#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqg s ALA 34 N 0.00 3.56 0.39 5.41 0.00 -1.26 -5.02 121.76 124.84 2nqg s ALA 34 Ca 0.00 1.42 -0.12 0.00 0.00 0.00 0.00 51.96 53.26 2nqg s ALA 34 Cb 0.00 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 2nqg s ALA 34 CO 0.00 -0.85 0.78 0.96 0.00 0.00 0.00 175.76 176.65 2nqg s ILE 35 N -0.90 4.73 -0.24 0.00 -4.36 -0.73 -4.65 121.20 115.05 2nqg s ILE 35 Ca 0.53 0.78 -0.26 0.00 -0.26 0.00 0.00 60.65 61.43 2nqg s ILE 35 Cb -0.43 -3.69 0.00 0.00 1.25 0.00 0.00 42.46 39.59 2nqg s ILE 35 CO 0.56 -0.42 0.92 -0.54 0.24 0.00 0.00 174.94 175.69 2nqg s LYS 36 N -3.58 4.22 0.06 0.37 1.02 -1.26 -0.13 119.74 120.43 2nqg s LYS 36 Ca 0.53 1.12 -0.31 0.00 0.02 0.00 0.00 55.97 57.33 2nqg s LYS 36 Cb -0.10 -3.64 -0.08 0.00 -0.52 0.00 0.00 37.83 33.48 2nqg s LYS 36 CO 0.27 -0.56 1.70 -0.47 -0.92 0.00 0.00 175.35 175.37 2nqg s TYR 37 N 2.98 2.25 -0.28 3.18 5.04 -0.13 -1.54 117.35 128.86 2nqg s TYR 37 Ca 0.39 0.20 0.00 0.00 -2.44 0.00 0.00 57.07 55.21 2nqg s TYR 37 Cb -0.15 -4.01 0.00 0.00 0.35 0.00 0.00 41.96 38.15 2nqg s TYR 37 CO 0.07 -4.14 0.00 1.28 -1.34 0.00 0.00 175.55 171.42 2nqg n LEU 38 N 5.92 0.24 0.00 6.97 4.77 -1.26 -2.09 117.00 131.55 2nqg n LEU 38 Ca 0.17 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2nqg n LEU 38 Cb 0.40 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 39.84 2nqg n LEU 38 CO 0.63 -0.57 0.00 0.61 -1.33 0.00 0.00 177.39 176.74 2nqg n GLY 39 N -0.95 0.50 3.71 -0.72 0.00 -0.59 -5.00 105.19 102.14 2nqg n GLY 39 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 2nqg n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqg s GLN 40 N -0.48 4.32 -0.40 1.61 -0.21 -0.89 -4.99 119.66 118.62 2nqg s GLN 40 Ca 0.00 2.03 -0.05 0.00 0.02 0.00 0.00 55.36 57.36 2nqg s GLN 40 Cb 0.00 -3.35 0.09 0.00 1.00 0.00 0.00 33.01 30.76 2nqg s GLN 40 CO 0.00 -0.46 0.20 0.34 -2.12 0.00 0.00 175.29 173.25 2nqg s ASP 41 N 1.33 5.35 0.11 5.90 -1.08 -1.26 -4.40 116.67 122.62 2nqg s ASP 41 Ca 0.64 -1.75 -0.29 0.00 -0.52 0.00 0.00 52.55 50.63 2nqg s ASP 41 Cb -0.35 -1.87 -0.10 0.00 -1.46 0.00 0.00 42.92 39.14 2nqg s ASP 41 CO 0.29 -0.51 1.48 0.22 0.52 0.00 0.00 175.17 177.17 2nqg h TYR 42 N 8.18 -1.47 -0.80 -5.34 5.03 -1.95 0.06 116.97 120.68 2nqg h TYR 42 Ca -0.18 0.07 -0.01 0.00 2.58 0.00 0.00 58.73 61.19 2nqg h TYR 42 Cb 1.06 0.68 -0.04 0.00 1.55 0.00 0.00 36.73 39.98 2nqg h TYR 42 CO 0.59 -0.44 0.47 0.93 -1.32 0.00 0.00 178.16 178.39 2nqg h GLU 43 N -0.40 1.09 -0.13 1.82 4.39 -1.99 -0.38 114.58 118.98 2nqg h GLU 43 Ca 0.05 -0.10 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 2nqg h GLU 43 Cb 0.54 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2nqg h GLU 43 CO -0.48 0.77 -0.02 -0.97 -1.16 0.00 0.00 179.01 177.16 2nqg h ASN 44 N 1.10 0.25 -0.27 1.42 -0.73 -1.95 -1.15 115.58 114.24 2nqg h ASN 44 Ca 0.29 -0.34 0.04 0.00 1.87 0.00 0.00 56.30 58.15 2nqg h ASN 44 Cb -0.03 -0.07 -0.04 0.00 0.27 0.00 0.00 38.32 38.46 2nqg h ASN 44 CO -0.05 0.53 0.05 -0.07 -0.37 0.00 0.00 177.43 177.52 2nqg h LEU 45 N -0.04 0.01 -0.44 0.34 3.38 -0.81 -0.96 115.31 116.79 2nqg h LEU 45 Ca 0.04 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.06 2nqg h LEU 45 Cb 0.41 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2nqg h LEU 45 CO 0.01 0.04 0.29 -0.09 0.09 0.00 0.00 178.44 178.78 2nqg h ARG 46 N 0.15 0.57 -0.59 1.13 2.43 -1.04 -1.11 114.38 115.93 2nqg h ARG 46 Ca 0.13 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 2nqg h ARG 46 Cb 0.13 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2nqg h ARG 46 CO -0.17 0.38 0.08 0.00 -1.51 0.00 0.00 179.97 178.76 2nqg h ALA 47 N 1.16 0.78 -0.34 2.80 0.00 -1.00 -1.54 119.26 121.13 2nqg h ALA 47 Ca 0.16 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2nqg h ALA 47 Cb -0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2nqg h ALA 47 CO -0.04 0.55 -0.41 0.00 0.00 0.00 0.00 179.25 179.34 2nqg h ARG 48 N 0.88 0.87 -0.54 0.00 3.08 -1.08 0.54 114.38 118.13 2nqg h ARG 48 Ca 0.18 -0.49 0.03 0.00 0.07 0.00 0.00 59.98 59.76 2nqg h ARG 48 Cb 0.44 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.48 2nqg h ARG 48 CO 0.01 1.13 0.33 0.00 -1.07 0.00 0.00 179.97 180.37 2nqg h LEU 50 N 0.65 -0.05 -0.57 0.00 3.38 -1.09 -1.46 115.31 116.17 2nqg h LEU 50 Ca 0.22 -0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.27 2nqg h LEU 50 Cb 0.02 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.70 2nqg h LEU 50 CO -0.10 -0.00 0.09 -0.61 0.09 0.00 0.00 178.44 177.90 2nqg h GLN 51 N -0.08 0.20 -0.16 1.13 4.15 -0.80 -2.94 115.11 116.61 2nqg h GLN 51 Ca -0.01 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2nqg h GLN 51 Cb 0.07 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2nqg h GLN 51 CO 0.01 0.14 0.00 0.09 -1.93 0.00 0.00 178.83 177.13 2nqg n ASN 52 N -5.17 1.26 -1.04 -0.69 5.03 -0.32 -4.93 115.26 109.40 2nqg n ASN 52 Ca 0.08 -1.75 -0.10 0.00 0.87 0.00 0.00 54.58 53.69 2nqg n ASN 52 Cb 0.31 -0.11 -0.01 0.00 -1.02 0.00 0.00 39.78 38.95 2nqg n ASN 52 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2nqg n GLY 53 N 1.00 0.15 3.42 7.41 0.00 -0.71 -5.02 105.19 111.44 2nqg n GLY 53 Ca 0.13 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 2nqg n GLY 53 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2nqg s VAL 54 N -2.46 1.35 0.02 1.61 -7.23 -0.64 -5.05 120.40 108.01 2nqg s VAL 54 Ca 0.00 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.12 2nqg s VAL 54 Cb 0.00 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 2nqg s VAL 54 CO 0.00 -0.19 0.08 -0.76 -0.31 0.00 0.00 175.10 173.92 2nqg s LEU 55 N -3.44 3.85 0.30 1.32 1.43 -1.26 -4.22 118.68 116.66 2nqg s LEU 55 Ca 0.32 0.10 -0.29 0.00 -1.03 0.00 0.00 54.13 53.22 2nqg s LEU 55 Cb 0.06 -2.32 -0.11 0.00 0.03 0.00 0.00 46.19 43.86 2nqg s LEU 55 CO 0.13 0.25 1.47 0.12 0.23 0.00 0.00 176.35 178.55 2nqg s PHE 56 N -1.24 2.85 -0.12 0.29 5.36 -0.25 -4.95 117.98 119.91 2nqg s PHE 56 Ca 0.24 1.05 0.01 0.00 -0.96 0.00 0.00 56.93 57.27 2nqg s PHE 56 Cb -0.12 -3.92 0.02 0.00 -0.34 0.00 0.00 43.02 38.66 2nqg s PHE 56 CO 0.16 -2.88 -0.15 -0.65 -1.46 0.00 0.00 175.22 170.23 2nqg s GLN 57 N -1.02 2.28 -0.60 10.12 -0.21 -1.26 -4.73 119.66 124.24 2nqg s GLN 57 Ca 0.57 -0.57 -0.23 0.00 0.02 0.00 0.00 55.36 55.15 2nqg s GLN 57 Cb -0.44 -1.98 0.06 0.00 1.00 0.00 0.00 33.01 31.64 2nqg s GLN 57 CO 0.51 -0.11 0.90 0.34 -2.12 0.00 0.00 175.29 174.81 2nqg s ASP 58 N 1.13 6.24 0.53 5.90 2.15 -1.26 -4.90 116.67 126.46 2nqg s ASP 58 Ca -0.03 -0.75 0.23 0.00 0.43 0.00 0.00 52.55 52.43 2nqg s ASP 58 Cb -0.14 -2.41 1.37 0.00 -0.30 0.00 0.00 42.92 41.44 2nqg s ASP 58 CO -0.04 -1.28 2.04 0.44 -0.17 0.00 0.00 175.17 176.16 2nqg h ASP 59 N 9.38 0.00 1.34 -0.34 3.32 -1.99 -2.33 116.42 125.80 2nqg h ASP 59 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2nqg h ASP 59 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2nqg h ASP 59 CO 1.12 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.64 2nqg h ALA 60 N 1.81 1.00 0.00 3.45 0.00 -2.00 -3.38 119.26 120.13 2nqg h ALA 60 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2nqg h ALA 60 Cb 0.73 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.38 2nqg h ALA 60 CO -0.00 0.00 -0.47 0.34 0.00 0.00 0.00 179.25 179.12 2nqg n PHE 61 N -2.59 -3.22 -2.00 0.00 -0.00 -0.95 -5.09 117.46 103.62 2nqg n PHE 61 Ca 0.04 -1.70 -0.29 0.00 -0.00 0.00 0.00 57.45 55.49 2nqg n PHE 61 Cb 0.38 1.55 0.06 0.00 -0.00 0.00 0.00 39.48 41.47 2nqg n PHE 61 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 2nqg s PRO 62 N 0.67 2.47 -1.43 -7.13 0.04 -0.92 -4.67 135.00 124.04 2nqg s PRO 62 Ca 0.32 0.18 -0.11 0.00 0.04 0.00 0.00 61.00 61.43 2nqg s PRO 62 Cb 0.23 -2.05 0.06 0.00 0.04 0.00 0.00 34.50 32.78 2nqg s PRO 62 CO -0.24 -1.21 2.27 -0.35 0.04 0.00 0.00 177.00 177.50 2nqg n PRO 63 N -3.05 3.35 -4.16 0.56 -0.04 -1.26 -4.49 135.00 125.92 2nqg n PRO 63 Ca 0.07 -2.86 -0.12 0.00 -0.04 0.00 0.00 63.50 60.54 2nqg n PRO 63 Cb 0.59 -3.05 -0.08 0.00 -0.04 0.00 0.00 33.50 30.91 2nqg n PRO 63 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2nqg s VAL 64 N 1.88 0.00 0.47 0.52 -7.23 -1.26 -4.92 120.40 109.86 2nqg s VAL 64 Ca 0.49 -1.85 0.13 0.00 -1.81 0.00 0.00 61.98 58.94 2nqg s VAL 64 Cb 0.14 -2.45 0.28 0.00 0.56 0.00 0.00 36.38 34.91 2nqg s VAL 64 CO -0.06 0.00 2.09 0.77 -0.31 0.00 0.00 175.10 177.59 2nqg h SER 65 N 2.45 0.23 0.74 4.85 4.64 -1.94 -2.21 113.55 122.31 2nqg h SER 65 Ca -0.32 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.97 2nqg h SER 65 Cb 1.25 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2nqg h SER 65 CO 0.46 0.16 -0.13 0.45 -0.87 0.00 0.00 176.83 176.90 2nqg h HIS 66 N 0.27 0.00 0.00 4.77 3.86 -1.90 -0.86 115.15 121.28 2nqg h HIS 66 Ca 0.10 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.25 2nqg h HIS 66 Cb 0.07 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 2nqg h HIS 66 CO -0.00 0.13 -0.30 0.77 0.86 0.00 0.00 177.93 179.39 2nqg h SER 67 N 0.00 0.00 -0.09 2.45 0.02 -1.62 -3.28 113.55 111.03 2nqg h SER 67 Ca -0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2nqg h SER 67 Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2nqg h SER 67 CO 0.02 0.30 -0.36 -0.07 -1.14 0.00 0.00 176.83 175.58 2nqg h LEU 68 N 0.00 0.48 0.00 5.07 3.38 -1.23 -2.03 115.31 120.97 2nqg h LEU 68 Ca -0.00 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.34 2nqg h LEU 68 Cb 1.00 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2nqg h LEU 68 CO 0.04 1.02 0.00 0.61 0.09 0.00 0.00 178.44 180.20 2nqg n GLY 69 N 0.64 -1.45 0.00 0.83 0.00 -0.87 -0.98 105.19 103.36 2nqg n GLY 69 Ca -0.08 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2nqg n GLY 69 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2nqg n PHE 70 N 7.99 0.00 0.00 1.61 1.16 -1.25 -4.11 117.46 122.86 2nqg n PHE 70 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 2nqg n PHE 70 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2nqg