 -4.89 105.19 97.98 3h6o n GLY 179 Ca -0.27 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 3h6o n GLY 179 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h6o h LEU 180 N 0.00 0.55 -9.30 0.99 3.38 -0.99 -3.42 115.31 106.52 3h6o h LEU 180 Ca 0.00 -0.24 -0.66 0.00 0.09 0.00 0.00 57.88 57.06 3h6o h LEU 180 Cb 0.13 -0.14 -0.14 0.00 0.09 0.00 0.00 40.66 40.60 3h6o h LEU 180 CO 0.00 0.65 -0.58 -0.63 0.09 0.00 0.00 178.44 177.97 3h6o s ILE 181 N -5.25 4.62 -0.17 1.22 1.01 -0.48 -4.78 121.20 117.37 3h6o s ILE 181 Ca -0.13 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.41 3h6o s ILE 181 Cb 0.09 -2.99 0.02 0.00 0.01 0.00 0.00 42.46 39.59 3h6o s ILE 181 CO 0.76 0.57 -0.20 -0.55 0.00 0.00 0.00 174.94 175.53 3h6o s SER 182 N -0.60 3.20 0.08 3.58 0.15 -0.94 -0.86 113.70 118.30 3h6o s SER 182 Ca 0.11 -0.62 0.07 0.00 0.70 0.00 0.00 55.95 56.21 3h6o s SER 182 Cb -0.12 -1.49 -0.04 0.00 -1.71 0.00 0.00 66.02 62.67 3h6o s SER 182 CO 0.02 0.02 -0.15 -0.76 1.20 0.00 0.00 173.24 173.57 3h6o s LEU 183 N 1.18 2.79 -0.16 3.45 1.43 0.82 -0.63 118.68 127.57 3h6o s LEU 183 Ca 0.02 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.69 3h6o s LEU 183 Cb -0.14 -1.63 0.02 0.00 0.03 0.00 0.00 46.19 44.47 3h6o s LEU 183 CO -0.10 0.21 -0.20 -1.58 0.23 0.00 0.00 176.35 174.92 3h6o s GLN 184 N -1.88 2.87 0.02 1.70 0.74 -0.03 -0.63 119.66 122.45 3h6o s GLN 184 Ca 0.18 -0.79 -0.30 0.00 0.05 0.00 0.00 55.36 54.50 3h6o s GLN 184 Cb -0.11 -2.44 -0.08 0.00 1.10 0.00 0.00 33.01 31.48 3h6o s GLN 184 CO 0.09 -0.15 1.81 0.08 -0.55 0.00 0.00 175.29 176.57 3h6o s VAL 185 N 1.17 3.16 -0.07 1.34 1.01 -0.18 -1.13 120.40 125.70 3h6o s VAL 185 Ca 0.01 0.30 0.15 0.00 0.00 0.00 0.00 61.98 62.44 3h6o s VAL 185 Cb -0.14 -3.20 -0.22 0.00 0.00 0.00 0.00 36.38 32.83 3h6o s VAL 185 CO -0.09 -0.02 0.23 0.29 0.00 0.00 0.00 175.10 175.51 3h6o n LYS 186 N 6.98 0.93 -3.68 2.72 4.76 0.17 0.61 118.16 130.66 3h6o n LYS 186 Ca 0.18 -0.09 -0.14 0.00 -2.87 0.00 0.00 58.31 55.39 3h6o n LYS 186 Cb 0.41 -1.38 -0.08 0.00 -1.84 0.00 0.00 35.03 32.14 3h6o n LYS 186 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3h6o s GLN 187 N -2.80 0.68 -0.02 1.97 -1.52 -0.96 -4.89 119.66 112.12 3h6o s GLN 187 Ca -0.06 0.56 0.05 0.00 -1.95 0.00 0.00 55.36 53.95 3h6o s GLN 187 Cb 0.08 0.32 -0.03 0.00 -0.22 0.00 0.00 33.01 33.17 3h6o s GLN 187 CO 0.64 -0.12 -0.16 0.15 -0.25 0.00 0.00 175.29 175.55 3h6o s LYS 188 N -0.10 2.36 0.00 2.91 1.02 -1.26 -0.35 119.74 124.32 3h6o s LYS 188 Ca -0.03 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.17 3h6o s LYS 188 Cb -0.03 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.97 3h6o s LYS 188 CO 0.02 0.60 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 3h6o n GLY 189 N 2.10 1.54 0.68 -3.33 0.00 0.88 -4.99 105.19 102.06 3h6o n GLY 189 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 3h6o n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o n ALA 190 N -3.00 2.09 -1.80 4.61 0.00 -1.26 -4.80 120.51 116.35 3h6o n ALA 190 Ca 0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 3h6o n ALA 190 Cb 0.00 0.08 0.11 0.00 0.00 0.00 0.00 19.45 19.65 3h6o n ALA 190 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3h6o n ASP 191 N -3.15 3.38 -3.53 0.00 3.85 -1.26 -4.90 116.55 110.94 3h6o n ASP 191 Ca -0.02 -3.83 -0.13 0.00 -0.71 0.00 0.00 54.79 50.09 3h6o n ASP 191 Cb 0.09 -0.44 -0.04 0.00 -1.35 0.00 0.00 41.12 39.37 3h6o n ASP 191 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 3h6o s PHE 192 N -3.42 -0.46 0.07 2.11 -0.12 -1.26 -1.50 117.98 113.39 3h6o s PHE 192 Ca 0.45 0.45 0.06 0.00 -0.05 0.00 0.00 56.93 57.84 3h6o s PHE 192 Cb 0.39 0.40 -0.03 0.00 -0.63 0.00 0.00 43.02 43.16 3h6o s PHE 192 CO -0.01 -0.70 -0.15 -0.51 -0.05 0.00 0.00 175.22 173.79 3h6o s LEU 193 N -2.18 2.27 -0.21 -1.99 1.43 -0.69 -0.08 118.68 117.22 3h6o s LEU 193 Ca -0.03 -0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 52.42 3h6o s LEU 193 Cb -0.00 -0.59 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 3h6o s LEU 193 CO -0.05 -0.04 -0.05 0.54 0.23 0.00 0.00 176.35 176.98 3h6o s VAL 194 N -1.21 3.33 0.26 -1.59 0.11 0.52 -1.03 120.40 120.80 3h6o s VAL 194 Ca -0.00 -0.51 0.11 0.00 -2.93 0.00 0.00 61.98 58.65 3h6o s VAL 194 Cb -0.10 -2.50 -0.05 0.00 -1.53 0.00 0.00 36.38 32.20 3h6o s VAL 194 CO 0.02 0.43 -0.14 0.42 -3.33 0.00 0.00 175.10 172.51 3h6o s THR 195 N 1.39 2.79 -0.15 5.04 -4.23 0.10 0.44 115.64 121.02 3h6o s THR 195 Ca 0.05 -2.20 -0.04 0.00 -1.18 0.00 0.00 61.69 58.32 3h6o s THR 195 Cb -0.14 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.21 3h6o s THR 195 CO -0.03 -0.36 -0.03 -0.70 -0.54 0.00 0.00 174.62 172.96 3h6o s GLU 196 N -3.47 3.63 -0.36 3.99 2.12 -0.28 -1.28 118.70 123.06 3h6o s GLU 196 Ca 0.30 -0.51 -0.29 0.00 0.36 0.00 0.00 54.97 54.83 3h6o s GLU 196 Cb -0.06 -2.91 -0.00 0.00 0.26 0.00 0.00 34.13 31.42 3h6o s GLU 196 CO 0.16 0.28 1.48 0.08 -0.54 0.00 0.00 175.26 176.72 3h6o s VAL 197 N 0.27 3.85 -0.06 3.70 1.01 -0.71 -0.85 120.40 127.61 3h6o s VAL 197 Ca -0.03 0.89 -0.08 0.00 0.00 0.00 0.00 61.98 62.76 3h6o s VAL 197 Cb -0.14 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 3h6o s VAL 197 CO 0.03 -0.61 0.34 -0.33 0.00 0.00 0.00 175.10 174.53 3h6o h GLU 198 N 10.85 -0.27 -4.78 2.72 5.08 -1.22 0.64 114.58 127.60 3h6o h GLU 198 Ca -0.29 0.02 -0.68 0.00 -1.00 0.00 0.00 59.36 57.41 3h6o h GLU 198 Cb 1.12 0.06 -0.33 0.00 0.50 0.00 0.00 28.75 30.10 3h6o h GLU 198 CO 1.06 -0.18 -0.71 -0.80 -1.00 0.00 0.00 179.01 177.39 3h6o s ASN 199 N -4.94 4.86 0.00 1.42 0.02 -1.17 -4.57 114.94 110.57 3h6o s ASN 199 Ca -0.04 -1.27 0.00 0.00 -1.02 0.00 0.00 52.86 50.53 3h6o s ASN 199 Cb 0.00 -1.70 0.00 0.00 0.02 0.00 0.00 41.25 39.57 3h6o s ASN 199 CO 0.12 -0.25 0.00 0.61 0.02 0.00 0.00 177.10 177.60 3h6o n GLY 200 N 4.62 0.33 0.00 0.66 0.00 -1.26 -2.22 105.19 107.31 3h6o n GLY 200 Ca -0.13 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 0.41 3.60 -0.02 0.00 -1.01 -4.68 105.19 108.49 3h6o n GLY 201 Ca 0.00 -2.21 -0.43 0.00 0.00 0.00 0.00 46.02 43.38 3h6o n GLY 201 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h6o s SER 202 N -3.91 6.66 0.15 1.61 0.01 -1.26 -1.71 113.70 115.26 3h6o s SER 202 Ca 0.00 0.51 -0.19 0.00 1.31 0.00 0.00 55.95 57.58 3h6o s SER 202 Cb 0.00 -2.50 -0.07 0.00 0.21 0.00 0.00 66.02 63.66 3h6o s SER 202 CO 0.00 -1.02 0.65 -1.48 0.41 0.00 0.00 173.24 171.80 3h6o s LEU 203 N 3.85 4.43 0.00 2.44 -0.00 0.16 -4.94 118.68 124.62 3h6o s LEU 203 Ca 0.42 1.33 0.00 0.00 -0.00 0.00 0.00 54.13 55.88 3h6o s LEU 203 Cb -0.10 -3.27 0.00 0.00 -0.00 0.00 0.00 46.19 42.81 3h6o s LEU 203 CO 0.24 0.14 0.00 0.61 -0.00 0.00 0.00 176.35 177.34 3h6o n GLY 204 N 1.15 5.74 3.91 -3.48 0.00 -1.26 -0.72 105.19 110.54 3h6o n GLY 204 Ca -0.06 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 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 0.15 6.42 -1.29 1.61 0.01 -1.26 -4.63 113.70 114.72 3h6o s SER 205 Ca 0.00 0.42 -0.04 0.00 1.31 0.00 0.00 55.95 57.64 3h6o s SER 205 Cb 0.00 -2.02 0.01 0.00 0.21 0.00 0.00 66.02 64.22 3h6o s SER 205 CO 0.00 0.11 1.06 0.29 0.41 0.00 0.00 173.24 175.11 3h6o n LYS 206 N 0.16 -7.04 -3.58 12.44 4.01 -0.73 -4.96 118.16 118.46 3h6o n LYS 206 Ca -0.04 0.82 -0.37 0.00 -0.51 0.00 0.00 58.31 58.21 3h6o n LYS 206 Cb 0.51 -5.82 -0.06 0.00 -0.51 0.00 0.00 35.03 29.16 3h6o n LYS 206 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3h6o s LYS 207 N -5.85 3.80 0.34 1.97 -0.14 -1.26 -4.71 119.74 113.89 3h6o s LYS 207 Ca 0.27 0.26 -0.29 0.00 -1.36 0.00 0.00 55.97 54.86 3h6o s LYS 207 Cb -0.12 -3.15 -0.10 0.00 -1.68 0.00 0.00 37.83 32.77 3h6o s LYS 207 CO 0.74 0.67 1.35 0.20 -0.76 0.00 0.00 175.35 177.55 3h6o s GLY 208 N -1.28 2.95 -0.04 -3.33 0.00 -1.26 -2.08 107.32 102.29 3h6o s GLY 208 Ca 0.25 1.33 0.03 0.00 0.00 0.00 0.00 44.72 46.33 3h6o s GLY 208 CO 0.14 2.00 -0.13 0.14 0.00 0.00 0.00 173.10 175.25 3h6o s VAL 209 N -1.07 1.10 0.05 1.40 1.01 -0.19 0.27 120.40 122.97 3h6o s VAL 209 Ca 0.50 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 62.02 3h6o s VAL 209 Cb -0.41 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 3h6o s VAL 209 CO 0.54 0.33 -0.20 0.20 0.00 0.00 0.00 175.10 175.97 3h6o s ASN 210 N 0.14 2.37 -0.72 3.32 -0.87 -0.43 -4.27 114.94 114.49 3h6o s ASN 210 Ca -0.04 -0.53 0.04 0.00 -1.57 0.00 0.00 52.86 50.76 3h6o s ASN 210 Cb -0.10 -0.19 0.17 0.00 -0.02 0.00 0.00 41.25 41.12 3h6o s ASN 210 CO 0.01 0.13 0.52 -0.76 -2.57 0.00 0.00 177.10 174.44 3h6o s LEU 211 N -1.25 4.92 0.16 0.60 1.43 -1.26 -1.20 118.68 122.09 3h6o s LEU 211 Ca 0.07 -3.75 -0.34 0.00 -1.03 0.00 0.00 54.13 49.08 3h6o s LEU 211 Cb -0.09 -1.69 -0.15 0.00 0.03 0.00 0.00 46.19 44.29 3h6o s LEU 211 CO 0.02 -0.12 1.35 -2.65 0.23 0.00 0.00 176.35 175.18 3h6o n PRO 212 N 2.15 1.55 -0.87 1.29 -0.02 -1.24 -1.43 135.00 136.42 3h6o n PRO 212 Ca 0.19 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3h6o n PRO 212 Cb 0.35 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3h6o n PRO 212 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h6o n GLY 213 N 2.46 0.70 3.88 -1.23 0.00 -1.26 -4.64 105.19 105.09 3h6o n GLY 213 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.06 3.39 -0.93 4.61 0.00 -0.51 -4.91 121.76 120.35 3h6o s ALA 214 Ca 0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 51.96 51.52 3h6o s ALA 214 Cb 0.00 -2.64 0.16 0.00 0.00 0.00 0.00 23.12 20.65 3h6o s ALA 214 CO 0.00 0.00 1.05 0.00 0.00 0.00 0.00 175.76 176.82 3h6o s ALA 215 N -2.35 3.67 -0.04 0.00 0.00 -1.26 -4.63 121.76 117.14 3h6o s ALA 215 Ca 0.50 -3.02 -0.30 0.00 0.00 0.00 0.00 51.96 49.14 3h6o s ALA 215 Cb -0.10 -3.89 -0.04 0.00 0.00 0.00 0.00 23.12 19.09 3h6o s ALA 215 CO 0.32 -2.74 1.22 0.08 0.00 0.00 0.00 175.76 174.64 3h6o s VAL 216 N 1.73 4.19 -0.37 0.00 1.01 -1.26 -4.87 120.40 120.84 3h6o s VAL 216 Ca 0.29 1.52 0.08 0.00 0.00 0.00 0.00 61.98 63.87 3h6o s VAL 216 Cb -0.06 -3.98 0.69 0.00 0.00 0.00 0.00 36.38 33.03 3h6o s VAL 216 CO -0.09 0.00 1.79 -0.90 0.00 0.00 0.00 175.10 175.91 3h6o n ASP 217 N 5.16 4.44 -4.77 3.32 5.75 -1.26 -4.95 116.55 124.24 3h6o n ASP 217 Ca 0.11 -3.26 -0.38 0.00 -0.01 0.00 0.00 54.79 51.26 3h6o n ASP 217 Cb 0.46 -0.76 0.00 0.00 -1.03 0.00 0.00 41.12 39.79 3h6o n ASP 217 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3h6o s LEU 218 N -2.91 4.01 0.84 -2.12 1.43 -1.26 -4.97 118.68 113.71 3h6o s LEU 218 Ca 0.53 2.45 -0.13 0.00 -1.03 0.00 0.00 54.13 55.95 3h6o s LEU 218 Cb 0.43 -4.20 0.06 0.00 0.03 0.00 0.00 46.19 42.51 3h6o s LEU 218 CO 0.12 -1.04 0.87 -0.81 0.23 0.00 0.00 176.35 175.71 3h6o n PRO 219 N -0.51 -0.01 -0.22 1.29 -0.04 -1.26 -4.88 135.00 129.37 3h6o n PRO 219 Ca 0.07 0.06 0.06 0.00 -0.04 0.00 0.00 63.50 63.65 3h6o n PRO 219 Cb 0.47 -2.17 0.32 0.00 -0.04 0.00 0.00 33.50 32.08 3h6o n PRO 219 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h6o h ALA 220 N -1.12 1.64 -3.83 0.55 0.00 -1.93 -3.43 119.26 111.15 3h6o h ALA 220 Ca -0.45 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.08 3h6o h ALA 220 Cb 1.30 -0.22 -0.30 0.00 0.00 0.00 0.00 17.79 18.57 3h6o h ALA 220 CO 0.42 0.24 -0.77 0.14 0.00 0.00 0.00 179.25 179.28 3h6o s VAL 221 N -5.75 0.52 0.89 0.00 -7.23 -1.26 -4.74 120.40 102.83 3h6o s VAL 221 Ca -0.10 -0.24 -0.14 0.00 -1.81 0.00 0.00 61.98 59.69 3h6o s VAL 221 Cb 0.19 -0.47 0.14 0.00 0.56 0.00 0.00 36.38 36.81 3h6o s VAL 221 CO 0.78 0.17 1.23 -0.94 -0.31 0.00 0.00 175.10 176.02 3h6o s SER 222 N 0.12 3.72 0.16 4.85 1.04 -1.26 -4.83 113.70 117.50 3h6o s SER 222 Ca -0.01 0.61 -0.15 0.00 0.48 0.00 0.00 55.95 56.88 3h6o s SER 222 Cb -0.06 -0.93 0.08 0.00 0.10 0.00 0.00 66.02 65.22 3h6o s SER 222 CO -0.00 -2.38 1.78 -0.33 0.98 0.00 0.00 173.24 173.28 3h6o h GLU 223 N -1.39 0.40 -0.51 4.02 5.08 -2.00 -1.54 114.58 118.64 3h6o h GLU 223 Ca -0.46 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 57.83 3h6o h GLU 223 Cb 1.29 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 