#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fgq h GLU 23 N 0.00 0.54 0.00 0.54 4.39 -2.03 -3.30 114.58 114.71 3fgq h GLU 23 Ca 0.00 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.37 3fgq h GLU 23 Cb 0.00 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3fgq h GLU 23 CO 0.00 0.93 -0.08 -1.91 -1.16 0.00 0.00 179.01 176.79 3fgq n GLU 24 N -4.35 0.14 0.23 2.33 4.07 -1.26 -3.50 120.64 118.32 3fgq n GLU 24 Ca -0.06 0.11 0.07 0.00 -0.06 0.00 0.00 57.16 57.21 3fgq n GLU 24 Cb 0.48 -1.66 0.57 0.00 -0.06 0.00 0.00 31.44 30.77 3fgq n GLU 24 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3fgq h ALA 25 N 2.74 1.85 0.13 4.31 0.00 -1.99 -2.26 119.26 124.05 3fgq h ALA 25 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3fgq h ALA 25 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3fgq h ALA 25 CO 0.00 0.11 -0.06 0.97 0.00 0.00 0.00 179.25 180.27 3fgq h ILE 26 N 0.02 0.97 -0.99 0.00 6.09 -1.77 -1.38 117.51 120.45 3fgq h ILE 26 Ca 0.00 -0.41 0.09 0.00 -1.37 0.00 0.00 64.86 63.18 3fgq h ILE 26 Cb 0.14 1.22 -0.08 0.00 0.47 0.00 0.00 36.82 38.58 3fgq h ILE 26 CO 0.01 0.10 0.63 0.00 -3.07 0.00 0.00 178.15 175.82 3fgq h ALA 27 N 0.46 1.44 -0.04 0.18 0.00 -1.67 -2.66 119.26 116.97 3fgq h ALA 27 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 3fgq h ALA 27 Cb 0.30 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3fgq h ALA 27 CO 0.03 0.32 -0.86 -0.44 0.00 0.00 0.00 179.25 178.29 3fgq h ASP 28 N 1.06 0.55 0.26 0.00 5.19 -1.29 -2.31 116.42 119.89 3fgq h ASP 28 Ca 0.46 -0.41 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 3fgq h ASP 28 Cb 0.34 -0.17 -0.04 0.00 0.18 0.00 0.00 39.33 39.64 3fgq h ASP 28 CO -0.22 1.19 -0.52 0.25 -3.12 0.00 0.00 179.24 176.81 3fgq h LEU 29 N 0.27 -1.53 -0.79 1.55 5.85 -0.92 0.19 115.31 119.93 3fgq h LEU 29 Ca -0.06 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3fgq h LEU 29 Cb 1.48 0.54 -0.04 0.00 0.37 0.00 0.00 40.66 43.01 3fgq h LEU 29 CO 0.15 -0.60 0.47 0.77 -0.34 0.00 0.00 178.44 178.89 3fgq h SER 30 N -0.85 0.96 -0.59 1.25 4.64 -1.52 0.39 113.55 117.84 3fgq h SER 30 Ca -0.03 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 3fgq h SER 30 Cb 0.80 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.62 3fgq h SER 30 CO -0.21 0.76 0.21 1.62 -0.87 0.00 0.00 176.83 178.33 3fgq h VAL 31 N 1.09 1.24 -0.27 0.95 3.04 -1.21 0.74 116.25 121.83 3fgq h VAL 31 Ca 0.28 -0.78 -0.04 0.00 -1.01 0.00 0.00 66.70 65.16 3fgq h VAL 31 Cb -0.02 0.63 -0.01 0.00 -2.01 0.00 0.00 31.29 29.88 3fgq h VAL 31 CO -0.05 0.30 0.03 0.78 -1.01 0.00 0.00 177.57 177.61 3fgq h ASN 32 N 0.83 0.44 -0.85 3.17 4.21 -0.04 -2.05 115.58 121.30 3fgq h ASN 32 Ca 0.19 -0.28 0.03 0.00 1.21 0.00 0.00 56.30 57.45 3fgq h ASN 32 Cb 0.26 -0.12 -0.05 0.00 -1.12 0.00 0.00 38.32 37.29 3fgq h ASN 32 CO -0.01 0.61 0.55 -0.03 -1.29 0.00 0.00 177.43 177.26 3fgq h MET 33 N 0.26 1.05 -0.40 0.81 4.05 0.16 -0.96 114.93 119.90 3fgq h MET 33 Ca 0.08 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 3fgq h MET 33 Cb 0.37 -0.24 -0.02 0.00 -0.80 0.00 0.00 31.60 30.92 3fgq h MET 33 CO 0.01 0.69 0.15 -0.92 0.23 0.00 0.00 176.91 177.07 3fgq h TYR 34 N 1.08 0.62 -0.57 1.39 5.03 0.74 0.20 116.97 125.46 3fgq h TYR 34 Ca 0.33 -0.05 -0.07 0.00 2.58 0.00 0.00 58.73 61.52 3fgq h TYR 34 Cb -0.03 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.05 3fgq h TYR 34 CO -0.02 0.56 0.06 -0.91 -1.32 0.00 0.00 178.16 176.53 3fgq h ASN 35 N 0.50 0.90 0.05 -2.11 2.35 -1.14 0.23 115.58 116.36 3fgq h ASN 35 Ca 0.13 -0.21 0.01 0.00 -0.55 0.00 0.00 56.30 55.68 3fgq h ASN 35 Cb 0.21 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3fgq h ASN 35 CO -0.01 0.92 -0.10 -0.09 -1.65 0.00 0.00 177.43 176.50 3fgq h ARG 36 N 0.88 -0.19 -0.67 0.81 9.65 -0.67 0.12 114.38 124.31 3fgq h ARG 36 Ca 0.18 0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 59.03 3fgq h ARG 36 Cb 0.43 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.02 3fgq h ARG 36 CO 0.01 -0.13 0.26 -0.07 2.80 0.00 0.00 179.97 182.84 3fgq h LEU 37 N -0.20 0.92 -0.48 3.80 3.38 -0.32 -2.17 115.31 120.23 3fgq h LEU 37 Ca 0.02 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 3fgq h LEU 37 Cb 0.22 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3fgq h LEU 37 CO -0.06 0.83 0.20 -0.09 0.09 0.00 0.00 178.44 179.40 3fgq h ARG 38 N 0.98 0.72 -0.29 1.13 2.43 -0.39 0.33 114.38 119.29 3fgq h ARG 38 Ca 0.23 -0.12 0.06 0.00 -0.81 0.00 0.00 59.98 59.34 3fgq h ARG 38 Cb 0.20 -0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 29.56 3fgq h ARG 38 CO -0.02 0.63 -0.33 0.00 -1.51 0.00 0.00 179.97 178.74 3fgq h ALA 39 N 1.05 -0.29 -0.01 2.80 0.00 -0.18 -3.05 119.26 119.57 3fgq h ALA 39 Ca 0.16 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3fgq h ALA 39 Cb 0.18 0.68 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3fgq h ALA 39 CO -0.01 -0.77 -0.30 -2.37 0.00 0.00 0.00 179.25 175.79 3fgq n THR 40 N -5.41 0.00 -2.05 0.00 5.66 -0.87 -4.45 114.28 107.16 3fgq n THR 40 Ca -0.01 -0.25 -0.21 0.00 -3.05 0.00 0.00 64.05 60.53 3fgq n THR 40 Cb 0.33 0.94 0.03 0.00 -1.55 0.00 0.00 70.33 70.09 3fgq n THR 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3fgq n GLY 41 N 1.36 6.09 3.66 1.09 0.00 0.11 -5.08 105.19 112.43 3fgq n GLY 41 Ca 0.12 -2.52 -0.46 0.00 0.00 0.00 0.00 46.02 43.16 3fgq n GLY 41 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3fgq n GLU 42 N -0.72 2.03 0.00 1.61 0.00 -1.24 -1.83 120.64 120.49 3fgq n GLU 42 Ca 0.41 0.73 0.00 0.00 0.00 0.00 0.00 57.16 58.30 3fgq n GLU 42 Cb 0.95 -2.44 0.00 0.00 0.00 0.00 0.00 31.44 29.95 3fgq n GLU 42 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 3fgq n ASP 43 N 2.87 0.00 -4.93 -1.84 4.64 -1.26 -5.00 116.55 111.03 3fgq n ASP 43 Ca 0.15 0.00 -0.27 0.00 -1.38 0.00 0.00 54.79 53.29 3fgq n ASP 43 Cb 0.29 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 40.34 3fgq n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 3fgq s GLU 44 N -0.13 3.51 0.76 -0.67 0.41 -0.76 -4.76 118.70 117.07 3fgq s GLU 44 Ca 0.00 -0.36 -0.14 0.00 -0.41 0.00 0.00 54.97 54.05 3fgq s GLU 44 Cb 0.00 -2.83 0.06 0.00 -1.78 0.00 0.00 34.13 29.57 3fgq s GLU 44 CO 0.00 0.39 1.21 -0.80 -0.49 0.00 0.00 175.26 175.57 3fgq s ASN 45 N -3.25 3.93 -0.02 -0.19 0.01 -1.26 -4.70 114.94 109.46 3fgq s ASN 45 Ca 0.38 2.38 0.04 0.00 -0.71 0.00 0.00 52.86 54.95 3fgq s ASN 45 Cb -0.11 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 38.95 3fgq s ASN 45 CO 0.29 -2.44 -0.12 -0.63 -1.51 0.00 0.00 177.10 172.70 3fgq s ILE 46 N -2.02 0.96 -0.29 0.60 1.01 -0.68 -4.91 121.20 115.86 3fgq s ILE 46 Ca 0.74 -0.50 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 3fgq s ILE 46 Cb -0.30 -0.81 0.12 0.00 0.01 0.00 0.00 42.46 41.49 3fgq s ILE 46 CO 0.47 0.28 0.64 -0.22 0.00 0.00 0.00 174.94 176.11 3fgq s LEU 47 N -0.15 -1.10 0.09 2.97 2.96 -1.26 -1.19 118.68 120.99 3fgq s LEU 47 Ca 0.02 1.54 -0.11 0.00 -0.22 0.00 0.00 54.13 55.36 3fgq s LEU 47 Cb -0.06 2.26 0.01 0.00 0.50 0.00 0.00 46.19 48.90 3fgq s LEU 47 CO -0.00 -0.22 0.26 0.72 -1.32 0.00 0.00 176.35 175.78 3fgq s PHE 48 N 2.79 0.03 -0.28 5.38 -0.12 -0.82 -4.31 117.98 120.65 3fgq s PHE 48 Ca -0.06 -0.39 -0.07 0.00 -0.05 0.00 0.00 56.93 56.36 3fgq s PHE 48 Cb -0.12 0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.32 3fgq s PHE 48 CO -0.19 -0.57 0.07 0.45 -0.05 0.00 0.00 175.22 174.93 3fgq s SER 49 N -2.72 5.07 0.21 1.98 0.15 -1.26 -1.76 113.70 115.36 3fgq s SER 49 Ca 0.03 -0.59 -0.10 0.00 0.70 0.00 0.00 55.95 55.99 3fgq s SER 49 Cb 0.03 -1.88 0.26 0.00 -1.71 0.00 0.00 66.02 62.72 3fgq s SER 49 CO -0.10 -0.15 1.76 -0.65 1.20 0.00 0.00 173.24 175.30 3fgq h PRO 50 N 8.23 0.47 -0.25 5.44 0.11 -1.76 -0.09 132.00 144.14 3fgq h PRO 50 Ca -0.33 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.73 3fgq h PRO 50 Cb 1.14 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 3fgq h PRO 50 CO 0.60 0.31 0.09 -0.07 -0.21 0.00 0.00 178.00 178.72 3fgq h LEU 51 N 0.48 0.35 -0.83 2.35 3.38 -1.81 0.12 115.31 119.36 3fgq h LEU 51 Ca 0.30 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3fgq h LEU 51 Cb 0.31 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3fgq h LEU 51 CO -0.26 0.44 0.52 -1.28 0.09 0.00 0.00 178.44 177.95 3fgq h SER 52 N 0.25 0.97 0.02 -0.43 0.87 -1.81 0.30 113.55 113.73 3fgq h SER 52 Ca 0.08 -0.05 -0.17 0.00 -1.23 0.00 0.00 61.79 60.43 3fgq h SER 52 Cb 0.20 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3fgq h SER 52 CO -0.01 0.73 -0.59 0.40 -0.53 0.00 0.00 176.83 176.84 3fgq h ILE 53 N 1.13 1.32 -0.28 2.23 2.04 -0.85 -1.22 117.51 121.88 3fgq h ILE 53 Ca 0.30 -1.85 -0.10 0.00 1.00 0.00 0.00 64.86 64.20 3fgq h ILE 53 Cb -0.09 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3fgq h ILE 53 CO -0.06 0.58 -0.26 0.00 0.00 0.00 0.00 178.15 178.40 3fgq h ALA 54 N 0.91 1.02 -0.25 1.87 0.00 -0.46 -1.25 119.26 121.11 3fgq h ALA 54 Ca -0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3fgq h ALA 54 Cb 1.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3fgq h ALA 54 CO 0.11 0.59 0.16 1.25 0.00 0.00 0.00 179.25 181.36 3fgq h LEU 55 N 0.48 0.30 -0.96 0.00 6.46 0.04 -0.25 115.31 121.38 3fgq h LEU 55 Ca 0.07 -0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.77 3fgq h LEU 55 Cb 0.71 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.53 3fgq h LEU 55 CO 0.05 0.25 0.45 0.00 -0.62 0.00 0.00 178.44 178.58 3fgq h ALA 56 N 1.06 1.20 -0.14 1.25 0.00 -0.99 -1.66 119.26 119.98 3fgq h ALA 56 Ca 0.09 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 3fgq h ALA 56 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 3fgq h ALA 56 CO -0.02 0.64 -0.60 0.52 0.00 0.00 0.00 179.25 179.79 3fgq h MET 57 N 1.19 0.48 -0.72 0.00 2.86 -1.04 -2.02 114.93 115.68 3fgq h MET 57 Ca 0.30 -0.32 0.04 0.00 -2.06 0.00 0.00 59.70 57.65 3fgq h MET 57 Cb 0.05 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 3fgq h MET 57 CO -0.05 0.94 0.45 0.78 1.06 0.00 0.00 176.91 180.09 3fgq h GLY 58 N 1.16 1.05 0.81 8.32 0.00 -0.71 0.35 103.07 114.04 3fgq h GLY 58 Ca -0.00 -0.33 0.03 0.00 0.00 0.00 0.00 47.33 47.02 3fgq h GLY 58 CO 0.11 0.27 0.26 -0.33 0.00 0.00 0.00 176.54 176.85 3fgq h MET 59 N 0.87 0.50 -0.31 4.80 2.86 -0.94 0.69 114.93 123.39 3fgq h MET 59 Ca 0.30 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.87 3fgq h MET 59 Cb 0.05 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 3fgq h MET 59 CO -0.12 0.33 0.07 0.52 1.06 0.00 0.00 176.91 178.77 3fgq h MET 60 N 0.51 0.50 -0.80 1.72 2.86 -1.01 -1.10 114.93 117.61 3fgq h MET 60 Ca 0.20 -0.12 0.06 0.00 -2.06 0.00 0.00 59.70 57.77 3fgq h MET 60 Cb 0.07 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.61 3fgq h MET 60 CO -0.12 0.57 0.49 1.49 1.06 0.00 0.00 176.91 180.41 3fgq h GLU 61 N 0.34 0.88 -0.04 1.72 4.81 0.07 0.54 114.58 122.89 3fgq h GLU 61 Ca 0.10 -0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 59.05 3fgq h GLU 61 Cb 0.30 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.49 3fgq h GLU 61 CO 0.00 0.58 -0.89 -0.07 -0.73 0.00 0.00 179.01 177.91 3fgq h LEU 62 N 0.91 0.65 -1.18 1.64 3.38 -0.75 -2.95 115.31 117.00 3fgq h LEU 62 Ca 0.35 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 3fgq h LEU 62 Cb 0.15 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3fgq h LEU 62 CO -0.17 1.27 0.22 1.23 0.09 0.00 0.00 178.44 181.08 3fgq h GLY 63 N 1.00 0.84 -1.54 0.83 0.00 -0.92 -3.41 103.07 99.88 3fgq h GLY 63 Ca -0.07 -0.42 -0.50 0.00 0.00 0.00 0.00 47.33 46.33 3fgq h GLY 63 CO 0.16 0.40 0.33 0.00 0.00 0.00 0.00 176.54 177.43 3fgq s ALA 64 N -5.36 3.18 0.10 3.60 0.00 0.16 -1.18 121.76 122.26 3fgq s ALA 64 Ca -0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 51.96 51.63 3fgq s ALA 64 Cb 0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 3fgq s ALA 64 CO 0.78 -0.61 0.02 -0.65 0.00 0.00 0.00 175.76 175.30 3fgq s GLN 65 N -5.06 0.80 5.18 0.00 -0.21 -0.18 -4.50 119.66 115.69 3fgq s GLN 65 Ca 0.53 -1.35 0.00 0.00 0.02 0.00 0.00 55.36 54.55 3fgq s GLN 65 Cb -0.11 0.22 0.00 0.00 1.00 0.00 0.00 33.01 34.12 3fgq s GLN 65 CO 0.51 -0.20 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 3fgq n GLY 66 N -0.02 1.87 0.30 3.09 0.00 -1.26 -2.66 105.19 106.52 3fgq n GLY 66 Ca -0.09 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3fgq n GLY 66 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3fgq h SER 67 N 9.39 0.64 -0.11 1.61 4.64 -1.98 0.30 113.55 128.04 3fgq h SER 67 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3fgq h SER 67 Cb 0.00 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 3fgq h SER 67 CO 0.00 0.58 0.06 0.74 -0.87 0.00 0.00 176.83 177.34 3fgq h THR 68 N 0.70 1.01 -0.24 2.95 2.02 -1.81 -0.63 112.91 116.92 3fgq h THR 68 Ca 0.17 -0.04 -0.08 0.00 0.77 0.00 0.00 66.41 67.23 3fgq h THR 68 Cb 0.14 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 3fgq h THR 68 CO -0.02 0.02 -0.18 -0.61 0.37 0.00 0.00 175.52 175.10 3fgq h GLN 69 N 0.13 0.41 -0.29 6.66 4.15 -1.09 -3.15 115.11 121.94 3fgq h GLN 69 Ca 0.04 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.27 3fgq h GLN 69 Cb -0.00 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 