n PHE 70 CO 0.00 0.00 0.00 1.17 -1.87 0.00 0.00 176.76 176.06 2nqg n LYS 71 N -0.71 0.00 0.16 3.97 4.81 -1.26 -4.35 118.16 120.78 2nqg n LYS 71 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.49 2nqg n LYS 71 Cb 0.03 0.00 0.51 0.00 0.02 0.00 0.00 35.03 35.59 2nqg n LYS 71 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2nqg h GLU 72 N 0.00 0.18 -0.62 1.64 4.39 -1.99 -3.04 114.58 115.13 2nqg h GLU 72 Ca 0.00 -0.02 -0.45 0.00 0.34 0.00 0.00 59.36 59.23 2nqg h GLU 72 Cb 0.00 -0.03 -0.37 0.00 -0.10 0.00 0.00 28.75 28.25 2nqg h GLU 72 CO 0.00 0.20 -0.79 1.28 -1.16 0.00 0.00 179.01 178.54 2nqg n LEU 73 N -4.43 4.40 -4.91 1.33 4.77 -1.26 -4.54 117.00 112.37 2nqg n LEU 73 Ca -0.01 -4.51 -0.28 0.00 -0.03 0.00 0.00 56.01 51.18 2nqg n LEU 73 Cb 0.15 -0.32 0.07 0.00 -2.33 0.00 0.00 43.42 41.00 2nqg n LEU 73 CO 0.36 1.94 0.71 -0.83 -1.33 0.00 0.00 177.39 178.24 2nqg s GLY 74 N -3.55 1.63 0.33 -0.72 0.00 -1.15 -2.97 107.32 100.88 2nqg s GLY 74 Ca 0.48 -0.71 0.10 0.00 0.00 0.00 0.00 44.72 44.59 2nqg s GLY 74 CO 0.02 -0.27 1.74 -0.56 0.00 0.00 0.00 173.10 174.03 2nqg h PRO 75 N -0.81 0.57 -0.71 2.90 0.13 -1.85 -2.77 132.00 129.47 2nqg h PRO 75 Ca -0.45 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2nqg h PRO 75 Cb 1.31 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2nqg h PRO 75 CO 0.64 0.38 0.00 0.09 -0.23 0.00 0.00 178.00 178.87 2nqg n ASN 76 N -4.83 2.01 -4.57 1.44 4.13 -1.26 -4.81 115.26 107.38 2nqg n ASN 76 Ca 0.26 -2.19 -0.27 0.00 1.68 0.00 0.00 54.58 54.06 2nqg n ASN 76 Cb 0.73 -0.44 -0.09 0.00 -1.54 0.00 0.00 39.78 38.44 2nqg n ASN 76 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2nqg s SER 77 N -0.42 4.25 0.21 6.41 1.04 -1.04 -5.05 113.70 119.09 2nqg s SER 77 Ca 0.15 -0.56 -0.09 0.00 0.48 0.00 0.00 55.95 55.93 2nqg s SER 77 Cb 0.10 -0.72 0.16 0.00 0.10 0.00 0.00 66.02 65.66 2nqg s SER 77 CO 0.06 0.11 1.81 0.28 0.98 0.00 0.00 173.24 176.48 2nqg h SER 78 N 3.00 1.03 -0.09 7.02 0.02 -1.89 -2.94 113.55 119.70 2nqg h SER 78 Ca -0.47 -0.13 0.01 0.00 -0.84 0.00 0.00 61.79 60.36 2nqg h SER 78 Cb 1.20 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 2nqg h SER 78 CO 0.54 0.87 0.04 0.11 -1.14 0.00 0.00 176.83 177.24 2nqg h LYS 79 N 1.12 0.09 -0.98 3.45 1.57 -1.94 -3.04 116.57 116.83 2nqg h LYS 79 Ca 0.27 -0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.17 2nqg h LYS 79 Cb 0.11 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.31 2nqg h LYS 79 CO -0.04 0.06 0.61 1.15 -0.57 0.00 0.00 179.45 180.66 2nqg h THR 80 N 0.09 0.92 -0.97 -0.16 2.02 -1.78 -3.34 112.91 109.69 2nqg h THR 80 Ca 0.04 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 66.91 2nqg h THR 80 Cb 0.01 -0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 66.22 2nqg h THR 80 CO -0.03 0.18 0.64 1.88 0.37 0.00 0.00 175.52 178.56 2nqg h TYR 81 N 0.97 1.21 -0.00 3.16 0.05 -1.39 -1.68 116.97 119.28 2nqg h TYR 81 Ca 0.49 0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.30 2nqg h TYR 81 Cb 0.48 -0.40 0.00 0.00 1.01 0.00 0.00 36.73 37.81 2nqg h TYR 81 CO -0.01 0.72 -0.24 0.41 -1.05 0.00 0.00 178.16 177.99 2nqg n GLY 82 N -1.37 -1.32 3.70 3.88 0.00 -1.25 -4.92 105.19 103.91 2nqg n GLY 82 Ca 0.12 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 2nqg n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nqg s ILE 83 N -2.94 3.62 -0.00 -0.61 1.01 -0.64 -4.69 121.20 116.95 2nqg s ILE 83 Ca 0.14 1.08 0.07 0.00 0.00 0.00 0.00 60.65 61.94 2nqg s ILE 83 Cb 0.18 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.94 2nqg s ILE 83 CO 0.60 0.03 -0.23 -0.54 0.00 0.00 0.00 174.94 174.80 2nqg s LYS 84 N 1.90 1.80 -0.24 2.79 1.02 0.26 -4.92 119.74 122.37 2nqg s LYS 84 Ca 0.64 -0.88 -0.20 0.00 0.02 0.00 0.00 55.97 55.55 2nqg s LYS 84 Cb -0.33 -1.80 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 2nqg s LYS 84 CO 0.28 0.49 0.59 -1.58 -0.92 0.00 0.00 175.35 174.20 2nqg s TRP 85 N -0.61 3.31 0.02 3.18 0.52 -1.26 -0.95 118.94 123.15 2nqg s TRP 85 Ca 0.09 0.80 0.01 0.00 0.02 0.00 0.00 56.10 57.02 2nqg s TRP 85 Cb -0.09 -2.78 -0.02 0.00 -1.15 0.00 0.00 33.47 29.43 2nqg s TRP 85 CO -0.00 -0.25 -0.05 0.15 0.02 0.00 0.00 176.95 176.81 2nqg s LYS 86 N 2.22 0.40 0.41 4.98 1.02 -0.66 -4.81 119.74 123.30 2nqg s LYS 86 Ca 0.25 -0.51 -0.22 0.00 0.02 0.00 0.00 55.97 55.52 2nqg s LYS 86 Cb -0.16 -0.20 -0.11 0.00 -0.52 0.00 0.00 37.83 36.85 2nqg s LYS 86 CO 0.09 0.04 0.95 1.03 -0.92 0.00 0.00 175.35 176.53 2nqg s ARG 87 N -1.04 4.28 0.58 1.68 0.52 -1.26 -0.63 118.95 123.08 2nqg s ARG 87 Ca -0.07 1.15 0.28 0.00 -0.52 0.00 0.00 55.73 56.56 2nqg s ARG 87 Cb -0.07 -2.27 1.60 0.00 0.52 0.00 0.00 34.95 34.73 2nqg s ARG 87 CO -0.00 0.02 2.07 -1.35 0.02 0.00 0.00 175.30 176.05 2nqg h PRO 88 N 2.09 0.00 0.00 3.54 0.11 -1.97 0.58 132.00 136.36 2nqg h PRO 88 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2nqg h PRO 88 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2nqg h PRO 88 CO 0.62 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.66 2nqg n THR 89 N -3.86 0.19 -0.03 -1.15 -2.24 -1.26 -2.05 114.28 103.87 2nqg n THR 89 Ca 0.03 0.05 -0.03 0.00 -2.27 0.00 0.00 64.05 61.82 2nqg n THR 89 Cb 0.38 -0.59 -0.14 0.00 -2.10 0.00 0.00 70.33 67.88 2nqg n THR 89 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2nqg n GLU 90 N -1.50 0.66 0.02 -0.78 1.02 0.15 -4.53 120.64 115.68 2nqg n GLU 90 Ca 0.06 0.06 -0.19 0.00 -0.02 0.00 0.00 57.16 57.08 2nqg n GLU 90 Cb 0.31 -1.64 -0.12 0.00 -0.02 0.00 0.00 31.44 29.97 2nqg n GLU 90 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2nqg h LEU 91 N 0.00 0.60 -8.16 -4.62 3.38 -1.20 -3.48 115.31 101.83 2nqg h LEU 91 Ca -0.30 -0.79 -0.27 0.00 0.09 0.00 0.00 57.88 56.60 2nqg h LEU 91 Cb 1.79 -0.19 -0.21 0.00 0.09 0.00 0.00 40.66 42.14 2nqg h LEU 91 CO 0.04 1.33 -0.73 -0.76 0.09 0.00 0.00 178.44 178.40 2nqg s LEU 92 N -8.19 2.25 0.26 1.67 1.43 -0.87 -5.05 118.68 110.18 2nqg s LEU 92 Ca -0.12 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 2nqg s LEU 92 Cb 0.04 -0.16 0.33 0.00 0.03 0.00 0.00 46.19 46.43 2nqg s LEU 92 CO 0.85 -0.20 1.65 0.77 0.23 0.00 0.00 176.35 179.64 2nqg h SER 93 N 4.51 0.43 -2.13 2.29 4.64 -1.88 -3.38 113.55 118.03 2nqg h SER 93 Ca -0.36 -0.18 -0.55 0.00 -0.47 0.00 0.00 61.79 60.23 2nqg h SER 93 Cb 1.20 -0.12 -0.41 0.00 -0.31 0.00 0.00 62.40 62.76 2nqg h SER 93 CO 0.41 0.79 -0.90 -3.20 -0.87 0.00 0.00 176.83 173.06 2nqg n ASN 94 N -4.03 2.44 -4.77 4.97 5.15 -1.26 -5.08 115.26 112.68 2nqg n ASN 94 Ca -0.01 -3.26 -0.37 0.00 -0.60 0.00 0.00 54.58 50.34 2nqg n ASN 94 Cb 0.49 -0.61 -0.01 0.00 -0.53 0.00 0.00 39.78 39.12 2nqg n ASN 94 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2nqg s PRO 95 N -2.59 3.78 0.03 1.20 0.04 -1.26 -4.98 135.00 131.22 2nqg s PRO 95 Ca 0.42 1.71 0.06 0.00 0.04 0.00 0.00 61.00 63.23 2nqg s PRO 95 Cb 0.26 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 2nqg s PRO 95 CO -0.09 -0.51 -0.16 -0.65 0.04 0.00 0.00 177.00 175.62 2nqg s GLN 96 N -2.74 1.14 -0.06 4.56 -1.52 -0.07 -4.64 119.66 116.33 2nqg s GLN 96 Ca 0.64 -0.77 -0.20 0.00 -1.95 0.00 0.00 55.36 53.08 2nqg s GLN 96 Cb -0.27 -1.17 -0.15 0.00 -0.22 0.00 0.00 33.01 31.20 2nqg s GLN 96 CO 0.32 0.30 0.78 0.35 -0.25 0.00 0.00 175.29 176.79 2nqg h PHE 97 N 5.08 -0.17 -3.30 0.91 3.57 -1.84 -1.53 116.94 119.67 2nqg h PHE 97 Ca -0.39 -0.00 -0.59 0.00 3.53 0.00 0.00 57.97 60.52 2nqg h PHE 97 Cb 1.17 0.06 -0.34 0.00 2.79 0.00 0.00 35.95 39.62 2nqg h PHE 97 CO 0.49 0.28 -0.84 0.42 -2.23 0.00 0.00 178.31 176.44 2nqg s ILE 98 N -3.12 1.53 -0.17 1.41 1.01 -1.26 -0.50 121.20 120.09 2nqg s ILE 98 Ca -0.12 -0.67 -0.00 0.00 0.00 0.00 0.00 60.65 59.85 2nqg s ILE 98 Cb 0.00 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 41.09 2nqg s ILE 98 CO 0.45 0.45 -0.15 -0.69 0.00 0.00 0.00 174.94 175.00 2nqg s VAL 99 N 0.86 2.62 -1.47 2.92 1.01 -1.26 -4.74 120.40 120.33 2nqg s VAL 99 Ca -0.09 -0.77 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2nqg s VAL 99 Cb -0.15 -2.12 0.06 0.00 0.00 0.00 0.00 36.38 34.16 2nqg s VAL 99 CO 0.00 0.51 0.97 0.47 0.00 0.00 0.00 175.10 177.05 2nqg n ASP 100 N 4.31 -5.33 0.00 3.32 8.00 -1.26 -4.72 116.55 120.87 2nqg n ASP 100 Ca -0.19 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.67 2nqg n ASP 100 Cb 0.51 -4.25 0.00 0.00 -0.02 0.00 0.00 41.12 37.36 2nqg n ASP 100 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nqg n GLY 101 N -1.73 -1.88 3.47 0.44 0.00 -1.26 -4.79 105.19 99.44 2nqg n GLY 101 Ca 0.02 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 2nqg n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqg s ALA 102 N -3.10 3.18 0.26 4.61 0.00 -1.26 -4.98 121.76 120.47 2nqg s ALA 102 Ca 0.00 -1.62 0.02 0.00 0.00 0.00 0.00 51.96 50.37 2nqg s ALA 102 Cb 0.00 -3.73 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 2nqg s ALA 102 CO 0.00 -2.51 0.06 0.95 0.00 0.00 0.00 175.76 174.26 2nqg s THR 103 N 3.78 0.82 -0.29 0.00 -4.23 -1.26 -4.82 115.64 109.64 2nqg s THR 103 Ca 0.24 -2.01 0.28 0.00 -1.18 0.00 0.00 61.69 59.02 2nqg s THR 103 Cb -0.16 -2.59 0.32 0.00 1.34 0.00 0.00 72.50 71.42 2nqg s THR 103 CO 0.14 -0.10 1.81 0.08 -0.54 0.00 0.00 174.62 176.01 2nqg h ARG 104 N 2.35 0.00 0.00 3.99 0.11 -1.91 -1.72 114.38 117.20 2nqg h ARG 104 Ca -0.39 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.69 2nqg h ARG 104 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2nqg h ARG 104 CO 0.64 0.00 0.00 0.25 0.10 0.00 0.00 179.97 180.96 2nqg n THR 105 N -2.68 0.70 1.39 0.08 -2.24 -1.26 -2.63 114.28 107.65 2nqg n THR 105 Ca 0.02 0.18 0.14 0.00 -2.27 0.00 0.00 64.05 62.12 2nqg n THR 105 Cb 0.33 -0.95 0.51 0.00 -2.10 0.00 0.00 70.33 68.12 2nqg n THR 105 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2nqg n ASP 106 N -1.32 0.92 -4.15 3.42 8.00 -0.65 -2.44 116.55 120.35 2nqg n ASP 106 Ca 0.06 -0.95 -0.39 0.00 0.71 0.00 0.00 54.79 54.22 2nqg n ASP 106 Cb 0.11 0.03 -0.07 0.00 -0.02 0.00 0.00 41.12 