3h6o h GLU 223 CO 0.54 0.27 0.12 -0.22 -1.00 0.00 0.00 179.01 178.72 3h6o h LYS 224 N 0.42 0.83 -0.57 2.33 3.64 -1.98 -2.95 116.57 118.28 3h6o h LYS 224 Ca 0.18 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3h6o h LYS 224 Cb 0.10 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 3h6o h LYS 224 CO -0.14 0.79 0.37 -0.44 -2.27 0.00 0.00 179.45 177.76 3h6o h ASP 225 N 0.72 0.62 -0.68 4.20 3.32 -1.86 0.13 116.42 122.87 3h6o h ASP 225 Ca 0.16 -0.01 0.13 0.00 0.02 0.00 0.00 57.03 57.33 3h6o h ASP 225 Cb 0.34 -0.15 -0.09 0.00 0.22 0.00 0.00 39.33 39.65 3h6o h ASP 225 CO 0.00 0.44 0.21 0.40 -1.72 0.00 0.00 179.24 178.58 3h6o h ILE 226 N 0.74 0.65 -0.05 0.35 2.04 -1.22 0.77 117.51 120.78 3h6o h ILE 226 Ca 0.22 -0.12 -0.20 0.00 1.00 0.00 0.00 64.86 65.76 3h6o h ILE 226 Cb -0.04 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 3h6o h ILE 226 CO -0.07 0.06 -0.80 1.56 0.00 0.00 0.00 178.15 178.91 3h6o h GLN 227 N 0.35 0.41 -0.27 2.37 1.08 -1.29 -2.87 115.11 114.88 3h6o h GLN 227 Ca 0.36 -0.36 -0.14 0.00 -1.45 0.00 0.00 58.65 57.06 3h6o h GLN 227 Cb 0.54 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 28.06 3h6o h GLN 227 CO -0.40 1.02 -0.38 -0.44 -0.95 0.00 0.00 178.83 177.67 3h6o h ASP 228 N 0.26 0.81 -0.79 1.46 3.32 -0.01 -2.21 116.42 119.26 3h6o h ASP 228 Ca -0.05 -0.51 0.06 0.00 0.02 0.00 0.00 57.03 56.56 3h6o h ASP 228 Cb 1.39 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 40.66 3h6o h ASP 228 CO 0.14 1.15 0.48 -0.07 -1.72 0.00 0.00 179.24 179.22 3h6o h LEU 229 N 0.48 0.75 -0.88 1.55 3.38 0.49 -0.40 115.31 120.68 3h6o h LEU 229 Ca 0.03 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 3h6o h LEU 229 Cb 0.97 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 3h6o h LEU 229 CO 0.09 0.48 -0.51 0.11 0.09 0.00 0.00 178.44 178.71 3h6o h LYS 230 N 0.88 0.00 -0.34 1.13 6.56 -1.47 -2.39 116.57 120.94 3h6o h LYS 230 Ca 0.34 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.89 3h6o h LYS 230 Cb 0.15 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.80 3h6o h LYS 230 CO -0.17 0.51 0.04 0.35 -2.06 0.00 0.00 179.45 178.12 3h6o h PHE 231 N 0.00 0.61 -0.67 -1.35 3.57 -0.88 -2.68 116.94 115.53 3h6o h PHE 231 Ca -0.01 -0.09 0.11 0.00 3.53 0.00 0.00 57.97 61.52 3h6o h PHE 231 Cb 0.98 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 3h6o h PHE 231 CO 0.00 0.64 0.45 0.78 -2.23 0.00 0.00 178.31 177.95 3h6o h GLY 232 N 0.39 0.69 0.55 2.40 0.00 -0.66 0.65 103.07 107.09 3h6o h GLY 232 Ca 0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 3h6o h GLY 232 CO 0.01 0.10 -0.04 -2.08 0.00 0.00 0.00 176.54 174.54 3h6o h VAL 233 N 0.46 1.17 -0.72 4.60 2.07 -1.36 -0.74 116.25 121.73 3h6o h VAL 233 Ca 0.32 -0.98 0.10 0.00 0.82 0.00 0.00 66.70 66.96 3h6o h VAL 233 Cb 0.61 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.12 3h6o h VAL 233 CO -0.10 0.24 0.48 -0.33 0.02 0.00 0.00 177.57 177.88 3h6o h GLU 234 N -0.55 0.60 -0.14 1.57 5.08 -1.11 -1.68 114.58 118.33 3h6o h GLU 234 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3h6o h GLU 234 Cb 0.47 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3h6o h GLU 234 CO 0.02 0.39 0.00 1.04 -1.00 0.00 0.00 179.01 179.46 3h6o n GLN 235 N -4.49 1.76 -3.38 2.33 1.13 0.18 -4.97 117.38 109.95 3h6o n GLN 235 Ca 0.12 -1.14 -0.21 0.00 -1.94 0.00 0.00 57.00 53.83 3h6o n GLN 235 Cb 0.34 -1.42 0.06 0.00 0.11 0.00 0.00 30.24 29.33 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 -5.92 -4.75 1.08 2.03 -0.53 -4.97 116.55 103.85 3h6o n ASP 236 Ca 0.17 -0.44 -0.35 0.00 0.52 0.00 0.00 54.79 54.69 3h6o n ASP 236 Cb 0.35 -4.58 0.05 0.00 -0.72 0.00 0.00 41.12 36.22 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 -3.25 2.79 -0.04 5.18 -7.23 -0.40 -4.97 120.40 112.48 3h6o s VAL 237 Ca 0.48 0.43 0.04 0.00 -1.81 0.00 0.00 61.98 61.11 3h6o s VAL 237 Cb -0.21 -3.04 -0.25 0.00 0.56 0.00 0.00 36.38 33.44 3h6o s VAL 237 CO 0.59 -0.17 0.69 0.44 -0.31 0.00 0.00 175.10 176.34 3h6o h ASP 238 N 0.36 0.19 -5.00 4.85 3.32 -1.62 -3.45 116.42 115.08 3h6o h ASP 238 Ca -0.49 -0.36 -0.12 0.00 0.02 0.00 0.00 57.03 56.08 3h6o h ASP 238 Cb 1.28 -0.06 -0.20 0.00 0.22 0.00 0.00 39.33 40.57 3h6o h ASP 238 CO 0.54 1.31 -0.33 0.00 -1.72 0.00 0.00 179.24 179.04 3h6o s MET 239 N -2.60 0.64 -0.12 3.56 0.23 -1.17 -1.98 119.30 117.87 3h6o s MET 239 Ca -0.09 -0.32 -0.01 0.00 -1.03 0.00 0.00 55.69 54.24 3h6o s MET 239 Cb 0.07 0.28 -0.02 0.00 -1.53 0.00 0.00 34.83 33.63 3h6o s MET 239 CO 0.82 -0.18 -0.09 0.08 -2.03 0.00 0.00 175.02 173.62 3h6o s VAL 240 N -1.59 3.47 -0.50 5.16 1.01 0.67 -1.62 120.40 127.00 3h6o s VAL 240 Ca -0.12 -0.53 -0.17 0.00 0.00 0.00 0.00 61.98 61.17 3h6o s VAL 240 Cb -0.05 -2.47 0.08 0.00 0.00 0.00 0.00 36.38 33.95 3h6o s VAL 240 CO 0.02 0.54 0.49 -0.36 0.00 0.00 0.00 175.10 175.79 3h6o s PHE 241 N 0.01 3.18 -0.24 5.22 0.08 -0.18 -0.50 117.98 125.54 3h6o s PHE 241 Ca -0.02 -0.91 -0.17 0.00 0.12 0.00 0.00 56.93 55.96 3h6o s PHE 241 Cb -0.14 -3.44 -0.03 0.00 -0.57 0.00 0.00 43.02 38.84 3h6o s PHE 241 CO 0.03 -0.93 0.46 0.00 -0.10 0.00 0.00 175.22 174.68 3h6o s ALA 242 N 1.95 3.57 0.39 5.36 0.00 0.29 -1.72 121.76 131.61 3h6o s ALA 242 Ca 0.07 -0.62 -0.24 0.00 0.00 0.00 0.00 51.96 51.17 3h6o s ALA 242 Cb -0.24 -2.78 -0.09 0.00 0.00 0.00 0.00 23.12 20.00 3h6o s ALA 242 CO 0.07 -0.59 1.01 -1.12 0.00 0.00 0.00 175.76 175.12 3h6o s SER 243 N 1.42 6.91 -1.20 0.00 0.01 -1.26 -1.18 113.70 118.40 3h6o s SER 243 Ca 0.20 1.93 -0.03 0.00 1.31 0.00 0.00 55.95 59.35 3h6o s SER 243 Cb -0.15 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.50 3h6o s SER 243 CO 0.09 -0.38 1.02 0.33 0.41 0.00 0.00 173.24 174.71 3h6o n PHE 244 N -0.04 -2.34 -2.87 2.43 7.35 -1.22 -4.81 117.46 115.96 3h6o n PHE 244 Ca 0.05 0.92 -0.41 0.00 -0.76 0.00 0.00 57.45 57.25 3h6o n PHE 244 Cb 0.51 -4.91 -0.04 0.00 0.35 0.00 0.00 39.48 35.39 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 -3.33 4.91 -0.10 -2.13 -1.09 -0.97 -4.92 121.20 113.57 3h6o s ILE 245 Ca 0.22 1.71 0.03 0.00 -2.23 0.00 0.00 60.65 60.37 3h6o s ILE 245 Cb -0.10 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.59 3h6o s ILE 245 CO 0.69 0.10 0.10 0.54 -1.23 0.00 0.00 174.94 175.15 3h6o n ARG 246 N 4.61 4.49 -3.58 2.79 1.74 -1.26 -4.34 116.66 121.11 3h6o n ARG 246 Ca 0.04 -0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 57.03 3h6o n ARG 246 Cb 0.50 -0.75 -0.02 0.00 -1.02 0.00 0.00 32.46 31.17 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 -1.51 1.06 0.32 5.56 -2.85 -1.26 -3.97 119.74 117.09 3h6o s LYS 247 Ca 0.00 -0.47 -0.00 0.00 -1.00 0.00 0.00 55.97 54.50 3h6o s LYS 247 Cb 0.02 0.44 0.51 0.00 -2.06 0.00 0.00 37.83 36.74 3h6o s LYS 247 CO 0.12 -0.47 1.98 0.00 0.10 0.00 0.00 175.35 177.07 3h6o h ALA 248 N 2.00 1.45 -0.31 0.59 0.00 -1.86 -2.10 119.26 119.02 3h6o h ALA 248 Ca -0.25 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.63 3h6o h ALA 248 Cb 1.25 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3h6o h ALA 248 CO 0.30 0.50 0.21 0.66 0.00 0.00 0.00 179.25 180.92 3h6o h SER 249 N 1.01 0.28 -0.35 0.00 4.64 -1.97 -0.96 113.55 116.20 3h6o h SER 249 Ca 0.27 -0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.56 3h6o h SER 249 Cb -0.09 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 3h6o h SER 249 CO -0.06 0.19 0.13 0.44 -0.87 0.00 0.00 176.83 176.66 3h6o h ASP 250 N 0.32 0.50 -0.65 4.97 3.32 -1.79 -1.73 116.42 121.36 3h6o h ASP 250 Ca 0.13 -0.18 0.06 0.00 0.02 0.00 0.00 57.03 57.06 3h6o h ASP 250 Cb 0.11 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.48 3h6o h ASP 250 CO -0.03 0.55 0.34 0.58 -1.72 0.00 0.00 179.24 178.96 3h6o h VAL 251 N 0.42 0.94 -0.42 -1.35 2.07 -1.33 -2.59 116.25 113.99 3h6o h VAL 251 Ca 0.12 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 3h6o h VAL 251 Cb 0.22 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3h6o h VAL 251 CO -0.01 0.12 -0.03 0.45 0.02 0.00 0.00 177.57 178.12 3h6o h HIS 252 N 0.63 0.73 -0.70 1.57 3.86 -0.87 -1.45 115.15 118.93 3h6o h HIS 252 Ca 0.30 -0.10 -0.07 0.00 -1.16 0.00 0.00 60.37 59.34 3h6o h HIS 252 Cb 0.21 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.45 3h6o h HIS 252 CO -0.09 0.71 0.18 1.49 0.86 0.00 0.00 177.93 181.08 3h6o h GLU 253 N 0.65 1.11 -0.15 2.45 4.57 -1.12 0.08 114.58 122.17 3h6o h GLU 253 Ca 0.13 -0.26 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3h6o h GLU 253 Cb 0.44 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 3h6o h GLU 253 CO 0.02 0.97 0.07 0.28 -1.18 0.00 0.00 179.01 179.17 3h6o h VAL 254 N 1.05 1.13 -0.43 0.32 2.07 -1.03 0.71 116.25 120.08 3h6o h VAL 254 Ca 0.22 -0.37 0.09 0.00 0.82 0.00 0.00 66.70 67.46 3h6o h VAL 254 Cb 0.35 1.11 -0.09 0.00 -1.52 0.00 0.00 31.29 31.14 3h6o h VAL 254 CO -0.00 0.12 -0.15 -0.09 0.02 0.00 0.00 177.57 177.47 3h6o h ARG 255 N 0.11 -0.05 -0.85 1.57 9.65 -1.16 -2.02 114.38 121.62 3h6o h ARG 255 Ca 0.05 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.91 3h6o h ARG 255 Cb 0.13 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.68 3h6o h ARG 255 CO -0.01 -0.03 0.45 -0.22 2.80 0.00 0.00 179.97 182.96 3h6o h LYS 256 N -0.05 1.19 -0.38 0.20 3.64 -0.62 0.67 116.57 121.21 3h6o h LYS 256 Ca 0.21 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3h6o h LYS 256 Cb 0.37 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3h6o h LYS 256 CO -0.47 0.88 0.08 0.28 -2.27 0.00 0.00 179.45 177.95 3h6o h VAL 257 N 1.19 1.23 -0.56 2.00 2.07 -0.47 -2.60 116.25 119.11 3h6o h VAL 257 Ca 0.30 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 3h6o h VAL 257 Cb 0.05 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3h6o h VAL 257 CO -0.05 0.28 0.25 -0.07 0.02 0.00 0.00 177.57 178.00 3h6o h LEU 258 N 0.47 0.71 0.00 2.57 3.38 -1.25 -3.47 115.31 117.72 3h6o h LEU 258 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3h6o h LEU 258 Cb 0.33 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3h6o h LEU 258 CO 0.00 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.76 3h6o n GLY 259 N -1.15 0.99 0.26 0.83 0.00 0.21 -2.09 105.19 104.24 3h6o n GLY 259 Ca 0.05 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.40 0.00 1.61 4.57 -1.88 -1.40 114.58 117.08 3h6o h GLU 260 Ca 0.00 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 3h6o h GLU 260 Cb 0.00 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.68 3h6o h GLU 260 CO 0.00 -0.27 -0.08 0.87 -1.18 0.00 0.00 179.01 178.35 3h6o h LYS 261 N -0.42 0.00 -0.60 1.92 1.79 -1.99 -2.95 116.57 114.33 3h6o h LYS 261 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3h6o h LYS 261 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 3h6o h LYS 261 CO -0.12 0.08 0.00 0.41 -1.08 0.00 0.00 179.45 178.74 3h6o n GLY 262 N -0.07 2.74 0.35 3.86 0.00 -0.89 -4.67 105.19 106.51 3h6o n GLY 262 Ca -0.00 -0.74 0.18 0.00 0.00 0.00 0.00 46.02 45.46 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 3.59 0.00 -0.02 1.61 2.10 -1.08 -1.20 116.57 121.57 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 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 3h6o h LYS 263 CO 0.09 0.00 -0.41 0.09 -2.00 0.00 0.00 179.45 177.22 3h6o n ASN 264 N -3.59 2.15 -4.71 7.07 3.02 -1.26 -4.91 115.26 113.02 3h6o n ASN 264 Ca 0.03 -1.57 -0.42 0.00 -0.03 0.00 0.00 54.58 52.58 3h6o n ASN 264 Cb 0.41 0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.97 3h6o n ASN 264 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3h6o s ILE 265 N -2.40 3.88 0.08 2.41 1.01 -0.46 -4.99 121.20 120.74 3h6o s ILE 265 Ca 0.19 1.33 -0.30 0.00 0.00 0.00 0.00 60.65 61.87 3h6o s ILE 265 Cb 0.18 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.75 3h6o s ILE 265 CO 0.53 0.08 1.04 -0.54 0.00 0.00 0.00 174.94 176.05 3h6o s LYS 266 N 1.34 4.59 -0.43 2.79 -0.14 -0.84 -4.89 119.74 122.17 3h6o s LYS 266 Ca 0.60 1.55 -0.14 0.00 -1.36 0.00 0.00 55.97 56.62 3h6o s LYS 266 Cb -0.31 -3.37 0.05 0.00 -1.68 0.00 0.00 37.83 32.52 3h6o