#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bag s THR 2 N 0.00 -0.46 0.74 1.96 2.01 -1.26 -3.49 115.64 115.13 1bag s THR 2 Ca 0.00 -0.14 -0.11 0.00 0.31 0.00 0.00 61.69 61.76 1bag s THR 2 Cb 0.00 -0.77 0.04 0.00 0.01 0.00 0.00 72.50 71.77 1bag s THR 2 CO 0.00 -0.20 1.08 0.00 -0.69 0.00 0.00 174.62 174.81 1bag s ALA 3 N 2.43 2.41 -1.36 7.40 0.00 -1.26 -4.93 121.76 126.45 1bag s ALA 3 Ca 0.10 0.22 0.06 0.00 0.00 0.00 0.00 51.96 52.34 1bag s ALA 3 Cb -0.15 -3.24 0.29 0.00 0.00 0.00 0.00 23.12 20.02 1bag s ALA 3 CO -0.16 -1.55 1.06 -0.35 0.00 0.00 0.00 175.76 174.76 1bag n PRO 4 N -3.33 0.07 -3.50 0.00 -0.04 -1.26 -4.72 135.00 122.22 1bag n PRO 4 Ca 0.09 0.26 -0.12 0.00 -0.04 0.00 0.00 63.50 63.68 1bag n PRO 4 Cb 0.53 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 1bag n PRO 4 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1bag s SER 5 N -2.64 -0.49 0.32 3.54 1.04 -1.26 -5.03 113.70 109.18 1bag s SER 5 Ca 0.05 0.23 0.04 0.00 0.48 0.00 0.00 55.95 56.76 1bag s SER 5 Cb 0.04 0.46 0.66 0.00 0.10 0.00 0.00 66.02 67.28 1bag s SER 5 CO 0.09 -0.66 1.88 0.40 0.98 0.00 0.00 173.24 175.92 1bag h ILE 6 N 2.32 0.93 0.00 -1.02 2.04 -1.91 -2.08 117.51 117.79 1bag h ILE 6 Ca -0.26 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 1bag h ILE 6 Cb 1.22 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1bag h ILE 6 CO 0.35 0.16 -0.18 0.50 0.00 0.00 0.00 178.15 178.97 1bag h LYS 7 N 0.87 0.00 -0.37 2.37 1.63 -1.96 -2.46 116.57 116.66 1bag h LYS 7 Ca 0.44 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.24 1bag h LYS 7 Cb 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1bag h LYS 7 CO -0.20 0.18 0.00 0.43 -3.45 0.00 0.00 179.45 176.41 1bag n SER 8 N -4.11 2.93 -1.55 4.20 7.64 -0.79 -4.52 113.62 117.41 1bag n SER 8 Ca -0.02 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.93 1bag n SER 8 Cb 0.26 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1bag n SER 8 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bag n GLY 9 N 1.39 4.55 3.52 0.23 0.00 -0.93 -4.61 105.19 109.35 1bag n GLY 9 Ca 0.19 -2.16 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 1bag n GLY 9 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bag s THR 10 N -0.28 3.60 -0.18 2.61 -4.23 -1.26 -4.26 115.64 111.64 1bag s THR 10 Ca 0.00 -0.50 -0.08 0.00 -1.18 0.00 0.00 61.69 59.94 1bag s THR 10 Cb 0.00 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 1bag s THR 10 CO 0.00 0.56 0.08 -0.63 -0.54 0.00 0.00 174.62 174.09 1bag s ILE 11 N -0.37 4.92 -0.22 2.99 1.01 -0.41 -2.24 121.20 126.89 1bag s ILE 11 Ca 0.05 0.01 -0.17 0.00 0.00 0.00 0.00 60.65 60.55 1bag s ILE 11 Cb -0.12 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.09 1bag s ILE 11 CO 0.02 0.47 0.44 -0.22 0.00 0.00 0.00 174.94 175.65 1bag s LEU 12 N 0.28 4.13 -0.80 2.97 2.96 -0.86 -0.31 118.68 127.05 1bag s LEU 12 Ca 0.05 0.53 -0.21 0.00 -0.22 0.00 0.00 54.13 54.28 1bag s LEU 12 Cb -0.12 -2.57 0.09 0.00 0.50 0.00 0.00 46.19 44.09 1bag s LEU 12 CO -0.00 -0.14 1.07 -2.28 -1.32 0.00 0.00 176.35 173.68 1bag s HIS 13 N 1.59 2.84 -1.11 5.38 5.65 0.16 -0.61 115.29 129.19 1bag s HIS 13 Ca 0.20 -0.91 -0.18 0.00 0.25 0.00 0.00 55.06 54.42 1bag s HIS 13 Cb -0.15 -4.32 -0.06 0.00 -1.18 0.00 0.00 32.58 26.87 1bag s HIS 13 CO 0.09 -1.61 2.08 0.00 -0.65 0.00 0.00 174.74 174.64 1bag n ALA 14 N 7.34 4.42 -1.68 1.58 0.00 -0.26 -2.46 120.51 129.47 1bag n ALA 14 Ca 0.10 -3.60 -0.43 0.00 0.00 0.00 0.00 53.44 49.52 1bag n ALA 14 Cb 0.47 -3.59 -0.03 0.00 0.00 0.00 0.00 19.45 16.30 1bag n ALA 14 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1bag s TRP 15 N 4.11 1.28 -0.62 0.00 -0.00 -1.26 -2.18 118.94 120.28 1bag s TRP 15 Ca 0.52 0.47 0.00 0.00 -0.00 0.00 0.00 56.10 57.09 1bag s TRP 15 Cb 0.14 -3.98 0.00 0.00 -0.00 0.00 0.00 33.47 29.63 1bag s TRP 15 CO 0.02 -4.03 0.00 0.09 -0.00 0.00 0.00 176.95 173.03 1bag n ASN 16 N 11.11 -4.04 -4.72 5.86 3.02 -1.26 -4.84 115.26 120.39 1bag n ASN 16 Ca 0.28 0.14 -0.41 0.00 -0.03 0.00 0.00 54.58 54.56 1bag n ASN 16 Cb 0.45 -2.05 -0.04 0.00 -0.61 0.00 0.00 39.78 37.53 1bag n ASN 16 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1bag s TRP 17 N -2.10 3.66 0.79 3.10 0.52 -0.93 0.15 118.94 124.13 1bag s TRP 17 Ca 0.00 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.55 1bag s TRP 17 Cb 0.00 -2.98 0.07 0.00 -1.15 0.00 0.00 33.47 29.41 1bag s TRP 17 CO 0.00 0.07 1.09 -1.54 0.02 0.00 0.00 176.95 176.59 1bag s SER 18 N 0.73 4.45 0.24 2.95 1.04 -0.45 -4.78 113.70 117.88 1bag s SER 18 Ca 0.45 1.59 -0.05 0.00 0.48 0.00 0.00 55.95 58.43 1bag s SER 18 Cb -0.20 -2.33 0.35 0.00 0.10 0.00 0.00 66.02 63.94 1bag s SER 18 CO 0.24 -2.04 1.85 -0.26 0.98 0.00 0.00 173.24 174.01 1bag h PHE 19 N -1.13 0.98 -0.56 5.02 0.04 -1.52 -1.50 116.94 118.27 1bag h PHE 19 Ca -0.46 0.03 -0.10 0.00 2.80 0.00 0.00 57.97 60.24 1bag h PHE 19 Cb 1.25 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 39.07 1bag h PHE 19 CO 0.53 0.48 -0.05 -0.91 -0.60 0.00 0.00 178.31 177.75 1bag h ASN 20 N 0.95 1.02 -0.39 2.17 2.35 -1.87 -0.65 115.58 119.16 1bag h ASN 20 Ca 0.38 -0.33 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1bag h ASN 20 Cb 0.21 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1bag h ASN 20 CO -0.19 1.11 0.17 0.74 -1.65 0.00 0.00 177.43 177.61 1bag h THR 21 N 0.91 1.18 0.43 2.81 2.02 -1.72 -1.15 112.91 117.39 1bag h THR 21 Ca 0.15 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1bag h THR 21 Cb 0.62 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1bag h THR 21 CO 0.04 0.20 -0.49 -0.07 0.37 0.00 0.00 175.52 175.57 1bag h LEU 22 N 0.48 -1.37 -0.95 2.58 3.38 -1.08 -0.19 115.31 118.15 1bag h LEU 22 Ca 0.13 0.12 0.27 0.00 0.09 0.00 0.00 57.88 58.49 1bag h LEU 22 Cb 0.16 0.46 -0.14 0.00 0.09 0.00 0.00 40.66 41.23 1bag h LEU 22 CO -0.01 -0.64 0.45 0.50 0.09 0.00 0.00 178.44 178.83 1bag h LYS 23 N -0.94 0.33 0.00 1.13 3.64 -0.94 0.19 116.57 119.97 1bag h LYS 23 Ca -0.05 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 1bag h LYS 23 Cb 0.84 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1bag h LYS 23 CO -0.10 0.22 -0.49 0.45 -2.27 0.00 0.00 179.45 177.26 1bag h HIS 24 N 0.34 0.00 -0.77 1.91 3.86 -0.37 -3.24 115.15 116.88 1bag h HIS 24 Ca 0.64 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 59.52 1bag h HIS 24 Cb 1.35 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.63 1bag h HIS 24 CO -0.10 0.49 0.37 0.09 0.86 0.00 0.00 177.93 179.64 1bag n ASN 25 N -3.46 3.94 -0.07 2.45 3.02 0.64 -4.61 115.26 117.17 1bag n ASN 25 Ca 0.00 -3.47 -0.16 0.00 -0.03 0.00 0.00 54.58 50.92 1bag n ASN 25 Cb 0.62 -0.76 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 1bag n ASN 25 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1bag h MET 26 N 1.63 0.85 -0.45 3.52 2.86 -1.52 -2.19 114.93 119.64 1bag h MET 26 Ca 0.41 -0.58 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1bag h MET 26 Cb 2.43 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 34.15 1bag h MET 26 CO 0.82 1.20 0.16 -0.22 1.06 0.00 0.00 176.91 179.94 1bag h LYS 27 N 0.63 0.68 -0.26 1.72 3.64 -1.87 -2.16 116.57 118.95 1bag h LYS 27 Ca -0.00 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1bag h LYS 27 Cb 1.21 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1bag h LYS 27 CO 0.13 0.64 0.15 -0.44 -2.27 0.00 0.00 179.45 177.66 1bag h ASP 28 N 0.58 0.23 -0.25 4.20 3.32 -1.88 0.44 116.42 123.07 1bag h ASP 28 Ca 0.15 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 1bag h ASP 28 Cb 0.23 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1bag h ASP 28 CO -0.01 0.17 0.09 0.40 -1.72 0.00 0.00 179.24 178.18 1bag h ILE 29 N 0.31 1.14 -0.11 0.35 2.04 -1.35 -0.12 117.51 119.76 1bag h ILE 29 Ca 0.10 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 1bag h ILE 29 Cb 0.01 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1bag h ILE 29 CO -0.06 0.18 -0.09 -0.74 0.00 0.00 0.00 178.15 177.44 1bag h HIS 30 N 0.44 0.30 -0.89 1.37 2.76 -0.70 -2.96 115.15 115.48 1bag h HIS 30 Ca 0.11 -0.08 0.04 0.00 -2.20 0.00 0.00 60.37 58.23 1bag h HIS 30 Cb 0.15 -0.07 -0.05 0.00 1.55 0.00 0.00 27.41 28.99 1bag h HIS 30 CO 0.00 0.65 0.57 -0.44 -1.30 0.00 0.00 177.93 177.41 1bag h ASP 31 N -0.13 0.95 0.23 3.26 3.32 -0.42 -1.08 116.42 122.54 1bag h ASP 31 Ca 0.02 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1bag h ASP 31 Cb 0.58 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1bag h ASP 31 CO 0.02 0.64 0.00 0.00 -1.72 0.00 0.00 179.24 178.19 1bag n ALA 32 N -2.35 1.65 -1.31 3.45 0.00 -0.10 -4.87 120.51 116.97 1bag n ALA 32 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1bag n ALA 32 Cb 0.10 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1bag n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bag n GLY 33 N -0.36 0.62 3.85 0.00 0.00 -0.41 -4.47 105.19 104.42 1bag n GLY 33 Ca 0.05 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 1bag n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bag s TYR 34 N -2.00 3.65 -0.13 1.61 2.02 -1.13 -4.60 117.35 116.77 1bag s TYR 34 Ca 0.00 0.97 0.17 0.00 -0.37 0.00 0.00 57.07 57.85 1bag s TYR 34 Cb 0.00 -2.29 -0.24 0.00 -0.40 0.00 0.00 41.96 39.03 1bag s TYR 34 CO 0.00 0.54 0.38 2.41 -1.57 0.00 0.00 175.55 177.31 1bag n THR 35 N 1.22 1.24 -4.18 -0.71 -1.04 -0.95 -4.72 114.28 105.14 1bag n THR 35 Ca -0.09 -0.77 -0.11 0.00 -2.04 0.00 0.00 64.05 61.04 1bag n THR 35 Cb 0.52 -0.58 -0.10 0.00 -1.82 0.00 0.00 70.33 68.35 1bag n THR 35 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bag s ALA 36 N -2.71 1.02 -0.00 2.41 0.00 -1.23 -1.22 121.76 120.01 1bag s ALA 36 Ca -0.07 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.43 1bag s ALA 36 Cb 0.08 0.68 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1bag s ALA 36 CO 0.84 -0.41 -0.12 0.42 0.00 0.00 0.00 175.76 176.48 1bag s ILE 37 N -3.88 0.97 -0.17 0.00 1.01 0.26 -2.02 121.20 117.37 1bag s ILE 37 Ca 0.22 -0.57 -0.01 0.00 0.00 0.00 0.00 60.65 60.29 1bag s ILE 37 Cb 0.07 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.71 1bag s ILE 37 CO 0.01 0.25 -0.11 -1.58 0.00 0.00 0.00 174.94 173.51 1bag s GLN 38 N -0.37 3.34 0.62 2.79 0.74 0.22 0.87 119.66 127.88 1bag s GLN 38 Ca 0.04 -0.68 0.01 0.00 0.05 0.00 0.00 55.36 54.78 1bag s GLN 38 Cb -0.05 -2.76 0.08 0.00 1.10 0.00 0.00 33.01 31.38 1bag s GLN 38 CO -0.00 0.02 0.87 0.95 -0.55 0.00 0.00 175.29 176.58 1bag s THR 39 N 0.84 2.41 0.73 -0.34 -4.23 -0.37 -1.10 115.64 113.58 1bag s THR 39 Ca -0.03 -0.66 -0.05 0.00 -1.18 0.00 0.00 61.69 59.77 1bag s THR 39 Cb -0.15 -2.74 0.10 0.00 1.34 0.00 0.00 72.50 71.05 1bag s THR 39 CO 0.00 0.00 1.02 -0.44 -0.54 0.00 0.00 174.62 174.66 1bag s SER 40 N -4.57 4.43 -0.13 3.99 0.01 -1.26 -3.76 113.70 112.40 1bag s SER 40 Ca 0.61 0.03 -0.36 0.00 1.31 0.00 0.00 55.95 57.54 1bag s SER 40 Cb -0.08 -0.51 -0.13 0.00 0.21 0.00 0.00 66.02 65.51 1bag s SER 40 CO 0.41 -1.81 1.80 -2.65 0.41 0.00 0.00 173.24 171.40 1bag n PRO 41 N -2.93 1.79 0.00 12.44 -0.02 -1.26 -4.40 135.00 140.63 1bag n PRO 41 Ca 0.12 0.66 0.14 0.00 -2.02 0.00 0.00 63.50 62.40 1bag n PRO 41 Cb 0.60 -2.43 0.66 0.00 -0.02 0.00 0.00 33.50 32.31 1bag n PRO 41 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1bag n ILE 42 N 4.76 0.00 -2.49 4.25 -5.35 -1.26 -4.94 119.36 114.33 1bag n ILE 42 Ca 0.23 -0.10 -0.24 0.00 -0.27 0.00 0.00 62.75 62.37 1bag n ILE 42 Cb 0.23 0.00 0.09 0.00 -1.74 0.00 0.00 39.64 38.23 1bag n ILE 42 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1bag s ASN 43 N -2.22 4.55 -0.05 7.28 4.22 -1.26 -0.08 114.94 127.38 1bag s ASN 43 Ca 0.36 -0.10 -0.30 0.00 -2.14 0.00 0.00 52.86 50.68 1bag s ASN 43 Cb 0.21 -0.42 -0.04 0.00 1.28 0.00 0.00 41.25 42.27 1bag s ASN 43 CO 0.41 -1.71 1.40 -1.58 -2.04 0.00 0.00 177.10 173.57 1bag s GLN 44 N -5.12 4.26 0.39 3.55 0.74 -0.28 -4.44 119.66 118.76 1bag s GLN 44 Ca 0.64 1.91 0.05 0.00 0.05 0.00 0.00 55.36 58.01 1bag s GLN 44 Cb -0.07 -3.69 -0.07 0.00 1.10 0.00 0.00 33.01 30.28 1bag s GLN 44 CO 0.44 -0.64 0.03 0.14 -0.55 0.00 0.00 175.29 174.70 1bag s VAL 45 N 2.91 1.64 -0.68 1.34 -7.23 -1.26 -1.65 120.40 115.48 1bag s VAL 45 Ca 0.63 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.52 1bag s VAL 45 Cb -0.29 -2.85 0.03 0.00 0.56 0.00 0.00 36.38 33.82 1bag s VAL 45 CO 0.24 0.00 1.29 -0.75 -0.31 0.00 0.00 175.10 175.57 1bag s LYS 46 N -3.78 3.27 -1.26 4.82 2.20 0.19 -4.72 119.74 120.46 1bag s LYS 46 Ca 0.33 -0.02 -0.18 0.00 -0.36 0.00 0.00 55.97 55.74 1bag s LYS 46 Cb 0.09 -4.14 0.00 0.00 -1.51 0.00 0.00 37.83 32.27 1bag s LYS 46 CO 0.16 -2.03 1.96 0.39 -0.36 0.00 0.00 175.35 175.47 1bag n GLU 47 N 9.06 2.60 -0.43 4.03 1.02 -1.26 -4.82 120.64 130.83 1bag n GLU 47 Ca 0.06 -2.73 -0.30 0.00 -0.02 0.00 0.00 57.16 54.17 1bag n GLU 47 Cb 0.49 -3.38 0.28 0.00 -0.02 0.00 0.00 31.44 28.81 1bag n GLU 47 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1bag s GLY 48 N 4.34 1.44 -1.53 0.62 0.00 -1.26 -2.09 107.32 108.84 1bag s GLY 48 Ca 0.54 -0.72 -0.01 0.00 0.00 0.00 0.00 44.72 44.53 1bag s GLY 48 CO 0.04 0.24 0.13 0.70 0.00 0.00 0.00 173.10 174.21 1bag n ASN 49 N -5.50 0.51 -3.36 1.64 3.02 -1.26 -0.26 115.26 110.05 1bag n ASN 49 Ca 0.11 -1.21 -0.24 0.00 -0.03 0.00 0.00 54.58 53.21 1bag n ASN 49 Cb 0.59 -1.93 0.01 0.00 -0.61 0.00 0.00 39.78 37.84 1bag n ASN 49 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1bag n GLN 50 N -4.52 -3.95 -1.00 3.52 -0.06 -1.26 -1.89 117.38 108.22 1bag n GLN 50 Ca -0.30 0.58 -0.00 0.00 -2.00 0.00 0.00 57.00 55.28 1bag n GLN 50 Cb 0.68 -5.34 -0.00 0.00 -4.06 0.00 0.00 30.24 21.52 1bag n GLN 50 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1bag n GLY 51 N -1.31 0.16 3.63 1.69 0.00 0.64 -4.95 105.19 105.05 1bag n GLY 51 Ca -0.03 -0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.54 1bag n GLY 51 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bag n ASP 52 N -0.70 2.02 -0.30 1.61 2.03 -0.79 -4.91 116.55 115.51 1bag n ASP 52 Ca -0.00 1.17 0.11 0.00 0.52 0.00 0.00 54.79 56.59 1bag n ASP 52 Cb 0.35 -1.36 0.52 0.00 -0.72 0.00 0.00 41.12 39.91 1bag n ASP 52 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1bag n LYS 53 N 1.15 1.39 -1.73 -0.67 4.76 -1.26 -4.82 118.16 116.98 1bag n LYS 53 Ca 0.10 -0.59 -0.42 0.00 -2.87 0.00 0.00 58.31 54.53 1bag n LYS 53 Cb 0.32 -1.38 -0.01 0.00 -1.84 0.00 0.00 35.03 32.11 1bag n LYS 53 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1bag n SER 54 N -0.22 3.33 -0.05 4.39 7.64 -1.26 -0.68 113.62 126.77 1bag n SER 54 Ca 0.17 1.20 0.24 0.00 1.01 0.00 0.00 58.87 61.48 1bag n SER 54 Cb 0.22 -1.55 0.72 0.00 -1.01 0.00 0.00 64.21 62.59 1bag n SER 54 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1bag h MET 55 N 3.32 0.00 0.00 1.43 4.05 -1.91 0.59 114.93 122.41 1bag h MET 55 Ca -0.48 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 1bag h MET 55 Cb 1.