41.17 2nqg n ASP 106 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2nqg s ILE 107 N -2.35 4.24 -0.29 0.53 -1.09 -1.08 -3.36 121.20 117.81 2nqg s ILE 107 Ca 0.30 -3.06 0.02 0.00 -2.23 0.00 0.00 60.65 55.68 2nqg s ILE 107 Cb 0.20 -3.70 0.07 0.00 -1.58 0.00 0.00 42.46 37.45 2nqg s ILE 107 CO 0.45 -0.95 -0.04 0.00 -1.23 0.00 0.00 174.94 173.17 2nqg n GLN 109 N 4.47 1.93 0.00 0.00 7.27 0.07 -1.99 117.38 129.13 2nqg n GLN 109 Ca -0.10 0.69 0.00 0.00 0.07 0.00 0.00 57.00 57.65 2nqg n GLN 109 Cb 0.42 -2.40 0.00 0.00 2.41 0.00 0.00 30.24 30.67 2nqg n GLN 109 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2nqg n GLY 110 N 0.80 2.82 2.44 1.69 0.00 -1.19 -4.85 105.19 106.90 2nqg n GLY 110 Ca 0.07 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.84 2nqg n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqg n ALA 111 N -3.00 6.98 -3.26 4.61 0.00 -0.41 -4.78 120.51 120.65 2nqg n ALA 111 Ca 0.00 -3.96 -0.13 0.00 0.00 0.00 0.00 53.44 49.34 2nqg n ALA 111 Cb 0.00 -2.90 -0.10 0.00 0.00 0.00 0.00 19.45 16.45 2nqg n ALA 111 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2nqg s LEU 112 N -1.65 0.64 -0.50 0.00 2.96 -1.26 -4.93 118.68 113.93 2nqg s LEU 112 Ca 0.57 0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 55.03 2nqg s LEU 112 Cb 0.18 1.27 -0.12 0.00 0.50 0.00 0.00 46.19 48.03 2nqg s LEU 112 CO -0.09 -0.20 3.19 0.61 -1.32 0.00 0.00 176.35 178.55 2nqg n GLY 113 N 2.53 3.75 1.92 7.98 0.00 -1.26 -4.54 105.19 115.57 2nqg n GLY 113 Ca -0.15 -1.51 -0.22 0.00 0.00 0.00 0.00 46.02 44.14 2nqg n GLY 113 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2nqg n ASP 114 N 2.18 4.97 -0.35 1.61 3.85 -1.26 -1.25 116.55 126.30 2nqg n ASP 114 Ca 0.52 -3.76 0.14 0.00 -0.71 0.00 0.00 54.79 50.99 2nqg n ASP 114 Cb 0.65 -0.71 0.34 0.00 -1.35 0.00 0.00 41.12 40.05 2nqg n ASP 114 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2nqg h TRP 116 N 0.69 1.22 -0.15 0.00 5.08 -1.87 0.73 115.95 121.64 2nqg h TRP 116 Ca 0.60 -0.06 -0.05 0.00 1.08 0.00 0.00 58.89 60.46 2nqg h TRP 116 Cb 1.01 -0.38 -0.00 0.00 -3.00 0.00 0.00 29.16 26.79 2nqg h TRP 116 CO -0.01 0.88 -0.09 1.25 -1.28 0.00 0.00 178.44 179.19 2nqg h LEU 117 N 1.21 0.34 -0.59 0.11 5.85 -1.55 -2.86 115.31 117.83 2nqg h LEU 117 Ca 0.29 -0.43 -0.15 0.00 0.84 0.00 0.00 57.88 58.43 2nqg h LEU 117 Cb 0.12 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2nqg h LEU 117 CO -0.04 0.70 -0.55 -0.07 -0.34 0.00 0.00 178.44 178.14 2nqg h LEU 118 N -0.01 0.49 -0.78 2.25 3.38 -0.98 -1.57 115.31 118.09 2nqg h LEU 118 Ca 0.03 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.78 2nqg h LEU 118 Cb 0.57 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2nqg h LEU 118 CO 0.03 0.94 0.49 0.00 0.09 0.00 0.00 178.44 179.99 2nqg h ALA 119 N 1.07 1.04 -0.46 1.53 0.00 -0.96 0.26 119.26 121.73 2nqg h ALA 119 Ca 0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2nqg h ALA 119 Cb 1.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2nqg h ALA 119 CO 0.10 0.27 0.22 0.00 0.00 0.00 0.00 179.25 179.83 2nqg h ALA 120 N 1.34 0.60 -0.44 0.00 0.00 -1.22 -1.43 119.26 118.10 2nqg h ALA 120 Ca 0.32 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2nqg h ALA 120 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2nqg h ALA 120 CO -0.13 0.17 0.08 0.82 0.00 0.00 0.00 179.25 180.18 2nqg h ILE 121 N 0.61 1.24 -0.66 0.00 2.04 -1.10 0.56 117.51 120.20 2nqg h ILE 121 Ca 0.16 -0.89 0.04 0.00 1.00 0.00 0.00 64.86 65.17 2nqg h ILE 121 Cb 0.13 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 2nqg h ILE 121 CO -0.02 0.31 0.39 0.00 0.00 0.00 0.00 178.15 178.83 2nqg h ALA 122 N 0.95 0.87 -0.47 1.87 0.00 -0.83 -2.55 119.26 119.10 2nqg h ALA 122 Ca 0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2nqg h ALA 122 Cb 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2nqg h ALA 122 CO 0.01 0.10 0.25 0.77 0.00 0.00 0.00 179.25 180.38 2nqg h SER 123 N 0.74 0.58 -1.00 0.00 0.02 -0.99 -2.94 113.55 109.96 2nqg h SER 123 Ca 0.28 -0.09 0.26 0.00 -0.84 0.00 0.00 61.79 61.39 2nqg h SER 123 Cb 0.10 -0.15 -0.13 0.00 0.14 0.00 0.00 62.40 62.36 2nqg h SER 123 CO -0.14 0.51 0.58 0.25 -1.14 0.00 0.00 176.83 176.89 2nqg h LEU 124 N 0.61 0.62 -2.26 5.07 5.85 -0.49 -1.11 115.31 123.60 2nqg h LEU 124 Ca 0.16 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 59.03 2nqg h LEU 124 Cb 0.06 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 2nqg h LEU 124 CO -0.03 0.05 -0.00 0.71 -0.34 0.00 0.00 178.44 178.83 2nqg h THR 125 N 0.52 0.00 0.00 1.05 1.35 -1.28 -2.38 112.91 112.17 2nqg h THR 125 Ca 0.66 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 66.27 2nqg h THR 125 Cb 1.31 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 2nqg h THR 125 CO -0.51 0.00 0.00 -0.07 -0.25 0.00 0.00 175.52 174.69 2nqg h LEU 126 N 0.00 0.00 -7.67 3.87 3.38 -1.32 -3.39 115.31 110.18 2nqg h LEU 126 Ca -0.00 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.28 2nqg h LEU 126 Cb 0.25 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.64 2nqg h LEU 126 CO 0.00 0.00 -0.51 0.21 0.09 0.00 0.00 178.44 178.23 2nqg s ASN 127 N -4.82 5.09 0.29 -0.43 3.84 -0.90 -4.98 114.94 113.04 2nqg s ASN 127 Ca 0.06 -2.45 0.04 0.00 0.21 0.00 0.00 52.86 50.72 2nqg s ASN 127 Cb 0.10 -1.80 0.66 0.00 -0.55 0.00 0.00 41.25 39.66 2nqg s ASN 127 CO 0.51 -0.43 1.80 1.05 -2.79 0.00 0.00 177.10 177.24 2nqg h GLU 128 N 7.46 0.81 -0.26 0.43 4.11 -1.80 0.14 114.58 125.47 2nqg h GLU 128 Ca -0.07 -0.05 -0.03 0.00 0.07 0.00 0.00 59.36 59.27 2nqg h GLU 128 Cb 0.99 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2nqg h GLU 128 CO 0.68 0.54 0.03 1.15 0.07 0.00 0.00 179.01 181.49 2nqg h THR 129 N 0.84 1.23 -0.04 -1.06 2.02 -1.93 -1.84 112.91 112.13 2nqg h THR 129 Ca 0.55 -0.80 -0.18 0.00 0.77 0.00 0.00 66.41 66.75 2nqg h THR 129 Cb 0.74 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 2nqg h THR 129 CO -0.34 0.26 -0.75 0.40 0.37 0.00 0.00 175.52 175.45 2nqg h ILE 130 N 0.24 1.43 -0.61 3.11 1.08 -1.76 -3.08 117.51 117.93 2nqg h ILE 130 Ca 0.08 -2.30 0.04 0.00 -0.39 0.00 0.00 64.86 62.29 2nqg h ILE 130 Cb 0.35 2.23 -0.04 0.00 -3.07 0.00 0.00 36.82 36.29 2nqg h ILE 130 CO 0.01 0.68 0.36 0.25 -0.69 0.00 0.00 178.15 178.75 2nqg h LEU 131 N 0.16 0.56 -0.81 1.44 5.85 -0.51 -2.73 115.31 119.28 2nqg h LEU 131 Ca -0.03 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2nqg h LEU 131 Cb 1.32 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2nqg h LEU 131 CO 0.12 0.38 -0.02 1.41 -0.34 0.00 0.00 178.44 180.00 2nqg n HIS 132 N -4.77 0.00 0.00 1.25 8.25 -0.71 -1.31 115.22 117.93 2nqg n HIS 132 Ca 0.06 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.35 2nqg n HIS 132 Cb 0.11 -0.01 -0.12 0.00 1.12 0.00 0.00 29.99 31.09 2nqg n HIS 132 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2nqg h ARG 133 N 1.97 0.27 -0.33 -0.41 2.43 -1.40 -3.33 114.38 113.58 2nqg h ARG 133 Ca 0.00 -0.34 -0.11 0.00 -0.81 0.00 0.00 59.98 58.72 2nqg h ARG 133 Cb 0.44 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 2nqg h ARG 133 CO 0.00 1.08 -0.26 0.28 -1.51 0.00 0.00 179.97 179.55 2nqg h VAL 134 N -0.39 1.27 -3.38 0.20 2.07 -1.21 -3.38 116.25 111.43 2nqg h VAL 134 Ca -0.07 -1.36 -0.66 0.00 0.82 0.00 0.00 66.70 65.42 2nqg h VAL 134 Cb 1.28 1.30 -0.39 0.00 -1.52 0.00 0.00 31.29 31.97 2nqg h VAL 134 CO 0.10 0.44 -0.46 -0.69 0.02 0.00 0.00 177.57 176.97 2nqg s VAL 135 N -4.52 3.24 0.53 2.57 1.01 -0.43 -1.35 120.40 121.45 2nqg s VAL 135 Ca -0.08 -3.43 -0.22 0.00 0.00 0.00 0.00 61.98 58.25 2nqg s VAL 135 Cb 0.13 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.31 2nqg s VAL 135 CO 0.82 -0.90 1.19 -2.65 0.00 0.00 0.00 175.10 173.57 2nqg n PRO 136 N 2.94 1.45 -1.50 2.72 -0.02 -1.25 -4.44 135.00 134.90 2nqg n PRO 136 Ca 0.10 0.53 -0.32 0.00 -2.02 0.00 0.00 63.50 61.80 2nqg n PRO 136 Cb 0.35 -2.37 0.07 0.00 -0.02 0.00 0.00 33.50 31.53 2nqg n PRO 136 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2nqg s TYR 137 N -1.34 2.60 0.00 6.00 6.14 -1.26 -4.39 117.35 125.10 2nqg s TYR 137 Ca 0.71 1.55 0.00 0.00 0.64 0.00 0.00 57.07 59.97 2nqg s TYR 137 Cb -0.44 -3.10 0.00 0.00 0.42 0.00 0.00 41.96 38.83 2nqg s TYR 137 CO 0.50 -1.74 0.00 0.41 0.64 0.00 0.00 175.55 175.36 2nqg n GLY 138 N -0.88 0.70 3.78 8.97 0.00 -1.26 -5.07 105.19 111.43 2nqg n GLY 138 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2nqg n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nqg s GLN 139 N -0.77 4.04 0.16 1.61 -0.21 -1.26 -5.07 119.66 118.15 2nqg s GLN 139 Ca 0.00 0.19 -0.19 0.00 0.02 0.00 0.00 55.36 55.38 2nqg s GLN 139 Cb 0.00 -3.33 0.04 0.00 1.00 0.00 0.00 33.01 30.73 2nqg s GLN 139 CO 0.00 0.45 0.51 -1.54 -2.12 0.00 0.00 175.29 172.59 2nqg s SER 140 N -0.22 -0.35 0.00 5.90 1.04 -1.26 -4.72 113.70 114.09 2nqg s SER 140 Ca 0.19 -0.27 0.25 0.00 0.48 0.00 0.00 55.95 56.61 2nqg s SER 140 Cb -0.14 0.55 0.84 0.00 0.10 0.00 0.00 66.02 67.37 2nqg s SER 140 CO 0.07 -0.96 1.62 0.49 0.98 0.00 0.00 173.24 175.45 2nqg n PHE 141 N -0.31 0.09 0.00 5.02 3.01 -1.26 -4.44 117.46 119.56 2nqg n PHE 141 Ca -0.14 -0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.27 2nqg n PHE 141 Cb 0.64 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.11 2nqg n PHE 141 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2nqg n GLN 142 N 0.40 0.00 -1.68 -1.08 3.00 -1.26 -4.75 117.38 112.01 2nqg n GLN 142 Ca 0.18 0.00 -0.51 0.00 -0.01 0.00 0.00 57.00 56.66 2nqg n GLN 142 Cb 0.38 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.57 2nqg n GLN 142 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 2nqg n GLU 143 N 0.00 1.82 -0.75 -1.09 4.07 -1.26 -1.47 120.64 121.96 2nqg n GLU 143 Ca 0.00 0.66 0.00 0.00 -0.06 0.00 0.00 57.16 57.76 2nqg n GLU 143 Cb 0.00 -2.43 0.00 0.00 -0.06 0.00 0.00 31.44 28.95 2nqg n GLU 143 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2nqg n GLY 144 N 3.97 0.80 3.71 8.31 0.00 -1.26 -4.84 105.19 115.87 2nqg n GLY 144 