s LYS 266 CO 0.28 0.03 0.33 0.42 -0.76 0.00 0.00 175.35 175.65 3h6o s ILE 267 N 0.43 5.10 -0.34 2.17 1.01 -1.26 -0.24 121.20 128.07 3h6o s ILE 267 Ca 0.51 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 60.10 3h6o s ILE 267 Cb -0.25 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 3h6o s ILE 267 CO 0.30 -0.43 0.38 -0.63 0.00 0.00 0.00 174.94 174.56 3h6o s ILE 268 N 1.63 5.15 0.06 2.92 -1.09 0.34 -1.25 121.20 128.97 3h6o s ILE 268 Ca 0.04 0.10 -0.29 0.00 -2.23 0.00 0.00 60.65 58.27 3h6o s ILE 268 Cb -0.21 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 36.79 3h6o s ILE 268 CO 0.08 -0.09 0.94 -0.44 -1.23 0.00 0.00 174.94 174.20 3h6o s SER 269 N 1.73 7.42 -0.25 3.58 0.01 -0.56 -0.54 113.70 125.08 3h6o s SER 269 Ca 0.13 1.70 -0.16 0.00 1.31 0.00 0.00 55.95 58.92 3h6o s SER 269 Cb -0.16 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 3h6o s SER 269 CO 0.12 -0.12 0.44 -0.54 0.41 0.00 0.00 173.24 173.54 3h6o s LYS 270 N 0.34 4.07 -0.40 12.44 1.02 -0.32 -0.21 119.74 136.67 3h6o s LYS 270 Ca 0.47 0.19 -0.18 0.00 0.02 0.00 0.00 55.97 56.48 3h6o s LYS 270 Cb -0.22 -3.63 0.01 0.00 -0.52 0.00 0.00 37.83 33.47 3h6o s LYS 270 CO 0.28 -0.26 0.46 0.42 -0.92 0.00 0.00 175.35 175.34 3h6o s ILE 271 N 2.01 5.06 0.00 2.17 -1.09 -0.59 -2.29 121.20 126.46 3h6o s ILE 271 Ca 0.18 -0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.46 3h6o s ILE 271 Cb -0.16 -4.02 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 3h6o s ILE 271 CO 0.09 -0.37 0.52 -0.62 -1.23 0.00 0.00 174.94 173.33 3h6o n GLU 272 N 5.67 0.32 -3.84 2.79 1.02 -1.26 -2.92 120.64 122.42 3h6o n GLU 272 Ca -0.06 -0.64 -0.09 0.00 -0.02 0.00 0.00 57.16 56.35 3h6o n GLU 272 Cb 0.48 -0.83 0.01 0.00 -0.02 0.00 0.00 31.44 31.08 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 -0.25 0.06 0.15 1.62 4.22 -1.26 -2.99 114.94 116.49 3h6o s ASN 273 Ca 0.00 -1.11 -0.15 0.00 -2.14 0.00 0.00 52.86 49.46 3h6o s ASN 273 Cb 0.00 0.82 0.03 0.00 1.28 0.00 0.00 41.25 43.38 3h6o s ASN 273 CO 0.00 -1.61 1.73 -0.74 -2.04 0.00 0.00 177.10 174.44 3h6o h HIS 274 N 2.01 0.69 -0.71 1.54 -0.00 -1.92 -2.53 115.15 114.24 3h6o h HIS 274 Ca -0.30 -0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.04 3h6o h HIS 274 Cb 1.25 -0.21 -0.04 0.00 -0.00 0.00 0.00 27.41 28.41 3h6o h HIS 274 CO 1.26 0.55 0.47 1.49 -0.00 0.00 0.00 177.93 181.70 3h6o h GLU 275 N 0.63 0.92 -0.74 5.26 4.81 -1.90 -1.34 114.58 122.22 3h6o h GLU 275 Ca 0.16 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 3h6o h GLU 275 Cb 0.12 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 3h6o h GLU 275 CO -0.02 0.61 0.42 0.78 -0.73 0.00 0.00 179.01 180.07 3h6o h GLY 276 N 0.95 1.08 1.07 1.92 0.00 -1.65 0.14 103.07 106.58 3h6o h GLY 276 Ca 0.26 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 47.01 3h6o h GLY 276 CO -0.06 0.45 -0.14 -2.08 0.00 0.00 0.00 176.54 174.71 3h6o h VAL 277 N 1.03 1.27 -0.04 4.60 2.07 -1.02 -2.38 116.25 121.78 3h6o h VAL 277 Ca 0.26 -1.29 -0.21 0.00 0.82 0.00 0.00 66.70 66.28 3h6o h VAL 277 Cb 0.00 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3h6o h VAL 277 CO -0.04 0.45 -0.86 0.03 0.02 0.00 0.00 177.57 177.16 3h6o h ARG 278 N 0.81 0.46 -0.76 1.57 3.08 -0.98 -3.06 114.38 115.50 3h6o h ARG 278 Ca 0.12 -0.44 -0.11 0.00 0.07 0.00 0.00 59.98 59.62 3h6o h ARG 278 Cb 0.70 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.80 3h6o h ARG 278 CO 0.05 1.09 0.13 0.54 -1.07 0.00 0.00 179.97 180.71 3h6o n ARG 279 N -3.80 3.52 -0.35 0.04 1.74 0.47 -4.66 116.66 113.62 3h6o n ARG 279 Ca -0.06 -2.43 0.04 0.00 -0.77 0.00 0.00 57.85 54.63 3h6o n ARG 279 Cb 0.79 -2.06 0.21 0.00 -1.02 0.00 0.00 32.46 30.38 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 2.51 1.15 -0.09 -1.55 3.57 -1.32 -2.53 116.94 118.69 3h6o h PHE 280 Ca 0.13 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3h6o h PHE 280 Cb 1.87 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 40.23 3h6o h PHE 280 CO 0.96 0.57 0.03 -0.44 -2.23 0.00 0.00 178.31 177.20 3h6o h ASP 281 N 1.10 0.12 -0.36 0.41 3.32 -1.86 0.17 116.42 119.32 3h6o h ASP 281 Ca 0.44 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 57.26 3h6o h ASP 281 Cb 0.25 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 3h6o h ASP 281 CO -0.18 0.27 0.07 1.05 -1.72 0.00 0.00 179.24 178.72 3h6o h GLU 282 N -0.03 0.68 0.01 3.56 4.11 -1.92 -1.33 114.58 119.66 3h6o h GLU 282 Ca 0.03 -0.14 -0.00 0.00 0.07 0.00 0.00 59.36 59.32 3h6o h GLU 282 Cb 0.18 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3h6o h GLU 282 CO -0.00 0.65 -0.00 0.82 0.07 0.00 0.00 179.01 180.55 3h6o h ILE 283 N 0.66 1.17 -0.90 -1.06 2.04 -0.99 -2.93 117.51 115.50 3h6o h ILE 283 Ca 0.14 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.49 3h6o h ILE 283 Cb 0.31 1.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 3h6o h ILE 283 CO 0.00 0.14 0.59 0.25 0.00 0.00 0.00 178.15 179.13 3h6o h LEU 284 N -0.24 1.01 -1.03 1.44 5.85 -0.48 -1.79 115.31 120.08 3h6o h LEU 284 Ca -0.00 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.77 3h6o h LEU 284 Cb 0.23 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 40.95 3h6o h LEU 284 CO 0.00 0.72 0.64 -0.08 -0.34 0.00 0.00 178.44 179.39 3h6o h GLU 285 N 1.19 1.12 0.00 1.25 4.22 -1.21 -2.53 114.58 118.62 3h6o h GLU 285 Ca 0.34 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.71 3h6o h GLU 285 Cb -0.10 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 28.90 3h6o h GLU 285 CO -0.09 0.74 -0.59 0.00 -2.18 0.00 0.00 179.01 176.90 3h6o h ALA 286 N 1.47 0.65 -1.95 2.92 0.00 -1.29 -3.47 119.26 117.59 3h6o h ALA 286 Ca 0.43 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.89 3h6o h ALA 286 Cb 0.20 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.01 3h6o h ALA 286 CO -0.18 0.00 -0.16 -1.12 0.00 0.00 0.00 179.25 177.80 3h6o s SER 287 N -4.77 5.79 0.19 0.00 0.01 -0.70 -4.93 113.70 109.29 3h6o s SER 287 Ca 0.05 0.10 0.24 0.00 1.31 0.00 0.00 55.95 57.66 3h6o s SER 287 Cb 0.11 -1.34 0.43 0.00 0.21 0.00 0.00 66.02 65.43 3h6o s SER 287 CO 0.72 -0.69 1.44 0.44 0.41 0.00 0.00 173.24 175.56 3h6o h ASP 288 N 0.49 0.00 0.00 2.44 3.32 -1.45 -3.48 116.42 117.75 3h6o h ASP 288 Ca -0.45 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.49 3h6o h ASP 288 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3h6o h ASP 288 CO 0.55 0.05 0.00 0.61 -1.72 0.00 0.00 179.24 178.74 3h6o n GLY 289 N 1.29 -1.13 2.99 2.75 0.00 -1.12 -4.01 105.19 105.95 3h6o n GLY 289 Ca 0.04 -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 -2.24 0.00 -0.23 -0.61 -1.09 -0.62 -1.50 121.20 114.91 3h6o s ILE 290 Ca 0.00 -0.01 -0.03 0.00 -2.23 0.00 0.00 60.65 58.38 3h6o s ILE 290 Cb 0.00 -0.16 0.00 0.00 -1.58 0.00 0.00 42.46 40.72 3h6o s ILE 290 CO 0.00 -0.00 -0.05 -0.32 -1.23 0.00 0.00 174.94 173.34 3h6o s MET 291 N 0.04 3.20 -1.07 2.79 -2.45 0.71 -0.31 119.30 122.22 3h6o s MET 291 Ca -0.00 -0.74 -0.22 0.00 -1.25 0.00 0.00 55.69 53.48 3h6o s MET 291 Cb -0.01 -2.99 0.01 0.00 1.25 0.00 0.00 34.83 33.08 3h6o s MET 291 CO 0.00 -0.26 1.72 0.08 1.05 0.00 0.00 175.02 177.61 3h6o s VAL 292 N 1.43 3.78 -1.22 10.11 1.01 0.16 -1.55 120.40 134.11 3h6o s VAL 292 Ca 0.04 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 3h6o s VAL 292 Cb -0.15 -4.73 -0.01 0.00 0.00 0.00 0.00 36.38 31.49 3h6o s VAL 292 CO -0.04 -1.54 1.93 0.00 0.00 0.00 0.00 175.10 175.45 3h6o n ALA 293 N 11.03 3.61 0.06 5.51 0.00 -1.15 -2.83 120.51 136.74 3h6o n ALA 293 Ca 0.40 -3.58 0.07 0.00 0.00 0.00 0.00 53.44 50.33 3h6o n ALA 293 Cb 0.48 -3.57 0.51 0.00 0.00 0.00 0.00 19.45 16.87 3h6o n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6o h ARG 294 N 7.72 0.35 0.00 0.00 3.08 -1.83 -2.29 114.38 121.40 3h6o h ARG 294 Ca 0.42 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3h6o h ARG 294 Cb 0.79 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.77 3h6o h ARG 294 CO 1.60 0.23 0.00 0.41 -1.07 0.00 0.00 179.97 181.14 3h6o n GLY 295 N -1.51 -3.30 0.31 0.04 0.00 -1.26 -0.92 105.19 98.56 3h6o n GLY 295 Ca 0.03 0.51 -0.05 0.00 0.00 0.00 0.00 46.02 46.51 3h6o n GLY 295 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h6o h ASP 296 N 0.00 0.88 -0.80 1.61 5.19 -1.86 -2.77 116.42 118.66 3h6o h ASP 296 Ca 0.00 -0.18 0.12 0.00 -0.62 0.00 0.00 57.03 56.35 3h6o h ASP 296 Cb 0.00 -0.23 -0.08 0.00 0.18 0.00 0.00 39.33 39.20 3h6o h ASP 296 CO 0.00 0.87 0.42 0.25 -3.12 0.00 0.00 179.24 177.66 3h6o h LEU 297 N 0.89 0.55 0.00 1.55 5.85 -1.31 -0.72 115.31 122.11 3h6o h LEU 297 Ca 0.19 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3h6o h LEU 297 Cb 0.35 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.36 3h6o h LEU 297 CO 0.00 0.28 0.00 0.61 -0.34 0.00 0.00 178.44 178.99 3h6o n GLY 298 N -1.32 -1.09 0.14 3.75 0.00 -0.09 -0.68 105.19 105.90 3h6o n GLY 298 Ca 0.14 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 1.05 0.05 -0.61 2.04 -1.08 -3.39 117.51 115.58 3h6o h ILE 299 Ca 0.00 -2.53 -0.23 0.00 1.00 0.00 0.00 64.86 63.10 3h6o h ILE 299 Cb 0.13 2.84 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 3h6o h ILE 299 CO 0.00 0.81 -1.06 -0.33 0.00 0.00 0.00 178.15 177.58 3h6o h GLU 300 N 0.01 0.18 -6.31 2.37 4.39 -0.72 -3.46 114.58 111.04 3h6o h GLU 300 Ca -0.31 -0.27 -0.61 0.00 0.34 0.00 0.00 59.36 58.52 3h6o h GLU 300 Cb 2.03 0.09 -0.17 0.00 -0.10 0.00 0.00 28.75 30.61 3h6o h GLU 300 CO 0.18 1.08 -0.79 0.96 -1.16 0.00 0.00 179.01 179.27 3h6o s ILE 301 N -2.86 2.29 0.12 3.13 -4.36 0.14 -4.59 121.20 115.08 3h6o s ILE 301 Ca -0.02 -2.17 -0.35 0.00 -0.26 0.00 0.00 60.65 57.85 3h6o s ILE 301 Cb 0.09 -2.15 -0.16 0.00 1.25 0.00 0.00 42.46 41.49 3h6o s ILE 301 CO 0.85 -0.27 1.37 -2.65 0.24 0.00 0.00 174.94 174.47 3h6o n PRO 302 N -0.09 1.40 0.21 0.37 -0.02 -1.26 -4.45 135.00 131.16 3h6o n PRO 302 Ca -0.10 0.50 0.05 0.00 -2.02 0.00 0.00 63.50 61.94 3h6o n PRO 302 Cb 0.58 -2.15 0.51 0.00 -0.02 0.00 0.00 33.50 32.41 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 4.65 1.72 0.00 3.55 0.00 -1.94 -0.72 119.26 126.52 3h6o h ALA 303 Ca -0.46 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3h6o h ALA 303 Cb 1.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3h6o h ALA 303 CO 0.79 0.21 0.00 -0.85 0.00 0.00 0.00 179.25 179.40 3h6o n GLU 304 N -4.35 0.06 0.00 0.00 0.00 -1.26 -2.20 120.64 112.89 3h6o n GLU 304 Ca -0.02 0.21 0.10 0.00 0.00 0.00 0.00 57.16 57.45 3h6o n GLU 304 Cb 0.22 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.11 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 -1.44 0.77 -0.12 3.44 5.02 -0.28 -4.56 118.16 120.99 3h6o n LYS 305 Ca 0.05 -0.59 -0.02 0.00 -2.02 0.00 0.00 58.31 55.73 3h6o n LYS 305 Cb 0.16 -1.48 0.21 0.00 -0.02 0.00 0.00 35.03 33.91 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 1.43 1.22 0.00 -0.18 2.07 -1.46 -2.31 116.25 117.01 3h6o h VAL 306 Ca 0.00 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 3h6o h VAL 306 Cb 0.64 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3h6o h VAL 306 CO 0.00 0.29 -0.04 2.19 0.02 0.00 0.00 177.57 180.03 3h6o h PHE 307 N 0.77 0.00 -0.05 1.57 -5.15 -1.80 -1.68 116.94 110.60 3h6o h PHE 307 Ca 0.17 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.90 3h6o h PHE 307 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.44 3h6o h PHE 307 CO 0.01 0.04 -0.16 -0.07 -2.00 0.00 0.00 178.31 176.13 3h6o h LEU 308 N 0.00 0.22 -0.90 2.10 3.38 -1.73 -2.09 115.31 116.29 3h6o h LEU 308 Ca -0.00 -0.62 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 3h6o h LEU 308 Cb 0.09 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 3h6o h LEU 308 CO 0.00 0.81 0.52 0.00 0.09 0.00 0.00 178.44 179.86 3h6o h ALA 309 N 0.42 1.14 0.20 1.53 0.00 -1.44 -0.21 119.26 120.90 3h6o h ALA 309 Ca -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3h6o h ALA 309 Cb 0.79 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3h6o h ALA 309 CO 0.03 0.62 -0.09 0.37 0.00 0.00 0.00 179.25 180.18 3h6o h GLN 310 N 