3fgq h GLN 69 CO -0.02 0.58 -0.08 -0.22 -1.93 0.00 0.00 178.83 177.16 3fgq h LYS 70 N 0.38 0.56 -0.74 1.69 1.63 0.30 -1.80 116.57 118.59 3fgq h LYS 70 Ca 0.07 -0.22 0.10 0.00 -0.85 0.00 0.00 60.65 59.75 3fgq h LYS 70 Cb 0.54 -0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 32.06 3fgq h LYS 70 CO 0.04 0.77 0.37 0.93 -3.45 0.00 0.00 179.45 178.11 3fgq h GLU 71 N 0.32 0.59 0.06 1.90 5.08 -1.13 0.73 114.58 122.13 3fgq h GLU 71 Ca 0.07 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3fgq h GLU 71 Cb 0.57 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3fgq h GLU 71 CO 0.03 0.39 -0.03 0.82 -1.00 0.00 0.00 179.01 179.22 3fgq h ILE 72 N 0.61 1.12 -0.35 3.13 2.04 -1.45 0.35 117.51 122.95 3fgq h ILE 72 Ca 0.37 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3fgq h ILE 72 Cb 0.42 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 3fgq h ILE 72 CO -0.29 0.15 0.19 0.03 0.00 0.00 0.00 178.15 178.24 3fgq h ARG 73 N -0.35 0.49 -0.34 2.37 3.08 -1.08 -1.58 114.38 116.97 3fgq h ARG 73 Ca -0.01 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.01 3fgq h ARG 73 Cb 0.31 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 3fgq h ARG 73 CO 0.01 0.41 0.16 1.25 -1.07 0.00 0.00 179.97 180.73 3fgq h HIS 74 N 0.45 0.30 0.00 3.04 2.76 0.61 0.83 115.15 123.14 3fgq h HIS 74 Ca 0.12 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 3fgq h HIS 74 Cb 0.06 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 28.92 3fgq h HIS 74 CO -0.03 0.16 -0.21 0.77 -1.30 0.00 0.00 177.93 177.33 3fgq h SER 75 N 0.34 0.00 0.80 3.26 0.02 -0.16 -0.82 113.55 116.98 3fgq h SER 75 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3fgq h SER 75 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 3fgq h SER 75 CO -0.11 0.21 -0.35 0.23 -1.14 0.00 0.00 176.83 175.67 3fgq n MET 76 N -3.96 0.09 -1.28 3.45 2.00 -0.61 -4.92 117.12 111.89 3fgq n MET 76 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 57.70 57.72 3fgq n MET 76 Cb 0.29 -1.57 0.00 0.00 0.00 0.00 0.00 33.22 31.94 3fgq n MET 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3fgq n GLY 77 N 1.45 0.47 1.84 3.03 0.00 0.05 -4.97 105.19 107.06 3fgq n GLY 77 Ca 0.05 -0.92 0.03 0.00 0.00 0.00 0.00 46.02 45.18 3fgq n GLY 77 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3fgq n TYR 78 N -3.24 2.11 -0.29 1.61 4.01 0.27 -4.59 117.16 117.03 3fgq n TYR 78 Ca 0.00 -0.91 0.06 0.00 -0.16 0.00 0.00 57.90 56.89 3fgq n TYR 78 Cb 0.19 -0.56 0.21 0.00 -0.31 0.00 0.00 39.34 38.87 3fgq n TYR 78 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3fgq h ASP 79 N 3.35 0.55 0.19 7.72 3.32 -1.87 -2.55 116.42 127.14 3fgq h ASP 79 Ca 0.09 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3fgq h ASP 79 Cb 2.06 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.60 3fgq h ASP 79 CO 0.55 0.26 -0.16 -1.54 -1.72 0.00 0.00 179.24 176.63 3fgq n SER 80 N -4.84 1.00 -4.54 6.45 3.41 -1.26 -4.77 113.62 109.06 3fgq n SER 80 Ca 0.16 -0.98 -0.43 0.00 -0.26 0.00 0.00 58.87 57.37 3fgq n SER 80 Cb 0.39 0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.34 3fgq n SER 80 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3fgq s LEU 81 N -2.36 4.32 0.00 1.04 1.43 -0.96 -4.92 118.68 117.22 3fgq s LEU 81 Ca 0.29 -0.08 0.15 0.00 -1.03 0.00 0.00 54.13 53.46 3fgq s LEU 81 Cb 0.20 -2.87 -0.16 0.00 0.03 0.00 0.00 46.19 43.40 3fgq s LEU 81 CO 0.46 -0.80 0.65 0.29 0.23 0.00 0.00 176.35 177.19 3fgq n LYS 82 N 6.42 1.97 -0.08 1.70 4.76 -1.26 -4.62 118.16 127.05 3fgq n LYS 82 Ca 0.01 -0.03 0.08 0.00 -2.87 0.00 0.00 58.31 55.49 3fgq n LYS 82 Cb 0.48 -1.22 0.11 0.00 -1.84 0.00 0.00 35.03 32.56 3fgq n LYS 82 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3fgq n ASN 83 N -1.31 2.16 0.00 4.39 3.02 -1.26 -4.96 115.26 117.30 3fgq n ASN 83 Ca 0.03 -2.85 0.00 0.00 -0.03 0.00 0.00 54.58 51.73 3fgq n ASN 83 Cb 0.24 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 3fgq n ASN 83 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fgq n GLY 84 N -1.21 0.52 0.36 7.41 0.00 -1.26 -4.93 105.19 106.07 3fgq n GLY 84 Ca 0.13 -0.65 0.18 0.00 0.00 0.00 0.00 46.02 45.68 3fgq n GLY 84 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3fgq h GLU 85 N 0.43 0.00 0.00 1.61 3.07 -1.93 -1.23 114.58 116.53 3fgq h GLU 85 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3fgq h GLU 85 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3fgq h GLU 85 CO 0.00 0.00 0.00 -0.85 -1.40 0.00 0.00 179.01 176.76 3fgq n GLU 86 N -4.04 0.19 -0.06 2.33 0.00 -1.26 -2.75 120.64 115.05 3fgq n GLU 86 Ca 0.06 0.12 0.12 0.00 0.00 0.00 0.00 57.16 57.46 3fgq n GLU 86 Cb 0.48 -1.50 0.28 0.00 0.00 0.00 0.00 31.44 30.70 3fgq n GLU 86 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3fgq n PHE 87 N -1.36 0.16 0.23 -1.84 3.72 -0.47 -4.35 117.46 113.56 3fgq n PHE 87 Ca 0.08 -0.08 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 3fgq n PHE 87 Cb 0.18 0.00 0.55 0.00 -0.94 0.00 0.00 39.48 39.27 3fgq n PHE 87 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3fgq h SER 88 N 3.62 0.00 0.10 4.37 4.64 -1.69 -2.29 113.55 122.30 3fgq h SER 88 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fgq h SER 88 Cb 0.78 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3fgq h SER 88 CO 0.00 0.21 -0.02 2.19 -0.87 0.00 0.00 176.83 178.34 3fgq h PHE 89 N 0.00 0.00 -0.70 4.77 -5.15 -1.84 -2.92 116.94 111.09 3fgq h PHE 89 Ca -0.00 0.00 0.09 0.00 -0.20 0.00 0.00 57.97 57.86 3fgq h PHE 89 Cb 0.60 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.72 3fgq h PHE 89 CO 0.00 0.02 0.46 -0.07 -2.00 0.00 0.00 178.31 176.73 3fgq h LEU 90 N 0.00 0.54 0.25 2.10 3.38 -1.75 -2.16 115.31 117.68 3fgq h LEU 90 Ca -0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3fgq h LEU 90 Cb 0.08 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3fgq h LEU 90 CO 0.00 0.33 -0.30 0.50 0.09 0.00 0.00 178.44 179.06 3fgq h LYS 91 N 0.60 -0.57 -0.85 1.13 1.63 -1.74 0.33 116.57 117.11 3fgq h LYS 91 Ca 0.32 0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 60.14 3fgq h LYS 91 Cb 0.46 0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 32.18 3fgq h LYS 91 CO -0.11 -0.38 0.46 1.49 -3.45 0.00 0.00 179.45 177.46 3fgq h GLU 92 N -0.60 1.18 -0.64 1.90 4.81 -1.65 -2.11 114.58 117.47 3fgq h GLU 92 Ca -0.00 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.13 3fgq h GLU 92 Cb 0.56 -0.23 -0.05 0.00 0.63 0.00 0.00 28.75 29.66 3fgq h GLU 92 CO -0.09 0.86 0.38 0.35 -0.73 0.00 0.00 179.01 179.79 3fgq h PHE 93 N 1.18 0.70 -0.85 0.92 -0.00 -1.04 -1.57 116.94 116.29 3fgq h PHE 93 Ca 0.30 0.02 -0.03 0.00 -0.00 0.00 0.00 57.97 58.26 3fgq h PHE 93 Cb 0.03 -0.22 -0.04 0.00 -0.00 0.00 0.00 35.95 35.72 3fgq h PHE 93 CO 0.01 0.37 0.42 0.77 -0.00 0.00 0.00 178.31 179.88 3fgq h SER 94 N 0.73 1.10 -0.71 0.41 0.02 -0.41 -2.71 113.55 111.98 3fgq h SER 94 Ca 0.27 -0.13 0.11 0.00 -0.84 0.00 0.00 61.79 61.20 3fgq h SER 94 Cb 0.10 -0.28 -0.08 0.00 0.14 0.00 0.00 62.40 62.27 3fgq h SER 94 CO -0.14 0.92 0.31 0.78 -1.14 0.00 0.00 176.83 177.56 3fgq h ASN 95 N 1.20 0.36 -0.75 3.07 2.35 -0.65 -1.90 115.58 119.26 3fgq h ASN 95 Ca 0.29 0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 56.09 3fgq h ASN 95 Cb 0.10 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 3fgq h ASN 95 CO -0.04 0.19 0.35 0.24 -1.65 0.00 0.00 177.43 176.52 3fgq h MET 96 N 0.51 1.09 0.00 0.81 2.86 -1.15 -2.00 114.93 117.05 3fgq h MET 96 Ca 0.36 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 3fgq h MET 96 Cb 0.46 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3fgq h MET 96 CO -0.32 0.85 0.00 0.28 1.06 0.00 0.00 176.91 178.78 3fgq h VAL 97 N 1.08 0.00 -0.12 -2.22 2.07 -1.16 -2.68 116.25 113.22 3fgq h VAL 97 Ca 0.26 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.62 3fgq h VAL 97 Cb 0.12 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3fgq h VAL 97 CO -0.03 0.00 0.00 0.35 0.02 0.00 0.00 177.57 177.91 3fgq n THR 98 N -2.84 0.82 -1.11 2.57 -2.24 -0.89 -4.94 114.28 105.66 3fgq n THR 98 Ca -0.01 -0.91 -0.33 0.00 -2.27 0.00 0.00 64.05 60.53 3fgq n THR 98 Cb 0.14 0.60 0.12 0.00 -2.10 0.00 0.00 70.33 69.10 3fgq n THR 98 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fgq s ALA 99 N -0.89 1.86 0.35 6.98 0.00 -0.81 -4.96 121.76 124.29 3fgq s ALA 99 Ca 0.09 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.49 3fgq s ALA 99 Cb 0.05 -3.45 -0.11 0.00 0.00 0.00 0.00 23.12 19.61 3fgq s ALA 99 CO 0.06 -2.25 1.47 0.15 0.00 0.00 0.00 175.76 175.20 3fgq s LYS 100 N -4.29 4.16 0.55 0.00 1.02 -1.26 -4.91 119.74 115.01 3fgq s LYS 100 Ca 0.70 2.50 0.33 0.00 0.02 0.00 0.00 55.97 59.53 3fgq s LYS 100 Cb -0.26 -3.00 1.45 0.00 -0.52 0.00 0.00 37.83 35.50 3fgq s LYS 100 CO 0.51 -0.49 2.02 1.49 -0.92 0.00 0.00 175.35 177.97 3fgq h GLU 101 N 3.46 0.00 0.00 1.68 4.81 -1.93 -2.25 114.58 120.35 3fgq h GLU 101 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3fgq h GLU 101 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3fgq h GLU 101 CO 0.67 0.04 0.00 0.66 -0.73 0.00 0.00 179.01 179.66 3fgq h SER 102 N 0.00 0.00 0.00 1.04 4.64 -1.99 -3.27 113.55 113.97 3fgq h SER 102 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3fgq h SER 102 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3fgq h SER 102 CO 0.01 0.00 -0.79 0.00 -0.87 0.00 0.00 176.83 175.17 3fgq n GLN 103 N -2.75 0.49 -3.80 4.77 6.02 -0.87 -4.70 117.38 116.54 3fgq n GLN 103 Ca 0.02 0.41 -0.05 0.00 -0.01 0.00 0.00 57.00 57.38 3fgq n GLN 103 Cb 0.35 -1.60 -0.02 0.00 1.02 0.00 0.00 30.24 30.00 3fgq n GLN 103 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.06 177.57 3fgq s TYR 104 N -2.48 -0.16 -0.10 1.08 -0.85 -1.05 -1.38 117.35 112.40 3fgq s TYR 104 Ca -0.21 -0.21 0.02 0.00 -0.52 0.00 0.00 57.07 56.15 3fgq s TYR 104 Cb 0.03 0.67 0.01 0.00 0.38 0.00 0.00 41.96 43.06 3fgq s TYR 104 CO 0.32 -1.02 -0.17 0.14 -1.52 0.00 0.00 175.55 173.30 3fgq s VAL 105 N -3.59 1.58 -0.31 -3.49 -7.23 -0.14 -3.97 120.40 103.25 3fgq s VAL 105 Ca 0.12 -0.71 0.03 0.00 -1.81 0.00 0.00 61.98 59.60 3fgq s VAL 105 Cb -0.04 -1.42 0.09 0.00 0.56 0.00 0.00 36.38 35.58 3fgq s VAL 105 CO 0.04 0.46 0.02 -0.32 -0.31 0.00 0.00 175.10 174.99 3fgq s MET 106 N 0.77 1.48 0.00 4.82 0.00 -1.26 -1.73 119.30 123.38 3fgq s MET 106 Ca -0.11 -1.58 -0.18 0.00 0.00 0.00 0.00 55.69 53.82 3fgq s MET 106 Cb -0.16 -2.91 -0.06 0.00 0.00 0.00 0.00 34.83 31.71 3fgq s MET 106 CO 0.02 -0.86 0.50 0.15 0.00 0.00 0.00 175.02 174.83 3fgq s LYS 107 N 1.09 4.15 -0.01 4.11 -0.14 -0.01 -4.66 119.74 124.28 3fgq s LYS 107 Ca 0.06 0.58 0.04 0.00 -1.36 0.00 0.00 55.97 55.29 3fgq s LYS 107 Cb -0.19 -3.28 -0.01 0.00 -1.68 0.00 0.00 37.83 32.67 3fgq s LYS 107 CO -0.10 0.53 -0.14 0.42 -0.76 0.00 0.00 175.35 175.30 3fgq s ILE 108 N -0.65 1.10 -0.26 2.17 1.01 -1.26 -0.99 121.20 122.32 3fgq s ILE 108 Ca 0.27 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.32 3fgq s ILE 108 Cb -0.18 -0.92 0.07 0.00 0.01 0.00 0.00 42.46 41.45 3fgq s ILE 108 CO 0.15 0.30 -0.00 0.00 0.00 0.00 0.00 174.94 175.39 3fgq s ALA 109 N -0.34 1.90 -0.15 9.38 0.00 -0.33 -4.77 121.76 127.45 3fgq s ALA 109 Ca 0.05 -1.50 0.02 0.00 0.00 0.00 0.00 51.96 50.53 3fgq s ALA 109 Cb -0.05 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.56 3fgq s ALA 109 CO -0.00 -1.35 -0.20 -0.80 0.00 0.00 0.00 175.76 173.41 3fgq s ASN 110 N 1.42 3.22 -0.09 0.00 0.01 -1.26 -0.99 114.94 117.24 3fgq s ASN 110 Ca -0.00 -0.59 -0.25 0.00 -0.71 0.00 0.00 52.86 51.31 3fgq s ASN 110 Cb -0.18 -1.47 0.06 0.00 0.41 0.00 0.00 41.25 40.06 3fgq s ASN 110 CO -0.10 0.07 0.58 -0.55 -1.51 0.00 0.00 177.10 175.58 3fgq s SER 111 N 0.91 -0.55 -0.20 -1.22 0.15 -0.29 -1.96 113.70 110.54 3fgq s SER 111 Ca -0.04 0.73 -0.08 0.00 0.70 0.00 0.00 55.95 57.25 3fgq s SER 111 Cb -0.15 0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 3fgq s SER 111 CO -0.04 -0.46 0.08 -0.22 1.20 0.00 0.00 173.24 173.80 3fgq s LEU 112 N -0.79 3.81 -0.18 3.45 2.96 -0.48 -0.32 118.68 127.13 3fgq s LEU 112 Ca -0.08 0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.80 3fgq s LEU 112 Cb -0.02 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 3fgq s LEU 112 CO 0.06 0.12 0.04 -0.36 -1.32 0.00 0.00 176.35 174.89 3fgq s PHE 113 N 0.71 3.19 -0.03 5.38 0.40 0.12 -0.44 117.98 127.32 3fgq s PHE 113 Ca 0.04 -0.04 0.03 0.00 -0.60 0.00 0.00 56.93 56.36 3fgq s PHE 113 Cb -0.13 -2.07 -0.00 0.00 0.51 0.00 0.00 43.02 41.33 3fgq s PHE 113 CO 0.02 0.07 -0.13 0.54 0.70 0.00 0.00 175.22 176.42 3fgq s VAL 114 N 0.48 1.09 0.10 -0.44 0.11 -0.03 -0.20 120.40 121.51 3fgq s VAL 114 Ca 0.02 -0.53 -0.36 0.00 -2.93 0.00 0.00 61.98 58.18 3fgq s VAL 114 Cb -0.13 -0.94 -0.17 0.00 -1.53 0.00 0.00 36.38 33.60 3fgq s VAL 114 CO 0.01 0.32 1.15 1.67 -3.33 0.00 0.00 175.10 174.93 3fgq n GLN 115 N 3.17 0.76 -1.55 1.54 -0.06 0.16 -1.01 117.38 120.39 3fgq n GLN 115 Ca -0.18 0.27 -0.47 0.00 -2.00 0.00 0.00 57.00 54.62 3fgq n GLN 115 Cb 0.54 -1.78 -0.03 0.00 -4.06 0.00 0.00 30.24 24.90 3fgq n GLN 115 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 3fgq n ASN 116 N 2.05 0.78 0.00 1.69 5.03 0.19 -2.11 115.26 122.90 3fgq n ASN 116 Ca 0.18 1.16 0.00 0.00 0.87 