#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 2.65 -1.18 1.69 -4.23 -1.26 -4.54 115.64 108.77 3h6o s THR 15 Ca 0.00 -1.04 -0.06 0.00 -1.18 0.00 0.00 61.69 59.41 3h6o s THR 15 Cb 0.00 -2.69 0.06 0.00 1.34 0.00 0.00 72.50 71.21 3h6o s THR 15 CO 0.00 0.00 0.16 0.00 -0.54 0.00 0.00 174.62 174.24 3h6o n GLN 16 N -1.96 -0.90 -3.92 3.99 10.64 0.08 -1.87 117.38 123.45 3h6o n GLN 16 Ca 0.10 0.08 -0.30 0.00 -1.83 0.00 0.00 57.00 55.05 3h6o n GLN 16 Cb 0.60 -2.82 0.02 0.00 -0.86 0.00 0.00 30.24 27.18 3h6o n GLN 16 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3h6o n GLN 17 N -3.33 -5.31 0.21 2.61 1.13 -1.26 -4.80 117.38 106.62 3h6o n GLN 17 Ca -0.11 0.58 0.10 0.00 -1.94 0.00 0.00 57.00 55.63 3h6o n GLN 17 Cb 0.43 -5.42 0.21 0.00 0.11 0.00 0.00 30.24 25.56 3h6o n GLN 17 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 3h6o h LEU 18 N -2.04 0.00 0.75 1.08 3.38 -1.65 -0.32 115.31 116.52 3h6o h LEU 18 Ca -0.58 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.35 3h6o h LEU 18 Cb 1.38 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.13 3h6o h LEU 18 CO 0.67 0.15 -0.36 -0.74 0.09 0.00 0.00 178.44 178.25 3h6o h HIS 19 N 0.00 -0.94 -0.95 1.13 2.76 -1.89 -2.97 115.15 112.29 3h6o h HIS 19 Ca -0.00 -0.02 0.23 0.00 -2.20 0.00 0.00 60.37 58.37 3h6o h HIS 19 Cb 1.03 0.31 -0.07 0.00 1.55 0.00 0.00 27.41 30.23 3h6o h HIS 19 CO 0.00 -0.58 0.63 0.00 -1.30 0.00 0.00 177.93 176.68 3h6o h ALA 20 N -1.33 2.30 -0.41 5.26 0.00 -1.77 -1.16 119.26 122.15 3h6o h ALA 20 Ca -0.10 0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.90 3h6o h ALA 20 Cb 0.78 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3h6o h ALA 20 CO 0.17 -0.62 0.28 0.00 0.00 0.00 0.00 179.25 179.09 3h6o h ALA 21 N 1.60 2.10 -0.00 0.00 0.00 -0.97 -2.43 119.26 119.56 3h6o h ALA 21 Ca 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3h6o h ALA 21 Cb 1.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3h6o h ALA 21 CO -0.18 -0.19 -0.08 -1.33 0.00 0.00 0.00 179.25 177.47 3h6o n MET 22 N -4.46 0.54 -1.92 0.00 2.81 -0.44 -4.65 117.12 109.00 3h6o n MET 22 Ca 0.06 -0.12 -0.42 0.00 -1.81 0.00 0.00 57.70 55.41 3h6o n MET 22 Cb 0.32 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.31 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 -2.54 3.70 0.12 3.04 0.00 -0.91 -4.89 121.76 120.27 3h6o s ALA 23 Ca 0.28 1.41 0.29 0.00 0.00 0.00 0.00 51.96 53.95 3h6o s ALA 23 Cb 0.20 -3.60 1.18 0.00 0.00 0.00 0.00 23.12 20.90 3h6o s ALA 23 CO 0.48 -0.82 1.92 -0.44 0.00 0.00 0.00 175.76 176.90 3h6o h ASP 24 N 5.39 0.00 -2.98 0.00 3.32 -1.91 -3.45 116.42 116.78 3h6o h ASP 24 Ca -0.45 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.11 3h6o h ASP 24 Cb 1.21 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.62 3h6o h ASP 24 CO 0.81 0.09 -0.74 0.42 -1.72 0.00 0.00 179.24 178.11 3h6o s THR 25 N -3.68 1.89 0.14 0.35 -4.23 -1.26 -5.05 115.64 103.80 3h6o s THR 25 Ca 0.01 -2.25 -0.11 0.00 -1.18 0.00 0.00 61.69 58.15 3h6o s THR 25 Cb 0.10 -2.11 -0.06 0.00 1.34 0.00 0.00 72.50 71.77 3h6o s THR 25 CO 0.58 -0.55 1.46 0.15 -0.54 0.00 0.00 174.62 175.72 3h6o h PHE 26 N 2.49 1.11 -0.17 3.99 3.04 -1.99 -1.81 116.94 123.61 3h6o h PHE 26 Ca -0.39 -0.35 0.03 0.00 3.98 0.00 0.00 57.97 61.25 3h6o h PHE 26 Cb 1.23 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 39.48 3h6o h PHE 26 CO 0.74 1.18 -0.05 1.25 -2.02 0.00 0.00 178.31 179.41 3h6o h LEU 27 N 0.73 -0.17 -1.07 0.59 5.85 -1.99 -1.04 115.31 118.21 3h6o h LEU 27 Ca 0.05 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 3h6o h LEU 27 Cb 1.02 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 3h6o h LEU 27 CO 0.10 -0.06 0.27 -0.08 -0.34 0.00 0.00 178.44 178.33 3h6o h GLU 28 N -0.01 0.93 -0.69 1.25 4.57 -1.96 -1.26 114.58 117.41 3h6o h GLU 28 Ca 0.08 -0.14 0.08 0.00 -1.18 0.00 0.00 59.36 58.20 3h6o h GLU 28 Cb 0.13 -0.17 -0.06 0.00 -0.16 0.00 0.00 28.75 28.49 3h6o h GLU 28 CO -0.18 0.75 0.36 1.25 -1.18 0.00 0.00 179.01 180.02 3h6o h HIS 29 N 0.92 0.65 0.04 0.92 2.76 -0.70 -0.76 115.15 118.99 3h6o h HIS 29 Ca 0.22 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3h6o h HIS 29 Cb 0.16 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 28.93 3h6o h HIS 29 CO 0.01 0.27 -0.02 0.52 -1.30 0.00 0.00 177.93 177.41 3h6o h MET 30 N 0.63 -0.06 -0.17 5.26 2.86 -0.59 -2.95 114.93 119.92 3h6o h MET 30 Ca 0.33 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 58.02 3h6o h MET 30 Cb 0.30 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 3h6o h MET 30 CO -0.24 0.02 0.16 0.00 1.06 0.00 0.00 176.91 177.92 3h6o n ARG 32 N -3.98 0.07 -1.67 0.00 1.74 -0.35 -4.93 116.66 107.53 3h6o n ARG 32 Ca 0.01 0.01 -0.46 0.00 -0.77 0.00 0.00 57.85 56.63 3h6o n ARG 32 Cb 0.28 -1.53 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 3h6o n ARG 32 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3h6o n LEU 33 N -1.62 3.29 -3.99 0.55 4.77 -0.70 -4.45 117.00 114.84 3h6o n LEU 33 Ca 0.04 1.04 -0.29 0.00 -0.03 0.00 0.00 56.01 56.77 3h6o n LEU 33 Cb 0.36 -1.42 -0.17 0.00 -2.33 0.00 0.00 43.42 39.87 3h6o n LEU 33 CO 0.37 -0.17 -0.47 -0.62 -1.33 0.00 0.00 177.39 175.17 3h6o s ASP 34 N 2.14 2.50 0.53 -1.43 3.68 -1.26 -5.01 116.67 117.82 3h6o s ASP 34 Ca 0.84 -0.43 0.31 0.00 2.13 0.00 0.00 52.55 55.40 3h6o s ASP 34 Cb -0.67 -1.07 1.34 0.00 -1.45 0.00 0.00 42.92 41.07 3h6o s ASP 34 CO 0.43 -0.06 1.98 0.16 0.13 0.00 0.00 175.17 177.80 3h6o h ILE 35 N 6.08 0.24 -0.28 4.11 3.07 -2.02 -2.21 117.51 126.49 3h6o h ILE 35 Ca -0.35 -0.65 0.00 0.00 1.55 0.00 0.00 64.86 65.41 3h6o h ILE 35 Cb 1.14 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.21 3h6o h ILE 35 CO 0.49 0.08 0.00 0.47 -1.05 0.00 0.00 178.15 178.14 3h6o n ASP 36 N -3.25 1.93 -4.50 2.16 10.43 -1.26 -4.75 116.55 117.31 3h6o n ASP 36 Ca -0.00 -1.86 -0.43 0.00 2.57 0.00 0.00 54.79 55.07 3h6o n ASP 36 Cb 0.31 -0.18 -0.09 0.00 1.84 0.00 0.00 41.12 43.00 3h6o n ASP 36 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3h6o s SER 37 N -1.29 6.20 0.30 -2.24 0.15 -0.83 -4.91 113.70 111.08 3h6o s SER 37 Ca 0.29 -0.57 -0.19 0.00 0.70 0.00 0.00 55.95 56.18 3h6o s SER 37 Cb 0.16 -2.23 -0.09 0.00 -1.71 0.00 0.00 66.02 62.15 3h6o s SER 37 CO 0.22 -0.55 0.80 -2.16 1.20 0.00 0.00 173.24 172.75 3h6o s PRO 38 N 2.16 4.22 1.05 5.44 0.04 -1.26 -4.58 135.00 142.07 3h6o s PRO 38 Ca 0.13 0.92 -0.12 0.00 0.04 0.00 0.00 61.00 61.96 3h6o s PRO 38 Cb -0.17 -2.62 0.22 0.00 0.04 0.00 0.00 34.50 31.97 3h6o s PRO 38 CO 0.14 0.24 1.07 -2.14 0.04 0.00 0.00 177.00 176.35 3h6o s PRO 39 N -2.48 0.00 0.90 0.56 0.02 -1.26 -0.74 135.00 132.01 3h6o s PRO 39 Ca 0.50 0.64 -0.12 0.00 0.02 0.00 0.00 61.00 62.05 3h6o s PRO 39 Cb -0.14 -1.68 0.13 0.00 0.02 0.00 0.00 34.50 32.84 3h6o s PRO 39 CO 0.19 -3.05 1.13 0.96 -0.33 0.00 0.00 177.00 175.90 3h6o s ILE 40 N -2.80 2.14 0.23 2.83 -4.36 -1.26 -4.75 121.20 113.24 3h6o s ILE 40 Ca 0.66 0.05 0.03 0.00 -0.26 0.00 0.00 60.65 61.13 3h6o s ILE 40 Cb -0.21 -2.78 -0.04 0.00 1.25 0.00 0.00 42.46 40.69 3h6o s ILE 40 CO 0.60 -0.06 1.56 0.74 0.24 0.00 0.00 174.94 178.02 3h6o h THR 41 N -1.47 1.36 -4.10 8.37 2.02 -1.91 -3.46 112.91 113.71 3h6o h THR 41 Ca -0.50 -1.90 -0.49 0.00 0.77 0.00 0.00 66.41 64.28 3h6o h THR 41 Cb 1.32 1.92 0.06 0.00 -1.74 0.00 0.00 68.15 69.72 3h6o h THR 41 CO 0.61 0.57 0.41 0.00 0.37 0.00 0.00 175.52 177.48 3h6o s ALA 42 N -3.84 2.72 -0.07 6.16 0.00 -1.26 -5.03 121.76 120.43 3h6o s ALA 42 Ca -0.05 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.60 3h6o s ALA 42 Cb 0.12 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.95 3h6o s ALA 42 CO 0.80 -0.70 -0.01 0.50 0.00 0.00 0.00 175.76 176.35 3h6o s ARG 43 N -3.43 0.75 -0.06 0.00 3.00 -1.26 -4.88 118.95 113.07 3h6o s ARG 43 Ca 0.70 0.04 0.16 0.00 -1.00 0.00 0.00 55.73 55.63 3h6o s ARG 43 Cb -0.21 -1.04 -0.22 0.00 0.00 0.00 0.00 34.95 33.48 3h6o s ARG 43 CO 0.27 -0.28 0.52 0.09 0.00 0.00 0.00 175.30 175.91 3h6o n ASN 44 N 5.02 0.56 -4.66 -2.12 5.03 -1.26 -4.83 115.26 112.99 3h6o n ASN 44 Ca -0.09 0.26 -0.43 0.00 0.87 0.00 0.00 54.58 55.18 3h6o n ASN 44 Cb 0.50 0.44 -0.02 0.00 -1.02 0.00 0.00 39.78 39.68 3h6o n ASN 44 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3h6o s THR 45 N -2.71 4.54 0.56 3.41 2.01 -1.26 -0.56 115.64 121.63 3h6o s THR 45 Ca -0.06 1.86 -0.20 0.00 0.31 0.00 0.00 61.69 63.60 3h6o s THR 45 Cb 0.08 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 3h6o s THR 45 CO 0.83 -0.16 1.24 -0.83 -0.69 0.00 0.00 174.62 175.01 3h6o s GLY 46 N 1.47 2.79 -0.19 4.40 0.00 -0.75 -4.84 107.32 110.21 3h6o s GLY 46 Ca 0.48 1.08 -0.00 0.00 0.00 0.00 0.00 44.72 46.28 3h6o s GLY 46 CO 0.09 1.52 -0.15 -0.42 0.00 0.00 0.00 173.10 174.14 3h6o s ILE 47 N -1.50 2.52 -0.27 0.90 1.01 -1.26 -1.14 121.20 121.47 3h6o s ILE 47 Ca 0.74 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 60.50 3h6o s ILE 47 Cb -0.33 -2.09 -0.05 0.00 0.01 0.00 0.00 42.46 40.01 3h6o s ILE 47 CO 0.37 0.50 0.16 -0.63 0.00 0.00 0.00 174.94 175.34 3h6o s ILE 48 N 1.28 5.15 -0.16 2.92 1.01 -0.28 -1.17 121.20 129.95 3h6o s ILE 48 Ca 0.04 0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.78 3h6o s ILE 48 Cb -0.14 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 38.89 3h6o s ILE 48 CO -0.08 0.29 -0.10 0.00 0.00 0.00 0.00 174.94 175.05 3h6o s THR 50 N 0.66 4.36 -0.01 0.00 2.01 -0.08 0.22 115.64 122.78 3h6o s THR 50 Ca -0.05 1.64 -0.18 0.00 0.31 0.00 0.00 61.69 63.41 3h6o s THR 50 Cb -0.15 -4.06 -0.05 0.00 0.01 0.00 0.00 72.50 68.25 3h6o s THR 50 CO 0.02 -0.13 0.52 -0.63 -0.69 0.00 0.00 174.62 173.71 3h6o s ILE 51 N 3.34 4.96 0.00 1.82 -1.09 0.06 -1.03 121.20 129.27 3h6o s ILE 51 Ca 0.53 1.08 0.00 0.00 -2.23 0.00 0.00 60.65 60.03 3h6o s ILE 51 Cb -0.21 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 36.82 3h6o s ILE 51 CO 0.14 0.46 0.00 0.61 -1.23 0.00 0.00 174.94 174.92 3h6o n GLY 52 N 2.34 3.17 0.49 6.18 0.00 -1.21 -4.71 105.19 111.46 3h6o n GLY 52 Ca -0.09 -1.00 0.31 0.00 0.00 0.00 0.00 46.02 45.24 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 0.14 0.00 1.61 0.11 -1.74 0.25 132.00 132.36 3h6o h PRO 53 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3h6o h PRO 53 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3h6o h PRO 53 CO 0.00 0.09 -0.11 0.00 -0.21 0.00 0.00 178.00 177.77 3h6o n ALA 54 N -2.65 2.52 -1.22 -0.75 0.00 -0.29 -4.24 120.51 113.88 3h6o n ALA 54 Ca 0.26 -0.13 0.01 0.00 0.00 0.00 0.00 53.44 53.59 3h6o n ALA 54 Cb 1.14 -1.40 0.01 0.00 0.00 0.00 0.00 19.45 19.20 3h6o n ALA 54 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h6o n SER 55 N -1.72 0.42 0.08 0.00 3.41 -0.00 -4.87 113.62 110.94 3h6o n SER 55 Ca 0.06 -1.61 -0.04 0.00 -0.26 0.00 0.00 58.87 57.02 3h6o n SER 55 Cb 0.37 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 64.16 3h6o n SER 55 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3h6o h ARG 56 N 0.00 0.00 -7.06 4.33 3.08 -1.52 -3.38 114.38 109.83 3h6o h ARG 56 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.51 3h6o h ARG 56 Cb 1.07 0.00 0.13 0.00 0.08 0.00 0.00 29.97 31.25 3h6o h ARG 56 CO 0.00 0.86 0.55 -1.54 -1.07 0.00 0.00 179.97 178.77 3h6o s SER 57 N -6.67 5.25 0.27 7.04 1.04 -1.26 -4.77 113.70 114.59 3h6o s SER 57 Ca 0.01 2.60 -0.04 0.00 0.48 0.00 0.00 55.95 59.00 3h6o s SER 57 Cb 0.10 -2.62 0.35 0.00 0.10 0.00 0.00 66.02 63.94 3h6o s SER 57 CO 0.80 -1.57 1.93 0.58 0.98 0.00 0.00 173.24 175.96 3h6o h VAL 58 N 1.22 1.21 -0.23 5.02 2.07 -1.91 -1.17 116.25 122.46 3h6o h VAL 58 Ca -0.51 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 3h6o h VAL 58 Cb 1.30 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3h6o h VAL 58 CO 0.56 0.23 -0.17 -0.33 0.02 0.00 0.00 177.57 177.88 3h6o h GLU 59 N 1.26 0.52 -0.39 1.57 4.39 -1.94 -1.79 114.58 118.20 3h6o h GLU 59 Ca 0.36 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3h6o h GLU 59 Cb -0.08 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 3h6o h GLU 59 CO -0.09 0.82 0.22 1.15 -1.16 0.00 0.00 179.01 179.95 3h6o h THR 60 N 0.22 1.14 -0.95 1.13 2.02 -1.88 -2.86 112.91 111.74 3h6o h THR 60 Ca 0.04 -0.37 0.10 0.00 0.77 0.00 0.00 66.41 66.95 3h6o h THR 60 Cb 0.70 0.67 -0.07 0.00 -1.74 0.00 0.00 68.15 67.71 3h6o h THR 60 CO 0.05 0.15 0.61 -0.07 0.37 0.00 0.00 175.52 176.62 3h6o h LEU 61 N 0.51 0.89 -0.71 2.58 3.38 -1.14 0.62 115.31 121.44 3h6o h LEU 61 Ca 0.14 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.18 3h6o h LEU 61 Cb 0.05 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 3h6o h LEU 61 CO -0.02 0.52 0.43 0.11 0.09 0.00 0.00 178.44 179.57 3h6o h LYS 62 N 0.99 0.79 0.00 1.13 1.57 -1.10 -0.42 116.57 119.53 3h6o h LYS 62 Ca 0.44 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 59.02 3h6o h LYS 62 Cb 0.37 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 3h6o h LYS 62 CO -0.20 0.53 -0.73 0.93 -0.57 0.00 0.00 179.45 179.41 3h6o h GLU 63 N 0.82 0.00 -0.21 3.15 4.39 -1.11 -1.38 114.58 120.24 3h6o h GLU 63 Ca 0.30 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.00 3h6o h GLU 63 Cb 0.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 3h6o h GLU 63 CO -0.14 0.73 0.14 0.52 -1.16 0.00 0.00 179.01 179.09 3h6o h MET 64 N 0.00 0.28 -0.15 2.33 2.86 -0.52 0.22 114.93 119.95 3h6o h MET 64 Ca -0.01 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3h6o h MET 64 Cb 1.31 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.90 3h6o h MET 64 CO 0.09 0.20 0.09 0.82 1.06 0.00 0.00 176.91 179.18 3h6o h ILE 65 N 0.27 1.02 0.00 -1.22 2.04 -0.93 -1.24 117.51 117.45 3h6o h ILE 65 Ca 0.08 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 3h6o h ILE 65 Cb -0.01 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 3h6o h ILE 65 CO -0.02 0.03 -0.10 0.11 0.00 0.00 0.00 178.15 178.18 3h6o h LYS 66 N 0.18 0.00 0.03 2.37 1.57 -1.12 -2.61 116.57 116.99 3h6o h LYS 66 Ca 0.06 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.62 3h6o h LYS 66 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 3h6o h LYS 66 CO -0.03 0.10 -1.04 0.77 -0.57 0.00 0.00 179.45 178.69 3h6o h SER 67 N 0.00 0.09 0.00 0.86 0.02 -0.50 -3.48 113.55 110.53 3h6o h SER 67 Ca -0.00 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3h6o h SER 67 Cb 0.27 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.78 3h6o h SER 67 CO 0.01 1.06 0.00 0.61 -1.14 0.00 0.00 176.83 177.38 3h6o n GLY 68 N 1.36 -0.25 3.72 -3.77 0.00 -0.66 -4.40 105.19 101.19 3h6o n GLY 68 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 4.19 -0.07 1.61 0.00 -0.56 -4.46 119.30 120.01 3h6o s MET 69 Ca 0.00 2.44 0.09 0.00 0.00 0.00 0.00 55.69 58.22 3h6o s MET 69 Cb 0.00 -3.12 -0.13 0.00 0.00 0.00 0.00 34.83 31.58 3h6o s MET 69 CO 0.00 -0.65 0.09 0.09 0.00 0.00 0.00 175.02 174.56 3h6o n ASN 70 N 3.87 2.72 -3.75 1.11 5.03 -0.32 -4.67 115.26 119.25 3h6o n ASN 70 Ca 0.14 0.00 -0.16 0.00 0.87 0.00 0.00 54.58 55.44 3h6o n ASN 70 Cb 0.37 0.96 -0.16 0.00 -1.02 0.00 0.00 39.78 39.94 3h6o n ASN 70 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3h6o s VAL 71 N -2.37 -0.07 -0.36 2.41 1.01 -0.89 -1.26 120.40 118.87 3h6o s VAL 71 Ca -0.04 0.25 -0.14 0.00 0.00 0.00 0.00 61.98 62.04 3h6o s VAL 71 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.30 3h6o s VAL 71 CO 0.39 0.10 0.31 0.00 0.00 0.00 0.00 175.10 175.90 3h6o s ALA 72 N 1.26 3.49 -0.22 5.51 0.00 0.29 -0.34 121.76 131.75 3h6o s ALA 72 Ca -0.07 -1.37 -0.13 0.00 0.00 0.00 0.00 51.96 50.39 3h6o s ALA 72 Cb -0.13 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 3h6o s ALA 72 CO -0.03 -1.13 0.28 0.50 0.00 0.00 0.00 175.76 175.37 3h6o s ARG 73 N 1.87 4.11 -0.29 0.00 3.52 0.13 -1.36 118.95 126.93 3h6o s ARG 73 Ca 0.09 -0.04 -0.07 0.00 -0.13 0.00 0.00 55.73 55.57 3h6o s ARG 73 Cb -0.17 -3.54 -0.00 0.00 -1.56 0.00 0.00 34.95 29.67 3h6o s ARG 73 CO 0.11 -0.00 0.09 -0.51 -0.81 0.00 0.00 175.30 174.18 3h6o s LEU 74 N 1.22 3.78 -0.34 -0.88 1.02 -0.76 -0.76 118.68 121.96 3h6o s LEU 74 Ca 0.13 -0.58 -0.24 0.00 0.02 0.00 0.00 54.13 53.45 3h6o s LEU 74 Cb -0.14 -1.90 0.01 0.00 0.02 0.00 0.00 46.19 44.18 3h6o s LEU 74 CO 0.06 -0.16 0.85 0.21 0.02 0.00 0.00 176.35 177.33 3h6o s ASN 75 N 1.54 6.65 0.00 2.29 3.84 -1.26 -1.33 114.94 126.66 3h6o s ASN 75 Ca 0.04 0.57 0.15 0.00 0.21 0.00 0.00 52.86 53.82 3h6o s ASN 75 Cb -0.17 -2.43 0.44 0.00 -0.55 0.00 0.00 41.25 38.54 3h6o s ASN 75 CO 0.03 -0.75 1.36 0.49 -2.79 0.00 0.00 177.10 175.44 3h6o n PHE 76 N 6.50 0.55 -0.32 0.43 3.01 -0.15 -3.65 117.46 123.83 3h6o n PHE 76 Ca 0.05 -0.28 0.13 0.00 1.01 0.00 0.00 57.45 58.37 3h6o n PHE 76 Cb 0.48 0.00 0.36 0.00 -0.01 0.00 0.00 39.48 40.31 3h6o n PHE 76 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3h6o h SER 77 N 2.65 0.71 -4.60 4.37 0.87 -1.83 -3.38 113.55 112.33 3h6o h SER 77 Ca 0.00 0.07 -0.26 0.00 -1.23 0.00 0.00 61.79 60.37 3h6o h SER 77 Cb 0.60 -0.07 -0.17 0.00 -0.44 0.00 0.00 62.40 62.33 3h6o h SER 77 CO 0.00 0.30 -0.71 -1.00 -0.53 0.00 0.00 176.83 174.88 3h6o s HIS 78 N -5.75 0.86 0.00 2.24 3.76 -1.24 -4.99 115.29 110.18 3h6o s HIS 78 Ca -0.10 -0.75 0.00 0.00 -0.15 0.00 0.00 55.06 54.06 3h6o s HIS 78 Cb 0.24 -0.50 0.00 0.00 1.11 0.00 0.00 32.58 33.43 3h6o s HIS 78 CO 0.80 -0.10 0.00 0.41 -0.85 0.00 0.00 174.74 175.00 3h6o n GLY 79 N 0.50 2.33 3.90 -2.22 0.00 -1.26 -4.87 105.19 103.56 3h6o n GLY 79 Ca -0.16 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 43.89 3h6o n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h6o s THR 80 N -1.73 4.38 0.29 2.61 -4.23 -1.26 -4.90 115.64 110.80 3h6o s THR 80 Ca 0.00 0.31 0.03 0.00 -1.18 0.00 0.00 61.69 60.85 3h6o s THR 80 Cb 0.00 -3.71 0.28 0.00 1.34 0.00 0.00 72.50 70.40 3h6o s THR 80 CO 0.00 -0.78 1.76 0.45 -0.54 0.00 0.00 174.62 175.51 3h6o h HIS 81 N -0.08 0.91 -0.05 3.99 -0.00 -1.98 -0.66 115.15 117.28 3h6o h HIS 81 Ca -0.46 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 59.95 3h6o h HIS 81 Cb 1.22 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 28.37 3h6o h HIS 81 CO 0.56 0.18 0.03 1.49 -0.00 0.00 0.00 177.93 180.19 3h6o h GLU 82 N 0.66 0.07 -0.23 2.45 4.81 -1.99 0.27 114.58 120.63 3h6o h GLU 82 Ca 0.54 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.78 3h6o h GLU 82 Cb 0.84 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 3h6o h GLU 82 CO -0.40 0.07 0.10 -0.92 -0.73 0.00 0.00 179.01 177.13 3h6o h TYR 83 N 0.05 0.19 -0.28 0.92 3.20 -1.81 -2.52 116.97 116.71 3h6o h TYR 83 Ca 0.02 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.75 3h6o h TYR 83 Cb 0.02 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 3h6o h TYR 83 CO -0.07 0.10 -0.42 0.45 -1.64 0.00 0.00 178.16 176.59 3h6o h HIS 84 N 0.22 0.83 -0.74 -3.82 3.86 -0.94 -1.96 115.15 112.60 3h6o h HIS 84 Ca 0.09 -0.25 0.07 0.00 -1.16 0.00 0.00 60.37 59.13 3h6o h HIS 84 Cb 0.03 -0.17 -0.06 0.00 1.06 0.00 0.00 27.41 28.27 3h6o h HIS 84 CO -0.10 0.99 0.42 0.00 0.86 0.00 0.00 177.93 180.10 3h6o h ALA 85 N 0.97 1.02 -0.39 2.45 0.00 -0.39 -1.60 119.26 121.33 3h6o h ALA 85 Ca 0.04 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3h6o h ALA 85 Cb 0.96 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3h6o h ALA 85 CO 0.09 0.09 -0.30 1.49 0.00 0.00 0.00 179.25 180.61 3h6o h GLU 86 N 0.75 0.85 -0.35 0.00 4.81 -1.19 -1.53 114.58 117.92 3h6o h GLU 86 Ca 0.34 -0.39 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3h6o h GLU 86 Cb 0.24 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 3h6o h GLU 86 CO -0.20 1.03 0.15 1.15 -0.73 0.00 0.00 179.01 180.41 3h6o h THR 87 N 0.71 0.95 0.14 0.32 2.02 -1.00 -1.32 112.91 114.73 3h6o h THR 87 Ca 0.08 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3h6o h THR 87 Cb 0.86 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3h6o h THR 87 CO 0.08 0.06 -0.12 0.40 0.37 0.00 0.00 175.52 176.30 3h6o h ILE 88 N 0.32 0.73 -0.72 3.11 2.04 -1.17 -1.21 117.51 120.61 3h6o h ILE 88 Ca 0.15 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.17 3h6o h ILE 88 Cb 0.09 0.73 -0.11 0.00 -0.74 0.00 0.00 36.82 36.79 3h6o h ILE 88 CO -0.13 0.00 0.14 0.50 0.00 0.00 0.00 178.15 178.66 3h6o h LYS 89 N -0.27 0.23 -0.67 2.37 3.64 -1.16 -0.69 116.57 120.02 3h6o h LYS 89 Ca -0.00 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 3h6o h LYS 89 Cb 0.25 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 3h6o h LYS 89 CO -0.02 0.15 0.10 -0.91 -2.27 0.00 0.00 179.45 176.50 3h6o h ASN 90 N 0.23 1.06 -0.84 4.20 -0.26 -0.90 -0.62 115.58 118.46 3h6o h ASN 90 Ca 0.40 -0.25 -0.03 0.00 -0.56 0.00 0.00 56.30 55.86 3h6o h ASN 90 Cb 0.69 -0.28 -0.04 0.00 -1.06 0.00 0.00 38.32 37.63 3h6o h ASN 90 CO -0.53 1.05 0.42 0.58 -1.06 0.00 0.00 177.43 177.89 3h6o h VAL 91 N 1.03 1.26 -0.07 2.81 2.07 -0.52 -0.80 116.25 122.03 3h6o h VAL 91 Ca 0.20 -0.69 -0.17 0.00 0.82 0.00 0.00 66.70 66.86 3h6o h VAL 91 Cb 0.45 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3h6o h VAL 91 CO 0.01 0.30 -0.69 0.03 0.02 0.00 0.00 177.57 177.24 3h6o h ARG 92 N 1.19 0.32 -0.41 1.57 3.08 -0.95 0.94 114.38 120.11 3h6o h ARG 92 Ca 0.29 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.96 3h6o h ARG 92 Cb 0.09 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3h6o h ARG 92 CO -0.04 0.89 -0.26 1.15 -1.07 0.00 0.00 179.97 180.64 3h6o h THR 93 N 0.22 1.28 -0.35 2.04 2.02 -0.95 -0.39 112.91 116.78 3h6o h THR 93 Ca -0.02 -1.42 -0.03 0.00 0.77 0.00 0.00 66.41 65.71 3h6o h THR 93 Cb 1.24 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 3h6o h THR 93 CO 0.11 0.48 0.09 0.00 0.37 0.00 0.00 175.52 176.57 3h6o h ALA 94 N 0.81 0.46 -0.21 6.16 0.00 -1.03 -2.64 119.26 122.81 3h6o h ALA 94 Ca 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3h6o h ALA 94 Cb 0.83 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3h6o h ALA 94 CO 0.07 0.12 -0.01 1.15 0.00 0.00 0.00 179.25 180.59 3h6o h THR 95 N 0.42 1.26 0.00 0.00 2.02 -0.75 -3.04 112.91 112.81 3h6o h THR 95 Ca 0.11 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.40 3h6o h THR 95 Cb 0.29 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 3h6o h THR 95 CO -0.00 0.27 0.00 -0.62 0.37 0.00 0.00 175.52 175.54 3h6o n GLU 96 N -4.67 0.17 0.30 6.66 -0.58 -0.16 -2.82 120.64 119.53 3h6o n GLU 96 Ca -0.04 0.07 0.18 0.00 -0.42 0.00 0.00 57.16 56.95 3h6o n GLU 96 Cb 0.24 -1.50 0.89 0.00 -0.57 0.00 0.00 31.44 30.50 3h6o n GLU 96 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3h6o h SER 97 N 0.00 0.00 0.06 1.62 4.64 -1.34 -2.19 113.55 116.33 3h6o h SER 97 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h6o h SER 97 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3h6o h SER 97 CO 0.00 0.03 -0.24 0.49 -0.87 0.00 0.00 176.83 176.24 3h6o n PHE 98 N -3.19 0.00 0.42 4.77 3.72 -1.13 -4.46 117.46 117.60 3h6o n PHE 98 Ca -0.01 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.49 3h6o n PHE 98 Cb 0.21 -0.04 0.42 0.00 -0.94 0.00 0.00 39.48 39.13 3h6o n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h6o n ALA 99 N 0.09 1.64 -0.27 4.37 0.00 -0.82 -3.09 120.51 122.42 3h6o n ALA 99 Ca 0.13 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.56 3h6o n ALA 99 Cb 0.44 -1.32 0.07 0.00 0.00 0.00 0.00 19.45 18.63 3h6o n ALA 99 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h6o h SER 100 N 0.00 0.84 -3.50 0.00 4.64 -1.78 -3.35 113.55 110.41 3h6o h SER 100 Ca 0.00 -0.02 -0.71 0.00 -0.47 0.00 0.00 61.79 60.59 3h6o h SER 100 Cb 0.31 -0.20 -0.27 0.00 -0.31 0.00 0.00 62.40 61.93 3h6o h SER 100 CO 0.00 0.60 -0.48 -0.62 -0.87 0.00 0.00 176.83 175.46 3h6o s ASP 101 N -5.86 5.67 0.57 4.97 2.15 -1.18 -4.97 116.67 118.03 3h6o s ASP 101 Ca -0.13 -1.33 0.35 0.00 0.43 0.00 0.00 52.55 51.88 3h6o s ASP 101 Cb 0.15 -2.00 1.67 0.00 -0.30 0.00 0.00 42.92 42.44 3h6o s ASP 101 CO 0.78 -0.49 2.11 -0.65 -0.17 0.00 0.00 175.17 176.75 3h6o h PRO 102 N 8.42 0.00 -0.05 4.34 0.11 -1.82 -1.36 132.00 141.64 3h6o h PRO 102 Ca -0.24 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.71 3h6o h PRO 102 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3h6o h PRO 102 CO 0.73 0.03 -0.68 0.82 -0.21 0.00 0.00 178.00 178.70 3h6o h ILE 103 N 0.00 1.42 -0.00 4.15 2.04 -1.93 -3.26 117.51 119.93 3h6o h ILE 103 Ca -0.00 -2.15 0.00 0.00 1.00 0.00 0.00 64.86 63.71 3h6o h ILE 103 Cb 0.35 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 3h6o h ILE 103 CO 0.00 0.63 -0.84 0.18 0.00 0.00 0.00 178.15 178.12 3h6o n LEU 104 N -3.81 1.13 -4.67 1.44 4.77 -0.97 -4.72 117.00 110.17 3h6o n LEU 104 Ca -0.03 -0.49 -0.42 0.00 -0.03 0.00 0.00 56.01 55.04 3h6o n LEU 104 Cb 0.67 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.70 3h6o n LEU 104 CO 0.45 0.26 1.47 -0.47 -1.33 0.00 0.00 177.39 177.77 3h6o s TYR 105 N -2.90 1.76 -0.32 -1.77 5.04 -0.55 -5.00 117.35 113.61 3h6o s TYR 105 Ca 0.10 -0.09 -0.12 0.00 -2.44 0.00 0.00 57.07 54.52 3h6o s TYR 105 Cb 0.17 -4.09 -0.02 0.00 0.35 0.00 0.00 41.96 38.36 3h6o s TYR 105 CO 0.79 -4.70 0.21 1.03 -1.34 0.00 0.00 175.55 171.54 3h6o s ARG 106 N 3.88 3.55 0.43 4.97 0.52 -1.26 -4.76 118.95 126.28 3h6o s ARG 106 Ca 0.81 -0.60 -0.24 0.00 -0.52 0.00 0.00 55.73 55.19 3h6o s ARG 106 Cb -0.40 -3.72 -0.11 0.00 0.52 0.00 0.00 34.95 31.25 3h6o s ARG 106 CO 0.36 -0.38 0.92 -2.30 0.02 0.00 0.00 175.30 173.91 3h6o n PRO 107 N 5.07 1.16 -4.45 3.54 -0.02 -1.26 -5.00 135.00 134.04 3h6o n PRO 107 Ca -0.13 0.42 -0.23 0.00 -2.02 0.00 0.00 63.50 61.54 3h6o n PRO 107 Cb 0.50 -1.95 -0.16 0.00 -0.02 0.00 0.00 33.50 31.87 3h6o n PRO 107 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h6o s VAL 108 N -1.33 0.95 0.35 -1.45 1.01 -1.26 -4.87 120.40 113.81 3h6o s VAL 108 Ca 0.64 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 3h6o s VAL 108 Cb -0.56 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 3h6o s VAL 108 CO 0.56 0.32 0.58 0.00 0.00 0.00 0.00 175.10 176.56 3h6o s ALA 109 N 0.75 3.65 -0.14 5.51 0.00 -0.39 -4.92 121.76 126.22 3h6o s ALA 109 Ca -0.13 -0.79 0.02 0.00 0.00 0.00 0.00 51.96 51.05 3h6o s ALA 109 Cb -0.15 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.76 3h6o s ALA 109 CO 0.02 -0.02 -0.19 0.08 0.00 0.00 0.00 175.76 175.66 3h6o s VAL 110 N -2.33 2.32 -0.08 0.00 1.01 -1.26 -0.55 120.40 119.52 3h6o s VAL 110 Ca 0.42 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.55 3h6o s VAL 110 Cb -0.10 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 3h6o s VAL 110 CO 0.36 0.54 -0.24 0.00 0.00 0.00 0.00 175.10 175.76 3h6o s ALA 111 N 0.75 2.20 -0.33 5.51 0.00 -0.47 -1.08 121.76 128.35 3h6o s ALA 111 Ca -0.08 -1.01 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 3h6o s ALA 111 Cb -0.16 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.18 3h6o s ALA 111 CO 0.00 0.37 0.23 -1.17 0.00 0.00 0.00 175.76 175.18 3h6o s LEU 112 N 0.03 4.41 -0.38 0.00 0.20 -0.65 -1.83 118.68 120.46 3h6o s LEU 112 Ca -0.09 -0.38 -0.15 0.00 0.69 0.00 0.00 54.13 54.20 3h6o s LEU 112 Cb -0.15 -2.12 0.00 0.00 -0.43 0.00 0.00 46.19 43.49 3h6o s LEU 112 CO 0.06 -0.21 0.32 -0.62 -0.29 0.00 0.00 176.35 175.61 3h6o s ASP 113 N 1.72 6.13 0.62 3.68 -1.08 -0.44 -1.11 116.67 126.18 3h6o s ASP 113 Ca 0.06 -0.59 -0.17 0.00 -0.52 0.00 0.00 52.55 51.33 3h6o s ASP 113 Cb -0.17 -2.17 -0.02 0.00 -1.46 0.00 0.00 42.92 39.10 3h6o s ASP 113 CO 0.10 -0.39 1.14 0.42 0.52 0.00 0.00 175.17 176.96 3h6o s THR 114 N 1.84 3.04 0.00 1.71 -4.23 -0.76 -0.97 115.64 116.28 3h6o s THR 114 Ca 0.08 0.55 -0.24 0.00 -1.18 0.00 0.00 61.69 60.90 3h6o s THR 114 Cb -0.18 -3.12 -0.18 0.00 1.34 0.00 0.00 72.50 70.36 3h6o s THR 114 CO 0.11 -0.23 1.33 0.50 -0.54 0.00 0.00 174.62 175.79 3h6o h LYS 115 N 0.45 0.07 0.00 3.99 3.64 -1.92 -3.40 116.57 119.41 3h6o h LYS 115 Ca -0.48 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 3h6o h LYS 115 Cb 1.26 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3h6o h LYS 115 CO 0.55 0.49 0.00 0.41 -2.27 0.00 0.00 179.45 178.62 3h6o n GLY 116 N 0.08 -0.39 3.73 5.01 0.00 -1.26 -4.88 105.19 107.47 3h6o n GLY 116 Ca -0.08 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 3h6o n GLY 116 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h6o s PRO 117 N -1.58 4.38 0.31 1.61 0.02 -1.26 -4.74 135.00 133.74 3h6o s PRO 117 Ca 0.00 2.01 0.08 0.00 0.02 0.00 0.00 61.00 63.11 3h6o s PRO 117 Cb 0.00 -3.23 -0.06 0.00 0.02 0.00 0.00 34.50 31.22 3h6o s PRO 117 CO 0.00 -0.29 -0.08 -1.21 -0.33 0.00 0.00 177.00 175.09 3h6o s GLU 118 N 0.39 1.67 -0.10 5.54 2.02 -1.26 -4.98 118.70 121.99 3h6o s GLU 118 Ca 0.59 -1.85 0.00 0.00 0.02 0.00 0.00 54.97 53.73 3h6o s GLU 118 Cb -0.35 -1.41 0.02 0.00 0.10 0.00 0.00 34.13 32.48 3h6o s GLU 118 CO 0.34 0.09 -0.09 0.42 0.02 0.00 0.00 175.26 176.04 3h6o s ILE 119 N -2.82 1.05 0.16 -1.63 1.01 -1.26 -4.94 121.20 112.77 3h6o s ILE 119 Ca 0.31 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 60.69 3h6o s ILE 119 Cb 0.03 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 3h6o s ILE 119 CO 0.14 0.36 -0.17 -0.13 0.00 0.00 0.00 174.94 175.15 3h6o s ARG 120 N 1.36 1.21 0.00 2.79 1.81 -1.26 -1.08 118.95 123.78 3h6o s ARG 120 Ca -0.02 -1.38 0.00 0.00 -1.72 0.00 0.00 55.73 52.61 3h6o s ARG 120 Cb -0.14 -1.18 0.00 0.00 -0.45 0.00 0.00 34.95 33.18 3h6o s ARG 120 CO -0.04 0.23 0.00 0.25 -0.68 0.00 0.00 175.30 175.06 3h6o n THR 121 N 0.29 0.00 -2.27 0.02 -2.24 -1.07 -2.00 114.28 107.01 3h6o n THR 121 Ca -0.13 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.22 3h6o n THR 121 Cb 0.57 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.78 3h6o n THR 121 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3h6o s GLU 133 N 0.00 3.44 -0.32 -0.78 2.56 -1.26 -4.56 118.70 117.78 3h6o s GLU 133 Ca 0.00 0.95 -0.21 0.00 0.00 0.00 0.00 54.97 55.71 3h6o s GLU 133 Cb 0.00 -4.09 -0.00 0.00 2.00 0.00 0.00 34.13 32.03 3h6o s GLU 133 CO 0.00 -1.73 0.64 -0.48 -0.56 0.00 0.00 175.26 173.13 3h6o s LEU 134 N 5.99 4.17 0.02 2.70 2.34 0.22 -4.92 118.68 129.20 3h6o s LEU 134 Ca 0.64 0.36 -0.25 0.00 0.06 0.00 0.00 54.13 54.94 3h6o s LEU 134 Cb -0.15 -2.83 -0.05 0.00 -0.56 0.00 0.00 46.19 42.60 3h6o s LEU 134 CO 0.31 -0.53 0.75 -0.54 -1.06 0.00 0.00 176.35 175.29 3h6o s LYS 135 N 2.67 4.47 0.30 1.48 -0.14 -1.26 -0.97 119.74 126.29 3h6o s LYS 135 Ca 0.26 1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 55.59 3h6o s LYS 135 Cb -0.15 -3.38 -0.12 0.00 -1.68 0.00 0.00 37.83 32.50 3h6o s LYS 135 CO 0.13 0.23 1.42 1.63 -0.76 0.00 0.00 175.35 178.00 3h6o n LYS 136 N 3.03 2.26 0.00 1.68 5.02 -1.26 -2.29 118.16 126.60 3h6o n LYS 136 Ca -0.02 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 3h6o n LYS 136 Cb 0.50 -2.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.05 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 1.57 2.72 3.79 0.72 0.00 -0.76 -4.99 105.19 108.24 3h6o n GLY 137 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.13 2.38 0.14 4.61 0.00 -0.97 -4.58 121.76 121.21 3h6o s ALA 138 Ca 0.00 0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.94 3h6o s ALA 138 Cb 0.00 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.83 3h6o s ALA 138 CO 0.00 -1.59 0.60 0.99 0.00 0.00 0.00 175.76 175.75 3h6o s THR 139 N -2.97 4.75 -0.04 0.00 2.01 -1.26 -1.08 115.64 117.05 3h6o s THR 139 Ca 0.60 1.06 -0.01 0.00 0.31 0.00 0.00 61.69 63.65 3h6o s THR 139 Cb -0.16 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.56 3h6o s THR 139 CO 0.56 0.34 0.07 -0.22 -0.69 0.00 0.00 174.62 174.68 3h6o s LEU 140 N -1.67 0.52 -0.04 4.42 2.96 -0.56 -4.86 118.68 119.45 3h6o s LEU 140 Ca 0.36 0.12 -0.23 0.00 -0.22 0.00 0.00 54.13 54.16 3h6o s LEU 140 Cb -0.17 -0.01 -0.04 0.00 0.50 0.00 0.00 46.19 46.46 3h6o s LEU 140 CO 0.20 -0.19 0.68 -1.59 -1.32 0.00 0.00 176.35 174.13 3h6o s LYS 141 N 1.68 4.42 -0.43 1.98 -2.85 -1.10 -1.62 119.74 121.82 3h6o s LYS 141 Ca -0.02 0.87 -0.11 0.00 -1.00 0.00 0.00 55.97 55.71 3h6o s LYS 141 Cb -0.12 -3.41 0.08 0.00 -2.06 0.00 0.00 37.83 32.31 3h6o s LYS 141 CO -0.04 0.16 0.29 0.42 0.10 0.00 0.00 175.35 176.29 3h6o s ILE 142 N 0.45 4.51 0.12 3.79 -1.09 -0.39 -0.81 121.20 127.78 3h6o s ILE 142 Ca 0.36 -1.29 0.05 0.00 -2.23 0.00 0.00 60.65 57.54 3h6o s ILE 142 Cb -0.18 -3.73 -0.04 0.00 -1.58 0.00 0.00 42.46 36.93 3h6o s ILE 142 CO 0.19 -0.52 0.05 -0.89 -1.23 0.00 0.00 174.94 172.54 3h6o s THR 143 N 1.49 4.17 -1.62 2.92 2.01 -0.44 -1.13 115.64 123.05 3h6o s THR 143 Ca 0.03 -1.06 0.14 0.00 0.31 0.00 0.00 61.69 61.12 3h6o s THR 143 Cb -0.23 -3.05 0.19 0.00 0.01 0.00 0.00 72.50 69.42 3h6o s THR 143 CO 0.03 0.02 1.06 0.18 -0.69 0.00 0.00 174.62 175.22 3h6o n LEU 144 N 0.18 2.48 -4.68 4.42 4.77 0.17 -3.29 117.00 121.06 3h6o n LEU 144 Ca -0.10 -1.29 -0.42 0.00 -0.03 0.00 0.00 56.01 54.17 3h6o n LEU 144 Cb 0.53 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 3h6o n LEU 144 CO 0.41 0.51 1.20 -1.81 -1.33 0.00 0.00 177.39 176.37 3h6o s ASP 145 N -1.14 6.79 0.44 -1.43 -0.00 -1.26 -4.90 116.67 115.16 3h6o s ASP 145 Ca 0.20 2.13 0.30 0.00 -0.00 0.00 0.00 52.55 55.18 3h6o s ASP 145 Cb 0.13 -2.55 1.29 0.00 -0.00 0.00 0.00 42.92 41.79 3h6o s ASP 145 CO 0.19 -0.79 1.89 0.78 -0.00 0.00 0.00 175.17 177.24 3h6o h ASN 146 N 8.35 0.00 -0.95 0.27 2.35 -1.97 -2.63 115.58 121.00 3h6o h ASN 146 Ca -0.37 0.00 0.19 0.00 -0.55 0.00 0.00 56.30 55.56 3h6o h ASN 146 Cb 1.17 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.46 3h6o h ASN 146 CO 0.93 0.00 0.60 0.00 -1.65 0.00 0.00 177.43 177.31 3h6o h ALA 147 N 2.10 1.94 -0.53 -0.83 0.00 -2.02 0.38 119.26 120.30 3h6o h ALA 147 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3h6o h ALA 147 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3h6o h ALA 147 CO 0.00 -0.25 0.03 2.48 0.00 0.00 0.00 179.25 181.51 3h6o n TYR 148 N -4.61 1.91 0.28 0.00 -0.00 -0.99 -4.49 117.16 109.26 3h6o n TYR 148 Ca 0.20 -0.70 0.15 0.00 -0.00 0.00 0.00 57.90 57.56 3h6o n TYR 148 Cb 0.61 -0.49 0.81 0.00 -0.00 0.00 0.00 39.34 40.27 3h6o n TYR 148 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.86 177.38 3h6o h MET 149 N 3.43 0.00 0.00 -3.48 0.00 -1.03 -2.81 114.93 111.03 3h6o h MET 149 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.73 3h6o h MET 149 Cb 1.87 0.00 0.00 0.00 0.00 0.00 0.00 31.60 33.47 3h6o h MET 149 CO 0.47 0.08 0.00 0.39 0.00 0.00 0.00 176.91 177.84 3h6o n GLU 150 N -3.45 1.25 -1.59 1.72 -0.58 -1.26 -4.73 120.64 112.00 3h6o n GLU 150 Ca -0.02 -1.01 -0.28 0.00 -0.42 0.00 0.00 57.16 55.43 3h6o n GLU 150 Cb 0.22 -0.94 0.07 0.00 -0.57 0.00 0.00 31.44 30.21 3h6o n GLU 150 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 3h6o n LYS 151 N -0.27 3.02 -1.84 3.49 -0.00 -1.06 -5.00 118.16 116.50 3h6o n LYS 151 Ca 0.00 -3.66 -0.39 0.00 -0.00 0.00 0.00 58.31 54.26 3h6o n LYS 151 Cb 0.18 -2.25 -0.03 0.00 -0.00 0.00 0.00 35.03 32.93 3h6o n LYS 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3h6o s ASP 153 N 8.96 4.46 0.57 0.00 1.47 -0.59 -5.02 116.67 126.51 3h6o s ASP 153 Ca 0.82 -1.34 0.32 0.00 1.18 0.00 0.00 52.55 53.54 3h6o s ASP 153 Cb -0.18 0.30 1.72 0.00 -0.34 0.00 0.00 42.92 44.42 3h6o s ASP 153 CO 0.26 -0.94 2.16 1.05 0.68 0.00 0.00 175.17 178.39 3h6o h GLU 154 N 1.04 0.00 0.14 2.11 9.09 -1.93 -3.14 114.58 121.89 3h6o h GLU 154 Ca -0.40 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 58.73 3h6o h GLU 154 Cb 1.