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.06 1bag h MET 55 CO 0.68 0.00 0.00 -1.13 0.23 0.00 0.00 176.91 176.69 1bag n SER 56 N -4.09 0.58 -0.61 1.39 3.41 -1.26 -1.65 113.62 111.39 1bag n SER 56 Ca 0.13 0.70 0.10 0.00 -0.26 0.00 0.00 58.87 59.54 1bag n SER 56 Cb 0.78 -0.80 0.33 0.00 -0.26 0.00 0.00 64.21 64.26 1bag n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1bag n ASN 57 N -2.21 1.84 -0.41 4.04 3.02 0.20 -4.50 115.26 117.23 1bag n ASN 57 Ca 0.00 -1.77 0.33 0.00 -0.03 0.00 0.00 54.58 53.11 1bag n ASN 57 Cb 0.13 -0.14 0.61 0.00 -0.61 0.00 0.00 39.78 39.77 1bag n ASN 57 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1bag h TRP 58 N 2.36 0.58 0.00 3.10 5.08 -1.48 -1.33 115.95 124.26 1bag h TRP 58 Ca 0.00 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.99 1bag h TRP 58 Cb 0.52 -0.15 0.00 0.00 -3.00 0.00 0.00 29.16 26.53 1bag h TRP 58 CO 0.14 -0.16 0.00 0.10 -1.28 0.00 0.00 178.44 177.23 1bag h TYR 59 N 0.15 0.00 0.00 0.12 -0.00 -1.86 -2.71 116.97 112.67 1bag h TYR 59 Ca 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 59.50 1bag h TYR 59 Cb 2.31 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 39.04 1bag h TYR 59 CO -0.01 0.00 0.00 -1.49 -0.00 0.00 0.00 178.16 176.66 1bag h TRP 60 N 0.00 0.00 0.00 0.10 4.06 -1.56 -2.71 115.95 115.84 1bag h TRP 60 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1bag h TRP 60 Cb 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.29 1bag h TRP 60 CO 0.00 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.16 1bag n LEU 61 N -3.03 0.00 -0.58 -4.49 4.77 -1.02 -2.49 117.00 110.16 1bag n LEU 61 Ca -0.00 0.10 0.09 0.00 -0.03 0.00 0.00 56.01 56.16 1bag n LEU 61 Cb 0.25 -0.10 0.21 0.00 -2.33 0.00 0.00 43.42 41.46 1bag n LEU 61 CO 0.25 -0.04 0.65 -1.22 -1.33 0.00 0.00 177.39 175.71 1bag n TYR 62 N -1.10 0.58 -3.80 -1.77 4.02 -1.02 -4.51 117.16 109.56 1bag n TYR 62 Ca 0.13 -0.95 -0.28 0.00 -0.01 0.00 0.00 57.90 56.79 1bag n TYR 62 Cb 0.09 -0.26 -0.12 0.00 -0.02 0.00 0.00 39.34 39.04 1bag n TYR 62 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1bag n GLN 63 N -0.89 1.56 -1.93 -0.72 6.02 -1.04 -4.84 117.38 115.55 1bag n GLN 63 Ca 0.20 -4.26 -0.37 0.00 -0.01 0.00 0.00 57.00 52.56 1bag n GLN 63 Cb 0.80 -2.17 0.04 0.00 1.02 0.00 0.00 30.24 29.92 1bag n GLN 63 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 1bag s PRO 64 N -1.23 3.09 -0.05 -1.09 0.02 -1.26 -0.64 135.00 133.84 1bag s PRO 64 Ca 0.27 2.00 0.02 0.00 0.02 0.00 0.00 61.00 63.31 1bag s PRO 64 Cb -0.02 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.35 1bag s PRO 64 CO -0.17 -1.16 -0.01 0.25 -0.33 0.00 0.00 177.00 175.57 1bag n THR 65 N -1.27 0.30 -3.58 0.99 -2.24 -0.66 -0.23 114.28 107.59 1bag n THR 65 Ca 0.12 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.63 1bag n THR 65 Cb 0.47 -0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 67.86 1bag n THR 65 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bag s SER 66 N -3.98 -0.36 -0.42 3.42 1.04 -1.21 -0.98 113.70 111.21 1bag s SER 66 Ca -0.04 -0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.31 1bag s SER 66 Cb 0.02 0.50 0.42 0.00 0.10 0.00 0.00 66.02 67.06 1bag s SER 66 CO 0.15 -0.82 1.86 -1.22 0.98 0.00 0.00 173.24 174.19 1bag n TYR 67 N -0.01 2.38 -2.73 5.02 4.02 -1.26 -3.55 117.16 121.03 1bag n TYR 67 Ca -0.17 -2.03 -0.31 0.00 -0.01 0.00 0.00 57.90 55.38 1bag n TYR 67 Cb 0.63 -1.00 -0.04 0.00 -0.02 0.00 0.00 39.34 38.91 1bag n TYR 67 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1bag s GLN 68 N -2.69 3.90 0.04 -0.72 -1.52 -1.26 -4.87 119.66 112.55 1bag s GLN 68 Ca 0.46 0.72 -0.15 0.00 -1.95 0.00 0.00 55.36 54.44 1bag s GLN 68 Cb 0.37 -2.29 -0.06 0.00 -0.22 0.00 0.00 33.01 30.81 1bag s GLN 68 CO 0.04 -0.09 0.46 0.42 -0.25 0.00 0.00 175.29 175.87 1bag s ILE 69 N -2.39 4.95 0.00 1.08 1.01 -1.26 -1.12 121.20 123.47 1bag s ILE 69 Ca 0.55 0.87 0.00 0.00 0.00 0.00 0.00 60.65 62.07 1bag s ILE 69 Cb -0.10 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1bag s ILE 69 CO 0.28 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.33 1bag n GLY 70 N 1.56 2.93 3.43 6.18 0.00 0.89 -4.07 105.19 116.12 1bag n GLY 70 Ca -0.11 -1.49 -0.11 0.00 0.00 0.00 0.00 46.02 44.30 1bag n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bag s ASN 71 N 0.00 -0.45 0.48 1.61 2.20 0.15 -3.08 114.94 115.84 1bag s ASN 71 Ca 0.00 -0.14 0.13 0.00 -0.94 0.00 0.00 52.86 51.90 1bag s ASN 71 Cb 0.00 0.58 1.11 0.00 -2.00 0.00 0.00 41.25 40.94 1bag s ASN 71 CO 0.00 -0.97 2.11 -0.09 -2.94 0.00 0.00 177.10 175.21 1bag h ARG 72 N 2.10 0.21 -0.01 3.55 2.43 -1.93 0.32 114.38 121.05 1bag h ARG 72 Ca -0.33 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.82 1bag h ARG 72 Cb 1.29 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1bag h ARG 72 CO 0.39 0.14 -0.04 1.88 -1.51 0.00 0.00 179.97 180.83 1bag h TYR 73 N 0.22 0.06 0.02 2.20 0.05 -1.95 -3.39 116.97 114.18 1bag h TYR 73 Ca 0.07 -0.02 -0.36 0.00 0.05 0.00 0.00 58.73 58.46 1bag h TYR 73 Cb 0.01 -0.01 -0.06 0.00 1.01 0.00 0.00 36.73 37.68 1bag h TYR 73 CO -0.00 0.68 -2.25 1.28 -1.05 0.00 0.00 178.16 176.82 1bag n LEU 74 N -4.74 1.59 0.00 3.88 4.77 -1.22 -4.25 117.00 117.03 1bag n LEU 74 Ca -0.09 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1bag n LEU 74 Cb 0.34 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1bag n LEU 74 CO 0.35 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1bag n GLY 75 N 1.94 0.78 3.96 -0.72 0.00 0.11 -1.26 105.19 110.00 1bag n GLY 75 Ca -0.35 -2.02 -0.22 0.00 0.00 0.00 0.00 46.02 43.42 1bag n GLY 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bag s THR 76 N -1.56 4.20 0.27 2.61 -4.23 -1.26 0.33 115.64 116.00 1bag s THR 76 Ca 0.00 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 59.90 1bag s THR 76 Cb 0.00 -3.53 0.27 0.00 1.34 0.00 0.00 72.50 70.58 1bag s THR 76 CO 0.00 -0.34 1.88 -0.08 -0.54 0.00 0.00 174.62 175.54 1bag h GLU 77 N 0.55 1.15 -0.59 3.99 4.81 -1.93 0.09 114.58 122.64 1bag h GLU 77 Ca -0.47 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 58.66 1bag h GLU 77 Cb 1.25 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 1bag h GLU 77 CO 0.57 0.76 0.25 0.37 -0.73 0.00 0.00 179.01 180.23 1bag h GLN 78 N 1.18 0.87 -0.62 1.92 5.75 -1.95 0.60 115.11 122.86 1bag h GLN 78 Ca 0.44 -0.15 -0.03 0.00 -0.15 0.00 0.00 58.65 58.76 1bag h GLN 78 Cb 0.17 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.55 1bag h GLN 78 CO -0.18 0.73 0.29 0.93 -2.65 0.00 0.00 178.83 177.96 1bag h GLU 79 N 0.81 0.90 -0.01 1.69 5.08 -1.66 0.24 114.58 121.64 1bag h GLU 79 Ca 0.20 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1bag h GLU 79 Cb 0.17 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1bag h GLU 79 CO -0.02 0.73 -0.09 0.35 -1.00 0.00 0.00 179.01 178.99 1bag h PHE 80 N 0.86 -0.22 -0.88 4.33 3.57 -0.60 0.20 116.94 124.19 1bag h PHE 80 Ca 0.21 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.78 1bag h PHE 80 Cb 0.14 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.92 1bag h PHE 80 CO 0.00 -0.14 0.55 0.87 -2.23 0.00 0.00 178.31 177.37 1bag h LYS 81 N -0.15 0.98 -0.30 1.11 1.57 -0.33 0.05 116.57 119.51 1bag h LYS 81 Ca 0.04 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 1bag h LYS 81 Cb 0.20 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1bag h LYS 81 CO -0.10 0.65 -0.29 0.93 -0.57 0.00 0.00 179.45 180.07 1bag h GLU 82 N 1.01 0.62 -0.33 3.15 5.08 0.14 -2.63 114.58 121.61 1bag h GLU 82 Ca 0.38 -0.26 -0.14 0.00 -1.00 0.00 0.00 59.36 58.34 1bag h GLU 82 Cb 0.17 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1bag h GLU 82 CO -0.17 0.84 -0.37 1.98 -1.00 0.00 0.00 179.01 180.29 1bag h MET 83 N 0.53 0.78 -0.11 2.33 4.05 0.53 -1.70 114.93 121.34 1bag h MET 83 Ca 0.07 -0.39 -0.05 0.00 -0.28 0.00 0.00 59.70 59.04 1bag h MET 83 Cb 0.77 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.56 1bag h MET 83 CO 0.06 1.02 -0.17 0.00 0.23 0.00 0.00 176.91 178.06 1bag h ALA 85 N 1.67 0.29 -0.28 0.00 0.00 -1.21 -1.97 119.26 117.77 1bag h ALA 85 Ca 0.03 -0.70 -0.11 0.00 0.00 0.00 0.00 54.91 54.13 1bag h ALA 85 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1bag h ALA 85 CO 0.03 0.77 -0.30 0.00 0.00 0.00 0.00 179.25 179.75 1bag h ALA 86 N 0.64 0.95 -0.19 0.00 0.00 -0.85 -2.12 119.26 117.68 1bag h ALA 86 Ca -0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1bag h ALA 86 Cb 1.61 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1bag h ALA 86 CO 0.18 0.61 0.04 0.00 0.00 0.00 0.00 179.25 180.08 1bag h ALA 87 N 1.17 0.26 0.00 0.00 0.00 -0.92 -2.51 119.26 117.26 1bag h ALA 87 Ca 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1bag h ALA 87 Cb 0.77 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1bag h ALA 87 CO 0.06 -0.09 -0.01 1.49 0.00 0.00 0.00 179.25 180.70 1bag h GLU 88 N 0.12 0.00 0.00 0.00 4.81 -1.14 -1.09 114.58 117.28 1bag h GLU 88 Ca 0.06 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1bag h GLU 88 Cb 0.28 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 1bag h GLU 88 CO 0.00 0.01 -0.06 1.49 -0.73 0.00 0.00 179.01 179.73 1bag h GLU 89 N 0.00 0.00 -0.13 1.92 4.57 -0.91 -1.60 114.58 118.44 1bag h GLU 89 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1bag h GLU 89 Cb 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1bag h GLU 89 CO 0.00 0.06 0.00 0.66 -1.18 0.00 0.00 179.01 178.55 1bag n TYR 90 N -3.70 0.43 -1.48 0.92 4.02 -0.55 -4.97 117.16 111.82 1bag n TYR 90 Ca -0.02 -0.91 -0.13 0.00 -0.01 0.00 0.00 57.90 56.83 1bag n TYR 90 Cb 0.16 -0.21 -0.05 0.00 -0.02 0.00 0.00 39.34 39.22 1bag n TYR 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1bag n GLY 91 N -0.93 1.14 3.80 2.72 0.00 -0.60 -4.99 105.19 106.34 1bag n GLY 91 Ca 0.17 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 1bag n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bag s ILE 92 N -2.49 4.98 0.18 -0.61 1.01 -0.52 -4.95 121.20 118.80 1bag s ILE 92 Ca 0.00 0.97 -0.01 0.00 0.00 0.00 0.00 60.65 61.62 1bag s ILE 92 Cb 0.00 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1bag s ILE 92 CO 0.00 0.52 0.36 -0.54 0.00 0.00 0.00 174.94 175.27 1bag s LYS 93 N -0.70 3.51 -0.12 2.79 -0.14 -0.36 -3.61 119.74 121.11 1bag s LYS 93 Ca 0.26 -0.36 0.00 0.00 -1.36 0.00 0.00 55.97 54.50 1bag s LYS 93 Cb -0.17 -2.87 -0.02 0.00 -1.68 0.00 0.00 37.83 33.09 1bag s LYS 93 CO 0.14 0.44 -0.13 0.08 -0.76 0.00 0.00 175.35 175.12 1bag s VAL 94 N -1.80 3.07 -0.10 3.17 1.01 -1.26 -0.58 120.40 123.91 1bag s VAL 94 Ca 0.38 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.71 1bag s VAL 94 Cb -0.11 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1bag s VAL 94 CO 0.28 0.53 -0.16 -0.63 0.00 0.00 0.00 175.10 175.12 1bag s ILE 95 N 0.22 2.78 -0.15 2.22 1.01 0.25 -0.36 121.20 127.17 1bag s ILE 95 Ca -0.08 -0.78 -0.04 0.00 0.00 0.00 0.00 60.65 59.75 1bag s ILE 95 Cb -0.15 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 1bag s ILE 95 CO 0.05 0.55 -0.02 -0.69 0.00 0.00 0.00 174.94 174.83 1bag s VAL 96 N 0.09 4.08 -0.60 2.92 1.01 -0.04 -1.24 120.40 126.63 1bag s VAL 96 Ca -0.07 -0.29 -0.28 0.00 0.00 0.00 0.00 61.98 61.33 1bag s VAL 96 Cb -0.15 -2.79 0.03 0.00 0.00 0.00 0.00 36.38 33.47 1bag s VAL 96 CO 0.05 0.50 1.23 -0.62 0.00 0.00 0.00 175.10 176.26 1bag s ASP 97 N 0.21 6.37 -0.44 3.32 -1.08 -1.25 -1.13 116.67 122.68 1bag s ASP 97 Ca -0.01 0.05 -0.15 0.00 -0.52 0.00 0.00 52.55 51.92 1bag s ASP 97 Cb -0.13 -2.55 0.04 0.00 -1.46 0.00 0.00 42.92 38.81 1bag s ASP 97 CO 0.02 -1.56 0.34 0.00 0.52 0.00 0.00 175.17 174.50 1bag s ALA 98 N 5.19 3.51 -1.12 3.66 0.00 -0.50 -4.04 121.76 128.46 1bag s ALA 98 Ca 0.43 -1.89 -0.16 0.00 0.00 0.00 0.00 51.96 50.34 1bag s ALA 98 Cb -0.08 -2.97 0.14 0.00 0.00 0.00 0.00 23.12 20.22 1bag s ALA 98 CO 0.24 -1.57 1.37 0.08 0.00 0.00 0.00 175.76 175.88 1bag s VAL 99 N 1.66 4.79 -0.33 0.00 1.01 -1.26 -2.18 120.40 124.09 1bag s VAL 99 Ca 0.05 -2.14 0.16 0.00 0.00 0.00 0.00 61.98 60.04 1bag s VAL 99 Cb -0.21 -4.91 0.55 0.00 0.00 0.00 0.00 36.38 31.80 1bag s VAL 99 CO 0.09 -1.65 1.45 2.30 0.00 0.00 0.00 175.10 177.29 1bag n ILE 100 N 5.18 2.16 -0.00 2.22 -5.35 -1.26 -4.47 119.36 117.84 1bag n ILE 100 Ca 0.34 -1.68 0.09 0.00 -0.27 0.00 0.00 62.75 61.23 1bag n ILE 100 Cb 0.45 -0.14 -0.15 0.00 -1.74 0.00 0.00 39.64 38.07 1bag n ILE 100 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1bag n ASN 101 N -0.16 0.12 -3.35 7.28 5.15 -1.26 -4.91 115.26 118.12 1bag n ASN 101 Ca 0.21 0.05 -0.10 0.00 -0.60 0.00 0.00 54.58 54.13 1bag n ASN 101 Cb 0.87 1.70 -0.01 0.00 -0.53 0.00 0.00 39.78 41.80 1bag n ASN 101 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1bag s HIS 102 N -3.40 0.38 0.00 1.20 -3.43 -1.26 -2.15 115.29 106.62 1bag s HIS 102 Ca -0.07 -0.84 0.00 0.00 -0.80 0.00 0.00 55.06 53.35 1bag s HIS 102 Cb 0.13 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1bag s HIS 102 CO 0.89 -1.30 0.00 0.25 -2.00 0.00 0.00 174.74 172.58 1bag n THR 103 N -0.50 0.00 -0.91 -5.38 -2.24 -0.73 -4.60 114.28 99.91 1bag n THR 103 Ca -0.04 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.45 1bag n THR 103 Cb 0.61 0.00 0.23 0.00 -2.10 0.00 0.00 70.33 69.06 1bag n THR 103 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1bag s THR 104 N -0.71 1.77 -0.12 4.28 -1.32 0.68 -3.76 115.64 116.45 1bag s THR 104 Ca 0.00 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.65 1bag s THR 104 Cb 0.00 -2.35 -0.18 0.00 -1.51 0.00 0.00 72.50 68.46 1bag s THR 104 CO 0.00 0.00 0.66 2.22 -2.21 0.00 0.00 174.62 175.29 1bag n PHE 105 N -4.73 0.73 -2.32 9.09 -1.74 -1.26 -2.81 117.46 114.43 1bag n PHE 105 Ca 0.08 0.25 -0.39 0.00 -0.56 0.00 0.00 57.45 56.83 1bag n PHE 105 Cb 0.58 -1.02 -0.03 0.00 1.52 0.00 0.00 39.48 40.52 1bag n PHE 105 CO 0.00 0.00 0.00 0.34 -0.56 0.00 0.00 176.76 176.54 1bag s ASP 106 N -5.63 5.78 0.38 5.98 -1.08 -1.26 -4.82 116.67 116.02 1bag s ASP 106 Ca -0.05 -0.30 0.11 0.00 -0.52 0.00 0.00 52.55 51.79 1bag s ASP 106 Cb 0.09 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.88 1bag s ASP 106 CO 0.82 -2.09 1.90 0.22 0.52 0.00 0.00 175.17 176.54 1bag h TYR 107 N 11.92 0.70 0.00 -5.34 3.20 -1.98 -0.81 116.97 124.66 1bag h TYR 107 Ca -0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.71 1bag h TYR 107 Cb 1.08 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.13 1bag h TYR 107 CO 1.12 0.28 0.00 0.00 -1.64 0.00 0.00 178.16 177.92 1bag n ALA 108 N -2.46 1.75 0.24 1.82 0.00 -1.26 -2.69 120.51 117.90 1bag n ALA 108 Ca 0.16 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.76 1bag n ALA 108 Cb 