0.00 0.00 54.58 56.78 3fgq n ASN 116 Cb 0.18 -1.18 0.00 0.00 -1.02 0.00 0.00 39.78 37.76 3fgq n ASN 116 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3fgq n GLY 117 N 1.66 3.24 3.71 7.41 0.00 -1.26 -5.01 105.19 114.94 3fgq n GLY 117 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3fgq n GLY 117 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fgq s PHE 118 N -2.25 3.34 0.20 1.61 0.40 -0.90 -5.00 117.98 115.37 3fgq s PHE 118 Ca 0.00 1.19 -0.30 0.00 -0.60 0.00 0.00 56.93 57.22 3fgq s PHE 118 Cb 0.00 -3.49 -0.08 0.00 0.51 0.00 0.00 43.02 39.96 3fgq s PHE 118 CO 0.00 -1.60 1.18 -1.58 0.70 0.00 0.00 175.22 173.92 3fgq s HIS 119 N 1.26 3.45 -0.16 0.36 5.65 -1.26 -4.97 115.29 119.62 3fgq s HIS 119 Ca 0.60 1.47 -0.03 0.00 0.25 0.00 0.00 55.06 57.36 3fgq s HIS 119 Cb -0.31 -3.40 -0.02 0.00 -1.18 0.00 0.00 32.58 27.67 3fgq s HIS 119 CO 0.29 -1.08 -0.07 0.08 -0.65 0.00 0.00 174.74 173.31 3fgq s VAL 120 N -0.21 3.52 0.20 0.89 1.01 -1.26 -4.36 120.40 120.20 3fgq s VAL 120 Ca 0.51 -0.48 -0.32 0.00 0.00 0.00 0.00 61.98 61.69 3fgq s VAL 120 Cb -0.32 -2.54 -0.13 0.00 0.00 0.00 0.00 36.38 33.38 3fgq s VAL 120 CO 0.37 0.48 1.50 0.59 0.00 0.00 0.00 175.10 178.05 3fgq n ASN 121 N 3.84 2.99 0.14 3.32 3.02 0.89 -4.87 115.26 124.59 3fgq n ASN 121 Ca -0.18 1.11 0.02 0.00 -0.03 0.00 0.00 54.58 55.50 3fgq n ASN 121 Cb 0.52 -1.44 0.36 0.00 -0.61 0.00 0.00 39.78 38.61 3fgq n ASN 121 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 3fgq h GLU 122 N 5.09 0.15 -0.24 3.52 4.57 -1.96 -1.76 114.58 123.96 3fgq h GLU 122 Ca -0.45 -0.05 -0.07 0.00 -1.18 0.00 0.00 59.36 57.61 3fgq h GLU 122 Cb 1.26 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 3fgq h GLU 122 CO 0.82 0.41 -0.12 1.49 -1.18 0.00 0.00 179.01 180.43 3fgq h GLU 123 N 0.14 0.51 -0.51 1.92 4.81 -1.95 0.95 114.58 120.45 3fgq h GLU 123 Ca 0.02 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.08 3fgq h GLU 123 Cb 0.54 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.86 3fgq h GLU 123 CO 0.04 0.77 0.24 0.35 -0.73 0.00 0.00 179.01 179.68 3fgq h PHE 124 N 0.23 0.44 -0.86 0.92 3.57 -1.75 -0.96 116.94 118.53 3fgq h PHE 124 Ca 0.05 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 3fgq h PHE 124 Cb 0.62 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 3fgq h PHE 124 CO 0.06 0.20 0.53 1.25 -2.23 0.00 0.00 178.31 178.12 3fgq h LEU 125 N 0.47 1.03 -0.43 0.59 6.46 -1.07 -1.01 115.31 121.35 3fgq h LEU 125 Ca 0.23 -0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 57.83 3fgq h LEU 125 Cb 0.17 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 3fgq h LEU 125 CO -0.18 0.78 -0.14 1.56 -0.62 0.00 0.00 178.44 179.84 3fgq h GLN 126 N 1.18 0.85 -0.24 1.25 1.08 -0.27 -2.34 115.11 116.62 3fgq h GLN 126 Ca 0.31 -0.34 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3fgq h GLN 126 Cb -0.07 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 3fgq h GLN 126 CO -0.06 0.98 0.15 0.52 -0.95 0.00 0.00 178.83 179.47 3fgq h MET 127 N 0.67 0.30 -0.42 1.46 2.86 -0.79 -0.73 114.93 118.28 3fgq h MET 127 Ca 0.10 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.81 3fgq h MET 127 Cb 0.69 -0.07 -0.08 0.00 0.06 0.00 0.00 31.60 32.20 3fgq h MET 127 CO 0.05 0.20 -0.13 0.52 1.06 0.00 0.00 176.91 178.60 3fgq h MET 128 N 0.31 -0.04 -0.50 1.72 2.86 -1.08 0.71 114.93 118.90 3fgq h MET 128 Ca 0.09 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.64 3fgq h MET 128 Cb -0.03 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 3fgq h MET 128 CO -0.03 -0.02 -0.05 -0.22 1.06 0.00 0.00 176.91 177.65 3fgq h LYS 129 N -0.04 0.91 0.11 1.72 3.64 -1.18 -1.39 116.57 120.34 3fgq h LYS 129 Ca 0.21 -0.32 -0.32 0.00 -1.27 0.00 0.00 60.65 58.95 3fgq h LYS 129 Cb 0.35 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3fgq h LYS 129 CO -0.46 0.97 -1.68 0.87 -2.27 0.00 0.00 179.45 176.88 3fgq h LYS 130 N 0.77 0.23 0.00 1.90 1.57 -0.74 -3.36 116.57 116.95 3fgq h LYS 130 Ca 0.14 -0.39 -0.07 0.00 -1.87 0.00 0.00 60.65 58.46 3fgq h LYS 130 Cb 0.59 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 3fgq h LYS 130 CO 0.04 1.06 -1.46 0.66 -0.57 0.00 0.00 179.45 179.18 3fgq n TYR 131 N -3.41 0.00 0.72 -1.35 4.01 0.21 -4.74 117.16 112.60 3fgq n TYR 131 Ca -0.21 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.63 3fgq n TYR 131 Cb 1.05 -0.28 0.08 0.00 -0.31 0.00 0.00 39.34 39.88 3fgq n TYR 131 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3fgq n PHE 132 N -2.03 0.02 -3.93 -0.72 3.01 -0.59 -4.92 117.46 108.31 3fgq n PHE 132 Ca -0.07 -0.02 -0.27 0.00 1.01 0.00 0.00 57.45 58.11 3fgq n PHE 132 Cb 0.48 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.94 3fgq n PHE 132 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3fgq n ASN 133 N 1.03 -1.69 -4.05 4.37 5.03 -0.86 -4.93 115.26 114.16 3fgq n ASN 133 Ca 0.11 -0.93 -0.18 0.00 0.87 0.00 0.00 54.58 54.46 3fgq n ASN 133 Cb 0.46 -3.38 -0.14 0.00 -1.02 0.00 0.00 39.78 35.70 3fgq n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3fgq s ALA 134 N -3.68 0.76 0.23 5.41 0.00 -0.81 -4.26 121.76 119.41 3fgq s ALA 134 Ca 0.22 -0.52 0.07 0.00 0.00 0.00 0.00 51.96 51.74 3fgq s ALA 134 Cb -0.12 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 3fgq s ALA 134 CO 0.87 0.15 0.11 0.00 0.00 0.00 0.00 175.76 176.88 3fgq s ALA 135 N -0.52 3.42 -0.20 0.00 0.00 -0.83 -3.21 121.76 120.43 3fgq s ALA 135 Ca 0.01 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.53 3fgq s ALA 135 Cb -0.05 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.94 3fgq s ALA 135 CO 0.00 0.34 -0.12 0.08 0.00 0.00 0.00 175.76 176.06 3fgq s VAL 136 N -2.04 2.64 -0.19 0.00 1.01 -1.26 -1.38 120.40 119.17 3fgq s VAL 136 Ca 0.31 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.50 3fgq s VAL 136 Cb -0.08 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.14 3fgq s VAL 136 CO 0.22 0.45 -0.18 0.20 0.00 0.00 0.00 175.10 175.79 3fgq s ASN 137 N 1.36 3.33 0.17 3.32 0.02 0.42 -4.98 114.94 118.58 3fgq s ASN 137 Ca 0.04 -0.71 -0.30 0.00 -1.02 0.00 0.00 52.86 50.88 3fgq s ASN 137 Cb -0.14 -1.50 -0.07 0.00 0.02 0.00 0.00 41.25 39.55 3fgq s ASN 137 CO -0.08 -0.02 1.05 -1.00 0.02 0.00 0.00 177.10 177.06 3fgq s HIS 138 N 1.28 3.69 0.24 2.20 3.76 -1.26 -0.85 115.29 124.35 3fgq s HIS 138 Ca 0.04 1.69 -0.05 0.00 -0.15 0.00 0.00 55.06 56.59 3fgq s HIS 138 Cb -0.14 -3.19 -0.02 0.00 1.11 0.00 0.00 32.58 30.34 3fgq s HIS 138 CO -0.12 -0.28 0.29 0.14 -0.85 0.00 0.00 174.74 173.93 3fgq s VAL 139 N -0.31 0.00 -0.43 -0.90 -7.23 -0.18 -4.85 120.40 106.50 3fgq s VAL 139 Ca 0.48 -1.75 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 3fgq s VAL 139 Cb -0.28 -2.40 0.08 0.00 0.56 0.00 0.00 36.38 34.34 3fgq s VAL 139 CO 0.33 0.00 0.30 -0.62 -0.31 0.00 0.00 175.10 174.80 3fgq s ASP 140 N -3.12 5.75 0.26 4.85 2.15 -1.26 0.57 116.67 125.87 3fgq s ASP 140 Ca 0.32 -1.50 0.25 0.00 0.43 0.00 0.00 52.55 52.05 3fgq s ASP 140 Cb 0.03 -2.03 0.93 0.00 -0.30 0.00 0.00 42.92 41.55 3fgq s ASP 140 CO 0.12 -0.57 1.75 -0.26 -0.17 0.00 0.00 175.17 176.04 3fgq h PHE 141 N 8.49 0.00 0.00 -5.34 -1.00 -1.93 -2.98 116.94 114.18 3fgq h PHE 141 Ca -0.24 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.54 3fgq h PHE 141 Cb 1.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.65 3fgq h PHE 141 CO 0.62 0.00 0.00 0.66 -1.61 0.00 0.00 178.31 177.98 3fgq h SER 142 N 0.00 0.00 -3.05 2.17 4.64 -1.91 -3.35 113.55 112.05 3fgq h SER 142 Ca 0.00 0.00 -0.76 0.00 -0.47 0.00 0.00 61.79 60.56 3fgq h SER 142 Cb 0.52 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.38 3fgq h SER 142 CO 0.00 0.00 0.68 -1.10 -0.87 0.00 0.00 176.83 175.54 3fgq s GLN 143 N -3.34 3.94 0.15 4.77 -0.21 -1.13 -4.92 119.66 118.92 3fgq s GLN 143 Ca 0.05 -2.63 -0.17 0.00 0.02 0.00 0.00 55.36 52.63 3fgq s GLN 143 Cb 0.09 -4.73 0.07 0.00 1.00 0.00 0.00 33.01 29.44 3fgq s GLN 143 CO 0.50 -1.49 1.71 -0.91 -2.12 0.00 0.00 175.29 172.98 3fgq h ASN 144 N 7.42 -0.14 -0.08 5.90 4.21 -1.86 0.82 115.58 131.86 3fgq h ASN 144 Ca 0.20 0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.75 3fgq h ASN 144 Cb 0.94 0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 38.27 3fgq h ASN 144 CO 1.03 -0.03 -0.08 0.58 -1.29 0.00 0.00 177.43 177.64 3fgq h VAL 145 N 0.10 1.37 -0.48 2.81 2.07 -1.91 -2.02 116.25 118.18 3fgq h VAL 145 Ca 0.17 -1.24 0.06 0.00 0.82 0.00 0.00 66.70 66.51 3fgq h VAL 145 Cb 0.23 2.02 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 3fgq h VAL 145 CO -0.28 0.35 0.18 0.00 0.02 0.00 0.00 177.57 177.84 3fgq h ALA 146 N 0.56 0.59 -0.31 1.67 0.00 -1.88 -0.10 119.26 119.79 3fgq h ALA 146 Ca 0.01 0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 3fgq h ALA 146 Cb 0.60 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3fgq h ALA 146 CO 0.02 -0.21 -0.49 -0.24 0.00 0.00 0.00 179.25 178.33 3fgq h VAL 147 N 0.36 1.28 -0.44 0.00 3.04 -0.88 0.13 116.25 119.73 3fgq h VAL 147 Ca 0.23 -1.67 -0.01 0.00 -1.01 0.00 0.00 66.70 64.23 3fgq h VAL 147 Cb 0.23 1.55 -0.02 0.00 -2.01 0.00 0.00 31.29 31.04 3fgq h VAL 147 CO -0.23 0.55 0.22 0.00 -1.01 0.00 0.00 177.57 177.09 3fgq h ALA 148 N 0.75 0.56 -0.39 3.17 0.00 -1.23 -0.88 119.26 121.25 3fgq h ALA 148 Ca 0.03 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.87 3fgq h ALA 148 Cb 1.09 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 3fgq h ALA 148 CO 0.11 0.12 0.17 -0.91 0.00 0.00 0.00 179.25 178.74 3fgq h ASN 149 N 0.57 0.22 -0.08 0.00 -0.26 -0.81 -0.45 115.58 114.76 3fgq h ASN 149 Ca 0.15 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.91 3fgq h ASN 149 Cb 0.11 -0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.36 3fgq h ASN 149 CO -0.02 0.17 -0.01 0.22 -1.06 0.00 0.00 177.43 176.73 3fgq h TYR 150 N 0.35 0.16 -0.50 1.19 3.20 -0.55 -0.95 116.97 119.87 3fgq h TYR 150 Ca 0.17 -0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.08 3fgq h TYR 150 Cb 0.12 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.29 3fgq h TYR 150 CO -0.12 0.43 0.18 0.82 -1.64 0.00 0.00 178.16 177.84 3fgq h ILE 151 N -0.17 0.84 -0.94 1.81 2.04 -1.11 0.74 117.51 120.72 3fgq h ILE 151 Ca 0.02 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.77 3fgq h ILE 151 Cb 0.38 0.44 -0.05 0.00 -0.74 0.00 0.00 36.82 36.85 3fgq h ILE 151 CO 0.01 0.07 0.62 0.78 0.00 0.00 0.00 178.15 179.63 3fgq h ASN 152 N 0.37 1.07 -0.32 1.72 2.35 -0.83 -0.18 115.58 119.76 3fgq h ASN 152 Ca 0.24 -0.03 -0.17 0.00 -0.55 0.00 0.00 56.30 55.79 3fgq h ASN 152 Cb 0.25 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 3fgq h ASN 152 CO -0.24 0.77 -0.46 0.11 -1.65 0.00 0.00 177.43 175.97 3fgq h LYS 153 N 1.27 0.90 -0.50 0.81 1.79 -0.70 0.12 116.57 120.25 3fgq h LYS 153 Ca 0.35 -0.51 0.02 0.00 -2.18 0.00 0.00 60.65 58.32 3fgq h LYS 153 Cb -0.13 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.53 3fgq h LYS 153 CO -0.08 1.16 0.31 2.35 -1.08 0.00 0.00 179.45 182.11 3fgq h TRP 154 N 0.71 0.59 -0.29 -1.35 7.01 -0.64 0.13 115.95 122.11 3fgq h TRP 154 Ca 0.04 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.01 3fgq h TRP 154 Cb 1.06 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.91 3fgq h TRP 154 CO 0.07 0.35 0.00 0.28 -2.79 0.00 0.00 178.44 176.35 3fgq h VAL 155 N 0.63 1.26 -0.33 2.65 2.07 -0.75 -2.01 116.25 119.77 3fgq h VAL 155 Ca 0.19 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.79 3fgq h VAL 155 Cb -0.02 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3fgq h VAL 155 CO -0.07 0.30 0.21 -0.33 0.02 0.00 0.00 177.57 177.70 3fgq h GLU 156 N 0.30 0.42 -0.61 1.57 5.08 -0.61 -1.85 114.58 118.87 3fgq h GLU 156 Ca 0.08 -0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.56 3fgq h GLU 156 Cb 0.43 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 3fgq h GLU 156 CO 0.01 0.28 0.42 -0.97 -1.00 0.00 0.00 179.01 177.75 3fgq h ASN 157 N 0.43 0.20 0.18 1.42 -0.73 -0.52 0.98 115.58 117.53 3fgq h ASN 157 Ca 0.12 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.30 3fgq h ASN 157 Cb -0.04 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.52 3fgq h ASN 157 CO -0.04 0.11 -0.19 0.59 -0.37 0.00 0.00 177.43 177.53 3fgq n ASN 158 N -4.43 1.13 -0.49 1.15 4.13 -0.76 -4.08 115.26 111.92 3fgq n ASN 158 Ca 0.11 -1.03 0.07 0.00 1.68 0.00 0.00 54.58 55.41 3fgq n ASN 158 Cb 0.53 0.10 0.13 0.00 -1.54 0.00 0.00 39.78 39.01 3fgq n ASN 158 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3fgq n THR 159 N -0.45 1.55 -2.73 3.41 -2.24 -0.45 -4.15 114.28 109.23 3fgq n THR 159 Ca 0.14 -2.20 -0.21 0.00 -2.27 0.00 0.00 64.05 59.51 3fgq n THR 159 Cb 0.35 -0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.59 3fgq n THR 159 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3fgq n ASN 160 N -0.92 -5.65 -0.96 3.42 5.03 -1.02 -1.49 115.26 113.67 3fgq n ASN 160 Ca 0.14 -0.13 -0.12 0.00 0.87 0.00 0.00 54.58 55.33 3fgq n ASN 160 Cb 0.73 -4.65 -0.05 0.00 -1.02 0.00 0.00 39.78 34.78 3fgq n ASN 160 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3fgq n ASN 161 N -2.22 -5.44 0.05 6.41 3.02 0.33 -4.87 115.26 112.54 3fgq n ASN 161 Ca -0.17 0.31 -0.05 0.00 -0.03 0.00 0.00 54.58 54.64 3fgq n ASN 161 Cb 0.64 -4.04 -0.09 0.00 -0.61 0.00 0.00 39.78 