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.40 3h6o h GLU 154 CO 0.64 0.06 -1.42 -2.95 0.05 0.00 0.00 179.01 175.39 3h6o h ASN 155 N 0.00 0.45 -3.92 3.06 7.08 -1.95 -3.46 115.58 116.83 3h6o h ASN 155 Ca -0.00 -0.88 -0.45 0.00 -3.08 0.00 0.00 56.30 51.89 3h6o h ASN 155 Cb 0.22 -0.15 -0.30 0.00 -2.08 0.00 0.00 38.32 36.01 3h6o h ASN 155 CO 0.01 1.63 -0.80 -0.51 -2.08 0.00 0.00 177.43 175.68 3h6o s ILE 156 N -2.49 0.91 -0.05 6.14 1.10 -1.19 -2.70 121.20 122.92 3h6o s ILE 156 Ca -0.18 -0.45 0.05 0.00 -0.51 0.00 0.00 60.65 59.55 3h6o s ILE 156 Cb 0.04 -0.79 -0.01 0.00 0.15 0.00 0.00 42.46 41.85 3h6o s ILE 156 CO 0.79 0.27 -0.20 -0.22 -2.11 0.00 0.00 174.94 173.48 3h6o s LEU 157 N 0.03 1.97 -0.03 8.50 2.96 0.01 -1.55 118.68 130.56 3h6o s LEU 157 Ca -0.01 -0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 53.48 3h6o s LEU 157 Cb -0.08 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 3h6o s LEU 157 CO 0.00 0.18 0.08 0.86 -1.32 0.00 0.00 176.35 176.15 3h6o s TRP 158 N -0.01 3.31 0.18 5.38 -0.00 -1.26 -1.33 118.94 125.22 3h6o s TRP 158 Ca -0.04 0.25 0.07 0.00 -0.00 0.00 0.00 56.10 56.38 3h6o s TRP 158 Cb -0.12 -1.78 -0.04 0.00 -0.00 0.00 0.00 33.47 31.53 3h6o s TRP 158 CO 0.03 0.56 -0.15 -0.51 -0.00 0.00 0.00 176.95 176.88 3h6o s LEU 159 N -1.50 2.51 0.00 5.86 1.43 -1.21 -4.33 118.68 121.44 3h6o s LEU 159 Ca 0.20 -0.95 0.22 0.00 -1.03 0.00 0.00 54.13 52.57 3h6o s LEU 159 Cb -0.12 -0.67 0.57 0.00 0.03 0.00 0.00 46.19 46.00 3h6o s LEU 159 CO 0.11 -0.15 1.49 -0.90 0.23 0.00 0.00 176.35 177.13 3h6o n ASP 160 N -0.09 3.63 -4.28 2.29 5.75 -0.85 -4.79 116.55 118.21 3h6o n ASP 160 Ca -0.10 -1.99 -0.45 0.00 -0.01 0.00 0.00 54.79 52.24 3h6o n ASP 160 Cb 0.59 -0.40 -0.05 0.00 -1.03 0.00 0.00 41.12 40.22 3h6o n ASP 160 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 3h6o s TYR 161 N -1.19 3.41 0.21 2.11 6.04 -1.26 -4.94 117.35 121.72 3h6o s TYR 161 Ca 0.44 -1.64 0.25 0.00 0.04 0.00 0.00 57.07 56.17 3h6o s TYR 161 Cb 0.24 -3.71 1.08 0.00 -1.04 0.00 0.00 41.96 38.53 3h6o s TYR 161 CO 0.32 -1.00 1.90 1.57 -1.54 0.00 0.00 175.55 176.79 3h6o h LYS 162 N 8.47 0.00 -0.05 4.97 5.09 -1.98 -2.63 116.57 130.45 3h6o h LYS 162 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.56 3h6o h LYS 162 Cb 1.07 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.40 3h6o h LYS 162 CO 0.92 0.19 0.00 0.09 -2.09 0.00 0.00 179.45 178.57 3h6o n ASN 163 N -3.44 1.29 -0.32 7.07 4.13 -1.26 -4.51 115.26 118.23 3h6o n ASN 163 Ca -0.00 -1.48 0.24 0.00 1.68 0.00 0.00 54.58 55.01 3h6o n ASN 163 Cb 0.38 -0.02 0.52 0.00 -1.54 0.00 0.00 39.78 39.12 3h6o n ASN 163 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 3h6o h ILE 164 N 1.94 0.51 -0.28 2.41 2.10 -1.86 0.26 117.51 122.59 3h6o h ILE 164 Ca 0.00 -0.13 -0.10 0.00 1.08 0.00 0.00 64.86 65.71 3h6o h ILE 164 Cb 0.42 0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 36.24 3h6o h ILE 164 CO 0.00 0.07 -0.26 0.00 -1.08 0.00 0.00 178.15 176.87 3h6o h LYS 166 N 0.49 0.28 -0.53 0.00 2.10 -0.80 -2.69 116.57 115.41 3h6o h LYS 166 Ca 0.07 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 3h6o h LYS 166 Cb 0.71 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 3h6o h LYS 166 CO 0.05 0.18 0.00 1.33 -2.00 0.00 0.00 179.45 179.02 3h6o n VAL 167 N -5.11 2.28 -4.68 0.07 0.24 -1.12 -4.87 118.33 105.14 3h6o n VAL 167 Ca 0.09 -1.41 -0.33 0.00 -2.04 0.00 0.00 64.34 60.65 3h6o n VAL 167 Cb 0.33 -0.10 -0.14 0.00 -1.47 0.00 0.00 33.84 32.46 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 -2.38 3.00 0.31 3.34 -7.23 -0.91 -4.71 120.40 111.81 3h6o s VAL 168 Ca 0.50 -0.67 0.09 0.00 -1.81 0.00 0.00 61.98 60.09 3h6o s VAL 168 Cb 0.36 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 3h6o s VAL 168 CO 0.18 0.52 0.05 -1.61 -0.31 0.00 0.00 175.10 173.92 3h6o s GLU 169 N 0.51 2.27 -0.17 4.82 8.01 -1.26 -4.89 118.70 127.98 3h6o s GLU 169 Ca -0.09 -1.53 -0.29 0.00 0.01 0.00 0.00 54.97 53.07 3h6o s GLU 169 Cb -0.16 -2.11 -0.04 0.00 -4.31 0.00 0.00 34.13 27.51 3h6o s GLU 169 CO 0.04 0.23 1.69 0.08 0.01 0.00 0.00 175.26 177.32 3h6o s VAL 170 N -2.40 3.58 0.00 2.63 1.01 -1.26 -2.07 120.40 121.88 3h6o s VAL 170 Ca 0.34 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.98 3h6o s VAL 170 Cb -0.04 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.78 3h6o s VAL 170 CO 0.21 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.71 3h6o n GLY 171 N 4.65 1.10 3.77 4.51 0.00 -0.21 -5.02 105.19 113.98 3h6o n GLY 171 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.87 7.40 0.33 1.61 0.01 -0.88 -4.72 113.70 116.58 3h6o s SER 172 Ca 0.00 1.88 -0.15 0.00 1.31 0.00 0.00 55.95 58.99 3h6o s SER 172 Cb 0.00 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.55 3h6o s SER 172 CO 0.00 -0.02 0.74 -1.59 0.41 0.00 0.00 173.24 172.78 3h6o s LYS 173 N -1.82 4.00 -0.04 12.44 0.00 -1.26 -1.31 119.74 131.74 3h6o s LYS 173 Ca 0.48 0.68 -0.01 0.00 0.00 0.00 0.00 55.97 57.11 3h6o s LYS 173 Cb -0.21 -2.42 0.03 0.00 0.00 0.00 0.00 37.83 35.22 3h6o s LYS 173 CO 0.26 0.15 0.03 0.42 0.00 0.00 0.00 175.35 176.21 3h6o s ILE 174 N -1.99 0.10 -0.04 3.79 1.01 0.31 -4.16 121.20 120.22 3h6o s ILE 174 Ca 0.54 0.25 0.01 0.00 0.00 0.00 0.00 60.65 61.45 3h6o s ILE 174 Cb -0.10 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 3h6o s ILE 174 CO 0.17 0.19 -0.04 -0.31 0.00 0.00 0.00 174.94 174.95 3h6o s TYR 175 N 1.75 3.00 -0.02 3.97 4.12 -0.55 -0.51 117.35 129.11 3h6o s TYR 175 Ca 0.00 0.06 0.02 0.00 0.02 0.00 0.00 57.07 57.17 3h6o s TYR 175 Cb -0.13 -1.69 0.01 0.00 -1.52 0.00 0.00 41.96 38.63 3h6o s TYR 175 CO -0.03 0.40 -0.06 0.08 0.02 0.00 0.00 175.55 175.95 3h6o s VAL 176 N -0.93 0.55 -0.70 0.71 1.01 -0.36 -1.44 120.40 119.23 3h6o s VAL 176 Ca 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 3h6o s VAL 176 Cb -0.11 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 3h6o s VAL 176 CO 0.05 0.19 0.63 -0.67 0.00 0.00 0.00 175.10 175.29 3h6o n ASP 177 N 3.38 -5.78 -3.89 3.32 4.64 0.22 -1.68 116.55 116.76 3h6o n ASP 177 Ca -0.18 -0.36 -0.26 0.00 -1.38 0.00 0.00 54.79 52.60 3h6o n ASP 177 Cb 0.55 -4.09 -0.01 0.00 -1.04 0.00 0.00 41.12 36.53 3h6o n ASP 177 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3h6o n ASP 178 N -2.36 -1.23 0.00 1.67 8.00 -1.23 -1.82 116.55 119.57 3h6o n ASP 178 Ca -0.03 -1.00 0.00 0.00 0.71 0.00 0.00 54.79 54.47 3h6o n ASP 178 Cb 0.56 -3.17 0.00 0.00 -0.02 0.00 0.00 41.12 38.48 3h6o n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h6o n GLY 179 N -1.90 0.65 0.26 0.44 0.00 -1.25 -4.89 105.19 98.49 3h6o n GLY 179 Ca -0.27 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 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 0.59 -8.67 0.99 4.07 -1.21 -3.43 115.31 107.65 3h6o h LEU 180 Ca 0.00 -0.17 -0.69 0.00 0.08 0.00 0.00 57.88 57.09 3h6o h LEU 180 Cb 0.07 -0.16 -0.28 0.00 1.08 0.00 0.00 40.66 41.37 3h6o h LEU 180 CO 0.00 0.76 -0.88 -0.63 -1.08 0.00 0.00 178.44 176.61 3h6o s ILE 181 N -4.68 2.08 0.06 1.22 1.01 -0.68 -4.79 121.20 115.42 3h6o s ILE 181 Ca -0.08 -1.25 0.07 0.00 0.00 0.00 0.00 60.65 59.39 3h6o s ILE 181 Cb 0.14 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 3h6o s ILE 181 CO 0.80 0.47 -0.20 -0.55 0.00 0.00 0.00 174.94 175.45 3h6o s SER 182 N -0.93 2.41 0.04 3.58 0.15 -0.85 -1.23 113.70 116.87 3h6o s SER 182 Ca 0.11 -0.56 -0.02 0.00 0.70 0.00 0.00 55.95 56.18 3h6o s SER 182 Cb -0.10 -0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.01 3h6o s SER 182 CO 0.01 0.12 0.02 -0.76 1.20 0.00 0.00 173.24 173.82 3h6o s LEU 183 N -1.35 2.18 0.01 3.45 1.43 0.33 -1.88 118.68 122.85 3h6o s LEU 183 Ca 0.07 -0.72 0.06 0.00 -1.03 0.00 0.00 54.13 52.51 3h6o s LEU 183 Cb -0.09 0.32 -0.02 0.00 0.03 0.00 0.00 46.19 46.43 3h6o s LEU 183 CO 0.02 -0.50 -0.19 -1.58 0.23 0.00 0.00 176.35 174.34 3h6o s GLN 184 N -2.88 1.40 -0.26 1.70 0.74 -0.83 -0.53 119.66 119.01 3h6o s GLN 184 Ca -0.03 -0.78 -0.26 0.00 0.05 0.00 0.00 55.36 54.35 3h6o s GLN 184 Cb 0.00 -1.42 0.00 0.00 1.10 0.00 0.00 33.01 32.69 3h6o s GLN 184 CO -0.06 0.38 0.89 0.08 -0.55 0.00 0.00 175.29 176.03 3h6o s VAL 185 N -0.62 4.76 -0.14 1.34 1.01 -0.43 -2.02 120.40 124.30 3h6o s VAL 185 Ca 0.07 1.63 0.08 0.00 0.00 0.00 0.00 61.98 63.76 3h6o s VAL 185 Cb -0.08 -4.19 -0.14 0.00 0.00 0.00 0.00 36.38 31.97 3h6o s VAL 185 CO 0.00 -0.16 -0.02 0.29 0.00 0.00 0.00 175.10 175.21 3h6o n LYS 186 N 6.19 1.40 -4.13 2.72 4.76 0.41 -1.05 118.16 128.46 3h6o n LYS 186 Ca 0.07 0.03 -0.16 0.00 -2.87 0.00 0.00 58.31 55.38 3h6o n LYS 186 Cb 0.47 -1.33 -0.12 0.00 -1.84 0.00 0.00 35.03 32.22 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 -2.32 0.71 -0.04 1.97 1.11 -0.46 -4.94 119.66 115.70 3h6o s GLN 187 Ca -0.12 -0.91 0.04 0.00 0.01 0.00 0.00 55.36 54.38 3h6o s GLN 187 Cb 0.04 -0.58 -0.00 0.00 -1.01 0.00 0.00 33.01 31.46 3h6o s GLN 187 CO 0.48 0.12 -0.16 0.15 0.01 0.00 0.00 175.29 175.89 3h6o s LYS 188 N -1.83 1.62 0.00 2.91 1.02 -1.26 -1.22 119.74 120.97 3h6o s LYS 188 Ca -0.04 -0.55 0.00 0.00 0.02 0.00 0.00 55.97 55.40 3h6o s LYS 188 Cb -0.09 -1.43 0.00 0.00 -0.52 0.00 0.00 37.83 35.79 3h6o s LYS 188 CO 0.01 0.22 0.00 0.41 -0.92 0.00 0.00 175.35 175.08 3h6o n GLY 189 N 3.16 5.40 0.24 -3.33 0.00 -0.52 -4.98 105.19 105.16 3h6o n GLY 189 Ca -0.18 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 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 1.89 0.61 4.61 0.00 -1.26 -4.66 120.51 118.70 3h6o n ALA 190 Ca 0.00 -0.50 0.12 0.00 0.00 0.00 0.00 53.44 53.05 3h6o n ALA 190 Cb 0.00 0.26 0.09 0.00 0.00 0.00 0.00 19.45 19.80 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 -3.09 0.64 -3.96 0.00 5.75 -1.26 -4.78 116.55 109.85 3h6o n ASP 191 Ca -0.22 -0.11 -0.13 0.00 -0.01 0.00 0.00 54.79 54.31 3h6o n ASP 191 Cb 0.71 0.55 -0.09 0.00 -1.03 0.00 0.00 41.12 41.26 3h6o n ASP 191 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3h6o s PHE 192 N -3.17 1.20 -0.16 2.11 -0.12 -1.26 0.43 117.98 117.01 3h6o s PHE 192 Ca 0.05 -1.37 -0.10 0.00 -0.05 0.00 0.00 56.93 55.46 3h6o s PHE 192 Cb 0.14 -0.49 0.05 0.00 -0.63 0.00 0.00 43.02 42.09 3h6o s PHE 192 CO 0.77 -0.75 0.39 -0.51 -0.05 0.00 0.00 175.22 175.07 3h6o s LEU 193 N -3.19 0.13 -0.51 -1.99 2.01 -0.28 -1.44 118.68 113.41 3h6o s LEU 193 Ca 0.37 0.83 -0.22 0.00 0.01 0.00 0.00 54.13 55.12 3h6o s LEU 193 Cb 0.05 1.30 0.04 0.00 0.01 0.00 0.00 46.19 47.59 3h6o s LEU 193 CO 0.15 -0.17 0.80 0.68 1.01 0.00 0.00 176.35 178.82 3h6o s VAL 194 N 1.02 4.61 0.24 -1.59 -7.23 -0.36 -1.26 120.40 115.83 3h6o s VAL 194 Ca -0.07 0.10 0.06 0.00 -1.81 0.00 0.00 61.98 60.26 3h6o s VAL 194 Cb -0.07 -4.40 -0.03 0.00 0.56 0.00 0.00 36.38 32.44 3h6o s VAL 194 CO -0.08 -0.90 0.24 0.42 -0.31 0.00 0.00 175.10 174.47 3h6o s THR 195 N 3.35 4.71 -0.03 5.32 -4.23 -0.64 -0.45 115.64 123.67 3h6o s THR 195 Ca 0.26 -1.23 0.07 0.00 -1.18 0.00 0.00 61.69 59.60 3h6o s THR 195 Cb -0.14 -3.53 -0.02 0.00 1.34 0.00 0.00 72.50 70.15 3h6o s THR 195 CO 0.18 -0.31 -0.25 -1.61 -0.54 0.00 0.00 174.62 172.09 3h6o s GLU 196 N -3.79 2.27 0.09 3.99 8.01 -0.86 -1.50 118.70 126.91 3h6o s GLU 196 Ca 0.33 -0.90 -0.30 0.00 0.01 0.00 0.00 54.97 54.11 3h6o s GLU 196 Cb -0.08 -2.10 -0.06 0.00 -4.31 0.00 0.00 34.13 27.57 3h6o s GLU 196 CO 0.26 0.52 1.14 0.08 0.01 0.00 0.00 175.26 177.27 3h6o s VAL 197 N -0.50 4.07 -0.05 2.63 1.01 -0.24 -1.97 120.40 125.36 3h6o s VAL 197 Ca 0.06 1.57 -0.04 0.00 0.00 0.00 0.00 61.98 63.58 3h6o s VAL 197 Cb -0.11 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 3h6o s VAL 197 CO 0.00 0.17 -0.07 -0.62 0.00 0.00 0.00 175.10 174.58 3h6o n GLU 198 N 3.43 0.16 -3.54 2.72 1.02 -0.79 -1.82 120.64 121.82 3h6o n GLU 198 Ca 0.07 0.29 -0.41 0.00 -0.02 0.00 0.00 57.16 57.08 3h6o n GLU 198 Cb 0.47 -1.02 -0.10 0.00 -0.02 0.00 0.00 31.44 30.77 3h6o n GLU 198 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3h6o s ASN 199 N -4.34 5.84 0.92 1.62 0.01 -1.13 -4.57 114.94 113.29 3h6o s ASN 199 Ca -0.06 -1.15 -0.12 0.00 -0.71 0.00 0.00 52.86 50.82 3h6o s ASN 199 Cb 0.01 -2.06 0.14 0.00 0.41 0.00 0.00 41.25 39.75 3h6o s ASN 199 CO 0.09 -0.47 1.10 -0.83 -1.51 0.00 0.00 177.10 175.48 3h6o s GLY 200 N 1.86 1.59 0.00 0.66 0.00 -1.26 -2.01 107.32 108.16 3h6o s GLY 200 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 44.72 44.46 3h6o s GLY 200 CO 0.06 0.25 0.00 0.61 0.00 0.00 0.00 173.10 174.02 3h6o n GLY 201 N -1.48 -1.79 3.57 0.20 0.00 -0.14 -4.81 105.19 100.75 3h6o n GLY 201 Ca 0.06 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 3h6o n GLY 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h6o s SER 202 N -0.14 6.50 -0.41 1.61 1.04 -1.26 0.73 113.70 121.77 3h6o s SER 202 Ca 0.00 0.17 -0.28 0.00 0.48 0.00 0.00 55.95 56.32 3h6o s SER 202 Cb 0.00 -2.40 0.02 0.00 0.10 0.00 0.00 66.02 63.74 3h6o s SER 202 CO 0.00 -0.84 1.04 -0.76 0.98 0.00 0.00 173.24 173.66 3h6o s LEU 203 N 3.26 3.84 0.00 2.42 1.43 -1.26 -4.93 118.68 123.44 3h6o s LEU 203 Ca 0.32 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 53.99 3h6o s LEU 203 Cb -0.12 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.67 3h6o s LEU 203 CO 0.20 -1.05 0.00 0.61 0.23 0.00 0.00 176.35 176.35 3h6o n GLY 204 N 4.53 0.86 3.60 -3.19 0.00 -1.26 -4.60 105.19 105.12 3h6o n GLY 204 Ca 0.10 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 3h6o n GLY 204 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h6o s SER 205 N -1.00 4.78 -1.31 1.61 1.04 -1.26 -4.71 113.70 112.86 3h6o s SER 205 Ca 0.00 0.00 -0.05 0.00 0.48 0.00 0.00 55.95 56.38 3h6o s SER 205 Cb 0.00 -1.29 -0.00 0.00 0.10 0.00 0.00 66.02 64.83 3h6o s SER 205 CO 0.00 0.35 0.59 1.17 0.98 0.00 0.00 173.24 176.33 3h6o n LYS 206 N 2.32 -3.21 -3.75 4.02 0.00 -1.26 -4.97 118.16 111.30 3h6o n LYS 206 Ca -0.18 0.48 -0.21 0.00 0.00 0.00 0.00 58.31 58.40 3h6o n LYS 206 Cb 0.53 -4.62 -0.01 0.00 0.00 0.00 0.00 35.03 30.93 3h6o n LYS 206 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3h6o s LYS 207 N -6.23 3.33 0.20 1.64 1.02 -1.26 -4.75 119.74 113.69 3h6o s LYS 207 Ca 0.12 -0.81 -0.30 0.00 0.02 0.00 0.00 55.97 55.00 3h6o s LYS 207 Cb -0.04 -2.85 -0.08 0.00 -0.52 0.00 0.00 37.83 34.34 3h6o s LYS 207 CO 0.86 0.28 1.05 0.20 -0.92 0.00 0.00 175.35 176.82 3h6o s GLY 208 N -4.05 2.97 -0.14 -3.33 0.00 -1.26 -2.58 107.32 98.93 3h6o s GLY 208 Ca 0.38 0.76 0.02 0.00 0.00 0.00 0.00 44.72 45.89 3h6o s GLY 208 CO 0.30 1.50 -0.21 0.14 0.00 0.00 0.00 173.10 174.83 3h6o s VAL 209 N -0.60 2.13 -0.02 1.40 1.01 -0.24 0.72 120.40 124.79 3h6o s VAL 209 Ca 0.46 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.55 3h6o s VAL 209 Cb -0.28 -1.85 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 3h6o s VAL 209 CO 0.35 0.55 -0.21 0.20 0.00 0.00 0.00 175.10 175.98 3h6o s ASN 210 N 0.80 3.45 -0.58 3.32 -0.87 -0.52 -4.31 114.94 116.24 3h6o s ASN 210 Ca -0.07 -0.37 0.00 0.00 -1.57 0.00 0.00 52.86 50.85 3h6o s ASN 210 Cb -0.16 -0.54 0.15 0.00 -0.02 0.00 0.00 41.25 40.68 3h6o s ASN 210 CO -0.01 0.32 0.36 -0.76 -2.57 0.00 0.00 177.10 174.43 3h6o s LEU 211 N -0.73 4.80 0.24 0.60 1.43 -1.26 -1.48 118.68 122.28 3h6o s LEU 211 Ca 0.11 -2.94 -0.31 0.00 -1.03 0.00 0.00 54.13 49.96 3h6o s LEU 211 Cb -0.10 -1.75 -0.12 0.00 0.03 0.00 0.00 46.19 44.25 3h6o s LEU 211 CO 0.00 -0.30 1.66 -2.84 0.23 0.00 0.00 176.35 175.10 3h6o s PRO 212 N -0.19 4.13 0.00 1.29 0.02 -1.26 -2.12 135.00 136.87 3h6o s PRO 212 Ca 0.17 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.77 3h6o s PRO 212 Cb -0.23 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.23 3h6o s PRO 212 CO -0.02 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.36 3h6o n GLY 213 N 3.27 0.87 3.83 0.52 0.00 -1.26 -4.71 105.19 107.72 3h6o n GLY 213 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.60 3.39 -1.22 4.61 0.00 -0.90 -4.92 121.76 119.11 3h6o s ALA 214 Ca 0.00 0.10 -0.13 0.00 0.00 0.00 0.00 51.96 51.93 3h6o s ALA 214 Cb 0.00 -2.78 0.17 0.00 0.00 0.00 0.00 23.12 20.51 3h6o s ALA 214 CO 0.00 0.34 1.52 0.00 0.00 0.00 0.00 175.76 177.61 3h6o n ALA 215 N 0.29 4.18 -2.03 0.00 0.00 -1.26 -4.63 120.51 117.06 3h6o n ALA 215 Ca -0.00 -4.27 -0.42 0.00 0.00 0.00 0.00 53.44 48.75 3h6o n ALA 215 Cb 0.52 -3.02 -0.03 0.00 0.00 0.00 0.00 19.45 16.92 3h6o n ALA 215 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3h6o s VAL 216 N 1.24 3.08 -2.37 0.00 1.01 -1.26 -4.90 120.40 117.20 3h6o s VAL 216 Ca 0.42 0.68 0.23 0.00 0.00 0.00 0.00 61.98 63.30 3h6o s VAL 216 Cb -0.01 -3.43 0.47 0.00 0.00 0.00 0.00 36.38 33.41 3h6o s VAL 216 CO 0.00 0.03 1.44 -0.90 0.00 0.00 0.00 175.10 175.67 3h6o n ASP 217 N 4.66 3.44 -4.39 3.32 5.75 -1.26 -4.97 116.55 123.11 