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 2nqg n GLY 144 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2nqg s TYR 145 N -3.03 3.14 -0.02 1.61 5.04 -0.54 -4.91 117.35 118.63 2nqg s TYR 145 Ca 0.00 0.84 0.23 0.00 -2.44 0.00 0.00 57.07 55.71 2nqg s TYR 145 Cb 0.00 -3.74 0.39 0.00 0.35 0.00 0.00 41.96 38.96 2nqg s TYR 145 CO 0.00 -2.67 1.15 0.00 -1.34 0.00 0.00 175.55 172.69 2nqg n ALA 146 N 4.15 2.51 -1.08 3.97 0.00 -1.26 -4.96 120.51 123.85 2nqg n ALA 146 Ca 0.12 -2.21 -0.03 0.00 0.00 0.00 0.00 53.44 51.33 2nqg n ALA 146 Cb 0.42 -0.71 -0.01 0.00 0.00 0.00 0.00 19.45 19.14 2nqg n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nqg n GLY 147 N 0.37 0.59 2.96 0.00 0.00 -1.26 -1.09 105.19 106.76 2nqg n GLY 147 Ca 0.03 -0.87 -0.17 0.00 0.00 0.00 0.00 46.02 45.01 2nqg n GLY 147 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2nqg s ILE 148 N -2.09 0.49 0.24 -0.61 2.07 -1.26 -1.81 121.20 118.23 2nqg s ILE 148 Ca 0.00 -0.25 0.01 0.00 -1.41 0.00 0.00 60.65 59.01 2nqg s ILE 148 Cb 0.00 -0.43 -0.05 0.00 0.13 0.00 0.00 42.46 42.11 2nqg s ILE 148 CO 0.00 0.15 0.07 -0.36 -1.91 0.00 0.00 174.94 172.89 2nqg s PHE 149 N -0.01 1.45 0.01 3.50 0.40 -0.15 -4.96 117.98 118.22 2nqg s PHE 149 Ca 0.01 -1.14 -0.08 0.00 -0.60 0.00 0.00 56.93 55.12 2nqg s PHE 149 Cb -0.04 -0.84 0.00 0.00 0.51 0.00 0.00 43.02 42.65 2nqg s PHE 149 CO -0.00 -0.30 0.14 -3.38 0.70 0.00 0.00 175.22 172.38 2nqg s HIS 150 N -3.73 0.05 0.05 0.36 -3.43 -1.26 -1.07 115.29 106.25 2nqg s HIS 150 Ca 0.34 -0.16 -0.02 0.00 -0.80 0.00 0.00 55.06 54.42 2nqg s HIS 150 Cb 0.07 -0.05 -0.03 0.00 -1.43 0.00 0.00 32.58 31.14 2nqg s HIS 150 CO 0.11 -0.31 -0.01 -0.06 -2.00 0.00 0.00 174.74 172.48 2nqg s PHE 151 N -1.57 0.43 -0.06 0.38 0.08 -0.35 -4.45 117.98 112.43 2nqg s PHE 151 Ca -0.13 -0.92 0.04 0.00 0.12 0.00 0.00 56.93 56.04 2nqg s PHE 151 Cb -0.07 -0.32 -0.02 0.00 -0.57 0.00 0.00 43.02 42.04 2nqg s PHE 151 CO 0.01 -0.36 -0.17 -0.65 -0.10 0.00 0.00 175.22 173.95 2nqg s GLN 152 N -3.46 2.64 0.04 0.44 -0.21 -0.46 -0.05 119.66 118.61 2nqg s GLN 152 Ca 0.03 -0.75 0.01 0.00 0.02 0.00 0.00 55.36 54.66 2nqg s GLN 152 Cb 0.05 -2.36 -0.03 0.00 1.00 0.00 0.00 33.01 31.67 2nqg s GLN 152 CO -0.08 0.50 -0.05 -0.51 -2.12 0.00 0.00 175.29 173.02 2nqg s LEU 153 N -0.42 2.32 -0.46 2.90 1.43 -0.55 -4.31 118.68 119.59 2nqg s LEU 153 Ca 0.04 -0.66 -0.28 0.00 -1.03 0.00 0.00 54.13 52.21 2nqg s LEU 153 Cb -0.12 -0.02 0.03 0.00 0.03 0.00 0.00 46.19 46.11 2nqg s LEU 153 CO 0.02 -0.32 1.07 0.86 0.23 0.00 0.00 176.35 178.20 2nqg s TRP 154 N -2.06 2.87 -0.12 0.29 -0.11 0.11 -0.35 118.94 119.57 2nqg s TRP 154 Ca -0.07 0.65 -0.13 0.00 1.22 0.00 0.00 56.10 57.77 2nqg s TRP 154 Cb -0.05 -4.25 0.03 0.00 -1.50 0.00 0.00 33.47 27.70 2nqg s TRP 154 CO -0.02 -1.19 0.36 -0.65 -4.62 0.00 0.00 176.95 170.83 2nqg s GLN 155 N 4.19 0.47 -2.01 5.86 -1.52 0.72 -4.38 119.66 122.99 2nqg s GLN 155 Ca 0.44 0.42 0.00 0.00 -1.95 0.00 0.00 55.36 54.27 2nqg s GLN 155 Cb -0.08 0.22 0.00 0.00 -0.22 0.00 0.00 33.01 32.93 2nqg s GLN 155 CO 0.29 -0.07 0.00 1.19 -0.25 0.00 0.00 175.29 176.45 2nqg n PHE 156 N 2.66 -0.00 -1.65 0.91 3.72 -1.26 -1.45 117.46 120.39 2nqg n PHE 156 Ca -0.14 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.24 2nqg n PHE 156 Cb 0.57 -3.21 -0.00 0.00 -0.94 0.00 0.00 39.48 35.90 2nqg n PHE 156 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nqg n GLY 157 N -0.64 0.39 3.19 1.37 0.00 -1.26 -5.06 105.19 103.17 2nqg n GLY 157 Ca -0.19 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.86 2nqg n GLY 157 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nqg s GLU 158 N -3.35 0.73 -0.22 1.61 0.41 -0.52 -5.13 118.70 112.23 2nqg s GLU 158 Ca 0.00 -0.69 -0.29 0.00 -0.41 0.00 0.00 54.97 53.58 2nqg s GLU 158 Cb 0.00 0.30 0.01 0.00 -1.78 0.00 0.00 34.13 32.66 2nqg s GLU 158 CO 0.00 -0.22 1.02 -1.58 -0.49 0.00 0.00 175.26 173.99 2nqg s TRP 159 N -2.84 3.35 -0.03 1.61 0.52 -1.26 -0.20 118.94 120.10 2nqg s TRP 159 Ca -0.03 1.46 0.07 0.00 0.02 0.00 0.00 56.10 57.61 2nqg s TRP 159 Cb 0.00 -3.24 -0.01 0.00 -1.15 0.00 0.00 33.47 29.06 2nqg s TRP 159 CO -0.05 -0.45 -0.23 0.54 0.02 0.00 0.00 176.95 176.78 2nqg s VAL 160 N 3.06 1.82 -0.23 4.03 0.11 0.53 -1.78 120.40 127.93 2nqg s VAL 160 Ca 0.44 -0.97 -0.17 0.00 -2.93 0.00 0.00 61.98 58.34 2nqg s VAL 160 Cb -0.15 -1.52 -0.03 0.00 -1.53 0.00 0.00 36.38 33.14 2nqg s VAL 160 CO 0.07 0.51 0.48 -0.62 -3.33 0.00 0.00 175.10 172.21 2nqg s ASP 161 N -0.41 6.45 -0.19 3.54 -1.08 0.82 -1.48 116.67 124.32 2nqg s ASP 161 Ca 0.05 0.53 -0.02 0.00 -0.52 0.00 0.00 52.55 52.59 2nqg s ASP 161 Cb -0.10 -2.27 -0.01 0.00 -1.46 0.00 0.00 42.92 39.09 2nqg s ASP 161 CO 0.00 -0.21 -0.09 -0.69 0.52 0.00 0.00 175.17 174.70 2nqg s VAL 162 N 1.91 3.05 0.26 1.11 1.01 0.93 -0.95 120.40 127.72 2nqg s VAL 162 Ca 0.21 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 2nqg s VAL 162 Cb -0.15 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 2nqg s VAL 162 CO 0.09 0.47 0.48 0.68 0.00 0.00 0.00 175.10 176.82 2nqg s VAL 163 N 1.13 5.12 0.01 2.92 -7.23 -1.26 -1.21 120.40 119.87 2nqg s VAL 163 Ca 0.01 -0.22 -0.01 0.00 -1.81 0.00 0.00 61.98 59.95 2nqg s VAL 163 Cb -0.14 -3.75 -0.01 0.00 0.56 0.00 0.00 36.38 33.03 2nqg s VAL 163 CO -0.03 -0.29 0.00 0.68 -0.31 0.00 0.00 175.10 175.16 2nqg s VAL 164 N -2.02 0.08 0.76 1.32 -7.23 -0.24 -4.97 120.40 108.10 2nqg s VAL 164 Ca 0.41 -0.65 -0.11 0.00 -1.81 0.00 0.00 61.98 59.82 2nqg s VAL 164 Cb -0.11 -0.22 0.05 0.00 0.56 0.00 0.00 36.38 36.66 2nqg s VAL 164 CO 0.30 -0.36 1.08 1.51 -0.31 0.00 0.00 175.10 177.33 2nqg s ASP 165 N -1.07 4.76 -0.02 4.85 3.84 -1.26 -0.97 116.67 126.79 2nqg s ASP 165 Ca -0.12 1.55 0.12 0.00 -0.00 0.00 0.00 52.55 54.11 2nqg s ASP 165 Cb -0.07 -2.34 0.38 0.00 -1.38 0.00 0.00 42.92 39.51 2nqg s ASP 165 CO -0.00 -1.83 1.28 -0.90 -0.00 0.00 0.00 175.17 173.72 2nqg n ASP 166 N -3.37 2.45 -4.68 2.11 3.85 -0.75 -4.83 116.55 111.33 2nqg n ASP 166 Ca 0.08 -2.09 -0.42 0.00 -0.71 0.00 0.00 54.79 51.65 2nqg n ASP 166 Cb 0.54 -0.33 -0.03 0.00 -1.35 0.00 0.00 41.12 39.95 2nqg n ASP 166 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 2nqg s LEU 167 N -1.09 4.35 0.07 -2.12 1.43 -1.26 -3.97 118.68 116.09 2nqg s LEU 167 Ca 0.28 2.40 0.08 0.00 -1.03 0.00 0.00 54.13 55.86 2nqg s LEU 167 Cb 0.16 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 2nqg s LEU 167 CO 0.17 -0.89 -0.21 -0.76 0.23 0.00 0.00 176.35 174.90 2nqg s LEU 168 N 3.02 2.22 0.06 1.79 1.43 0.20 -4.84 118.68 122.56 2nqg s LEU 168 Ca 0.74 -0.59 -0.31 0.00 -1.03 0.00 0.00 54.13 52.94 2nqg s LEU 168 Cb -0.38 -0.93 -0.06 0.00 0.03 0.00 0.00 46.19 44.85 2nqg s LEU 168 CO 0.32 0.12 1.34 -2.84 0.23 0.00 0.00 176.35 175.51 2nqg s PRO 169 N -1.48 4.34 0.09 1.29 0.02 -1.26 -1.66 135.00 136.35 2nqg s PRO 169 Ca 0.07 1.95 0.04 0.00 0.02 0.00 0.00 61.00 63.07 2nqg s PRO 169 Cb -0.09 -3.37 -0.03 0.00 0.02 0.00 0.00 34.50 31.02 2nqg s PRO 169 CO 0.03 -0.43 -0.10 0.95 -0.33 0.00 0.00 177.00 177.12 2nqg s THR 170 N 1.49 0.90 -0.02 0.99 -4.23 -0.13 -1.72 115.64 112.91 2nqg s THR 170 Ca 0.63 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 2nqg s THR 170 Cb -0.33 -1.27 0.03 0.00 1.34 0.00 0.00 72.50 72.26 2nqg s THR 170 CO 0.29 -0.53 0.02 -0.75 -0.54 0.00 0.00 174.62 173.11 2nqg s LYS 171 N -2.64 -0.01 -1.20 3.99 2.20 0.54 -0.57 119.74 122.06 2nqg s LYS 171 Ca 0.04 0.16 -0.06 0.00 -0.36 0.00 0.00 55.97 55.75 2nqg s LYS 171 Cb -0.04 -0.25 0.04 0.00 -1.51 0.00 0.00 37.83 36.08 2nqg s LYS 171 CO -0.00 -0.15 0.34 -0.25 -0.36 0.00 0.00 175.35 174.93 2nqg n ASP 172 N 4.09 -3.86 0.00 1.43 10.43 -1.26 -1.31 116.55 126.07 2nqg n ASP 172 Ca -0.27 -0.19 0.00 0.00 2.57 0.00 0.00 54.79 56.91 2nqg n ASP 172 Cb 0.51 -3.22 0.00 0.00 1.84 0.00 0.00 41.12 40.25 2nqg n ASP 172 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2nqg n GLY 173 N -1.07 0.54 3.24 0.44 0.00 -1.26 -5.04 105.19 102.04 2nqg n GLY 173 Ca -0.06 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 2nqg n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nqg s LYS 174 N -0.25 1.35 0.29 1.61 -0.14 -0.43 -5.03 119.74 117.14 2nqg s LYS 174 Ca 0.00 -0.92 -0.30 0.00 -1.36 0.00 0.00 55.97 53.39 2nqg s LYS 174 Cb 0.00 -1.46 -0.12 0.00 -1.68 0.00 0.00 37.83 34.57 2nqg s LYS 174 CO 0.00 0.37 1.54 1.28 -0.76 0.00 0.00 175.35 177.79 2nqg n LEU 175 N 1.87 4.09 0.09 3.17 4.77 -1.26 -0.34 117.00 129.39 2nqg n LEU 175 Ca -0.17 1.15 -0.14 0.00 -0.03 0.00 0.00 56.01 56.82 2nqg n LEU 175 Cb 0.53 -1.56 -0.14 0.00 -2.33 0.00 0.00 43.42 39.93 2nqg n LEU 175 CO 0.23 -0.00 -0.05 1.62 -1.33 0.00 0.00 177.39 177.86 2nqg h VAL 176 N 3.25 1.50 0.00 4.08 3.04 -1.65 -3.45 116.25 123.02 2nqg h VAL 176 Ca -0.47 -3.11 0.00 0.00 -1.01 0.00 0.00 66.70 62.12 2nqg h VAL 176 Cb 1.24 2.90 0.00 0.00 -2.01 0.00 0.00 31.29 33.42 2nqg h VAL 176 CO 0.77 0.90 0.00 0.49 -1.01 0.00 0.00 177.57 178.72 2nqg n PHE 177 N -3.48 0.00 -1.94 3.17 3.72 -1.26 -1.29 117.46 116.38 2nqg n PHE 177 Ca -0.08 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.94 2nqg n PHE 177 Cb 1.01 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.57 2nqg n PHE 177 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2nqg s VAL 178 N 4.87 2.42 0.14 -4.37 0.11 -1.26 -3.20 120.40 119.10 2nqg s VAL 178 Ca 0.00 0.31 -0.08 0.00 -2.93 0.00 0.00 61.98 59.28 2nqg s VAL 178 Cb 0.00 -3.16 -0.01 0.00 -1.53 0.00 0.00 36.38 31.68 2nqg s VAL 178 CO 0.00 -0.00 0.23 -1.38 -3.33 0.00 0.00 175.10 170.62 2nqg s HIS 179 N -1.38 0.37 0.39 1.54 -3.43 -0.84 -4.44 115.29 107.49 2nqg s HIS 179 Ca 0.69 -0.75 -0.03 0.00 -0.80 0.00 0.00 55.06 54.16 2nqg s HIS 179 Cb -0.36 -0.10 -0.04 0.00 -1.43 0.00 0.00 32.58 30.65 2nqg s HIS 179 CO 0.43 -0.65 0.66 0.45 -2.00 0.00 0.00 174.74 173.63 2nqg s SER 180 N -2.94 6.33 0.54 7.38 0.15 -1.21 -1.13 113.70 122.81 2nqg s SER 180 Ca 0.14 0.73 0.29 0.00 0.70 0.00 0.00 55.95 57.81 2nqg s SER 180 Cb 0.04 -2.16 1.55 0.00 -1.71 