35.68 3fgq n ASN 161 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3fgq h LEU 162 N 0.00 0.00 -8.18 3.41 -0.00 -1.47 -3.42 115.31 105.65 3fgq h LEU 162 Ca -0.26 0.00 -0.73 0.00 -0.00 0.00 0.00 57.88 56.90 3fgq h LEU 162 Cb 1.13 0.00 -0.26 0.00 -0.00 0.00 0.00 40.66 41.53 3fgq h LEU 162 CO 0.37 0.86 -0.41 -0.69 -0.00 0.00 0.00 178.44 178.58 3fgq s VAL 163 N -2.75 4.62 0.30 1.22 1.01 -1.26 -5.06 120.40 118.47 3fgq s VAL 163 Ca -0.00 -1.29 0.08 0.00 0.00 0.00 0.00 61.98 60.77 3fgq s VAL 163 Cb 0.09 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 3fgq s VAL 163 CO 0.81 -0.55 0.17 -0.54 0.00 0.00 0.00 175.10 174.98 3fgq s LYS 164 N 1.51 2.62 -1.59 2.72 1.02 -1.26 -3.72 119.74 121.04 3fgq s LYS 164 Ca 0.03 -1.30 -0.10 0.00 0.02 0.00 0.00 55.97 54.63 3fgq s LYS 164 Cb -0.24 -2.37 0.09 0.00 -0.52 0.00 0.00 37.83 34.79 3fgq s LYS 164 CO 0.04 0.25 0.54 -0.25 -0.92 0.00 0.00 175.35 175.00 3fgq n ASP 165 N -1.16 -1.57 -0.17 2.83 8.00 -1.26 -4.84 116.55 118.38 3fgq n ASP 165 Ca -0.05 -1.06 -0.05 0.00 0.71 0.00 0.00 54.79 54.34 3fgq n ASP 165 Cb 0.59 -2.63 0.04 0.00 -0.02 0.00 0.00 41.12 39.11 3fgq n ASP 165 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3fgq h LEU 166 N -1.62 0.43 -9.17 0.64 5.85 -1.91 -3.45 115.31 106.08 3fgq h LEU 166 Ca -0.62 0.02 -0.47 0.00 0.84 0.00 0.00 57.88 57.65 3fgq h LEU 166 Cb 1.38 -0.07 -0.14 0.00 0.37 0.00 0.00 40.66 42.21 3fgq h LEU 166 CO 0.72 0.30 -0.64 0.68 -0.34 0.00 0.00 178.44 179.16 3fgq s VAL 167 N -6.14 1.36 0.16 1.05 -7.23 -1.26 -5.10 120.40 103.24 3fgq s VAL 167 Ca -0.13 -2.05 0.06 0.00 -1.81 0.00 0.00 61.98 58.05 3fgq s VAL 167 Cb 0.13 -2.62 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 3fgq s VAL 167 CO 0.74 -0.15 -0.12 -0.44 -0.31 0.00 0.00 175.10 174.81 3fgq s SER 168 N -3.46 2.05 0.48 4.85 0.01 -1.26 -4.90 113.70 111.47 3fgq s SER 168 Ca 0.33 -0.96 0.18 0.00 1.31 0.00 0.00 55.95 56.80 3fgq s SER 168 Cb 0.07 -0.06 1.19 0.00 0.21 0.00 0.00 66.02 67.43 3fgq s SER 168 CO 0.13 -0.24 2.02 -0.65 0.41 0.00 0.00 173.24 174.91 3fgq h PRO 169 N 2.91 0.19 0.00 12.44 0.11 -1.91 -1.25 132.00 144.50 3fgq h PRO 169 Ca -0.38 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 3fgq h PRO 169 Cb 1.20 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3fgq h PRO 169 CO 0.60 0.13 -0.03 0.07 -0.21 0.00 0.00 178.00 178.56 3fgq h ARG 170 N 0.20 0.00 0.00 1.05 0.11 -1.96 -1.34 114.38 112.45 3fgq h ARG 170 Ca 0.21 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.29 3fgq h ARG 170 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 3fgq h ARG 170 CO -0.03 0.03 0.00 -0.25 0.10 0.00 0.00 179.97 179.81 3fgq n ASP 171 N -3.22 0.05 -0.07 0.08 10.43 -0.47 -2.30 116.55 121.05 3fgq n ASP 171 Ca -0.01 0.51 0.08 0.00 2.57 0.00 0.00 54.79 57.94 3fgq n ASP 171 Cb 0.20 -0.52 0.11 0.00 1.84 0.00 0.00 41.12 42.74 3fgq n ASP 171 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 3fgq n PHE 172 N -1.56 0.00 -0.12 1.24 3.01 -0.50 -4.63 117.46 114.89 3fgq n PHE 172 Ca 0.02 -0.87 -0.09 0.00 1.01 0.00 0.00 57.45 57.52 3fgq n PHE 172 Cb 0.13 -0.13 -0.01 0.00 -0.01 0.00 0.00 39.48 39.46 3fgq n PHE 172 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 3fgq h ASP 173 N 0.00 0.48 -3.92 4.37 3.32 -1.53 -3.42 116.42 115.72 3fgq h ASP 173 Ca 0.00 -0.11 -0.50 0.00 0.02 0.00 0.00 57.03 56.44 3fgq h ASP 173 Cb 0.92 -0.12 0.04 0.00 0.22 0.00 0.00 39.33 40.39 3fgq h ASP 173 CO 0.00 0.46 0.48 0.00 -1.72 0.00 0.00 179.24 178.46 3fgq s ALA 174 N -5.77 3.20 0.03 3.45 0.00 -1.26 -4.95 121.76 116.45 3fgq s ALA 174 Ca -0.13 0.90 -0.37 0.00 0.00 0.00 0.00 51.96 52.35 3fgq s ALA 174 Cb 0.10 -3.35 -0.16 0.00 0.00 0.00 0.00 23.12 19.71 3fgq s ALA 174 CO 0.74 -0.38 1.43 0.00 0.00 0.00 0.00 175.76 177.55 3fgq n ALA 175 N 0.28 -0.67 -2.77 0.00 0.00 -1.26 -4.96 120.51 111.13 3fgq n ALA 175 Ca 0.03 0.49 -0.18 0.00 0.00 0.00 0.00 53.44 53.78 3fgq n ALA 175 Cb 0.47 -2.13 -0.15 0.00 0.00 0.00 0.00 19.45 17.64 3fgq n ALA 175 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3fgq s THR 176 N 1.09 0.63 0.00 0.00 -4.23 -1.26 -4.97 115.64 106.90 3fgq s THR 176 Ca 0.87 -0.33 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 3fgq s THR 176 Cb -0.95 -0.54 0.00 0.00 1.34 0.00 0.00 72.50 72.35 3fgq s THR 176 CO 0.49 0.18 0.00 -1.22 -0.54 0.00 0.00 174.62 173.54 3fgq n TYR 177 N 2.97 0.00 -3.68 3.99 4.01 -1.26 -4.75 117.16 118.43 3fgq n TYR 177 Ca -0.14 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.50 3fgq n TYR 177 Cb 0.57 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.50 3fgq n TYR 177 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3fgq s LEU 178 N -2.05 -0.26 -0.02 7.72 2.96 -1.26 -0.67 118.68 125.11 3fgq s LEU 178 Ca 0.00 0.98 0.01 0.00 -0.22 0.00 0.00 54.13 54.91 3fgq s LEU 178 Cb 0.00 1.48 0.01 0.00 0.50 0.00 0.00 46.19 48.18 3fgq s LEU 178 CO 0.00 -0.20 -0.04 0.00 -1.32 0.00 0.00 176.35 174.79 3fgq s ALA 179 N 1.56 0.47 -0.21 5.97 0.00 0.72 -1.45 121.76 128.81 3fgq s ALA 179 Ca -0.09 -0.12 -0.09 0.00 0.00 0.00 0.00 51.96 51.67 3fgq s ALA 179 Cb -0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 3fgq s ALA 179 CO -0.14 0.05 0.10 -1.17 0.00 0.00 0.00 175.76 174.61 3fgq s LEU 180 N 0.30 3.89 -0.12 0.00 2.96 -0.20 0.16 118.68 125.67 3fgq s LEU 180 Ca -0.03 0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 3fgq s LEU 180 Cb -0.07 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.62 3fgq s LEU 180 CO -0.00 0.11 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.33 3fgq s ILE 181 N 0.79 1.68 -0.07 6.68 -1.09 0.56 -1.20 121.20 128.56 3fgq s ILE 181 Ca 0.05 -0.75 -0.01 0.00 -2.23 0.00 0.00 60.65 57.71 3fgq s ILE 181 Cb -0.13 -1.52 0.03 0.00 -1.58 0.00 0.00 42.46 39.26 3fgq s ILE 181 CO 0.02 0.48 -0.00 0.21 -1.23 0.00 0.00 174.94 174.42 3fgq s ASN 182 N 0.91 1.58 0.03 3.58 3.84 -0.16 -1.13 114.94 123.59 3fgq s ASN 182 Ca -0.07 -0.09 -0.00 0.00 0.21 0.00 0.00 52.86 52.91 3fgq s ASN 182 Cb -0.15 -0.45 -0.03 0.00 -0.55 0.00 0.00 41.25 40.07 3fgq s ASN 182 CO -0.01 -0.19 -0.03 0.00 -2.79 0.00 0.00 177.10 174.08 3fgq s ALA 183 N 1.93 0.30 -0.17 1.71 0.00 -0.17 -0.86 121.76 124.51 3fgq s ALA 183 Ca 0.04 -0.86 -0.14 0.00 0.00 0.00 0.00 51.96 51.01 3fgq s ALA 183 Cb -0.12 0.20 0.05 0.00 0.00 0.00 0.00 23.12 23.24 3fgq s ALA 183 CO -0.05 -0.24 0.45 0.54 0.00 0.00 0.00 175.76 176.46 3fgq s VAL 184 N -2.48 -0.01 -0.03 0.00 0.11 -0.04 -1.18 120.40 116.77 3fgq s VAL 184 Ca -0.06 0.03 0.07 0.00 -2.93 0.00 0.00 61.98 59.09 3fgq s VAL 184 Cb -0.03 -0.64 -0.02 0.00 -1.53 0.00 0.00 36.38 34.16 3fgq s VAL 184 CO -0.05 0.01 -0.24 -0.47 -3.33 0.00 0.00 175.10 171.02 3fgq s TYR 185 N 0.69 2.39 -0.02 1.54 5.04 -0.16 -0.87 117.35 125.97 3fgq s TYR 185 Ca -0.04 -0.44 0.01 0.00 -2.44 0.00 0.00 57.07 54.17 3fgq s TYR 185 Cb -0.05 -1.53 0.01 0.00 0.35 0.00 0.00 41.96 40.73 3fgq s TYR 185 CO -0.05 -0.03 -0.05 0.12 -1.34 0.00 0.00 175.55 174.20 3fgq s PHE 186 N -0.56 0.55 -0.11 4.97 5.36 -0.49 -0.83 117.98 126.87 3fgq s PHE 186 Ca 0.08 -0.11 -0.07 0.00 -0.96 0.00 0.00 56.93 55.87 3fgq s PHE 186 Cb -0.11 -0.42 0.04 0.00 -0.34 0.00 0.00 43.02 42.19 3fgq s PHE 186 CO -0.00 -0.07 0.27 0.21 -1.46 0.00 0.00 175.22 174.17 3fgq s LYS 187 N 0.25 0.27 0.18 10.12 2.20 -0.70 -1.93 119.74 130.11 3fgq s LYS 187 Ca -0.03 0.49 0.11 0.00 -0.36 0.00 0.00 55.97 56.18 3fgq s LYS 187 Cb -0.07 -0.00 -0.04 0.00 -1.51 0.00 0.00 37.83 36.21 3fgq s LYS 187 CO -0.00 -0.11 -0.24 0.20 -0.36 0.00 0.00 175.35 174.84 3fgq s GLY 188 N 0.83 1.63 -0.12 5.54 0.00 -1.26 -0.97 107.32 112.96 3fgq s GLY 188 Ca -0.06 -1.58 -0.22 0.00 0.00 0.00 0.00 44.72 42.87 3fgq s GLY 188 CO -0.05 -1.60 0.66 -1.31 0.00 0.00 0.00 173.10 170.79 3fgq s ASN 189 N -2.54 6.86 0.41 1.64 0.02 -0.48 -4.90 114.94 115.94 3fgq s ASN 189 Ca 0.18 1.03 -0.26 0.00 -1.02 0.00 0.00 52.86 52.80 3fgq s ASN 189 Cb -0.08 -2.38 -0.09 0.00 0.02 0.00 0.00 41.25 38.73 3fgq s ASN 189 CO 0.09 -0.16 1.29 0.26 0.02 0.00 0.00 177.10 178.59 3fgq s TRP 190 N 1.17 2.84 0.33 2.20 0.23 -0.45 0.13 118.94 125.39 3fgq s TRP 190 Ca 0.33 1.42 0.01 0.00 -2.03 0.00 0.00 56.10 55.84 3fgq s TRP 190 Cb -0.17 -3.64 0.58 0.00 0.03 0.00 0.00 33.47 30.27 3fgq s TRP 190 CO 0.14 -2.02 1.99 -0.22 0.96 0.00 0.00 176.95 177.81 3fgq h LYS 191 N 2.66 0.91 -4.71 4.98 3.64 -1.42 0.12 116.57 122.75 3fgq h LYS 191 Ca -0.49 -0.05 -0.66 0.00 -1.27 0.00 0.00 60.65 58.17 3fgq h LYS 191 Cb 1.25 -0.20 -0.39 0.00 -0.41 0.00 0.00 32.23 32.47 3fgq h LYS 191 CO 0.62 0.60 -0.76 0.45 -2.27 0.00 0.00 179.45 178.10 3fgq s SER 192 N -6.40 4.55 0.72 4.20 0.15 -1.26 -3.91 113.70 111.75 3fgq s SER 192 Ca -0.10 -1.75 -0.16 0.00 0.70 0.00 0.00 55.95 54.64 3fgq s SER 192 Cb 0.18 -1.54 0.03 0.00 -1.71 0.00 0.00 66.02 62.98 3fgq s SER 192 CO 0.77 -0.29 1.18 0.00 1.20 0.00 0.00 173.24 176.11 3fgq n GLN 193 N 4.38 0.64 -3.25 5.44 10.64 -0.16 -4.84 117.38 130.22 3fgq n GLN 193 Ca -0.05 0.28 -0.38 0.00 -1.83 0.00 0.00 57.00 55.02 3fgq n GLN 193 Cb 0.42 -2.42 -0.06 0.00 -0.86 0.00 0.00 30.24 27.32 3fgq n GLN 193 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 3fgq s PHE 194 N -1.75 3.76 -0.11 2.61 0.08 -0.09 -4.92 117.98 117.55 3fgq s PHE 194 Ca 0.77 1.27 -0.22 0.00 0.12 0.00 0.00 56.93 58.87 3fgq s PHE 194 Cb -0.34 -2.50 -0.03 0.00 -0.57 0.00 0.00 43.02 39.57 3fgq s PHE 194 CO 0.46 0.52 0.66 1.03 -0.10 0.00 0.00 175.22 177.79 3fgq s ARG 195 N -1.38 4.36 0.53 0.44 0.52 -1.26 -4.61 118.95 117.55 3fgq s ARG 195 Ca 0.33 0.76 0.21 0.00 -0.52 0.00 0.00 55.73 56.50 3fgq s ARG 195 Cb -0.19 -3.49 1.43 0.00 0.52 0.00 0.00 34.95 33.22 3fgq s ARG 195 CO 0.20 -0.02 2.16 -1.00 0.02 0.00 0.00 175.30 176.66 3fgq h PRO 196 N 6.97 0.00 0.00 3.54 0.13 -1.95 -0.32 132.00 140.37 3fgq h PRO 196 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 3fgq h PRO 196 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3fgq h PRO 196 CO 0.77 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.72 3fgq n GLU 197 N -4.24 0.13 -0.02 0.86 -0.00 -1.26 -2.26 120.64 113.85 3fgq n GLU 197 Ca -0.03 0.38 0.13 0.00 -0.00 0.00 0.00 57.16 57.64 3fgq n GLU 197 Cb 0.11 -1.76 0.28 0.00 -0.00 0.00 0.00 31.44 30.08 3fgq n GLU 197 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3fgq n ASN 198 N -2.00 2.41 -4.68 -1.84 3.02 -0.13 -4.88 115.26 107.15 3fgq n ASN 198 Ca 0.02 -1.80 -0.40 0.00 -0.03 0.00 0.00 54.58 52.37 3fgq n ASN 198 Cb 0.20 -0.03 -0.05 0.00 -0.61 0.00 0.00 39.78 39.29 3fgq n ASN 198 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3fgq s THR 199 N -1.95 5.02 0.09 3.41 2.01 -0.96 -3.85 115.64 119.41 3fgq s THR 199 Ca 0.33 1.33 -0.03 0.00 0.31 0.00 0.00 61.69 63.63 3fgq s THR 199 Cb 0.20 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 3fgq s THR 199 CO 0.31 0.15 0.06 -0.13 -0.69 0.00 0.00 174.62 174.32 3fgq s ARG 200 N 1.52 0.78 0.05 4.92 0.52 -0.65 -4.86 118.95 121.23 3fgq s ARG 200 Ca 0.33 -1.23 -0.31 0.00 -0.52 0.00 0.00 55.73 54.00 3fgq s ARG 200 Cb -0.16 0.25 -0.06 0.00 0.52 0.00 0.00 34.95 35.50 3fgq s ARG 200 CO 0.13 -0.20 1.30 0.99 0.02 0.00 0.00 175.30 177.54 3fgq s THR 201 N -3.95 3.76 0.20 0.02 2.01 -1.26 0.25 115.64 116.68 3fgq s THR 201 Ca 0.12 1.23 0.06 0.00 0.31 0.00 0.00 61.69 63.41 3fgq s THR 201 Cb 0.07 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.74 3fgq s THR 201 CO -0.06 0.06 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.48 3fgq s PHE 202 N 1.50 1.57 0.08 4.92 0.40 -0.41 -4.88 117.98 121.17 3fgq s PHE 202 Ca 0.61 -0.72 -0.14 0.00 -0.60 0.00 0.00 56.93 56.09 3fgq s PHE 202 Cb -0.32 -0.81 -0.06 0.00 0.51 0.00 0.00 43.02 42.34 3fgq s PHE 202 CO 0.28 0.18 0.47 -1.54 0.70 0.00 0.00 175.22 175.32 3fgq s SER 203 N -3.28 6.80 -0.15 1.36 1.04 -1.26 -1.16 113.70 117.05 3fgq s SER 203 Ca 0.23 0.99 0.01 0.00 0.48 0.00 0.00 55.95 57.66 3fgq s SER 203 Cb 0.02 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.89 3fgq s SER 203 CO 0.06 0.20 -0.18 0.12 0.98 0.00 0.00 173.24 174.42 3fgq s PHE 204 N -1.30 2.73 -0.46 5.02 2.19 0.15 -4.88 117.98 121.43 3fgq s PHE 204 Ca 0.32 -1.18 -0.17 0.00 0.33 0.00 0.00 56.93 56.23 3fgq s PHE 204 Cb -0.16 -1.86 0.04 0.00 -1.31 0.00 0.00 43.02 39.74 3fgq s PHE 204 CO 0.17 -0.54 0.49 0.99 1.83 0.00 0.00 175.22 178.16 3fgq s THR 205 N 0.82 5.05 0.86 0.12 2.01 -0.13 -1.15 115.64 123.22 3fgq s THR 205 Ca -0.06 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.30 3fgq s THR 205 Cb -0.15 -4.13 0.11 0.00 0.01 0.00 0.00 72.50 68.33 3fgq s THR 205 CO -0.01 -0.57 1.09 -0.54 -0.69 0.00 0.00 174.62 173.91 3fgq s LYS 206 N 2.19 1.53 0.00 4.92 1.02 0.59 -4.14 119.74 125.86 3fgq s LYS 206 Ca 0.11 0.98 0.21 0.00 0.02 0.00 0.00 55.97 57.30 3fgq s LYS 206 Cb -0.19 -1.83 1.00 0.00 -0.52 0.00 0.00 37.83 36.29 3fgq s LYS 206 CO 0.12 -2.09 1.69 -0.25 -0.92 0.00 0.00 175.35 173.89 3fgq n ASP 207 N -3.80 0.00 -1.55 2.83 8.00 -1.26 -0.73 116.55 120.04 3fgq n ASP 207 Ca 0.08 0.25 0.06 0.00 0.71 0.00 0.00 54.79 55.89 3fgq n ASP 207 Cb 0.54 -0.40 0.32 0.00 -0.02 0.00 0.00 41.12 41.57 3fgq n ASP 207 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3fgq n ASP 208 N -1.40 4.58 0.00 -2.24 5.68 -1.26 -4.94 116.55 116.98 3fgq n ASP 208 