3h6o n ASP 217 Ca 0.14 -1.98 -0.39 0.00 -0.01 0.00 0.00 54.79 52.54 3h6o n ASP 217 Cb 0.41 -0.29 0.02 0.00 -1.03 0.00 0.00 41.12 40.23 3h6o n ASP 217 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3h6o n LEU 218 N 1.45 -1.00 -4.69 -2.12 4.77 -1.26 -4.91 117.00 109.25 3h6o n LEU 218 Ca 0.20 0.75 -0.31 0.00 -0.03 0.00 0.00 56.01 56.63 3h6o n LEU 218 Cb 0.59 -1.04 0.15 0.00 -2.33 0.00 0.00 43.42 40.79 3h6o n LEU 218 CO 0.16 -3.63 0.67 -2.84 -1.33 0.00 0.00 177.39 170.41 3h6o s PRO 219 N -1.58 1.19 0.34 3.23 0.02 -1.26 -4.91 135.00 132.03 3h6o s PRO 219 Ca 0.63 1.32 0.05 0.00 0.02 0.00 0.00 61.00 63.02 3h6o s PRO 219 Cb -0.51 -1.76 0.69 0.00 0.02 0.00 0.00 34.50 32.94 3h6o s PRO 219 CO 0.59 -2.44 1.93 0.00 -0.33 0.00 0.00 177.00 176.75 3h6o h ALA 220 N -1.72 1.67 -3.86 -1.55 0.00 -1.90 -3.42 119.26 108.47 3h6o h ALA 220 Ca -0.45 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.09 3h6o h ALA 220 Cb 1.27 -0.21 -0.29 0.00 0.00 0.00 0.00 17.79 18.56 3h6o h ALA 220 CO 0.46 0.19 -0.76 0.14 0.00 0.00 0.00 179.25 179.28 3h6o s VAL 221 N -5.75 0.49 0.97 0.00 -7.23 -1.26 -4.70 120.40 102.92 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 0.20 -0.43 0.18 0.00 0.56 0.00 0.00 36.38 36.88 3h6o s VAL 221 CO 0.78 0.15 1.18 -0.94 -0.31 0.00 0.00 175.10 175.97 3h6o s SER 222 N 0.04 3.01 0.16 4.85 1.04 -1.26 -4.87 113.70 116.67 3h6o s SER 222 Ca -0.00 0.71 -0.15 0.00 0.48 0.00 0.00 55.95 56.98 3h6o s SER 222 Cb -0.05 -1.08 0.07 0.00 0.10 0.00 0.00 66.02 65.07 3h6o s SER 222 CO -0.00 -2.84 1.78 -0.33 0.98 0.00 0.00 173.24 172.83 3h6o h GLU 223 N -1.70 0.42 -0.68 4.02 4.39 -2.00 -2.10 114.58 116.93 3h6o h GLU 223 Ca -0.47 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.23 3h6o h GLU 223 Cb 1.30 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 29.81 3h6o h GLU 223 CO 0.51 0.28 0.43 -0.22 -1.16 0.00 0.00 179.01 178.84 3h6o h LYS 224 N 0.43 0.81 -0.74 2.33 3.64 -1.98 -2.56 116.57 118.49 3h6o h LYS 224 Ca 0.18 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 3h6o h LYS 224 Cb 0.08 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 31.66 3h6o h LYS 224 CO -0.12 0.54 0.45 -0.44 -2.27 0.00 0.00 179.45 177.60 3h6o h ASP 225 N 0.83 0.70 -0.89 4.20 3.32 -1.83 -0.21 116.42 122.54 3h6o h ASP 225 Ca 0.27 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.35 3h6o h ASP 225 Cb 0.02 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 3h6o h ASP 225 CO -0.11 0.46 0.59 0.40 -1.72 0.00 0.00 179.24 178.86 3h6o h ILE 226 N 0.84 1.23 -0.09 0.35 2.04 -0.98 0.19 117.51 121.08 3h6o h ILE 226 Ca 0.32 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 3h6o h ILE 226 Cb 0.13 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.13 3h6o h ILE 226 CO -0.16 0.22 -0.10 1.56 0.00 0.00 0.00 178.15 179.68 3h6o h GLN 227 N 1.20 0.23 -0.73 2.37 4.20 -1.22 -2.62 115.11 118.54 3h6o h GLN 227 Ca 0.33 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.88 3h6o h GLN 227 Cb -0.13 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 3h6o h GLN 227 CO -0.07 0.66 0.32 -0.44 -0.67 0.00 0.00 178.83 178.62 3h6o h ASP 228 N -0.19 0.97 -0.25 1.46 3.32 -0.66 0.31 116.42 121.38 3h6o h ASP 228 Ca 0.01 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 3h6o h ASP 228 Cb 0.62 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 3h6o h ASP 228 CO 0.02 0.85 0.10 -0.07 -1.72 0.00 0.00 179.24 178.42 3h6o h LEU 229 N 1.05 0.34 -0.89 1.55 3.38 -0.67 0.15 115.31 120.21 3h6o h LEU 229 Ca 0.25 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3h6o h LEU 229 Cb 0.16 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3h6o h LEU 229 CO -0.03 0.42 0.10 0.11 0.09 0.00 0.00 178.44 179.13 3h6o h LYS 230 N 0.24 0.92 -1.00 1.13 6.56 -1.22 -1.24 116.57 121.96 3h6o h LYS 230 Ca 0.08 -0.22 0.01 0.00 -1.06 0.00 0.00 60.65 59.46 3h6o h LYS 230 Cb 0.18 -0.12 -0.05 0.00 -0.57 0.00 0.00 32.23 31.67 3h6o h LYS 230 CO -0.01 0.85 0.66 0.35 -2.06 0.00 0.00 179.45 179.24 3h6o h PHE 231 N 0.87 1.26 -0.41 -1.35 3.57 -0.78 -1.14 116.94 118.95 3h6o h PHE 231 Ca 0.18 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.78 3h6o h PHE 231 Cb 0.37 -0.42 -0.06 0.00 2.79 0.00 0.00 35.95 38.63 3h6o h PHE 231 CO 0.02 0.79 0.06 0.78 -2.23 0.00 0.00 178.31 177.73 3h6o h GLY 232 N 1.35 0.47 0.93 2.40 0.00 0.42 0.12 103.07 108.76 3h6o h GLY 232 Ca 0.37 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.69 3h6o h GLY 232 CO -0.08 -0.06 -0.03 -2.08 0.00 0.00 0.00 176.54 174.30 3h6o h VAL 233 N 0.19 1.00 -0.74 4.60 2.07 -0.99 -0.78 116.25 121.60 3h6o h VAL 233 Ca 0.20 -0.17 0.16 0.00 0.82 0.00 0.00 66.70 67.71 3h6o h VAL 233 Cb 0.26 1.11 -0.12 0.00 -1.52 0.00 0.00 31.29 31.02 3h6o h VAL 233 CO -0.28 0.04 0.12 -0.33 0.02 0.00 0.00 177.57 177.15 3h6o h GLU 234 N -0.15 0.20 0.00 1.57 5.08 -0.94 -0.81 114.58 119.52 3h6o h GLU 234 Ca -0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3h6o h GLU 234 Cb 0.13 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3h6o h GLU 234 CO 0.01 0.13 0.00 1.04 -1.00 0.00 0.00 179.01 179.20 3h6o n GLN 235 N -5.22 0.47 -3.48 2.33 1.13 0.41 -4.93 117.38 108.09 3h6o n GLN 235 Ca 0.14 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.99 3h6o n GLN 235 Cb 0.47 -1.50 0.08 0.00 0.11 0.00 0.00 30.24 29.40 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 -1.26 -4.96 -4.70 1.08 2.03 -0.31 -4.99 116.55 103.43 3h6o n ASP 236 Ca 0.15 -0.53 -0.31 0.00 0.52 0.00 0.00 54.79 54.62 3h6o n ASP 236 Cb 0.23 -4.78 0.14 0.00 -0.72 0.00 0.00 41.12 35.99 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 -3.31 2.38 -0.08 5.18 -7.23 -0.94 -4.97 120.40 111.43 3h6o s VAL 237 Ca 0.39 0.13 0.10 0.00 -1.81 0.00 0.00 61.98 60.80 3h6o s VAL 237 Cb -0.17 -2.32 -0.24 0.00 0.56 0.00 0.00 36.38 34.21 3h6o s VAL 237 CO 0.68 -0.15 0.52 0.47 -0.31 0.00 0.00 175.10 176.31 3h6o n ASP 238 N -3.90 0.97 -3.75 4.85 8.00 -0.24 -4.85 116.55 117.62 3h6o n ASP 238 Ca 0.11 0.32 -0.10 0.00 0.71 0.00 0.00 54.79 55.83 3h6o n ASP 238 Cb 0.52 -0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.51 3h6o n ASP 238 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h6o s MET 239 N -2.58 0.92 -0.12 -1.24 0.23 -1.18 -2.17 119.30 113.16 3h6o s MET 239 Ca -0.09 -0.78 0.02 0.00 -1.03 0.00 0.00 55.69 53.82 3h6o s MET 239 Cb 0.08 0.39 -0.00 0.00 -1.53 0.00 0.00 34.83 33.76 3h6o s MET 239 CO 0.81 -0.32 -0.20 0.08 -2.03 0.00 0.00 175.02 173.36 3h6o s VAL 240 N -3.58 2.39 -0.62 5.16 1.01 0.92 -1.64 120.40 124.04 3h6o s VAL 240 Ca 0.02 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 60.90 3h6o s VAL 240 Cb 0.03 -1.95 0.09 0.00 0.00 0.00 0.00 36.38 34.54 3h6o s VAL 240 CO -0.10 0.54 0.80 -0.36 0.00 0.00 0.00 175.10 175.99 3h6o s PHE 241 N 0.44 2.87 -0.40 5.22 0.08 -0.27 -0.40 117.98 125.53 3h6o s PHE 241 Ca -0.14 -0.81 -0.25 0.00 0.12 0.00 0.00 56.93 55.85 3h6o s PHE 241 Cb -0.17 -4.12 0.02 0.00 -0.57 0.00 0.00 43.02 38.18 3h6o s PHE 241 CO 0.06 -1.43 0.89 0.00 -0.10 0.00 0.00 175.22 174.65 3h6o s ALA 242 N 3.20 3.36 0.52 5.36 0.00 -0.19 -1.83 121.76 132.18 3h6o s ALA 242 Ca 0.15 -0.61 -0.21 0.00 0.00 0.00 0.00 51.96 51.29 3h6o s ALA 242 Cb -0.21 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.32 3h6o s ALA 242 CO 0.08 -1.73 1.24 -1.12 0.00 0.00 0.00 175.76 174.22 3h6o s SER 243 N 2.00 5.63 -1.28 0.00 0.01 -1.26 -1.41 113.70 117.39 3h6o s SER 243 Ca 0.36 2.47 -0.08 0.00 1.31 0.00 0.00 55.95 60.01 3h6o s SER 243 Cb -0.12 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.51 3h6o s SER 243 CO 0.21 -1.30 1.12 0.33 0.41 0.00 0.00 173.24 174.01 3h6o n PHE 244 N -0.95 -2.72 -2.51 2.43 -0.00 -1.23 -4.76 117.46 107.72 3h6o n PHE 244 Ca 0.10 0.96 -0.43 0.00 -0.00 0.00 0.00 57.45 58.09 3h6o n PHE 244 Cb 0.48 -4.83 -0.02 0.00 -0.00 0.00 0.00 39.48 35.10 3h6o n PHE 244 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 3h6o s ILE 245 N -3.30 4.38 -0.06 -2.13 -1.09 -0.90 -4.90 121.20 113.20 3h6o s ILE 245 Ca 0.54 1.69 0.01 0.00 -2.23 0.00 0.00 60.65 60.66 3h6o s ILE 245 Cb -0.24 -4.09 -0.02 0.00 -1.58 0.00 0.00 42.46 36.54 3h6o s ILE 245 CO 0.69 -0.04 0.06 0.54 -1.23 0.00 0.00 174.94 174.96 3h6o n ARG 246 N 5.51 5.68 -3.52 2.79 1.74 -1.26 -4.41 116.66 123.18 3h6o n ARG 246 Ca 0.11 -0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.09 3h6o n ARG 246 Cb 0.46 -0.63 -0.03 0.00 -1.02 0.00 0.00 32.46 31.24 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 -1.26 0.78 0.29 5.56 -2.85 -1.26 -4.15 119.74 116.84 3h6o s LYS 247 Ca 0.00 -0.15 0.02 0.00 -1.00 0.00 0.00 55.97 54.84 3h6o s LYS 247 Cb 0.01 0.36 0.71 0.00 -2.06 0.00 0.00 37.83 36.85 3h6o s LYS 247 CO 0.06 -0.31 1.63 0.00 0.10 0.00 0.00 175.35 176.82 3h6o h ALA 248 N 2.22 1.23 -0.46 0.59 0.00 -1.87 -1.27 119.26 119.69 3h6o h ALA 248 Ca -0.21 0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3h6o h ALA 248 Cb 1.21 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 3h6o h ALA 248 CO 0.31 -0.50 0.17 0.66 0.00 0.00 0.00 179.25 179.89 3h6o h SER 249 N 0.15 0.60 -0.68 0.00 4.64 -1.96 -1.50 113.55 114.80 3h6o h SER 249 Ca 0.55 -0.07 0.07 0.00 -0.47 0.00 0.00 61.79 61.88 3h6o h SER 249 Cb 1.13 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 63.00 3h6o h SER 249 CO -0.71 0.56 0.35 0.44 -0.87 0.00 0.00 176.83 176.60 3h6o h ASP 250 N 0.66 0.49 -0.62 4.97 3.32 -1.64 -1.01 116.42 122.59 3h6o h ASP 250 Ca 0.16 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.17 3h6o h ASP 250 Cb 0.15 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3h6o h ASP 250 CO -0.01 0.30 0.08 0.58 -1.72 0.00 0.00 179.24 178.46 3h6o h VAL 251 N 0.63 1.26 -0.69 -1.35 2.07 -1.30 -2.35 116.25 114.52 3h6o h VAL 251 Ca 0.32 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.74 3h6o h VAL 251 Cb 0.27 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3h6o h VAL 251 CO -0.22 0.39 0.23 0.45 0.02 0.00 0.00 177.57 178.44 3h6o h HIS 252 N 0.95 1.08 -0.35 1.57 3.86 -0.96 -0.53 115.15 120.77 3h6o h HIS 252 Ca 0.19 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 3h6o h HIS 252 Cb 0.46 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 3h6o h HIS 252 CO 0.03 0.85 0.08 0.93 0.86 0.00 0.00 177.93 180.69 3h6o h GLU 253 N 1.02 0.56 -0.67 2.45 5.08 -1.03 0.17 114.58 122.16 3h6o h GLU 253 Ca 0.23 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3h6o h GLU 253 Cb 0.26 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 3h6o h GLU 253 CO -0.01 0.61 0.41 0.28 -1.00 0.00 0.00 179.01 179.30 3h6o h VAL 254 N 0.41 1.05 -1.00 3.13 2.07 -1.19 -1.07 116.25 119.65 3h6o h VAL 254 Ca 0.11 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 67.38 3h6o h VAL 254 Cb 0.30 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 3h6o h VAL 254 CO 0.00 0.14 0.66 -0.09 0.02 0.00 0.00 177.57 178.31 3h6o h ARG 255 N 0.78 1.30 -0.32 1.57 9.65 -0.74 -2.33 114.38 124.30 3h6o h ARG 255 Ca 0.28 -0.08 -0.10 0.00 -1.10 0.00 0.00 59.98 58.98 3h6o h ARG 255 Cb 0.08 -0.29 -0.01 0.00 -1.39 0.00 0.00 29.97 28.35 3h6o h ARG 255 CO -0.13 0.86 -0.23 -0.22 2.80 0.00 0.00 179.97 183.05 3h6o h LYS 256 N 1.34 0.61 -0.32 0.20 1.63 0.01 -2.32 116.57 117.71 3h6o h LYS 256 Ca 0.37 -0.24 -0.09 0.00 -0.85 0.00 0.00 60.65 59.84 3h6o h LYS 256 Cb -0.13 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.46 3h6o h LYS 256 CO -0.09 0.80 -0.16 0.28 -3.45 0.00 0.00 179.45 176.83 3h6o h VAL 257 N 0.54 1.29 0.00 2.00 2.07 -0.97 -2.92 116.25 118.26 3h6o h VAL 257 Ca 0.08 -1.26 -0.05 0.00 0.82 0.00 0.00 66.70 66.29 3h6o h VAL 257 Cb 0.69 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3h6o h VAL 257 CO 0.05 0.41 -0.23 -0.07 0.02 0.00 0.00 177.57 177.75 3h6o h LEU 258 N 0.45 0.00 0.00 2.57 3.38 -1.40 -3.45 115.31 116.86 3h6o h LEU 258 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3h6o h LEU 258 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3h6o h LEU 258 CO 0.05 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.41 3h6o n GLY 259 N -0.59 -0.70 0.30 0.83 0.00 -0.88 -0.94 105.19 103.21 3h6o n GLY 259 Ca -0.02 -1.02 -0.08 0.00 0.00 0.00 0.00 46.02 44.90 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 0.99 -0.69 1.61 4.81 -1.89 -1.79 114.58 117.62 3h6o h GLU 260 Ca 0.00 -0.32 0.02 0.00 -0.13 0.00 0.00 59.36 58.94 3h6o h GLU 260 Cb 0.00 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 3h6o h GLU 260 CO 0.00 0.99 0.45 0.87 -0.73 0.00 0.00 179.01 180.59 3h6o h LYS 261 N 0.90 0.84 -0.58 1.92 6.56 -1.98 -2.49 116.57 121.73 3h6o h LYS 261 Ca 0.16 -0.05 -0.24 0.00 -1.06 0.00 0.00 60.65 59.45 3h6o h LYS 261 Cb 0.57 -0.19 -0.15 0.00 -0.57 0.00 0.00 32.23 31.90 3h6o h LYS 261 CO 0.03 0.55 0.19 0.41 -2.06 0.00 0.00 179.45 178.57 3h6o n GLY 262 N -1.44 4.43 0.29 3.86 0.00 -0.12 -4.71 105.19 107.50 3h6o n GLY 262 Ca 0.08 -1.12 0.16 0.00 0.00 0.00 0.00 46.02 45.14 3h6o n GLY 262 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3h6o h LYS 263 N 1.46 0.00 -0.02 1.61 2.10 -0.85 -2.56 116.57 118.30 3h6o h LYS 263 Ca 0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 3h6o h LYS 263 Cb 2.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.40 3h6o h LYS 263 CO 0.61 0.06 -0.19 0.09 -2.00 0.00 0.00 179.45 178.02 3h6o n ASN 264 N -3.43 2.38 -4.69 7.07 3.02 -1.26 -4.90 115.26 113.44 3h6o n ASN 264 Ca -0.02 -1.70 -0.42 0.00 -0.03 0.00 0.00 54.58 52.40 3h6o n ASN 264 Cb 0.19 0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 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 -2.21 4.63 0.12 2.41 1.01 -0.97 -4.98 121.20 121.21 3h6o s ILE 265 Ca 0.25 1.91 -0.30 0.00 0.00 0.00 0.00 60.65 62.51 3h6o s ILE 265 Cb 0.19 -4.23 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 3h6o s ILE 265 CO 0.42 0.00 1.02 -0.54 0.00 0.00 0.00 174.94 175.84 3h6o s LYS 266 N 2.07 4.64 -0.42 2.79 -0.14 -0.92 -4.83 119.74 122.93 3h6o s LYS 266 Ca 0.50 1.55 -0.13 0.00 -1.36 0.00 0.00 55.97 56.54 3h6o s LYS 266 Cb -0.20 -3.35 0.05 0.00 -1.68 0.00 0.00 37.83 32.65 3h6o s LYS 266 CO 0.19 0.13 0.30 0.42 -0.76 0.00 0.00 175.35 175.63 3h6o s ILE 267 N 0.04 4.90 -0.37 2.17 1.01 -1.26 -0.05 121.20 127.64 3h6o s ILE 267 Ca 0.49 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 3h6o s ILE 267 Cb -0.25 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3h6o s ILE 267 CO 0.31 -0.40 0.44 -0.63 0.00 0.00 0.00 174.94 174.66 3h6o s ILE 268 N 1.59 5.08 -0.01 2.92 -1.09 0.47 -1.05 121.20 129.11 3h6o s ILE 268 Ca 0.04 0.06 -0.26 0.00 -2.23 0.00 0.00 60.65 58.25 3h6o s ILE 268 Cb -0.21 -3.94 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 3h6o s ILE 268 CO 0.07 -0.23 0.82 -0.44 -1.23 0.00 0.00 174.94 173.92 3h6o s SER 269 N 1.77 7.18 -0.23 3.58 0.01 -0.64 -1.02 113.70 124.35 3h6o s SER 269 Ca 0.15 1.42 -0.20 0.00 1.31 0.00 0.00 55.95 58.63 3h6o s SER 269 Cb -0.16 -2.48 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 3h6o s SER 269 CO 0.13 -0.14 0.61 -0.54 0.41 0.00 0.00 173.24 173.72 3h6o s LYS 270 N 0.66 4.15 -0.39 12.44 1.02 -0.50 -0.96 119.74 136.16 3h6o s LYS 270 Ca 0.43 0.55 -0.17 0.00 0.02 0.00 0.00 55.97 56.80 3h6o s LYS 270 Cb -0.20 -3.62 0.01 0.00 -0.52 0.00 0.00 37.83 33.51 3h6o s LYS 270 CO 0.23 -0.33 0.41 0.42 -0.92 0.00 0.00 175.35 175.16 3h6o s ILE 271 N 2.23 5.11 0.00 2.17 -1.09 -0.92 -2.12 121.20 126.58 3h6o s ILE 271 Ca 0.27 -0.21 0.00 0.00 -2.23 0.00 0.00 60.65 58.47 3h6o s ILE 271 Cb -0.16 -3.97 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 3h6o s ILE 271 CO 0.09 -0.31 0.11 -0.62 -1.23 0.00 0.00 174.94 172.97 3h6o n GLU 272 N 5.53 2.06 -4.07 2.79 1.02 -1.26 -2.73 120.64 123.99 3h6o n GLU 272 Ca -0.08 -0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 56.83 3h6o n GLU 272 Cb 0.48 -0.46 -0.05 0.00 -0.02 0.00 0.00 31.44 31.39 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 -0.32 0.46 0.22 1.62 4.22 -1.26 -3.23 114.94 116.64 3h6o s ASN 273 Ca 0.00 -1.28 -0.08 0.00 -2.14 0.00 0.00 52.86 49.36 3h6o s ASN 273 Cb 0.00 0.61 0.28 0.00 1.28 0.00 0.00 41.25 43.41 3h6o s ASN 273 CO 0.00 -1.19 1.80 -0.74 -2.04 0.00 0.00 177.10 174.92 3h6o h HIS 274 N 2.22 0.68 -0.89 1.54 -0.00 -1.92 -2.79 115.15 113.99 3h6o h HIS 274 Ca -0.29 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.12 3h6o h HIS 274 Cb 1.24 -0.20 -0.04 0.00 -0.00 0.00 0.00 27.41 28.41 3h6o h HIS 274 CO 0.97 0.30 0.59 1.49 -0.00 0.00 0.00 177.93 181.28 3h6o h GLU 275 N 0.67 1.16 -0.13 5.26 4.81 -1.91 -1.13 114.58 123.31 3h6o h GLU 275 Ca 0.32 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.35 3h6o h GLU 275 Cb 0.25 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3h6o h GLU 275 CO -0.21 0.77 -0.46 0.78 -0.73 0.00 0.00 179.01 179.16 3h6o h GLY 276 N 1.20 0.35 0.59 1.92 0.00 -1.66 -1.13 103.07 104.34 3h6o h GLY 276 Ca 0.33 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 3h6o h GLY 276 CO -0.07 0.33 -0.01 -2.08 0.00 0.00 0.00 176.54 174.70 3h6o h VAL 277 N 0.26 1.34 -0.42 4.60 2.07 -1.24 -1.26 116.25 121.61 3h6o h VAL 277 Ca 0.02 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 3h6o h VAL 277 Cb 0.92 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 3h6o h VAL 277 CO 0.08 0.27 0.22 0.03 0.02 0.00 0.00 177.57 178.19 3h6o h ARG 278 N -0.38 0.57 -0.52 1.57 3.08 -1.15 -2.27 114.38 115.27 3h6o h ARG 278 Ca 0.00 -0.06 -0.19 0.00 0.07 0.00 0.00 59.98 59.81 