0.00 0.00 66.02 63.75 2nqg s SER 180 CO -0.03 -0.39 2.11 0.00 1.20 0.00 0.00 173.24 176.13 2nqg h ALA 181 N 0.76 1.30 -1.81 5.45 0.00 -1.71 -3.37 119.26 119.87 2nqg h ALA 181 Ca -0.48 -0.08 -0.59 0.00 0.00 0.00 0.00 54.91 53.76 2nqg h ALA 181 Cb 1.21 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2nqg h ALA 181 CO 0.63 0.11 0.71 -0.65 0.00 0.00 0.00 179.25 180.05 2nqg s GLN 182 N -4.24 3.54 0.11 0.00 -1.52 -1.26 -4.94 119.66 111.35 2nqg s GLN 182 Ca -0.03 0.20 0.14 0.00 -1.95 0.00 0.00 55.36 53.72 2nqg s GLN 182 Cb 0.13 -3.95 0.63 0.00 -0.22 0.00 0.00 33.01 29.60 2nqg s GLN 182 CO 0.57 -1.36 1.43 0.41 -0.25 0.00 0.00 175.29 176.08 2nqg n GLY 183 N 4.96 -0.90 1.02 3.09 0.00 -1.26 -1.37 105.19 110.72 2nqg n GLY 183 Ca 0.07 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.22 2nqg n GLY 183 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2nqg n ASN 184 N -1.79 3.39 -4.67 1.61 2.04 -1.26 -4.97 115.26 109.61 2nqg n ASN 184 Ca 0.01 -1.97 -0.35 0.00 -0.44 0.00 0.00 54.58 51.84 2nqg n ASN 184 Cb 0.11 -0.33 -0.09 0.00 -2.53 0.00 0.00 39.78 36.94 2nqg n ASN 184 CO 0.00 0.00 0.00 -0.70 -0.44 0.00 0.00 177.26 176.12 2nqg s GLU 185 N -1.08 3.58 0.00 -3.83 2.12 -0.47 -0.89 118.70 118.13 2nqg s GLU 185 Ca 0.36 -0.35 0.00 0.00 0.36 0.00 0.00 54.97 55.34 2nqg s GLU 185 Cb 0.19 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.53 2nqg s GLU 185 CO 0.26 0.47 0.03 1.19 -0.54 0.00 0.00 175.26 176.67 2nqg n PHE 186 N 2.91 0.00 -0.31 5.30 3.72 -0.58 -4.22 117.46 124.28 2nqg n PHE 186 Ca -0.18 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.24 2nqg n PHE 186 Cb 0.53 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.28 2nqg n PHE 186 CO 0.00 0.00 0.00 0.11 -0.05 0.00 0.00 176.76 176.82 2nqg h TRP 187 N 0.00 1.09 -0.03 1.38 5.08 -1.02 -2.09 115.95 120.37 2nqg h TRP 187 Ca 0.00 0.03 -0.22 0.00 1.08 0.00 0.00 58.89 59.78 2nqg h TRP 187 Cb 0.00 -0.36 0.00 0.00 -3.00 0.00 0.00 29.16 25.80 2nqg h TRP 187 CO 0.00 0.61 -0.88 0.66 -1.28 0.00 0.00 178.44 177.55 2nqg h SER 188 N 1.11 0.56 -0.83 0.11 4.64 -1.86 -0.28 113.55 117.00 2nqg h SER 188 Ca 0.37 -0.42 0.04 0.00 -0.47 0.00 0.00 61.79 61.31 2nqg h SER 188 Cb 0.08 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 61.95 2nqg h SER 188 CO -0.12 1.20 0.53 0.00 -0.87 0.00 0.00 176.83 177.57 2nqg h ALA 189 N 0.77 1.09 -0.39 5.18 0.00 -1.70 -1.70 119.26 122.51 2nqg h ALA 189 Ca -0.07 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2nqg h ALA 189 Cb 1.50 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2nqg h ALA 189 CO 0.15 0.34 -0.30 -0.07 0.00 0.00 0.00 179.25 179.38 2nqg h LEU 190 N 1.02 0.94 -0.15 0.00 3.38 -1.23 -2.01 115.31 117.26 2nqg h LEU 190 Ca 0.33 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2nqg h LEU 190 Cb 0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2nqg h LEU 190 CO -0.12 1.18 0.08 0.25 0.09 0.00 0.00 178.44 179.92 2nqg h LEU 191 N 0.71 0.18 -1.05 1.67 5.85 -0.92 -1.98 115.31 119.78 2nqg h LEU 191 Ca 0.07 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.78 2nqg h LEU 191 Cb 0.88 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 2nqg h LEU 191 CO 0.08 0.21 0.63 -0.08 -0.34 0.00 0.00 178.44 178.95 2nqg h GLU 192 N 0.14 1.10 -0.54 1.25 4.81 -1.32 -0.70 114.58 119.31 2nqg h GLU 192 Ca 0.05 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 2nqg h GLU 192 Cb 0.07 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 2nqg h GLU 192 CO -0.01 0.73 0.05 -0.22 -0.73 0.00 0.00 179.01 178.83 2nqg h LYS 193 N 1.14 0.89 -0.36 1.92 3.64 -1.17 -0.44 116.57 122.19 2nqg h LYS 193 Ca 0.42 -0.23 -0.11 0.00 -1.27 0.00 0.00 60.65 59.45 2nqg h LYS 193 Cb 0.18 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2nqg h LYS 193 CO -0.16 0.86 -0.24 0.00 -2.27 0.00 0.00 179.45 177.63 2nqg h ALA 194 N 1.21 0.89 -0.30 5.00 0.00 -0.54 -1.35 119.26 124.17 2nqg h ALA 194 Ca 0.17 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 2nqg h ALA 194 Cb 0.43 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2nqg h ALA 194 CO 0.02 0.62 -0.53 -0.92 0.00 0.00 0.00 179.25 178.44 2nqg h TYR 195 N 0.63 1.09 -0.77 0.00 5.03 -0.90 -2.29 116.97 119.76 2nqg h TYR 195 Ca 0.08 -0.38 0.06 0.00 2.58 0.00 0.00 58.73 61.07 2nqg h TYR 195 Cb 0.74 -0.21 -0.06 0.00 1.55 0.00 0.00 36.73 38.76 2nqg h TYR 195 CO 0.04 1.21 0.46 0.00 -1.32 0.00 0.00 178.16 178.55 2nqg h ALA 196 N 0.71 1.05 -0.33 1.82 0.00 -0.95 -2.90 119.26 118.66 2nqg h ALA 196 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.97 2nqg h ALA 196 Cb 1.13 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 2nqg h ALA 196 CO 0.12 0.18 0.09 -0.22 0.00 0.00 0.00 179.25 179.41 2nqg h LYS 197 N 0.85 0.21 0.00 0.00 3.64 -0.68 0.73 116.57 121.31 2nqg h LYS 197 Ca 0.34 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.66 2nqg h LYS 197 Cb 0.17 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2nqg h LYS 197 CO -0.17 0.14 -0.24 -0.39 -2.27 0.00 0.00 179.45 176.52 2nqg h VAL 198 N 0.21 0.95 -0.01 2.00 -1.51 -1.43 -2.14 116.25 114.34 2nqg h VAL 198 Ca 0.15 -0.87 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 2nqg h VAL 198 Cb 0.15 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 2nqg h VAL 198 CO -0.18 0.23 -0.23 0.59 -1.23 0.00 0.00 177.57 176.75 2nqg n ASN 199 N -3.95 1.13 0.00 4.19 3.02 -0.78 -5.00 115.26 113.88 2nqg n ASN 199 Ca -0.02 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 2nqg n ASN 199 Cb 0.32 0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 2nqg n ASN 199 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nqg n GLY 200 N 1.32 2.91 3.65 7.41 0.00 0.18 -4.84 105.19 115.82 2nqg n GLY 200 Ca 0.13 -0.81 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 2nqg n GLY 200 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nqg s SER 201 N 0.05 -0.25 0.17 1.61 1.04 -0.88 -4.72 113.70 110.73 2nqg s SER 201 Ca 0.00 -0.23 -0.13 0.00 0.48 0.00 0.00 55.95 56.06 2nqg s SER 201 Cb 0.00 0.44 0.07 0.00 0.10 0.00 0.00 66.02 66.64 2nqg s SER 201 CO 0.00 -0.78 1.80 1.88 0.98 0.00 0.00 173.24 177.12 2nqg h TYR 202 N 2.00 0.76 -1.01 5.02 -1.99 -1.20 -3.08 116.97 117.47 2nqg h TYR 202 Ca -0.24 -0.01 0.13 0.00 2.00 0.00 0.00 58.73 60.62 2nqg h TYR 202 Cb 1.24 -0.25 -0.09 0.00 2.00 0.00 0.00 36.73 39.63 2nqg h TYR 202 CO 0.33 0.54 0.63 1.49 -0.00 0.00 0.00 178.16 181.14 2nqg h GLU 203 N 0.77 0.93 -0.30 4.88 4.81 -1.34 0.80 114.58 125.13 2nqg h GLU 203 Ca 0.20 -0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.46 2nqg h GLU 203 Cb 0.01 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 2nqg h GLU 203 CO -0.04 0.62 0.60 0.00 -0.73 0.00 0.00 179.01 179.46 2nqg h ALA 204 N 1.56 1.95 -0.00 2.92 0.00 -1.82 0.57 119.26 124.43 2nqg h ALA 204 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 2nqg h ALA 204 Cb 0.55 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2nqg h ALA 204 CO -0.28 -0.75 -0.22 1.28 0.00 0.00 0.00 179.25 179.27 2nqg n LEU 205 N -3.18 0.57 -4.63 0.00 4.77 0.27 -4.87 117.00 109.94 2nqg n LEU 205 Ca 0.05 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.60 2nqg n LEU 205 Cb 0.72 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2nqg n LEU 205 CO 0.18 0.11 1.25 -0.55 -1.33 0.00 0.00 177.39 177.05 2nqg s SER 206 N -2.66 6.51 0.00 -1.43 0.15 0.19 -4.18 113.70 112.28 2nqg s SER 206 Ca 0.22 1.35 0.00 0.00 0.70 0.00 0.00 55.95 58.22 2nqg s SER 206 Cb 0.19 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2nqg s SER 206 CO 0.54 -1.19 0.00 0.61 1.20 0.00 0.00 173.24 174.40 2nqg n GLY 207 N 4.54 -3.04 0.90 9.45 0.00 -0.38 -5.01 105.19 111.64 2nqg n GLY 207 Ca 0.17 -0.71 -0.01 0.00 0.00 0.00 0.00 46.02 45.47 2nqg n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqg n GLY 208 N 0.15 1.28 3.23 -0.02 0.00 -1.26 -5.08 105.19 103.49 2nqg n GLY 208 Ca 0.00 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 2nqg n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nqg h THR 210 N 5.21 0.55 0.00 0.00 2.02 -1.97 -1.17 112.91 117.55 2nqg h THR 210 Ca -0.30 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 2nqg h THR 210 Cb 1.18 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2nqg h THR 210 CO 0.47 0.11 -0.08 0.28 0.37 0.00 0.00 175.52 176.67 2nqg h SER 211 N 0.60 0.00 0.01 4.18 0.02 -1.95 -1.49 113.55 114.91 2nqg h SER 211 Ca 0.64 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.59 2nqg h SER 211 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2nqg h SER 211 CO -0.47 0.08 -0.00 -0.08 -1.14 0.00 0.00 176.83 175.22 2nqg h GLU 212 N 0.00 -0.01 -0.72 3.45 4.81 -1.61 -1.90 114.58 118.61 2nqg h GLU 212 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2nqg h GLU 212 Cb 0.16 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2nqg h GLU 212 CO 0.01 0.40 0.40 0.00 -0.73 0.00 0.00 179.01 179.09 2nqg h ALA 213 N 0.57 1.36 -0.28 2.92 0.00 -1.53 -2.02 119.26 120.29 2nqg h ALA 213 Ca -0.00 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2nqg h ALA 213 Cb 0.41 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2nqg h ALA 213 CO 0.00 0.53 -0.07 0.74 0.00 0.00 0.00 179.25 180.45 2nqg h PHE 214 N 0.99 -0.16 0.01 0.00 0.04 -1.15 -2.31 116.94 114.37 2nqg h PHE 214 Ca 0.25 0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.08 2nqg h PHE 214 Cb 0.01 0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.24 2nqg h PHE 214 CO 0.01 -0.12 -0.19 0.93 -0.60 0.00 0.00 178.31 178.33 2nqg h GLU 215 N -0.01 -0.31 0.00 1.51 5.08 -1.18 -2.65 114.58 117.03 2nqg h GLU 215 Ca 0.13 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2nqg h GLU 215 Cb 0.21 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2nqg h GLU 215 CO -0.29 -0.20 0.00 -0.44 -1.00 0.00 0.00 179.01 177.08 2nqg h ASP 216 N -0.32 0.00 -0.01 1.42 3.45 -1.12 0.77 116.42 120.62 2nqg h ASP 216 Ca 0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.52 2nqg h ASP 216 Cb 0.39 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.16 2nqg h ASP 