Ca 0.08 -2.63 0.00 0.00 -0.50 0.00 0.00 54.79 51.74 3fgq n ASP 208 Cb 0.21 -0.61 0.00 0.00 -1.14 0.00 0.00 41.12 39.58 3fgq n ASP 208 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3fgq n GLU 209 N 0.63 0.00 -1.90 0.11 1.02 0.09 -4.99 120.64 115.60 3fgq n GLU 209 Ca 0.22 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 57.04 3fgq n GLU 209 Cb 0.94 -3.15 0.03 0.00 -0.02 0.00 0.00 31.44 29.23 3fgq n GLU 209 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3fgq s SER 210 N -2.73 5.56 0.04 1.62 1.04 -1.26 -4.79 113.70 113.19 3fgq s SER 210 Ca 0.00 1.82 0.09 0.00 0.48 0.00 0.00 55.95 58.34 3fgq s SER 210 Cb 0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 3fgq s SER 210 CO 0.00 -1.32 -0.25 -1.61 0.98 0.00 0.00 173.24 171.04 3fgq s GLU 211 N -4.24 1.71 0.06 4.02 2.02 -1.26 -0.30 118.70 120.71 3fgq s GLU 211 Ca 0.63 -1.06 0.04 0.00 0.02 0.00 0.00 54.97 54.60 3fgq s GLU 211 Cb -0.17 -1.86 -0.03 0.00 0.10 0.00 0.00 34.13 32.17 3fgq s GLU 211 CO 0.41 0.48 -0.11 0.54 0.02 0.00 0.00 175.26 176.60 3fgq s VAL 212 N -0.79 0.83 -0.11 2.63 0.11 -0.30 -4.94 120.40 117.82 3fgq s VAL 212 Ca 0.11 -1.20 -0.18 0.00 -2.93 0.00 0.00 61.98 57.78 3fgq s VAL 212 Cb -0.10 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3fgq s VAL 212 CO 0.02 -0.31 0.46 -1.10 -3.33 0.00 0.00 175.10 170.84 3fgq s GLN 213 N -1.67 4.31 0.11 1.54 -1.52 -1.26 0.31 119.66 121.49 3fgq s GLN 213 Ca -0.06 0.42 -0.00 0.00 -1.95 0.00 0.00 55.36 53.77 3fgq s GLN 213 Cb -0.10 -3.42 -0.04 0.00 -0.22 0.00 0.00 33.01 29.23 3fgq s GLN 213 CO 0.01 0.19 0.01 0.96 -0.25 0.00 0.00 175.29 176.21 3fgq s ILE 214 N 0.52 0.31 -0.27 1.08 -5.25 -0.31 -4.96 121.20 112.32 3fgq s ILE 214 Ca 0.25 -1.90 -0.29 0.00 -0.99 0.00 0.00 60.65 57.72 3fgq s ILE 214 Cb -0.15 -1.86 -0.00 0.00 2.95 0.00 0.00 42.46 43.40 3fgq s ILE 214 CO 0.10 -0.68 1.30 -2.84 -1.79 0.00 0.00 174.94 171.04 3fgq s PRO 215 N -3.96 3.97 -0.39 0.37 0.02 -1.26 -1.28 135.00 132.46 3fgq s PRO 215 Ca 0.17 1.34 -0.16 0.00 0.02 0.00 0.00 61.00 62.38 3fgq s PRO 215 Cb 0.07 -3.86 0.01 0.00 0.02 0.00 0.00 34.50 30.74 3fgq s PRO 215 CO -0.02 -1.05 0.35 1.41 -0.33 0.00 0.00 177.00 177.37 3fgq s MET 216 N 4.05 3.18 0.57 5.54 1.75 0.14 -1.28 119.30 133.26 3fgq s MET 216 Ca 0.56 -0.78 -0.17 0.00 -1.25 0.00 0.00 55.69 54.06 3fgq s MET 216 Cb -0.18 -3.92 -0.04 0.00 2.84 0.00 0.00 34.83 33.52 3fgq s MET 216 CO 0.22 -0.71 1.06 -1.64 -0.65 0.00 0.00 175.02 173.29 3fgq s MET 217 N 1.91 3.39 -0.02 4.11 -1.94 0.90 -1.63 119.30 126.02 3fgq s MET 217 Ca 0.09 1.25 -0.01 0.00 -1.71 0.00 0.00 55.69 55.30 3fgq s MET 217 Cb -0.18 -2.04 0.01 0.00 2.01 0.00 0.00 34.83 34.63 3fgq s MET 217 CO 0.12 -0.75 0.05 -0.47 -0.01 0.00 0.00 175.02 173.95 3fgq s TYR 218 N -2.34 -0.05 0.12 -0.03 5.04 -1.25 -0.98 117.35 117.85 3fgq s TYR 218 Ca 0.65 0.14 -0.22 0.00 -2.44 0.00 0.00 57.07 55.19 3fgq s TYR 218 Cb -0.16 -0.02 0.06 0.00 0.35 0.00 0.00 41.96 42.19 3fgq s TYR 218 CO 0.34 -0.04 0.56 1.14 -1.34 0.00 0.00 175.55 176.20 3fgq s GLN 219 N 0.20 1.18 -0.28 4.97 -2.07 -0.39 -4.37 119.66 118.89 3fgq s GLN 219 Ca -0.01 -0.41 -0.09 0.00 -1.82 0.00 0.00 55.36 53.03 3fgq s GLN 219 Cb -0.02 0.54 -0.02 0.00 -1.09 0.00 0.00 33.01 32.42 3fgq s GLN 219 CO -0.01 -0.48 0.12 -1.14 -1.32 0.00 0.00 175.29 172.46 3fgq s GLN 220 N -3.31 3.51 0.23 9.60 0.74 -1.26 -0.33 119.66 128.83 3fgq s GLN 220 Ca -0.01 -0.59 -0.08 0.00 0.05 0.00 0.00 55.36 54.73 3fgq s GLN 220 Cb -0.00 -3.46 0.03 0.00 1.10 0.00 0.00 33.01 30.68 3fgq s GLN 220 CO -0.09 -0.30 0.45 0.41 -0.55 0.00 0.00 175.29 175.21 3fgq n GLY 221 N 4.96 1.45 3.62 2.59 0.00 -0.88 -4.96 105.19 111.97 3fgq n GLY 221 Ca -0.15 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 3fgq n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fgq s GLU 222 N -2.07 4.02 0.31 1.61 0.41 -1.26 -1.09 118.70 120.63 3fgq s GLU 222 Ca 0.09 0.71 0.03 0.00 -0.41 0.00 0.00 54.97 55.39 3fgq s GLU 222 Cb -0.03 -3.71 -0.04 0.00 -1.78 0.00 0.00 34.13 28.57 3fgq s GLU 222 CO 0.07 -0.67 0.13 -0.06 -0.49 0.00 0.00 175.26 174.24 3fgq s PHE 223 N 3.01 1.64 -0.22 1.61 0.08 -0.61 -4.81 117.98 118.68 3fgq s PHE 223 Ca 0.34 -1.28 -0.10 0.00 0.12 0.00 0.00 56.93 56.02 3fgq s PHE 223 Cb -0.14 -0.94 -0.05 0.00 -0.57 0.00 0.00 43.02 41.32 3fgq s PHE 223 CO 0.12 -0.40 0.13 0.71 -0.10 0.00 0.00 175.22 175.68 3fgq s TYR 224 N -3.57 3.33 -0.02 0.36 1.51 -0.45 -0.98 117.35 117.53 3fgq s TYR 224 Ca 0.35 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.64 3fgq s TYR 224 Cb 0.06 -2.20 0.01 0.00 -0.11 0.00 0.00 41.96 39.72 3fgq s TYR 224 CO 0.16 0.14 -0.03 -0.47 -1.11 0.00 0.00 175.55 174.24 3fgq s TYR 225 N 0.73 0.47 0.08 2.71 5.04 0.07 0.14 117.35 126.59 3fgq s TYR 225 Ca 0.07 -0.09 -0.03 0.00 -2.44 0.00 0.00 57.07 54.58 3fgq s TYR 225 Cb -0.12 -0.41 -0.03 0.00 0.35 0.00 0.00 41.96 41.74 3fgq s TYR 225 CO 0.02 -0.09 0.05 0.20 -1.34 0.00 0.00 175.55 174.38 3fgq s GLY 226 N 0.49 0.49 0.04 8.97 0.00 -0.56 -1.33 107.32 115.43 3fgq s GLY 226 Ca -0.05 -1.12 0.08 0.00 0.00 0.00 0.00 44.72 43.63 3fgq s GLY 226 CO -0.01 -1.20 -0.22 -0.54 0.00 0.00 0.00 173.10 171.14 3fgq s GLU 227 N -3.93 1.94 0.02 2.90 2.02 -1.26 -1.00 118.70 119.39 3fgq s GLU 227 Ca 0.10 -1.05 -0.03 0.00 0.02 0.00 0.00 54.97 54.01 3fgq s GLU 227 Cb 0.07 -2.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.20 3fgq s GLU 227 CO -0.08 0.53 0.04 -0.06 0.02 0.00 0.00 175.26 175.72 3fgq s PHE 228 N -0.87 0.20 0.11 1.61 0.40 -0.22 -4.95 117.98 114.26 3fgq s PHE 228 Ca 0.13 -0.44 -0.30 0.00 -0.60 0.00 0.00 56.93 55.72 3fgq s PHE 228 Cb -0.10 -0.15 -0.06 0.00 0.51 0.00 0.00 43.02 43.21 3fgq s PHE 228 CO 0.04 -0.27 1.07 0.45 0.70 0.00 0.00 175.22 177.21 3fgq s SER 229 N -1.66 7.30 0.00 1.36 0.15 -1.26 -0.14 113.70 119.44 3fgq s SER 229 Ca -0.12 1.94 0.24 0.00 0.70 0.00 0.00 55.95 58.71 3fgq s SER 229 Cb -0.06 -2.59 1.31 0.00 -1.71 0.00 0.00 66.02 62.97 3fgq s SER 229 CO -0.01 -0.24 1.78 -0.90 1.20 0.00 0.00 173.24 175.06 3fgq n ASP 230 N 3.00 0.00 0.00 5.45 3.85 -1.21 -4.83 116.55 122.81 3fgq n ASP 230 Ca 0.04 -0.44 0.00 0.00 -0.71 0.00 0.00 54.79 53.68 3fgq n ASP 230 Cb 0.48 -0.13 0.00 0.00 -1.35 0.00 0.00 41.12 40.12 3fgq n ASP 230 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3fgq n GLY 231 N 0.57 2.70 0.04 6.12 0.00 -1.26 -4.90 105.19 108.45 3fgq n GLY 231 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.27 3fgq n GLY 231 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fgq n SER 232 N 0.00 0.23 0.00 1.61 3.41 -1.26 -4.88 113.62 112.73 3fgq n SER 232 Ca 0.00 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 3fgq n SER 232 Cb 0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 3fgq n SER 232 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3fgq n ASN 233 N -1.74 -2.28 -4.64 4.04 5.03 -1.26 -4.94 115.26 109.48 3fgq n ASN 233 Ca 0.04 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.20 3fgq n ASN 233 Cb 0.26 -2.72 0.19 0.00 -1.02 0.00 0.00 39.78 36.48 3fgq n ASN 233 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3fgq s GLU 234 N -1.31 0.27 0.19 3.52 2.02 -1.26 -4.93 118.70 117.20 3fgq s GLU 234 Ca 0.00 0.71 -0.31 0.00 0.02 0.00 0.00 54.97 55.39 3fgq s GLU 234 Cb 0.00 -1.70 -0.10 0.00 0.10 0.00 0.00 34.13 32.43 3fgq s GLU 234 CO 0.00 -2.89 1.54 0.00 0.02 0.00 0.00 175.26 173.93 3fgq s ALA 235 N -2.81 3.74 0.00 5.21 0.00 -1.26 -2.62 121.76 124.02 3fgq s ALA 235 Ca 0.66 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.99 3fgq s ALA 235 Cb -0.20 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.31 3fgq s ALA 235 CO 0.59 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.98 3fgq n GLY 236 N 3.27 1.62 3.13 0.00 0.00 -1.26 -4.89 105.19 107.05 3fgq n GLY 236 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 3fgq n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fgq n GLY 237 N 0.00 -0.13 3.21 -0.02 0.00 -1.08 -4.79 105.19 102.38 3fgq n GLY 237 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3fgq n GLY 237 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fgq s ILE 238 N 0.35 0.14 0.20 -0.61 -4.36 -1.26 -3.28 121.20 112.38 3fgq s ILE 238 Ca 0.33 -1.34 0.07 0.00 -0.26 0.00 0.00 60.65 59.45 3fgq s ILE 238 Cb -0.20 -1.48 -0.05 0.00 1.25 0.00 0.00 42.46 41.98 3fgq s ILE 238 CO 0.14 -0.64 -0.14 -0.72 0.24 0.00 0.00 174.94 173.82 3fgq s TYR 239 N -3.90 1.65 0.00 1.37 1.13 0.80 -4.07 117.35 114.34 3fgq s TYR 239 Ca 0.08 -0.59 -0.00 0.00 -1.41 0.00 0.00 57.07 55.15 3fgq s TYR 239 Cb 0.05 -0.78 -0.04 0.00 -1.10 0.00 0.00 41.96 40.10 3fgq s TYR 239 CO -0.08 0.32 0.08 -0.65 -2.51 0.00 0.00 175.55 172.71 3fgq s GLN 240 N -3.62 3.05 -0.11 -3.49 -0.21 -0.41 -1.06 119.66 113.82 3fgq s GLN 240 Ca 0.21 -0.50 0.02 0.00 0.02 0.00 0.00 55.36 55.11 3fgq s GLN 240 Cb -0.01 -2.85 0.01 0.00 1.00 0.00 0.00 33.01 31.17 3fgq s GLN 240 CO 0.06 0.64 -0.17 0.08 -2.12 0.00 0.00 175.29 173.78 3fgq s VAL 241 N -1.22 1.61 -0.10 1.09 1.01 -0.17 -0.87 120.40 121.76 3fgq s VAL 241 Ca 0.24 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3fgq s VAL 241 Cb -0.12 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.83 3fgq s VAL 241 CO 0.15 0.46 -0.16 -0.22 0.00 0.00 0.00 175.10 175.33 3fgq s LEU 242 N 0.83 1.77 -0.20 3.92 2.96 -0.19 -1.50 118.68 126.27 3fgq s LEU 242 Ca -0.10 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 3fgq s LEU 242 Cb -0.16 -1.10 -0.00 0.00 0.50 0.00 0.00 46.19 45.44 3fgq s LEU 242 CO 0.01 0.04 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.28 3fgq s GLU 243 N 0.85 3.27 -0.28 1.98 2.12 0.12 0.39 118.70 127.16 3fgq s GLU 243 Ca -0.09 -0.69 -0.06 0.00 0.36 0.00 0.00 54.97 54.49 3fgq s GLU 243 Cb -0.15 -2.86 0.01 0.00 0.26 0.00 0.00 34.13 31.39 3fgq s GLU 243 CO 0.01 -0.17 0.05 0.42 -0.54 0.00 0.00 175.26 175.03 3fgq s ILE 244 N 1.34 3.82 0.29 -3.70 1.01 0.88 -1.34 121.20 123.50 3fgq s ILE 244 Ca 0.04 -0.68 -0.29 0.00 0.00 0.00 0.00 60.65 59.72 3fgq s ILE 244 Cb -0.14 -2.94 -0.10 0.00 0.01 0.00 0.00 42.46 39.29 3fgq s ILE 244 CO -0.05 0.14 1.15 -2.84 0.00 0.00 0.00 174.94 173.33 3fgq s PRO 245 N 1.49 4.57 0.48 2.79 0.02 -1.26 -1.29 135.00 141.80 3fgq s PRO 245 Ca 0.03 1.90 -0.09 0.00 0.02 0.00 0.00 61.00 62.86 3fgq s PRO 245 Cb -0.17 -3.16 -0.05 0.00 0.02 0.00 0.00 34.50 31.14 3fgq s PRO 245 CO 0.01 0.12 0.84 0.71 -0.33 0.00 0.00 177.00 178.35 3fgq s TYR 246 N -1.15 3.54 0.28 6.54 1.51 0.00 -1.44 117.35 126.62 3fgq s TYR 246 Ca 0.45 1.02 -0.28 0.00 -1.01 0.00 0.00 57.07 57.25 3fgq s TYR 246 Cb -0.34 -2.45 -0.14 0.00 -0.11 0.00 0.00 41.96 38.91 3fgq s TYR 246 CO 0.44 -0.30 0.94 -1.91 -1.11 0.00 0.00 175.55 173.61 3fgq n GLU 247 N -2.00 1.17 0.00 -0.62 4.07 0.12 -2.00 120.64 121.38 3fgq n GLU 247 Ca 0.03 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.53 3fgq n GLU 247 Cb 0.54 -1.73 0.00 0.00 -0.06 0.00 0.00 31.44 30.20 3fgq n GLU 247 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3fgq n GLY 248 N 1.32 1.08 3.52 8.31 0.00 -1.26 -4.62 105.19 113.54 3fgq n GLY 248 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3fgq n GLY 248 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fgq n ASP 249 N 0.00 0.00 -0.06 1.61 9.92 -0.85 -4.79 116.55 122.39 3fgq n ASP 249 Ca 0.00 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 54.05 3fgq n ASP 249 Cb 0.00 -1.02 -0.13 0.00 -0.64 0.00 0.00 41.12 39.33 3fgq n ASP 249 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3fgq n GLU 250 N -2.00 0.69 -3.99 -1.24 1.02 -1.26 -4.83 120.64 109.03 3fgq n GLU 250 Ca 0.00 0.27 -0.32 0.00 -0.02 0.00 0.00 57.16 57.08 3fgq n GLU 250 Cb 0.00 -1.64 -0.06 0.00 -0.02 0.00 0.00 31.44 29.73 3fgq n GLU 250 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3fgq s ILE 251 N -2.52 5.09 0.08 -3.67 -1.09 -1.26 0.47 121.20 118.29 3fgq s ILE 251 Ca -0.28 -0.36 -0.09 0.00 -2.23 0.00 0.00 60.65 57.69 3fgq s ILE 251 Cb 0.08 -3.39 0.00 0.00 -1.58 0.00 0.00 42.46 37.57 3fgq s ILE 251 CO 0.67 0.27 0.20 -0.94 -1.23 0.00 0.00 174.94 173.92 3fgq s SER 252 N -2.04 0.08 -0.23 3.58 1.04 0.28 -0.82 113.70 115.60 3fgq s SER 252 Ca 0.28 -0.56 -0.09 0.00 0.48 0.00 0.00 55.95 56.05 3fgq s SER 252 Cb -0.12 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 3fgq s SER 252 CO 0.19 -0.69 0.11 -0.32 0.98 0.00 0.00 173.24 173.51 3fgq s MET 253 N -3.54 3.93 -0.24 4.02 1.75 -0.41 -1.45 119.30 123.37 3fgq s MET 253 Ca 0.02 -0.35 -0.06 0.00 -1.25 0.00 0.00 55.69 54.05 3fgq s MET 253 Cb 0.03 -3.39 -0.02 0.00 2.84 0.00 0.00 34.83 34.29 3fgq s MET 253 CO -0.09 0.06 0.04 1.41 -0.65 0.00 0.00 175.02 175.79 3fgq s MET 254 N 1.00 3.60 -0.10 4.11 0.00 0.86 -0.08 119.30 128.69 3fgq s MET 254 Ca 0.06 -0.51 -0.02 0.00 0.00 0.00 0.00 55.69 55.21 3fgq s MET 254 Cb -0.14 -3.23 -0.03 0.00 0.00 0.00 0.00 34.83 31.43 3fgq s MET 254 CO 0.03 -0.16 0.00 -0.51 0.00 0.00 0.00 175.02 174.39 3fgq s LEU 255 N 1.50 3.55 -0.18 4.11 1.43 0.16 -0.48 118.68 128.78 3fgq s LEU 255 Ca 0.06 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 3fgq s LEU 255 Cb -0.15 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.27 3fgq s LEU 255 CO 0.02 0.34 -0.20 -0.69 0.23 0.00 0.00 176.35 176.05 3fgq s VAL 256 N -0.66 2.06 -0.16 -1.59 1.01 0.43 -1.02 120.40 120.47 3fgq s VAL 256 Ca 0.11 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 3fgq s VAL 256 Cb -0.12 -1.85 0.04 0.00 0.00 0.00 0.00 36.38 34.45 3fgq s VAL 256 CO 0.02 0.54 -0.03 -0.22 0.00 0.00 0.00 175.10 175.42 3fgq s LEU 257 N 1.24 1.41 0.92 3.92 2.96 -0.05 -2.26 118.68 126.82 3fgq s LEU 257 Ca 0.04 -0.63 -0.12 0.00 -0.22 0.00 0.00 54.13 53.20 3fgq s LEU 257 Cb -0.13 -0.79 0.14 0.00 0.50 0.00 0.00 46.19 45.91 3fgq s LEU 257 CO -0.12 -0.21 1.09 -0.94 -1.32 0.00 0.00 176.35 174.85 3fgq s SER 258 N 1.72 3.28 0.78 3.68 1.04 -1.26 -1.29 113.70 121.66 3fgq s SER 258 Ca 0.01 1.42 -0.13 0.00 0.48 0.00 0.00 55.95 57.72 3fgq s SER 258 Cb -0.15 -2.09 0.07 0.00 0.10 0.00 0.00 66.02 63.94 3fgq s SER 258 CO -0.07 -2.75 1.16 -0.60 0.98 0.00 0.00 173.24 171.96 3fgq s ARG 259 N -4.94 1.89 0.49 4.02 3.52 -1.26 -4.84 118.95 117.83 3fgq s ARG 259 Ca 0.64 1.58 0.16 0.00 -0.13 0.00 0.00 55.73 57.98 3fgq s ARG 259 Cb -0.18 -1.82 1.19 0.00 -1.56 0.00 0.00 34.95 32.58 3fgq s ARG 259 CO 0.57 -1.99 2.08 1.96 -0.81 0.00 0.00 175.30 177.12 3fgq h GLN 260 N -0.85 0.14 -0.01 5.12 4.20 -1.96 -1.36 115.11 120.40 3fgq h GLN 260 Ca -0.46 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.25 3fgq h GLN 260 Cb 1.27 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.02 3fgq h GLN 260 CO 0.48 0.09 -0.19 -0.85 -0.67 0.00 0.00 178.83 177.69 3fgq n GLU 261 N -4.49 1.05 -4.10 1.46 0.00 -1.26 -4.88 120.64 108.42 3fgq n GLU 261 Ca 0.02 -0.62 -0.35 0.00 0.00 0.00 0.00 57.16 56.21 3fgq n GLU 261 Cb 0.22 -1.49 -0.08 0.00 0.00 0.00 0.00 31.44 30.09 3fgq n GLU 261 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3fgq s VAL 262 N -2.38 4.85 0.56 3.84 1.01 -0.51 -5.11 120.40 122.66 3fgq s VAL 262 Ca 0.28 -0.03 -0.19 0.00 0.00 0.00 0.00 61.98 62.04 3fgq s VAL 262 Cb 0.20 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 3fgq s VAL 262 CO 0.47 0.57 1.12 -2.84 0.00 0.00 0.00 175.10 174.43 3fgq s PRO 263 N -0.58 3.28 0.34 2.72 0.02 -1.26 -4.62 135.00 134.90 3fgq s PRO 263 Ca 0.11 1.57 0.02 0.00 0.02 0.00 0.00 61.00 62.72 3fgq s PRO 263 Cb -0.12 -2.00 0.62 0.00 0.02 0.00 0.00 34.50 33.02 3fgq s PRO 263 CO 0.02 -0.90 1.98 1.25 -0.33 0.00 0.00 177.00 179.02 3fgq h LEU 264 N 1.02 0.77 -2.11 -5.54 5.85 -1.95 -2.70 115.31 110.65 3fgq h LEU 264 Ca -0.49 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.28 3fgq h LEU 264 Cb 1.26 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 3fgq h LEU 264 CO 0.56 0.54 0.32 0.00 -0.34 0.00 0.00 178.44 179.52 3fgq h ALA 265 N 1.57 1.79 0.00 1.25 0.00 -1.97 0.18 119.26 122.07 3fgq h ALA 265 Ca 0.28 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 3fgq h ALA 265 Cb 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3fgq h ALA 265 CO -0.08 -0.43 -0.47 1.79 0.00 0.00 0.00 179.25 180.06 3fgq h THR 266 N 0.00 1.06 0.02 0.00 1.35 -1.87 -3.24 112.91 110.23 3fgq h THR 266 Ca 0.11 -1.79 -0.29 0.00 -0.55 0.00 0.00 66.41 63.89 3fgq h THR 266 Cb 0.74 2.05 -0.04 0.00 -1.73 0.00 0.00 68.15 69.17 3fgq h THR 266 CO -0.00 0.46 -1.68 -0.07 -0.25 0.00 0.00 175.52 173.98 3fgq h LEU 267 N 0.00 0.05 -0.85 3.87 3.38 -0.82 -3.40 115.31 117.54 3fgq h LEU 267 Ca -0.00 -0.11 0.12 0.00 0.09 0.00 0.00 57.88 57.97 3fgq h LEU 267 Cb 1.01 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.66 3fgq h LEU 267 CO 0.06 1.10 0.47 -0.33 0.09 0.00 0.00 178.44 179.83 3fgq h GLU 268 N 0.01 0.72 0.00 1.13 5.08 -1.43 -0.11 114.58 119.98 3fgq h GLU 268 Ca -0.28 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3fgq h GLU 268 Cb 2.00 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 31.09 3fgq h GLU 268 CO 0.09 0.48 0.00 -1.35 -1.00 0.00 0.00 179.01 177.22 3fgq h PRO 269 N 0.74 0.00 0.00 2.33 0.11 -1.78 0.18 132.00 133.57 3fgq h PRO 269 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 3fgq h PRO 269 Cb 0.49 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.60 3fgq h PRO 269 CO -0.29 0.00 -0.07 1.28 -0.21 0.00 0.00 178.00 178.71 3fgq n LEU 270 N -2.32 0.12 -4.64 2.35 4.32 -0.05 -4.83 117.00 111.95 3fgq n LEU 270 Ca -0.01 0.44 -0.43 0.00 -0.02 0.00 0.00 56.01 55.99 3fgq n LEU 270 Cb 0.08 -0.45 -0.02 0.00 -1.62 0.00 0.00 43.42 41.40 3fgq n LEU 270 CO 0.12 0.00 1.32 -0.69 -1.22 0.00 0.00 177.39 176.93 3fgq s VAL 271 N -3.01 3.77 0.06 4.08 1.01 0.05 -4.79 120.40 121.58 3fgq s VAL 271 Ca 0.13 0.89 -0.26 0.00 0.00 0.00 0.00 61.98 62.74 3fgq s VAL 271 Cb 0.18 -3.74 0.07 0.00 0.00 0.00 0.00 36.38 32.89 3fgq s VAL 271 CO 0.56 -0.27 0.62 -0.54 0.00 0.00 0.00 175.10 175.47 3fgq s LYS 272 N 4.44 1.15 0.41 2.72 1.02 -1.26 -5.01 119.74 123.21 3fgq s LYS 272 Ca 0.69 -0.15 0.15 0.00 0.02 0.00 0.00 55.97 56.67 3fgq s LYS 272 Cb -0.25 0.53 1.01 0.00 -0.52 0.00 0.00 37.83 38.61 3fgq s LYS 272 CO 0.27 -0.44 1.89 0.00 -0.92 0.00 0.00 175.35 176.15 3fgq h ALA 273 N 2.52 2.08 -0.21 5.17 0.00 -1.92 -0.18 119.26 126.72 3fgq h ALA 273 Ca -0.31 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 3fgq h ALA 273 Cb 1.23 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 3fgq h ALA 273 CO 0.39 -0.32 -0.22 0.37 0.00 0.00 0.00 179.25 179.47 3fgq h GLN 274 N 0.47 0.52 -0.05 0.00 4.15 -1.96 -1.97 115.11 116.27 3fgq h GLN 274 Ca 0.42 -0.28 0.03 0.00 0.77 0.00 0.00 58.65 59.59 3fgq h GLN 274 Cb 0.92 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.59 3fgq h GLN 274 CO -0.16 0.86 -0.13 1.25 -1.93 0.00 0.00 178.83 178.72 3fgq h LEU 275 N 0.20 -0.40 -0.80 -2.39 5.85 -1.38 -0.33 115.31 116.06 3fgq h LEU 275 Ca 0.03 0.07 0.15 0.00 0.84 0.00 0.00 57.88 58.97 3fgq h LEU 275 Cb 0.77 0.18 -0.10 0.00 0.37 0.00 0.00 40.66 41.89 3fgq h LEU 275 CO 0.05 -0.18 0.36 0.58 -0.34 0.00 0.00 178.44 178.92 3fgq h VAL 276 N -0.20 0.67 -0.40 1.05 2.07 -1.16 0.31 116.25 118.60 3fgq h VAL 276 Ca 0.06 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.44 3fgq h VAL 276 Cb 0.29 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3fgq h VAL 276 CO -0.17 0.09 0.18 -0.08 0.02 0.00 0.00 177.57 177.62 3fgq h GLU 277 N 0.51 0.37 -0.05 1.57 4.57 -0.89 -0.33 114.58 120.33 3fgq h GLU 277 Ca 0.44 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.60 3fgq h GLU 277 Cb 0.67 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 3fgq h GLU 277 CO -0.39 0.24 0.03 1.49 -1.18 0.00 0.00 179.01 179.20 3fgq h GLU 278 N 0.38 0.06 -0.24 1.92 4.81 0.12 -0.44 114.58 121.19 3fgq h GLU 278 Ca 0.17 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.46 3fgq h GLU 278 Cb 0.10 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.39 3fgq h GLU 278 CO -0.13 0.09 -0.32 -1.49 -0.73 0.00 0.00 179.01 176.42 3fgq h TRP 279 N 0.02 -0.90 -0.92 0.92 6.55 -0.47 0.40 115.95 121.55 3fgq h TRP 279 Ca 0.02 0.05 0.13 0.00 0.95 0.00 0.00 58.89 60.03 3fgq h TRP 279 Cb 0.04 0.43 -0.09 0.00 -0.86 0.00 0.00 29.16 28.68 3fgq h TRP 279 CO -0.06 -0.39 0.54 0.00 -1.05 0.00 0.00 178.44 177.48 3fgq h ALA 280 N 0.56 1.39 0.00 1.49 0.00 -0.56 -0.97 119.26 121.17 3fgq h ALA 280 Ca 0.13 0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.86 3fgq h ALA 280 Cb 0.54 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3fgq h ALA 280 CO -0.43 0.07 -1.12 -0.91 0.00 0.00 0.00 179.25 176.86 3fgq h ASN 281 N 0.82 0.00 0.48 0.00 2.35 0.01 -3.38 115.58 115.86 3fgq h ASN 281 Ca 0.48 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.93 3fgq h ASN 281 Cb 0.56 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.89 3fgq h ASN 281 CO -0.30 0.98 -1.66 0.28 -1.65 0.00 0.00 177.43 175.08 3fgq h SER 282 N 0.00 0.12 -3.41 5.81 0.02 0.58 -3.47 113.55 113.20 3fgq h SER 282 Ca -0.06 -0.22 -0.57 0.00 -0.84 0.00 0.00 61.79 60.09 3fgq h SER 282 Cb 1.80 -0.04 0.15 0.00 0.14 0.00 0.00 62.40 64.46 3fgq h SER 282 CO 0.12 1.20 0.11 1.33 -1.14 0.00 0.00 176.83 178.45 3fgq n VAL 283 N -3.20 3.22 -4.59 2.27 0.24 -0.45 -4.84 118.33 110.99 3fgq n VAL 283 Ca -0.17 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.34 61.40 3fgq n VAL 283 Cb 1.04 -1.14 -0.14 0.00 -1.47 0.00 0.00 33.84 32.13 3fgq n VAL 283 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3fgq s LYS 284 N -2.50 1.20 -0.04 7.34 -0.14 -0.44 -4.76 119.74 120.41 3fgq s LYS 284 Ca 0.71 -0.75 -0.30 0.00 -1.36 0.00 0.00 55.97 54.28 3fgq s LYS 284 Cb -0.45 -1.23 -0.03 0.00 -1.68 0.00 0.00 37.83 34.44 3fgq s LYS 284 CO 0.51 0.32 1.03 0.21 -0.76 0.00 0.00 175.35 176.66 3fgq s LYS 285 N -0.88 4.48 -0.00 1.68 2.20 -1.26 -0.75 119.74 125.21 3fgq s LYS 285 Ca 0.05 1.47 -0.30 0.00 -0.36 0.00 0.00 55.97 56.83 3fgq s LYS 285 Cb -0.08 -3.49 0.10 0.00 -1.51 0.00 0.00 37.83 32.86 3fgq s LYS 285 CO 0.01 -0.20 1.10 1.14 -0.36 0.00 0.00 175.35 177.03 3fgq s GLN 286 N 1.49 0.69 0.15 4.03 -2.07 -0.15 -4.97 119.66 118.82 3fgq s GLN 286 Ca 0.52 -0.34 -0.31 0.00 -1.82 0.00 0.00 55.36 53.41 3fgq s GLN 286 Cb -0.21 0.26 -0.08 0.00 -1.09 0.00 0.00 33.01 31.89 3fgq s GLN 286 CO 0.24 -0.31 1.37 0.15 -1.32 0.00 0.00 175.29 175.42 3fgq s LYS 287 N -2.81 4.34 0.02 9.60 1.02 -1.26 -1.57 119.74 129.09 3fgq s LYS 287 Ca 0.11 2.08 0.02 0.00 0.02 0.00 0.00 55.97 58.20 3fgq s LYS 287 Cb 0.01 -3.22 -0.01 0.00 -0.52 0.00 0.00 37.83 34.08 3fgq s LYS 287 CO -0.03 -0.38 -0.08 0.08 -0.92 0.00 0.00 175.35 174.02 3fgq s VAL 288 N 0.74 0.60 -0.23 3.17 1.01 -0.25 -3.96 120.40 121.49 3fgq s VAL 288 Ca 0.62 -0.67 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 3fgq s VAL 288 Cb -0.37 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 3fgq s VAL 288 CO 0.33 -0.07 0.45 -1.61 0.00 0.00 0.00 175.10 174.21 3fgq s GLU 289 N -0.82 4.13 -0.11 2.72 2.02 0.03 -2.08 118.70 124.60 3fgq s GLU 289 Ca -0.02 0.26 0.03 0.00 0.02 0.00 0.00 54.97 55.26 3fgq s GLU 289 Cb -0.06 -3.59 0.01 0.00 0.10 0.00 0.00 34.13 30.59 3fgq s GLU 289 CO 0.00 -0.18 -0.19 0.08 0.02 0.00 0.00 175.26 174.99 3fgq s VAL 290 N 1.76 1.77 -0.25 2.63 1.01 0.55 -0.67 120.40 127.20 3fgq s VAL 290 Ca 0.20 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 3fgq s VAL 290 Cb -0.15 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.67 3fgq s VAL 290 CO 0.09 0.49 -0.03 -0.31 0.00 0.00 0.00 175.10 175.34 3fgq s TYR 291 N 0.71 3.05 -0.04 5.22 2.02 -0.25 -1.26 117.35 126.80 3fgq s TYR 291 Ca -0.11 -1.30 0.01 0.00 -0.37 0.00 0.00 57.07 55.29 3fgq s TYR 291 Cb -0.16 -2.11 0.02 0.00 -0.40 0.00 0.00 41.96 39.31 3fgq s TYR 291 CO 0.02 -0.66 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.14 3fgq s LEU 292 N 1.39 1.30 0.51 -1.29 2.96 -0.16 -0.66 118.68 122.74 3fgq s LEU 292 Ca 0.02 -0.09 -0.22 0.00 -0.22 0.00 0.00 54.13 53.62 3fgq s LEU 292 Cb -0.16 -0.37 -0.06 0.00 0.50 0.00 0.00 46.19 46.10 3fgq s LEU 292 CO -0.03 -0.06 1.24 -2.84 -1.32 0.00 0.00 176.35 173.34 3fgq s PRO 293 N 0.91 3.42 -0.13 0.98 0.02 -1.26 -0.07 135.00 138.87 3fgq s PRO 293 Ca -0.11 1.95 -0.29 0.00 0.02 0.00 0.00 61.00 62.56 3fgq s PRO 293 Cb -0.14 -2.28 -0.01 0.00 0.02 0.00 0.00 34.50 32.08 3fgq s PRO 293 CO -0.00 -0.88 1.11 0.50 -0.33 0.00 0.00 177.00 177.40 3fgq s ARG 294 N -2.87 4.33 0.16 5.54 3.52 -0.40 -4.76 118.95 124.47 3fgq s ARG 294 Ca 0.68 1.50 -0.21 0.00 -0.13 0.00 0.00 55.73 57.58 3fgq s ARG 294 Cb -0.33 -3.61 0.06 0.00 -1.56 0.00 0.00 34.95 29.51 3fgq s ARG 294 CO 0.39 -0.49 0.55 -0.59 -0.81 0.00 0.00 175.30 174.35 3fgq s PHE 295 N 2.60 -0.41 0.11 5.12 -0.12 -0.79 -4.65 117.98 119.84 3fgq s PHE 295 Ca 0.50 0.15 0.09 0.00 -0.05 0.00 0.00 56.93 57.62 3fgq s PHE 295 Cb -0.20 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 3fgq s PHE 295 CO 0.15 -0.84 -0.22 0.95 -0.05 0.00 0.00 175.22 175.21 3fgq s THR 296 N -3.78 1.83 0.02 -4.49 -4.23 -1.26 -0.86 115.64 102.87 3fgq s THR 296 Ca 0.03 -1.59 0.02 0.00 -1.18 0.00 0.00 61.69 58.97 3fgq s THR 296 Cb -0.01 -1.65 -0.02 0.00 1.34 0.00 0.00 72.50 72.17 3fgq s THR 296 CO -0.11 -0.02 -0.07 0.54 -0.54 0.00 0.00 174.62 174.41 3fgq s VAL 297 N -1.13 0.55 0.09 2.29 0.11 0.35 -4.94 120.40 117.72 3fgq s VAL 297 Ca 0.08 -0.73 -0.10 0.00 -2.93 0.00 0.00 61.98 58.30 3fgq s VAL 297 Cb -0.10 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 3fgq s VAL 297 CO 0.05 -0.14 0.22 -1.83 -3.33 0.00 0.00 175.10 170.07 3fgq s GLU 298 N -0.95 0.86 -0.26 1.54 -1.05 -1.26 0.39 118.70 117.97 3fgq s GLU 298 Ca -0.04 -0.87 -0.17 0.00 -0.15 0.00 0.00 54.97 53.74 3fgq s GLU 298 Cb -0.07 0.35 0.07 0.00 -0.44 0.00 0.00 34.13 34.05 3fgq s GLU 298 CO 0.00 -0.28 0.65 -1.14 0.95 0.00 0.00 175.26 175.44 3fgq s GLN 299 N -3.66 0.69 -0.19 -4.83 0.74 -0.86 -4.70 119.66 106.84 3fgq s GLN 299 Ca 0.03 1.08 -0.08 0.00 0.05 0.00 0.00 55.36 56.44 3fgq s GLN 299 Cb 0.04 0.19 -0.04 0.00 1.10 0.00 0.00 33.01 34.30 3fgq s GLN 299 CO -0.10 -0.13 0.07 -2.00 -0.55 0.00 0.00 175.29 172.58 3fgq s GLU 300 N 1.20 3.95 0.02 1.67 2.12 -1.26 -1.48 118.70 124.92 3fgq s GLU 300 Ca -0.07 -0.35 0.09 0.00 0.36 0.00 0.00 54.97 55.00 3fgq s GLU 300 Cb -0.05 -3.25 -0.03 0.00 0.26 0.00 0.00 34.13 31.06 3fgq s GLU 300 CO -0.13 0.21 -0.26 -1.50 -0.54 0.00 0.00 175.26 173.04 3fgq s ILE 301 N 0.56 2.08 -0.69 -3.70 2.07 0.14 -5.00 121.20 116.66 3fgq s ILE 301 Ca 0.04 -1.28 -0.22 0.00 -1.41 0.00 0.00 60.65 57.78 3fgq s ILE 301 Cb -0.13 -1.76 0.07 0.00 0.13 0.00 0.00 42.46 40.78 3fgq s ILE 301 CO 0.01 