0.46 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1bag n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bag n ALA 109 N -1.74 2.79 -1.84 0.00 0.00 -0.31 -4.90 120.51 114.50 1bag n ALA 109 Ca 0.03 -0.31 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 1bag n ALA 109 Cb 0.25 -1.04 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 1bag n ALA 109 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bag s ILE 110 N -3.33 2.42 0.77 0.00 1.01 -1.10 -4.81 121.20 116.17 1bag s ILE 110 Ca 0.00 0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.87 1bag s ILE 110 Cb 0.12 -3.22 0.06 0.00 0.01 0.00 0.00 42.46 39.43 1bag s ILE 110 CO 0.80 0.05 1.11 -0.94 0.00 0.00 0.00 174.94 175.96 1bag s SER 111 N 0.65 4.31 0.29 3.58 1.04 -0.15 -4.85 113.70 118.57 1bag s SER 111 Ca 0.64 1.95 0.01 0.00 0.48 0.00 0.00 55.95 59.04 1bag s SER 111 Cb -0.45 -2.54 0.45 0.00 0.10 0.00 0.00 66.02 63.58 1bag s SER 111 CO 0.41 -2.17 1.78 0.78 0.98 0.00 0.00 173.24 175.02 1bag h ASN 112 N -1.00 0.58 -0.75 7.02 4.21 -1.93 -0.49 115.58 123.23 1bag h ASN 112 Ca -0.44 -0.15 0.17 0.00 1.21 0.00 0.00 56.30 57.09 1bag h ASN 112 Cb 1.24 -0.16 -0.11 0.00 -1.12 0.00 0.00 38.32 38.17 1bag h ASN 112 CO 0.50 0.71 0.17 -0.08 -1.29 0.00 0.00 177.43 177.44 1bag h GLU 113 N 0.56 0.24 0.01 0.81 4.81 -1.92 0.21 114.58 119.30 1bag h GLU 113 Ca 0.11 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1bag h GLU 113 Cb 0.48 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1bag h GLU 113 CO 0.03 0.16 -0.00 0.28 -0.73 0.00 0.00 179.01 178.74 1bag h VAL 114 N 0.25 1.60 0.00 0.32 2.07 -1.61 -3.31 116.25 115.56 1bag h VAL 114 Ca 0.42 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 66.05 1bag h VAL 114 Cb 0.74 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.38 1bag h VAL 114 CO -0.53 0.48 0.00 0.11 0.02 0.00 0.00 177.57 177.65 1bag h LYS 115 N -0.83 0.00 0.00 1.57 1.57 -0.53 -2.04 116.57 116.31 1bag h LYS 115 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1bag h LYS 115 Cb 0.80 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 1bag h LYS 115 CO 0.00 0.00 -0.19 0.77 -0.57 0.00 0.00 179.45 179.47 1bag h SER 116 N 0.00 0.00 -2.99 0.86 0.02 -0.69 -3.43 113.55 107.33 1bag h SER 116 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 1bag h SER 116 Cb 0.00 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1bag h SER 116 CO 0.00 0.19 0.97 -0.63 -1.14 0.00 0.00 176.83 176.21 1bag s ILE 117 N -3.65 4.12 0.12 3.27 1.01 -0.77 -4.95 121.20 120.35 1bag s ILE 117 Ca 0.01 1.31 -0.31 0.00 0.00 0.00 0.00 60.65 61.65 1bag s ILE 117 Cb 0.10 -4.02 -0.11 0.00 0.01 0.00 0.00 42.46 38.44 1bag s ILE 117 CO 0.62 -0.31 1.83 -2.65 0.00 0.00 0.00 174.94 174.44 1bag n PRO 118 N 7.08 2.77 -3.45 2.79 -0.02 -1.26 -2.97 135.00 139.94 1bag n PRO 118 Ca 0.15 1.01 -0.19 0.00 -2.02 0.00 0.00 63.50 62.45 1bag n PRO 118 Cb 0.46 -2.90 0.07 0.00 -0.02 0.00 0.00 33.50 31.10 1bag n PRO 118 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1bag n ASN 119 N 5.57 -4.00 0.18 2.55 5.15 -1.26 -4.93 115.26 118.51 1bag n ASN 119 Ca 0.18 -0.74 0.10 0.00 -0.60 0.00 0.00 54.58 53.51 1bag n ASN 119 Cb 0.37 -4.73 0.10 0.00 -0.53 0.00 0.00 39.78 34.99 1bag n ASN 119 CO 0.00 0.00 0.00 4.11 1.40 0.00 0.00 177.26 182.77 1bag h TRP 120 N -1.58 0.00 -1.48 1.20 5.08 -1.89 -3.44 115.95 113.84 1bag h TRP 120 Ca -0.61 0.00 -0.63 0.00 1.08 0.00 0.00 58.89 58.73 1bag h TRP 120 Cb 1.33 0.00 -0.13 0.00 -3.00 0.00 0.00 29.16 27.37 1bag h TRP 120 CO 0.38 0.10 -0.58 -0.08 -1.28 0.00 0.00 178.44 176.99 1bag s THR 121 N -3.19 1.91 -0.26 0.12 -1.32 -1.26 0.31 115.64 111.95 1bag s THR 121 Ca 0.05 -1.97 0.13 0.00 -1.21 0.00 0.00 61.69 58.69 1bag s THR 121 Cb 0.06 -2.88 -0.18 0.00 -1.51 0.00 0.00 72.50 67.99 1bag s THR 121 CO 0.71 0.00 0.40 1.41 -2.21 0.00 0.00 174.62 174.93 1bag n HIS 122 N -1.04 0.00 0.00 9.09 8.25 0.29 -4.48 115.22 127.34 1bag n HIS 122 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1bag n HIS 122 Cb 0.67 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1bag n HIS 122 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bag n GLY 123 N 1.56 -0.07 2.25 -1.41 0.00 -1.25 -4.82 105.19 101.46 1bag n GLY 123 Ca -0.00 -2.27 -0.08 0.00 0.00 0.00 0.00 46.02 43.67 1bag n GLY 123 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bag n ASN 124 N 0.00 2.77 -4.54 1.61 6.94 -1.26 -1.21 115.26 119.57 1bag n ASN 124 Ca 0.00 -2.79 -0.43 0.00 -0.02 0.00 0.00 54.58 51.34 1bag n ASN 124 Cb 0.00 -0.42 -0.04 0.00 -2.36 0.00 0.00 39.78 36.97 1bag n ASN 124 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1bag s THR 125 N -3.72 4.30 0.17 5.53 2.01 -1.26 -4.72 115.64 117.96 1bag s THR 125 Ca 0.37 0.45 -0.31 0.00 0.31 0.00 0.00 61.69 62.51 1bag s THR 125 Cb 0.36 -4.58 -0.17 0.00 0.01 0.00 0.00 72.50 68.13 1bag s THR 125 CO -0.02 -1.15 0.85 0.00 -0.69 0.00 0.00 174.62 173.61 1bag n GLN 126 N 7.68 0.50 -1.78 4.92 1.13 -1.26 -0.83 117.38 127.75 1bag n GLN 126 Ca 0.04 0.18 -0.41 0.00 -1.94 0.00 0.00 57.00 54.86 1bag n GLN 126 Cb 0.48 -1.45 -0.00 0.00 0.11 0.00 0.00 30.24 29.38 1bag n GLN 126 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1bag s ILE 127 N -0.63 2.00 -0.00 5.09 1.01 0.16 -4.69 121.20 124.13 1bag s ILE 127 Ca 0.70 0.00 -0.03 0.00 0.00 0.00 0.00 60.65 61.32 1bag s ILE 127 Cb -0.93 -3.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.52 1bag s ILE 127 CO 0.56 0.00 -0.06 1.17 0.00 0.00 0.00 174.94 176.60 1bag n LYS 128 N 0.43 0.10 -3.16 2.79 0.00 -1.26 -4.95 118.16 112.11 1bag n LYS 128 Ca 0.01 0.04 -0.44 0.00 0.00 0.00 0.00 58.31 57.91 1bag n LYS 128 Cb 0.39 -0.52 -0.05 0.00 0.00 0.00 0.00 35.03 34.85 1bag n LYS 128 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 1bag s ASN 129 N -5.30 6.19 0.11 3.14 2.47 -1.26 -4.92 114.94 115.37 1bag s ASN 129 Ca -0.05 -1.28 0.13 0.00 0.42 0.00 0.00 52.86 52.08 1bag s ASN 129 Cb 0.01 -2.28 0.60 0.00 -1.45 0.00 0.00 41.25 38.12 1bag s ASN 129 CO 0.08 -0.99 1.40 0.79 -3.72 0.00 0.00 177.10 174.66 1bag n TRP 130 N 6.12 0.29 1.24 0.43 7.02 -1.26 -1.46 117.44 129.83 1bag n TRP 130 Ca -0.09 0.13 0.13 0.00 -1.02 0.00 0.00 57.50 56.65 1bag n TRP 130 Cb 0.43 -0.71 0.42 0.00 -2.42 0.00 0.00 31.31 29.03 1bag n TRP 130 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1bag n SER 131 N -1.78 0.81 -4.55 -0.99 7.64 -1.26 -4.62 113.62 108.87 1bag n SER 131 Ca 0.01 -0.71 -0.40 0.00 1.01 0.00 0.00 58.87 58.78 1bag n SER 131 Cb 0.11 0.09 -0.09 0.00 -1.01 0.00 0.00 64.21 63.30 1bag n SER 131 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1bag s ASP 132 N -2.57 6.17 0.19 6.43 2.15 -0.53 -4.71 116.67 123.80 1bag s ASP 132 Ca 0.23 -0.18 -0.12 0.00 0.43 0.00 0.00 52.55 52.92 1bag s ASP 132 Cb 0.19 -2.19 0.11 0.00 -0.30 0.00 0.00 42.92 40.73 1bag s ASP 132 CO 0.53 -0.30 1.83 0.03 -0.17 0.00 0.00 175.17 177.09 1bag h ARG 133 N 8.43 0.89 -0.46 4.34 2.47 -1.86 0.19 114.38 128.38 1bag h ARG 133 Ca -0.30 -0.08 0.03 0.00 -1.26 0.00 0.00 59.98 58.37 1bag h ARG 133 Cb 1.15 -0.19 -0.04 0.00 -1.65 0.00 0.00 29.97 29.25 1bag h ARG 133 CO 0.68 0.64 0.25 2.35 0.56 0.00 0.00 179.97 184.44 1bag h TRP 134 N 0.89 0.46 -0.37 3.04 7.01 -1.94 0.92 115.95 125.97 1bag h TRP 134 Ca 0.24 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 61.15 1bag h TRP 134 Cb -0.02 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 26.89 1bag h TRP 134 CO -0.02 0.24 -0.18 0.22 -2.79 0.00 0.00 178.44 175.92 1bag h ASP 135 N 0.49 0.80 -0.24 2.65 1.82 -1.74 -0.00 116.42 120.19 1bag h ASP 135 Ca 0.20 -0.40 -0.08 0.00 -0.39 0.00 0.00 57.03 56.35 1bag h ASP 135 Cb 0.08 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 39.85 1bag h ASP 135 CO -0.12 1.03 -0.12 0.58 -1.61 0.00 0.00 179.24 178.99 1bag h VAL 136 N 0.57 1.25 0.10 2.25 2.07 -0.20 -2.24 116.25 120.05 1bag h VAL 136 Ca 0.08 -1.11 -0.35 0.00 0.82 0.00 0.00 66.70 66.14 1bag h VAL 136 Cb 0.72 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 1bag h VAL 136 CO 0.05 0.37 -1.92 0.35 0.02 0.00 0.00 177.57 176.44 1bag n THR 137 N -4.18 1.73 1.29 2.57 -2.24 0.28 -4.47 114.28 109.26 1bag n THR 137 Ca 0.01 -0.55 0.14 0.00 -2.27 0.00 0.00 64.05 61.37 1bag n THR 137 Cb 0.35 -1.77 0.51 0.00 -2.10 0.00 0.00 70.33 67.32 1bag n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bag n GLN 138 N -3.63 0.61 -4.46 -0.78 1.13 -0.02 -4.64 117.38 105.60 1bag n GLN 138 Ca -0.33 -0.27 -0.31 0.00 -1.94 0.00 0.00 57.00 54.15 1bag n GLN 138 Cb 0.99 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 29.79 1bag n GLN 138 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1bag s ASN 139 N -2.57 4.30 -0.08 1.08 0.01 -0.84 -4.87 114.94 111.97 1bag s ASN 139 Ca 0.25 -1.51 -0.29 0.00 -0.71 0.00 0.00 52.86 50.59 1bag s ASN 139 Cb 0.19 0.48 -0.02 0.00 0.41 0.00 0.00 41.25 42.32 1bag s ASN 139 CO 0.51 -0.94 1.00 -0.55 -1.51 0.00 0.00 177.10 175.61 1bag s SER 140 N -4.01 7.26 -0.39 -1.22 0.15 -0.01 -4.80 113.70 110.69 1bag s SER 140 Ca 0.15 1.55 -0.20 0.00 0.70 0.00 0.00 55.95 58.15 1bag s SER 140 Cb 0.00 -2.56 0.01 0.00 -1.71 0.00 0.00 66.02 61.77 1bag s SER 140 CO 0.09 -0.40 0.61 -0.22 1.20 0.00 0.00 173.24 174.52 1bag s LEU 141 N 1.79 4.39 -0.45 3.45 1.98 -1.26 0.37 118.68 128.95 1bag s LEU 141 Ca 0.49 -0.11 0.00 0.00 -2.89 0.00 0.00 54.13 51.62 1bag s LEU 141 Cb -0.19 -2.72 0.00 0.00 0.66 0.00 0.00 46.19 43.94 1bag s LEU 141 CO 0.20 -0.66 0.00 0.18 -1.89 0.00 0.00 176.35 174.18 1bag n LEU 142 N 6.08 0.23 0.00 -0.68 4.77 -1.26 -1.60 117.00 124.55 1bag n LEU 142 Ca -0.02 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1bag n LEU 142 Cb 0.48 -2.07 0.00 0.00 -2.33 0.00 0.00 43.42 39.50 1bag n LEU 142 CO 0.50 -0.77 0.00 0.61 -1.33 0.00 0.00 177.39 176.41 1bag n GLY 143 N -0.30 0.76 3.70 -0.72 0.00 -1.26 -5.01 105.19 102.36 1bag n GLY 143 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1bag n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bag s LEU 144 N 0.00 4.32 0.01 0.99 1.43 -0.63 -4.43 118.68 120.37 1bag s LEU 144 Ca 0.00 1.77 -0.35 0.00 -1.03 0.00 0.00 54.13 54.53 1bag s LEU 144 Cb 0.00 -3.57 -0.13 0.00 0.03 0.00 0.00 46.19 42.52 1bag s LEU 144 CO 0.00 -0.45 1.70 -1.22 0.23 0.00 0.00 176.35 176.61 1bag n TYR 145 N 4.55 2.22 -2.90 0.29 4.02 -1.12 -4.07 117.16 120.15 1bag n TYR 145 Ca 0.09 0.20 -0.42 0.00 -0.01 0.00 0.00 57.90 57.75 1bag n TYR 145 Cb 0.48 -2.57 -0.05 0.00 -0.02 0.00 0.00 39.34 37.18 1bag n TYR 145 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1bag s ASP 146 N 2.44 6.57 0.59 7.72 2.15 -0.35 -1.78 116.67 134.02 1bag s ASP 146 Ca 0.87 0.35 -0.18 0.00 0.43 0.00 0.00 52.55 54.02 1bag s ASP 146 Cb -0.74 -2.42 -0.07 0.00 -0.30 0.00 0.00 42.92 39.39 1bag s ASP 146 CO 0.47 -0.82 0.73 0.79 -0.17 0.00 0.00 175.17 176.16 1bag n TRP 147 N 6.64 0.00 -3.09 -5.34 7.02 -0.91 0.10 117.44 121.86 1bag n TRP 147 Ca 0.04 0.44 -0.44 0.00 -1.02 0.00 0.00 57.50 56.52 1bag n TRP 147 Cb 0.48 -2.04 0.00 0.00 -2.42 0.00 0.00 31.31 27.34 1bag n TRP 147 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1bag n ASN 148 N -0.15 5.47 0.02 -0.99 5.15 0.15 -4.33 115.26 120.58 1bag n ASN 148 Ca 0.13 -3.06 0.01 0.00 -0.60 0.00 0.00 54.58 51.07 1bag n ASN 148 Cb 0.48 -1.45 0.08 0.00 -0.53 0.00 0.00 39.78 38.35 1bag n ASN 148 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1bag n THR 149 N 3.32 1.69 0.16 -0.44 -2.24 -1.26 -1.07 114.28 114.44 1bag n THR 149 Ca 0.30 0.53 0.12 0.00 -2.27 0.00 0.00 64.05 62.73 1bag n THR 149 Cb 0.40 -1.53 0.09 0.00 -2.10 0.00 0.00 70.33 67.18 1bag n THR 149 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1bag h GLN 150 N 0.00 0.00 -6.51 -0.78 7.50 -1.94 -3.42 115.11 109.96 1bag h GLN 150 Ca 0.00 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.59 1bag h GLN 150 Cb 0.10 0.00 -0.06 0.00 0.05 0.00 0.00 27.48 27.57 1bag h GLN 150 CO 0.00 0.00 1.07 1.21 -1.50 0.00 0.00 178.83 179.61 1bag s ASN 151 N -5.80 6.28 0.60 1.46 3.84 -0.23 -4.88 114.94 116.21 1bag s ASN 151 Ca 0.03 0.61 0.29 0.00 0.21 0.00 0.00 52.86 54.00 1bag s ASN 151 Cb 0.07 -2.54 1.59 0.00 -0.55 0.00 0.00 41.25 39.82 1bag s ASN 151 CO 0.73 -1.52 2.00 0.71 -2.79 0.00 0.00 177.10 176.23 1bag h THR 152 N 6.42 0.38 -0.04 -5.21 1.35 -1.86 0.17 112.91 114.12 1bag h THR 152 Ca -0.27 0.00 -0.16 0.00 -0.55 0.00 0.00 66.41 65.43 1bag h THR 152 Cb 1.10 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.24 1bag h THR 152 CO 1.12 0.00 -0.68 -0.61 -0.25 0.00 0.00 175.52 175.10 1bag h GLN 153 N 0.00 0.19 0.06 4.72 4.15 -1.94 -1.37 115.11 120.93 1bag h GLN 153 Ca 0.13 -0.15 -0.25 0.00 0.77 0.00 0.00 58.65 59.16 1bag h GLN 153 Cb 0.79 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.52 1bag h GLN 153 CO -0.00 0.80 -1.07 -0.39 -1.93 0.00 0.00 178.83 176.24 1bag h VAL 154 N 0.13 1.45 -0.01 2.39 -1.51 -1.00 -2.32 116.25 115.38 1bag h VAL 154 Ca -0.02 -2.73 0.02 0.00 -1.23 0.00 0.00 66.70 62.74 1bag h VAL 154 Cb 1.21 2.66 -0.02 0.00 -2.13 0.00 0.00 31.29 33.01 1bag h VAL 154 CO 0.10 0.80 -0.08 1.56 -1.23 0.00 0.00 177.57 178.73 1bag h GLN 155 N 0.15 -0.13 -0.72 5.19 4.20 -1.16 0.53 115.11 123.17 1bag h GLN 155 Ca -0.10 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.64 1bag h GLN 155 Cb 1.75 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 29.51 1bag h GLN 155 CO 0.18 -0.09 0.46 1.03 -0.67 0.00 0.00 178.83 179.74 1bag h SER 156 N -0.14 0.77 -0.25 1.46 0.87 -1.27 0.22 113.55 115.22 1bag h SER 156 Ca 0.04 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1bag h SER 156 Cb 0.18 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1bag h SER 156 CO -0.09 0.54 0.10 0.22 -0.53 0.00 0.00 176.83 177.07 1bag h TYR 157 N 0.91 0.37 -0.32 2.24 3.20 -0.98 -0.93 116.97 121.45 1bag h TYR 157 Ca 0.29 -0.03 -0.13 0.00 3.14 0.00 0.00 58.73 62.00 1bag h TYR 157 Cb -0.01 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1bag h TYR 157 CO -0.04 0.38 -0.34 -0.07 -1.64 0.00 0.00 178.16 176.46 1bag h LEU 158 N 0.25 0.74 -0.60 2.82 3.38 -0.49 -3.09 115.31 118.32 1bag h LEU 158 Ca 0.08 -0.31 -0.12 0.00 0.09 0.00 0.00 57.88 57.62 1bag h LEU 158 Cb 0.16 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1bag h LEU 158 CO -0.01 1.02 -0.16 0.50 0.09 0.00 0.00 178.44 179.88 1bag h LYS 159 N 0.60 0.94 0.00 1.13 3.64 -0.47 -2.36 116.57 120.05 1bag h LYS 159 Ca 0.06 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1bag h LYS 159 Cb 0.86 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1bag h LYS 159 CO 0.07 1.03 0.00 0.07 -2.27 0.00 0.00 179.45 178.35 1bag h ARG 160 N 0.83 0.00 -0.04 1.90 0.11 -1.09 -1.00 114.38 115.08 1bag h ARG 160 Ca 0.12 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 60.06 1bag h ARG 160 Cb 0.71 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.80 1bag h ARG 