3h6o h ARG 278 Cb 0.45 -0.12 -0.12 0.00 0.08 0.00 0.00 29.97 30.27 3h6o h ARG 278 CO 0.00 0.43 0.14 0.54 -1.07 0.00 0.00 179.97 180.01 3h6o n ARG 279 N -4.42 2.66 -0.30 0.04 1.74 -0.44 -4.74 116.66 111.21 3h6o n ARG 279 Ca 0.03 -3.05 0.06 0.00 -0.77 0.00 0.00 57.85 54.12 3h6o n ARG 279 Cb 0.10 -1.98 0.21 0.00 -1.02 0.00 0.00 32.46 29.78 3h6o n ARG 279 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3h6o h PHE 280 N 1.63 0.81 0.37 -1.55 3.57 -0.60 -2.69 116.94 118.48 3h6o h PHE 280 Ca 0.24 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3h6o h PHE 280 Cb 1.96 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 40.47 3h6o h PHE 280 CO 1.05 0.23 -0.18 -0.44 -2.23 0.00 0.00 178.31 176.74 3h6o h ASP 281 N 0.68 -0.42 -0.98 0.41 3.32 -1.85 0.35 116.42 117.94 3h6o h ASP 281 Ca 0.45 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.52 3h6o h ASP 281 Cb 0.58 0.11 -0.06 0.00 0.22 0.00 0.00 39.33 40.18 3h6o h ASP 281 CO -0.33 -0.24 0.64 1.05 -1.72 0.00 0.00 179.24 178.64 3h6o h GLU 282 N -0.57 1.16 -0.40 3.56 4.11 -1.93 -1.83 114.58 118.69 3h6o h GLU 282 Ca -0.05 -0.07 -0.02 0.00 0.07 0.00 0.00 59.36 59.29 3h6o h GLU 282 Cb 0.43 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3h6o h GLU 282 CO 0.08 0.77 0.16 0.82 0.07 0.00 0.00 179.01 180.91 3h6o h ILE 283 N 1.20 1.20 -0.57 -1.06 2.04 -1.11 -3.01 117.51 116.21 3h6o h ILE 283 Ca 0.40 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.69 3h6o h ILE 283 Cb 0.08 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 3h6o h ILE 283 CO -0.14 0.22 0.32 0.25 0.00 0.00 0.00 178.15 178.80 3h6o h LEU 284 N 0.50 0.50 -1.38 1.44 5.85 0.08 -2.17 115.31 120.13 3h6o h LEU 284 Ca 0.13 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 3h6o h LEU 284 Cb 0.20 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 3h6o h LEU 284 CO -0.01 0.35 0.16 -0.08 -0.34 0.00 0.00 178.44 178.52 3h6o h GLU 285 N 0.63 0.58 0.00 1.25 4.22 -1.26 -2.84 114.58 117.15 3h6o h GLU 285 Ca 0.24 -0.08 -0.11 0.00 0.08 0.00 0.00 59.36 59.49 3h6o h GLU 285 Cb 0.08 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3h6o h GLU 285 CO -0.13 0.49 -0.89 0.00 -2.18 0.00 0.00 179.01 176.29 3h6o h ALA 286 N 1.60 0.66 -2.17 2.92 0.00 -1.38 -3.47 119.26 117.43 3h6o h ALA 286 Ca 0.14 -0.52 -0.47 0.00 0.00 0.00 0.00 54.91 54.07 3h6o h ALA 286 Cb 0.12 0.08 0.05 0.00 0.00 0.00 0.00 17.79 18.04 3h6o h ALA 286 CO -0.01 0.61 0.06 -1.12 0.00 0.00 0.00 179.25 178.79 3h6o s SER 287 N -6.02 5.63 0.00 0.00 0.01 -0.83 -4.93 113.70 107.55 3h6o s SER 287 Ca 0.01 0.48 0.26 0.00 1.31 0.00 0.00 55.95 58.01 3h6o s SER 287 Cb 0.08 -1.55 0.62 0.00 0.21 0.00 0.00 66.02 65.39 3h6o s SER 287 CO 0.77 -0.95 1.48 0.47 0.41 0.00 0.00 173.24 175.42 3h6o n ASP 288 N -2.39 0.88 0.00 2.44 8.00 -0.21 -4.95 116.55 120.31 3h6o n ASP 288 Ca 0.04 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.84 3h6o n ASP 288 Cb 0.58 0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 3h6o n ASP 288 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3h6o n GLY 289 N 1.40 -0.76 2.92 0.44 0.00 -1.15 -4.11 105.19 103.93 3h6o n GLY 289 Ca 0.10 -1.12 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.00 0.25 -0.21 -0.61 -1.09 -0.46 -1.62 121.20 115.46 3h6o s ILE 290 Ca 0.00 -0.12 -0.06 0.00 -2.23 0.00 0.00 60.65 58.24 3h6o s ILE 290 Cb 0.00 -0.22 -0.03 0.00 -1.58 0.00 0.00 42.46 40.63 3h6o s ILE 290 CO 0.00 0.08 0.03 -0.32 -1.23 0.00 0.00 174.94 173.50 3h6o s MET 291 N -0.00 3.71 -0.90 2.79 -2.45 -0.13 0.23 119.30 122.54 3h6o s MET 291 Ca 0.00 -0.47 -0.25 0.00 -1.25 0.00 0.00 55.69 53.73 3h6o s MET 291 Cb -0.02 -3.17 0.04 0.00 1.25 0.00 0.00 34.83 32.93 3h6o s MET 291 CO -0.00 0.03 1.40 0.08 1.05 0.00 0.00 175.02 177.57 3h6o s VAL 292 N 1.00 3.83 -1.33 10.11 1.01 0.64 -2.17 120.40 133.49 3h6o s VAL 292 Ca 0.03 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 3h6o s VAL 292 Cb -0.14 -4.97 0.12 0.00 0.00 0.00 0.00 36.38 31.38 3h6o s VAL 292 CO 0.02 -1.88 1.93 0.00 0.00 0.00 0.00 175.10 175.17 3h6o n ALA 293 N 9.21 5.09 0.12 5.51 0.00 -1.11 -2.96 120.51 136.37 3h6o n ALA 293 Ca 0.21 -4.12 0.05 0.00 0.00 0.00 0.00 53.44 49.58 3h6o n ALA 293 Cb 0.50 -3.23 0.48 0.00 0.00 0.00 0.00 19.45 17.19 3h6o n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6o h ARG 294 N 6.16 0.28 0.16 0.00 3.08 -1.83 -1.82 114.38 120.41 3h6o h ARG 294 Ca 0.45 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.46 3h6o h ARG 294 Cb 0.68 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 3h6o h ARG 294 CO 1.66 0.26 -0.13 0.78 -1.07 0.00 0.00 179.97 181.46 3h6o h GLY 295 N 0.45 -0.73 1.85 0.04 0.00 -1.85 -0.40 103.07 102.43 3h6o h GLY 295 Ca 0.07 0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.62 3h6o h GLY 295 CO -0.01 -0.26 -0.41 -0.55 0.00 0.00 0.00 176.54 175.32 3h6o h ASP 296 N -0.28 0.17 -0.69 0.19 3.32 -1.86 -2.73 116.42 114.55 3h6o h ASP 296 Ca -0.02 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 3h6o h ASP 296 Cb 0.24 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 3h6o h ASP 296 CO 0.00 0.57 0.34 0.25 -1.72 0.00 0.00 179.24 178.68 3h6o h LEU 297 N 0.14 0.91 0.00 1.55 5.85 -1.29 -2.04 115.31 120.42 3h6o h LEU 297 Ca 0.01 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3h6o h LEU 297 Cb 0.79 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3h6o h LEU 297 CO 0.06 0.76 0.00 0.61 -0.34 0.00 0.00 178.44 179.53 3h6o n GLY 298 N -1.11 -1.08 0.13 3.75 0.00 -0.17 -0.01 105.19 106.72 3h6o n GLY 298 Ca 0.07 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 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 0.69 -0.12 -0.61 2.04 -1.35 -3.38 117.51 114.78 3h6o h ILE 299 Ca 0.00 -2.33 -0.06 0.00 1.00 0.00 0.00 64.86 63.47 3h6o h ILE 299 Cb 0.20 2.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.77 3h6o h ILE 299 CO 0.00 0.81 -0.17 -0.33 0.00 0.00 0.00 178.15 178.46 3h6o h GLU 300 N -0.09 0.34 -6.26 2.37 4.39 -1.14 -3.46 114.58 110.73 3h6o h GLU 300 Ca -0.41 -0.20 -0.60 0.00 0.34 0.00 0.00 59.36 58.50 3h6o h GLU 300 Cb 1.93 0.02 -0.09 0.00 -0.10 0.00 0.00 28.75 30.50 3h6o h GLU 300 CO 0.05 0.77 -0.61 0.96 -1.16 0.00 0.00 179.01 179.02 3h6o s ILE 301 N -4.16 4.15 0.16 3.13 -4.36 0.99 -4.70 121.20 116.42 3h6o s ILE 301 Ca -0.14 -1.19 -0.33 0.00 -0.26 0.00 0.00 60.65 58.72 3h6o s ILE 301 Cb 0.05 -3.09 -0.15 0.00 1.25 0.00 0.00 42.46 40.51 3h6o s ILE 301 CO 0.75 -0.08 1.27 -2.65 0.24 0.00 0.00 174.94 174.47 3h6o n PRO 302 N -0.13 1.36 -0.12 0.37 -0.02 -1.26 -4.42 135.00 130.77 3h6o n PRO 302 Ca -0.09 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 61.99 3h6o n PRO 302 Cb 0.54 -2.06 0.47 0.00 -0.02 0.00 0.00 33.50 32.43 3h6o n PRO 302 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h6o h ALA 303 N 3.93 1.96 0.00 3.55 0.00 -1.93 -0.84 119.26 125.94 3h6o h ALA 303 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3h6o h ALA 303 Cb 1.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3h6o h ALA 303 CO 0.74 -0.11 0.00 -0.85 0.00 0.00 0.00 179.25 179.03 3h6o n GLU 304 N -4.48 0.07 0.00 0.00 0.00 -1.26 -2.62 120.64 112.35 3h6o n GLU 304 Ca 0.11 0.37 0.11 0.00 0.00 0.00 0.00 57.16 57.76 3h6o n GLU 304 Cb 0.38 -1.65 0.03 0.00 0.00 0.00 0.00 31.44 30.19 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 -1.79 1.16 -0.16 3.44 5.02 -0.32 -4.54 118.16 120.98 3h6o n LYS 305 Ca 0.02 -0.94 -0.05 0.00 -2.02 0.00 0.00 58.31 55.32 3h6o n LYS 305 Cb 0.15 -1.48 0.13 0.00 -0.02 0.00 0.00 35.03 33.81 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 2.30 1.25 -0.07 -0.18 2.07 -1.58 -2.28 116.25 117.76 3h6o h VAL 306 Ca 0.00 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 3h6o h VAL 306 Cb 0.73 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3h6o h VAL 306 CO 0.00 0.35 -0.06 2.19 0.02 0.00 0.00 177.57 180.08 3h6o h PHE 307 N 0.86 0.09 -0.24 1.57 -5.15 -1.80 0.35 116.94 112.62 3h6o h PHE 307 Ca 0.17 -0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.89 3h6o h PHE 307 Cb 0.40 -0.03 -0.01 0.00 0.22 0.00 0.00 35.95 36.53 3h6o h PHE 307 CO 0.02 0.15 -0.04 -0.07 -2.00 0.00 0.00 178.31 176.38 3h6o h LEU 308 N 0.09 0.46 -0.70 2.10 3.38 -1.72 -1.84 115.31 117.07 3h6o h LEU 308 Ca 0.02 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 3h6o h LEU 308 Cb 0.16 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3h6o h LEU 308 CO 0.01 0.70 0.33 0.00 0.09 0.00 0.00 178.44 179.57 3h6o h ALA 309 N 0.77 0.91 -0.10 1.53 0.00 -1.04 -0.39 119.26 120.94 3h6o h ALA 309 Ca 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 309 Cb 0.49 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3h6o h ALA 309 CO 0.02 0.48 0.02 0.37 0.00 0.00 0.00 179.25 180.13 3h6o h GLN 310 N 0.98 0.16 -0.56 0.00 4.15 -0.96 -1.50 115.11 117.38 3h6o h GLN 310 Ca 0.24 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.54 3h6o h GLN 310 Cb 0.12 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.77 3h6o h GLN 310 CO -0.03 0.36 0.03 0.87 -1.93 0.00 0.00 178.83 178.13 3h6o h LYS 311 N -0.07 0.97 -0.78 1.69 1.57 -1.24 -0.61 116.57 118.11 3h6o h LYS 311 Ca 0.03 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3h6o h LYS 311 Cb 0.28 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 3h6o h LYS 311 CO 0.00 0.96 0.52 1.98 -0.57 0.00 0.00 179.45 182.34 3h6o h MET 312 N 0.86 1.03 -0.04 3.15 4.05 -1.04 -0.83 114.93 122.10 3h6o h MET 312 Ca 0.16 -0.06 -0.16 0.00 -0.28 0.00 0.00 59.70 59.36 3h6o h MET 312 Cb 0.50 -0.23 0.01 0.00 -0.80 0.00 0.00 31.60 31.08 3h6o h MET 312 CO 0.02 0.68 -0.62 0.52 0.23 0.00 0.00 176.91 177.74 3h6o h MET 313 N 1.06 0.49 -0.32 0.39 2.86 -1.05 -2.05 114.93 116.30 3h6o h MET 313 Ca 0.29 -0.47 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 3h6o h MET 313 Cb -0.12 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 3h6o h MET 313 CO -0.06 1.11 0.20 0.82 1.06 0.00 0.00 176.91 180.04 3h6o h ILE 314 N 0.05 1.10 -0.29 -1.22 2.04 -1.06 -0.87 117.51 117.27 3h6o h ILE 314 Ca -0.07 -0.22 0.05 0.00 1.00 0.00 0.00 64.86 65.62 3h6o h ILE 314 Cb 1.30 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 38.01 3h6o h ILE 314 CO 0.12 0.10 0.02 1.23 0.00 0.00 0.00 178.15 179.63 3h6o h GLY 315 N 0.42 0.30 1.88 5.37 0.00 -1.15 0.24 103.07 110.13 3h6o h GLY 315 Ca 0.12 0.01 -0.10 0.00 0.00 0.00 0.00 47.33 47.36 3h6o h GLY 315 CO -0.02 -0.04 -0.42 3.21 0.00 0.00 0.00 176.54 179.27 3h6o h ARG 316 N 0.12 0.13 -0.17 4.80 3.08 -1.26 -0.09 114.38 121.00 3h6o h ARG 316 Ca 0.14 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 3h6o h ARG 316 Cb 0.17 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 3h6o h ARG 316 CO -0.21 0.53 -0.23 0.00 -1.07 0.00 0.00 179.97 179.00 3h6o h ASN 318 N 0.10 0.80 -0.23 0.00 -0.26 -0.36 0.49 115.58 116.11 3h6o h ASN 318 Ca 0.02 0.04 -0.12 0.00 -0.56 0.00 0.00 56.30 55.69 3h6o h ASN 318 Cb 0.79 -0.12 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 3h6o h ASN 318 CO 0.05 0.45 -0.26 -0.09 -1.06 0.00 0.00 177.43 176.53 3h6o h ARG 319 N 0.90 0.71 0.00 0.81 2.43 -0.87 -2.95 114.38 115.41 3h6o h ARG 319 Ca 0.43 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3h6o h ARG 319 Cb 0.38 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3h6o h ARG 319 CO -0.24 0.89 -0.29 0.00 -1.51 0.00 0.00 179.97 178.82 3h6o h ALA 320 N 1.10 0.83 -0.54 2.80 0.00 -0.59 -3.48 119.26 119.38 3h6o h ALA 320 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3h6o h ALA 320 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3h6o h ALA 320 CO 0.06 0.00 -0.11 0.41 0.00 0.00 0.00 179.25 179.61 3h6o n GLY 321 N 1.24 0.32 3.64 0.00 0.00 0.16 -5.05 105.19 105.50 3h6o n GLY 321 Ca 0.04 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 3h6o n GLY 321 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6o s LYS 322 N -3.76 2.84 0.40 1.61 1.02 -0.79 -4.94 119.74 116.12 3h6o s LYS 322 Ca 0.00 -0.51 -0.27 0.00 0.02 0.00 0.00 55.97 55.21 3h6o s LYS 322 Cb 0.00 -2.68 -0.10 0.00 -0.52 0.00 0.00 37.83 34.53 3h6o s LYS 322 CO 0.00 0.67 1.43 -2.30 -0.92 0.00 0.00 175.35 174.24 3h6o n PRO 323 N 2.03 2.43 -4.55 -1.68 -0.02 -1.26 -4.42 135.00 127.53 3h6o n PRO 323 Ca -0.18 0.86 -0.22 0.00 -2.02 0.00 0.00 63.50 61.94 3h6o n PRO 323 Cb 0.53 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.25 3h6o n PRO 323 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h6o s VAL 324 N -1.15 1.01 -0.16 -1.45 0.11 -1.26 -1.35 120.40 116.15 3h6o s VAL 324 Ca 0.56 -0.49 -0.04 0.00 -2.93 0.00 0.00 61.98 59.08 3h6o s VAL 324 Cb -0.48 -0.88 -0.03 0.00 -1.53 0.00 0.00 36.38 33.46 3h6o s VAL 324 CO 0.61 0.30 -0.02 -0.63 -3.33 0.00 0.00 175.10 172.03 3h6o s ILE 325 N 0.11 3.99 -0.12 7.04 1.01 0.14 -1.43 121.20 131.95 3h6o s ILE 325 Ca -0.03 -0.32 -0.15 0.00 0.00 0.00 0.00 60.65 60.16 3h6o s ILE 325 Cb -0.09 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 3h6o s ILE 325 CO 0.01 0.49 0.35 0.00 0.00 0.00 0.00 174.94 175.78 3h6o s ALA 327 N 0.12 0.01 0.00 0.00 0.00 -1.15 -2.17 121.76 118.56 3h6o s ALA 327 Ca 0.20 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.65 3h6o s ALA 327 Cb -0.14 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.14 3h6o s ALA 327 CO 0.07 -0.21 0.00 2.41 0.00 0.00 0.00 175.76 178.04 3h6o n THR 328 N 1.36 -1.12 -1.82 0.00 -1.04 -1.26 -3.75 114.28 106.64 3h6o n THR 328 Ca -0.22 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.68 3h6o n THR 328 Cb 0.56 -1.45 -0.02 0.00 -1.82 0.00 0.00 70.33 67.59 3h6o n THR 328 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h6o n GLN 329 N 1.32 -0.79 -0.08 -2.82 6.02 -1.26 -4.72 117.38 115.04 3h6o n GLN 329 Ca 0.00 0.66 -0.13 0.00 -0.01 0.00 0.00 57.00 57.51 3h6o n GLN 329 Cb 0.00 -4.68 -0.05 0.00 1.02 0.00 0.00 30.24 26.53 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 0.66 -0.58 -1.09 2.86 -1.88 -3.30 114.93 111.60 3h6o h MET 330 Ca -0.23 -0.36 -0.41 0.00 -2.06 0.00 0.00 59.70 56.63 3h6o h MET 330 Cb 0.97 0.02 -0.38 0.00 0.06 0.00 0.00 31.60 32.27 3h6o h MET 330 CO 0.30 0.97 -0.86 1.28 1.06 0.00 0.00 176.91 179.66 3h6o n LEU 331 N -4.28 3.82 -0.32 1.22 4.77 -1.26 -4.60 117.00 116.34 3h6o n LEU 331 Ca -0.04 -4.18 0.19 0.00 -0.03 0.00 0.00 56.01 51.94 3h6o n LEU 331 Cb 0.47 -0.16 0.39 0.00 -2.33 0.00 0.00 43.42 41.79 3h6o n LEU 331 CO 0.44 1.74 1.04 -0.08 -1.33 0.00 0.00 177.39 179.21 3h6o h GLU 332 N 2.12 0.28 0.00 3.23 4.57 -1.98 0.25 114.58 123.05 3h6o h GLU 332 Ca 0.20 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 3h6o h GLU 332 Cb 1.44 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.96 3h6o h GLU 332 CO 0.53 0.18 -0.06 0.66 -1.18 0.00 0.00 179.01 179.15 3h6o h SER 333 N 0.29 0.00 0.00 1.04 4.64 -1.92 -2.59 113.55 115.01 3h6o h SER 333 Ca 0.65 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 3h6o h SER 333 Cb 1.