0.43 0.99 -0.62 -1.91 0.00 0.00 174.94 173.84 3fgq s ASP 302 N -1.01 6.22 0.45 4.50 3.68 -1.26 -1.23 116.67 128.01 3fgq s ASP 302 Ca 0.11 -1.08 0.18 0.00 2.13 0.00 0.00 52.55 53.89 3fgq s ASP 302 Cb -0.10 -2.42 1.05 0.00 -1.45 0.00 0.00 42.92 40.00 3fgq s ASP 302 CO 0.01 -1.42 1.96 -0.07 0.13 0.00 0.00 175.17 175.79 3fgq h LEU 303 N 11.31 0.00 -0.08 -1.34 3.38 -1.03 -1.98 115.31 125.57 3fgq h LEU 303 Ca -0.24 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3fgq h LEU 303 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 3fgq h LEU 303 CO 1.18 0.22 0.04 0.50 0.09 0.00 0.00 178.44 180.47 3fgq h LYS 304 N 0.00 0.12 0.08 1.13 3.64 -1.89 0.11 116.57 119.77 3fgq h LYS 304 Ca -0.00 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.38 3fgq h LYS 304 Cb 0.44 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 3fgq h LYS 304 CO 0.03 0.23 -0.23 -0.44 -2.27 0.00 0.00 179.45 176.77 3fgq h ASP 305 N -0.01 -0.66 -0.57 4.20 3.45 -1.71 -1.27 116.42 119.85 3fgq h ASP 305 Ca 0.03 0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.60 3fgq h ASP 305 Cb 0.15 0.26 -0.04 0.00 -0.56 0.00 0.00 39.33 39.14 3fgq h ASP 305 CO -0.00 -0.31 0.34 0.58 -1.57 0.00 0.00 179.24 178.27 3fgq h VAL 306 N -0.41 1.05 -0.30 -1.35 2.07 -1.16 -2.96 116.25 113.19 3fgq h VAL 306 Ca 0.04 -0.23 -0.17 0.00 0.82 0.00 0.00 66.70 67.16 3fgq h VAL 306 Cb 0.45 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 3fgq h VAL 306 CO -0.15 0.12 -0.48 -0.07 0.02 0.00 0.00 177.57 177.01 3fgq h LEU 307 N 0.66 0.89 -0.81 2.57 3.38 -0.62 -3.05 115.31 118.34 3fgq h LEU 307 Ca 0.23 -0.45 0.15 0.00 0.09 0.00 0.00 57.88 57.91 3fgq h LEU 307 Cb 0.04 -0.25 -0.10 0.00 0.09 0.00 0.00 40.66 40.44 3fgq h LEU 307 CO -0.11 1.22 0.37 0.11 0.09 0.00 0.00 178.44 180.12 3fgq h LYS 308 N 0.64 0.51 0.00 1.13 1.57 -1.06 0.37 116.57 119.72 3fgq h LYS 308 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fgq h LYS 308 Cb 1.06 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.26 3fgq h LYS 308 CO 0.11 0.34 0.00 0.00 -0.57 0.00 0.00 179.45 179.32 3fgq h ALA 309 N 1.57 1.00 -0.48 3.86 0.00 -1.45 -2.38 119.26 121.37 3fgq h ALA 309 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3fgq h ALA 309 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3fgq h ALA 309 CO -0.40 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.13 3fgq n LEU 310 N -2.87 5.08 0.00 0.00 4.77 0.13 -4.95 117.00 119.16 3fgq n LEU 310 Ca -0.01 -2.92 0.00 0.00 -0.03 0.00 0.00 56.01 53.05 3fgq n LEU 310 Cb 0.18 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 3fgq n LEU 310 CO 0.21 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 3fgq n GLY 311 N 0.30 3.13 3.56 -0.72 0.00 -0.90 -4.68 105.19 105.88 3fgq n GLY 311 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 3fgq n GLY 311 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fgq s ILE 312 N -3.00 3.70 0.00 -0.61 1.01 -0.96 -4.69 121.20 116.66 3fgq s ILE 312 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 60.65 61.13 3fgq s ILE 312 Cb 0.00 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.83 3fgq s ILE 312 CO 0.00 -1.51 0.00 0.35 0.00 0.00 0.00 174.94 173.78 3fgq n THR 313 N 6.65 0.00 0.07 2.92 -2.24 -1.26 -2.96 114.28 117.45 3fgq n THR 313 Ca 0.08 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.84 3fgq n THR 313 Cb 0.50 -0.09 0.22 0.00 -2.10 0.00 0.00 70.33 68.85 3fgq n THR 313 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3fgq h GLU 314 N 0.00 0.33 0.00 -0.78 4.81 -1.93 -2.04 114.58 114.98 3fgq h GLU 314 Ca 0.00 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 3fgq h GLU 314 Cb 0.12 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 3fgq h GLU 314 CO 0.00 0.65 -0.02 0.97 -0.73 0.00 0.00 179.01 179.88 3fgq h ILE 315 N 0.29 0.17 -0.31 2.32 2.10 -1.88 -2.70 117.51 117.50 3fgq h ILE 315 Ca 0.03 -0.20 0.00 0.00 1.08 0.00 0.00 64.86 65.77 3fgq h ILE 315 Cb 0.76 1.16 0.00 0.00 -1.09 0.00 0.00 36.82 37.66 3fgq h ILE 315 CO 0.06 0.02 0.00 0.49 -1.08 0.00 0.00 178.15 177.64 3fgq n PHE 316 N -3.28 0.40 -4.45 2.19 3.01 -0.77 -1.09 117.46 113.47 3fgq n PHE 316 Ca -0.02 -0.20 -0.22 0.00 1.01 0.00 0.00 57.45 58.02 3fgq n PHE 316 Cb 0.15 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.52 3fgq n PHE 316 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 3fgq s ILE 317 N -1.60 0.85 -0.60 4.37 -4.36 -1.03 -4.72 121.20 114.12 3fgq s ILE 317 Ca 0.35 -2.00 0.18 0.00 -0.26 0.00 0.00 60.65 58.92 3fgq s ILE 317 Cb 0.20 -2.61 0.18 0.00 1.25 0.00 0.00 42.46 41.48 3fgq s ILE 317 CO 0.28 0.00 1.54 0.29 0.24 0.00 0.00 174.94 177.30 3fgq n LYS 318 N -0.72 0.11 -0.00 0.37 4.01 -1.26 -1.11 118.16 119.55 3fgq n LYS 318 Ca -0.03 0.45 0.16 0.00 -0.51 0.00 0.00 58.31 58.37 3fgq n LYS 318 Cb 0.66 -1.76 0.88 0.00 -0.51 0.00 0.00 35.03 34.30 3fgq n LYS 318 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 3fgq n ASP 319 N -1.98 0.20 -4.65 4.39 10.43 -1.26 -4.90 116.55 118.78 3fgq n ASP 319 Ca 0.01 -1.08 -0.49 0.00 2.57 0.00 0.00 54.79 55.81 3fgq n ASP 319 Cb 0.14 -0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.05 3fgq n ASP 319 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3fgq n ALA 320 N -0.84 0.51 -3.03 2.24 0.00 -0.27 -4.94 120.51 114.17 3fgq n ALA 320 Ca 0.23 0.45 -0.45 0.00 0.00 0.00 0.00 53.44 53.67 3fgq n ALA 320 Cb 0.14 -2.27 -0.06 0.00 0.00 0.00 0.00 19.45 17.26 3fgq n ALA 320 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3fgq s ASN 321 N 1.17 6.18 -0.25 0.00 3.84 -1.26 -4.90 114.94 119.72 3fgq s ASN 321 Ca 0.83 -1.42 0.09 0.00 0.21 0.00 0.00 52.86 52.56 3fgq s ASN 321 Cb -0.79 -2.23 0.44 0.00 -0.55 0.00 0.00 41.25 38.12 3fgq s ASN 321 CO 0.43 -0.84 1.22 0.18 -2.79 0.00 0.00 177.10 175.30 3fgq n LEU 322 N 5.58 3.79 0.17 3.21 4.77 -1.26 -1.01 117.00 132.24 3fgq n LEU 322 Ca -0.11 -4.29 0.13 0.00 -0.03 0.00 0.00 56.01 51.71 3fgq n LEU 322 Cb 0.43 -0.45 0.54 0.00 -2.33 0.00 0.00 43.42 41.60 3fgq n LEU 322 CO 0.52 1.72 0.89 0.71 -1.33 0.00 0.00 177.39 179.91 3fgq h THR 323 N 1.53 0.00 0.00 -5.08 1.35 -1.65 -0.21 112.91 108.85 3fgq h THR 323 Ca 0.18 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.72 3fgq h THR 323 Cb 1.26 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 68.80 3fgq h THR 323 CO 0.37 0.00 -0.04 1.23 -0.25 0.00 0.00 175.52 176.83 3fgq h GLY 324 N 2.29 0.00 0.00 5.82 0.00 -1.37 -3.31 103.07 106.51 3fgq h GLY 324 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3fgq h GLY 324 CO 0.00 0.00 -1.31 1.47 0.00 0.00 0.00 176.54 176.70 3fgq n LEU 325 N -4.06 0.00 -3.66 3.11 -0.00 -0.17 -4.57 117.00 107.65 3fgq n LEU 325 Ca -0.03 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.84 3fgq n LEU 325 Cb 0.12 0.03 -0.08 0.00 -0.00 0.00 0.00 43.42 43.49 3fgq n LEU 325 CO 0.31 0.03 0.31 -0.55 -0.00 0.00 0.00 177.39 177.49 3fgq s SER 326 N -2.91 -0.64 0.00 1.45 0.15 -0.74 -0.07 113.70 110.94 3fgq s SER 326 Ca -0.02 1.21 0.26 0.00 0.70 0.00 0.00 55.95 58.10 3fgq s SER 326 Cb 0.04 1.23 1.35 0.00 -1.71 0.00 0.00 66.02 66.92 3fgq s SER 326 CO 0.26 -0.24 1.89 -0.90 1.20 0.00 0.00 173.24 175.45 3fgq n ASP 327 N 2.64 0.54 -4.66 5.45 3.85 -1.26 -3.76 116.55 119.34 3fgq n ASP 327 Ca -0.14 -1.32 -0.43 0.00 -0.71 0.00 0.00 54.79 52.19 3fgq n ASP 327 Cb 0.56 -0.02 -0.02 0.00 -1.35 0.00 0.00 41.12 40.29 3fgq n ASP 327 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 3fgq s ASN 328 N -1.82 6.99 0.29 -1.12 3.84 -1.26 -4.91 114.94 116.94 3fgq s ASN 328 Ca 0.38 1.66 0.25 0.00 0.21 0.00 0.00 52.86 55.36 3fgq s ASN 328 Cb 0.19 -2.54 0.71 0.00 -0.55 0.00 0.00 41.25 39.05 3fgq s ASN 328 CO 0.30 -0.71 1.73 0.50 -2.79 0.00 0.00 177.10 176.13 3fgq h LYS 329 N 7.95 0.00 0.00 0.43 3.64 -1.98 -3.15 116.57 123.47 3fgq h LYS 329 Ca -0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3fgq h LYS 329 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 3fgq h LYS 329 CO 0.96 0.00 0.00 0.93 -2.27 0.00 0.00 179.45 179.07 3fgq h GLU 330 N 0.00 0.00 -6.44 1.90 4.39 -1.92 -3.48 114.58 109.04 3fgq h GLU 330 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 3fgq h GLU 330 Cb 0.78 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.40 3fgq h GLU 330 CO 0.00 0.00 0.22 -1.50 -1.16 0.00 0.00 179.01 176.57 3fgq s ILE 331 N -3.30 4.55 0.20 3.13 2.07 -1.19 -4.92 121.20 121.74 3fgq s ILE 331 Ca 0.06 1.78 -0.08 0.00 -1.41 0.00 0.00 60.65 61.01 3fgq s ILE 331 Cb 0.09 -4.18 -0.02 0.00 0.13 0.00 0.00 42.46 38.48 3fgq s ILE 331 CO 0.56 0.40 0.30 0.72 -1.91 0.00 0.00 174.94 175.00 3fgq s PHE 332 N -0.35 0.63 -0.57 3.50 -0.71 -1.26 -4.67 117.98 114.55 3fgq s PHE 332 Ca 0.40 -0.95 -0.24 0.00 -1.04 0.00 0.00 56.93 55.10 3fgq s PHE 332 Cb -0.22 -0.14 0.05 0.00 -1.21 0.00 0.00 43.02 41.50 3fgq s PHE 332 CO 0.26 -0.78 0.94 -1.17 -1.34 0.00 0.00 175.22 173.13 3fgq s LEU 333 N -3.05 4.14 0.23 -1.99 0.20 -0.25 -4.03 118.68 113.93 3fgq s LEU 333 Ca 0.26 -0.45 0.06 0.00 0.69 0.00 0.00 54.13 54.69 3fgq s LEU 333 Cb 0.03 -2.76 0.21 0.00 -0.43 0.00 0.00 46.19 43.24 3fgq s LEU 333 CO 0.07 -1.26 1.52 0.28 -0.29 0.00 0.00 176.35 176.67 3fgq h SER 334 N 9.35 0.16 -3.41 3.68 0.02 -1.56 -3.39 113.55 118.40 3fgq h SER 334 Ca -0.27 -0.10 -0.12 0.00 -0.84 0.00 0.00 61.79 60.46 3fgq h SER 334 Cb 1.07 -0.05 -0.26 0.00 0.14 0.00 0.00 62.40 63.31 3fgq h SER 334 CO 1.10 0.80 -0.28 -0.75 -1.14 0.00 0.00 176.83 176.56 3fgq s LYS 335 N -3.53 0.42 -0.19 3.45 2.47 -1.21 -5.05 119.74 116.10 3fgq s LYS 335 Ca -0.03 0.73 -0.04 0.00 -1.56 0.00 0.00 55.97 55.07 3fgq s LYS 335 Cb 0.12 0.05 0.06 0.00 -1.46 0.00 0.00 37.83 36.60 3fgq s LYS 335 CO 0.79 -0.13 0.08 0.00 0.16 0.00 0.00 175.35 176.25 3fgq s ALA 336 N 1.07 0.63 -0.07 3.13 0.00 -1.26 -1.03 121.76 124.23 3fgq s ALA 336 Ca -0.07 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.43 3fgq s ALA 336 Cb -0.07 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.92 3fgq s ALA 336 CO -0.09 -1.22 -0.20 0.42 0.00 0.00 0.00 175.76 174.67 3fgq s ILE 337 N 2.04 2.48 -0.06 0.00 -1.09 -0.34 -0.32 121.20 123.92 3fgq s ILE 337 Ca 0.02 -0.91 0.04 0.00 -2.23 0.00 0.00 60.65 57.56 3fgq s ILE 337 Cb -0.16 -1.95 0.00 0.00 -1.58 0.00 0.00 42.46 38.77 3fgq s ILE 337 CO -0.11 0.57 -0.16 -2.28 -1.23 0.00 0.00 174.94 171.72 3fgq s HIS 338 N -0.19 1.71 -0.04 3.97 5.65 -0.36 -0.99 115.29 125.03 3fgq s HIS 338 Ca -0.02 -0.56 0.01 0.00 0.25 0.00 0.00 55.06 54.75 3fgq s HIS 338 Cb -0.13 -1.18 0.02 0.00 -1.18 0.00 0.00 32.58 30.11 3fgq s HIS 338 CO 0.03 -0.22 -0.04 0.21 -0.65 0.00 0.00 174.74 174.07 3fgq s LYS 339 N 0.25 0.76 0.09 2.88 2.20 -0.04 0.25 119.74 126.14 3fgq s LYS 339 Ca -0.09 -0.09 0.07 0.00 -0.36 0.00 0.00 55.97 55.51 3fgq s LYS 339 Cb -0.13 -0.78 -0.04 0.00 -1.51 0.00 0.00 37.83 35.37 3fgq s LYS 339 CO 0.03 -0.08 -0.14 -1.12 -0.36 0.00 0.00 175.35 173.69 3fgq s SER 340 N 0.87 4.15 -0.04 1.43 0.01 -0.55 -0.86 113.70 118.72 3fgq s SER 340 Ca -0.11 -0.44 -0.02 0.00 1.31 0.00 0.00 55.95 56.69 3fgq s SER 340 Cb -0.14 -0.72 0.03 0.00 0.21 0.00 0.00 66.02 65.40 3fgq s SER 340 CO 0.00 0.19 0.07 0.12 0.41 0.00 0.00 173.24 174.03 3fgq s PHE 341 N -1.14 0.01 -0.06 2.43 5.36 -0.05 -2.04 117.98 122.50 3fgq s PHE 341 Ca 0.19 0.28 0.05 0.00 -0.96 0.00 0.00 56.93 56.49 3fgq s PHE 341 Cb -0.11 -0.37 -0.01 0.00 -0.34 0.00 0.00 43.02 42.20 3fgq s PHE 341 CO 0.11 -0.17 -0.23 -1.17 -1.46 0.00 0.00 175.22 172.30 3fgq s LEU 342 N 1.83 2.03 -0.10 6.12 2.96 0.16 -1.39 118.68 130.28 3fgq s LEU 342 Ca 0.00 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.47 3fgq s LEU 342 Cb -0.12 -1.28 0.00 0.00 0.50 0.00 0.00 46.19 45.29 3fgq s LEU 342 CO -0.03 0.20 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.27 3fgq s GLU 343 N -0.01 2.94 -0.12 1.98 2.12 -0.82 -0.49 118.70 124.30 3fgq s GLU 343 Ca -0.06 -0.84 0.02 0.00 0.36 0.00 0.00 54.97 54.44 3fgq s GLU 343 Cb -0.14 -2.25 0.01 0.00 0.26 0.00 0.00 34.13 32.01 3fgq s GLU 343 CO 0.04 0.14 -0.18 0.08 -0.54 0.00 0.00 175.26 174.81 3fgq s VAL 344 N 0.43 1.70 0.00 3.70 1.01 -0.04 -4.45 120.40 122.75 3fgq s VAL 344 Ca -0.17 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.05 3fgq s VAL 344 Cb -0.17 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.68 3fgq s VAL 344 CO 0.07 0.48 0.00 -0.46 0.00 0.00 0.00 175.10 175.19 3fgq n ASN 345 N 4.15 0.00 0.20 3.32 2.04 -1.26 -1.89 115.26 121.82 3fgq n ASN 345 Ca -0.19 -0.37 0.07 0.00 -0.44 0.00 0.00 54.58 53.65 3fgq n ASN 345 Cb 0.51 0.00 0.41 0.00 -2.53 0.00 0.00 39.78 38.17 3fgq n ASN 345 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3fgq h GLU 346 N 0.00 0.00 -6.72 -3.83 3.07 -1.97 -3.46 114.58 101.67 3fgq h GLU 346 Ca 0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 3fgq h GLU 346 Cb 0.00 0.00 0.07 0.00 -0.84 0.00 0.00 28.75 27.98 3fgq h GLU 346 CO 0.00 0.31 0.94 0.39 -1.40 0.00 0.00 179.01 179.24 3fgq n GLU 347 N -3.52 2.71 -3.01 2.33 1.02 -1.26 -0.91 120.64 118.00 3fgq n GLU 347 Ca -0.00 0.97 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 3fgq n GLU 347 Cb 0.46 -2.78 0.00 0.00 -0.02 0.00 0.00 31.44 29.10 3fgq n GLU 347 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3fgq n GLY 348 N 3.03 -0.76 3.88 0.62 0.00 -1.26 -1.34 105.19 