216 CO -0.18 0.00 -0.68 0.49 -1.57 0.00 0.00 179.24 177.30 2nqg n PHE 217 N -2.64 0.00 0.00 4.55 3.72 -0.89 0.09 117.46 122.29 2nqg n PHE 217 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2nqg n PHE 217 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 2nqg n PHE 217 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2nqg n THR 218 N -0.86 0.00 -1.11 4.37 -2.24 -0.27 -4.84 114.28 109.33 2nqg n THR 218 Ca 0.05 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.80 2nqg n THR 218 Cb 0.34 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 2nqg n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nqg n GLY 219 N 1.60 0.51 0.58 3.38 0.00 0.25 -5.01 105.19 106.50 2nqg n GLY 219 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 2nqg n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nqg n GLY 220 N -0.52 0.44 3.55 -0.02 0.00 -1.26 -5.08 105.19 102.29 2nqg n GLY 220 Ca -0.04 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 2nqg n GLY 220 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nqg s VAL 221 N -0.44 4.87 0.07 1.61 1.01 -0.82 -4.79 120.40 121.90 2nqg s VAL 221 Ca 0.10 0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 2nqg s VAL 221 Cb -0.01 -3.29 -0.06 0.00 0.00 0.00 0.00 36.38 33.03 2nqg s VAL 221 CO 0.07 0.32 0.46 0.42 0.00 0.00 0.00 175.10 176.36 2nqg s THR 222 N 1.48 4.97 0.06 3.92 -4.23 -1.26 -1.23 115.64 119.35 2nqg s THR 222 Ca 0.06 0.75 0.04 0.00 -1.18 0.00 0.00 61.69 61.37 2nqg s THR 222 Cb -0.15 -3.72 -0.03 0.00 1.34 0.00 0.00 72.50 69.95 2nqg s THR 222 CO 0.06 0.40 -0.11 -1.83 -0.54 0.00 0.00 174.62 172.60 2nqg s GLU 223 N -1.58 0.69 0.23 3.99 -1.05 0.33 -5.00 118.70 116.31 2nqg s GLU 223 Ca 0.31 -0.86 0.09 0.00 -0.15 0.00 0.00 54.97 54.36 2nqg s GLU 223 Cb -0.16 -0.59 -0.05 0.00 -0.44 0.00 0.00 34.13 32.90 2nqg s GLU 223 CO 0.17 0.12 -0.17 1.67 0.95 0.00 0.00 175.26 178.01 2nqg s TRP 224 N -1.31 1.92 -0.05 4.83 1.48 -1.26 -0.72 118.94 123.82 2nqg s TRP 224 Ca -0.06 -0.48 0.02 0.00 -1.06 0.00 0.00 56.10 54.53 2nqg s TRP 224 Cb -0.10 -0.87 0.01 0.00 -1.16 0.00 0.00 33.47 31.35 2nqg s TRP 224 CO 0.01 0.48 -0.11 0.71 -4.06 0.00 0.00 176.95 173.98 2nqg s TYR 225 N -2.77 1.29 -0.61 1.66 2.02 0.19 -4.99 117.35 114.14 2nqg s TYR 225 Ca 0.25 -0.42 -0.26 0.00 -0.37 0.00 0.00 57.07 56.28 2nqg s TYR 225 Cb -0.02 -0.94 0.04 0.00 -0.40 0.00 0.00 41.96 40.64 2nqg s TYR 225 CO 0.10 -0.21 1.08 0.34 -1.57 0.00 0.00 175.55 175.29 2nqg s ASP 226 N 0.48 6.31 0.62 2.29 3.68 -1.26 -2.05 116.67 126.74 2nqg s ASP 226 Ca -0.10 -0.33 0.39 0.00 2.13 0.00 0.00 52.55 54.64 2nqg s ASP 226 Cb -0.13 -2.49 2.00 0.00 -1.45 0.00 0.00 42.92 40.85 2nqg s ASP 226 CO 0.02 -1.44 2.23 -0.07 0.13 0.00 0.00 175.17 176.04 2nqg h LEU 227 N 11.67 0.00 -0.17 -1.34 3.38 -1.55 0.37 115.31 127.68 2nqg h LEU 227 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2nqg h LEU 227 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2nqg h LEU 227 CO 1.16 0.01 0.00 1.56 0.09 0.00 0.00 178.44 181.27 2nqg h GLN 228 N 0.00 0.00 -1.28 1.13 7.50 -1.80 -3.21 115.11 117.45 2nqg h GLN 228 Ca -0.00 0.00 -0.57 0.00 0.50 0.00 0.00 58.65 58.58 2nqg h GLN 228 Cb 0.18 0.00 -0.42 0.00 0.05 0.00 0.00 27.48 27.29 2nqg h GLN 228 CO 0.00 0.00 -0.78 1.63 -1.50 0.00 0.00 178.83 178.19 2nqg n LYS 229 N -2.92 3.38 -2.15 1.46 5.02 0.09 -5.09 118.16 117.94 2nqg n LYS 229 Ca 0.04 -4.36 -0.41 0.00 -2.02 0.00 0.00 58.31 51.56 2nqg n LYS 229 Cb 0.48 -2.21 -0.02 0.00 -0.02 0.00 0.00 35.03 33.25 2nqg n LYS 229 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nqg s ALA 230 N -3.55 3.49 0.76 7.82 0.00 -0.98 -4.78 121.76 124.53 2nqg s ALA 230 Ca 0.48 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 53.55 2nqg s ALA 230 Cb 0.40 -3.47 0.05 0.00 0.00 0.00 0.00 23.12 20.11 2nqg s ALA 230 CO -0.12 -0.59 1.10 -1.25 0.00 0.00 0.00 175.76 174.90 2nqg s PRO 231 N -1.69 2.25 0.53 0.00 0.04 -1.26 -4.92 135.00 129.95 2nqg s PRO 231 Ca 0.49 1.25 0.18 0.00 0.04 0.00 0.00 61.00 62.96 2nqg s PRO 231 Cb -0.39 -1.89 1.35 0.00 0.04 0.00 0.00 34.50 33.61 2nqg s PRO 231 CO 0.51 -1.66 2.16 0.66 0.04 0.00 0.00 177.00 178.72 2nqg h SER 232 N -0.97 0.00 -0.59 6.66 4.64 -2.04 -2.49 113.55 118.76 2nqg h SER 232 Ca -0.44 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.73 2nqg h SER 232 Cb 1.24 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.24 2nqg h SER 232 CO 0.51 0.00 0.19 -0.90 -0.87 0.00 0.00 176.83 175.76 2nqg n ASP 233 N -4.43 4.43 -0.18 4.97 5.75 -1.26 -4.62 116.55 121.21 2nqg n ASP 233 Ca -0.03 -2.95 -0.06 0.00 -0.01 0.00 0.00 54.79 51.73 2nqg n ASP 233 Cb 0.09 -0.70 0.10 0.00 -1.03 0.00 0.00 41.12 39.58 2nqg n ASP 233 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2nqg h LEU 234 N 2.46 0.93 -1.18 -2.12 5.85 -1.81 -1.16 115.31 118.28 2nqg h LEU 234 Ca 0.18 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2nqg h LEU 234 Cb 2.00 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 42.73 2nqg h LEU 234 CO 0.58 0.95 0.57 0.22 -0.34 0.00 0.00 178.44 180.42 2nqg h TYR 235 N 0.91 1.03 -0.65 1.25 5.03 -1.85 -2.13 116.97 120.55 2nqg h TYR 235 Ca 0.18 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.51 2nqg h TYR 235 Cb 0.44 -0.34 -0.03 0.00 1.55 0.00 0.00 36.73 38.35 2nqg h TYR 235 CO 0.03 0.58 0.40 1.96 -1.32 0.00 0.00 178.16 179.81 2nqg h GLN 236 N 1.05 0.87 -0.87 1.82 1.08 -1.57 -1.77 115.11 115.71 2nqg h GLN 236 Ca 0.35 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.46 2nqg h GLN 236 Cb 0.08 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.28 2nqg h GLN 236 CO -0.11 0.62 0.46 0.82 -0.95 0.00 0.00 178.83 179.66 2nqg h ILE 237 N 0.88 1.26 0.27 2.54 2.04 -1.10 -0.27 117.51 123.12 2nqg h ILE 237 Ca 0.23 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 2nqg h ILE 237 Cb -0.04 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 2nqg h ILE 237 CO -0.05 0.30 -0.13 0.40 0.00 0.00 0.00 178.15 178.67 2nqg h ILE 238 N 1.22 0.76 -0.72 -0.67 2.04 -1.16 0.35 117.51 119.34 2nqg h ILE 238 Ca 0.30 -0.63 0.15 0.00 1.00 0.00 0.00 64.86 65.68 2nqg h ILE 238 Cb 0.06 1.09 -0.10 0.00 -0.74 0.00 0.00 36.82 37.13 2nqg h ILE 238 CO -0.05 0.13 0.22 -0.07 0.00 0.00 0.00 178.15 178.38 2nqg h LEU 239 N -0.71 0.11 -0.56 1.44 3.38 -1.21 0.12 115.31 117.88 2nqg h LEU 239 Ca -0.04 0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 2nqg h LEU 239 Cb 0.48 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2nqg h LEU 239 CO 0.06 0.02 -0.56 0.07 0.09 0.00 0.00 178.44 178.12 2nqg h LYS 240 N 0.33 0.46 -0.15 1.13 2.10 -0.97 -1.56 116.57 117.91 2nqg h LYS 240 Ca 0.40 -0.30 -0.02 0.00 -2.00 0.00 0.00 60.65 58.74 2nqg h LYS 240 Cb 0.65 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.01 2nqg h LYS 240 CO -0.45 0.90 0.03 0.00 -2.00 0.00 0.00 179.45 177.92 2nqg h ALA 241 N 1.04 0.20 -0.68 0.07 0.00 -0.26 -2.65 119.26 116.98 2nqg h ALA 241 Ca 0.00 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.80 2nqg h ALA 241 Cb 1.09 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 2nqg h ALA 241 CO 0.10 -0.15 0.40 -0.07 0.00 0.00 0.00 179.25 179.53 2nqg h LEU 242 N 0.03 0.63 -0.37 0.00 3.38 -0.77 -2.26 115.31 115.96 2nqg h LEU 242 Ca 0.05 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2nqg h LEU 242 Cb 0.29 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.84 2nqg h LEU 242 CO 0.00 0.42 -0.52 -0.08 0.09 0.00 0.00 178.44 178.36 2nqg h GLU 243 N 0.77 -0.36 -0.17 1.13 4.81 -1.16 -2.65 114.58 116.94 2nqg h GLU 243 Ca 0.29 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2nqg h GLU 243 Cb 0.11 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2nqg h GLU 243 CO -0.14 -0.24 0.00 2.89 -0.73 0.00 0.00 179.01 180.79 2nqg n ARG 244 N -5.17 1.20 -1.03 1.92 1.85 -1.01 -4.90 116.66 109.53 2nqg n ARG 244 Ca -0.03 -0.28 -0.01 0.00 -1.00 0.00 0.00 57.85 56.53 2nqg n ARG 244 Cb 0.32 -1.12 -0.00 0.00 -1.05 0.00 0.00 32.46 30.61 2nqg n ARG 244 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2nqg n GLY 245 N 0.56 0.49 3.72 2.89 0.00 -0.96 -4.93 105.19 106.96 2nqg n GLY 245 Ca 0.03 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 2nqg n GLY 245 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nqg s SER 246 N -2.44 3.97 -0.15 1.61 0.01 -0.89 -4.78 113.70 111.02 2nqg s SER 246 Ca 0.00 2.18 -0.07 0.00 1.31 0.00 0.00 55.95 59.37 2nqg s SER 246 Cb 0.00 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 2nqg s SER 246 CO 0.00 -2.41 0.08 -0.76 0.41 0.00 0.00 173.24 170.56 2nqg s LEU 247 N -5.68 3.95 -0.05 2.44 1.43 -0.39 -4.66 118.68 115.71 2nqg s LEU 247 Ca 0.69 0.20 0.03 0.00 -1.03 0.00 0.00 54.13 54.01 2nqg s LEU 247 Cb -0.24 -1.98 0.01 0.00 0.03 0.00 0.00 46.19 44.01 2nqg s LEU 247 CO 0.50 0.26 -0.13 -0.76 0.23 0.00 0.00 176.35 176.46 2nqg s LEU 248 N -0.17 1.74 0.17 1.79 1.02 -1.26 -0.24 118.68 121.73 2nqg s LEU 248 Ca 0.08 -0.29 0.02 0.00 0.02 0.00 0.00 54.13 53.95 2nqg s LEU 248 Cb -0.12 -0.81 -0.05 0.00 0.02 0.00 0.00 46.19 45.24 2nqg s LEU 248 CO 0.01 0.07 0.01 -0.83 0.02 0.00 0.00 176.35 175.63 2nqg s GLY 249 N 0.41 1.19 0.13 -3.19 0.00 -0.53 -1.20 107.32 104.12 2nqg s GLY 249 Ca -0.10 -1.58 -0.05 0.00 0.00 0.00 0.00 44.72 43.00 2nqg s GLY 249 CO 0.03 -1.51 0.15 0.00 0.00 0.00 0.00 173.10 171.77 2nqg s SER 251 N -2.97 -0.53 -0.26 0.00 1.04 -0.81 -0.59 113.70 109.58 2nqg s SER 251 Ca 0.16 0.05 -0.04 0.00 0.48 0.00 0.00 55.95 56.60 2nqg s SER 251 Cb 0.06 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.74 2nqg s SER 251 CO -0.03 -0.88 -0.01 -0.63 0.98 0.00 0.00 173.24 172.68 2nqg s ILE 252 N -3.45 3.33 0.33 -1.02 1.01 -1.26 -1.67 121.20 118.46 2nqg s ILE 252 Ca 0.01 -0.83 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 2nqg s ILE 252 Cb -0.01 -2.67 -0.11 0.00 0.01 0.00 0.00 42.46 39.67 2nqg s ILE 252 CO -0.11 0.19 1.56 -3.20 0.00 0.00 0.00 174.94 173.38 2nqg n ASN 253 N 4.76 3.87 -4.48 3.58 5.15 -1.26 -0.04 115.26 126.84 2nqg n ASN 253 Ca -0.16 1.18 -0.43 0.00 -0.60 0.00 0.00 