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 3h6o h SER 333 CO -0.62 0.06 0.00 0.23 -0.87 0.00 0.00 176.83 175.62 3h6o n MET 334 N -3.25 0.77 -0.18 4.77 2.81 0.08 -0.33 117.12 121.79 3h6o n MET 334 Ca -0.01 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.81 3h6o n MET 334 Cb 0.26 -1.46 0.02 0.00 -0.71 0.00 0.00 33.22 31.33 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 1.14 0.00 2.02 2.04 -1.62 -3.29 117.51 117.80 3h6o h ILE 335 Ca 0.00 -0.29 -0.24 0.00 1.00 0.00 0.00 64.86 65.33 3h6o h ILE 335 Cb 0.00 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 3h6o h ILE 335 CO 0.00 0.14 -1.92 0.29 0.00 0.00 0.00 178.15 176.67 3h6o n LYS 336 N -4.71 1.59 -4.21 2.37 4.76 -0.73 -0.91 118.16 116.33 3h6o n LYS 336 Ca 0.03 0.01 -0.33 0.00 -2.87 0.00 0.00 58.31 55.15 3h6o n LYS 336 Cb 0.03 -1.34 -0.08 0.00 -1.84 0.00 0.00 35.03 31.80 3h6o n LYS 336 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3h6o s LYS 337 N -2.32 2.87 0.55 1.97 1.02 0.55 -4.93 119.74 119.46 3h6o s LYS 337 Ca -0.09 -0.58 0.34 0.00 0.02 0.00 0.00 55.97 55.66 3h6o s LYS 337 Cb 0.04 -2.73 1.41 0.00 -0.52 0.00 0.00 37.83 36.04 3h6o s LYS 337 CO 0.51 0.63 2.00 -1.00 -0.92 0.00 0.00 175.35 176.57 3h6o h PRO 338 N 4.21 0.00 -6.39 -1.68 0.13 -1.86 -3.34 132.00 123.06 3h6o h PRO 338 Ca -0.49 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.02 3h6o h PRO 338 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.06 3h6o h PRO 338 CO 0.59 0.01 -0.85 1.03 -0.23 0.00 0.00 178.00 178.55 3h6o s ARG 339 N -3.70 1.42 0.81 0.86 0.52 -1.26 -4.88 118.95 112.71 3h6o s ARG 339 Ca 0.01 -1.10 -0.10 0.00 -0.52 0.00 0.00 55.73 54.02 3h6o s ARG 339 Cb 0.09 -1.65 0.11 0.00 0.52 0.00 0.00 34.95 34.03 3h6o s ARG 339 CO 0.54 0.41 1.14 -1.25 0.02 0.00 0.00 175.30 176.16 3h6o s PRO 340 N -1.51 1.63 0.72 3.54 0.04 -1.26 -4.59 135.00 133.57 3h6o s PRO 340 Ca 0.09 -0.32 -0.08 0.00 0.04 0.00 0.00 61.00 60.74 3h6o s PRO 340 Cb -0.10 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.46 3h6o s PRO 340 CO 0.03 -1.69 1.05 0.95 0.04 0.00 0.00 177.00 177.38 3h6o s THR 341 N -3.50 2.35 0.26 1.26 -4.23 -1.26 -4.95 115.64 105.57 3h6o s THR 341 Ca 0.65 -0.16 0.03 0.00 -1.18 0.00 0.00 61.69 61.04 3h6o s THR 341 Cb -0.08 -3.05 0.01 0.00 1.34 0.00 0.00 72.50 70.71 3h6o s THR 341 CO 0.48 -0.06 1.63 0.03 -0.54 0.00 0.00 174.62 176.17 3h6o h ARG 342 N -0.68 0.36 0.00 3.99 2.47 -2.00 -2.48 114.38 116.04 3h6o h ARG 342 Ca -0.45 -0.19 -0.07 0.00 -1.26 0.00 0.00 59.98 58.01 3h6o h ARG 342 Cb 1.31 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 3h6o h ARG 342 CO 0.62 0.74 -0.35 0.00 0.56 0.00 0.00 179.97 181.53 3h6o h ALA 343 N 1.24 1.31 0.21 0.04 0.00 -1.98 -1.96 119.26 118.12 3h6o h ALA 343 Ca 0.02 -0.32 -0.29 0.00 0.00 0.00 0.00 54.91 54.32 3h6o h ALA 343 Cb 0.91 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.67 3h6o h ALA 343 CO 0.08 0.44 -1.30 0.93 0.00 0.00 0.00 179.25 179.39 3h6o h GLU 344 N 0.00 0.44 -0.77 0.00 5.08 -1.77 -1.28 114.58 116.28 3h6o h GLU 344 Ca -0.00 -0.76 -0.05 0.00 -1.00 0.00 0.00 59.36 57.54 3h6o h GLU 344 Cb 0.67 0.28 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 3h6o h GLU 344 CO 0.05 1.36 0.27 0.78 -1.00 0.00 0.00 179.01 180.47 3h6o h GLY 345 N 0.03 1.27 0.93 -3.84 0.00 -1.46 -2.22 103.07 97.78 3h6o h GLY 345 Ca -0.23 -0.73 0.01 0.00 0.00 0.00 0.00 47.33 46.38 3h6o h GLY 345 CO 0.22 0.68 0.27 0.23 0.00 0.00 0.00 176.54 177.94 3h6o h SER 346 N 1.14 0.45 -0.58 0.19 0.87 -1.41 -2.45 113.55 111.77 3h6o h SER 346 Ca 0.25 -0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.83 3h6o h SER 346 Cb 0.27 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 3h6o h SER 346 CO -0.01 0.32 0.37 -0.78 -0.53 0.00 0.00 176.83 176.20 3h6o h ASP 347 N 0.55 0.61 -0.44 6.23 3.58 -0.93 -0.14 116.42 125.89 3h6o h ASP 347 Ca 0.17 -0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.56 3h6o h ASP 347 Cb -0.01 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.88 3h6o h ASP 347 CO -0.07 0.44 0.05 0.58 -2.88 0.00 0.00 179.24 177.36 3h6o h VAL 348 N 0.73 1.25 -0.21 2.25 2.07 -1.36 -2.16 116.25 118.83 3h6o h VAL 348 Ca 0.22 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.83 3h6o h VAL 348 Cb -0.03 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3h6o h VAL 348 CO -0.07 0.33 0.02 0.00 0.02 0.00 0.00 177.57 177.86 3h6o h ALA 349 N 0.93 0.19 -0.01 1.67 0.00 -1.14 -2.87 119.26 118.02 3h6o h ALA 349 Ca 0.13 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3h6o h ALA 349 Cb 0.42 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3h6o h ALA 349 CO 0.01 -0.41 -0.43 -0.91 0.00 0.00 0.00 179.25 177.51 3h6o h ASN 350 N 0.09 0.03 -0.73 0.00 2.35 -0.97 -0.88 115.58 115.48 3h6o h ASN 350 Ca 0.09 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 3h6o h ASN 350 Cb 0.11 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 3h6o h ASN 350 CO -0.14 0.46 0.28 0.00 -1.65 0.00 0.00 177.43 176.37 3h6o h ALA 351 N 1.55 1.09 -0.04 -0.83 0.00 -1.24 0.24 119.26 120.02 3h6o h ALA 351 Ca -0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3h6o h ALA 351 Cb 0.77 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3h6o h ALA 351 CO 0.06 0.64 -0.04 0.28 0.00 0.00 0.00 179.25 180.19 3h6o h VAL 352 N 1.08 1.36 -0.98 0.00 2.07 -1.23 -1.12 116.25 117.43 3h6o h VAL 352 Ca 0.25 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.69 3h6o h VAL 352 Cb 0.23 2.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.97 3h6o h VAL 352 CO -0.02 0.31 0.64 -0.07 0.02 0.00 0.00 177.57 178.45 3h6o h LEU 353 N -0.33 1.00 -1.36 2.57 3.38 -1.03 -0.79 115.31 118.75 3h6o h LEU 353 Ca 0.01 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.05 3h6o h LEU 353 Cb 0.52 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3h6o h LEU 353 CO 0.01 0.63 0.48 0.44 0.09 0.00 0.00 178.44 180.09 3h6o h ASP 354 N 1.12 0.69 0.00 -0.43 3.32 -0.44 -3.47 116.42 117.21 3h6o h ASP 354 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 3h6o h ASP 354 Cb 0.21 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3h6o h ASP 354 CO -0.18 0.45 0.00 0.61 -1.72 0.00 0.00 179.24 178.40 3h6o n GLY 355 N -1.44 1.94 3.72 2.75 0.00 -0.30 -4.68 105.19 107.18 3h6o n GLY 355 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 3.53 0.23 4.61 0.00 -0.46 -4.88 121.76 122.80 3h6o s ALA 356 Ca 0.00 1.04 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 3h6o s ALA 356 Cb 0.00 -3.51 0.25 0.00 0.00 0.00 0.00 23.12 19.87 3h6o s ALA 356 CO 0.00 -0.56 1.66 -0.44 0.00 0.00 0.00 175.76 176.42 3h6o h ASP 357 N 6.71 0.69 -4.55 0.00 3.32 -1.54 -3.44 116.42 117.61 3h6o h ASP 357 Ca -0.42 -0.24 -0.24 0.00 0.02 0.00 0.00 57.03 56.14 3h6o h ASP 357 Cb 1.21 -0.19 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 3h6o h ASP 357 CO 0.84 0.91 -0.72 0.00 -1.72 0.00 0.00 179.24 178.55 3h6o s ILE 359 N -1.00 2.41 0.08 0.00 -4.36 -0.29 -1.21 121.20 116.83 3h6o s ILE 359 Ca -0.09 -1.81 0.06 0.00 -0.26 0.00 0.00 60.65 58.56 3h6o s ILE 359 Cb -0.07 -2.11 -0.03 0.00 1.25 0.00 0.00 42.46 41.50 3h6o s ILE 359 CO -0.00 0.02 -0.17 -0.32 0.24 0.00 0.00 174.94 174.70 3h6o s MET 360 N -2.30 0.98 -0.05 0.37 1.75 -0.92 -1.13 119.30 118.00 3h6o s MET 360 Ca 0.17 -1.00 0.07 0.00 -1.25 0.00 0.00 55.69 53.67 3h6o s MET 360 Cb -0.09 -1.10 -0.01 0.00 2.84 0.00 0.00 34.83 36.47 3h6o s MET 360 CO 0.08 0.25 -0.25 -0.51 -0.65 0.00 0.00 175.02 173.95 3h6o s LEU 361 N -1.68 2.06 0.00 4.11 1.43 0.06 -4.43 118.68 120.23 3h6o s LEU 361 Ca 0.02 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 3h6o s LEU 361 Cb -0.10 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.78 3h6o s LEU 361 CO 0.03 0.26 0.00 -1.20 0.23 0.00 0.00 176.35 175.67 3h6o n SER 362 N 2.80 0.00 0.11 2.29 7.64 -1.26 -0.91 113.62 124.29 3h6o n SER 362 Ca -0.17 0.00 0.16 0.00 1.01 0.00 0.00 58.87 59.87 3h6o n SER 362 Cb 0.52 0.00 0.69 0.00 -1.01 0.00 0.00 64.21 64.41 3h6o n SER 362 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3h6o h GLY 363 N 0.00 0.00 0.95 0.23 0.00 -1.97 0.10 103.07 102.38 3h6o h GLY 363 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.41 3h6o h GLY 363 CO 0.00 0.00 0.48 0.83 0.00 0.00 0.00 176.54 177.85 3h6o h GLU 364 N 0.00 0.66 0.00 4.80 3.07 -1.90 -1.21 114.58 120.00 3h6o h GLU 364 Ca 0.15 -0.04 -0.25 0.00 -0.50 0.00 0.00 59.36 58.72 3h6o h GLU 364 Cb 0.61 -0.15 -0.05 0.00 -0.84 0.00 0.00 28.75 28.33 3h6o h GLU 364 CO -0.00 0.44 -1.95 0.25 -1.40 0.00 0.00 179.01 176.35 3h6o n THR 365 N -4.49 0.95 0.08 1.13 -2.24 -0.76 -3.67 114.28 105.27 3h6o n THR 365 Ca 0.12 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.28 3h6o n THR 365 Cb 0.30 -0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 67.61 3h6o n THR 365 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h6o h ALA 366 N 0.38 -0.16 0.00 6.98 0.00 0.90 -3.34 119.26 124.03 3h6o h ALA 366 Ca -0.37 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3h6o h ALA 366 Cb 1.73 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.58 3h6o h ALA 366 CO -0.01 -0.49 0.00 0.36 0.00 0.00 0.00 179.25 179.11 3h6o n LYS 367 N -5.06 -0.06 -2.11 0.00 2.85 -0.83 -1.14 118.16 111.80 3h6o n LYS 367 Ca -0.08 -0.41 -0.27 0.00 -1.05 0.00 0.00 58.31 56.49 3h6o n LYS 367 Cb 0.17 -0.75 0.08 0.00 -0.65 0.00 0.00 35.03 33.87 3h6o n LYS 367 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3h6o s GLY 368 N -0.11 1.66 0.23 2.58 0.00 -0.52 -4.79 107.32 106.38 3h6o s GLY 368 Ca 0.00 -0.86 0.25 0.00 0.00 0.00 0.00 44.72 44.11 3h6o s GLY 368 CO 0.00 -0.42 1.70 -0.55 0.00 0.00 0.00 173.10 173.83 3h6o h ASP 369 N -0.76 0.00 -2.05 1.64 3.32 -1.23 -3.39 116.42 113.95 3h6o h ASP 369 Ca -0.45 -0.02 -0.52 0.00 0.02 0.00 0.00 57.03 56.06 3h6o h ASP 369 Cb 1.32 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.47 3h6o h ASP 369 CO 0.61 0.01 -1.07 -1.22 -1.72 0.00 0.00 179.24 175.85 3h6o n TYR 370 N -2.37 0.76 -0.09 4.55 4.01 -1.24 -4.96 117.16 117.83 3h6o n TYR 370 Ca 0.05 -3.80 -0.14 0.00 -0.16 0.00 0.00 57.90 53.84 3h6o n TYR 370 Cb 0.45 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 39.01 3h6o n TYR 370 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3h6o h PRO 371 N 3.27 0.83 -0.44 -0.72 0.13 -1.77 -2.29 132.00 131.01 3h6o h PRO 371 Ca 0.10 -0.50 -0.10 0.00 -0.87 0.00 0.00 66.00 64.63 3h6o h PRO 371 Cb 0.87 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 3h6o h PRO 371 CO 0.55 1.13 -0.13 -0.07 -0.23 0.00 0.00 178.00 179.25 3h6o h LEU 372 N 0.60 0.88 -0.60 1.56 3.38 -1.93 -2.50 115.31 116.69 3h6o h LEU 372 Ca 0.03 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3h6o h LEU 372 Cb 1.06 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 3h6o h LEU 372 CO 0.11 1.05 0.24 -0.33 0.09 0.00 0.00 178.44 179.59 3h6o h GLU 373 N 0.70 0.90 -0.90 1.13 3.07 -1.94 -0.86 114.58 116.68 3h6o h GLU 373 Ca 0.11 -0.17 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 3h6o h GLU 373 Cb 0.68 -0.15 -0.05 0.00 -0.84 0.00 0.00 28.75 28.39 3h6o h GLU 373 CO 0.05 0.77 0.59 0.00 -1.40 0.00 0.00 179.01 179.02 3h6o h ALA 374 N 1.09 1.17 -0.29 3.43 0.00 -1.32 -0.62 119.26 122.72 3h6o h ALA 374 Ca 0.20 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3h6o h ALA 374 Cb 0.21 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3h6o h ALA 374 CO -0.02 0.50 -0.04 0.28 0.00 0.00 0.00 179.25 179.98 3h6o h VAL 375 N 1.18 1.27 -0.30 0.00 2.07 -1.16 -2.46 116.25 116.86 3h6o h VAL 375 Ca 0.34 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 3h6o h VAL 375 Cb -0.07 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3h6o h VAL 375 CO -0.09 0.33 -0.03 0.03 0.02 0.00 0.00 177.57 177.82 3h6o h ARG 376 N 0.30 0.47 0.27 1.57 3.08 -0.94 -1.46 114.38 117.67 3h6o h ARG 376 Ca 0.08 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3h6o h ARG 376 Cb 0.50 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.48 3h6o h ARG 376 CO 0.02 0.52 -0.13 1.98 -1.07 0.00 0.00 179.97 181.29 3h6o h MET 377 N 0.44 -0.35 -0.74 0.04 4.05 -1.09 -1.06 114.93 116.23 3h6o h MET 377 Ca 0.09 0.02 0.14 0.00 -0.28 0.00 0.00 59.70 59.67 3h6o h MET 377 Cb 0.35 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.18 3h6o h MET 377 CO 0.01 -0.02 0.49 1.96 0.23 0.00 0.00 176.91 179.58 3h6o h GLN 378 N -0.71 0.44 -0.17 0.39 4.20 -1.37 -0.28 115.11 117.62 3h6o h GLN 378 Ca -0.04 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 3h6o h GLN 378 Cb 0.49 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 3h6o h GLN 378 CO 0.06 0.29 0.03 1.25 -0.67 0.00 0.00 178.83 179.80 3h6o h HIS 379 N 0.46 0.29 -0.24 2.96 2.76 -1.09 -1.26 115.15 119.03 3h6o h HIS 379 Ca 0.36 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.48 3h6o h HIS 379 Cb 0.76 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.63 3h6o h HIS 379 CO -0.00 0.42 0.11 -0.07 -1.30 0.00 0.00 177.93 177.09 3h6o h LEU 380 N 0.07 0.32 0.19 0.26 3.38 -0.18 -2.85 115.31 116.51 3h6o h LEU 380 Ca 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3h6o h LEU 380 Cb 0.28 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3h6o h LEU 380 CO 0.00 0.36 -0.09 0.40 0.09 0.00 0.00 178.44 179.20 3h6o h ILE 381 N 0.25 0.88 -0.63 1.22 2.04 -1.15 -2.82 117.51 117.31 3h6o h ILE 381 Ca 0.08 -0.38 0.13 0.00 1.00 0.00 0.00 64.86 65.69 3h6o h ILE 381 Cb 0.13 1.11 -0.11 0.00 -0.74 0.00 0.00 36.82 37.21 3h6o h ILE 381 CO -0.01 0.09 -0.09 0.00 0.00 0.00 0.00 178.15 178.14 3h6o h ALA 382 N 0.33 0.51 -0.37 1.87 0.00 -1.22 0.08 119.26 120.45 3h6o h ALA 382 Ca -0.03 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3h6o h ALA 382 Cb 0.34 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3h6o h ALA 382 CO 0.04 -0.42 0.23 -0.09 0.00 0.00 0.00 179.25 179.02 3h6o h ARG 383 N 0.04 0.46 -0.03 0.00 2.43 -1.47 0.11 114.38 115.93 3h6o h ARG 383 Ca 0.32 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 3h6o h ARG 383 Cb 0.50 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 3h6o h ARG 383 CO -0.60 0.31 0.01 0.93 -1.51 0.00 0.00 179.97 179.10 3h6o h GLU 384 N 0.48 0.03 -0.60 0.20 4.39 -1.02 -2.90 114.58 115.16 3h6o h GLU 384 Ca 0.14 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 3h6o h GLU 384 Cb -0.04 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 3h6o h GLU 384 CO -0.04 0.02 0.26 0.00 -1.16 0.00 0.00 179.01 178.09 3h6o h ALA 385 N 1.02 1.33 -0.47 3.43 0.00 -0.69 -2.53 119.26 121.35 3h6o h ALA 385 Ca 0.01 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3h6o h ALA 385 Cb 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3h6o h ALA 385 CO -0.01 0.51 0.14 0.93 0.00 0.00 0.00 179.25 180.82 3h6o h GLU 386 N 0.86 0.69 -0.04 0.00 5.08 -0.84 -1.59 114.58 118.73 3h6o h GLU 386 Ca 0.21 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.36 3h6o h GLU 386 Cb 0.13 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3h6o h GLU 386 CO -0.02 0.60 -0.44 0.00 -1.00 0.00 0.00 179.01 178.15 3h6o h ALA 387 N 1.49 1.21 -0.01 3.43 0.00 -1.26 -3.23 119.26 120.89 3h6o h ALA 387 Ca 0.16 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3h6o h ALA 387 Cb 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3h6o h ALA 387 CO -0.01 0.57 -0.02 0.00 0.00 0.00 0.00 179.25 179.80 3h6o n ALA 388 N -2.46 2.65 -1.77 0.00 0.00 -0.63 -4.56 120.51 113.73 3h6o n ALA 388 Ca -0.02 -0.34 -0.41 0.00 0.00 0.00 0.00 53.44 52.68 3h6o n ALA 388 Cb 0.47 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 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 -2.06 2.54 -1.30 0.00 1.01 -1.01 -4.94 121.20 115.43 3h6o s ILE 389 Ca 0.41 0.54 -0.13 0.00 0.00 0.00 0.00 60.65 61.47 3h6o s ILE 389 Cb 0.21 -3.34 0.13 0.00 0.01 0.00 0.00 42.46 39.46 3h6o s ILE 389 CO 0.37 0.13 1.81 0.00 0.00 0.00 0.00 174.94 177.24 3h6o n TYR 390 N 0.71 3.91 0.14 3.97 9.36 -1.26 -4.81 117.16 129.18 3h6o n TYR 390 Ca 0.00 -2.99 0.08 0.00 3.32 0.00 0.00 57.90 58.31 3h6o n TYR 390 Cb 0.41 -2.26 0.58 0.00 -0.63 0.00 0.00 39.34 37.44 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 6.49 0.17 0.39 2.98 3.86 -1.92 -1.37 115.15 125.76 3h6o h HIS 391 Ca 0.42 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.63 3h6o h HIS 391 Cb 0.74 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 3h6o h HIS 391 CO 1.28 0.10 -0.32 1.25 0.86 0.00 0.00 177.93 181.11 3h6o h LEU 392 N 0.18 -0.84 -0.20 2.43 5.85 -1.87 0.23 115.31 121.08 3h6o h LEU 392 Ca 0.09 0.07 -0.19 0.00 0.84 0.00 0.00 57.88 58.68 3h6o h LEU 392 Cb 0.12 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3h6o h LEU 392 CO -0.02 -0.47 -0.91 -0.61 -0.34 0.00 0.00 178.44 176.09 3h6o h GLN 393 N -0.72 0.04 0.22 1.25 4.15 -1.93 -2.81 115.11 115.32 3h6o h GLN 393 Ca -0.03 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 3h6o h GLN 393 Cb 0.62 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 3h6o h GLN 393 CO -0.02 0.92 -0.17 1.25 -1.93 0.00 0.00 178.83 178.88 3h6o h LEU 394 N 0.02 -0.45 -0.78 -2.39 5.85 -1.00 -0.64 115.31 115.92 3h6o h LEU 394 Ca -0.02 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.63 3h6o h LEU 394 Cb 1.60 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.76 3h6o h LEU 394 CO 0.12 -0.27 -0.19 0.15 -0.34 0.00 0.00 178.44 177.91 3h6o h PHE 395 N -0.41 0.80 -0.26 1.25 3.04 -0.66 -0.63 116.94 120.06 3h6o h PHE 395 Ca -0.01 -0.17 0.04 0.00 3.98 0.00 0.00 57.97 61.81 3h6o h PHE 395 Cb 0.36 -0.20 -0.04 0.00 2.56 0.00 0.00 35.95 38.64 3h6o h PHE 395 CO -0.12 0.85 0.03 0.93 -2.02 0.00 0.00 178.31 177.98 3h6o h GLU 396 N 0.63 0.12 0.02 1.11 5.08 -1.41 -1.54 114.58 118.59 3h6o h GLU 396 Ca 0.10 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3h6o h GLU 396 Cb 0.68 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3h6o h GLU 396 CO 0.05 0.08 -0.01 0.93 -1.00 0.00 0.00 179.01 179.06 3h6o h GLU 397 N 0.12 -0.03 -0.76 2.33 5.08 -0.96 -1.17 114.58 119.19 3h6o h GLU 397 Ca 0.12 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.64 3h6o h GLU 397 Cb 0.14 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 3h6o h GLU 397 CO -0.18 0.40 0.27 -0.07 -1.00 0.00 0.00 179.01 178.43 3h6o h LEU 398 N -0.46 0.19 -0.87 1.33 3.38 -1.10 0.11 115.31 117.89 3h6o h LEU 398 Ca -0.00 0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 3h6o h LEU 398 Cb 0.44 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3h6o h LEU 398 CO 0.00 0.04 -0.52 -0.09 0.09 0.00 0.00 178.44 177.97 3h6o h ARG 399 N 0.38 0.10 -0.05 1.13 9.65 -1.24 -2.89 114.38 121.46 3h6o h ARG 399 Ca 0.43 -0.06 -0.21 0.00 -1.10 0.00 0.00 59.98 59.04 3h6o h ARG 399 Cb 0.70 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.29 3h6o h ARG 399 CO -0.45 0.60 -0.85 0.00 2.80 0.00 0.00 179.97 182.07 3h6o h ARG 400 N 0.08 0.49 -1.11 0.20 3.08 0.11 -3.28 114.38 113.95 3h6o h ARG 400 Ca -0.00 -0.46 -0.20 0.00 0.07 0.00 0.00 59.98 59.39 3h6o h ARG 400 Cb 0.95 0.11 -0.11 0.00 0.08 0.00 0.00 29.97 31.00 3h6o h ARG 400 CO 0.07 1.10 0.26 1.28 -1.07 0.00 0.00 179.97 181.61 3h6o n LEU 401 N -3.81 4.72 -3.92 3.04 4.77 0.27 -4.87 117.00 117.19 3h6o n LEU 401 Ca -0.06 -2.43 -0.29 0.00 -0.03 0.00 0.00 56.01 53.20 3h6o n LEU 401 Cb 0.78 -0.71 -0.16 0.00 -2.33 0.00 0.00 43.42 41.00 3h6o n LEU 401 CO 0.51 0.79 -0.43 0.00 -1.33 0.00 0.00 177.39 176.93 3h6o s ALA 402 N -1.26 1.71 0.45 -1.18 0.00 -1.18 -5.00 121.76 115.30 3h6o s ALA 402 Ca 0.22 -1.05 -0.23 0.00 0.00 0.00 0.00 51.96 50.90 3h6o s ALA 402 Cb 0.18 -1.24 -0.10 0.00 0.00 0.00 0.00 23.12 21.96 3h6o s ALA 402 CO 0.03 -0.91 0.95 -2.30 0.00 0.00 0.00 175.76 173.53 3h6o n PRO 403 N 4.78 1.20 -3.13 0.00 -0.02 -1.26 -4.97 135.00 131.60 3h6o n PRO 403 Ca -0.13 0.44 -0.45 0.00 -2.02 0.00 0.00 63.50 61.34 3h6o n PRO 403 Cb 0.46 -2.00 -0.04 0.00 -0.02 0.00 0.00 33.50 31.90 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 -1.34 4.97 