109.36 3fgq n GLY 348 Ca 0.12 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 3fgq n GLY 348 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fgq s SER 349 N -4.00 6.49 0.24 1.61 0.01 0.40 -4.54 113.70 113.91 3fgq s SER 349 Ca 0.00 1.00 -0.31 0.00 1.31 0.00 0.00 55.95 57.95 3fgq s SER 349 Cb 0.00 -2.27 -0.14 0.00 0.21 0.00 0.00 66.02 63.82 3fgq s SER 349 CO 0.00 -0.34 1.24 -0.62 0.41 0.00 0.00 173.24 173.93 3fgq n GLU 350 N -1.21 1.64 -2.41 12.44 -0.58 -1.26 -0.99 120.64 128.26 3fgq n GLU 350 Ca 0.01 0.58 -0.40 0.00 -0.42 0.00 0.00 57.16 56.93 3fgq n GLU 350 Cb 0.54 -2.12 -0.04 0.00 -0.57 0.00 0.00 31.44 29.25 3fgq n GLU 350 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3fgq s ALA 351 N -0.39 3.38 0.26 0.62 0.00 -1.26 -4.85 121.76 119.52 3fgq s ALA 351 Ca 0.67 0.95 -0.30 0.00 0.00 0.00 0.00 51.96 53.28 3fgq s ALA 351 Cb -0.72 -3.35 -0.10 0.00 0.00 0.00 0.00 23.12 18.95 3fgq s ALA 351 CO 0.54 -0.27 1.42 0.00 0.00 0.00 0.00 175.76 177.45 3fgq s ALA 352 N -1.21 3.61 0.03 0.00 0.00 -1.26 -5.13 121.76 117.80 3fgq s ALA 352 Ca 0.47 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.76 3fgq s ALA 352 Cb -0.32 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.21 3fgq s ALA 352 CO 0.42 -0.74 0.13 0.00 0.00 0.00 0.00 175.76 175.57 3fgq s ALA 353 N -0.20 3.75 -0.17 0.00 0.00 -1.26 -5.13 121.76 118.75 3fgq s ALA 353 Ca 0.58 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.65 3fgq s ALA 353 Cb -0.42 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.05 3fgq s ALA 353 CO 0.45 0.75 0.02 0.00 0.00 0.00 0.00 175.76 176.98 3fgq n ALA 359 N 0.74 0.12 0.53 0.00 0.00 -1.26 -5.31 120.51 115.33 3fgq n ALA 359 Ca -0.10 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.43 3fgq n ALA 359 Cb 0.52 -0.08 0.37 0.00 0.00 0.00 0.00 19.45 20.26 3fgq n ALA 359 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3fgq n ILE 360 N -0.31 0.87 0.25 0.00 3.06 -1.26 -2.15 119.36 119.81 3fgq n ILE 360 Ca 0.00 0.21 0.10 0.00 -2.50 0.00 0.00 62.75 60.56 3fgq n ILE 360 Cb 0.00 -0.97 0.66 0.00 0.54 0.00 0.00 39.64 39.87 3fgq n ILE 360 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 3fgq h SER 361 N 0.00 0.00 -0.12 9.51 4.64 -2.08 -1.34 113.55 124.15 3fgq h SER 361 Ca 0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 3fgq h SER 361 Cb 0.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3fgq h SER 361 CO 0.00 0.13 0.16 0.03 -0.87 0.00 0.00 176.83 176.29 3fgq h ARG 362 N 0.00 0.00 -0.16 4.77 2.47 -1.95 -1.58 114.38 117.93 3fgq h ARG 362 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3fgq h ARG 362 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 3fgq h ARG 362 CO 0.02 0.00 0.00 -1.33 0.56 0.00 0.00 179.97 179.22 3fgq n MET 363 N -3.66 1.76 -0.22 0.04 2.81 -0.51 -4.47 117.12 112.87 3fgq n MET 363 Ca 0.00 -1.14 0.10 0.00 -1.81 0.00 0.00 57.70 54.86 3fgq n MET 363 Cb 0.27 -1.41 0.39 0.00 -0.71 0.00 0.00 33.22 31.76 3fgq n MET 363 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3fgq h ALA 364 N 4.11 1.83 0.00 3.04 0.00 -1.42 0.24 119.26 127.07 3fgq h ALA 364 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fgq h ALA 364 Cb 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3fgq h ALA 364 CO 0.00 -0.02 0.00 -0.39 0.00 0.00 0.00 179.25 178.84 3fgq h VAL 365 N 0.67 0.00 -0.00 0.00 -1.51 -1.84 -1.10 116.25 112.47 3fgq h VAL 365 Ca 0.38 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 65.77 3fgq h VAL 365 Cb 0.56 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 30.41 3fgq h VAL 365 CO -0.15 0.00 -0.88 0.18 -1.23 0.00 0.00 177.57 175.49 3fgq n LEU 366 N -2.35 0.99 -4.71 4.19 4.77 0.86 -4.93 117.00 115.82 3fgq n LEU 366 Ca -0.01 -0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 55.12 3fgq n LEU 366 Cb 0.10 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3fgq n LEU 366 CO 0.14 0.24 1.43 -0.31 -1.33 0.00 0.00 177.39 177.55 3fgq s TYR 367 N -2.96 2.54 0.86 -1.77 4.12 -0.42 -4.97 117.35 114.75 3fgq s TYR 367 Ca 0.09 0.16 -0.11 0.00 0.02 0.00 0.00 57.07 57.23 3fgq s TYR 367 Cb 0.16 -4.17 0.11 0.00 -1.52 0.00 0.00 41.96 36.54 3fgq s TYR 367 CO 0.82 -4.63 1.10 -2.14 0.02 0.00 0.00 175.55 170.73 3fgq s PRO 368 N 1.90 1.52 -0.08 -1.71 0.02 -1.25 -4.75 135.00 130.64 3fgq s PRO 368 Ca 0.78 1.20 0.01 0.00 0.02 0.00 0.00 61.00 63.01 3fgq s PRO 368 Cb -0.48 -1.81 0.02 0.00 0.02 0.00 0.00 34.50 32.25 3fgq s PRO 368 CO 0.34 -2.17 -0.09 -0.65 -0.33 0.00 0.00 177.00 174.10 3fgq s GLN 369 N -4.81 1.52 -0.20 5.54 -0.21 -1.26 -0.79 119.66 119.46 3fgq s GLN 369 Ca 0.64 -0.31 0.01 0.00 0.02 0.00 0.00 55.36 55.72 3fgq s GLN 369 Cb -0.19 -1.41 0.04 0.00 1.00 0.00 0.00 33.01 32.45 3fgq s GLN 369 CO 0.57 -0.11 -0.11 0.08 -2.12 0.00 0.00 175.29 173.60 3fgq s VAL 370 N 1.13 1.72 -0.32 1.09 1.01 0.16 -4.97 120.40 120.23 3fgq s VAL 370 Ca -0.06 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 60.89 3fgq s VAL 370 Cb -0.14 -1.77 0.08 0.00 0.00 0.00 0.00 36.38 34.54 3fgq s VAL 370 CO -0.02 0.20 0.01 -0.51 0.00 0.00 0.00 175.10 174.79 3fgq s ILE 371 N 1.36 2.58 -1.34 2.22 2.07 -1.26 -1.10 121.20 125.74 3fgq s ILE 371 Ca -0.01 -1.85 -0.15 0.00 -1.41 0.00 0.00 60.65 57.22 3fgq s ILE 371 Cb -0.16 -2.66 0.08 0.00 0.13 0.00 0.00 42.46 39.85 3fgq s ILE 371 CO -0.08 -0.32 1.88 0.52 -1.91 0.00 0.00 174.94 175.03 3fgq n VAL 372 N 4.45 3.87 -1.38 4.00 0.31 0.17 -4.64 118.33 125.11 3fgq n VAL 372 Ca -0.07 -3.85 0.07 0.00 -0.01 0.00 0.00 64.34 60.48 3fgq n VAL 372 Cb 0.42 -2.46 0.19 0.00 -0.91 0.00 0.00 33.84 31.08 3fgq n VAL 372 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3fgq n ASP 373 N 6.71 2.08 -3.63 4.52 3.85 -1.26 -4.37 116.55 124.44 3fgq n ASP 373 Ca 0.47 -3.58 -0.08 0.00 -0.71 0.00 0.00 54.79 50.90 3fgq n ASP 373 Cb 0.42 -0.50 -0.01 0.00 -1.35 0.00 0.00 41.12 39.67 3fgq n ASP 373 CO 0.00 0.00 0.00 -1.38 -1.01 0.00 0.00 177.20 174.81 3fgq s HIS 374 N -3.10 -0.04 0.58 2.11 -3.43 -1.26 -0.95 115.29 109.20 3fgq s HIS 374 Ca 0.37 -0.46 -0.20 0.00 -0.80 0.00 0.00 55.06 53.97 3fgq s HIS 374 Cb 0.34 0.68 -0.05 0.00 -1.43 0.00 0.00 32.58 32.12 3fgq s HIS 374 CO -0.02 -1.30 1.12 -2.30 -2.00 0.00 0.00 174.74 170.24 3fgq n PRO 375 N -0.47 1.15 -3.79 -0.38 -0.02 -1.26 -4.99 135.00 125.23 3fgq n PRO 375 Ca -0.05 0.44 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 3fgq n PRO 375 Cb 0.60 -2.32 -0.09 0.00 -0.02 0.00 0.00 33.50 31.67 3fgq n PRO 375 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3fgq s PHE 376 N -1.42 -0.14 0.24 6.00 -0.71 -0.94 -4.65 117.98 116.36 3fgq s PHE 376 Ca 0.75 0.20 -0.10 0.00 -1.04 0.00 0.00 56.93 56.75 3fgq s PHE 376 Cb -0.42 0.06 -0.07 0.00 -1.21 0.00 0.00 43.02 41.38 3fgq s PHE 376 CO 0.47 -0.35 0.56 0.12 -1.34 0.00 0.00 175.22 174.68 3fgq s PHE 377 N -1.23 3.43 0.08 3.49 5.36 -0.96 -0.49 117.98 127.66 3fgq s PHE 377 Ca -0.13 0.87 -0.10 0.00 -0.96 0.00 0.00 56.93 56.61 3fgq s PHE 377 Cb -0.06 -2.26 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 3fgq s PHE 377 CO 0.03 0.25 0.22 -0.59 -1.46 0.00 0.00 175.22 173.67 3fgq s PHE 378 N -1.85 0.08 0.03 10.12 -0.71 -0.37 -0.43 117.98 124.85 3fgq s PHE 378 Ca 0.47 -0.44 -0.03 0.00 -1.04 0.00 0.00 56.93 55.90 3fgq s PHE 378 Cb -0.11 -0.01 -0.02 0.00 -1.21 0.00 0.00 43.02 41.67 3fgq s PHE 378 CO 0.22 -0.54 0.03 -0.48 -1.34 0.00 0.00 175.22 173.11 3fgq s LEU 379 N -2.66 2.09 -0.14 -1.99 0.05 0.37 -1.88 118.68 114.51 3fgq s LEU 379 Ca 0.02 -0.61 -0.03 0.00 0.05 0.00 0.00 54.13 53.57 3fgq s LEU 379 Cb 0.03 0.35 -0.03 0.00 -2.05 0.00 0.00 46.19 44.50 3fgq s LEU 379 CO -0.09 -0.45 -0.05 -0.63 -0.55 0.00 0.00 176.35 174.57 3fgq s ILE 380 N -2.45 3.79 0.01 1.48 1.01 0.36 -0.10 121.20 125.30 3fgq s ILE 380 Ca -0.07 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.11 3fgq s ILE 380 Cb -0.02 -2.64 -0.00 0.00 0.01 0.00 0.00 42.46 39.80 3fgq s ILE 380 CO -0.04 0.51 0.13 0.00 0.00 0.00 0.00 174.94 175.54 3fgq s ARG 381 N 0.23 0.52 -0.25 2.79 1.70 -0.53 0.13 118.95 123.55 3fgq s ARG 381 Ca -0.03 -0.50 -0.22 0.00 -0.47 0.00 0.00 55.73 54.51 3fgq s ARG 381 Cb -0.14 0.21 -0.01 0.00 -0.57 0.00 0.00 34.95 34.44 3fgq s ARG 381 CO 0.03 -0.13 0.70 1.21 -1.08 0.00 0.00 175.30 176.03 3fgq s ASN 382 N -1.61 6.67 0.41 -2.89 3.84 -0.32 -0.55 114.94 120.49 3fgq s ASN 382 Ca -0.12 0.83 0.22 0.00 0.21 0.00 0.00 52.86 53.99 3fgq s ASN 382 Cb -0.06 -2.37 0.79 0.00 -0.55 0.00 0.00 41.25 39.06 3fgq s ASN 382 CO -0.00 -0.42 1.77 0.03 -2.79 0.00 0.00 177.10 175.69 3fgq h ARG 383 N 7.81 0.00 0.17 0.43 3.08 -0.30 0.71 114.38 126.27 3fgq h ARG 383 Ca -0.26 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.44 3fgq h ARG 383 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 3fgq h ARG 383 CO 0.81 0.29 -1.80 -0.09 -1.07 0.00 0.00 179.97 178.11 3fgq h ARG 384 N 0.00 0.35 0.00 0.04 2.43 -1.90 -3.37 114.38 111.93 3fgq h ARG 384 Ca -0.00 -0.60 -0.02 0.00 -0.81 0.00 0.00 59.98 58.54 3fgq h ARG 384 Cb 0.83 0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3fgq h ARG 384 CO 0.04 1.27 -1.95 0.25 -1.51 0.00 0.00 179.97 178.07 3fgq n THR 385 N -3.55 0.14 -0.41 0.20 -2.24 -1.22 -4.98 114.28 102.22 3fgq n THR 385 Ca -0.26 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 3fgq n THR 385 Cb 1.07 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 3fgq n THR 385 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fgq n GLY 386 N 1.29 1.64 3.77 3.38 0.00 0.25 -5.01 105.19 110.50 3fgq n GLY 386 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 3fgq n GLY 386 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fgq s THR 387 N -3.21 3.53 -0.36 2.61 -4.23 -1.22 -4.69 115.64 108.08 3fgq s THR 387 Ca 0.00 1.41 -0.21 0.00 -1.18 0.00 0.00 61.69 61.71 3fgq s THR 387 Cb 0.00 -3.84 0.00 0.00 1.34 0.00 0.00 72.50 70.00 3fgq s THR 387 CO 0.00 0.23 0.66 -0.63 -0.54 0.00 0.00 174.62 174.34 3fgq s ILE 388 N -1.33 4.86 0.06 2.99 -1.09 -1.26 -1.17 121.20 124.25 3fgq s ILE 388 Ca 0.49 0.62 -0.12 0.00 -2.23 0.00 0.00 60.65 59.41 3fgq s ILE 388 Cb -0.29 -4.10 -0.31 0.00 -1.58 0.00 0.00 42.46 36.18 3fgq s ILE 388 CO 0.37 -0.34 1.08 -0.07 -1.23 0.00 0.00 174.94 174.75 3fgq h LEU 389 N 9.44 0.74 -7.56 2.97 4.07 -0.67 -3.36 115.31 120.93 3fgq h LEU 389 Ca -0.26 -0.74 -0.08 0.00 0.08 0.00 0.00 57.88 56.87 3fgq h LEU 389 Cb 1.11 -0.24 -0.16 0.00 1.08 0.00 0.00 40.66 42.45 3fgq h LEU 389 CO 0.85 1.57 -0.23 -0.36 -1.08 0.00 0.00 178.44 179.18 3fgq s PHE 390 N -2.76 -0.08 -0.01 1.13 0.08 -0.85 -3.99 117.98 111.49 3fgq s PHE 390 Ca -0.08 -0.13 -0.08 0.00 0.12 0.00 0.00 56.93 56.77 3fgq s PHE 390 Cb 0.06 0.10 0.00 0.00 -0.57 0.00 0.00 43.02 42.61 3fgq s PHE 390 CO 0.92 -0.55 0.15 1.41 -0.10 0.00 0.00 175.22 177.06 3fgq s MET 391 N -2.97 0.47 0.00 0.44 -2.45 -0.72 -0.49 119.30 113.57 3fgq s MET 391 Ca -0.02 -0.32 0.00 0.00 -1.25 0.00 0.00 55.69 54.10 3fgq s MET 391 Cb 0.01 0.20 0.00 0.00 1.25 0.00 0.00 34.83 36.28 3fgq s MET 391 CO -0.06 -0.11 0.00 0.41 1.05 0.00 0.00 175.02 176.31 3fgq n GLY 392 N 1.59 -1.10 3.16 2.11 0.00 -0.79 -1.95 105.19 108.21 3fgq n GLY 392 Ca -0.22 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 3fgq n GLY 392 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3fgq s ARG 393 N -0.40 0.67 -0.28 1.61 1.70 -0.34 -1.24 118.95 120.67 3fgq s ARG 393 Ca 0.00 -0.71 -0.04 0.00 -0.47 0.00 0.00 55.73 54.51 3fgq s ARG 393 Cb 0.00 0.27 0.02 0.00 -0.57 0.00 0.00 34.95 34.68 3fgq s ARG 393 CO 0.00 -0.19 0.02 0.08 -1.08 0.00 0.00 175.30 174.13 3fgq s VAL 394 N -2.71 3.43 -0.20 4.99 1.01 0.36 -1.69 120.40 125.59 3fgq s VAL 394 Ca -0.04 -0.95 0.15 0.00 0.00 0.00 0.00 61.98 61.15 3fgq s VAL 394 Cb -0.00 -2.80 -0.24 0.00 0.00 0.00 0.00 36.38 33.33 3fgq s VAL 394 CO -0.05 0.07 0.05 0.23 0.00 0.00 0.00 175.10 175.40 3fgq n MET 395 N 4.76 0.68 -3.77 2.72 2.81 -1.26 -2.22 117.12 120.83 3fgq n MET 395 Ca -0.15 0.03 -0.29 0.00 -1.81 0.00 0.00 57.70 55.48 3fgq n MET 395 Cb 0.47 -1.53 -0.16 0.00 -0.71 0.00 0.00 33.22 31.29 3fgq n MET 395 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 3fgq s HIS 396 N -2.50 1.55 -0.78 2.03 3.76 -1.26 -4.74 115.29 113.34 3fgq s HIS 396 Ca -0.13 -1.37 0.25 0.00 -0.15 0.00 0.00 55.06 53.66 3fgq s HIS 396 Cb 0.07 -1.40 0.61 0.00 1.11 0.00 0.00 32.58 32.96 3fgq s HIS 396 CO 0.80 -0.75 1.53 -0.35 -0.85 0.00 0.00 174.74 175.12 3fgq n PRO 397 N 4.90 0.19 -2.14 8.40 -0.04 -1.26 -4.92 135.00 140.13 3fgq n PRO 397 Ca -0.07 0.09 -0.32 0.00 -0.04 0.00 0.00 63.50 63.16 3fgq n PRO 397 Cb 0.44 -1.65 -0.00 0.00 -0.04 0.00 0.00 33.50 32.25 3fgq n PRO 397 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3fgq s GLU 398 N -3.10 3.56 1.37 0.54 1.03 -1.26 -4.51 118.70 116.32 3fgq s GLU 398 Ca 0.09 1.06 -0.20 0.00 0.03 0.00 0.00 54.97 55.96 3fgq s GLU 398 Cb 0.15 -2.07 0.35 0.00 -0.80 0.00 0.00 34.13 31.75 3fgq s GLU 398 CO 0.66 -0.60 0.89 2.41 -1.33 0.00 0.00 175.26 177.29 3fgq n THR 399 N -1.96 0.00 -0.08 1.83 -1.04 -1.26 -4.98 114.28 106.79 3fgq n THR 399 Ca 0.08 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 3fgq n THR 399 Cb 0.53 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 68.07 3fgq n THR 399 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66