1.24 -0.25 -0.60 0.00 4.15 -1.31 -0.64 115.11 117.70 3h6o h GLN 310 Ca 0.32 0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.68 3h6o h GLN 310 Cb -0.02 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 3h6o h GLN 310 CO -0.06 -0.06 0.06 0.87 -1.93 0.00 0.00 178.83 177.71 3h6o h LYS 311 N -0.40 0.99 -0.07 1.69 1.57 -1.35 0.13 116.57 119.13 3h6o h LYS 311 Ca -0.03 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3h6o h LYS 311 Cb 0.31 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 3h6o h LYS 311 CO 0.04 0.94 0.05 1.98 -0.57 0.00 0.00 179.45 181.89 3h6o h MET 312 N 0.93 0.10 -0.31 3.15 4.05 -0.98 -1.40 114.93 120.47 3h6o h MET 312 Ca 0.18 -0.01 -0.07 0.00 -0.28 0.00 0.00 59.70 59.52 3h6o h MET 312 Cb 0.45 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 3h6o h MET 312 CO 0.02 0.08 -0.10 0.52 0.23 0.00 0.00 176.91 177.66 3h6o h MET 313 N 0.09 0.61 -1.00 0.39 2.86 -0.83 -1.39 114.93 115.67 3h6o h MET 313 Ca 0.03 -0.25 0.02 0.00 -2.06 0.00 0.00 59.70 57.44 3h6o h MET 313 Cb 0.00 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 3h6o h MET 313 CO -0.01 0.81 0.66 0.82 1.06 0.00 0.00 176.91 180.26 3h6o h ILE 314 N 0.38 1.22 -0.15 -1.22 2.04 -0.74 -1.39 117.51 117.65 3h6o h ILE 314 Ca 0.08 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 3h6o h ILE 314 Cb 0.60 -0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3h6o h ILE 314 CO 0.04 0.24 0.06 1.23 0.00 0.00 0.00 178.15 179.71 3h6o h GLY 315 N 1.32 0.24 1.48 5.37 0.00 -1.03 -0.60 103.07 109.84 3h6o h GLY 315 Ca 0.38 -0.13 -0.12 0.00 0.00 0.00 0.00 47.33 47.46 3h6o h GLY 315 CO -0.10 0.12 -0.33 3.21 0.00 0.00 0.00 176.54 179.45 3h6o h ARG 316 N 0.08 0.59 -0.39 4.80 3.08 -1.05 0.12 114.38 121.61 3h6o h ARG 316 Ca 0.05 -0.26 -0.13 0.00 0.07 0.00 0.00 59.98 59.71 3h6o h ARG 316 Cb 0.17 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3h6o h ARG 316 CO -0.00 0.84 -0.25 0.00 -1.07 0.00 0.00 179.97 179.48 3h6o h ASN 318 N 0.66 0.09 -0.00 0.00 -0.26 -0.96 0.12 115.58 115.22 3h6o h ASN 318 Ca 0.08 0.04 -0.04 0.00 -0.56 0.00 0.00 56.30 55.82 3h6o h ASN 318 Cb 0.82 0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 38.11 3h6o h ASN 318 CO 0.07 0.08 -0.10 -0.09 -1.06 0.00 0.00 177.43 176.34 3h6o h ARG 319 N 0.23 0.23 0.00 0.81 2.43 -0.85 -2.96 114.38 114.27 3h6o h ARG 319 Ca 0.15 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3h6o h ARG 319 Cb 0.14 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3h6o h ARG 319 CO -0.17 0.34 -0.48 0.00 -1.51 0.00 0.00 179.97 178.16 3h6o n ALA 320 N -2.49 3.18 -1.05 2.80 0.00 -0.44 -4.95 120.51 117.55 3h6o n ALA 320 Ca -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 53.44 53.13 3h6o n ALA 320 Cb 0.24 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 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 1.44 0.53 3.80 0.00 0.00 -0.14 -5.05 105.19 105.77 3h6o n GLY 321 Ca 0.05 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.79 3.16 0.36 1.61 1.02 -0.23 -4.89 119.74 118.98 3h6o s LYS 322 Ca 0.00 -0.39 -0.28 0.00 0.02 0.00 0.00 55.97 55.31 3h6o s LYS 322 Cb 0.00 -2.93 -0.11 0.00 -0.52 0.00 0.00 37.83 34.27 3h6o s LYS 322 CO 0.00 0.68 1.44 -2.14 -0.92 0.00 0.00 175.35 174.41 3h6o s PRO 323 N -1.50 4.17 -0.03 -1.68 0.02 -1.26 -4.33 135.00 130.41 3h6o s PRO 323 Ca 0.20 2.48 0.03 0.00 0.02 0.00 0.00 61.00 63.74 3h6o s PRO 323 Cb -0.12 -3.00 -0.00 0.00 0.02 0.00 0.00 34.50 31.40 3h6o s PRO 323 CO 0.11 -0.44 -0.12 0.54 -0.33 0.00 0.00 177.00 176.75 3h6o s VAL 324 N -1.10 1.03 -0.18 3.83 0.11 -1.26 -1.58 120.40 121.24 3h6o s VAL 324 Ca 0.52 -0.51 -0.03 0.00 -2.93 0.00 0.00 61.98 59.03 3h6o s VAL 324 Cb -0.45 -0.89 -0.02 0.00 -1.53 0.00 0.00 36.38 33.50 3h6o s VAL 324 CO 0.60 0.30 -0.06 -0.63 -3.33 0.00 0.00 175.10 171.98 3h6o s ILE 325 N 0.01 3.46 -0.15 7.04 1.01 0.58 -0.72 121.20 132.43 3h6o s ILE 325 Ca -0.01 -0.49 -0.19 0.00 0.00 0.00 0.00 60.65 59.96 3h6o s ILE 325 Cb -0.08 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 3h6o s ILE 325 CO 0.01 0.47 0.54 0.00 0.00 0.00 0.00 174.94 175.95 3h6o s ALA 327 N 1.16 1.11 0.00 0.00 0.00 -1.13 -1.91 121.76 120.99 3h6o s ALA 327 Ca 0.27 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 51.00 3h6o s ALA 327 Cb -0.16 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3h6o s ALA 327 CO 0.11 -0.07 0.00 2.41 0.00 0.00 0.00 175.76 178.20 3h6o n THR 328 N 0.41 -1.53 -1.69 0.00 -1.04 -1.26 -3.60 114.28 105.57 3h6o n THR 328 Ca -0.15 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.70 3h6o n THR 328 Cb 0.58 -1.61 -0.05 0.00 -1.82 0.00 0.00 70.33 67.43 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 0.71 -1.17 -0.12 -2.82 6.02 -1.26 -4.76 117.38 113.99 3h6o n GLN 329 Ca 0.00 0.99 -0.09 0.00 -0.01 0.00 0.00 57.00 57.89 3h6o n GLN 329 Cb 0.00 -5.23 -0.01 0.00 1.02 0.00 0.00 30.24 26.01 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 0.52 -1.27 -1.09 2.86 -1.88 -3.25 114.93 110.82 3h6o h MET 330 Ca -0.34 -0.08 -0.51 0.00 -2.06 0.00 0.00 59.70 56.71 3h6o h MET 330 Cb 1.11 -0.09 -0.41 0.00 0.06 0.00 0.00 31.60 32.27 3h6o h MET 330 CO 0.48 0.47 -0.88 1.28 1.06 0.00 0.00 176.91 179.31 3h6o n LEU 331 N -4.72 3.69 -0.31 1.22 4.77 -1.26 -4.57 117.00 115.82 3h6o n LEU 331 Ca -0.01 -4.68 -0.00 0.00 -0.03 0.00 0.00 56.01 51.30 3h6o n LEU 331 Cb 0.11 -0.17 0.13 0.00 -2.33 0.00 0.00 43.42 41.16 3h6o n LEU 331 CO 0.36 1.99 1.20 -0.08 -1.33 0.00 0.00 177.39 179.53 3h6o h GLU 332 N 2.67 0.97 0.00 3.23 4.57 -1.97 -0.85 114.58 123.20 3h6o h GLU 332 Ca 0.18 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 3h6o h GLU 332 Cb 1.06 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 29.43 3h6o h GLU 332 CO 0.72 0.64 -0.05 0.66 -1.18 0.00 0.00 179.01 179.80 3h6o h SER 333 N 1.00 0.00 0.16 1.04 4.64 -1.93 -2.03 113.55 116.43 3h6o h SER 333 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3h6o h SER 333 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3h6o h SER 333 CO -0.15 0.05 0.00 0.23 -0.87 0.00 0.00 176.83 176.09 3h6o n MET 334 N -3.78 0.19 -0.22 4.77 2.81 -0.33 -1.13 117.12 119.42 3h6o n MET 334 Ca -0.02 0.15 -0.02 0.00 -1.81 0.00 0.00 57.70 56.00 3h6o n MET 334 Cb 0.15 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.35 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 1.22 0.00 2.02 2.04 -1.52 -3.35 117.51 117.92 3h6o h ILE 335 Ca 0.00 -0.55 -0.22 0.00 1.00 0.00 0.00 64.86 65.08 3h6o h ILE 335 Cb 0.08 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.35 3h6o h ILE 335 CO 0.00 0.25 -1.84 0.29 0.00 0.00 0.00 178.15 176.85 3h6o n LYS 336 N -4.36 1.51 -4.23 2.37 5.02 -0.39 -0.85 118.16 117.24 3h6o n LYS 336 Ca 0.07 0.02 -0.31 0.00 -2.02 0.00 0.00 58.31 56.08 3h6o n LYS 336 Cb 0.10 -1.31 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 3h6o n LYS 336 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3h6o s LYS 337 N -2.29 2.49 0.00 1.97 1.02 -0.29 -4.89 119.74 117.74 3h6o s LYS 337 Ca -0.11 -0.83 0.31 0.00 0.02 0.00 0.00 55.97 55.36 3h6o s LYS 337 Cb 0.04 -2.50 1.78 0.00 -0.52 0.00 0.00 37.83 36.63 3h6o s LYS 337 CO 0.45 0.55 2.15 -0.35 -0.92 0.00 0.00 175.35 177.23 3h6o n PRO 338 N 0.87 0.86 -3.95 -1.68 -0.04 -1.26 -4.05 135.00 125.76 3h6o n PRO 338 Ca -0.13 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.22 3h6o n PRO 338 Cb 0.52 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.11 0.19 0.90 0.54 3.00 -1.26 -4.92 118.95 115.29 3h6o s ARG 339 Ca 0.43 -0.30 -0.12 0.00 0.00 0.00 0.00 55.73 55.74 3h6o s ARG 339 Cb 0.21 -0.01 0.13 0.00 0.00 0.00 0.00 34.95 35.28 3h6o s ARG 339 CO 0.37 -0.01 1.12 -1.25 0.00 0.00 0.00 175.30 175.54 3h6o s PRO 340 N -0.67 1.24 0.75 3.54 0.04 -1.26 -4.60 135.00 134.04 3h6o s PRO 340 Ca -0.07 0.43 -0.09 0.00 0.04 0.00 0.00 61.00 61.31 3h6o s PRO 340 Cb -0.05 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.72 3h6o s PRO 340 CO -0.00 -2.16 1.10 0.95 0.04 0.00 0.00 177.00 176.92 3h6o s THR 341 N -3.18 2.27 0.19 1.26 -4.23 -1.26 -4.95 115.64 105.74 3h6o s THR 341 Ca 0.63 -0.08 -0.01 0.00 -1.18 0.00 0.00 61.69 61.05 3h6o s THR 341 Cb -0.15 -3.05 -0.08 0.00 1.34 0.00 0.00 72.50 70.56 3h6o s THR 341 CO 0.54 -0.06 1.48 0.03 -0.54 0.00 0.00 174.62 176.07 3h6o h ARG 342 N -0.81 0.42 -1.00 3.99 2.47 -1.99 -2.48 114.38 114.96 3h6o h ARG 342 Ca -0.45 -0.30 0.09 0.00 -1.26 0.00 0.00 59.98 58.05 3h6o h ARG 342 Cb 1.32 0.05 -0.07 0.00 -1.65 0.00 0.00 29.97 29.61 3h6o h ARG 342 CO 0.63 0.93 0.64 0.00 0.56 0.00 0.00 179.97 182.73 3h6o h ALA 343 N 1.00 1.46 -0.23 0.04 0.00 -1.99 -2.00 119.26 117.54 3h6o h ALA 343 Ca -0.02 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3h6o h ALA 343 Cb 1.20 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h6o h ALA 343 CO 0.11 0.35 -0.37 0.93 0.00 0.00 0.00 179.25 180.27 3h6o h GLU 344 N 1.10 0.65 -0.06 0.00 5.08 -1.70 -0.75 114.58 118.89 3h6o h GLU 344 Ca 0.46 -0.40 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 3h6o h GLU 344 Cb 0.31 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3h6o h GLU 344 CO -0.21 1.01 -0.46 0.78 -1.00 0.00 0.00 179.01 179.14 3h6o h GLY 345 N 0.36 0.16 0.93 -3.84 0.00 -1.45 -1.99 103.07 97.24 3h6o h GLY 345 Ca 0.02 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 3h6o h GLY 345 CO 0.08 0.14 0.08 0.23 0.00 0.00 0.00 176.54 177.08 3h6o h SER 346 N 0.12 0.20 -0.53 0.19 0.87 -1.28 -2.51 113.55 110.61 3h6o h SER 346 Ca 0.01 -0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.48 3h6o h SER 346 Cb 0.86 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.74 3h6o h SER 346 CO 0.07 0.24 0.34 -0.78 -0.53 0.00 0.00 176.83 176.17 3h6o h ASP 347 N 0.15 0.58 0.05 6.23 3.58 -0.89 0.10 116.42 126.21 3h6o h ASP 347 Ca 0.06 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 3h6o h ASP 347 Cb 0.09 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.00 3h6o h ASP 347 CO -0.01 0.42 -0.02 0.58 -2.88 0.00 0.00 179.24 177.33 3h6o h VAL 348 N 0.69 1.09 -0.57 2.25 2.07 -1.40 -1.59 116.25 118.80 3h6o h VAL 348 Ca 0.20 -0.45 0.07 0.00 0.82 0.00 0.00 66.70 67.34 3h6o h VAL 348 Cb -0.06 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 3h6o h VAL 348 CO -0.05 0.11 0.25 0.00 0.02 0.00 0.00 177.57 177.90 3h6o h ALA 349 N 0.68 0.73 -0.16 1.67 0.00 -1.28 -2.65 119.26 118.26 3h6o h ALA 349 Ca -0.01 0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3h6o h ALA 349 Cb 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3h6o h ALA 349 CO 0.01 -0.13 -0.50 -0.91 0.00 0.00 0.00 179.25 177.72 3h6o h ASN 350 N 0.47 0.47 -0.65 0.00 2.35 -0.94 0.60 115.58 117.86 3h6o h ASN 350 Ca 0.27 -0.23 0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3h6o h ASN 350 Cb 0.26 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 3h6o h ASN 350 CO -0.23 0.89 0.40 0.00 -1.65 0.00 0.00 177.43 176.83 3h6o h ALA 351 N 1.13 0.86 -0.11 -0.83 0.00 -1.04 0.18 119.26 119.44 3h6o h ALA 351 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h6o h ALA 351 Cb 1.00 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 3h6o h ALA 351 CO 0.09 0.14 0.04 0.28 0.00 0.00 0.00 179.25 179.79 3h6o h VAL 352 N 0.77 1.16 -0.90 0.00 2.07 -1.09 -0.85 116.25 117.40 3h6o h VAL 352 Ca 0.27 -0.49 0.04 0.00 0.82 0.00 0.00 66.70 67.33 3h6o h VAL 352 Cb 0.06 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 3h6o h VAL 352 CO -0.12 0.15 0.59 -0.07 0.02 0.00 0.00 177.57 178.14 3h6o h LEU 353 N 0.01 0.97 -1.55 2.57 3.38 -0.78 -1.02 115.31 118.90 3h6o h LEU 353 Ca 0.04 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.03 3h6o h LEU 353 Cb 0.19 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3h6o h LEU 353 CO -0.00 0.67 0.34 0.44 0.09 0.00 0.00 178.44 179.98 3h6o h ASP 354 N 1.13 0.50 0.00 -0.43 3.32 -0.42 -3.46 116.42 117.06 3h6o h ASP 354 Ca 0.36 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.40 3h6o h ASP 354 Cb 0.02 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3h6o h ASP 354 CO -0.11 0.35 0.00 0.61 -1.72 0.00 0.00 