0.17 4.25 1.01 -1.26 -5.03 121.20 123.97 3h6o s ILE 404 Ca 0.65 -1.39 0.08 0.00 0.00 0.00 0.00 60.65 59.99 3h6o s ILE 404 Cb -0.54 -4.52 -0.04 0.00 0.01 0.00 0.00 42.46 37.37 3h6o s ILE 404 CO 0.56 -1.15 -0.05 0.42 0.00 0.00 0.00 174.94 174.71 3h6o s THR 405 N 2.16 3.47 -2.00 2.92 -4.23 -1.26 -5.00 115.64 111.70 3h6o s THR 405 Ca 0.15 -1.50 0.13 0.00 -1.18 0.00 0.00 61.69 59.30 3h6o s THR 405 Cb -0.19 -2.72 0.36 0.00 1.34 0.00 0.00 72.50 71.29 3h6o s THR 405 CO 0.01 -0.08 1.19 -1.20 -0.54 0.00 0.00 174.62 173.99 3h6o n SER 406 N 0.04 0.00 -4.61 3.99 7.64 -1.26 -4.80 113.62 114.62 3h6o n SER 406 Ca -0.10 -0.57 -0.43 0.00 1.01 0.00 0.00 58.87 58.78 3h6o n SER 406 Cb 0.55 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.72 3h6o n SER 406 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3h6o s ASP 407 N -1.91 5.91 0.39 6.43 2.15 -1.26 -4.89 116.67 123.49 3h6o s ASP 407 Ca 0.19 1.48 0.19 0.00 0.43 0.00 0.00 52.55 54.84 3h6o s ASP 407 Cb 0.09 -2.52 0.77 0.00 -0.30 0.00 0.00 42.92 40.96 3h6o s ASP 407 CO 0.15 -1.66 1.78 -0.65 -0.17 0.00 0.00 175.17 174.62 3h6o h PRO 408 N 12.83 0.00 -0.41 4.34 0.11 -1.90 -2.75 132.00 144.21 3h6o h PRO 408 Ca -0.35 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.67 3h6o h PRO 408 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3h6o h PRO 408 CO 1.01 0.35 -0.07 1.15 -0.21 0.00 0.00 178.00 180.23 3h6o h THR 409 N 0.00 1.27 -0.55 -1.15 2.02 -1.90 -1.03 112.91 111.56 3h6o h THR 409 Ca -0.00 -1.14 -0.08 0.00 0.77 0.00 0.00 66.41 65.96 3h6o h THR 409 Cb 0.80 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.36 3h6o h THR 409 CO 0.05 0.39 0.04 -0.33 0.37 0.00 0.00 175.52 176.03 3h6o h GLU 410 N 0.60 0.92 -0.13 6.66 3.07 -1.87 -1.98 114.58 121.85 3h6o h GLU 410 Ca 0.11 -0.25 -0.19 0.00 -0.50 0.00 0.00 59.36 58.53 3h6o h GLU 410 Cb 0.58 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3h6o h GLU 410 CO 0.03 0.89 -0.69 0.00 -1.40 0.00 0.00 179.01 177.84 3h6o h ALA 411 N 1.18 0.56 -0.29 3.43 0.00 -1.40 -2.08 119.26 120.66 3h6o h ALA 411 Ca 0.17 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 3h6o h ALA 411 Cb 0.45 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3h6o h ALA 411 CO 0.02 0.72 0.06 1.15 0.00 0.00 0.00 179.25 181.20 3h6o h THR 412 N 0.38 1.22 -0.28 0.00 2.02 -1.16 -2.12 112.91 112.98 3h6o h THR 412 Ca -0.02 -0.76 0.04 0.00 0.77 0.00 0.00 66.41 66.44 3h6o h THR 412 Cb 1.27 1.17 -0.04 0.00 -1.74 0.00 0.00 68.15 68.82 3h6o h THR 412 CO 0.13 0.25 0.06 0.00 0.37 0.00 0.00 175.52 176.32 3h6o h ALA 413 N 0.88 0.29 -0.45 6.16 0.00 -1.23 -0.56 119.26 124.35 3h6o h ALA 413 Ca 0.09 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 3h6o h ALA 413 Cb 0.31 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3h6o h ALA 413 CO 0.00 -0.36 -0.13 -0.24 0.00 0.00 0.00 179.25 178.53 3h6o h VAL 414 N 0.16 1.27 -0.70 0.00 3.04 -1.42 -1.93 116.25 116.68 3h6o h VAL 414 Ca 0.13 -1.25 0.05 0.00 -1.01 0.00 0.00 66.70 64.61 3h6o h VAL 414 Cb 0.13 1.16 -0.04 0.00 -2.01 0.00 0.00 31.29 30.52 3h6o h VAL 414 CO -0.17 0.43 0.46 1.23 -1.01 0.00 0.00 177.57 178.51 3h6o h GLY 415 N 0.71 0.94 0.96 3.17 0.00 -1.18 -1.20 103.07 106.47 3h6o h GLY 415 Ca 0.11 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 46.97 3h6o h GLY 415 CO 0.05 0.26 -0.49 0.00 0.00 0.00 0.00 176.54 176.36 3h6o h ALA 416 N 1.60 0.29 -0.72 3.60 0.00 -0.92 -1.03 119.26 122.09 3h6o h ALA 416 Ca 0.29 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3h6o h ALA 416 Cb 0.14 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3h6o h ALA 416 CO -0.09 0.45 0.38 0.28 0.00 0.00 0.00 179.25 180.27 3h6o h VAL 417 N 0.30 1.22 -0.43 0.00 2.07 -1.20 0.43 116.25 118.63 3h6o h VAL 417 Ca -0.01 -0.58 -0.09 0.00 0.82 0.00 0.00 66.70 66.84 3h6o h VAL 417 Cb 1.11 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3h6o h VAL 417 CO 0.10 0.25 -0.08 -0.08 0.02 0.00 0.00 177.57 177.79 3h6o h GLU 418 N 0.99 0.82 -0.74 1.57 4.57 -1.23 -2.61 114.58 117.95 3h6o h GLU 418 Ca 0.25 -0.30 0.05 0.00 -1.18 0.00 0.00 59.36 58.18 3h6o h GLU 418 Cb 0.06 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 3h6o h GLU 418 CO -0.04 0.92 0.45 0.00 -1.18 0.00 0.00 179.01 179.16 3h6o h ALA 419 N 0.87 0.99 -0.32 2.92 0.00 -1.03 -1.21 119.26 121.48 3h6o h ALA 419 Ca 0.11 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3h6o h ALA 419 Cb 0.60 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3h6o h ALA 419 CO 0.04 0.18 0.11 0.66 0.00 0.00 0.00 179.25 180.24 3h6o h SER 420 N 0.84 0.40 -0.08 0.00 4.64 -0.71 -2.15 113.55 116.49 3h6o h SER 420 Ca 0.32 -0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.48 3h6o h SER 420 Cb 0.12 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3h6o h SER 420 CO -0.15 0.39 -0.41 -0.26 -0.87 0.00 0.00 176.83 175.52 3h6o h PHE 421 N 0.45 0.58 -0.83 4.77 0.04 -1.08 -0.57 116.94 120.30 3h6o h PHE 421 Ca 0.11 -0.26 0.04 0.00 2.80 0.00 0.00 57.97 60.66 3h6o h PHE 421 Cb 0.13 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.14 3h6o h PHE 421 CO 0.00 1.01 0.54 -0.22 -0.60 0.00 0.00 178.31 179.05 3h6o h LYS 422 N -0.02 0.99 -0.21 1.51 1.63 -0.88 -2.95 116.57 116.64 3h6o h LYS 422 Ca -0.03 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 3h6o h LYS 422 Cb 1.06 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 3h6o h LYS 422 CO 0.09 0.65 0.00 0.00 -3.45 0.00 0.00 179.45 176.74 3h6o s SER 425 N -4.27 4.41 0.12 0.00 1.04 -0.65 -4.90 113.70 109.45 3h6o s SER 425 Ca 0.07 2.58 0.25 0.00 0.48 0.00 0.00 55.95 59.33 3h6o s SER 425 Cb -0.04 -2.61 0.95 0.00 0.10 0.00 0.00 66.02 64.42 3h6o s SER 425 CO 0.88 -2.13 1.78 0.61 0.98 0.00 0.00 173.24 175.36 3h6o n GLY 426 N 0.83 -1.48 3.57 7.32 0.00 -0.94 -4.65 105.19 109.84 3h6o n GLY 426 Ca 0.15 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 3h6o n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6o s ALA 427 N -3.09 -1.94 -0.27 4.61 0.00 -1.26 -4.36 121.76 115.45 3h6o s ALA 427 Ca 0.10 1.49 -0.07 0.00 0.00 0.00 0.00 51.96 53.48 3h6o s ALA 427 Cb 0.14 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 3h6o s ALA 427 CO 0.50 -0.42 0.07 0.42 0.00 0.00 0.00 175.76 176.33 3h6o s ILE 428 N -1.70 4.15 -0.23 0.00 1.01 0.83 -1.10 121.20 124.16 3h6o s ILE 428 Ca 0.02 -0.38 -0.10 0.00 0.00 0.00 0.00 60.65 60.19 3h6o s ILE 428 Cb -0.01 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.40 3h6o s ILE 428 CO -0.02 0.24 0.15 -0.63 0.00 0.00 0.00 174.94 174.68 3h6o s ILE 429 N 1.57 5.30 -0.05 2.92 1.01 0.26 -0.88 121.20 131.33 3h6o s ILE 429 Ca 0.05 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.87 3h6o s ILE 429 Cb -0.16 -3.46 0.02 0.00 0.01 0.00 0.00 42.46 38.87 3h6o s ILE 429 CO 0.03 0.36 -0.05 -0.69 0.00 0.00 0.00 174.94 174.59 3h6o s VAL 430 N 0.95 0.59 -0.11 2.92 1.01 -0.79 0.14 120.40 125.11 3h6o s VAL 430 Ca 0.07 -0.13 -0.24 0.00 0.00 0.00 0.00 61.98 61.68 3h6o s VAL 430 Cb -0.13 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.60 3h6o s VAL 430 CO 0.03 0.25 0.74 -0.76 0.00 0.00 0.00 175.10 175.36 3h6o s LEU 431 N 1.04 4.25 -0.09 3.92 1.43 -1.00 -0.79 118.68 127.45 3h6o s LEU 431 Ca -0.09 1.16 -0.05 0.00 -1.03 0.00 0.00 54.13 54.12 3h6o s LEU 431 Cb -0.14 -3.12 0.04 0.00 0.03 0.00 0.00 46.19 43.00 3h6o s LEU 431 CO -0.01 -0.23 0.21 0.28 0.23 0.00 0.00 176.35 176.84 3h6o s THR 432 N 1.38 -0.04 -0.11 5.49 -1.32 -0.86 -4.89 115.64 115.28 3h6o s THR 432 Ca 0.37 0.15 -0.25 0.00 -1.21 0.00 0.00 61.69 60.76 3h6o s THR 432 Cb -0.17 -0.33 -0.22 0.00 -1.51 0.00 0.00 72.50 70.27 3h6o s THR 432 CO 0.16 0.06 0.77 0.11 -2.21 0.00 0.00 174.62 173.51 3h6o h LYS 433 N 7.18 -0.02 0.00 7.08 1.57 -1.95 -3.38 116.57 127.05 3h6o h LYS 433 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 3h6o h LYS 433 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3h6o h LYS 433 CO 0.39 0.75 -1.08 -1.13 -0.57 0.00 0.00 179.45 177.81 3h6o n SER 434 N -4.69 0.65 0.00 0.86 3.41 -1.26 -4.64 113.62 107.95 3h6o n SER 434 Ca -0.09 -0.43 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 3h6o n SER 434 Cb 0.38 0.94 0.00 0.00 -0.26 0.00 0.00 64.21 65.27 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 1.41 1.75 0.16 5.00 0.00 -1.26 -4.84 105.19 107.41 3h6o n GLY 435 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 3h6o n GLY 435 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3h6o h ARG 436 N 3.32 0.39 -0.69 1.61 2.43 -1.94 -0.79 114.38 118.71 3h6o h ARG 436 Ca 0.00 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3h6o h ARG 436 Cb 0.00 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 3h6o h ARG 436 CO 0.00 0.26 0.46 0.77 -1.51 0.00 0.00 179.97 179.95 3h6o h SER 437 N 0.40 0.67 0.46 -3.80 0.02 -1.93 -0.74 113.55 108.64 3h6o h SER 437 Ca 0.15 -0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.82 3h6o h SER 437 Cb 0.03 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 62.43 3h6o h SER 437 CO -0.09 0.45 -1.20 0.00 -1.14 0.00 0.00 176.83 174.85 3h6o h ALA 438 N 1.61 0.12 -0.89 3.77 0.00 -1.76 -2.92 119.26 119.18 3h6o h ALA 438 Ca 0.29 -0.83 0.07 0.00 0.00 0.00 0.00 54.91 54.44 3h6o h ALA 438 Cb 0.16 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 3h6o h ALA 438 CO -0.09 0.87 0.56 0.45 0.00 0.00 0.00 179.25 181.04 3h6o h HIS 439 N 0.14 1.03 -0.21 0.00 3.86 -0.55 -0.71 115.15 118.71 3h6o h HIS 439 Ca -0.14 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.01 3h6o h HIS 439 Cb 1.90 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 30.02 3h6o h HIS 439 CO 0.08 0.51 -0.24 1.96 0.86 0.00 0.00 177.93 181.10 3h6o h GLN 440 N 1.00 0.39 -0.24 2.45 4.20 -1.16 -1.69 115.11 120.06 3h6o h GLN 440 Ca 0.40 -0.14 -0.15 0.00 0.06 0.00 0.00 58.65 58.82 3h6o h GLN 440 Cb 0.21 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3h6o h GLN 440 CO -0.19 0.61 -0.43 0.28 -0.67 0.00 0.00 178.83 178.43 3h6o h VAL 441 N 0.35 1.31 0.00 -0.54 2.07 -1.27 -3.29 116.25 114.87 3h6o h VAL 441 Ca 0.06 -1.64 -0.05 0.00 0.82 0.00 0.00 66.70 65.89 3h6o h VAL 441 Cb 0.61 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 3h6o h VAL 441 CO 0.04 0.52 -0.24 0.00 0.02 0.00 0.00 177.57 177.92 3h6o h ALA 442 N 0.64 1.42 0.00 1.67 0.00 -0.75 -2.60 119.26 119.63 3h6o h ALA 442 Ca 0.01 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3h6o h ALA 442 Cb 1.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3h6o h ALA 442 CO 0.10 0.30 0.00 0.07 0.00 0.00 0.00 179.25 179.71 3h6o h ARG 443 N 0.00 0.00 -0.23 0.00 0.11 -1.38 -1.50 114.38 111.38 3h6o h ARG 443 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h6o h ARG 443 Cb 0.48 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.56 3h6o h ARG 443 CO 0.03 0.00 0.00 0.66 0.10 0.00 0.00 179.97 180.76 3h6o n TYR 444 N -2.73 0.30 -3.63 4.08 4.01 -0.98 -4.97 117.16 113.24 3h6o n TYR 444 Ca 0.02 -0.15 -0.28 0.00 -0.16 0.00 0.00 57.90 57.32 3h6o n TYR 444 Cb 0.29 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.37 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 0.50 -1.68 -1.57 -0.72 5.12 -0.56 -4.78 116.66 112.96 3h6o n ARG 445 Ca 0.16 0.53 -0.33 0.00 -1.93 0.00 0.00 57.85 56.28 3h6o n ARG 445 Cb 0.36 -4.47 0.07 0.00 -1.16 0.00 0.00 32.46 27.26 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 -5.75 2.54 0.12 5.56 0.04 -1.26 -4.93 135.00 131.32 3h6o s PRO 446 Ca 0.43 1.37 -0.14 0.00 0.04 0.00 0.00 61.00 62.70 3h6o s PRO 446 Cb -0.14 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 3h6o s PRO 446 CO 0.84 -1.45 1.55 -0.09 0.04 0.00 0.00 177.00 177.89 3h6o h ARG 447 N -0.36 0.73 -6.89 4.56 2.43 -1.93 -3.45 114.38 109.48 3h6o h ARG 447 Ca -0.46 -0.26 -0.51 0.00 -0.81 0.00 0.00 59.98 57.94 3h6o h ARG 447 Cb 1.25 -0.05 0.05 0.00 -0.42 0.00 0.00 29.97 30.79 3h6o h ARG 447 CO 0.53 0.85 0.54 0.00 -1.51 0.00 0.00 179.97 180.38 3h6o s ALA 448 N -4.88 3.34 0.33 2.80 0.00 -1.26 -4.99 121.76 117.09 3h6o s ALA 448 Ca -0.13 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 3h6o s ALA 448 Cb 0.10 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 3h6o s ALA 448 CO 0.80 -0.47 1.43 -1.25 0.00 0.00 0.00 175.76 176.28 3h6o s PRO 449 N -1.90 4.22 -0.52 0.00 0.04 -1.26 -4.63 135.00 130.95 3h6o s PRO 449 Ca 0.51 2.41 -0.15 0.00 0.04 0.00 0.00 61.00 63.81 3h6o s PRO 449 Cb -0.34 -3.03 0.12 0.00 0.04 0.00 0.00 34.50 31.28 3h6o s PRO 449 CO 0.44 -0.41 0.46 0.42 0.04 0.00 0.00 177.00 177.95 3h6o s ILE 450 N -0.79 5.10 -0.66 0.56 1.01 0.14 -0.12 121.20 126.44 3h6o s ILE 450 Ca 0.54 -1.44 -0.25 0.00 0.00 0.00 0.00 60.65 59.50 3h6o s ILE 450 Cb -0.44 -4.23 0.04 0.00 0.01 0.00 0.00 42.46 37.85 3h6o s ILE 450 CO 0.54 -0.80 1.11 -0.63 0.00 0.00 0.00 174.94 175.17 3h6o s ILE 451 N 1.58 4.06 -0.39 2.92 1.01 -0.06 0.13 121.20 130.45 3h6o s ILE 451 Ca 0.03 0.20 -0.19 0.00 0.00 0.00 0.00 60.65 60.70 3h6o s ILE 451 Cb -0.28 -4.76 0.01 0.00 0.01 0.00 0.00 42.46 37.44 3h6o s ILE 451 CO 0.03 -1.54 0.55 0.00 0.00 0.00 0.00 174.94 173.98 3h6o s ALA 452 N 4.81 3.42 -0.26 9.38 0.00 -0.42 -1.89 121.76 136.80 3h6o s ALA 452 Ca 0.31 -1.15 -0.16 0.00 0.00 0.00 0.00 51.96 50.96 3h6o s ALA 452 Cb -0.12 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.85 3h6o s ALA 452 CO 0.15 -1.47 0.44 0.08 0.00 0.00 0.00 175.76 174.96 3h6o s VAL 453 N 2.51 5.13 0.01 0.00 1.01 0.03 -1.78 120.40 127.31 3h6o s VAL 453 Ca 0.19 0.72 -0.03 0.00 0.00 0.00 0.00 61.98 62.87 3h6o s VAL 453 Cb -0.15 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 3h6o s VAL 453 CO 0.15 0.13 0.03 0.28 0.00 0.00 0.00 175.10 175.69 3h6o s THR 454 N 2.13 0.10 -2.05 3.92 -1.32 -1.03 -2.03 115.64 115.36 3h6o s THR 454 Ca 0.18 -0.81 0.27 0.00 -1.21 0.00 0.00 61.69 60.12 3h6o s THR 454 Cb -0.16 -0.31 0.38 0.00 -1.51 0.00 0.00 72.50 70.90 3h6o s THR 454 CO 0.09 -0.44 1.64 0.54 -2.21 0.00 0.00 174.62 174.24 3h6o n ARG 455 N 1.59 1.16 -3.37 7.08 1.74 -1.26 -0.36 116.66 123.24 3h6o n ARG 455 Ca -0.23 -0.68 -0.42 0.00 -0.77 0.00 0.00 57.85 55.75 3h6o n ARG 455 Cb 0.55 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 30.42 3h6o n ARG 455 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3h6o s ASN 456 N -2.30 6.17 0.27 0.55 3.84 -1.26 -4.87 114.94 117.34 3h6o s ASN 456 Ca 0.30 -0.56 -0.03 0.00 0.21 0.00 0.00 52.86 52.78 3h6o s ASN 456 Cb 0.20 -2.20 0.40 0.00 -0.55 0.00 0.00 41.25 39.10 3h6o s ASN 456 CO 0.45 -0.48 1.90 -0.65 -2.79 0.00 0.00 177.10 175.52 3h6o h PRO 457 N 8.63 1.16 -0.13 0.43 0.11 -1.95 -1.70 132.00 138.54 3h6o h PRO 457 Ca -0.28 -0.07 -0.23 0.00 0.11 0.00 0.00 66.00 65.53 3h6o h PRO 457 Cb 1.12 -0.26 0.01 0.00 0.11 0.00 0.00 31.00 31.98 3h6o h PRO 457 CO 0.75 0.77 -0.81 0.37 -0.21 0.00 0.00 178.00 178.86 3h6o h GLN 458 N 1.19 0.78 -0.44 1.05 4.15 -1.97 -2.64 115.11 117.24 3h6o h GLN 458 Ca 0.42 -0.66 0.08 0.00 0.77 0.00 0.00 58.65 59.26 3h6o h GLN 458 Cb 0.11 0.14 -0.07 0.00 0.21 0.00 0.00 27.48 27.87 3h6o h GLN 458 CO -0.15 1.26 -0.03 1.15 -1.93 0.00 0.00 178.83 179.13 3h6o h THR 459 N 0.52 0.64 -0.95 2.39 2.02 -1.81 -1.18 112.91 114.53 3h6o h THR 459 Ca -0.06 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.09 3h6o h THR 459 Cb 1.44 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 68.36 3h6o h THR 459 CO 0.17 0.01 0.61 0.00 0.37 0.00 0.00 175.52 176.68 3h6o h ALA 460 N 1.40 1.28 -0.12 6.16 0.00 -1.23 -1.76 119.26 124.99 3h6o h ALA 460 Ca 0.22 -0.08 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 3h6o h ALA 460 Cb 0.32 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.74 3h6o h ALA 460 CO -0.38 0.65 -0.78 0.00 0.00 0.00 0.00 179.25 178.73 3h6o h ARG 461 N 1.30 0.74 0.00 0.00 3.08 -1.13 -3.26 114.38 115.12 3h6o h ARG 461 Ca 0.35 -0.64 -0.04 0.00 0.07 0.00 0.00 59.98 59.72 3h6o h ARG 461 Cb -0.11 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 3h6o h ARG 461 CO -0.07 1.24 -0.18 1.96 -1.07 0.00 0.00 179.97 181.85 3h6o h GLN 462 N 0.45 0.00 0.00 0.04 4.20 -1.07 -3.16 115.11 115.57 3h6o h GLN 462 Ca -0.06 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3h6o h GLN 462 Cb 1.42 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.20 3h6o h GLN 462 CO 0.16 0.18 -0.04 0.00 -0.67 0.00 0.00 178.83 178.45 3h6o h ALA 463 N 1.82 1.20 -0.15 3.87 0.00 -1.36 -2.32 119.26 122.32 3h6o h ALA 463 Ca -0.00 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3h6o h ALA 463 Cb 0.89 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3h6o h ALA 463 CO 0.02 0.05 0.23 0.45 0.00 0.00 0.00 179.25 180.00 3h6o h HIS 464 N 0.00 0.00 0.00 0.00 3.86 -1.71 -2.26 115.15 115.04 3h6o h HIS 464 Ca -0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3h6o h HIS 464 Cb 0.19 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 3h6o h HIS 464 CO 0.00 0.00 -0.01 -0.07 0.86 0.00 0.00 177.93 178.71 3h6o h LEU 465 N 0.00 0.00 -9.04 2.43 3.38 -1.67 -3.39 115.31 107.02 3h6o h LEU 465 Ca 0.07 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.42 3h6o h LEU 465 Cb 0.53 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.11 3h6o h LEU 465 CO -0.00 0.01 -0.57 -0.31 0.09 0.00 0.00 178.44 177.66 3h6o s TYR 466 N -4.05 3.23 0.12 1.13 2.02 -0.85 -4.55 117.35 114.39 3h6o s TYR 466 Ca -0.03 0.02 -0.35 0.00 -0.37 0.00 0.00 57.07 56.33 3h6o s TYR 466 Cb 0.12 -2.10 -0.16 0.00 -0.40 0.00 0.00 41.96 39.42 3h6o s TYR 466 CO 0.47 0.09 