160 CO 0.05 0.00 -0.51 0.35 0.10 0.00 0.00 179.97 179.96 1bag h PHE 161 N 0.00 0.59 -0.16 4.08 3.57 -1.39 -1.60 116.94 122.03 1bag h PHE 161 Ca 0.00 -0.29 -0.00 0.00 3.53 0.00 0.00 57.97 61.20 1bag h PHE 161 Cb 0.23 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 1bag h PHE 161 CO 0.00 1.09 0.09 -0.07 -2.23 0.00 0.00 178.31 177.19 1bag h LEU 162 N -0.07 0.20 -0.44 0.59 3.38 -1.15 -1.43 115.31 116.39 1bag h LEU 162 Ca -0.05 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 57.93 1bag h LEU 162 Cb 1.20 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.82 1bag h LEU 162 CO 0.10 0.22 -0.06 -0.08 0.09 0.00 0.00 178.44 178.71 1bag h GLU 163 N 0.17 0.05 -0.59 1.13 4.57 -1.25 -0.91 114.58 117.75 1bag h GLU 163 Ca 0.06 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1bag h GLU 163 Cb 0.06 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1bag h GLU 163 CO -0.01 0.03 0.37 -0.09 -1.18 0.00 0.00 179.01 178.13 1bag h ARG 164 N 0.05 0.79 -0.16 1.92 2.43 -0.88 0.50 114.38 119.03 1bag h ARG 164 Ca 0.22 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 1bag h ARG 164 Cb 0.33 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1bag h ARG 164 CO -0.41 0.54 -0.05 0.00 -1.51 0.00 0.00 179.97 178.54 1bag h ALA 165 N 1.60 0.22 -0.62 2.80 0.00 -0.16 -0.52 119.26 122.59 1bag h ALA 165 Ca 0.21 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1bag h ALA 165 Cb -0.06 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1bag h ALA 165 CO -0.04 -0.00 0.36 -0.07 0.00 0.00 0.00 179.25 179.49 1bag h LEU 166 N 0.00 0.56 -1.43 0.00 4.07 -0.69 -0.18 115.31 117.65 1bag h LEU 166 Ca 0.04 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1bag h LEU 166 Cb 0.50 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 42.13 1bag h LEU 166 CO 0.02 0.38 -0.12 0.78 -1.08 0.00 0.00 178.44 178.42 1bag h ASN 167 N 0.69 0.00 1.07 -0.43 4.21 -0.78 -1.68 115.58 118.66 1bag h ASN 167 Ca 0.26 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.77 1bag h ASN 167 Cb 0.09 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 1bag h ASN 167 CO -0.13 0.12 -0.08 0.47 -1.29 0.00 0.00 177.43 176.52 1bag n ASP 168 N -3.31 0.29 0.00 5.81 8.00 -0.21 -4.90 116.55 122.23 1bag n ASP 168 Ca -0.00 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.92 1bag n ASP 168 Cb 0.34 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.98 1bag n ASP 168 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bag n GLY 169 N 1.44 1.48 3.69 0.44 0.00 -0.63 -4.40 105.19 107.21 1bag n GLY 169 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1bag n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bag s ALA 170 N -0.97 1.71 0.00 4.61 0.00 -0.41 -4.72 121.76 121.98 1bag s ALA 170 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1bag s ALA 170 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1bag s ALA 170 CO 0.00 -2.45 0.09 -0.25 0.00 0.00 0.00 175.76 173.15 1bag n ASP 171 N -3.67 0.19 -3.42 0.00 8.00 0.51 -4.34 116.55 113.82 1bag n ASP 171 Ca 0.13 -0.52 -0.04 0.00 0.71 0.00 0.00 54.79 55.07 1bag n ASP 171 Cb 0.51 0.42 0.01 0.00 -0.02 0.00 0.00 41.12 42.04 1bag n ASP 171 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1bag s GLY 172 N -0.42 0.05 0.04 0.44 0.00 -0.98 -1.24 107.32 105.21 1bag s GLY 172 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1bag s GLY 172 CO 0.00 1.67 -0.04 -1.36 0.00 0.00 0.00 173.10 173.36 1bag s PHE 173 N -2.42 0.45 -0.31 1.90 0.08 -1.01 -0.86 117.98 115.81 1bag s PHE 173 Ca 0.19 -0.69 0.03 0.00 0.12 0.00 0.00 56.93 56.58 1bag s PHE 173 Cb -0.02 -0.30 0.09 0.00 -0.57 0.00 0.00 43.02 42.21 1bag s PHE 173 CO 0.05 -0.21 0.03 0.50 -0.10 0.00 0.00 175.22 175.48 1bag s ARG 174 N -2.27 1.45 -0.60 0.44 3.00 -0.28 -1.16 118.95 119.53 1bag s ARG 174 Ca -0.07 -1.56 -0.28 0.00 -1.00 0.00 0.00 55.73 52.83 1bag s ARG 174 Cb -0.04 -2.87 0.02 0.00 0.00 0.00 0.00 34.95 32.05 1bag s ARG 174 CO -0.03 -0.86 1.39 -0.06 0.00 0.00 0.00 175.30 175.74 1bag s PHE 175 N 1.12 2.27 0.41 5.12 0.08 0.06 -1.40 117.98 125.63 1bag s PHE 175 Ca 0.06 0.38 -0.27 0.00 0.12 0.00 0.00 56.93 57.23 1bag s PHE 175 Cb -0.19 -4.43 -0.09 0.00 -0.57 0.00 0.00 43.02 37.74 1bag s PHE 175 CO -0.11 -1.98 1.40 0.34 -0.10 0.00 0.00 175.22 174.78 1bag s ASP 176 N 4.39 6.19 -1.35 1.36 2.15 -0.93 -0.80 116.67 127.69 1bag s ASP 176 Ca 0.49 2.87 -0.15 0.00 0.43 0.00 0.00 52.55 56.18 1bag s ASP 176 Cb -0.10 -2.65 0.14 0.00 -0.30 0.00 0.00 42.92 40.01 1bag s ASP 176 CO 0.23 -0.96 0.48 0.00 -0.17 0.00 0.00 175.17 174.75 1bag n ALA 177 N 0.15 -1.14 0.22 3.66 0.00 -1.26 -4.52 120.51 117.62 1bag n ALA 177 Ca 0.03 -0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.54 1bag n ALA 177 Cb 0.42 -2.30 0.77 0.00 0.00 0.00 0.00 19.45 18.33 1bag n ALA 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bag h ALA 178 N 0.92 1.02 0.00 0.00 0.00 -1.33 0.17 119.26 120.05 1bag h ALA 178 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1bag h ALA 178 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1bag h ALA 178 CO 0.62 -0.02 0.00 -0.22 0.00 0.00 0.00 179.25 179.63 1bag h LYS 179 N 0.00 0.00 -0.61 0.00 3.64 -1.86 -3.18 116.57 114.56 1bag h LYS 179 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1bag h LYS 179 Cb 0.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1bag h LYS 179 CO 0.00 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.90 1bag n HIS 180 N -2.35 1.83 -3.95 1.91 8.25 0.05 -4.70 115.22 116.26 1bag n HIS 180 Ca 0.03 -0.68 -0.30 0.00 -0.26 0.00 0.00 57.72 56.51 1bag n HIS 180 Cb 0.32 -0.40 -0.16 0.00 1.12 0.00 0.00 29.99 30.87 1bag n HIS 180 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1bag s ILE 181 N -2.37 1.49 0.95 1.59 1.01 -1.20 -4.46 121.20 118.20 1bag s ILE 181 Ca 0.53 -1.02 -0.14 0.00 0.00 0.00 0.00 60.65 60.02 1bag s ILE 181 Cb 0.38 -1.67 -0.00 0.00 0.01 0.00 0.00 42.46 41.18 1bag s ILE 181 CO 0.20 0.05 0.17 -1.84 0.00 0.00 0.00 174.94 173.52 1bag n GLU 182 N 4.72 -0.20 -3.56 2.79 0.00 -1.26 -5.00 120.64 118.13 1bag n GLU 182 Ca -0.13 -0.03 -0.21 0.00 0.00 0.00 0.00 57.16 56.79 1bag n GLU 182 Cb 0.46 -1.68 -0.02 0.00 0.00 0.00 0.00 31.44 30.19 1bag n GLU 182 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1bag s LEU 183 N 0.76 3.32 0.09 -1.84 1.43 -1.26 -4.61 118.68 116.57 1bag s LEU 183 Ca 0.54 -0.79 -0.24 0.00 -1.03 0.00 0.00 54.13 52.61 1bag s LEU 183 Cb -0.21 -1.97 -0.14 0.00 0.03 0.00 0.00 46.19 43.90 1bag s LEU 183 CO 0.70 -0.73 1.73 -0.65 0.23 0.00 0.00 176.35 177.63 1bag h PRO 184 N 0.95 -0.07 -0.80 1.29 0.11 -1.77 -2.12 132.00 129.59 1bag h PRO 184 Ca -0.40 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1bag h PRO 184 Cb 1.27 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1bag h PRO 184 CO 0.56 -0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.90 1bag n ASP 185 N -5.13 0.80 -2.43 -2.05 5.75 -1.26 -3.97 116.55 108.26 1bag n ASP 185 Ca -0.07 -2.00 -0.22 0.00 -0.01 0.00 0.00 54.79 52.49 1bag n ASP 185 Cb 0.07 -0.40 -0.11 0.00 -1.03 0.00 0.00 41.12 39.65 1bag n ASP 185 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1bag n ASP 186 N -0.10 6.29 -0.33 -1.12 -0.08 -0.83 -4.95 116.55 115.43 1bag n ASP 186 Ca 0.00 -2.73 0.00 0.00 -1.51 0.00 0.00 54.79 50.55 1bag n ASP 186 Cb 0.20 -1.39 0.00 0.00 2.34 0.00 0.00 41.12 42.27 1bag n ASP 186 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1bag n GLY 187 N 2.18 -1.38 0.21 0.27 0.00 -1.26 -3.56 105.19 101.64 1bag n GLY 187 Ca 0.51 -1.22 0.08 0.00 0.00 0.00 0.00 46.02 45.40 1bag n GLY 187 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1bag h SER 188 N 0.00 0.00 -0.13 1.61 4.64 -1.93 -0.98 113.55 116.76 1bag h SER 188 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bag h SER 188 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1bag h SER 188 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1bag n TYR 189 N -2.26 0.36 -0.28 4.77 0.18 -1.25 -5.05 117.16 113.63 1bag n TYR 189 Ca -0.01 -0.82 -0.30 0.00 1.88 0.00 0.00 57.90 58.64 1bag n TYR 189 Cb 0.36 -0.17 0.29 0.00 -0.38 0.00 0.00 39.34 39.44 1bag n TYR 189 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1bag s GLY 190 N -2.05 1.39 0.18 -7.48 0.00 -0.38 -4.94 107.32 94.04 1bag s GLY 190 Ca 0.29 -0.75 -0.24 0.00 0.00 0.00 0.00 44.72 44.02 1bag s GLY 190 CO 0.06 0.26 0.86 -1.35 0.00 0.00 0.00 173.10 172.93 1bag s SER 191 N -3.00 -0.24 -0.30 1.64 1.04 -1.01 -4.93 113.70 106.90 1bag s SER 191 Ca 0.68 -0.41 0.05 0.00 0.48 0.00 0.00 55.95 56.75 1bag s SER 191 Cb -0.14 0.56 0.53 0.00 0.10 0.00 0.00 66.02 67.07 1bag s SER 191 CO 0.59 -1.02 1.63 0.00 0.98 0.00 0.00 173.24 175.42 1bag n GLN 192 N -0.44 2.44 0.13 4.02 1.13 -1.26 -2.05 117.38 121.36 1bag n GLN 192 Ca -0.06 -2.29 -0.13 0.00 -1.94 0.00 0.00 57.00 52.57 1bag n GLN 192 Cb 0.61 -1.94 -0.06 0.00 0.11 0.00 0.00 30.24 28.96 1bag n GLN 192 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1bag h PHE 193 N 1.32 -0.47 0.18 1.08 3.57 -1.85 -1.91 116.94 118.85 1bag h PHE 193 Ca 0.36 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 1bag h PHE 193 Cb 2.22 0.19 0.00 0.00 2.79 0.00 0.00 35.95 41.15 1bag h PHE 193 CO 1.11 -0.27 -0.09 -1.49 -2.23 0.00 0.00 178.31 175.34 1bag h TRP 194 N -0.39 -0.22 -0.51 0.41 4.06 -1.81 -0.45 115.95 117.03 1bag h TRP 194 Ca 0.01 -0.01 0.14 0.00 2.06 0.00 0.00 58.89 61.09 1bag h TRP 194 Cb 0.37 0.07 -0.02 0.00 -1.00 0.00 0.00 29.16 28.58 1bag h TRP 194 CO -0.15 0.05 0.37 -1.35 -3.56 0.00 0.00 178.44 173.79 1bag h PRO 195 N -0.48 0.05 0.02 0.49 0.11 -1.89 -0.74 132.00 129.56 1bag h PRO 195 Ca -0.02 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1bag h PRO 195 Cb 0.37 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1bag h PRO 195 CO 0.04 0.03 -0.01 -0.97 -0.21 0.00 0.00 178.00 176.88 1bag h ASN 196 N 0.05 -0.02 0.33 -2.05 -1.24 -1.06 -3.24 115.58 108.35 1bag h ASN 196 Ca 0.24 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.26 1bag h ASN 196 Cb 0.91 0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.96 1bag h ASN 196 CO -0.02 0.05 0.00 2.30 -1.29 0.00 0.00 177.43 178.48 1bag n ILE 197 N -2.46 1.33 0.86 2.57 -5.35 -0.20 -1.14 119.36 114.97 1bag n ILE 197 Ca -0.00 0.35 0.12 0.00 -0.27 0.00 0.00 62.75 62.95 1bag n ILE 197 Cb 0.01 -1.20 0.24 0.00 -1.74 0.00 0.00 39.64 36.95 1bag n ILE 197 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1bag n THR 198 N -1.57 0.11 -1.90 7.28 -1.04 -0.29 -4.56 114.28 112.31 1bag n THR 198 Ca 0.02 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.55 1bag n THR 198 Cb 0.11 0.09 -0.01 0.00 -1.82 0.00 0.00 70.33 68.71 1bag n THR 198 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1bag n ASN 199 N -1.69 8.02 -1.56 8.00 5.15 -0.29 -4.90 115.26 127.99 1bag n ASN 199 Ca 0.05 -3.05 0.00 0.00 -0.60 0.00 0.00 54.58 50.98 1bag n ASN 199 Cb 0.37 -1.40 0.00 0.00 -0.53 0.00 0.00 39.78 38.22 1bag n ASN 199 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1bag n THR 200 N 2.11 0.00 0.18 -0.44 -2.24 -1.26 -5.03 114.28 107.60 1bag n THR 200 Ca 0.64 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 62.49 1bag n THR 200 Cb 0.25 0.00 0.24 0.00 -2.10 0.00 0.00 70.33 68.72 1bag n THR 200 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1bag n SER 201 N -0.86 3.17 -4.67 3.42 3.41 -1.26 -4.93 113.62 111.90 1bag n SER 201 Ca 0.00 -2.17 -0.42 0.00 -0.26 0.00 0.00 58.87 56.02 1bag n SER 201 Cb 0.00 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 63.50 1bag n SER 201 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bag s ALA 202 N -1.55 3.63 0.08 7.33 0.00 -1.26 -4.89 121.76 125.11 1bag s ALA 202 Ca 0.35 1.32 -0.23 0.00 0.00 0.00 0.00 51.96 53.41 1bag s ALA 202 Cb 0.21 -3.81 -0.15 0.00 0.00 0.00 0.00 23.12 19.36 1bag s ALA 202 CO 0.20 -1.46 1.70 0.93 0.00 0.00 0.00 175.76 177.13 1bag h GLU 203 N 9.96 -0.00 -5.38 0.00 5.08 -1.53 -3.44 114.58 119.27 1bag h GLU 203 Ca -0.48 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.42 1bag h GLU 203 Cb 1.23 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.22 1bag h GLU 203 CO 0.94 0.04 -0.80 0.12 -1.00 0.00 0.00 179.01 178.31 1bag s PHE 204 N -6.03 1.29 -0.28 4.33 5.36 -1.23 -5.03 117.98 116.38 1bag s PHE 204 Ca -0.13 -0.33 -0.18 0.00 -0.96 0.00 0.00 56.93 55.33 1bag s PHE 204 Cb 0.06 -0.78 0.09 0.00 -0.34 0.00 0.00 43.02 42.05 1bag s PHE 204 CO 0.66 0.03 0.75 1.14 -1.46 0.00 0.00 175.22 176.34 1bag s GLN 205 N -0.94 0.67 0.05 10.12 -2.07 -1.26 -2.41 119.66 123.83 1bag s GLN 205 Ca 0.03 1.07 -0.03 0.00 -1.82 0.00 0.00 55.36 54.61 1bag s GLN 205 Cb -0.07 0.18 -0.02 0.00 -1.09 0.00 0.00 33.01 32.01 1bag s GLN 205 CO 0.01 -0.13 0.04 1.52 -1.32 0.00 0.00 175.29 175.41 1bag s TYR 206 N 1.30 0.36 0.12 9.60 1.13 -0.31 -2.69 117.35 126.87 1bag s TYR 206 Ca -0.07 -0.81 0.10 0.00 -1.41 0.00 0.00 57.07 54.87 1bag s TYR 206 Cb -0.05 -0.26 -0.04 0.00 -1.10 0.00 0.00 41.96 40.51 1bag s TYR 206 CO -0.15 -0.40 -0.21 0.20 -2.51 0.00 0.00 175.55 172.48 1bag s GLY 207 N -2.63 1.65 -0.50 5.49 0.00 -0.42 -0.76 107.32 110.15 1bag s GLY 207 Ca 0.02 -1.40 -0.27 0.00 0.00 0.00 0.00 44.72 43.07 1bag s GLY 207 CO -0.08 -1.38 1.04 1.62 0.00 0.00 0.00 173.10 174.29 1bag s GLN 208 N -2.13 3.57 -0.48 2.90 0.74 0.02 -3.44 119.66 120.85 1bag s GLN 208 Ca 0.17 0.26 0.03 0.00 0.05 0.00 0.00 55.36 55.86 1bag s GLN 208 Cb -0.10 -3.95 0.14 0.00 1.10 0.00 0.00 33.01 30.20 1bag s GLN 208 CO 0.09 -1.38 0.29 0.42 -0.55 0.00 0.00 175.29 174.16 1bag s ILE 209 N 4.20 1.58 0.14 -2.34 1.01 -1.26 -2.48 121.20 122.05 1bag s ILE 209 Ca 0.41 -2.88 -0.31 0.00 0.00 0.00 0.00 60.65 57.87 1bag s ILE 209 Cb -0.09 -2.09 -0.10 0.00 0.01 0.00 0.00 42.46 40.19 1bag s ILE 209 CO 0.27 -0.94 1.69 -0.76 0.00 0.00 0.00 174.94 175.20 1bag s LEU 210 N 0.00 4.38 0.32 2.97 1.43 -1.26 -4.54 118.68 121.98 1bag s LEU 210 Ca 0.20 2.68 -0.28 0.00 -1.03 0.00 0.00 54.13 55.70 1bag s LEU 210 Cb -0.18 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.36 1bag s LEU 210 CO -0.05 -0.92 1.16 -1.10 0.23 0.00 0.00 176.35 175.68 1bag s GLN 211 N 1.88 4.45 0.00 1.70 -0.21 -1.26 -4.83 119.66 121.39 1bag s GLN 211 Ca 0.75 1.90 0.00 0.00 0.02 0.00 0.00 55.36 58.03 1bag s GLN 211 Cb -0.45 -3.04 0.00 0.00 1.00 0.00 0.00 33.01 30.52 1bag s GLN 211 CO 0.33 0.01 0.00 -0.40 -2.12 0.00 0.00 175.29 173.11 1bag n ASP 212 N 0.84 0.00 0.10 5.90 5.68 -1.26 -4.98 116.55 122.83 1bag n ASP 212 Ca 0.00 -0.13 -0.15 0.00 -0.50 0.00 0.00 54.79 54.01 1bag n ASP 212 Cb 0.45 0.00 -0.14 0.00 -1.14 0.00 0.00 41.12 40.29 1bag n ASP 212 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1bag h SER 213 N 0.00 0.37 -0.94 -1.12 4.64 -1.94 -3.33 113.55 111.22 1bag h SER 213 Ca 0.00 -0.40 -0.55 0.00 -0.47 0.00 0.00 61.79 60.37 1bag h SER 213 Cb 0.00 -0.12 -0.29 0.00 -0.31 0.00 0.00 62.40 61.69 1bag h SER 213 CO 0.00 1.31 0.71 0.00 -0.87 0.00 0.00 176.83 177.98 1bag n ALA 214 N -2.51 5.75 0.07 5.18 0.00 -1.26 -4.35 120.51 123.39 1bag n ALA 214 Ca -0.08 -2.96 0.09 0.00 0.00 0.00 0.00 53.44 50.49 1bag n ALA 214 Cb 1.01 -1.55 -0.13 0.00 0.00 0.00 0.00 19.45 18.78 1bag n ALA 214 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bag n SER 215 N -0.95 1.06 -4.04 0.00 3.41 -1.25 -4.87 113.62 106.99 1bag n SER 215 Ca 0.58 -0.09 -0.29 0.00 -0.26 0.00 0.00 58.87 58.81 1bag n SER 215 Cb 1.22 1.70 -0.03 0.00 -0.26 0.00 0.00 64.21 66.85 1bag n SER 215 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1bag n ARG 216 N -2.02 -2.21 -0.22 4.33 1.74 -1.26 -4.83 116.66 112.18 1bag n ARG 216 Ca -0.03 0.30 0.02 0.00 -0.77 0.00 0.00 57.85 57.37 1bag n ARG 216 Cb 0.43 -4.07 0.10 0.00 -1.02 0.00 0.00 32.46 27.90 1bag n ARG 216 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1bag h ASP 217 N -1.90 -0.41 0.55 0.55 3.32 -1.95 0.83 116.42 117.41 1bag h ASP 217 Ca -0.65 0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1bag h ASP 217 Cb 1.38 0.34 0.00 0.00 0.22 0.00 0.00 39.33 41.27 1bag h ASP 217 CO 0.62 -0.17 0.00 0.00 -1.72 0.00 0.00 179.24 177.97 1bag n ALA 218 N -2.94 1.51 -0.05 3.45 0.00 -1.26 -1.88 120.51 119.32 1bag n ALA 218 Ca 0.10 0.11 -0.21 0.00 0.00 0.00 0.00 53.44 53.44 1bag n ALA 218 Cb 0.38 -1.