179.24 178.37 3h6o n GLY 355 N -1.48 1.92 3.74 2.75 0.00 -0.39 -4.71 105.19 107.03 3h6o n GLY 355 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.00 3.56 0.22 4.61 0.00 -0.38 -4.91 121.76 122.86 3h6o s ALA 356 Ca 0.00 1.18 -0.02 0.00 0.00 0.00 0.00 51.96 53.12 3h6o s ALA 356 Cb 0.00 -3.50 0.20 0.00 0.00 0.00 0.00 23.12 19.82 3h6o s ALA 356 CO 0.00 -0.60 1.58 -0.44 0.00 0.00 0.00 175.76 176.30 3h6o h ASP 357 N 5.20 0.61 -4.91 0.00 3.32 -1.23 -3.44 116.42 115.97 3h6o h ASP 357 Ca -0.45 -0.27 -0.17 0.00 0.02 0.00 0.00 57.03 56.15 3h6o h ASP 357 Cb 1.22 -0.17 -0.21 0.00 0.22 0.00 0.00 39.33 40.38 3h6o h ASP 357 CO 0.77 0.95 -0.68 0.00 -1.72 0.00 0.00 179.24 178.56 3h6o s ILE 359 N -1.37 2.22 0.05 0.00 -4.36 -0.67 -1.17 121.20 115.91 3h6o s ILE 359 Ca -0.15 -1.85 0.06 0.00 -0.26 0.00 0.00 60.65 58.45 3h6o s ILE 359 Cb -0.09 -2.00 -0.03 0.00 1.25 0.00 0.00 42.46 41.59 3h6o s ILE 359 CO -0.01 -0.03 -0.17 -0.32 0.24 0.00 0.00 174.94 174.65 3h6o s MET 360 N -2.32 1.10 -0.09 0.37 1.75 -0.80 -1.92 119.30 117.38 3h6o s MET 360 Ca 0.16 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 53.73 3h6o s MET 360 Cb -0.09 -1.19 -0.01 0.00 2.84 0.00 0.00 34.83 36.38 3h6o s MET 360 CO 0.07 0.29 -0.19 -0.51 -0.65 0.00 0.00 175.02 174.03 3h6o s LEU 361 N -1.34 2.38 0.00 4.11 1.43 0.44 -4.42 118.68 121.28 3h6o s LEU 361 Ca 0.04 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 3h6o s LEU 361 Cb -0.09 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.65 3h6o s LEU 361 CO 0.02 0.21 0.00 -1.20 0.23 0.00 0.00 176.35 175.61 3h6o n SER 362 N 3.19 0.00 -0.05 2.29 7.64 -1.26 -1.04 113.62 124.38 3h6o n SER 362 Ca -0.18 0.00 0.25 0.00 1.01 0.00 0.00 58.87 59.95 3h6o n SER 362 Cb 0.52 0.00 0.71 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 1.75 0.23 0.00 -1.97 -1.16 103.07 101.92 3h6o h GLY 363 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 3h6o h GLY 363 CO 0.00 0.00 0.15 0.83 0.00 0.00 0.00 176.54 177.52 3h6o h GLU 364 N 0.00 0.24 0.00 4.80 3.07 -1.90 -1.42 114.58 119.37 3h6o h GLU 364 Ca 0.32 -0.01 -0.23 0.00 -0.50 0.00 0.00 59.36 58.93 3h6o h GLU 364 Cb 1.57 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 29.38 3h6o h GLU 364 CO -0.00 0.16 -1.88 0.25 -1.40 0.00 0.00 179.01 176.13 3h6o n THR 365 N -4.50 0.89 -0.01 1.13 -2.24 -0.53 -3.49 114.28 105.52 3h6o n THR 365 Ca 0.01 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 61.23 3h6o n THR 365 Cb 0.11 -0.87 -0.07 0.00 -2.10 0.00 0.00 70.33 67.40 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 0.31 0.09 0.00 6.98 0.00 -0.52 -3.34 119.26 122.77 3h6o h ALA 366 Ca -0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3h6o h ALA 366 Cb 1.66 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3h6o h ALA 366 CO -0.02 -0.30 0.00 1.63 0.00 0.00 0.00 179.25 180.56 3h6o n LYS 367 N -4.92 -0.26 -1.42 0.00 4.01 -1.01 -0.39 118.16 114.16 3h6o n LYS 367 Ca -0.06 -0.24 -0.29 0.00 -0.51 0.00 0.00 58.31 57.21 3h6o n LYS 367 Cb 0.13 -0.69 0.15 0.00 -0.51 0.00 0.00 35.03 34.12 3h6o n LYS 367 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 3h6o s GLY 368 N -0.03 1.57 0.05 0.72 0.00 -0.57 -4.76 107.32 104.31 3h6o s GLY 368 Ca 0.00 -0.49 0.26 0.00 0.00 0.00 0.00 44.72 44.50 3h6o s GLY 368 CO 0.00 0.10 1.58 1.22 0.00 0.00 0.00 173.10 176.00 3h6o n ASP 369 N -3.91 0.45 -2.86 1.64 8.00 -0.03 -4.41 116.55 115.43 3h6o n ASP 369 Ca 0.06 0.15 -0.14 0.00 0.71 0.00 0.00 54.79 55.58 3h6o n ASP 369 Cb 0.59 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.58 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 -1.74 0.98 -0.27 1.24 4.01 -1.26 -4.94 117.16 115.18 3h6o n TYR 370 Ca 0.05 -3.23 0.08 0.00 -0.16 0.00 0.00 57.90 54.64 3h6o n TYR 370 Cb 0.37 -0.38 0.32 0.00 -0.31 0.00 0.00 39.34 39.33 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 2.98 0.82 0.08 -0.72 0.13 -1.77 -1.94 132.00 131.59 3h6o h PRO 371 Ca 0.00 -0.05 -0.26 0.00 -0.87 0.00 0.00 66.00 64.82 3h6o h PRO 371 Cb 1.07 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 32.02 3h6o h PRO 371 CO 0.53 0.54 -1.13 -0.07 -0.23 0.00 0.00 178.00 177.64 3h6o h LEU 372 N 0.84 0.55 -0.67 1.56 3.38 -1.92 -2.99 115.31 116.07 3h6o h LEU 372 Ca 0.40 -0.51 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 3h6o h LEU 372 Cb 0.43 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3h6o h LEU 372 CO -0.17 1.35 -0.14 -0.33 0.09 0.00 0.00 178.44 179.24 3h6o h GLU 373 N 0.17 0.89 -0.40 1.13 3.07 -1.89 -1.46 114.58 116.08 3h6o h GLU 373 Ca -0.13 -0.33 0.02 0.00 -0.50 0.00 0.00 59.36 58.42 3h6o h GLU 373 Cb 1.81 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 29.64 3h6o h GLU 373 CO 0.20 0.97 0.24 0.00 -1.40 0.00 0.00 179.01 179.01 3h6o h ALA 374 N 1.04 0.51 0.25 3.43 0.00 -1.36 -0.28 119.26 122.85 3h6o h ALA 374 Ca 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3h6o h ALA 374 Cb 0.67 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3h6o h ALA 374 CO 0.05 -0.09 -0.12 0.28 0.00 0.00 0.00 179.25 179.37 3h6o h VAL 375 N 0.48 0.81 -0.42 0.00 2.07 -1.46 -1.98 116.25 115.76 3h6o h VAL 375 Ca 0.16 -0.53 0.12 0.00 0.82 0.00 0.00 66.70 67.27 3h6o h VAL 375 Cb 0.01 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 3h6o h VAL 375 CO -0.07 0.11 0.33 0.03 0.02 0.00 0.00 177.57 177.99 3h6o h ARG 376 N -0.61 0.00 0.08 1.57 3.08 -1.14 -1.14 114.38 116.22 3h6o h ARG 376 Ca -0.03 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.86 3h6o h ARG 376 Cb 0.44 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.51 3h6o h ARG 376 CO 0.06 0.00 -0.67 1.98 -1.07 0.00 0.00 179.97 180.26 3h6o h MET 377 N 0.00 0.31 -0.99 0.04 4.05 -0.75 -2.06 114.93 115.52 3h6o h MET 377 Ca 0.20 -0.45 0.09 0.00 -0.28 0.00 0.00 59.70 59.26 3h6o h MET 377 Cb 0.85 0.15 -0.07 0.00 -0.80 0.00 0.00 31.60 31.73 3h6o h MET 377 CO -0.00 1.17 0.63 1.96 0.23 0.00 0.00 176.91 180.90 3h6o h GLN 378 N -0.32 1.06 -0.41 0.39 4.20 -0.82 -0.19 115.11 119.03 3h6o h GLN 378 Ca -0.11 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.52 3h6o h GLN 378 Cb 1.47 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 3h6o h GLN 378 CO 0.13 0.70 0.19 1.25 -0.67 0.00 0.00 178.83 180.43 3h6o h HIS 379 N 1.09 0.59 -0.29 2.96 2.76 -1.26 0.12 115.15 121.13 3h6o h HIS 379 Ca 0.45 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.55 3h6o h HIS 379 Cb 0.29 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 3h6o h HIS 379 CO -0.01 0.50 0.03 -0.07 -1.30 0.00 0.00 177.93 177.09 3h6o h LEU 380 N 0.52 0.47 -0.10 0.26 3.38 -0.84 -2.96 115.31 116.03 3h6o h LEU 380 Ca 0.14 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3h6o h LEU 380 Cb 0.14 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3h6o h LEU 380 CO -0.02 0.63 -0.00 0.40 0.09 0.00 0.00 178.44 179.54 3h6o h ILE 381 N 0.30 1.25 -0.57 1.22 2.04 -1.03 -2.46 117.51 118.26 3h6o h ILE 381 Ca 0.09 -0.80 0.12 0.00 1.00 0.00 0.00 64.86 65.26 3h6o h ILE 381 Cb 0.37 1.59 -0.10 0.00 -0.74 0.00 0.00 36.82 37.93 3h6o h ILE 381 CO 0.01 0.23 -0.03 0.00 0.00 0.00 0.00 178.15 178.36 3h6o h ALA 382 N 0.74 0.52 -0.60 1.87 0.00 -0.79 -0.56 119.26 120.43 3h6o h ALA 382 Ca 0.03 0.18 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3h6o h ALA 382 Cb 0.35 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3h6o h ALA 382 CO 0.01 -0.40 0.12 -0.09 0.00 0.00 0.00 179.25 178.88 3h6o h ARG 383 N 0.09 0.98 -0.60 0.00 2.43 -1.49 0.11 114.38 115.90 3h6o h ARG 383 Ca 0.29 -0.25 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3h6o h ARG 383 Cb 0.46 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 3h6o h ARG 383 CO -0.51 0.92 0.27 0.93 -1.51 0.00 0.00 179.97 180.07 3h6o h GLU 384 N 0.89 0.87 -0.30 0.20 4.39 -0.88 -3.04 114.58 116.72 3h6o h GLU 384 Ca 0.19 -0.14 -0.15 0.00 0.34 0.00 0.00 59.36 59.59 3h6o h GLU 384 Cb 0.39 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3h6o h GLU 384 CO 0.01 0.72 -0.43 0.00 -1.16 0.00 0.00 179.01 178.15 3h6o h ALA 385 N 1.11 0.67 -0.99 3.43 0.00 -0.83 -3.11 119.26 119.54 3h6o h ALA 385 Ca 0.20 -0.47 0.07 0.00 0.00 0.00 0.00 54.91 54.71 3h6o h ALA 385 Cb 0.15 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 3h6o h ALA 385 CO -0.02 0.67 0.63 0.93 0.00 0.00 0.00 179.25 181.46 3h6o h GLU 386 N 0.61 1.12 0.00 0.00 5.08 -0.92 -1.02 114.58 119.45 3h6o h GLU 386 Ca 0.04 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 3h6o h GLU 386 Cb 0.99 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3h6o h GLU 386 CO 0.09 0.74 -0.25 0.00 -1.00 0.00 0.00 179.01 178.59 3h6o h ALA 387 N 1.45 1.23 -0.00 3.43 0.00 -1.47 -3.16 119.26 120.74 3h6o h ALA 387 Ca 0.43 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3h6o h ALA 387 Cb 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3h6o h ALA 387 CO -0.17 0.31 -0.24 0.00 0.00 0.00 0.00 179.25 179.14 3h6o n ALA 388 N -2.33 2.96 -1.79 0.00 0.00 -0.41 -4.57 120.51 114.37 3h6o n ALA 388 Ca -0.01 -0.25 -0.41 0.00 0.00 0.00 0.00 53.44 52.76 3h6o n ALA 388 Cb 0.36 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 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 -2.88 2.21 -1.21 0.00 1.01 -1.04 -4.92 121.20 114.36 3h6o s ILE 389 Ca 0.16 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.88 3h6o s ILE 389 Cb 0.19 -3.12 0.19 0.00 0.01 0.00 0.00 42.46 39.73 3h6o s ILE 389 CO 0.59 0.04 1.54 0.00 0.00 0.00 0.00 174.94 177.10 3h6o n TYR 390 N 1.54 4.19 0.04 3.97 9.36 -1.26 -4.79 117.16 130.21 3h6o n TYR 390 Ca 0.05 -3.19 0.10 0.00 3.32 0.00 0.00 57.90 58.18 3h6o n TYR 390 Cb 0.39 -1.99 0.55 0.00 -0.63 0.00 0.00 39.34 37.66 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 6.52 0.27 0.33 2.98 3.86 -1.91 -0.95 115.15 126.24 3h6o h HIS 391 Ca 0.32 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.53 3h6o h HIS 391 Cb 0.78 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 3h6o h HIS 391 CO 1.10 0.15 -0.28 1.25 0.86 0.00 0.00 177.93 181.01 3h6o h LEU 392 N 0.27 -0.73 -0.04 2.43 5.85 -1.87 0.11 115.31 121.33 3h6o h LEU 392 Ca 0.17 0.06 -0.23 0.00 0.84 0.00 0.00 57.88 58.72 3h6o h LEU 392 Cb 0.34 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 3h6o h LEU 392 CO -0.03 -0.41 -1.06 -0.61 -0.34 0.00 0.00 178.44 175.98 3h6o h GLN 393 N -0.62 0.20 0.37 1.25 4.15 -1.90 -2.91 115.11 115.65 3h6o h GLN 393 Ca -0.02 -0.29 -0.00 0.00 0.77 0.00 0.00 58.65 59.11 3h6o h GLN 393 Cb 0.55 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 3h6o h GLN 393 CO -0.03 1.08 -0.36 1.25 -1.93 0.00 0.00 178.83 178.84 3h6o h LEU 394 N 0.08 -0.99 -0.92 -2.39 5.85 -1.05 -1.13 115.31 114.76 3h6o h LEU 394 Ca -0.08 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3h6o h LEU 394 Cb 1.76 0.33 -0.04 0.00 0.37 0.00 0.00 40.66 43.08 3h6o h LEU 394 CO 0.16 -0.51 0.54 0.15 -0.34 0.00 0.00 178.44 178.44 3h6o h PHE 395 N -0.76 1.22 -0.80 1.25 3.04 -0.88 -1.52 116.94 118.49 3h6o h PHE 395 Ca -0.03 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 61.96 3h6o h PHE 395 Cb 0.68 -0.40 -0.06 0.00 2.56 0.00 0.00 35.95 38.74 3h6o h PHE 395 CO -0.20 0.82 0.49 0.93 -2.02 0.00 0.00 178.31 178.33 3h6o h GLU 396 N 1.27 0.90 -0.16 1.11 5.08 -1.30 0.24 114.58 121.72 3h6o h GLU 396 Ca 0.33 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.52 3h6o h GLU 396 Cb -0.03 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.02 3h6o h GLU 396 CO -0.06 0.59 -0.35 0.93 -1.00 0.00 0.00 179.01 179.12 3h6o h GLU 397 N 0.93 0.52 -0.56 2.33 5.08 -0.70 0.22 114.58 122.39 3h6o h GLU 397 Ca 0.34 -0.35 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3h6o h GLU 397 Cb 0.11 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3h6o h GLU 397 CO -0.15 0.96 0.10 -0.07 -1.00 0.00 0.00 179.01 178.85 3h6o h LEU 398 N 0.16 0.84 0.55 1.33 3.38 -1.15 0.26 115.31 120.68 3h6o h LEU 398 Ca 0.00 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 3h6o h LEU 398 Cb 0.95 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.49 3h6o h LEU 398 CO 0.08 0.84 -0.26 -0.09 