1.38 -2.13 -1.57 0.00 0.00 175.55 173.79 3h6o n ARG 467 N 3.70 1.42 0.00 -0.62 3.00 -1.26 -2.25 116.66 120.66 3h6o n ARG 467 Ca -0.16 0.51 0.00 0.00 -0.00 0.00 0.00 57.85 58.20 3h6o n ARG 467 Cb 0.52 -2.17 0.00 0.00 0.00 0.00 0.00 32.46 30.81 3h6o n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3h6o n GLY 468 N 2.65 2.88 3.67 5.14 0.00 0.28 -4.75 105.19 115.06 3h6o n GLY 468 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.91 4.65 -0.46 -0.61 1.01 -0.95 -0.68 121.20 122.24 3h6o s ILE 469 Ca 0.00 1.96 -0.08 0.00 0.00 0.00 0.00 60.65 62.53 3h6o s ILE 469 Cb 0.00 -4.26 0.12 0.00 0.01 0.00 0.00 42.46 38.33 3h6o s ILE 469 CO 0.00 -0.10 0.32 0.12 0.00 0.00 0.00 174.94 175.28 3h6o s PHE 470 N 2.78 3.46 0.20 3.97 5.36 0.34 -4.65 117.98 129.43 3h6o s PHE 470 Ca 0.47 -2.00 -0.30 0.00 -0.96 0.00 0.00 56.93 54.14 3h6o s PHE 470 Cb -0.17 -3.45 -0.08 0.00 -0.34 0.00 0.00 43.02 38.98 3h6o s PHE 470 CO 0.12 -0.99 0.95 -1.25 -1.46 0.00 0.00 175.22 172.58 3h6o s PRO 471 N 1.28 4.80 -0.02 10.12 0.04 -1.26 -1.30 135.00 148.66 3h6o s PRO 471 Ca 0.07 1.47 0.04 0.00 0.04 0.00 0.00 61.00 62.62 3h6o s PRO 471 Cb -0.25 -3.31 -0.00 0.00 0.04 0.00 0.00 34.50 30.97 3h6o s PRO 471 CO -0.02 0.42 -0.13 0.14 0.04 0.00 0.00 177.00 177.45 3h6o s VAL 472 N -0.80 1.09 -0.41 -0.36 -7.23 -0.74 -4.50 120.40 107.45 3h6o s VAL 472 Ca 0.43 -0.56 -0.12 0.00 -1.81 0.00 0.00 61.98 59.93 3h6o s VAL 472 Cb -0.25 -0.93 0.05 0.00 0.56 0.00 0.00 36.38 35.81 3h6o s VAL 472 CO 0.31 0.32 0.27 -0.22 -0.31 0.00 0.00 175.10 175.47 3h6o s LEU 473 N -0.08 5.07 -0.01 1.32 2.96 -1.26 -2.47 118.68 124.22 3h6o s LEU 473 Ca 0.01 -1.23 -0.30 0.00 -0.22 0.00 0.00 54.13 52.39 3h6o s LEU 473 Cb -0.08 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 3h6o s LEU 473 CO 0.00 -0.49 1.02 0.00 -1.32 0.00 0.00 176.35 175.56 3h6o n LYS 475 N 4.11 2.06 -2.24 0.00 5.02 -1.26 -4.26 118.16 121.59 3h6o n LYS 475 Ca 0.07 -2.11 -0.39 0.00 -2.02 0.00 0.00 58.31 53.86 3h6o n LYS 475 Cb 0.50 -1.28 -0.02 0.00 -0.02 0.00 0.00 35.03 34.20 3h6o n LYS 475 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3h6o s ASP 476 N -2.04 6.64 0.90 4.39 -0.00 -1.26 -5.00 116.67 120.30 3h6o s ASP 476 Ca 0.18 2.46 -0.11 0.00 -0.00 0.00 0.00 52.55 55.09 3h6o s ASP 476 Cb 0.16 -2.63 0.13 0.00 -0.00 0.00 0.00 42.92 40.58 3h6o s ASP 476 CO 0.02 -0.60 1.13 -0.81 -0.00 0.00 0.00 175.17 174.90 3h6o n PRO 477 N 0.39 -0.32 -2.29 8.23 -0.04 -1.26 -4.92 135.00 134.79 3h6o n PRO 477 Ca 0.02 -0.02 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 3h6o n PRO 477 Cb 0.45 -2.37 -0.02 0.00 -0.04 0.00 0.00 33.50 31.52 3h6o n PRO 477 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3h6o s VAL 478 N -2.52 4.01 0.47 0.52 1.01 -1.26 -5.00 120.40 117.63 3h6o s VAL 478 Ca 0.68 1.27 -0.22 0.00 0.00 0.00 0.00 61.98 63.71 3h6o s VAL 478 Cb -0.24 -3.82 -0.08 0.00 0.00 0.00 0.00 36.38 32.24 3h6o s VAL 478 CO 0.57 -0.08 1.11 -1.10 0.00 0.00 0.00 175.10 175.60 3h6o s GLN 479 N 3.28 3.78 0.20 2.72 -1.52 -1.26 -4.95 119.66 121.90 3h6o s GLN 479 Ca 0.61 1.61 -0.06 0.00 -1.95 0.00 0.00 55.36 55.57 3h6o s GLN 479 Cb -0.26 -2.30 0.14 0.00 -0.22 0.00 0.00 33.01 30.36 3h6o s GLN 479 CO 0.21 -0.50 1.63 1.49 -0.25 0.00 0.00 175.29 177.87 3h6o h GLU 480 N 1.90 0.90 -6.27 2.91 4.57 -2.00 -3.38 114.58 113.20 3h6o h GLU 480 Ca -0.49 -0.33 -0.59 0.00 -1.18 0.00 0.00 59.36 56.76 3h6o h GLU 480 Cb 1.24 -0.06 -0.10 0.00 -0.16 0.00 0.00 28.75 29.67 3h6o h GLU 480 CO 0.60 0.98 0.66 0.00 -1.18 0.00 0.00 179.01 180.06 3h6o s ALA 481 N -4.76 3.22 0.33 2.92 0.00 -1.26 -4.94 121.76 117.26 3h6o s ALA 481 Ca -0.10 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.15 3h6o s ALA 481 Cb 0.13 -3.70 0.56 0.00 0.00 0.00 0.00 23.12 20.11 3h6o s ALA 481 CO 0.85 -2.10 1.91 2.35 0.00 0.00 0.00 175.76 178.77 3h6o h TRP 482 N 9.11 0.73 -0.68 0.00 7.01 -1.99 -0.49 115.95 129.63 3h6o h TRP 482 Ca -0.24 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 60.76 3h6o h TRP 482 Cb 1.07 -0.23 -0.04 0.00 -2.10 0.00 0.00 29.16 27.86 3h6o h TRP 482 CO 0.89 0.57 0.43 0.00 -2.79 0.00 0.00 178.44 177.54 3h6o h ALA 483 N 1.49 0.90 -0.56 2.65 0.00 -1.94 0.18 119.26 121.98 3h6o h ALA 483 Ca 0.17 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3h6o h ALA 483 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3h6o h ALA 483 CO -0.02 0.19 0.07 0.93 0.00 0.00 0.00 179.25 180.43 3h6o h GLU 484 N 0.83 0.95 -0.85 0.00 5.08 -1.78 -2.01 114.58 116.80 3h6o h GLU 484 Ca 0.28 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3h6o h GLU 484 Cb 0.03 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 3h6o h GLU 484 CO -0.11 0.92 0.48 0.22 -1.00 0.00 0.00 179.01 179.52 3h6o h ASP 485 N 0.84 1.05 -0.13 1.42 3.58 -0.33 0.35 116.42 123.20 3h6o h ASP 485 Ca 0.17 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 3h6o h ASP 485 Cb 0.44 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3h6o h ASP 485 CO 0.02 0.83 0.04 0.58 -2.88 0.00 0.00 179.24 177.83 3h6o h VAL 486 N 1.18 1.17 -0.50 2.25 2.07 -0.60 -3.03 116.25 118.80 3h6o h VAL 486 Ca 0.30 -0.52 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 3h6o h VAL 486 Cb 0.00 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3h6o h VAL 486 CO -0.05 0.16 -0.11 0.44 0.02 0.00 0.00 177.57 178.02 3h6o h ASP 487 N 0.04 0.92 -0.78 0.57 3.32 -0.82 -1.78 116.42 117.89 3h6o h ASP 487 Ca 0.04 -0.30 0.18 0.00 0.02 0.00 0.00 57.03 56.97 3h6o h ASP 487 Cb 0.20 -0.25 -0.12 0.00 0.22 0.00 0.00 39.33 39.38 3h6o h ASP 487 CO -0.00 1.05 0.19 0.25 -1.72 0.00 0.00 179.24 179.00 3h6o h LEU 488 N 0.83 0.00 -0.03 1.55 7.12 -0.34 -0.10 115.31 124.33 3h6o h LEU 488 Ca 0.13 0.16 -0.24 0.00 0.13 0.00 0.00 57.88 58.07 3h6o h LEU 488 Cb 0.65 0.22 -0.01 0.00 -0.53 0.00 0.00 40.66 40.99 3h6o h LEU 488 CO 0.04 -0.07 -1.07 0.03 -0.13 0.00 0.00 178.44 177.25 3h6o h ARG 489 N 0.25 0.21 -0.43 1.25 3.08 -1.30 -1.41 114.38 116.03 3h6o h ARG 489 Ca 0.45 -0.30 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 3h6o h ARG 489 Cb 0.80 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 3h6o h ARG 489 CO -0.55 1.09 0.13 0.28 -1.07 0.00 0.00 179.97 179.85 3h6o h VAL 490 N 0.08 1.22 -0.44 2.04 2.07 -1.05 -2.28 116.25 117.90 3h6o h VAL 490 Ca -0.08 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.62 3h6o h VAL 490 Cb 1.77 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 3h6o h VAL 490 CO 0.17 0.27 -0.01 -1.13 0.02 0.00 0.00 177.57 176.89 3h6o h ASN 491 N 0.56 0.69 -0.45 0.57 -0.00 -0.96 -0.87 115.58 115.12 3h6o h ASN 491 Ca 0.14 -0.16 0.08 0.00 -0.00 0.00 0.00 56.30 56.36 3h6o h ASN 491 Cb 0.28 -0.18 -0.07 0.00 -0.00 0.00 0.00 38.32 38.35 3h6o h ASN 491 CO -0.00 0.76 0.06 0.15 -0.00 0.00 0.00 177.43 178.40 3h6o h PHE 492 N 0.67 0.08 -0.77 0.67 3.57 -1.17 -0.08 116.94 119.92 3h6o h PHE 492 Ca 0.13 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.71 3h6o h PHE 492 Cb 0.43 0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.15 3h6o h PHE 492 CO 0.02 -0.03 0.48 0.00 -2.23 0.00 0.00 178.31 176.54 3h6o h ALA 493 N 1.36 1.03 -0.62 2.41 0.00 -0.77 -0.84 119.26 121.84 3h6o h ALA 493 Ca 0.22 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.14 3h6o h ALA 493 Cb 0.30 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3h6o h ALA 493 CO -0.32 0.24 0.39 0.52 0.00 0.00 0.00 179.25 180.08 3h6o h MET 494 N 0.91 0.76 -0.56 0.00 2.86 -0.49 -1.89 114.93 116.52 3h6o h MET 494 Ca 0.32 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.85 3h6o h MET 494 Cb 0.08 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 3h6o h MET 494 CO -0.14 0.50 0.09 -0.91 1.06 0.00 0.00 176.91 177.52 3h6o h ASN 495 N 0.78 0.85 -0.07 1.22 2.35 -0.51 -2.09 115.58 118.10 3h6o h ASN 495 Ca 0.24 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3h6o h ASN 495 Cb -0.03 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.11 3h6o h ASN 495 CO -0.08 0.86 0.03 0.58 -1.65 0.00 0.00 177.43 177.17 3h6o h VAL 496 N 0.85 1.13 -0.40 2.81 2.07 -0.93 -1.87 116.25 119.90 3h6o h VAL 496 Ca 0.18 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 3h6o h VAL 496 Cb 0.37 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 3h6o h VAL 496 CO 0.01 0.11 -0.04 1.23 0.02 0.00 0.00 177.57 178.89 3h6o h GLY 497 N -0.02 0.72 0.77 2.17 0.00 -1.20 0.18 103.07 105.70 3h6o h GLY 497 Ca 0.02 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 3h6o h GLY 497 CO -0.00 0.45 0.01 0.50 0.00 0.00 0.00 176.54 177.50 3h6o h LYS 498 N 0.63 0.17 -0.59 4.80 1.57 -1.39 0.18 116.57 121.93 3h6o h LYS 498 Ca 0.12 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 3h6o h LYS 498 Cb 0.46 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 3h6o h LYS 498 CO 0.02 0.39 0.04 0.00 -0.57 0.00 0.00 179.45 179.33 3h6o h ALA 499 N 0.77 0.95 0.00 3.86 0.00 -0.96 -2.36 119.26 121.52 3h6o h ALA 499 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3h6o h ALA 499 Cb 0.31 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3h6o h ALA 499 CO 0.00 0.64 0.00 0.00 0.00 0.00 0.00 179.25 179.89 3h6o h ARG 500 N 0.93 0.00 0.00 0.00 2.47 -0.70 -3.47 114.38 113.60 3h6o h ARG 500 Ca 0.18 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 3h6o h ARG 500 Cb 0.48 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.80 3h6o h ARG 500 CO 0.02 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.96 3h6o n GLY 501 N 0.45 0.50 0.15 0.04 0.00 -0.89 -4.94 105.19 100.50 3h6o n GLY 501 Ca 0.02 -0.90 0.03 0.00 0.00 0.00 0.00 46.02 45.17 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 0.00 -2.54 1.61 0.04 -0.91 -3.42 116.94 111.73 3h6o h PHE 502 Ca 0.00 0.00 0.12 0.00 2.80 0.00 0.00 57.97 60.89 3h6o h PHE 502 Cb 0.15 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 3h6o h PHE 502 CO 0.00 0.51 0.50 1.97 -0.60 0.00 0.00 178.31 180.69 3h6o n PHE 503 N -3.32 -1.43 -3.94 -0.55 1.16 -1.14 -4.87 117.46 103.36 3h6o n PHE 503 Ca 0.01 -1.25 -0.09 0.00 -1.87 0.00 0.00 57.45 54.25 3h6o n PHE 503 Cb 0.68 0.61 -0.07 0.00 -1.61 0.00 0.00 39.48 39.09 3h6o n PHE 503 CO 0.00 0.00 0.00 -1.59 -1.87 0.00 0.00 176.76 173.30 3h6o s LYS 504 N -2.05 1.06 0.11 3.97 -2.85 -1.26 -4.07 119.74 114.64 3h6o s LYS 504 Ca 0.20 -1.13 -0.34 0.00 -1.00 0.00 0.00 55.97 53.70 3h6o s LYS 504 Cb -0.03 0.36 -0.18 0.00 -2.06 0.00 0.00 37.83 35.92 3h6o s LYS 504 CO 0.06 -0.37 0.83 1.17 0.10 0.00 0.00 175.35 177.14 3h6o n LYS 505 N -0.17 0.13 0.00 1.78 4.81 -1.26 -1.15 118.16 122.31 3h6o n LYS 505 Ca -0.09 0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 3h6o n LYS 505 Cb 0.63 -1.32 0.00 0.00 0.02 0.00 0.00 35.03 34.36 3h6o n LYS 505 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3h6o n GLY 506 N 1.78 3.05 3.76 3.14 0.00 -0.01 -4.94 105.19 111.97 3h6o n GLY 506 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.41 5.73 -0.10 1.61 1.11 -0.30 -4.60 116.67 119.71 3h6o s ASP 507 Ca 0.00 2.51 -0.12 0.00 0.18 0.00 0.00 52.55 55.12 3h6o s ASP 507 Cb 0.00 -2.62 -0.05 0.00 1.07 0.00 0.00 42.92 41.33 3h6o s ASP 507 CO 0.00 -1.24 0.28 0.68 1.18 0.00 0.00 175.17 176.07 3h6o s VAL 508 N -1.44 5.28 0.16 -1.27 -7.23 -1.26 0.36 120.40 115.00 3h6o s VAL 508 Ca 0.68 0.53 0.02 0.00 -1.81 0.00 0.00 61.98 61.39 3h6o s VAL 508 Cb -0.34 -3.58 -0.05 0.00 0.56 0.00 0.00 36.38 32.98 3h6o s VAL 508 CO 0.40 0.52 -0.01 0.68 -0.31 0.00 0.00 175.10 176.39 3h6o s VAL 509 N -0.49 0.69 -0.14 1.32 -7.23 -0.12 -2.20 120.40 112.23 3h6o s VAL 509 Ca 0.18 -1.98 -0.04 0.00 -1.81 0.00 0.00 61.98 58.33 3h6o s VAL 509 Cb -0.14 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 3h6o s VAL 509 CO 0.07 -0.53 -0.01 -0.63 -0.31 0.00 0.00 175.10 173.69 3h6o s ILE 510 N -3.64 4.17 -0.11 -0.62 -1.09 -0.26 -1.97 121.20 117.68 3h6o s ILE 510 Ca 0.22 -0.27 0.03 0.00 -2.23 0.00 0.00 60.65 58.40 3h6o s ILE 510 Cb 0.06 -2.81 0.01 0.00 -1.58 0.00 0.00 42.46 38.14 3h6o s ILE 510 CO 0.03 0.52 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.37 3h6o s VAL 511 N -0.01 1.80 -0.22 2.92 1.01 -0.18 0.93 120.40 126.64 3h6o s VAL 511 Ca 0.02 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 3h6o s VAL 511 Cb -0.13 -1.59 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3h6o s VAL 511 CO 0.02 0.50 -0.03 -0.76 0.00 0.00 0.00 175.10 174.83 3h6o s LEU 512 N 0.69 2.95 0.34 3.92 2.01 0.38 -1.31 118.68 127.65 3h6o s LEU 512 Ca -0.12 -0.37 0.04 0.00 0.01 0.00 0.00 54.13 53.70 3h6o s LEU 512 Cb -0.16 -1.75 -0.03 0.00 0.01 0.00 0.00 46.19 44.25 3h6o s LEU 512 CO 0.02 -0.01 0.19 0.42 1.01 0.00 0.00 176.35 177.98 3h6o s THR 513 N 1.43 0.28 0.47 5.49 -4.23 -0.06 -2.36 115.64 116.66 3h6o s THR 513 Ca 0.05 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.60 3h6o s THR 513 Cb -0.14 -2.46 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 3h6o s THR 513 CO -0.02 0.00 0.07 -0.83 -0.54 0.00 0.00 174.62 173.30 3h6o s GLY 514 N -3.43 2.72 0.04 3.99 0.00 -1.26 -0.87 107.32 108.51 3h6o s GLY 514 Ca 0.34 -1.24 0.23 0.00 0.00 0.00 0.00 44.72 44.05 3h6o s GLY 514 CO 0.20 -2.11 1.11 -2.67 0.00 0.00 0.00 173.10 169.63 3h6o n TRP 515 N -1.23 0.20 -3.72 1.90 4.27 -0.97 -4.86 117.44 113.03 3h6o n TRP 515 Ca -0.11 0.06 -0.10 0.00 -3.89 0.00 0.00 57.50 53.46 3h6o n TRP 515 Cb 0.66 -0.36 -0.03 0.00 -1.36 0.00 0.00 31.31 30.22 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 -3.13 1.40 0.92 -2.67 1.70 -1.26 -5.17 118.95 110.74 3h6o s ARG 516 Ca 0.06 -0.84 -0.11 0.00 -0.47 0.00 0.00 55.73 54.37 3h6o s ARG 516 Cb 0.15 0.53 0.15 0.00 -0.57 0.00 0.00 34.95 35.21 3h6o s ARG 516 CO 0.78 -0.60 1.10 -1.25 -1.08 0.00 0.00 175.30 174.25 3h6o s PRO 517 N -3.86 1.00 0.00 3.89 0.04 -1.26 -4.81 135.00 130.00 3h6o s PRO 517 Ca 0.09 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.25 3h6o s PRO 517 Cb -0.01 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.77 3h6o s PRO 517 CO -0.03 -2.50 0.00 0.41 0.04 0.00 0.00 177.00 174.92 3h6o n GLY 518 N -0.39 -0.38 3.73 0.56 0.00 -1.26 -4.96 105.19 102.49 3h6o n GLY 518 Ca 0.08 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 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 -1.91 4.61 0.00 1.61 0.01 -1.26 -4.18 113.70 112.59 3h6o s SER 519 Ca 0.00 2.50 0.00 0.00 1.31 0.00 0.00 55.95 59.76 3h6o s SER 519 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 3h6o s SER 519 CO 0.00 -1.99 0.00 0.61 0.41 0.00 0.00 173.24 172.27 3h6o n GLY 520 N 0.67 0.62 0.38 3.44 0.00 -1.26 -4.93 105.19 104.10 3h6o n GLY 520 Ca 0.15 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.72 0.32 -1.69 1.61 3.72 -1.26 -4.91 117.46 112.53 3h6o n PHE 521 Ca 0.00 -0.64 -0.42 0.00 -0.05 0.00 0.00 57.45 56.33 3h6o n PHE 521 Cb 0.00 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.41 3h6o n PHE 521 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3h6o n THR 522 N -0.30 0.30 -1.49 4.37 -1.04 -1.26 -2.29 114.28 112.56 3h6o n THR 522 Ca 0.10 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 3h6o n THR 522 Cb 0.48 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 66.90 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 5.32 0.00 -4.08 8.00 6.94 -0.70 -3.76 115.26 126.98 3h6o n ASN 523 Ca 0.18 -0.75 -0.32 0.00 -0.02 0.00 0.00 54.58 53.67 3h6o n ASN 523 Cb 0.37 0.00 -0.16 0.00 -2.36 0.00 0.00 39.78 37.62 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 1.86 -0.06 5.53 2.01 -0.05 -4.96 115.64 119.97 3h6o s THR 524 Ca 0.00 -0.82 0.03 0.00 0.31 0.00 0.00 61.69 61.21 3h6o s THR 524 Cb 0.00 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.78 3h6o s THR 524 CO 0.00 0.51 -0.14 -0.32 -0.69 0.00 0.00 174.62 173.97 3h6o s MET 525 N 1.35 2.64 -0.01 4.92 1.75 -1.26 -0.88 119.30 127.81 3h6o s MET 525 Ca 0.05 -0.70 0.01 0.00 -1.25 0.00 0.00 55.69 53.80 3h6o s MET 525 Cb -0.13 -2.41 0.01 0.00 2.84 0.00 0.00 34.83 35.14 3h6o s MET 525 CO -0.12 0.56 -0.03 1.03 -0.65 0.00 0.00 175.02 175.81 3h6o s ARG 526 N -0.55 0.35 -0.24 4.11 0.52 -0.43 -4.97 118.95 117.73 3h6o s ARG 526 Ca 0.08 -0.07 -0.13 0.00 -0.52 0.00 0.00 55.73 55.08 3h6o s ARG 526 Cb -0.11 -0.40 -0.04 0.00 0.52 0.00 0.00 34.95 34.91 3h6o s ARG 526 CO 0.01 0.01 0.27 0.08 0.02 0.00 0.00 175.30 175.69 3h6o s VAL 527 N 0.31 5.27 0.03 3.52 1.01 -1.26 -1.01 120.40 128.26 3h6o s VAL 527 Ca -0.03 0.38 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 3h6o s VAL 527 Cb -0.06 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 3h6o s VAL 527 CO -0.01 0.27 0.10 0.68 0.00 0.00 0.00 175.10 176.14 3h6o s VAL 528 N 1.46 0.12 0.37 2.92 -7.23 -0.83 -4.99 120.40 112.23 3h6o s VAL 528 Ca 0.12 -1.00 -0.25 0.00 -1.81 0.00 0.00 61.98 59.04 3h6o s VAL 528 Cb -0.15 -0.77 -0.09 0.00 0.56 0.00 0.00 36.38 35.93 3h6o s VAL 528 CO 0.08 -0.55 1.03 -2.16 -0.31 0.00 0.00 175.10 173.19 3h6o s PRO 529 N -2.31 4.29 0.10 4.82 0.04 -1.26 -0.95 135.00 139.73 3h6o s PRO 529 Ca -0.07 1.50 -0.31 0.00 0.04 0.00 0.00 61.00 62.16 3h6o s PRO 529 Cb -0.03 -2.64 -0.09 0.00 0.04 0.00 0.00 34.50 31.77 3h6o s PRO 529 CO -0.03 -0.03 1.74 0.08 0.04 0.00 0.00 177.00 178.80 3h6o s VAL 530 N -1.61 2.74 -2.00 -0.36 1.01 0.16 -4.88 120.40 115.45 3h6o s VAL 530 Ca 0.55 0.25 0.30 0.00 0.00 0.00 0.00 61.98 63.08 3h6o s VAL 530 Cb -0.22 -3.16 0.85 0.00 0.00 0.00 0.00 36.38 33.85 3h6o s VAL 530 CO 0.28 0.00 2.12 -0.81 0.00 0.00 0.00 175.10 176.69