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.34 1bag n ALA 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bag h ALA 219 N 2.20 0.27 -0.38 0.00 0.00 -1.20 -3.36 119.26 116.80 1bag h ALA 219 Ca 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 54.91 53.68 1bag h ALA 219 Cb 0.27 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1bag h ALA 219 CO 0.00 0.83 0.07 1.88 0.00 0.00 0.00 179.25 182.03 1bag h TYR 220 N -0.61 0.58 -0.51 0.00 0.05 -1.37 -1.75 116.97 113.35 1bag h TYR 220 Ca -0.34 -0.04 0.15 0.00 0.05 0.00 0.00 58.73 58.55 1bag h TYR 220 Cb 1.55 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 39.10 1bag h TYR 220 CO 0.11 0.52 0.45 0.00 -1.05 0.00 0.00 178.16 178.19 1bag h ALA 221 N 1.53 2.33 0.00 3.88 0.00 -1.39 0.49 119.26 126.10 1bag h ALA 221 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bag h ALA 221 Cb 0.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1bag h ALA 221 CO 0.00 -0.72 0.00 0.09 0.00 0.00 0.00 179.25 178.62 1bag n ASN 222 N -3.98 0.00 0.00 0.00 3.02 -0.66 -3.60 115.26 110.05 1bag n ASN 222 Ca 0.10 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 1bag n ASN 222 Cb 0.66 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1bag n ASN 222 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1bag n TYR 223 N -1.32 0.00 -3.97 3.10 4.01 0.16 -5.11 117.16 114.03 1bag n TYR 223 Ca 0.07 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.72 1bag n TYR 223 Cb 0.14 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.12 1bag n TYR 223 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bag s MET 224 N -1.84 1.40 0.71 -0.72 0.23 -0.20 -5.02 119.30 113.86 1bag s MET 224 Ca 0.00 -1.20 -0.11 0.00 -1.03 0.00 0.00 55.69 53.34 1bag s MET 224 Cb 0.00 0.44 0.02 0.00 -1.53 0.00 0.00 34.83 33.76 1bag s MET 224 CO 0.00 -0.56 1.07 -0.51 -2.03 0.00 0.00 175.02 172.99 1bag s ASP 225 N -2.99 5.13 0.32 -1.18 1.11 -1.09 -3.40 116.67 114.56 1bag s ASP 225 Ca 0.20 1.72 0.10 0.00 0.18 0.00 0.00 52.55 54.75 1bag s ASP 225 Cb 0.01 -2.51 -0.06 0.00 1.07 0.00 0.00 42.92 41.43 1bag s ASP 225 CO 0.05 -1.61 -0.12 0.68 1.18 0.00 0.00 175.17 175.35 1bag s VAL 226 N -2.91 2.27 -0.13 -1.27 -7.23 -0.34 -1.30 120.40 109.49 1bag s VAL 226 Ca 0.60 -2.26 -0.18 0.00 -1.81 0.00 0.00 61.98 58.33 1bag s VAL 226 Cb -0.15 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 1bag s VAL 226 CO 0.53 -0.27 0.48 0.42 -0.31 0.00 0.00 175.10 175.95 1bag s THR 227 N -2.61 5.18 -1.24 5.32 -4.23 -1.22 -1.11 115.64 115.74 1bag s THR 227 Ca 0.32 0.95 -0.13 0.00 -1.18 0.00 0.00 61.69 61.64 1bag s THR 227 Cb 0.00 -3.82 0.16 0.00 1.34 0.00 0.00 72.50 70.19 1bag s THR 227 CO 0.16 0.31 1.57 0.00 -0.54 0.00 0.00 174.62 176.11 1bag n ALA 228 N 3.80 4.21 -0.08 3.99 0.00 -0.65 -4.76 120.51 127.03 1bag n ALA 228 Ca -0.07 -4.23 -0.05 0.00 0.00 0.00 0.00 53.44 49.08 1bag n ALA 228 Cb 0.51 -3.08 0.14 0.00 0.00 0.00 0.00 19.45 17.03 1bag n ALA 228 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bag h SER 229 N 6.83 0.72 -0.35 0.00 4.64 -1.87 -2.50 113.55 121.02 1bag h SER 229 Ca 0.35 -0.21 -0.08 0.00 -0.47 0.00 0.00 61.79 61.37 1bag h SER 229 Cb 0.81 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 1bag h SER 229 CO 1.35 0.86 -0.11 0.78 -0.87 0.00 0.00 176.83 178.85 1bag h ASN 230 N 0.66 0.69 -0.82 4.97 2.35 -1.86 -2.57 115.58 119.01 1bag h ASN 230 Ca 0.11 -0.38 0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1bag h ASN 230 Cb 0.58 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.72 1bag h ASN 230 CO 0.04 0.91 0.53 0.22 -1.65 0.00 0.00 177.43 177.47 1bag h TYR 231 N 0.47 0.99 -0.55 1.19 3.20 -1.60 0.27 116.97 120.94 1bag h TYR 231 Ca 0.08 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.02 1bag h TYR 231 Cb 0.62 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.53 1bag h TYR 231 CO 0.05 0.57 0.36 0.78 -1.64 0.00 0.00 178.16 178.29 1bag h GLY 232 N 1.03 0.70 1.36 1.82 0.00 -1.22 0.35 103.07 107.11 1bag h GLY 232 Ca 0.32 -0.24 -0.15 0.00 0.00 0.00 0.00 47.33 47.27 1bag h GLY 232 CO -0.11 0.20 -0.41 0.84 0.00 0.00 0.00 176.54 177.06 1bag h HIS 233 N 0.60 0.84 -0.12 5.60 -0.00 -0.12 -1.84 115.15 120.12 1bag h HIS 233 Ca 0.22 -0.25 0.00 0.00 -0.00 0.00 0.00 60.37 60.34 1bag h HIS 233 Cb 0.14 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.37 1bag h HIS 233 CO -0.00 1.00 0.08 0.77 -0.00 0.00 0.00 177.93 179.77 1bag h SER 234 N 0.57 0.14 -0.03 3.26 0.02 0.24 -1.15 113.55 116.60 1bag h SER 234 Ca 0.04 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1bag h SER 234 Cb 0.95 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.43 1bag h SER 234 CO 0.09 0.12 -0.13 0.40 -1.14 0.00 0.00 176.83 176.17 1bag h ILE 235 N 0.14 0.67 -0.60 3.27 1.08 -1.07 0.01 117.51 121.00 1bag h ILE 235 Ca 0.04 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.51 1bag h ILE 235 Cb 0.00 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 1bag h ILE 235 CO -0.01 0.00 0.36 0.03 -0.69 0.00 0.00 178.15 177.84 1bag h ARG 236 N -0.21 0.81 -0.14 2.37 3.08 -1.18 -0.44 114.38 118.67 1bag h ARG 236 Ca 0.05 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1bag h ARG 236 Cb 0.28 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1bag h ARG 236 CO -0.15 0.57 0.05 0.77 -1.07 0.00 0.00 179.97 180.14 1bag h SER 237 N 0.83 0.20 0.00 7.04 0.02 -0.56 0.02 113.55 121.10 1bag h SER 237 Ca 0.22 -0.19 0.03 0.00 -0.84 0.00 0.00 61.79 61.01 1bag h SER 237 Cb -0.03 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 1bag h SER 237 CO -0.04 0.33 -0.21 0.00 -1.14 0.00 0.00 176.83 175.78 1bag h ALA 238 N 0.87 -0.27 -0.41 3.77 0.00 -0.42 -0.89 119.26 121.92 1bag h ALA 238 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1bag h ALA 238 Cb 0.20 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1bag h ALA 238 CO -0.00 -0.70 0.27 -0.07 0.00 0.00 0.00 179.25 178.75 1bag h LEU 239 N -0.33 0.43 0.28 0.00 3.38 -0.98 0.14 115.31 118.22 1bag h LEU 239 Ca 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1bag h LEU 239 Cb 0.41 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1bag h LEU 239 CO -0.19 0.30 -0.13 0.50 0.09 0.00 0.00 178.44 179.01 1bag h LYS 240 N 0.50 -0.36 -0.00 1.13 1.63 0.34 -2.82 116.57 116.99 1bag h LYS 240 Ca 0.16 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 1bag h LYS 240 Cb 0.02 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1bag h LYS 240 CO -0.04 -0.18 -0.01 0.09 -3.45 0.00 0.00 179.45 175.87 1bag n ASN 241 N -5.21 0.39 -1.74 4.20 3.02 -0.66 -4.88 115.26 110.38 1bag n ASN 241 Ca -0.10 -1.08 -0.20 0.00 -0.03 0.00 0.00 54.58 53.17 1bag n ASN 241 Cb 0.19 -0.01 -0.07 0.00 -0.61 0.00 0.00 39.78 39.29 1bag n ASN 241 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1bag n ARG 242 N -0.72 -1.46 -3.70 3.52 5.12 0.40 -4.92 116.66 114.91 1bag n ARG 242 Ca 0.22 1.15 -0.38 0.00 -1.93 0.00 0.00 57.85 56.92 1bag n ARG 242 Cb 0.18 -5.58 -0.10 0.00 -1.16 0.00 0.00 32.46 25.80 1bag n ARG 242 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 1bag s ASN 243 N -2.61 5.40 -0.32 0.55 3.84 -0.71 -4.55 114.94 116.54 1bag s ASN 243 Ca 0.00 -2.11 -0.00 0.00 0.21 0.00 0.00 52.86 50.96 1bag s ASN 243 Cb 0.00 -1.89 0.27 0.00 -0.55 0.00 0.00 41.25 39.08 1bag s ASN 243 CO 0.00 -0.56 1.87 0.18 -2.79 0.00 0.00 177.10 175.80 1bag n LEU 244 N 4.53 6.14 -4.61 3.21 4.77 0.86 -4.57 117.00 127.32 1bag n LEU 244 Ca -0.02 -3.17 -0.45 0.00 -0.03 0.00 0.00 56.01 52.33 1bag n LEU 244 Cb 0.41 -0.95 -0.04 0.00 -2.33 0.00 0.00 43.42 40.51 1bag n LEU 244 CO 0.36 1.12 1.69 0.61 -1.33 0.00 0.00 177.39 179.84 1bag n GLY 245 N 0.07 1.27 0.39 -0.72 0.00 -1.08 -4.73 105.19 100.40 1bag n GLY 245 Ca 0.32 0.84 0.25 0.00 0.00 0.00 0.00 46.02 47.43 1bag n GLY 245 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bag h VAL 246 N 6.33 0.40 -1.00 1.61 2.07 -1.88 -1.84 116.25 121.96 1bag h VAL 246 Ca -0.43 -0.12 0.19 0.00 0.82 0.00 0.00 66.70 67.16 1bag h VAL 246 Cb 1.26 0.02 -0.10 0.00 -1.52 0.00 0.00 31.29 30.94 1bag h VAL 246 CO 0.96 0.07 0.61 0.28 0.02 0.00 0.00 177.57 179.51 1bag h SER 247 N 0.36 0.75 0.12 0.57 0.02 -2.00 -2.76 113.55 110.60 1bag h SER 247 Ca 0.67 0.09 -0.34 0.00 -0.84 0.00 0.00 61.79 61.37 1bag h SER 247 Cb 1.69 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 64.17 1bag h SER 247 CO -0.42 0.26 -1.85 -0.55 -1.14 0.00 0.00 176.83 173.14 1bag h ASN 248 N 0.73 0.38 -0.51 3.07 -1.07 -1.73 -3.39 115.58 113.06 1bag h ASN 248 Ca 0.57 -0.89 -0.31 0.00 0.07 0.00 0.00 56.30 55.73 1bag h ASN 248 Cb 0.94 -0.13 -0.15 0.00 -2.07 0.00 0.00 38.32 36.91 1bag h ASN 248 CO -0.36 1.80 0.40 2.30 0.07 0.00 0.00 177.43 181.64 1bag n ILE 249 N -3.64 2.52 0.00 6.14 -5.35 -1.12 -3.94 119.36 113.97 1bag n ILE 249 Ca -0.31 -1.40 0.00 0.00 -0.27 0.00 0.00 62.75 60.77 1bag n ILE 249 Cb 1.00 -1.06 0.00 0.00 -1.74 0.00 0.00 39.64 37.84 1bag n ILE 249 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1bag n SER 250 N -0.02 3.16 -4.70 7.28 3.41 -1.06 -4.95 113.62 116.75 1bag n SER 250 Ca 0.32 -0.01 -0.38 0.00 -0.26 0.00 0.00 58.87 58.54 1bag n SER 250 Cb 0.82 0.65 -0.07 0.00 -0.26 0.00 0.00 64.21 65.35 1bag n SER 250 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1bag s HIS 251 N -1.28 3.44 -2.00 7.33 5.65 -1.25 -4.95 115.29 122.22 1bag s HIS 251 Ca 0.00 0.68 0.14 0.00 0.25 0.00 0.00 55.06 56.13 1bag s HIS 251 Cb 0.00 -2.48 0.83 0.00 -1.18 0.00 0.00 32.58 29.76 1bag s HIS 251 CO 0.00 0.11 1.30 0.66 -0.65 0.00 0.00 174.74 176.16 1bag n TYR 252 N 4.00 0.00 -3.92 3.88 4.01 -1.26 -4.87 117.16 119.00 1bag n TYR 252 Ca -0.09 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.36 1bag n TYR 252 Cb 0.51 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.56 1bag n TYR 252 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bag n ALA 253 N -0.84 -1.43 -3.32 -0.72 0.00 -1.26 -3.63 120.51 109.31 1bag n ALA 253 Ca 0.10 0.09 -0.12 0.00 0.00 0.00 0.00 53.44 53.51 1bag n ALA 253 Cb 0.05 -3.83 -0.03 0.00 0.00 0.00 0.00 19.45 15.64 1bag n ALA 253 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bag s SER 254 N -3.53 -0.48 -0.04 0.00 0.15 -1.26 -4.62 113.70 103.93 1bag s SER 254 Ca 0.54 0.02 0.21 0.00 0.70 0.00 0.00 55.95 57.41 1bag s SER 254 Cb -0.27 0.55 0.67 0.00 -1.71 0.00 0.00 66.02 65.25 1bag s SER 254 CO 0.84 -0.87 1.56 -0.90 1.20 0.00 0.00 173.24 175.07 1bag n ASP 255 N -0.11 4.16 -4.88 5.45 5.75 -1.26 -4.87 116.55 120.78 1bag n ASP 255 Ca -0.17 -2.14 -0.35 0.00 -0.01 0.00 0.00 54.79 52.12 1bag n ASP 255 Cb 0.63 -0.52 -0.05 0.00 -1.03 0.00 0.00 41.12 40.15 1bag n ASP 255 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1bag s VAL 256 N -1.29 5.33 0.51 2.12 1.01 -1.26 -4.91 120.40 121.91 1bag s VAL 256 Ca 0.49 0.22 -0.20 0.00 0.00 0.00 0.00 61.98 62.50 1bag s VAL 256 Cb 0.28 -3.54 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 1bag s VAL 256 CO 0.30 0.44 1.05 -0.94 0.00 0.00 0.00 175.10 175.95 1bag s SER 257 N -1.51 6.19 0.55 3.32 1.04 -1.26 -4.93 113.70 117.10 1bag s SER 257 Ca 0.24 1.94 0.33 0.00 0.48 0.00 0.00 55.95 58.95 1bag s SER 257 Cb -0.13 -2.56 1.81 0.00 0.10 0.00 0.00 66.02 65.24 1bag s SER 257 CO 0.13 -0.89 2.01 0.00 0.98 0.00 0.00 173.24 175.48 1bag h ALA 258 N 1.37 1.08 -0.16 5.32 0.00 -1.93 -1.82 119.26 123.12 1bag h ALA 258 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1bag h ALA 258 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1bag h ALA 258 CO 0.59 -0.08 0.00 -0.40 0.00 0.00 0.00 179.25 179.36 1bag n ASP 259 N -2.74 0.93 -0.67 0.00 5.68 -1.24 -2.58 116.55 115.92 1bag n ASP 259 Ca -0.02 -1.94 0.05 0.00 -0.50 0.00 0.00 54.79 52.38 1bag n ASP 259 Cb 0.14 -0.11 0.08 0.00 -1.14 0.00 0.00 41.12 40.09 1bag n ASP 259 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1bag n LYS 260 N -0.02 0.64 -5.12 0.11 4.76 -0.68 -4.98 118.16 112.88 1bag n LYS 260 Ca 0.07 -2.12 -0.29 0.00 -2.87 0.00 0.00 58.31 53.10 1bag n LYS 260 Cb 0.16 -0.85 -0.16 0.00 -1.84 0.00 0.00 35.03 32.34 1bag n LYS 260 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1bag s LEU 261 N -1.38 2.06 -0.16 -0.35 1.02 -1.08 -1.19 118.68 117.60 1bag s LEU 261 Ca 0.24 -0.44 -0.01 0.00 0.02 0.00 0.00 54.13 53.94 1bag s LEU 261 Cb 0.25 -1.20 -0.01 0.00 0.02 0.00 0.00 46.19 45.24 1bag s LEU 261 CO -0.05 0.28 -0.12 -0.69 0.02 0.00 0.00 176.35 175.79 1bag s VAL 262 N -0.59 2.98 0.38 -1.59 1.01 -0.26 -1.04 120.40 121.29 1bag s VAL 262 Ca 0.09 -0.66 0.08 0.00 0.00 0.00 0.00 61.98 61.49 1bag s VAL 262 Cb -0.09 -2.