0.09 0.00 0.00 178.44 179.10 3h6o h ARG 399 N 0.85 -0.71 -0.94 1.13 2.43 -0.46 -2.06 114.38 114.62 3h6o h ARG 399 Ca 0.18 0.05 0.22 0.00 -0.81 0.00 0.00 59.98 59.61 3h6o h ARG 399 Cb 0.36 0.16 -0.12 0.00 -0.42 0.00 0.00 29.97 29.95 3h6o h ARG 399 CO 0.01 -0.43 0.49 0.00 -1.51 0.00 0.00 179.97 178.53 3h6o h ARG 400 N -0.86 0.51 -0.49 0.20 3.08 -0.41 -2.11 114.38 114.29 3h6o h ARG 400 Ca -0.08 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3h6o h ARG 400 Cb 0.61 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3h6o h ARG 400 CO 0.12 0.34 0.00 1.28 -1.07 0.00 0.00 179.97 180.64 3h6o n LEU 401 N -4.94 2.45 -4.60 3.04 7.99 0.91 -4.86 117.00 116.99 3h6o n LEU 401 Ca 0.23 -1.23 -0.40 0.00 -0.01 0.00 0.00 56.01 54.60 3h6o n LEU 401 Cb 0.65 -0.35 -0.08 0.00 -0.11 0.00 0.00 43.42 43.53 3h6o n LEU 401 CO 0.16 0.50 0.15 0.00 -1.51 0.00 0.00 177.39 176.69 3h6o s ALA 402 N -1.60 3.55 0.23 -1.18 0.00 -0.79 -5.00 121.76 116.97 3h6o s ALA 402 Ca 0.27 -0.81 -0.31 0.00 0.00 0.00 0.00 51.96 51.10 3h6o s ALA 402 Cb 0.16 -2.84 -0.14 0.00 0.00 0.00 0.00 23.12 20.30 3h6o s ALA 402 CO 0.15 -0.82 1.33 -2.30 0.00 0.00 0.00 175.76 174.12 3h6o n PRO 403 N 5.48 1.80 -2.64 0.00 -0.02 -1.26 -4.91 135.00 133.45 3h6o n PRO 403 Ca -0.06 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 3h6o n PRO 403 Cb 0.50 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 3h6o n PRO 403 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h6o s ILE 404 N -0.18 4.10 0.11 4.25 1.01 -1.26 -4.98 121.20 124.25 3h6o s ILE 404 Ca 0.68 0.74 0.01 0.00 0.00 0.00 0.00 60.65 62.08 3h6o s ILE 404 Cb -0.70 -4.69 -0.04 0.00 0.01 0.00 0.00 42.46 37.04 3h6o s ILE 404 CO 0.51 -1.30 -0.04 0.42 0.00 0.00 0.00 174.94 174.53 3h6o s THR 405 N 4.73 0.60 -1.07 2.92 -4.23 -1.26 -5.05 115.64 112.28 3h6o s THR 405 Ca 0.40 -1.93 0.17 0.00 -1.18 0.00 0.00 61.69 59.14 3h6o s THR 405 Cb -0.09 -1.79 0.17 0.00 1.34 0.00 0.00 72.50 72.13 3h6o s THR 405 CO 0.24 -0.77 1.54 -1.54 -0.54 0.00 0.00 174.62 173.54 3h6o n SER 406 N -0.07 0.00 -4.61 3.99 3.41 -1.26 -4.83 113.62 110.25 3h6o n SER 406 Ca -0.11 0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 58.50 3h6o n SER 406 Cb 0.62 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 64.07 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 -2.93 5.66 0.41 4.04 -1.08 -1.26 -4.87 116.67 116.64 3h6o s ASP 407 Ca 0.09 1.80 0.09 0.00 -0.52 0.00 0.00 52.55 54.01 3h6o s ASP 407 Cb 0.11 -2.52 0.85 0.00 -1.46 0.00 0.00 42.92 39.91 3h6o s ASP 407 CO 0.30 -1.81 1.99 1.55 0.52 0.00 0.00 175.17 177.72 3h6o h PRO 408 N 14.09 0.35 -0.47 4.34 0.13 -1.91 -2.70 132.00 145.83 3h6o h PRO 408 Ca -0.40 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 3h6o h PRO 408 Cb 1.22 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 3h6o h PRO 408 CO 0.98 0.34 -0.13 1.79 -0.23 0.00 0.00 178.00 180.75 3h6o h THR 409 N 0.35 1.27 -0.19 1.56 1.35 -1.90 0.91 112.91 116.26 3h6o h THR 409 Ca 0.08 -1.26 -0.02 0.00 -0.55 0.00 0.00 66.41 64.67 3h6o h THR 409 Cb 0.16 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 3h6o h THR 409 CO -0.00 0.43 0.05 -0.33 -0.25 0.00 0.00 175.52 175.42 3h6o h GLU 410 N 0.75 0.30 -0.56 4.72 5.08 -1.87 -1.28 114.58 121.72 3h6o h GLU 410 Ca 0.12 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.50 3h6o h GLU 410 Cb 0.68 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 3h6o h GLU 410 CO 0.05 0.42 0.16 0.00 -1.00 0.00 0.00 179.01 178.64 3h6o h ALA 411 N 0.87 0.68 -0.58 3.43 0.00 -1.31 -1.46 119.26 120.89 3h6o h ALA 411 Ca 0.06 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3h6o h ALA 411 Cb 0.25 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3h6o h ALA 411 CO -0.00 -0.26 0.36 1.15 0.00 0.00 0.00 179.25 180.51 3h6o h THR 412 N 0.32 1.16 -0.64 0.00 2.02 -0.77 -2.00 112.91 113.01 3h6o h THR 412 Ca 0.29 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 3h6o h THR 412 Cb 0.38 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 3h6o h THR 412 CO -0.33 0.17 0.34 0.00 0.37 0.00 0.00 175.52 176.06 3h6o h ALA 413 N 1.19 0.82 -0.03 6.16 0.00 -0.48 -2.22 119.26 124.70 3h6o h ALA 413 Ca 0.21 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 3h6o h ALA 413 Cb -0.04 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.50 3h6o h ALA 413 CO -0.04 0.35 -0.93 -0.24 0.00 0.00 0.00 179.25 178.39 3h6o h VAL 414 N 0.87 1.35 -0.96 0.00 3.04 -1.26 -2.60 116.25 116.69 3h6o h VAL 414 Ca 0.22 -2.29 0.05 0.00 -1.01 0.00 0.00 66.70 63.67 3h6o h VAL 414 Cb 0.07 2.32 -0.06 0.00 -2.01 0.00 0.00 31.29 31.60 3h6o h VAL 414 CO -0.03 0.70 0.62 1.23 -1.01 0.00 0.00 177.57 179.07 3h6o h GLY 415 N 0.93 1.43 1.19 3.17 0.00 -1.28 -0.08 103.07 108.43 3h6o h GLY 415 Ca -0.08 -0.46 -0.15 0.00 0.00 0.00 0.00 47.33 46.64 3h6o h GLY 415 CO 0.17 0.36 -0.33 0.00 0.00 0.00 0.00 176.54 176.75 3h6o h ALA 416 N 1.42 0.67 -0.23 3.60 0.00 -1.24 -0.71 119.26 122.76 3h6o h ALA 416 Ca 0.40 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3h6o h ALA 416 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3h6o h ALA 416 CO -0.15 0.67 -0.04 0.28 0.00 0.00 0.00 179.25 180.02 3h6o h VAL 417 N 0.75 1.28 -0.32 0.00 2.07 -1.18 -0.02 116.25 118.83 3h6o h VAL 417 Ca 0.08 -1.00 0.06 0.00 0.82 0.00 0.00 66.70 66.66 3h6o h VAL 417 Cb 0.90 1.46 -0.06 0.00 -1.52 0.00 0.00 31.29 32.07 3h6o h VAL 417 CO 0.08 0.31 -0.07 -0.08 0.02 0.00 0.00 177.57 177.83 3h6o h GLU 418 N 0.18 0.01 -0.90 1.57 4.57 -0.98 -1.57 114.58 117.45 3h6o h GLU 418 Ca 0.06 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.28 3h6o h GLU 418 Cb 0.48 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.01 3h6o h GLU 418 CO 0.02 0.01 0.59 0.00 -1.18 0.00 0.00 179.01 178.45 3h6o h ALA 419 N 1.31 1.44 -0.35 2.92 0.00 -0.99 -1.68 119.26 121.91 3h6o h ALA 419 Ca 0.15 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3h6o h ALA 419 Cb 0.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3h6o h ALA 419 CO -0.32 0.47 -0.26 0.66 0.00 0.00 0.00 179.25 179.80 3h6o h SER 420 N 1.12 0.73 -0.33 0.00 4.64 -0.14 -2.39 113.55 117.18 3h6o h SER 420 Ca 0.36 -0.27 -0.08 0.00 -0.47 0.00 0.00 61.79 61.33 3h6o h SER 420 Cb 0.03 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3h6o h SER 420 CO -0.11 0.96 -0.09 -0.26 -0.87 0.00 0.00 176.83 176.46 3h6o h PHE 421 N 0.62 0.73 -0.45 4.77 0.04 -1.02 -0.62 116.94 121.00 3h6o h PHE 421 Ca 0.08 -0.16 0.05 0.00 2.80 0.00 0.00 57.97 60.74 3h6o h PHE 421 Cb 0.77 -0.18 -0.05 0.00 2.20 0.00 0.00 35.95 38.69 3h6o h PHE 421 CO 0.04 0.82 0.17 -0.22 -0.60 0.00 0.00 178.31 178.52 3h6o h LYS 422 N 0.42 0.33 -0.50 1.51 1.63 -1.00 -2.85 116.57 116.10 3h6o h LYS 422 Ca 0.08 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 3h6o h LYS 422 Cb 0.60 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 3h6o h LYS 422 CO 0.04 0.22 0.00 0.00 -3.45 0.00 0.00 179.45 176.25 3h6o s SER 425 N -3.61 5.85 0.51 0.00 1.04 -0.81 -4.96 113.70 111.72 3h6o s SER 425 Ca 0.44 1.65 0.28 0.00 0.48 0.00 0.00 55.95 58.80 3h6o s SER 425 Cb -0.22 -2.51 1.32 0.00 0.10 0.00 0.00 66.02 64.71 3h6o s SER 425 CO 0.95 -1.12 1.99 1.23 0.98 0.00 0.00 173.24 177.27 3h6o h GLY 426 N 0.00 0.00 -3.75 7.32 0.00 -1.72 -3.43 103.07 101.50 3h6o h GLY 426 Ca -0.45 0.00 0.22 0.00 0.00 0.00 0.00 47.33 47.09 3h6o h GLY 426 CO 0.59 0.00 0.74 0.00 0.00 0.00 0.00 176.54 177.86 3h6o s ALA 427 N -3.93 -2.02 -0.29 3.60 0.00 -1.26 -4.29 121.76 113.57 3h6o s ALA 427 Ca -0.01 1.49 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 3h6o s ALA 427 Cb 0.12 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.19 3h6o s ALA 427 CO 0.59 -0.59 0.03 0.42 0.00 0.00 0.00 175.76 176.20 3h6o s ILE 428 N -2.46 3.41 -0.14 0.00 1.01 -0.40 -1.68 121.20 120.94 3h6o s ILE 428 Ca 0.08 -1.00 -0.17 0.00 0.00 0.00 0.00 60.65 59.55 3h6o s ILE 428 Cb -0.01 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 3h6o s ILE 428 CO -0.05 0.04 0.44 -0.63 0.00 0.00 0.00 174.94 174.73 3h6o s ILE 429 N 1.38 5.21 -0.08 2.92 1.01 0.11 -1.04 121.20 130.71 3h6o s ILE 429 Ca -0.00 0.86 -0.00 0.00 0.00 0.00 0.00 60.65 61.51 3h6o s ILE 429 Cb -0.18 -3.78 0.02 0.00 0.01 0.00 0.00 42.46 38.54 3h6o s ILE 429 CO -0.00 0.33 -0.05 -0.69 0.00 0.00 0.00 174.94 174.52 3h6o s VAL 430 N 0.69 0.78 0.02 2.92 1.01 0.05 -0.07 120.40 125.79 3h6o s VAL 430 Ca 0.24 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 3h6o s VAL 430 Cb -0.15 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 3h6o s VAL 430 CO 0.09 0.31 1.01 -0.76 0.00 0.00 0.00 175.10 175.75 3h6o s LEU 431 N 1.53 4.38 -0.15 3.92 1.43 -1.09 -0.91 118.68 127.79 3h6o s LEU 431 Ca 0.00 1.72 -0.13 0.00 -1.03 0.00 0.00 54.13 54.69 3h6o s LEU 431 Cb -0.13 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.56 3h6o s LEU 431 CO -0.05 -0.27 0.38 0.28 0.23 0.00 0.00 176.35 176.93 3h6o s THR 432 N 0.93 -0.00 -0.21 5.49 -1.32 -0.81 -4.86 115.64 114.85 3h6o s THR 432 Ca 0.52 0.02 -0.19 0.00 -1.21 0.00 0.00 61.69 60.83 3h6o s THR 432 Cb -0.22 -0.54 -0.19 0.00 -1.51 0.00 0.00 72.50 70.03 3h6o s THR 432 CO 0.28 0.01 0.16 0.29 -2.21 0.00 0.00 174.62 173.15 3h6o n LYS 433 N 3.08 0.59 0.08 7.08 5.02 -1.26 -4.21 118.16 128.54 3h6o n LYS 433 Ca -0.15 0.51 0.11 0.00 -2.02 0.00 0.00 58.31 56.77 3h6o n LYS 433 Cb 0.57 -1.71 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 3h6o n LYS 433 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3h6o n SER 434 N -4.31 0.70 0.00 4.39 3.41 -1.26 -4.62 113.62 111.93 3h6o n SER 434 Ca -0.35 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 3h6o n SER 434 Cb 0.74 0.68 0.00 0.00 -0.26 0.00 0.00 64.21 65.37 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 1.22 3.26 0.32 5.00 0.00 -1.26 -4.83 105.19 108.89 3h6o n GLY 435 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 2.38 0.84 -0.46 1.61 3.08 -1.95 -1.16 114.38 118.72 3h6o h ARG 436 Ca 0.00 -0.10 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 3h6o h ARG 436 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 3h6o h ARG 436 CO 0.00 0.64 -0.18 0.77 -1.07 0.00 0.00 179.97 180.14 3h6o h SER 437 N 0.84 0.90 -0.50 7.04 0.02 -1.94 -1.10 113.55 118.80 3h6o h SER 437 Ca 0.21 -0.31 -0.07 0.00 -0.84 0.00 0.00 61.79 60.78 3h6o h SER 437 Cb 0.