54.58 54.57 2nqg n ASN 253 Cb 0.48 -1.61 -0.04 0.00 -0.53 0.00 0.00 39.78 38.08 2nqg n ASN 253 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2nqg s ILE 254 N -0.44 4.38 -1.16 -1.44 1.01 -1.26 -4.76 121.20 117.54 2nqg s ILE 254 Ca 0.60 -0.09 0.27 0.00 0.00 0.00 0.00 60.65 61.43 2nqg s ILE 254 Cb -0.48 -4.60 0.18 0.00 0.01 0.00 0.00 42.46 37.57 2nqg s ILE 254 CO 0.54 -1.27 1.67 -1.20 0.00 0.00 0.00 174.94 174.69 2nqg n SER 255 N 7.51 0.36 0.00 3.58 7.64 -1.26 -4.09 113.62 127.36 2nqg n SER 255 Ca -0.02 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2nqg n SER 255 Cb 0.46 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 2nqg n SER 255 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2nqg n ASP 256 N -1.36 0.68 0.00 6.43 4.64 -1.26 -5.10 116.55 120.58 2nqg n ASP 256 Ca 0.08 -1.29 0.00 0.00 -1.38 0.00 0.00 54.79 52.20 2nqg n ASP 256 Cb 0.33 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.41 2nqg n ASP 256 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 2nqg n ILE 257 N -0.15 0.00 -2.73 5.18 2.08 -1.26 -4.42 119.36 118.06 2nqg n ILE 257 Ca 0.00 0.00 -0.04 0.00 0.56 0.00 0.00 62.75 63.27 2nqg n ILE 257 Cb 0.35 0.00 0.08 0.00 -0.75 0.00 0.00 39.64 39.32 2nqg n ILE 257 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 2nqg n ARG 258 N 0.00 1.41 -0.32 0.38 1.85 -1.26 -4.90 116.66 113.82 2nqg n ARG 258 Ca 0.00 -2.44 -0.04 0.00 -1.00 0.00 0.00 57.85 54.36 2nqg n ARG 258 Cb 0.00 -0.62 0.07 0.00 -1.05 0.00 0.00 32.46 30.85 2nqg n ARG 258 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2nqg n ASP 259 N -0.79 2.96 -0.24 2.89 8.00 -1.26 -2.58 116.55 125.53 2nqg n ASP 259 Ca -0.02 -2.39 0.00 0.00 0.71 0.00 0.00 54.79 53.08 2nqg n ASP 259 Cb 0.84 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 2nqg n ASP 259 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2nqg n LEU 260 N 0.08 0.00 -0.00 0.64 4.32 -1.26 -5.10 117.00 115.68 2nqg n LEU 260 Ca 0.14 -0.59 0.00 0.00 -0.02 0.00 0.00 56.01 55.54 2nqg n LEU 260 Cb 0.74 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.54 2nqg n LEU 260 CO 0.15 0.37 -0.00 -0.62 -1.22 0.00 0.00 177.39 176.07 2nqg n GLU 261 N 0.00 -0.00 -0.02 3.23 -0.58 -1.06 -4.69 120.64 117.51 2nqg n GLU 261 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2nqg n GLU 261 Cb 0.56 -0.01 0.31 0.00 -0.57 0.00 0.00 31.44 31.73 2nqg n GLU 261 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2nqg h ALA 262 N -0.00 1.42 -2.97 0.62 0.00 -1.91 -3.44 119.26 112.98 2nqg h ALA 262 Ca -0.00 -0.16 -0.58 0.00 0.00 0.00 0.00 54.91 54.16 2nqg h ALA 262 Cb 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 17.79 17.54 2nqg h ALA 262 CO 0.00 0.42 -0.21 0.42 0.00 0.00 0.00 179.25 179.89 2nqg s ILE 263 N -5.13 5.22 0.88 0.00 1.01 -1.26 0.09 121.20 122.01 2nqg s ILE 263 Ca -0.08 0.81 -0.13 0.00 0.00 0.00 0.00 60.65 61.25 2nqg s ILE 263 Cb 0.16 -3.75 0.16 0.00 0.01 0.00 0.00 42.46 39.04 2nqg s ILE 263 CO 0.76 0.36 1.23 0.42 0.00 0.00 0.00 174.94 177.72 2nqg s THR 264 N 0.49 2.04 0.38 2.92 -4.23 0.57 -4.92 115.64 112.87 2nqg s THR 264 Ca 0.23 -0.09 0.17 0.00 -1.18 0.00 0.00 61.69 60.82 2nqg s THR 264 Cb -0.14 -2.95 0.16 0.00 1.34 0.00 0.00 72.50 70.91 2nqg s THR 264 CO 0.08 0.00 1.91 -0.26 -0.54 0.00 0.00 174.62 175.81 2nqg h PHE 265 N -1.32 0.00 -0.45 3.99 0.04 -1.91 -2.58 116.94 114.70 2nqg h PHE 265 Ca -0.44 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.33 2nqg h PHE 265 Cb 1.26 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.41 2nqg h PHE 265 CO -0.63 0.27 0.00 1.63 -0.60 0.00 0.00 178.31 178.98 2nqg n LYS 266 N -3.98 3.12 -1.79 1.51 4.76 -1.26 -4.93 118.16 115.59 2nqg n LYS 266 Ca -0.02 -2.08 -0.08 0.00 -2.87 0.00 0.00 58.31 53.26 2nqg n LYS 266 Cb 0.34 -1.78 -0.02 0.00 -1.84 0.00 0.00 35.03 31.73 2nqg n LYS 266 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2nqg n ASN 267 N 0.68 -3.29 -4.88 4.39 5.15 -0.97 -0.45 115.26 115.89 2nqg n ASN 267 Ca 0.19 0.07 -0.33 0.00 -0.60 0.00 0.00 54.58 53.91 2nqg n ASN 267 Cb 0.72 -2.17 -0.05 0.00 -0.53 0.00 0.00 39.78 37.75 2nqg n ASN 267 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2nqg s LEU 268 N -2.10 4.27 -0.22 1.20 1.43 -1.26 -3.99 118.68 118.01 2nqg s LEU 268 Ca 0.00 0.72 -0.09 0.00 -1.03 0.00 0.00 54.13 53.73 2nqg s LEU 268 Cb 0.00 -3.29 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 2nqg s LEU 268 CO 0.00 0.06 0.11 -0.69 0.23 0.00 0.00 176.35 176.06 2nqg s VAL 269 N -1.61 4.95 0.28 -1.59 1.01 -1.26 -0.32 120.40 121.86 2nqg s VAL 269 Ca 0.40 0.04 -0.17 0.00 0.00 0.00 0.00 61.98 62.24 2nqg s VAL 269 Cb -0.12 -3.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.88 2nqg s VAL 269 CO 0.22 0.38 0.74 -0.13 0.00 0.00 0.00 175.10 176.31 2nqg s ARG 270 N 0.97 4.12 -1.11 2.72 0.52 0.11 -4.01 118.95 122.27 2nqg s ARG 270 Ca 0.06 0.78 -0.07 0.00 -0.52 0.00 0.00 55.73 55.97 2nqg s ARG 270 Cb -0.14 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.73 2nqg s ARG 270 CO 0.03 0.25 0.97 0.41 0.02 0.00 0.00 175.30 176.99 2nqg n GLY 271 N 0.09 -0.28 2.83 -3.53 0.00 0.95 -4.91 105.19 100.35 2nqg n GLY 271 Ca 0.01 0.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.96 2nqg n GLY 271 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2nqg s HIS 272 N -3.26 -0.12 0.04 1.61 5.04 -1.26 -5.03 115.29 112.32 2nqg s HIS 272 Ca 0.48 0.46 -0.31 0.00 -1.54 0.00 0.00 55.06 54.16 2nqg s HIS 272 Cb -0.21 -0.23 -0.06 0.00 0.04 0.00 0.00 32.58 32.12 2nqg s HIS 272 CO 0.60 -0.20 1.24 0.00 -2.34 0.00 0.00 174.74 174.03 2nqg s ALA 273 N 1.76 3.45 0.11 1.58 0.00 -1.26 -4.43 121.76 122.97 2nqg s ALA 273 Ca -0.02 0.85 0.06 0.00 0.00 0.00 0.00 51.96 52.85 2nqg s ALA 273 Cb -0.12 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.48 2nqg s ALA 273 CO -0.05 -0.55 -0.06 0.71 0.00 0.00 0.00 175.76 175.81 2nqg s TYR 274 N 1.37 2.82 0.03 0.00 1.51 0.25 -4.43 117.35 118.90 2nqg s TYR 274 Ca 0.59 -0.12 -0.19 0.00 -1.01 0.00 0.00 57.07 56.35 2nqg s TYR 274 Cb -0.30 -1.46 -0.06 0.00 -0.11 0.00 0.00 41.96 40.04 2nqg s TYR 274 CO 0.28 0.45 0.54 -1.12 -1.11 0.00 0.00 175.55 174.59 2nqg s SER 275 N -2.32 6.97 -0.24 2.29 0.01 -0.79 -1.29 113.70 118.32 2nqg s SER 275 Ca 0.23 1.15 -0.13 0.00 1.31 0.00 0.00 55.95 58.51 2nqg s SER 275 Cb -0.11 -2.34 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2nqg s SER 275 CO 0.16 0.22 0.28 -0.69 0.41 0.00 0.00 173.24 173.62 2nqg s VAL 276 N -0.74 5.27 0.00 3.43 1.01 -0.34 -0.43 120.40 128.60 2nqg s VAL 276 Ca 0.28 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.68 2nqg s VAL 276 Cb -0.18 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2nqg s VAL 276 CO 0.17 0.27 0.00 0.35 0.00 0.00 0.00 175.10 175.89 2nqg n THR 277 N 4.54 0.00 -3.58 3.92 -2.24 0.86 -4.49 114.28 113.28 2nqg n THR 277 Ca -0.12 -0.45 -0.06 0.00 -2.27 0.00 0.00 64.05 61.15 2nqg n THR 277 Cb 0.51 0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 69.70 2nqg n THR 277 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2nqg s ASP 278 N -1.00 -0.27 -0.14 3.42 -1.08 -1.06 -4.96 116.67 111.58 2nqg s ASP 278 Ca 0.00 -0.10 -0.06 0.00 -0.52 0.00 0.00 52.55 51.87 2nqg s ASP 278 Cb 0.00 0.36 0.06 0.00 -1.46 0.00 0.00 42.92 41.89 2nqg s ASP 278 CO 0.00 -0.62 0.31 0.00 0.52 0.00 0.00 175.17 175.38 2nqg s ALA 279 N -3.03 -0.74 0.04 3.66 0.00 -1.26 -1.01 121.76 119.42 2nqg s ALA 279 Ca 0.08 1.16 -0.13 0.00 0.00 0.00 0.00 51.96 53.07 2nqg s ALA 279 Cb -0.01 -0.92 0.02 0.00 0.00 0.00 0.00 23.12 22.21 2nqg s ALA 279 CO -0.06 -0.43 0.28 0.15 0.00 0.00 0.00 175.76 175.70 2nqg s LYS 280 N 1.86 0.77 -0.10 0.00 -0.14 -0.90 -4.97 119.74 116.26 2nqg s LYS 280 Ca -0.05 -0.51 0.00 0.00 -1.36 0.00 0.00 55.97 54.05 2nqg s LYS 280 Cb -0.11 0.33 -0.02 0.00 -1.68 0.00 0.00 37.83 36.35 2nqg s LYS 280 CO -0.10 -0.24 -0.11 -0.65 -0.76 0.00 0.00 175.35 173.49 2nqg s GLN 281 N -2.47 3.11 0.16 1.68 -0.21 -1.26 -0.33 119.66 120.34 2nqg s GLN 281 Ca -0.06 -0.64 0.09 0.00 0.02 0.00 0.00 55.36 54.77 2nqg s GLN 281 Cb -0.01 -2.60 -0.04 0.00 1.00 0.00 0.00 33.01 31.36 2nqg s GLN 281 CO -0.03 0.39 -0.21 0.14 -2.12 0.00 0.00 175.29 173.46 2nqg s VAL 282 N -0.09 1.96 -0.49 1.09 -7.23 -0.40 -4.95 120.40 110.28 2nqg s VAL 282 Ca -0.01 -1.86 -0.19 0.00 -1.81 0.00 0.00 61.98 58.11 2nqg s VAL 282 Cb -0.14 -1.87 0.05 0.00 0.56 0.00 0.00 36.38 34.99 2nqg s VAL 282 CO 0.03 -0.18 0.63 -0.89 -0.31 0.00 0.00 175.10 174.38 2nqg s THR 283 N -1.70 4.86 -0.35 5.32 2.01 -1.26 -0.26 115.64 124.25 2nqg s THR 283 Ca 0.15 -0.36 -0.09 0.00 0.31 0.00 0.00 61.69 61.70 2nqg s THR 283 Cb -0.07 -4.28 0.03 0.00 0.01 0.00 0.00 72.50 68.19 2nqg s THR 283 CO 0.07 -0.77 0.15 -0.47 -0.69 0.00 0.00 174.62 172.91 2nqg s TYR 284 N 2.69 3.24 -1.22 4.92 6.14 0.52 -3.95 117.35 129.70 2nqg s TYR 284 Ca 0.17 -1.19 -0.31 0.00 0.64 0.00 0.00 57.07 56.38 2nqg s TYR 284 Cb -0.18 -2.35 0.03 0.00 0.42 0.00 0.00 41.96 39.88 2nqg s TYR 284 CO 0.13 -0.68 0.68 1.04 0.64 0.00 0.00 175.55 177.36 2nqg n GLN 285 N 4.90 -0.48 -0.30 4.97 6.02 -0.77 -1.52 117.38 130.20 2nqg n GLN 285 Ca -0.12 0.15 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2nqg n GLN 285 Cb 0.45 -2.88 0.00 0.00 1.02 0.00 0.00 30.24 28.84 2nqg n GLN 285 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nqg n GLY 286 N -2.04 1.53 3.58 1.08 0.00 -1.26 -4.99 105.19 103.08 2nqg n GLY 286 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 2nqg n GLY 286 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2nqg s GLN 287 N -0.12 2.54 0.13 1.61 0.74 -0.57 -5.05 119.66 118.93 2nqg s GLN 287 Ca 0.00 -0.72 -0.31 0.00 0.05 0.00 0.00 55.36 54.38 2nqg s GLN 287 Cb 0.00 -2.49 -0.08 0.00 1.10 0.00 0.00 33.01 31.55 2nqg s GLN 287 CO 0.00 0.60 1.36 0.50 -0.55 0.00 0.00 175.29 177.20 2nqg s ARG 288 N -1.34 4.34 -0.13 1.67 3.52 -1.26 0.20 118.95 125.96 2nqg s ARG 288 Ca 0.16 2.05 0.02 0.00 -0.13 0.00 0.00 55.73 57.83 2nqg s ARG 288 Cb -0.11 -3.24 0.01 0.00 -1.56 0.00 0.00 34.95 30.05 2nqg s ARG 288 CO 