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.94 1bag s VAL 262 CO -0.00 0.50 0.04 0.42 0.00 0.00 0.00 175.10 176.06 1bag s THR 263 N 0.79 2.30 0.19 3.92 -4.23 0.21 -1.63 115.64 117.19 1bag s THR 263 Ca -0.04 -1.94 -0.23 0.00 -1.18 0.00 0.00 61.69 58.29 1bag s THR 263 Cb -0.15 -2.90 0.06 0.00 1.34 0.00 0.00 72.50 70.85 1bag s THR 263 CO 0.01 -0.08 0.92 -1.66 -0.54 0.00 0.00 174.62 173.26 1bag s TRP 264 N -2.61 -0.11 -0.18 3.99 -2.14 -1.26 -0.82 118.94 115.81 1bag s TRP 264 Ca 0.36 -0.26 0.03 0.00 2.66 0.00 0.00 56.10 58.90 1bag s TRP 264 Cb 0.04 0.67 -0.22 0.00 -3.10 0.00 0.00 33.47 30.86 1bag s TRP 264 CO 0.19 -0.95 0.12 0.28 -2.66 0.00 0.00 176.95 173.94 1bag n VAL 265 N -0.49 1.58 -3.55 -0.66 0.31 -1.26 -4.29 118.33 109.97 1bag n VAL 265 Ca -0.05 -0.67 -0.11 0.00 -0.01 0.00 0.00 64.34 63.49 1bag n VAL 265 Cb 0.60 -1.32 -0.04 0.00 -0.91 0.00 0.00 33.84 32.18 1bag n VAL 265 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1bag s GLU 266 N -2.54 1.15 0.46 5.55 -1.05 -1.26 -4.58 118.70 116.43 1bag s GLU 266 Ca -0.23 -0.62 0.05 0.00 -0.15 0.00 0.00 54.97 54.02 1bag s GLU 266 Cb 0.08 0.52 -0.03 0.00 -0.44 0.00 0.00 34.13 34.25 1bag s GLU 266 CO 0.72 -0.47 0.11 -1.54 0.95 0.00 0.00 175.26 175.03 1bag s SER 267 N -2.78 4.22 0.52 0.83 1.04 -1.26 -4.67 113.70 111.59 1bag s SER 267 Ca 0.02 -1.35 0.21 0.00 0.48 0.00 0.00 55.95 55.31 1bag s SER 267 Cb 0.01 -0.03 1.37 0.00 0.10 0.00 0.00 66.02 67.47 1bag s SER 267 CO -0.12 -0.69 2.12 1.12 0.98 0.00 0.00 173.24 176.64 1bag h HIS 268 N 1.40 0.00 0.02 5.02 2.07 -2.00 -2.80 115.15 118.86 1bag h HIS 268 Ca -0.43 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.09 1bag h HIS 268 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 1bag h HIS 268 CO 0.98 0.07 -0.01 -0.44 -3.07 0.00 0.00 177.93 175.46 1bag h ASP 269 N 0.00 -0.03 -0.40 3.10 3.32 -1.96 0.93 116.42 121.39 1bag h ASP 269 Ca -0.00 -0.61 0.09 0.00 0.02 0.00 0.00 57.03 56.53 1bag h ASP 269 Cb 0.15 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1bag h ASP 269 CO 0.01 0.62 0.28 0.71 -1.72 0.00 0.00 179.24 179.13 1bag h THR 270 N -0.69 0.86 0.00 0.35 1.35 -1.91 -0.45 112.91 112.43 1bag h THR 270 Ca -0.00 -0.04 -0.09 0.00 -0.55 0.00 0.00 66.41 65.72 1bag h THR 270 Cb 0.64 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 1bag h THR 270 CO 0.01 0.02 -0.61 0.22 -0.25 0.00 0.00 175.52 174.91 1bag h TYR 271 N 0.12 0.00 0.00 4.73 5.03 -1.52 0.46 116.97 125.79 1bag h TYR 271 Ca 0.18 0.00 -0.16 0.00 2.58 0.00 0.00 58.73 61.34 1bag h TYR 271 Cb 0.57 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.83 1bag h TYR 271 CO -0.00 0.86 -0.84 0.00 -1.32 0.00 0.00 178.16 176.86 1bag h ALA 272 N -0.54 0.57 -2.29 1.82 0.00 -0.71 -3.42 119.26 114.68 1bag h ALA 272 Ca -0.14 -0.71 -0.52 0.00 0.00 0.00 0.00 54.91 53.54 1bag h ALA 272 Cb 0.89 -0.04 0.16 0.00 0.00 0.00 0.00 17.79 18.80 1bag h ALA 272 CO -0.09 0.93 0.27 -0.80 0.00 0.00 0.00 179.25 179.56 1bag s ASN 273 N -6.45 3.75 0.18 0.00 0.01 -0.19 -4.87 114.94 107.38 1bag s ASN 273 Ca 0.02 1.99 0.13 0.00 -0.71 0.00 0.00 52.86 54.29 1bag s ASN 273 Cb 0.09 -2.54 0.69 0.00 0.41 0.00 0.00 41.25 39.90 1bag s ASN 273 CO 0.78 -2.54 1.41 0.47 -1.51 0.00 0.00 177.10 175.71 1bag n ASP 274 N -3.86 0.33 0.08 -1.22 8.00 -1.26 -1.60 116.55 117.02 1bag n ASP 274 Ca 0.10 0.65 -0.05 0.00 0.71 0.00 0.00 54.79 56.20 1bag n ASP 274 Cb 0.53 -0.69 0.15 0.00 -0.02 0.00 0.00 41.12 41.08 1bag n ASP 274 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1bag h ASP 275 N 0.00 0.31 -5.97 -2.24 3.04 -1.90 -3.47 116.42 106.19 1bag h ASP 275 Ca 0.00 -0.16 -0.41 0.00 -3.24 0.00 0.00 57.03 53.22 1bag h ASP 275 Cb 0.03 -0.09 0.08 0.00 -1.04 0.00 0.00 39.33 38.32 1bag h ASP 275 CO 0.00 0.78 -0.75 -0.62 -2.04 0.00 0.00 179.24 176.61 1bag n GLU 276 N -3.93 -6.51 -0.30 4.15 1.02 -0.63 -4.90 120.64 109.54 1bag n GLU 276 Ca -0.02 0.73 0.03 0.00 -0.02 0.00 0.00 57.16 57.88 1bag n GLU 276 Cb 0.57 -5.65 0.23 0.00 -0.02 0.00 0.00 31.44 26.57 1bag n GLU 276 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1bag h GLU 277 N -2.23 1.03 0.00 3.49 4.57 -1.24 -3.22 114.58 116.99 1bag h GLU 277 Ca -0.58 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 57.53 1bag h GLU 277 Cb 1.36 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1bag h GLU 277 CO 0.58 0.68 0.00 -1.13 -1.18 0.00 0.00 179.01 177.96 1bag n SER 278 N -4.48 1.25 0.29 1.04 3.41 -0.56 -4.71 113.62 109.87 1bag n SER 278 Ca 0.13 -1.37 0.14 0.00 -0.26 0.00 0.00 58.87 57.51 1bag n SER 278 Cb 0.17 0.00 0.86 0.00 -0.26 0.00 0.00 64.21 64.98 1bag n SER 278 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1bag h THR 279 N 0.22 0.55 -0.98 6.66 2.02 -1.71 -2.57 112.91 117.10 1bag h THR 279 Ca 0.00 -0.16 0.14 0.00 0.77 0.00 0.00 66.41 67.16 1bag h THR 279 Cb 0.27 1.10 -0.09 0.00 -1.74 0.00 0.00 68.15 67.70 1bag h THR 279 CO 0.00 0.04 0.62 4.11 0.37 0.00 0.00 175.52 180.65 1bag h TRP 280 N 0.00 1.06 -2.05 3.16 5.08 -1.84 0.20 115.95 121.56 1bag h TRP 280 Ca -0.00 0.03 -0.46 0.00 1.08 0.00 0.00 58.89 59.54 1bag h TRP 280 Cb 0.10 -0.33 0.24 0.00 -3.00 0.00 0.00 29.16 26.17 1bag h TRP 280 CO 0.00 0.38 -1.40 -1.33 -1.28 0.00 0.00 178.44 174.81 1bag n MET 281 N -4.63 -1.36 -4.36 0.12 2.81 -0.97 -3.02 117.12 105.71 1bag n MET 281 Ca 0.20 -0.38 -0.19 0.00 -1.81 0.00 0.00 57.70 55.51 1bag n MET 281 Cb 0.43 -1.57 -0.09 0.00 -0.71 0.00 0.00 33.22 31.27 1bag n MET 281 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1bag s SER 282 N -1.69 1.63 0.32 7.83 1.04 -1.26 -0.74 113.70 120.84 1bag s SER 282 Ca 0.52 -1.52 0.05 0.00 0.48 0.00 0.00 55.95 55.48 1bag s SER 282 Cb -0.07 0.32 0.69 0.00 0.10 0.00 0.00 66.02 67.06 1bag s SER 282 CO 0.66 -0.84 1.86 0.44 0.98 0.00 0.00 173.24 176.34 1bag h ASP 283 N 2.20 0.78 -0.56 7.02 3.32 -1.97 -1.22 116.42 125.99 1bag h ASP 283 Ca -0.35 0.04 -0.07 0.00 0.02 0.00 0.00 57.03 56.67 1bag h ASP 283 Cb 1.25 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 1bag h ASP 283 CO 0.55 0.42 0.11 0.44 -1.72 0.00 0.00 179.24 179.04 1bag h ASP 284 N 0.84 0.92 0.07 6.45 3.32 -1.96 0.10 116.42 126.17 1bag h ASP 284 Ca 0.46 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 57.19 1bag h ASP 284 Cb 0.56 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1bag h ASP 284 CO -0.22 0.91 -0.38 0.44 -1.72 0.00 0.00 179.24 178.27 1bag h ASP 285 N 0.91 0.43 -0.28 6.45 3.32 -1.66 -2.70 116.42 122.90 1bag h ASP 285 Ca 0.19 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 56.91 1bag h ASP 285 Cb 0.39 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1bag h ASP 285 CO 0.01 0.77 -0.42 0.40 -1.72 0.00 0.00 179.24 178.29 1bag h ILE 286 N 0.34 1.29 -0.31 0.35 2.04 -0.49 -1.27 117.51 119.47 1bag h ILE 286 Ca 0.03 -1.61 0.04 0.00 1.00 0.00 0.00 64.86 64.33 1bag h ILE 286 Cb 0.83 1.64 -0.04 0.00 -0.74 0.00 0.00 36.82 38.51 1bag h ILE 286 CO 0.07 0.52 0.09 0.03 0.00 0.00 0.00 178.15 178.86 1bag h ARG 287 N 0.53 0.22 -0.47 2.37 3.08 -0.69 0.23 114.38 119.64 1bag h ARG 287 Ca 0.03 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 1bag h ARG 287 Cb 1.01 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1bag h ARG 287 CO 0.10 0.14 -0.10 -0.07 -1.07 0.00 0.00 179.97 178.97 1bag h LEU 288 N 0.22 0.85 -0.43 3.04 3.38 -1.49 -1.34 115.31 119.54 1bag h LEU 288 Ca 0.14 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1bag h LEU 288 Cb 0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1bag h LEU 288 CO -0.16 0.97 0.10 1.23 0.09 0.00 0.00 178.44 180.67 1bag h GLY 289 N 0.97 0.75 0.97 0.83 0.00 -0.63 -2.13 103.07 103.84 1bag h GLY 289 Ca 0.13 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 1bag h GLY 289 CO 0.04 0.44 0.20 -0.25 0.00 0.00 0.00 176.54 176.97 1bag h TRP 290 N 0.57 0.75 -0.95 5.60 2.91 -0.35 -1.88 115.95 122.61 1bag h TRP 290 Ca 0.14 -0.05 0.09 0.00 1.13 0.00 0.00 58.89 60.19 1bag h TRP 290 Cb 0.33 -0.23 -0.08 0.00 -0.51 0.00 0.00 29.16 28.68 1bag h TRP 290 CO 0.02 0.63 0.59 0.00 -1.03 0.00 0.00 178.44 178.65 1bag h ALA 291 N 1.05 1.37 -0.16 2.65 0.00 -1.04 0.28 119.26 123.40 1bag h ALA 291 Ca 0.17 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1bag h ALA 291 Cb 0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1bag h ALA 291 CO -0.01 0.26 -0.00 0.28 0.00 0.00 0.00 179.25 179.78 1bag h VAL 292 N 0.99 1.25 0.07 0.00 2.07 -0.69 -3.17 116.25 116.79 1bag h VAL 292 Ca 0.44 -0.85 -0.29 0.00 0.82 0.00 0.00 66.70 66.83 1bag h VAL 292 Cb 0.34 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1bag h VAL 292 CO -0.23 0.25 -1.50 0.16 0.02 0.00 0.00 177.57 176.27 1bag h ILE 293 N 0.03 1.16 -0.09 4.57 3.07 -1.00 -3.35 117.51 121.91 1bag h ILE 293 Ca 0.05 -2.86 0.00 0.00 1.55 0.00 0.00 64.86 63.59 1bag h ILE 293 Cb 0.38 2.68 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 1bag h ILE 293 CO 0.01 0.78 0.00 0.00 -1.05 0.00 0.00 178.15 177.88 1bag n ALA 294 N -2.60 2.51 0.38 0.16 0.00 0.94 -2.73 120.51 119.17 1bag n ALA 294 Ca -0.14 -0.19 0.06 0.00 0.00 0.00 0.00 53.44 53.16 1bag n ALA 294 Cb 1.03 -1.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.35 1bag n ALA 294 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1bag n SER 295 N -0.27 1.09 -4.72 0.00 3.41 -1.20 -4.19 113.62 107.75 1bag n SER 295 Ca 0.06 -0.53 -0.30 0.00 -0.26 0.00 0.00 58.87 57.84 1bag n SER 295 Cb 0.10 1.18 0.13 0.00 -0.26 0.00 0.00 64.21 65.36 1bag n SER 295 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1bag s ARG 296 N -2.36 1.41 0.07 4.33 1.81 -1.10 -4.96 118.95 118.14 1bag s ARG 296 Ca 0.02 0.92 0.03 0.00 -1.72 0.00 0.00 55.73 54.98 1bag s ARG 296 Cb 0.09 -1.82 -0.04 0.00 -0.45 0.00 0.00 34.95 32.73 1bag s ARG 296 CO 0.49 -2.17 0.04 -1.54 -0.68 0.00 0.00 175.30 171.45 1bag s SER 297 N -3.37 5.29 0.00 0.23 1.04 -1.26 -4.68 113.70 110.95 1bag s SER 297 Ca 0.63 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 57.00 1bag s SER 297 Cb -0.18 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.57 1bag s SER 297 CO 0.57 0.19 0.00 0.61 0.98 0.00 0.00 173.24 175.59 1bag n GLY 298 N 0.67 2.03 3.83 7.32 0.00 -1.26 -4.85 105.19 112.93 1bag n GLY 298 Ca -0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1bag n GLY 298 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bag s SER 299 N -0.27 6.89 -0.42 1.61 1.04 -1.07 -3.66 113.70 117.82 1bag s SER 299 Ca 0.00 1.07 -0.18 0.00 0.48 0.00 0.00 55.95 57.32 1bag s SER 299 Cb 0.00 -2.29 0.02 0.00 0.10 0.00 0.00 66.02 63.85 1bag s SER 299 CO 0.00 0.27 0.48 -0.89 0.98 0.00 0.00 173.24 174.08 1bag s THR 300 N -1.16 5.04 0.32 2.02 2.01 -0.21 -4.91 115.64 118.75 1bag s THR 300 Ca 0.28 -0.23 -0.27 0.00 0.31 0.00 0.00 61.69 61.79 1bag s THR 300 Cb -0.17 -4.06 -0.10 0.00 0.01 0.00 0.00 72.50 68.18 1bag s THR 300 CO 0.16 -0.44 0.98 -2.16 -0.69 0.00 0.00 174.62 172.48 1bag s PRO 301 N 2.27 4.54 -0.22 4.92 0.04 -1.26 -0.62 135.00 144.68 1bag s PRO 301 Ca 0.14 1.45 0.02 0.00 0.04 0.00 0.00 61.00 62.65 1bag s PRO 301 Cb -0.16 -2.86 0.05 0.00 0.04 0.00 0.00 34.50 31.56 1bag s PRO 301 CO 0.15 0.22 -0.13 -1.17 0.04 0.00 0.00 177.00 176.11 1bag s LEU 302 N -1.98 2.79 -0.12 -3.56 1.98 0.00 -1.29 118.68 116.51 1bag s LEU 302 Ca 0.50 -1.08 -0.24 0.00 -2.89 0.00 0.00 54.13 50.42 1bag s LEU 302 Cb -0.22 -1.44 -0.02 0.00 0.66 0.00 0.00 46.19 45.17 1bag s LEU 302 CO 0.28 -0.13 0.77 0.12 -1.89 0.00 0.00 176.35 175.49 1bag s PHE 303 N 1.23 3.49 -0.34 5.38 2.19 0.58 -4.62 117.98 125.89 1bag s PHE 303 Ca -0.03 1.24 -0.17 0.00 0.33 0.00 0.00 56.93 58.29 1bag s PHE 303 Cb -0.17 -2.92 -0.01 0.00 -1.31 0.00 0.00 43.02 38.61 1bag s PHE 303 CO -0.08 -0.10 0.47 0.12 1.83 0.00 0.00 175.22 177.47 1bag s PHE 304 N 1.55 3.19 -0.60 10.12 5.36 -1.26 0.37 117.98 136.70 1bag s PHE 304 Ca 0.38 0.16 -0.28 0.00 -0.96 0.00 0.00 56.93 56.23 1bag s PHE 304 Cb -0.17 -2.84 0.03 0.00 -0.34 0.00 0.00 43.02 39.70 1bag s PHE 304 CO 0.15 -0.49 1.18 0.45 -1.46 0.00 0.00 175.22 175.05 1bag s SER 305 N 1.74 6.40 0.61 6.13 0.15 -1.03 -4.98 113.70 122.71 1bag s SER 305 Ca 0.17 -0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.68 1bag s SER 305 Cb -0.16 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 1bag s SER 305 CO 0.13 -1.51 1.02 -0.13 1.20 0.00 0.00 173.24 173.95 1bag s ARG 306 N 4.96 3.63 0.47 5.44 0.52 -1.26 -4.37 118.95 128.34 1bag s ARG 306 Ca 0.40 0.76 -0.24 0.00 -0.52 0.00 0.00 55.73 56.13 1bag s ARG 306 Cb -0.08 -2.09 -0.08 0.00 0.52 0.00 0.00 34.95 33.22 1bag s ARG 306 CO 0.23 -0.54 1.39 -2.30 0.02 0.00 0.00 175.30 174.10 1bag n PRO 307 N -2.63 2.05 -1.65 3.54 -0.02 -1.26 -1.33 135.00 133.70 1bag n PRO 307 Ca 0.06 0.74 -0.52 0.00 -2.02 0.00 0.00 63.50 61.76 1bag n PRO 307 Cb 0.54 -2.58 -0.06 0.00 -0.02 0.00 0.00 33.50 31.38 1bag n PRO 307 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1bag n GLU 308 N -0.38 1.63 -0.64 -0.52 4.07 -1.26 -0.32 120.64 123.22 1bag n GLU 308 Ca 0.07 0.58 0.00 0.00 -0.06 0.00 0.00 57.16 57.74 1bag n GLU 308 Cb 0.42 -2.45 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 1bag n GLU 308 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1bag n GLY 309 N 4.77 0.75 3.87 8.31 0.00 -1.26 -4.49 105.19 117.13 1bag n GLY 309 Ca 0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 1bag n GLY 309 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bag s GLY 310 N -1.82 1.63 0.00 -0.02 0.00 0.56 -4.76 107.32 102.92 1bag s GLY 310 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 44.72 44.44 1bag s GLY 310 CO 0.00 0.08 0.00 0.61 0.00 0.00 0.00 173.10 173.79 1bag n GLY 311 N -2.81 3.05 3.21 0.20 0.00 0.41 -4.95 105.19 104.30 1bag n GLY 311 Ca 0.07 -2.01 -0.21 0.00 0.00 0.00 0.00 46.02 43.87 1bag n GLY 311 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bag n ASN 312 N 0.00 -5.84 0.00 1.61 3.02 0.08 -1.81 115.26 112.32 1bag n ASN 312 Ca 0.00 -0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 1bag n ASN 312 Cb 0.00 -4.53 0.00 0.00 -0.61 0.00 0.00 39.78 34.64 1bag n ASN 312 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bag n GLY 313 N -1.72 3.02 3.62 7.41 0.00 -0.06 -4.87 105.19 112.60 1bag n GLY 313 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1bag n GLY 313 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bag s VAL 314 N -2.08 4.45 -0.14 1.61 1.01 -0.75 -4.85 120.40 119.64 1bag s VAL 314 Ca 0.00 1.50 -0.11 0.00 0.00 0.00 0.00 61.98 63.37 1bag s VAL 314 Cb 0.00 -4.45 -0.08 0.00 0.00 0.00 0.00 36.38 31.86 1bag s VAL 314 CO 0.00 -0.62 0.03 0.03 0.00 0.00 0.00 175.10 174.54 1bag h ARG 315 N 8.44 0.00 -3.34 2.72 3.08 -1.91 0.12 114.38 123.50 1bag h ARG 315 Ca -0.22 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.16 1bag h ARG 315 Cb 1.06 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.73 1bag h ARG 315 CO 1.05 0.29 -0.38 -0.06 -1.07 0.00 0.00 179.97 179.79 1bag s PHE 316 N -2.09 3.56 -0.06 3.04 0.08 -1.26 -4.70 117.98 116.55 1bag s PHE 316 Ca -0.14 -3.05 0.29 0.00 0.12 0.00 0.00 56.93 54.15 1bag s PHE 316 Cb 0.02 -3.03 1.40 0.00 -0.57 0.00 0.00 43.02 40.84 1bag s PHE 316 CO 0.28 -0.72 1.88 -1.00 -0.10 0.00 0.00 175.22 175.56 1bag h PRO 317 N 6.22 0.00 -2.43 0.24 0.13 -1.85 -3.47 132.00 130.84 1bag h PRO 317 Ca 0.07 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.05 1bag h PRO 317 Cb 0.85 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.02 1bag h PRO 317 CO 0.75 0.00 -0.24 0.41 -0.23 0.00 0.00 178.00 178.70 1bag n GLY 318 N -0.63 0.35 0.05 1.56 0.00 -1.26 -4.94 105.19 100.32 1bag n GLY 318 Ca -0.00 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.67 1bag n GLY 318 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bag