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 3h6o h SER 437 CO -0.03 1.06 0.05 0.00 -1.14 0.00 0.00 176.83 176.76 3h6o h ALA 438 N 1.01 0.67 -0.97 3.77 0.00 -1.75 -2.89 119.26 119.11 3h6o h ALA 438 Ca 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3h6o h ALA 438 Cb 0.71 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3h6o h ALA 438 CO 0.05 0.44 0.61 0.45 0.00 0.00 0.00 179.25 180.81 3h6o h HIS 439 N 0.73 1.25 -0.26 0.00 -0.00 -1.03 -0.61 115.15 115.22 3h6o h HIS 439 Ca 0.15 0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.47 3h6o h HIS 439 Cb 0.45 -0.42 -0.02 0.00 -0.00 0.00 0.00 27.41 27.43 3h6o h HIS 439 CO 0.03 0.81 -0.10 1.96 -0.00 0.00 0.00 177.93 180.63 3h6o h GLN 440 N 1.32 0.43 -0.06 2.45 4.20 -1.12 -1.99 115.11 120.34 3h6o h GLN 440 Ca 0.35 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.92 3h6o h GLN 440 Cb -0.10 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.62 3h6o h GLN 440 CO -0.07 0.53 -0.08 0.28 -0.67 0.00 0.00 178.83 178.82 3h6o h VAL 441 N 0.40 1.40 -0.88 -0.54 2.07 -1.27 -3.29 116.25 114.14 3h6o h VAL 441 Ca 0.08 -1.34 0.16 0.00 0.82 0.00 0.00 66.70 66.42 3h6o h VAL 441 Cb 0.42 2.16 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 3h6o h VAL 441 CO 0.02 0.37 0.57 0.00 0.02 0.00 0.00 177.57 178.55 3h6o h ALA 442 N 0.50 1.94 0.00 1.67 0.00 -0.83 -1.78 119.26 120.76 3h6o h ALA 442 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h6o h ALA 442 Cb 0.64 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3h6o h ALA 442 CO 0.02 -0.19 -0.01 0.07 0.00 0.00 0.00 179.25 179.14 3h6o h ARG 443 N 0.60 0.00 -0.03 0.00 0.11 -1.44 -0.91 114.38 112.71 3h6o h ARG 443 Ca 0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.53 3h6o h ARG 443 Cb 0.84 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.92 3h6o h ARG 443 CO -0.20 0.01 0.00 0.66 0.10 0.00 0.00 179.97 180.54 3h6o n TYR 444 N -3.16 0.02 -3.48 4.08 4.01 -0.67 -4.96 117.16 113.00 3h6o n TYR 444 Ca -0.02 -0.01 -0.21 0.00 -0.16 0.00 0.00 57.90 57.50 3h6o n TYR 444 Cb 0.12 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.21 3h6o n TYR 444 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3h6o n ARG 445 N 0.44 -3.18 -1.30 -0.72 5.12 -0.35 -4.74 116.66 111.93 3h6o n ARG 445 Ca 0.18 0.71 -0.34 0.00 -1.93 0.00 0.00 57.85 56.47 3h6o n ARG 445 Cb 0.41 -5.26 0.11 0.00 -1.16 0.00 0.00 32.46 26.55 3h6o n ARG 445 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3h6o s PRO 446 N -5.28 1.93 0.03 5.56 0.04 -1.26 -4.93 135.00 131.09 3h6o s PRO 446 Ca 0.30 1.75 -0.19 0.00 0.04 0.00 0.00 61.00 62.90 3h6o s PRO 446 Cb -0.07 -1.81 -0.19 0.00 0.04 0.00 0.00 34.50 32.47 3h6o s PRO 446 CO 0.79 -1.99 1.20 -0.09 0.04 0.00 0.00 177.00 176.94 3h6o h ARG 447 N -0.57 0.48 -7.04 4.56 2.43 -1.95 -3.46 114.38 108.83 3h6o h ARG 447 Ca -0.47 -0.41 -0.52 0.00 -0.81 0.00 0.00 59.98 57.78 3h6o h ARG 447 Cb 1.29 0.09 0.08 0.00 -0.42 0.00 0.00 29.97 31.02 3h6o h ARG 447 CO 0.48 1.04 0.49 0.00 -1.51 0.00 0.00 179.97 180.47 3h6o s ALA 448 N -3.60 2.81 0.35 2.80 0.00 -1.26 -4.98 121.76 117.88 3h6o s ALA 448 Ca -0.13 0.98 -0.27 0.00 0.00 0.00 0.00 51.96 52.54 3h6o s ALA 448 Cb 0.05 -3.42 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 3h6o s ALA 448 CO 0.82 -0.87 1.11 -1.25 0.00 0.00 0.00 175.76 175.57 3h6o s PRO 449 N -2.98 4.32 -0.42 0.00 0.04 -1.26 -4.69 135.00 130.01 3h6o s PRO 449 Ca 0.69 1.75 -0.15 0.00 0.04 0.00 0.00 61.00 63.33 3h6o s PRO 449 Cb -0.29 -2.85 0.03 0.00 0.04 0.00 0.00 34.50 31.43 3h6o s PRO 449 CO 0.34 -0.06 0.33 0.42 0.04 0.00 0.00 177.00 178.07 3h6o s ILE 450 N -1.38 5.24 -0.45 0.56 1.01 0.15 -1.28 121.20 125.06 3h6o s ILE 450 Ca 0.52 -0.69 -0.24 0.00 0.00 0.00 0.00 60.65 60.24 3h6o s ILE 450 Cb -0.29 -3.97 0.02 0.00 0.01 0.00 0.00 42.46 38.23 3h6o s ILE 450 CO 0.37 -0.37 0.85 -0.63 0.00 0.00 0.00 174.94 175.16 3h6o s ILE 451 N 1.72 4.58 -0.55 2.92 1.01 -0.20 0.87 121.20 131.54 3h6o s ILE 451 Ca 0.06 0.62 -0.17 0.00 0.00 0.00 0.00 60.65 61.16 3h6o s ILE 451 Cb -0.20 -4.36 0.11 0.00 0.01 0.00 0.00 42.46 38.02 3h6o s ILE 451 CO 0.10 -0.74 0.58 0.00 0.00 0.00 0.00 174.94 174.87 3h6o s ALA 452 N 3.48 3.54 -0.15 9.38 0.00 -0.90 -0.77 121.76 136.35 3h6o s ALA 452 Ca 0.33 -2.36 -0.24 0.00 0.00 0.00 0.00 51.96 49.69 3h6o s ALA 452 Cb -0.11 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 3h6o s ALA 452 CO 0.24 -2.13 0.77 0.08 0.00 0.00 0.00 175.76 174.72 3h6o s VAL 453 N 2.07 4.94 -0.01 0.00 1.01 -0.09 -0.72 120.40 127.60 3h6o s VAL 453 Ca 0.07 1.53 -0.11 0.00 0.00 0.00 0.00 61.98 63.47 3h6o s VAL 453 Cb -0.27 -4.09 0.01 0.00 0.00 0.00 0.00 36.38 32.03 3h6o s VAL 453 CO 0.05 0.10 0.22 0.28 0.00 0.00 0.00 175.10 175.75 3h6o s THR 454 N 1.77 0.07 -0.88 3.92 -1.32 -0.80 -1.93 115.64 116.46 3h6o s THR 454 Ca 0.37 -0.57 0.24 0.00 -1.21 0.00 0.00 61.69 60.51 3h6o s THR 454 Cb -0.17 -0.52 -0.08 0.00 -1.51 0.00 0.00 72.50 70.23 3h6o s THR 454 CO 0.14 -0.32 1.20 0.54 -2.21 0.00 0.00 174.62 173.97 3h6o n ARG 455 N 1.39 0.09 -2.81 7.08 1.74 -1.26 -0.68 116.66 122.22 3h6o n ARG 455 Ca -0.22 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.43 3h6o n ARG 455 Cb 0.56 -1.53 -0.04 0.00 -1.02 0.00 0.00 32.46 30.43 3h6o n ARG 455 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3h6o s ASN 456 N -3.30 6.51 0.36 0.55 3.84 -1.26 -4.89 114.94 116.75 3h6o s ASN 456 Ca 0.08 0.14 0.08 0.00 0.21 0.00 0.00 52.86 53.37 3h6o s ASN 456 Cb 0.16 -2.46 0.68 0.00 -0.55 0.00 0.00 41.25 39.09 3h6o s ASN 456 CO 0.76 -1.06 1.87 -0.65 -2.79 0.00 0.00 177.10 175.24 3h6o h PRO 457 N 9.07 0.31 -0.31 0.43 0.11 -1.95 -1.79 132.00 137.87 3h6o h PRO 457 Ca -0.24 -0.08 -0.06 0.00 0.11 0.00 0.00 66.00 65.73 3h6o h PRO 457 Cb 1.07 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3h6o h PRO 457 CO 1.03 0.46 -0.05 0.37 -0.21 0.00 0.00 178.00 179.60 3h6o h GLN 458 N 0.29 0.58 -0.92 1.05 4.15 -1.97 -2.40 115.11 115.90 3h6o h GLN 458 Ca 0.06 -0.21 0.07 0.00 0.77 0.00 0.00 58.65 59.33 3h6o h GLN 458 Cb 0.44 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.02 3h6o h GLN 458 CO 0.03 0.75 0.58 1.15 -1.93 0.00 0.00 178.83 179.41 3h6o h THR 459 N 0.36 1.05 -0.48 2.39 2.02 -1.76 -0.51 112.91 115.99 3h6o h THR 459 Ca 0.08 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.80 3h6o h THR 459 Cb 0.52 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 3h6o h THR 459 CO 0.03 0.19 -0.11 0.00 0.37 0.00 0.00 175.52 176.00 3h6o h ALA 460 N 1.43 0.91 -0.06 6.16 0.00 -1.21 -0.93 119.26 125.56 3h6o h ALA 460 Ca 0.40 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3h6o h ALA 460 Cb 0.19 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h6o h ALA 460 CO -0.18 0.63 -0.24 0.00 0.00 0.00 0.00 179.25 179.46 3h6o h ARG 461 N 0.78 0.27 0.00 0.00 3.08 -1.05 -3.29 114.38 114.17 3h6o h ARG 461 Ca 0.13 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 3h6o h ARG 461 Cb 0.62 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 3h6o h ARG 461 CO 0.04 0.84 -0.13 1.96 -1.07 0.00 0.00 179.97 181.62 3h6o h GLN 462 N -0.25 0.00 0.00 0.04 4.20 -1.10 -3.00 115.11 115.00 3h6o h GLN 462 Ca -0.01 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 3h6o h GLN 462 Cb 0.88 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.66 3h6o h GLN 462 CO 0.05 0.13 -0.01 0.00 -0.67 0.00 0.00 178.83 178.32 3h6o h ALA 463 N 1.87 1.36 0.00 3.87 0.00 -1.23 -2.24 119.26 122.89 3h6o h ALA 463 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h6o h ALA 463 Cb 0.42 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3h6o h ALA 463 CO 0.02 0.02 -0.01 0.45 0.00 0.00 0.00 179.25 179.72 3h6o h HIS 464 N 0.00 0.00 -0.03 0.00 3.86 -1.70 -2.38 115.15 114.90 3h6o h HIS 464 Ca -0.00 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 3h6o h HIS 464 Cb 0.04 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.51 3h6o h HIS 464 CO 0.00 0.01 0.04 -0.07 0.86 0.00 0.00 177.93 178.77 3h6o h LEU 465 N 0.00 0.00 -9.21 2.43 3.38 -1.65 -3.39 115.31 106.88 3h6o h LEU 465 Ca -0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 3h6o h LEU 465 Cb 0.06 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.68 3h6o h LEU 465 CO 0.00 0.00 -0.50 -0.31 0.09 0.00 0.00 178.44 177.72 3h6o s TYR 466 N -4.57 3.37 0.06 1.13 2.02 -0.90 -4.56 117.35 113.91 3h6o s TYR 466 Ca -0.05 0.28 -0.36 0.00 -0.37 0.00 0.00 57.07 56.57 3h6o s TYR 466 Cb 0.15 -2.19 -0.16 0.00 -0.40 0.00 0.00 41.96 39.37 3h6o s TYR 466 CO 0.53 0.22 1.47 -2.13 -1.57 0.00 0.00 175.55 174.07 3h6o n ARG 467 N 3.74 1.47 0.00 -0.62 3.00 -1.26 -2.52 116.66 120.47 3h6o n ARG 467 Ca -0.16 0.53 0.00 0.00 -0.00 0.00 0.00 57.85 58.23 3h6o n ARG 467 Cb 0.52 -2.22 0.00 0.00 0.00 0.00 0.00 32.46 30.76 3h6o n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3h6o n GLY 468 N 3.03 3.18 3.70 5.14 0.00 -0.35 -4.74 105.19 115.15 3h6o n GLY 468 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.57 4.91 -0.50 -0.61 1.01 -1.05 0.31 121.20 122.70 3h6o s ILE 469 Ca 0.00 1.81 0.04 0.00 0.00 0.00 0.00 60.65 62.49 3h6o s ILE 469 Cb 0.00 -4.21 0.13 0.00 0.01 0.00 0.00 42.46 38.39 3h6o s ILE 469 CO 0.00 0.14 0.24 0.12 0.00 0.00 0.00 174.94 175.44 3h6o s PHE 470 N 1.29 3.28 0.12 3.97 5.36 0.25 -4.72 117.98 127.53 3h6o s PHE 470 Ca 0.45 -3.13 -0.30 0.00 -0.96 0.00 0.00 56.93 52.99 3h6o s PHE 470 Cb -0.19 -2.86 -0.06 0.00 -0.34 0.00 0.00 43.02 39.57 3h6o s PHE 470 CO 0.21 -0.78 1.09 -1.25 -1.46 0.00 0.00 175.22 173.03 3h6o s PRO 471 N -0.11 4.56 -0.06 10.12 0.04 -1.26 -2.13 135.00 146.17 3h6o s PRO 471 Ca 0.16 1.66 0.04 0.00 0.04 0.00 0.00 61.00 62.90 3h6o s PRO 471 Cb -0.25 -3.33 -0.00 0.00 0.04 0.00 0.00 34.50 30.96 3h6o s PRO 471 CO -0.01 -0.00 -0.19 0.14 0.04 0.00 0.00 177.00 176.97 3h6o s VAL 472 N 0.26 1.63 -0.59 -0.36 -7.23 0.11 -4.59 120.40 109.63 3h6o s VAL 472 Ca 0.52 -0.80 -0.18 0.00 -1.81 0.00 0.00 61.98 59.71 3h6o s VAL 472 Cb -0.28 -1.41 0.11 0.00 0.56 0.00 0.00 36.38 35.37 3h6o s VAL 472 CO 0.32 0.46 0.66 -0.22 -0.31 0.00 0.00 175.10 176.01 3h6o s LEU 473 N 0.22 5.61 0.10 1.32 2.96 -1.26 -1.90 118.68 125.72 3h6o s LEU 473 Ca -0.10 -1.55 -0.30 0.00 -0.22 0.00 0.00 54.13 51.96 3h6o s LEU 473 Cb -0.14 -2.28 -0.06 0.00 0.50 0.00 0.00 46.19 44.21 3h6o s LEU 473 CO 0.04 -1.05 1.15 0.00 -1.32 0.00 0.00 176.35 175.18 3h6o n LYS 475 N 3.38 1.12 -2.06 0.00 4.76 -1.26 -4.41 118.16 119.69 3h6o n LYS 475 Ca 0.07 -1.22 -0.39 0.00 -2.87 0.00 0.00 58.31 53.89 3h6o n LYS 475 Cb 0.47 -1.11 -0.00 0.00 -1.84 0.00 0.00 35.03 32.54 3h6o n LYS 475 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3h6o s ASP 476 N -0.68 6.19 0.61 4.39 1.01 -1.26 -4.98 116.67 121.94 3h6o s ASP 476 Ca 0.08 2.61 -0.19 0.00 0.71 0.00 0.00 52.55 55.77 3h6o s ASP 476 Cb 0.05 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 3h6o s ASP 476 CO 0.07 -0.93 1.06 -2.65 0.21 0.00 0.00 175.17 172.93 3h6o n PRO 477 N -0.07 0.99 -1.92 8.23 -0.02 -1.26 -4.93 135.00 136.02 3h6o n PRO 477 Ca 0.05 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.49 3h6o n PRO 477 Cb 0.44 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 3h6o n PRO 477 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h6o s VAL 478 N -1.47 3.18 0.29 -1.45 1.01 -1.26 -4.98 120.40 115.71 3h6o s VAL 478 Ca 0.77 0.49 -0.28 0.00 0.00 0.00 0.00 61.98 62.96 3h6o s VAL 478 Cb -0.41 -3.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.56 3h6o s VAL 478 CO 0.46 -0.02 1.00 -1.10 0.00 0.00 0.00 175.10 175.44 3h6o s GLN 479 N 3.23 4.65 0.29 2.72 -1.52 -1.26 -4.96 119.66 122.81 3h6o s GLN 479 Ca 0.76 1.56 0.00 0.00 -1.95 0.00 0.00 55.36 55.73 3h6o s GLN 479 Cb -0.38 -3.07 0.44 0.00 -0.22 0.00 0.00 33.01 29.78 3h6o s GLN 479 CO 0.33 0.30 1.81 1.05 -0.25 0.00 0.00 175.29 178.52 3h6o h GLU 480 N 3.65 0.70 -5.98 2.91 4.11 -2.00 -3.37 114.58 114.60 3h6o h GLU 480 Ca -0.46 -0.17 -0.59 0.00 0.07 0.00 0.00 59.36 58.21 3h6o h GLU 480 Cb 1.20 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.29 3h6o h GLU 480 CO 0.66 0.70 0.64 0.00 0.07 0.00 0.00 179.01 181.09 3h6o s ALA 481 N -5.00 3.62 0.20 1.06 0.00 -1.26 -4.95 121.76 115.43 3h6o s ALA 481 Ca -0.09 -0.06 -0.09 0.00 0.00 0.00 0.00 51.96 51.72 3h6o s ALA 481 Cb 0.15 -3.45 0.13 0.00 0.00 0.00 0.00 23.12 19.95 3h6o s ALA 481 CO 0.79 -1.11 1.76 2.35 0.00 0.00 0.00 175.76 179.56 3h6o h TRP 482 N 7.74 1.10 -0.54 0.00 7.01 -2.00 -2.24 115.95 127.03 3h6o h TRP 482 Ca -0.21 -0.08 0.07 0.00 2.11 0.00 0.00 58.89 60.77 3h6o h TRP 482 Cb 1.08 -0.33 -0.06 0.00 -2.10 0.00 0.00 29.16 27.75 3h6o h TRP 482 CO 0.77 0.84 0.22 0.00 -2.79 0.00 0.00 178.44 177.49 3h6o h ALA 483 N 1.14 0.68 -0.84 2.65 0.00 -1.92 0.01 119.26 120.98 3h6o h ALA 483 Ca 0.24 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.24 3h6o h ALA 483 Cb 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3h6o h ALA 483 CO -0.02 -0.16 0.54 0.93 0.00 0.00 0.00 179.25 180.55 3h6o h GLU 484 N 0.43 1.04 -0.46 0.00 5.08 -1.87 -1.46 114.58 117.34 3h6o h GLU 484 Ca 0.25 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 3h6o h GLU 484 Cb 0.24 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 3h6o h GLU 484 CO -0.23 0.69 -0.09 0.22 -1.00 0.00 0.00 179.01 178.60 3h6o h ASP 485 N 1.07 0.81 0.61 1.42 3.58 -0.69 0.19 116.42 123.41 3h6o h ASP 485 Ca 0.33 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 3h6o h ASP 485 Cb -0.01 -0.22 0.01 0.00 1.72 0.00 0.00 39.33 40.83 3h6o h ASP 485 CO -0.11 0.93 -0.29 0.58 -2.88 0.00 0.00 179.24 177.47 3h6o h VAL 486 N 0.75 0.38 -0.90 2.25 2.07 -0.86 -2.76 116.25 117.17 3h6o h VAL 486 Ca 0.13 -0.10 0.14 0.00 0.82 0.00 0.00 66.70 67.68 3h6o h VAL 486 Cb 0.58 0.42 -0.09 0.00 -1.52 0.00 0.00 31.29 30.68 3h6o h VAL 486 CO 0.04 0.02 