n LYS 319 N -2.05 3.75 -4.03 1.61 5.02 -1.26 -5.03 118.16 116.16 1bag n LYS 319 Ca -0.01 -0.15 -0.12 0.00 -2.02 0.00 0.00 58.31 56.00 1bag n LYS 319 Cb 0.53 -0.92 -0.04 0.00 -0.02 0.00 0.00 35.03 34.58 1bag n LYS 319 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1bag s SER 320 N -1.63 0.53 0.30 4.39 1.04 -1.26 -4.97 113.70 112.10 1bag s SER 320 Ca 0.04 -1.30 0.04 0.00 0.48 0.00 0.00 55.95 55.21 1bag s SER 320 Cb 0.06 0.66 -0.03 0.00 0.10 0.00 0.00 66.02 66.81 1bag s SER 320 CO 0.30 -1.30 0.19 -1.10 0.98 0.00 0.00 173.24 172.32 1bag s GLN 321 N -3.22 1.61 0.25 4.02 -0.21 -1.26 -4.55 119.66 116.30 1bag s GLN 321 Ca 0.27 -1.92 -0.31 0.00 0.02 0.00 0.00 55.36 53.42 1bag s GLN 321 Cb -0.01 0.07 -0.12 0.00 1.00 0.00 0.00 33.01 33.95 1bag s GLN 321 CO 0.16 -0.51 1.65 -0.89 -2.12 0.00 0.00 175.29 173.58 1bag n ILE 322 N -0.57 0.55 0.00 1.08 5.41 0.14 -1.31 119.36 124.67 1bag n ILE 322 Ca 0.03 -0.14 0.00 0.00 1.00 0.00 0.00 62.75 63.64 1bag n ILE 322 Cb 0.64 -1.96 0.00 0.00 -0.71 0.00 0.00 39.64 37.61 1bag n ILE 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1bag n GLY 323 N 2.98 2.47 3.78 7.39 0.00 0.40 -4.93 105.19 117.28 1bag n GLY 323 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1bag n GLY 323 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bag s ASP 324 N 0.41 6.16 0.55 1.61 1.01 -0.43 -1.33 116.67 124.64 1bag s ASP 324 Ca 0.00 2.10 -0.22 0.00 0.71 0.00 0.00 52.55 55.14 1bag s ASP 324 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 1bag s ASP 324 CO 0.00 -0.91 1.35 -0.60 0.21 0.00 0.00 175.17 175.21 1bag s ARG 325 N -3.05 3.14 0.13 8.23 3.52 -1.26 -4.47 118.95 125.20 1bag s ARG 325 Ca 0.67 2.21 -0.02 0.00 -0.13 0.00 0.00 55.73 58.46 1bag s ARG 325 Cb -0.22 -2.25 0.03 0.00 -1.56 0.00 0.00 34.95 30.96 1bag s ARG 325 CO 0.26 -1.18 0.14 0.41 -0.81 0.00 0.00 175.30 174.12 1bag n GLY 326 N 0.72 -1.76 3.64 8.12 0.00 -1.26 -4.63 105.19 110.02 1bag n GLY 326 Ca 0.10 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.25 1bag n GLY 326 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bag s SER 327 N -1.70 2.65 0.01 1.61 1.04 -0.44 -4.70 113.70 112.17 1bag s SER 327 Ca 0.09 1.86 0.23 0.00 0.48 0.00 0.00 55.95 58.61 1bag s SER 327 Cb -0.00 -2.43 0.96 0.00 0.10 0.00 0.00 66.02 64.64 1bag s SER 327 CO 0.06 -3.21 1.72 0.00 0.98 0.00 0.00 173.24 172.79 1bag n ALA 328 N -4.29 2.03 -0.13 5.32 0.00 -1.26 -3.74 120.51 118.44 1bag n ALA 328 Ca 0.08 -0.07 0.24 0.00 0.00 0.00 0.00 53.44 53.69 1bag n ALA 328 Cb 0.53 -1.37 0.68 0.00 0.00 0.00 0.00 19.45 19.29 1bag n ALA 328 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1bag h LEU 329 N 0.00 0.07 -2.42 0.00 5.85 -1.96 0.71 115.31 117.56 1bag h LEU 329 Ca 0.00 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1bag h LEU 329 Cb 0.40 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 1bag h LEU 329 CO 0.00 0.03 0.19 2.19 -0.34 0.00 0.00 178.44 180.51 1bag h PHE 330 N 0.07 0.00 -0.04 1.25 -0.00 -1.95 -1.40 116.94 114.86 1bag h PHE 330 Ca 0.37 0.00 -0.07 0.00 -0.00 0.00 0.00 57.97 58.27 1bag h PHE 330 Cb 1.38 0.00 -0.12 0.00 -0.00 0.00 0.00 35.95 37.22 1bag h PHE 330 CO -0.00 0.00 -0.65 -0.85 -0.00 0.00 0.00 178.31 176.81 1bag n GLU 331 N -3.11 1.32 -2.18 6.09 0.28 0.24 -4.76 120.64 118.52 1bag n GLU 331 Ca -0.02 -3.05 -0.36 0.00 -0.16 0.00 0.00 57.16 53.57 1bag n GLU 331 Cb 0.26 -1.28 0.01 0.00 1.43 0.00 0.00 31.44 31.86 1bag n GLU 331 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1bag s ASP 332 N -2.98 5.68 0.35 -1.84 2.15 -0.53 -4.79 116.67 114.71 1bag s ASP 332 Ca 0.38 2.29 0.09 0.00 0.43 0.00 0.00 52.55 55.73 1bag s ASP 332 Cb 0.38 -2.59 0.81 0.00 -0.30 0.00 0.00 42.92 41.22 1bag s ASP 332 CO -0.09 -1.25 1.87 -0.61 -0.17 0.00 0.00 175.17 174.92 1bag h GLN 333 N 1.34 0.68 0.03 4.34 4.15 -1.91 0.52 115.11 124.26 1bag h GLN 333 Ca -0.50 -0.04 -0.25 0.00 0.77 0.00 0.00 58.65 58.63 1bag h GLN 333 Cb 1.27 -0.15 0.01 0.00 0.21 0.00 0.00 27.48 28.82 1bag h GLN 333 CO 0.57 0.45 -1.04 0.00 -1.93 0.00 0.00 178.83 176.88 1bag h ALA 334 N 1.60 0.23 -0.15 3.38 0.00 -1.87 -2.11 119.26 120.33 1bag h ALA 334 Ca 0.45 -0.73 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1bag h ALA 334 Cb 0.72 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1bag h ALA 334 CO -0.21 0.78 -0.10 0.82 0.00 0.00 0.00 179.25 180.54 1bag h ILE 335 N 0.27 1.33 -0.68 0.00 5.03 -1.72 -2.79 117.51 118.94 1bag h ILE 335 Ca -0.11 -1.18 0.05 0.00 -0.12 0.00 0.00 64.86 63.50 1bag h ILE 335 Cb 1.69 1.78 -0.05 0.00 -3.03 0.00 0.00 36.82 37.21 1bag h ILE 335 CO 0.19 0.35 0.39 0.74 -0.68 0.00 0.00 178.15 179.14 1bag h THR 336 N -0.01 1.00 -0.71 -0.27 2.02 -0.98 -1.02 112.91 112.93 1bag h THR 336 Ca 0.03 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 1bag h THR 336 Cb 0.59 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1bag h THR 336 CO 0.03 0.13 0.33 0.00 0.37 0.00 0.00 175.52 176.38 1bag h ALA 337 N 1.34 1.24 -0.03 6.16 0.00 -1.35 -1.14 119.26 125.47 1bag h ALA 337 Ca 0.30 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 1bag h ALA 337 Cb 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1bag h ALA 337 CO -0.16 0.58 -0.70 0.28 0.00 0.00 0.00 179.25 179.25 1bag h VAL 338 N 1.02 1.45 -0.02 0.00 2.07 -1.09 -0.52 116.25 119.16 1bag h VAL 338 Ca 0.25 -2.28 -0.00 0.00 0.82 0.00 0.00 66.70 65.49 1bag h VAL 338 Cb 0.12 2.22 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1bag h VAL 338 CO -0.03 0.66 0.00 0.78 0.02 0.00 0.00 177.57 179.00 1bag h ASN 339 N 0.09 0.03 -0.26 0.57 2.35 -0.70 0.50 115.58 118.16 1bag h ASN 339 Ca -0.02 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.53 1bag h ASN 339 Cb 1.24 -0.01 -0.05 0.00 0.05 0.00 0.00 38.32 39.56 1bag h ASN 339 CO 0.10 0.28 -0.04 0.03 -1.65 0.00 0.00 177.43 176.15 1bag h ARG 340 N -0.23 0.03 -0.13 0.81 3.08 -1.16 0.49 114.38 117.27 1bag h ARG 340 Ca 0.00 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1bag h ARG 340 Cb 0.26 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1bag h ARG 340 CO 0.00 0.02 -0.11 0.35 -1.07 0.00 0.00 179.97 179.15 1bag h PHE 341 N 0.03 -0.28 -0.53 3.04 3.57 -0.90 0.15 116.94 122.02 1bag h PHE 341 Ca 0.12 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.73 1bag h PHE 341 Cb 0.18 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.99 1bag h PHE 341 CO -0.24 -0.17 0.13 1.25 -2.23 0.00 0.00 178.31 177.05 1bag h HIS 342 N -0.13 0.22 0.62 0.41 2.76 0.85 -0.68 115.15 119.20 1bag h HIS 342 Ca 0.09 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.26 1bag h HIS 342 Cb 0.26 -0.02 0.01 0.00 1.55 0.00 0.00 27.41 29.21 1bag h HIS 342 CO -0.24 0.02 -0.30 -0.91 -1.30 0.00 0.00 177.93 175.20 1bag h ASN 343 N 0.28 -0.71 0.11 3.26 -0.26 -0.19 -3.13 115.58 114.94 1bag h ASN 343 Ca 0.27 -0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.98 1bag h ASN 343 Cb 0.36 0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.80 1bag h ASN 343 CO -0.33 -0.42 -0.06 -0.37 -1.06 0.00 0.00 177.43 175.19 1bag h VAL 344 N -0.97 0.77 -0.30 2.81 -1.51 -0.79 -1.85 116.25 114.40 1bag h VAL 344 Ca -0.09 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 1bag h VAL 344 Cb 0.68 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1bag h VAL 344 CO 0.14 0.06 0.00 0.23 -1.23 0.00 0.00 177.57 176.77 1bag n MET 345 N -4.06 1.78 -1.71 5.19 2.81 -0.28 -4.92 117.12 115.93 1bag n MET 345 Ca -0.03 -1.12 -0.43 0.00 -1.81 0.00 0.00 57.70 54.31 1bag n MET 345 Cb 0.15 -1.28 -0.02 0.00 -0.71 0.00 0.00 33.22 31.36 1bag n MET 345 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1bag n ALA 346 N 0.39 1.89 0.00 3.04 0.00 -0.70 -1.07 120.51 124.06 1bag n ALA 346 Ca 0.10 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1bag n ALA 346 Cb 0.29 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.36 1bag n ALA 346 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bag n GLY 347 N 2.25 2.88 3.77 0.00 0.00 -1.26 -5.03 105.19 107.80 1bag n GLY 347 Ca 0.10 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1bag n GLY 347 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bag s GLN 348 N 0.00 4.18 0.80 1.61 1.11 -0.24 -5.04 119.66 122.09 1bag s GLN 348 Ca 0.00 2.16 -0.11 0.00 0.01 0.00 0.00 55.36 57.42 1bag s GLN 348 Cb 0.00 -2.91 0.08 0.00 -1.01 0.00 0.00 33.01 29.17 1bag s GLN 348 CO 0.00 -0.32 1.16 -1.25 0.01 0.00 0.00 175.29 174.89 1bag s PRO 349 N -2.01 1.92 0.25 2.91 0.04 -1.26 -4.78 135.00 132.06 1bag s PRO 349 Ca 0.53 0.03 0.04 0.00 0.04 0.00 0.00 61.00 61.64 1bag s PRO 349 Cb -0.38 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.13 1bag s PRO 349 CO 0.50 -1.59 -0.01 -1.83 0.04 0.00 0.00 177.00 174.11 1bag s GLU 350 N -5.55 1.40 -0.25 4.56 -1.05 -1.26 -2.54 118.70 114.01 1bag s GLU 350 Ca 0.62 -1.71 -0.06 0.00 -0.15 0.00 0.00 54.97 53.67 1bag s GLU 350 Cb -0.11 -0.73 0.13 0.00 -0.44 0.00 0.00 34.13 32.98 1bag s GLU 350 CO 0.49 -0.08 0.51 -2.00 0.95 0.00 0.00 175.26 175.12 1bag s GLU 351 N -3.84 0.44 0.20 -4.83 2.56 -1.05 -4.96 118.70 107.22 1bag s GLU 351 Ca 0.29 1.05 -0.03 0.00 0.00 0.00 0.00 54.97 56.29 1bag s GLU 351 Cb 0.06 0.37 -0.05 0.00 2.00 0.00 0.00 34.13 36.51 1bag s GLU 351 CO 0.10 -0.38 0.42 -0.51 -0.56 0.00 0.00 175.26 174.33 1bag s LEU 352 N 2.72 4.21 0.27 2.70 1.43 -1.26 -2.05 118.68 126.70 1bag s LEU 352 Ca 0.04 0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 53.46 1bag s LEU 352 Cb -0.13 -3.28 0.07 0.00 0.03 0.00 0.00 46.19 42.88 1bag s LEU 352 CO -0.17 -0.05 0.94 -0.94 0.23 0.00 0.00 176.35 176.37 1bag s SER 353 N -2.96 0.01 -0.32 2.29 1.04 -0.98 -5.03 113.70 107.75 1bag s SER 353 Ca 0.40 -0.87 -0.01 0.00 0.48 0.00 0.00 55.95 55.95 1bag s SER 353 Cb -0.11 0.64 0.11 0.00 0.10 0.00 0.00 66.02 66.76 1bag s SER 353 CO 0.28 -1.28 0.12 0.20 0.98 0.00 0.00 173.24 173.54 1bag s ASN 354 N -3.27 3.92 -0.23 7.02 -0.87 -1.26 -2.39 114.94 117.84 1bag s ASN 354 Ca 0.19 -1.73 -0.43 0.00 -1.57 0.00 0.00 52.86 49.32 1bag s ASN 354 Cb -0.04 -0.82 -0.19 0.00 -0.02 0.00 0.00 41.25 40.17 1bag s ASN 354 CO 0.08 -0.40 1.37 -2.65 -2.57 0.00 0.00 177.10 172.93 1bag n PRO 355 N 4.71 0.15 -2.50 -0.60 -0.02 -1.26 -0.71 135.00 134.79 1bag n PRO 355 Ca -0.01 0.06 -0.20 0.00 -2.02 0.00 0.00 63.50 61.33 1bag n PRO 355 Cb 0.41 -1.58 -0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1bag n PRO 355 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1bag n ASN 356 N 2.94 -5.66 -0.22 2.55 4.13 -1.26 -1.16 115.26 116.58 1bag n ASN 356 Ca 0.25 -0.03 -0.03 0.00 1.68 0.00 0.00 54.58 56.45 1bag n ASN 356 Cb 0.03 -4.70 -0.01 0.00 -1.54 0.00 0.00 39.78 33.56 1bag n ASN 356 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1bag n GLY 357 N -1.06 0.41 3.58 7.41 0.00 0.12 -4.94 105.19 110.71 1bag n GLY 357 Ca -0.21 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1bag n GLY 357 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bag s ASN 358 N -2.16 6.58 0.00 1.61 3.84 -0.31 -4.90 114.94 119.60 1bag s ASN 358 Ca 0.00 0.32 0.21 0.00 0.21 0.00 0.00 52.86 53.60 1bag s ASN 358 Cb 0.00 -2.47 1.05 0.00 -0.55 0.00 0.00 41.25 39.28 1bag s ASN 358 CO 0.00 -1.01 1.67 -0.46 -2.79 0.00 0.00 177.10 174.51 1bag n ASN 359 N 7.12 0.00 -0.11 -4.21 0.23 -1.26 -2.04 115.26 114.99 1bag n ASN 359 Ca 0.07 0.03 0.13 0.00 -0.53 0.00 0.00 54.58 54.29 1bag n ASN 359 Cb 0.48 -0.30 0.48 0.00 -2.08 0.00 0.00 39.78 38.36 1bag n ASN 359 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1bag n GLN 360 N -1.30 0.50 -4.18 -3.83 6.02 -1.26 -0.10 117.38 113.22 1bag n GLN 360 Ca 0.10 -0.22 -0.34 0.00 -0.01 0.00 0.00 57.00 56.53 1bag n GLN 360 Cb 0.17 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.79 1bag n GLN 360 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1bag s ILE 361 N -2.65 2.77 -0.16 5.09 1.01 -0.87 -0.80 121.20 125.59 1bag s ILE 361 Ca 0.22 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 60.09 1bag s ILE 361 Cb 0.19 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 1bag s ILE 361 CO 0.54 0.49 0.07 0.12 0.00 0.00 0.00 174.94 176.16 1bag s PHE 362 N 1.18 3.31 -0.05 3.97 5.36 0.95 -4.02 117.98 128.67 1bag s PHE 362 Ca 0.02 0.18 0.02 0.00 -0.96 0.00 0.00 56.93 56.18 1bag s PHE 362 Cb -0.14 -2.03 0.02 0.00 -0.34 0.00 0.00 43.02 40.52 1bag s PHE 362 CO -0.05 0.29 -0.08 1.41 -1.46 0.00 0.00 175.22 175.33 1bag s MET 363 N 0.03 1.22 -0.16 10.12 -2.45 -1.01 -0.20 119.30 126.85 1bag s MET 363 Ca 0.06 -0.25 0.00 0.00 -1.25 0.00 0.00 55.69 54.26 1bag s MET 363 Cb -0.12 -1.09 0.03 0.00 1.25 0.00 0.00 34.83 34.90 1bag s MET 363 CO 0.01 -0.03 -0.13 1.21 1.05 0.00 0.00 175.02 177.14 1bag s ASN 364 N 0.77 2.82 -0.34 1.11 3.84 0.18 -2.31 114.94 121.02 1bag s ASN 364 Ca -0.13 -0.57 -0.08 0.00 0.21 0.00 0.00 52.86 52.29 1bag s ASN 364 Cb -0.15 -1.16 0.03 0.00 -0.55 0.00 0.00 41.25 39.42 1bag s ASN 364 CO 0.02 -0.08 0.13 -1.58 -2.79 0.00 0.00 177.10 172.79 1bag s GLN 365 N 1.49 2.80 -0.58 0.43 0.74 -0.87 -0.97 119.66 122.69 1bag s GLN 365 Ca 0.03 -1.07 -0.20 0.00 0.05 0.00 0.00 55.36 54.18 1bag s GLN 365 Cb -0.14 -3.52 0.09 0.00 1.10 0.00 0.00 33.01 30.54 1bag s GLN 365 CO -0.10 -0.62 0.74 1.03 -0.55 0.00 0.00 175.29 175.79 1bag s ARG 366 N 1.47 3.08 5.89 1.67 1.81 -0.36 -2.54 118.95 129.97 1bag s ARG 366 Ca 0.00 -1.11 0.00 0.00 -1.72 0.00 0.00 55.73 52.90 1bag s ARG 366 Cb -0.19 -4.22 0.00 0.00 -0.45 0.00 0.00 34.95 30.10 1bag s ARG 366 CO 0.04 -1.51 0.00 0.41 -0.68 0.00 0.00 175.30 173.56 1bag n GLY 367 N 5.26 3.22 0.54 -3.53 0.00 -1.05 -1.58 105.19 108.05 1bag n GLY 367 Ca -0.08 -0.13 0.06 0.00 0.00 0.00 0.00 46.02 45.88 1bag n GLY 367 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bag n SER 368 N 3.30 1.83 -0.09 1.61 3.41 -1.26 -4.68 113.62 117.74 1bag n SER 368 Ca 0.00 -3.79 -0.18 0.00 -0.26 0.00 0.00 58.87 54.64 1bag n SER 368 Cb 0.00 -0.52 -0.07 0.00 -0.26 0.00 0.00 64.21 63.36 1bag n SER 368 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1bag n HIS 369 N -1.16 0.00 -4.09 7.33 8.25 -0.61 -4.39 115.22 120.54 1bag n HIS 369 Ca 0.19 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.55 1bag n HIS 369 Cb 0.69 -0.66 -0.09 0.00 1.12 0.00 0.00 29.99 31.05 1bag n HIS 369 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1bag s GLY 370 N -5.43 0.90 -0.05 -1.41 0.00 -1.07 -4.22 107.32 96.03 1bag s GLY 370 Ca -0.25 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.14 1bag s GLY 370 CO 0.34 -1.16 0.12 0.14 0.00 0.00 0.00 173.10 172.54 1bag s VAL 371 N -4.04 -0.03 -0.15 1.40 1.01 0.14 -1.23 120.40 117.49 1bag s VAL 371 Ca 0.25 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.37 1bag s VAL 371 Cb 0.06 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 36.25 1bag s VAL 371 CO 0.04 0.05 -0.20 -0.69 0.00 0.00 0.00 175.10 174.30 1bag s VAL 372 N 0.77 2.18 -0.05 2.92 1.01 -0.15 0.20 120.40 127.28 1bag s VAL 372 Ca -0.06 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.04 1bag s VAL 372 Cb -0.08 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 1bag s VAL 372 CO -0.04 0.54 -0.18 -0.76 0.00 0.00 0.00 175.10 174.67 1bag s LEU 373 N 0.93 2.53 -0.11 3.92 1.43 -0.02 -0.64 118.68 126.73 1bag s LEU 373 Ca -0.04 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 52.75 1bag s LEU 373 Cb -0.15 -1.50 0.04 0.00 0.03 0.00 0.00 46.19 44.61 1bag s LEU 373 CO -0.04 0.32 0.01 0.00 0.23 0.00 0.00 176.35 176.87 1bag s ALA 374 N -0.58 0.79 -0.48 4.21 0.00 0.71 -0.26 121.76 126.15 1bag s ALA 374 Ca 0.08 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.65 1bag s ALA 374 Cb -0.11 -0.86 0.11 0.00 0.00 0.00 0.00 23.12 22.26 1bag s ALA 374 CO 0.01 -0.65 0.37 1.21 0.00 0.00 0.00 175.76 176.70 1bag s ASN 375 N 1.94 5.82 0.16 0.00 2.47 0.09 -0.04 114.94 125.39 1bag s ASN 375 Ca 0.03 -1.80 0.25 0.00 0.42 0.00 0.00 52.86 51.77 1bag s ASN 375 Cb -0.14 -2.06 0.92 0.00 -1.45 0.00 0.00 41.25 38.53 1bag s ASN 375 CO -0.06 -0.70 1.78 0.00 -3.72 0.00 0.00 177.10 174.39 1bag n ALA 376 N 5.00 2.13 -1.08 1.71 0.00 0.02 -2.17 120.51 126.12 1bag n ALA 376 Ca -0.10 -0.02 -0.32 0.00 0.00 0.00 0.00 53.44 53.00 1bag n ALA 376 Cb 0.41 -1.44 0.12 0.00 0.00 0.00 0.00 19.45 18.55 1bag n ALA 376 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1bag s GLY 377 N -3.41 1.99 0.00 0.00 0.00 -1.25 -4.60 107.32 100.05 1bag s GLY 377 Ca 0.10 0.68 0.18 0.00 0.00 0.00 0.00 44.72 45.68 1bag s GLY 377 CO 0.52 1.08 1.53 1.44 0.00 0.00 0.00 173.10 177.67 1bag n SER 378 N -3.44 1.28 -4.19 1.64 7.64 -1.26 -1.23 113.62 114.06 1bag n SER 378 Ca 0.12 -1.69 -0.11 0.00 1.01 0.00 0.00 58.87 58.20 1bag n SER 378 Cb 0.51 -0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 63.52 1bag n SER 378 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1bag s SER 379 N -1.48 0.63 0.44 6.43 1.04 -1.26 -4.91 113.70 114.58 1bag s SER 379 Ca 0.29 -1.21 -0.17 0.00 0.48 0.00 0.00 55.95 55.34 1bag s SER 379 Cb 0.15 0.24 -0.09 0.00 0.10 0.00 0.00 66.02 66.42 1bag s SER 379 CO 0.23 -0.68 0.91 -0.44 0.98 0.00 0.00 173.24 174.24 1bag s SER 380 N -3.10 6.75 -0.01 7.02 0.01 -1.26 -3.77 113.70 119.34 1bag s SER 380 Ca 0.25 1.52 0.01 0.00 1.31 0.00 0.00 55.95 59.04 1bag s SER 380 Cb 0.07 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1bag s SER 380 CO 0.03 -0.42 -0.04 -0.69 0.41 0.00 0.00 173.24 172.53 1bag s VAL 381 N -2.33 0.37 -0.14 3.43 1.01 -0.84 -4.92 120.40 116.97 1bag s VAL 381 Ca 0.58 -0.17 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 1bag s VAL 381 Cb -0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 36.38 35.91 1bag s VAL 381 CO 0.22 0.12 0.18 -0.44 0.00 0.00 0.00 175.10 175.18 1bag s SER 382 N 0.05 6.37 0.27 3.32 0.01 -1.26 -0.19 113.70 122.28 1bag s SER 382 Ca -0.00 0.44 0.11 0.00 1.31 0.00 0.00 55.95 57.80 1bag s SER 382 Cb -0.04 -2.11 -0.05 0.00 0.21 0.00 0.00 66.02 64.04 1bag s SER 382 CO -0.00 0.28 -0.08 0.27 0.41 0.00 0.00 173.24 174.11 1bag s ILE 383 N -0.34 3.02 -0.36 1.44 -4.36 0.76 -4.95 121.20 116.41 1bag s ILE 383 Ca 0.14 -2.12 0.05 0.00 -0.26 0.00 0.00 60.65 58.46 1bag s ILE 383 Cb -0.12 -2.62 0.17 0.00 1.25 0.00 0.00 42.46 41.14 1bag s ILE 383 CO 0.03 -0.38 0.52 0.21 0.24 0.00 0.00 174.94 175.56 1bag s ASN 384 N -3.61 -0.55 0.23 4.36 3.84 -1.20 -3.02 114.94 114.98 1bag s ASN 384 Ca 0.31 -0.76 0.04 0.00 0.21 0.00 0.00 52.86 52.65 1bag s ASN 384 Cb -0.06 1.48 -0.05 0.00 -0.55 0.00 0.00 41.25 42.07 1bag s ASN 384 CO 0.18 -0.24 -0.01 0.42 -2.79 0.00 0.00 177.10 174.66 1bag s THR 385 N 2.01 1.06 0.77 -5.21 -4.23 -0.37 -4.77 115.64 104.91 1bag s THR 385 Ca 0.14 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 58.51 1bag s THR 385 Cb -0.09 -2.35 0.06 0.00 1.34 0.00 0.00 72.50 71.45 1bag s THR 385 CO -0.13 -0.32 1.09 0.00 -0.54 0.00 0.00 174.62 174.72 1bag s ALA 386 N -3.40 2.24 -0.10 3.99 0.00 -1.26 0.35 121.76 123.58 1bag s ALA 386 Ca 0.28 0.22 -0.25 0.00 0.00 0.00 0.00 51.96 52.21 1bag s ALA 386 Cb 0.06 -3.26 0.06 0.00 0.00 0.00 0.00 23.12 19.98 1bag s ALA 386 CO 0.09 -1.76 0.60 0.99 0.00 0.00 0.00 175.76 175.67 1bag s THR 387 N -2.92 0.01 -2.51 0.00 2.01 -0.30 -4.57 115.64 107.36 1bag s THR 387 Ca 0.61 -0.09 0.26 0.00 0.31 0.00 0.00 61.69 62.79 1bag s THR 387 Cb -0.17 -0.89 0.39 0.00 0.01 0.00 0.00 72.50 71.84 1bag s THR 387 CO 0.56 -0.05 1.56 0.29 -0.69 0.00 0.00 174.62 176.29 1bag n LYS 388 N 1.52 1.70 -2.43 4.92 5.02 -1.26 -4.63 118.16 123.01 1bag n LYS 388 Ca -0.18 -1.15 -0.36 0.00 -2.02 0.00 0.00 58.31 54.60 1bag n LYS 388 Cb 0.56 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 34.07 1bag n LYS 388 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bag s LEU 389 N -2.09 3.97 0.91 -0.35 1.43 -1.26 -4.61 118.68 116.68 1bag s LEU 389 Ca 0.33 2.10 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 1bag s LEU 389 Cb 0.20 -4.36 0.14 0.00 0.03 0.00 0.00 46.19 42.20 1bag s LEU 389 CO 0.36 -0.79 1.09 -2.16 0.23 0.00 0.00 176.35 175.09 1bag s PRO 390 N -2.86 1.10 0.60 1.29 0.04 -1.26 -4.72 135.00 129.18 1bag s PRO 390 Ca 0.64 0.90 -0.17 0.00 0.04 0.00 0.00 61.00 62.42 1bag s PRO 390 Cb -0.22 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1bag s PRO 390 CO 0.27 -2.37 1.09 -0.51 0.04 0.00 0.00 177.00 175.52 1bag s ASP 391 N -3.28 5.57 0.00 6.66 1.01 -1.26 -4.71 116.67 120.66 1bag s ASP 391 Ca 0.64 1.97 0.00 0.00 0.71 0.00 0.00 52.55 55.87 1bag s ASP 391 Cb -0.19 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.19 1bag s ASP 391 CO 0.58 -1.32 0.00 0.61 0.21 0.00 0.00 175.17 175.25 1bag n GLY 392 N -0.50 1.46 3.83 0.21 0.00 -0.29 -4.93 105.19 104.99 1bag n GLY 392 Ca 0.10 -1.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 1bag n GLY 392 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bag s ARG 393 N -1.52 3.96 -0.11 1.61 3.52 -1.26 -1.21 118.95 123.93 1bag s ARG 393 Ca 0.00 0.46 -0.01 0.00 -0.13 0.00 0.00 55.73 56.04 1bag s ARG 393 Cb 0.00 -3.20 0.03 0.00 -1.56 0.00 0.00 34.95 30.22 1bag s ARG 393 CO 0.00 0.67 -0.01 0.71 -0.81 0.00 0.00 175.30 175.86 1bag s TYR 394 N -1.12 0.92 0.12 5.12 2.02 -0.02 -4.99 117.35 119.40 1bag s TYR 394 Ca 0.26 -0.44 -0.21 0.00 -0.37 0.00 0.00 57.07 56.30 1bag s TYR 394 Cb -0.17 -0.94 -0.07 0.00 -0.40 0.00 0.00 41.96 40.38 1bag s TYR 394 CO 0.15 -0.43 0.65 -0.51 -1.57 0.00 0.00 175.55 173.84 1bag s ASP 395 N 1.89 7.15 -0.09 2.29 1.11 -1.26 -0.13 116.67 127.63 1bag s ASP 395 Ca 0.04 1.39 -0.29 0.00 0.18 0.00 0.00 52.55 53.86 1bag s ASP 395 Cb -0.13 -2.40 -0.06 0.00 1.07 0.00 0.00 42.92 41.39 1bag s ASP 395 CO -0.06 0.23 1.94 0.21 1.18 0.00 0.00 175.17 178.66 1bag s ASN 396 N -1.20 6.18 0.20 0.27 2.47 0.61 -4.83 114.94 118.64 1bag s ASN 396 Ca 0.33 2.22 0.12 0.00 0.42 0.00 0.00 52.86 55.95 1bag s ASN 396 Cb -0.20 -2.53 -0.06 0.00 -1.45 0.00 0.00 41.25 37.01 1bag s ASN 396 CO 0.21 -1.33 1.34 0.11 -3.72 0.00 0.00 177.10 173.72 1bag h LYS 397 N 11.75 0.00 0.00 0.43 1.57 -1.71 -3.27 116.57 125.34 1bag h LYS 397 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1bag h LYS 397 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1bag h LYS 397 CO 0.96 0.70 0.00 0.00 -0.57 0.00 0.00 179.45 180.54 1bag h ALA 398 N 1.28 1.00 -3.00 3.86 0.00 -1.82 -3.45 119.26 117.13 1bag h ALA 398 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bag h ALA 398 Cb 1.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1bag h ALA 398 CO 0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.75 1bag n GLY 399 N 0.56 1.74 3.67 0.00 0.00 -1.23 -3.16 105.19 106.76 1bag n GLY 399 Ca 0.02 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1bag n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bag s ALA 400 N -1.00 3.23 0.00 4.61 0.00 -1.26 -4.62 121.76 122.71 1bag s ALA 400 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.01 1bag s ALA 400 Cb 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 21.81 1bag s ALA 400 CO 0.00 0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.81 1bag n GLY 401 N 1.48 3.52 2.98 0.00 0.00 -1.26 -4.83 105.19 107.08 1bag n GLY 401 Ca -0.15 -1.73 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 1bag n GLY 401 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bag s SER 402 N 0.00 0.12 0.07 1.61 0.01 -1.26 -0.28 113.70 113.96 1bag s SER 402 Ca 0.00 -0.28 0.05 0.00 1.31 0.00 0.00 55.95 57.03 1bag s SER 402 Cb 0.00 0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.31 1bag s SER 402 CO 0.00 -0.22 -0.13 -0.36 0.41 0.00 0.00 173.24 172.93 1bag s PHE 403 N -1.00 1.16 -0.13 2.43 0.40 0.82 -4.55 117.98 117.11 1bag s PHE 403 Ca -0.11 -0.47 0.01 0.00 -0.60 0.00 0.00 56.93 55.77 1bag s PHE 403 Cb -0.07 -0.65 0.02 0.00 0.51 0.00 0.00 43.02 42.83 1bag s PHE 403 CO -0.00 0.04 -0.16 -1.14 0.70 0.00 0.00 175.22 174.66 1bag s GLN 404 N -1.73 2.38 -0.14 0.44 0.74 -0.61 -0.84 119.66 119.89 1bag s GLN 404 Ca -0.03 -0.61 -0.15 0.00 0.05 0.00 0.00 55.36 54.63 1bag s GLN 404 Cb -0.10 -2.07 -0.05 0.00 1.10 0.00 0.00 33.01 31.89 1bag s GLN 404 CO 0.02 -0.13 0.34 0.08 -0.55 0.00 0.00 175.29 175.04 1bag s VAL 405 N 1.18 5.27 -0.15 1.34 1.01 -0.35 -2.21 120.40 126.49 1bag s VAL 405 Ca -0.02 0.65 -0.06 0.00 0.00 0.00 0.00 61.98 62.55 1bag s VAL 405 Cb -0.14 -3.67 0.07 0.00 0.00 0.00 0.00 36.38 32.63 1bag s VAL 405 CO -0.06 0.39 0.33 0.21 0.00 0.00 0.00 175.10 175.98 1bag s ASN 406 N 0.36 -0.10 -1.30 3.32 3.04 -0.34 -1.14 114.94 118.79 1bag s ASN 406 Ca 0.19 0.74 -0.01 0.00 0.04 0.00 0.00 52.86 53.83 1bag s ASN 406 Cb -0.14 0.82 0.00 0.00 -1.54 0.00 0.00 41.25 40.40 1bag s ASN 406 CO 0.06 -0.21 0.76 -0.67 -3.04 0.00 0.00 177.10 173.99 1bag n ASP 407 N 4.91 -1.46 -2.84 -4.21 2.03 -1.26 -1.31 116.55 112.41 1bag n ASP 407 Ca -0.14 -0.79 -0.21 0.00 0.52 0.00 0.00 54.79 54.18 1bag n ASP 407 Cb 0.51 -4.22 0.01 0.00 -0.72 0.00 0.00 41.12 36.70 1bag n ASP 407 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1bag n GLY 408 N -1.51 -0.51 2.78 0.27 0.00 -1.26 -4.97 105.19 99.99 1bag n GLY 408 Ca -0.28 0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 1bag n GLY 408 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bag s LYS 409 N -5.50 0.68 0.04 1.61 1.02 -0.43 -1.15 119.74 116.02 1bag s LYS 409 Ca 0.20 0.08 -0.30 0.00 0.02 0.00 0.00 55.97 55.97 1bag s LYS 409 Cb -0.09 -1.01 -0.04 0.00 -0.52 0.00 0.00 37.83 36.17 1bag s LYS 409 CO 0.25 -0.29 0.96 -1.17 -0.92 0.00 0.00 175.35 174.17 1bag s LEU 410 N 1.91 4.42 -0.01 3.17 2.96 0.15 -1.20 118.68 130.10 1bag s LEU 410 Ca 0.04 1.69 -0.07 0.00 -0.22 0.00 0.00 54.13 55.57 1bag s LEU 410 Cb -0.12 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.02 1bag s LEU 410 CO -0.05 -0.17 0.14 0.42 -1.32 0.00 0.00 176.35 175.37 1bag s THR 411 N 0.57 0.07 0.00 3.68 -4.23 -0.94 -1.24 115.64 113.55 1bag s THR 411 Ca 0.49 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 1bag s THR 411 Cb -0.22 -0.40 0.00 0.00 1.34 0.00 0.00 72.50 73.22 1bag s THR 411 CO 0.28 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1bag n GLY 412 N 1.71 1.48 3.32 3.99 0.00 -1.17 -1.58 105.19 112.95 1bag n GLY 412 Ca -0.21 -1.36 -0.38 0.00 0.00 0.00 0.00 46.02 44.07 1bag n GLY 412 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bag s THR 413 N -1.90 3.99 -0.29 2.61 2.01 -1.26 -0.17 115.64 120.63 1bag s THR 413 Ca 0.00 -0.88 -0.24 0.00 0.31 0.00 0.00 61.69 60.88 1bag s THR 413 Cb 0.00 -3.16 -0.00 0.00 0.01 0.00 0.00 72.50 69.35 1bag s THR 413 CO 0.00 -0.07 0.80 -0.51 -0.69 0.00 0.00 174.62 174.15 1bag s ILE 414 N 1.47 4.80 0.83 1.82 2.07 0.73 -4.90 121.20 128.02 1bag s ILE 414 Ca 0.01 1.29 -0.12 0.00 -1.41 0.00 0.00 60.65 60.41 1bag s ILE 414 Cb -0.18 -4.14 0.10 0.00 0.13 0.00 0.00 42.46 38.37 1bag s ILE 414 CO 0.03 -0.21 1.19 0.20 -1.91 0.00 0.00 174.94 174.24 1bag s ASN 415 N 1.55 3.44 0.61 4.50 0.02 -1.26 -1.99 114.94 121.81 1bag s ASN 415 Ca 0.33 2.30 -0.19 0.00 -1.02 0.00 0.00 52.86 54.28 1bag s ASN 415 Cb -0.14 -2.58 -0.03 0.00 0.02 0.00 0.00 41.25 38.52 1bag s ASN 415 CO 0.11 -2.76 1.29 0.00 0.02 0.00 0.00 177.10 175.76 1bag n ALA 416 N -3.56 1.22 -4.19 0.60 0.00 -1.25 -2.59 120.51 110.76 1bag n ALA 416 Ca 0.13 0.05 -0.36 0.00 0.00 0.00 0.00 53.44 53.25 1bag n ALA 416 Cb 0.51 -2.32 -0.05 0.00 0.00 0.00 0.00 19.45 17.59 1bag n ALA 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bag n ARG 417 N -1.52 -2.07 -4.42 0.00 5.12 -0.36 -4.90 116.66 108.51 1bag n ARG 417 Ca 0.14 0.25 -0.22 0.00 -1.93 0.00 0.00 57.85 56.10 1bag n ARG 417 Cb 0.47 -4.90 -0.10 0.00 -1.16 0.00 0.00 32.46 26.76 1bag n ARG 417 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1bag s SER 418 N -3.13 3.15 0.09 0.55 0.01 -0.99 -4.97 113.70 108.40 1bag s SER 418 Ca 0.71 -1.03 0.08 0.00 1.31 0.00 0.00 55.95 57.03 1bag s SER 418 Cb -0.40 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.56 1bag s SER 418 CO 0.88 -0.06 -0.18 -0.69 0.41 0.00 0.00 173.24 173.60 1bag s VAL 419 N -2.72 2.83 -0.03 3.43 1.01 -1.26 -0.73 120.40 122.94 1bag s VAL 419 Ca 0.27 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.85 1bag s VAL 419 Cb -0.03 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.11 1bag s VAL 419 CO 0.11 0.18 0.00 0.00 0.00 0.00 0.00 175.10 175.40 1bag s ALA 420 N -1.07 0.27 -0.19 5.51 0.00 0.64 -4.46 121.76 122.47 1bag s ALA 420 Ca 0.17 0.18 -0.01 0.00 0.00 0.00 0.00 51.96 52.30 1bag s ALA 420 Cb -0.11 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.72 1bag s ALA 420 CO 0.09 -0.07 -0.12 0.08 0.00 0.00 0.00 175.76 175.74 1bag s VAL 421 N 0.97 2.83 -0.12 0.00 1.01 -1.26 -0.84 120.40 122.99 1bag s VAL 421 Ca -0.10 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1bag s VAL 421 Cb -0.13 -2.23 0.02 0.00 0.00 0.00 0.00 36.38 34.03 1bag s VAL 421 CO -0.02 0.49 -0.14 -0.76 0.00 0.00 0.00 175.10 174.66 1bag s LEU 422 N 1.17 1.68 -0.21 3.92 1.02 0.13 -1.87 118.68 124.53 1bag s LEU 422 Ca 0.01 -0.43 -0.33 0.00 0.02 0.00 0.00 54.13 53.40 1bag s LEU 422 Cb -0.14 -1.09 0.15 0.00 0.02 0.00 0.00 46.19 45.13 1bag s LEU 422 CO -0.04 -0.01 1.22 -0.72 0.02 0.00 0.00 176.35 176.82 1bag s TYR 423 N 1.12 -0.14 0.71 0.29 1.13 -1.26 0.26 117.35 119.46 1bag s TYR 423 Ca -0.04 0.14 -0.15 0.00 -1.41 0.00 0.00 57.07 55.61 1bag s TYR 423 Cb -0.14 0.50 0.03 0.00 -1.10 0.00 0.00 41.96 41.25 1bag s TYR 423 CO -0.04 -0.18 1.16 -2.14 -2.51 0.00 0.00 175.55 171.84 1bag s PRO 424 N -1.99 2.35 0.00 -3.49 0.02 -1.26 -4.90 135.00 125.73 1bag s PRO 424 Ca 0.08 1.58 0.00 0.00 0.02 0.00 0.00 61.00 62.68 1bag s PRO 424 Cb -0.01 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1bag s PRO 424 CO -0.05 -1.64 0.00 -0.40 -0.33 0.00 0.00 177.00 174.59