0.52 0.44 0.02 0.00 0.00 177.57 178.60 3h6o h ASP 487 N -0.89 0.70 -0.93 0.57 3.45 -1.07 -0.43 116.42 117.82 3h6o h ASP 487 Ca -0.08 0.07 0.05 0.00 0.43 0.00 0.00 57.03 57.50 3h6o h ASP 487 Cb 0.65 -0.05 -0.06 0.00 -0.56 0.00 0.00 39.33 39.31 3h6o h ASP 487 CO 0.14 0.33 0.60 0.25 -1.57 0.00 0.00 179.24 178.98 3h6o h LEU 488 N 0.77 0.97 -0.26 1.55 5.85 -0.59 -0.82 115.31 122.79 3h6o h LEU 488 Ca 0.47 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.99 3h6o h LEU 488 Cb 0.59 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3h6o h LEU 488 CO -0.32 0.65 -0.89 0.03 -0.34 0.00 0.00 178.44 177.57 3h6o h ARG 489 N 1.12 0.21 -0.57 1.25 3.08 -0.91 -1.86 114.38 116.70 3h6o h ARG 489 Ca 0.38 -0.23 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 3h6o h ARG 489 Cb 0.08 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3h6o h ARG 489 CO -0.14 0.97 0.05 0.28 -1.07 0.00 0.00 179.97 180.05 3h6o h VAL 490 N 0.11 1.26 -0.05 2.04 2.07 -0.83 -2.31 116.25 118.54 3h6o h VAL 490 Ca -0.05 -1.05 -0.14 0.00 0.82 0.00 0.00 66.70 66.29 3h6o h VAL 490 Cb 1.53 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3h6o h VAL 490 CO 0.14 0.38 -0.58 -1.13 0.02 0.00 0.00 177.57 176.40 3h6o h ASN 491 N 0.87 0.19 -0.52 0.57 -0.00 -1.11 -2.04 115.58 113.54 3h6o h ASN 491 Ca 0.17 -0.11 0.08 0.00 -0.00 0.00 0.00 56.30 56.44 3h6o h ASN 491 Cb 0.48 -0.06 -0.06 0.00 -0.00 0.00 0.00 38.32 38.68 3h6o h ASN 491 CO 0.02 0.73 0.16 0.15 -0.00 0.00 0.00 177.43 178.49 3h6o h PHE 492 N 0.13 0.28 -0.96 0.67 3.57 -1.22 -0.95 116.94 118.45 3h6o h PHE 492 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3h6o h PHE 492 Cb 1.06 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.71 3h6o h PHE 492 CO 0.01 0.06 0.64 0.00 -2.23 0.00 0.00 178.31 176.79 3h6o h ALA 493 N 1.37 1.31 -0.29 2.41 0.00 -1.00 -1.16 119.26 121.90 3h6o h ALA 493 Ca 0.26 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3h6o h ALA 493 Cb 0.31 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3h6o h ALA 493 CO -0.29 0.64 -0.27 0.52 0.00 0.00 0.00 179.25 179.86 3h6o h MET 494 N 1.31 0.57 -0.18 0.00 2.86 -0.84 -1.77 114.93 116.88 3h6o h MET 494 Ca 0.35 -0.23 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 3h6o h MET 494 Cb -0.15 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.48 3h6o h MET 494 CO -0.08 0.78 -0.11 -0.91 1.06 0.00 0.00 176.91 177.66 3h6o h ASN 495 N 0.50 0.40 -0.48 1.22 2.35 -0.72 -1.80 115.58 117.06 3h6o h ASN 495 Ca 0.07 -0.43 0.08 0.00 -0.55 0.00 0.00 56.30 55.46 3h6o h ASN 495 Cb 0.72 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.92 3h6o h ASN 495 CO 0.06 0.75 0.10 0.58 -1.65 0.00 0.00 177.43 177.27 3h6o h VAL 496 N 0.06 0.75 -0.63 2.81 2.07 -1.19 0.26 116.25 120.37 3h6o h VAL 496 Ca 0.04 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 3h6o h VAL 496 Cb 0.61 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 3h6o h VAL 496 CO 0.03 0.04 0.22 1.23 0.02 0.00 0.00 177.57 179.11 3h6o h GLY 497 N 0.24 1.05 0.81 2.17 0.00 -1.25 0.37 103.07 106.45 3h6o h GLY 497 Ca 0.24 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.95 3h6o h GLY 497 CO -0.30 0.57 -0.10 0.50 0.00 0.00 0.00 176.54 177.21 3h6o h LYS 498 N 0.91 -0.27 -0.86 4.80 1.57 -1.04 0.19 116.57 121.86 3h6o h LYS 498 Ca 0.21 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 59.02 3h6o h LYS 498 Cb 0.27 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.59 3h6o h LYS 498 CO -0.01 -0.03 0.57 0.00 -0.57 0.00 0.00 179.45 179.40 3h6o h ALA 499 N 0.27 1.11 -0.00 3.86 0.00 -0.88 -2.25 119.26 121.36 3h6o h ALA 499 Ca -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3h6o h ALA 499 Cb 0.36 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3h6o h ALA 499 CO 0.05 0.47 -0.09 0.54 0.00 0.00 0.00 179.25 180.21 3h6o n ARG 500 N -4.50 0.08 -1.67 0.00 1.74 0.11 -4.93 116.66 107.48 3h6o n ARG 500 Ca 0.10 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 3h6o n ARG 500 Cb 0.04 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.98 3h6o n ARG 500 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h6o n GLY 501 N 1.47 0.47 0.07 -0.13 0.00 -0.63 -4.94 105.19 101.50 3h6o n GLY 501 Ca 0.08 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 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 0.07 -3.42 1.61 0.04 -0.91 -3.44 116.94 110.89 3h6o h PHE 502 Ca 0.00 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.64 3h6o h PHE 502 Cb 0.74 -0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.84 3h6o h PHE 502 CO 0.00 1.05 0.06 -0.59 -0.60 0.00 0.00 178.31 178.23 3h6o s PHE 503 N -2.68 0.35 0.14 -0.55 -0.12 -1.19 -4.81 117.98 109.12 3h6o s PHE 503 Ca -0.01 -0.81 0.05 0.00 -0.05 0.00 0.00 56.93 56.12 3h6o s PHE 503 Cb 0.09 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 3h6o s PHE 503 CO 0.83 -1.27 -0.11 -1.59 -0.05 0.00 0.00 175.22 173.02 3h6o s LYS 504 N -3.18 1.04 -0.16 1.99 -2.85 -1.26 -4.12 119.74 111.20 3h6o s LYS 504 Ca 0.20 -1.37 -0.42 0.00 -1.00 0.00 0.00 55.97 53.38 3h6o s LYS 504 Cb -0.03 -0.71 -0.19 0.00 -2.06 0.00 0.00 37.83 34.84 3h6o s LYS 504 CO 0.12 0.11 1.34 1.17 0.10 0.00 0.00 175.35 178.19 3h6o n LYS 505 N 0.06 0.32 0.00 1.78 4.81 -1.26 -1.48 118.16 122.38 3h6o n LYS 505 Ca -0.12 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 3h6o n LYS 505 Cb 0.59 -1.66 0.00 0.00 0.02 0.00 0.00 35.03 33.98 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 2.70 2.64 3.71 3.14 0.00 0.80 -4.94 105.19 113.25 3h6o n GLY 506 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.20 3.77 -0.13 1.61 1.01 -0.55 -4.58 116.67 117.59 3h6o s ASP 507 Ca 0.00 2.15 -0.08 0.00 0.71 0.00 0.00 52.55 55.32 3h6o s ASP 507 Cb 0.00 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3h6o s ASP 507 CO 0.00 -2.54 0.16 0.68 0.21 0.00 0.00 175.17 173.68 3h6o s VAL 508 N -2.50 5.45 0.17 -1.27 -7.23 -1.26 0.20 120.40 113.96 3h6o s VAL 508 Ca 0.68 0.26 0.06 0.00 -1.81 0.00 0.00 61.98 61.16 3h6o s VAL 508 Cb -0.23 -3.44 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 3h6o s VAL 508 CO 0.53 0.57 -0.12 0.68 -0.31 0.00 0.00 175.10 176.45 3h6o s VAL 509 N -0.68 1.38 -0.11 1.32 -7.23 -0.07 -2.02 120.40 113.00 3h6o s VAL 509 Ca 0.14 -2.10 -0.03 0.00 -1.81 0.00 0.00 61.98 58.19 3h6o s VAL 509 Cb -0.12 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 3h6o s VAL 509 CO 0.03 -0.67 0.00 -0.63 -0.31 0.00 0.00 175.10 173.52 3h6o s ILE 510 N -3.13 4.28 -0.10 -0.62 1.01 -0.67 -0.81 121.20 121.16 3h6o s ILE 510 Ca 0.18 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.60 3h6o s ILE 510 Cb 0.01 -2.83 0.01 0.00 0.01 0.00 0.00 42.46 39.67 3h6o s ILE 510 CO 0.03 0.57 -0.14 -0.69 0.00 0.00 0.00 174.94 174.71 3h6o s VAL 511 N -0.54 1.41 -0.16 2.92 1.01 0.01 0.09 120.40 125.15 3h6o s VAL 511 Ca 0.09 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 3h6o s VAL 511 Cb -0.12 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3h6o s VAL 511 CO 0.02 0.42 -0.02 -0.76 0.00 0.00 0.00 175.10 174.76 3h6o s LEU 512 N 0.94 3.31 0.24 3.92 1.43 0.89 -1.16 118.68 128.26 3h6o s LEU 512 Ca -0.08 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 52.91 3h6o s LEU 512 Cb -0.15 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 3h6o s LEU 512 CO -0.00 0.16 0.21 0.42 0.23 0.00 0.00 176.35 177.36 3h6o s THR 513 N 0.43 0.00 0.54 5.49 -4.23 -0.29 -2.68 115.64 114.89 3h6o s THR 513 Ca -0.03 -1.94 0.02 0.00 -1.18 0.00 0.00 61.69 58.57 3h6o s THR 513 Cb -0.14 -2.48 0.02 0.00 1.34 0.00 0.00 72.50 71.24 3h6o s THR 513 CO 0.03 0.00 0.18 0.61 -0.54 0.00 0.00 174.62 174.90 3h6o n GLY 514 N -0.37 3.19 0.01 3.99 0.00 -1.26 -0.40 105.19 110.35 3h6o n GLY 514 Ca 0.03 -2.34 0.10 0.00 0.00 0.00 0.00 46.02 43.81 3h6o n GLY 514 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3h6o n TRP 515 N -1.53 0.03 -3.98 1.61 4.27 -1.05 -4.85 117.44 111.94 3h6o n TRP 515 Ca -0.13 0.01 -0.09 0.00 -3.89 0.00 0.00 57.50 53.39 3h6o n TRP 515 Cb 0.65 -0.14 -0.06 0.00 -1.36 0.00 0.00 31.31 30.40 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 -3.10 1.47 0.95 -2.67 1.70 -1.26 -5.17 118.95 110.87 3h6o s ARG 516 Ca 0.05 -1.22 -0.12 0.00 -0.47 0.00 0.00 55.73 53.97 3h6o s ARG 516 Cb 0.16 0.46 0.16 0.00 -0.57 0.00 0.00 34.95 35.15 3h6o s ARG 516 CO 0.85 -0.60 1.10 -2.14 -1.08 0.00 0.00 175.30 173.43 3h6o s PRO 517 N -4.00 0.82 0.00 3.89 0.02 -1.26 -4.84 135.00 129.63 3h6o s PRO 517 Ca 0.21 0.59 0.00 0.00 0.02 0.00 0.00 61.00 61.82 3h6o s PRO 517 Cb 0.00 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.74 3h6o s PRO 517 CO 0.07 -2.48 0.00 0.41 -0.33 0.00 0.00 177.00 174.67 3h6o n GLY 518 N -1.27 -0.86 3.82 0.52 0.00 -1.26 -4.97 105.19 101.18 3h6o n GLY 518 Ca 0.06 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 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 -3.26 6.71 0.00 1.61 0.01 -1.26 -4.35 113.70 113.16 3h6o s SER 519 Ca 0.00 1.73 0.00 0.00 1.31 0.00 0.00 55.95 58.99 3h6o s SER 519 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 3h6o s SER 519 CO 0.00 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 173.74 3h6o n GLY 520 N -0.71 0.85 0.48 3.44 0.00 -1.26 -4.95 105.19 103.03 3h6o n GLY 520 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.20 0.43 -1.69 1.61 3.01 -1.26 -4.94 117.46 112.42 3h6o n PHE 521 Ca 0.00 -0.72 -0.45 0.00 1.01 0.00 0.00 57.45 57.30 3h6o n PHE 521 Cb 0.00 -0.15 -0.04 0.00 -0.01 0.00 0.00 39.48 39.29 3h6o n PHE 521 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 3h6o n THR 522 N -0.39 0.18 -1.86 4.37 -1.04 -1.26 -2.54 114.28 111.75 3h6o n THR 522 Ca 0.13 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 3h6o n THR 522 Cb 0.58 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 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 4.58 0.00 -3.96 8.00 6.94 -0.58 -3.85 115.26 126.39 3h6o n ASN 523 Ca 0.18 -1.00 -0.29 0.00 -0.02 0.00 0.00 54.58 53.45 3h6o n ASN 523 Cb 0.32 0.00 -0.17 0.00 -2.36 0.00 0.00 39.78 37.58 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 1.32 -0.18 5.53 2.01 0.47 -4.92 115.64 119.86 3h6o s THR 524 Ca 0.00 -0.54 -0.00 0.00 0.31 0.00 0.00 61.69 61.46 3h6o s THR 524 Cb 0.00 -1.31 0.01 0.00 0.01 0.00 0.00 72.50 71.21 3h6o s THR 524 CO 0.00 0.36 -0.16 -0.32 -0.69 0.00 0.00 174.62 173.81 3h6o s MET 525 N 1.58 3.10 0.04 4.92 1.75 -1.26 -1.14 119.30 128.30 3h6o s MET 525 Ca 0.04 -0.78 0.09 0.00 -1.25 0.00 0.00 55.69 53.79 3h6o s MET 525 Cb -0.13 -2.66 -0.03 0.00 2.84 0.00 0.00 34.83 34.85 3h6o s MET 525 CO -0.09 -0.17 -0.24 1.03 -0.65 0.00 0.00 175.02 174.90 3h6o s ARG 526 N 1.24 1.88 -0.29 4.11 0.52 -0.31 -4.97 118.95 121.13 3h6o s ARG 526 Ca 0.03 -1.07 -0.09 0.00 -0.52 0.00 0.00 55.73 54.08 3h6o s ARG 526 Cb -0.14 -2.03 -0.01 0.00 0.52 0.00 0.00 34.95 33.29 3h6o s ARG 526 CO -0.09 0.52 0.12 0.08 0.02 0.00 0.00 175.30 175.96 3h6o s VAL 527 N -0.83 4.47 0.04 3.52 1.01 -1.26 -0.81 120.40 126.55 3h6o s VAL 527 Ca 0.12 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.78 3h6o s VAL 527 Cb -0.10 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 3h6o s VAL 527 CO 0.03 0.14 -0.15 -0.69 0.00 0.00 0.00 175.10 174.42 3h6o s VAL 528 N 1.60 1.23 0.40 2.92 1.01 0.01 -4.97 120.40 122.61 3h6o s VAL 528 Ca 0.05 -1.05 -0.23 0.00 0.00 0.00 0.00 61.98 60.75 3h6o s VAL 528 Cb -0.17 -1.10 -0.10 0.00 0.00 0.00 0.00 36.38 35.01 3h6o s VAL 528 CO 0.05 0.04 0.96 -2.16 0.00 0.00 0.00 175.10 173.99 3h6o s PRO 529 N -1.17 4.31 -0.04 2.72 0.05 -1.26 -0.89 135.00 138.72 3h6o s PRO 529 Ca 0.03 1.20 -0.30 0.00 0.05 0.00 0.00 61.00 61.98 3h6o s PRO 529 Cb -0.08 -2.36 -0.05 0.00 0.05 0.00 0.00 34.50 32.05 3h6o s PRO 529 CO 0.01 0.03 1.49 0.08 0.05 0.00 0.00 177.00 178.67 3h6o s VAL 530 N -1.99 3.70 -2.00 -0.36 1.01 0.13 -4.87 120.40 116.02 3h6o s VAL 530 Ca 0.59 0.98 0.17 0.00 0.00 0.00 0.00 61.98 63.72 3h6o s VAL 530 Cb -0.13 -3.63 0.49 0.00 0.00 0.00 0.00 36.38 33.11 3h6o s VAL 530 CO 0.17 -0.05 1.43 -0.81 0.00 0.00 0.00 175.10 175.84