0.07 -0.38 -0.17 0.08 -0.81 0.00 0.00 175.30 174.08 2nqg s VAL 289 N 0.88 1.70 -0.14 7.11 1.01 0.64 -4.87 120.40 126.72 2nqg s VAL 289 Ca 0.62 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 2nqg s VAL 289 Cb -0.36 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 2nqg s VAL 289 CO 0.32 0.48 1.31 0.20 0.00 0.00 0.00 175.10 177.41 2nqg s ASN 290 N 1.02 6.91 0.24 3.32 0.02 -1.26 -1.28 114.94 123.91 2nqg s ASN 290 Ca -0.04 1.77 0.08 0.00 -1.02 0.00 0.00 52.86 53.64 2nqg s ASN 290 Cb -0.15 -2.54 -0.04 0.00 0.02 0.00 0.00 41.25 38.55 2nqg s ASN 290 CO -0.04 -0.78 0.10 -0.76 0.02 0.00 0.00 177.10 175.64 2nqg s LEU 291 N 3.51 3.54 0.01 0.60 1.43 0.55 -1.15 118.68 127.18 2nqg s LEU 291 Ca 0.57 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.29 2nqg s LEU 291 Cb -0.23 -2.10 -0.01 0.00 0.03 0.00 0.00 46.19 43.88 2nqg s LEU 291 CO 0.17 0.01 -0.02 -0.51 0.23 0.00 0.00 176.35 176.22 2nqg s ILE 292 N -2.09 0.14 -0.09 -0.59 2.07 -0.50 -2.11 121.20 118.03 2nqg s ILE 292 Ca 0.31 -0.33 0.04 0.00 -1.41 0.00 0.00 60.65 59.27 2nqg s ILE 292 Cb -0.08 -0.17 -0.00 0.00 0.13 0.00 0.00 42.46 42.34 2nqg s ILE 292 CO 0.22 -0.12 -0.23 -0.60 -1.91 0.00 0.00 174.94 172.30 2nqg s ARG 293 N -0.47 2.84 0.14 3.50 3.52 -0.18 -1.13 118.95 127.18 2nqg s ARG 293 Ca -0.04 -0.85 0.03 0.00 -0.13 0.00 0.00 55.73 54.74 2nqg s ARG 293 Cb -0.03 -2.20 -0.04 0.00 -1.56 0.00 0.00 34.95 31.11 2nqg s ARG 293 CO -0.00 0.22 -0.06 -1.64 -0.81 0.00 0.00 175.30 173.00 2nqg s MET 294 N 0.25 1.03 -0.09 5.12 -1.94 -0.69 -0.10 119.30 122.87 2nqg s MET 294 Ca -0.15 -1.45 0.00 0.00 -1.71 0.00 0.00 55.69 52.38 2nqg s MET 294 Cb -0.17 -0.42 0.02 0.00 2.01 0.00 0.00 34.83 36.28 2nqg s MET 294 CO 0.07 -0.01 -0.07 0.50 -0.01 0.00 0.00 175.02 175.50 2nqg s ARG 295 N -3.82 1.31 -0.05 2.03 3.52 0.43 -0.89 118.95 121.49 2nqg s ARG 295 Ca 0.18 -0.21 -0.30 0.00 -0.13 0.00 0.00 55.73 55.27 2nqg s ARG 295 Cb 0.04 -1.35 -0.05 0.00 -1.56 0.00 0.00 34.95 32.04 2nqg s ARG 295 CO 0.00 -0.19 1.49 1.21 -0.81 0.00 0.00 175.30 177.00 2nqg s ASN 296 N 1.44 6.78 0.36 -2.12 3.84 0.48 -1.89 114.94 123.83 2nqg s ASN 296 Ca -0.01 2.10 0.25 0.00 0.21 0.00 0.00 52.86 55.41 2nqg s ASN 296 Cb -0.13 -2.55 1.27 0.00 -0.55 0.00 0.00 41.25 39.30 2nqg s ASN 296 CO -0.04 -0.82 1.77 1.55 -2.79 0.00 0.00 177.10 176.77 2nqg h PRO 297 N 8.60 0.00 -0.96 0.43 0.13 -1.86 0.20 132.00 138.53 2nqg h PRO 297 Ca -0.36 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 65.04 2nqg h PRO 297 Cb 1.16 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 2nqg h PRO 297 CO 0.94 0.00 0.69 -1.49 -0.23 0.00 0.00 178.00 177.90 2nqg h TRP 298 N 0.00 0.07 -0.01 1.56 6.55 -1.89 0.24 115.95 122.47 2nqg h TRP 298 Ca 0.00 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.84 2nqg h TRP 298 Cb 0.12 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.40 2nqg h TRP 298 CO 0.00 0.01 -0.00 0.41 -1.05 0.00 0.00 178.44 177.81 2nqg n GLY 299 N -1.70 0.47 3.70 1.49 0.00 0.71 -4.19 105.19 105.66 2nqg n GLY 299 Ca 0.20 -0.26 -0.04 0.00 0.00 0.00 0.00 46.02 45.92 2nqg n GLY 299 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2nqg s GLU 300 N -0.56 1.07 -0.06 1.61 -1.05 -1.26 -3.07 118.70 115.39 2nqg s GLU 300 Ca 0.00 -0.56 -0.01 0.00 -0.15 0.00 0.00 54.97 54.24 2nqg s GLU 300 Cb 0.00 0.39 0.01 0.00 -0.44 0.00 0.00 34.13 34.08 2nqg s GLU 300 CO 0.00 -0.49 0.03 0.28 0.95 0.00 0.00 175.26 176.03 2nqg n VAL 301 N -0.43 -4.91 -4.34 1.83 0.31 -1.26 -4.53 118.33 105.00 2nqg n VAL 301 Ca -0.07 0.56 -0.25 0.00 -0.01 0.00 0.00 64.34 64.58 2nqg n VAL 301 Cb 0.61 -4.50 -0.12 0.00 -0.91 0.00 0.00 33.84 28.92 2nqg n VAL 301 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2nqg s GLU 302 N -0.64 1.27 0.08 5.55 2.02 -1.26 -4.82 118.70 120.91 2nqg s GLU 302 Ca -0.03 -1.32 -0.33 0.00 0.02 0.00 0.00 54.97 53.30 2nqg s GLU 302 Cb 0.00 -1.52 -0.18 0.00 0.10 0.00 0.00 34.13 32.53 2nqg s GLU 302 CO 0.19 0.34 0.79 1.87 0.02 0.00 0.00 175.26 178.47 2nqg n TRP 303 N 0.70 0.14 -1.04 1.61 -0.00 -1.26 -4.67 117.44 112.92 2nqg n TRP 303 Ca -0.16 0.97 0.09 0.00 -0.00 0.00 0.00 57.50 58.40 2nqg n TRP 303 Cb 0.55 -1.94 0.19 0.00 -0.00 0.00 0.00 31.31 30.11 2nqg n TRP 303 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 2nqg n LYS 304 N 1.22 1.98 -0.43 5.87 4.76 0.41 -4.66 118.16 127.31 2nqg n LYS 304 Ca 0.18 -2.70 0.00 0.00 -2.87 0.00 0.00 58.31 52.92 2nqg n LYS 304 Cb 0.15 -1.65 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 2nqg n LYS 304 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2nqg n GLY 305 N -1.05 0.57 3.64 0.72 0.00 -1.26 -4.92 105.19 102.90 2nqg n GLY 305 Ca 0.18 -1.91 -0.45 0.00 0.00 0.00 0.00 46.02 43.85 2nqg n GLY 305 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2nqg n PRO 306 N -0.79 1.70 -0.30 1.61 -0.02 -1.26 -1.98 135.00 133.97 2nqg n PRO 306 Ca 0.00 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2nqg n PRO 306 Cb 0.00 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 2nqg n PRO 306 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2nqg n TRP 307 N 1.12 0.00 -0.79 6.00 7.02 -1.26 -4.36 117.44 125.17 2nqg n TRP 307 Ca 0.11 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.26 2nqg n TRP 307 Cb 0.31 -0.03 0.12 0.00 -2.42 0.00 0.00 31.31 29.29 2nqg n TRP 307 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2nqg n SER 308 N 0.00 -2.35 -0.26 -0.99 3.41 -0.84 -4.02 113.62 108.57 2nqg n SER 308 Ca 0.00 0.24 0.21 0.00 -0.26 0.00 0.00 58.87 59.06 2nqg n SER 308 Cb 0.00 -1.14 0.54 0.00 -0.26 0.00 0.00 64.21 63.35 2nqg n SER 308 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2nqg h ASP 309 N -1.62 0.37 -0.30 4.04 3.45 -1.89 -2.29 116.42 118.19 2nqg h ASP 309 Ca -0.45 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.05 2nqg h ASP 309 Cb 1.30 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 40.05 2nqg h ASP 309 CO 0.34 0.13 0.00 0.59 -1.57 0.00 0.00 179.24 178.73 2nqg n ASN 310 N -4.50 3.51 -4.82 6.45 5.03 -1.26 -4.77 115.26 114.90 2nqg n ASN 310 Ca 0.21 -2.61 -0.32 0.00 0.87 0.00 0.00 54.58 52.73 2nqg n ASN 310 Cb 0.77 -0.42 0.04 0.00 -1.02 0.00 0.00 39.78 39.15 2nqg n ASN 310 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2nqg s SER 311 N -1.55 5.55 0.35 6.41 1.04 -0.86 -4.96 113.70 119.69 2nqg s SER 311 Ca 0.35 1.67 0.14 0.00 0.48 0.00 0.00 55.95 58.58 2nqg s SER 311 Cb 0.25 -2.51 0.65 0.00 0.10 0.00 0.00 66.02 64.51 2nqg s SER 311 CO 0.12 -1.33 1.77 1.88 0.98 0.00 0.00 173.24 176.65 2nqg h TYR 312 N -0.33 0.00 -1.06 5.02 0.99 -1.94 -3.34 116.97 116.31 2nqg h TYR 312 Ca -0.45 0.00 0.30 0.00 2.00 0.00 0.00 58.73 60.58 2nqg h TYR 312 Cb 1.21 0.00 -0.12 0.00 1.00 0.00 0.00 36.73 38.82 2nqg h TYR 312 CO 0.61 0.43 0.65 0.93 -0.00 0.00 0.00 178.16 180.78 2nqg h GLU 313 N 0.00 0.37 0.00 4.88 3.07 -1.93 0.39 114.58 121.36 2nqg h GLU 313 Ca -0.00 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 2nqg h GLU 313 Cb 0.79 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.62 2nqg h GLU 313 CO 0.06 0.24 -0.11 -1.49 -1.40 0.00 0.00 179.01 176.30 2nqg h TRP 314 N 0.38 0.00 -0.01 4.33 4.06 -1.93 -0.99 115.95 121.79 2nqg h TRP 314 Ca 0.68 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.63 2nqg h TRP 314 Cb 1.64 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.80 2nqg h TRP 314 CO -0.01 0.11 0.21 -0.91 -3.56 0.00 0.00 178.44 174.29 2nqg h ASN 315 N 0.00 0.00 -0.01 -3.49 2.35 -0.45 -3.21 115.58 110.76 2nqg h ASN 315 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2nqg h ASN 315 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2nqg h ASN 315 CO 0.01 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.08 2nqg n LYS 316 N -3.00 2.07 -3.36 0.81 5.02 -0.38 -4.98 118.16 114.35 2nqg n LYS 316 Ca -0.02 -2.11 -0.20 0.00 -2.02 0.00 0.00 58.31 53.97 2nqg n LYS 316 Cb 0.27 -1.28 -0.01 0.00 -0.02 0.00 0.00 35.03 33.98 2nqg n LYS 316 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2nqg s VAL 317 N -2.04 2.72 0.43 -0.18 -7.23 -1.22 -1.85 120.40 111.03 2nqg s VAL 317 Ca 0.18 -1.21 -0.22 0.00 -1.81 0.00 0.00 61.98 58.91 2nqg s VAL 317 Cb 0.16 -2.93 -0.09 0.00 0.56 0.00 0.00 36.38 34.07 2nqg s VAL 317 CO 0.02 0.00 1.01 1.51 -0.31 0.00 0.00 175.10 177.33 2nqg s ASP 318 N -4.24 6.72 0.31 4.85 1.47 -1.25 -4.89 116.67 119.64 2nqg s ASP 318 Ca 0.51 1.91 0.07 0.00 1.18 0.00 0.00 52.55 56.21 2nqg s ASP 318 Cb -0.06 -2.57 0.85 0.00 -0.34 0.00 0.00 42.92 40.81 2nqg s ASP 318 CO 0.30 -0.52 1.67 -0.65 0.68 0.00 0.00 175.17 176.65 2nqg h PRO 319 N 2.13 0.31 0.31 2.11 0.11 -1.97 -2.45 132.00 132.56 2nqg h PRO 319 Ca -0.49 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2nqg h PRO 319 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2nqg h PRO 319 CO 0.61 0.21 -0.15 -0.92 -0.21 0.00 0.00 178.00 177.54 2nqg h TYR 320 N 0.32 -0.38 -0.90 0.65 5.03 -1.98 -1.41 116.97 118.29 2nqg h TYR 320 Ca 0.62 -0.01 0.16 0.00 2.58 0.00 0.00 58.73 62.09 2nqg h TYR 320 Cb 1.29 0.13 -0.10 0.00 1.55 0.00 0.00 36.73 39.60 2nqg h TYR 320 CO -0.13 -0.09 0.48 0.93 -1.32 0.00 0.00 178.16 178.03 2nqg h GLU 321 N -0.66 0.63 -0.16 1.82 5.08 -1.89 0.53 114.58 119.93 2nqg h GLU 321 Ca -0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2nqg h GLU 321 Cb 0.46 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2nqg h GLU 321 CO 0.07 0.42 0.10 -0.09 -1.00 0.00 0.00 179.01 178.51 2nqg h ARG 322 N 0.65 0.21 0.00 2.33 2.43 -1.26 -1.77 114.38 116.98 2nqg h ARG 322 Ca 0.50 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 2nqg h ARG 322 Cb 0.75 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 2nqg h ARG 322 CO -0.38 0.17 -0.06 0.39 -1.51 0.00 0.00 179.97 178.58 2nqg n GLU 323 N -4.96 0.27 0.07 0.20 -0.58 -0.55 -0.46 120.64 114.63 2nqg n GLU 323 Ca -0.04 0.21 -0.12 0.00 -0.42 0.00 0.00 57.16 56.79 2nqg n GLU 323 Cb 0.04 -1.80 -0.13 0.00 -0.57 0.00 0.00 31.44 28.98 2nqg n GLU 323 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2nqg h GLN 324 N 0.00 0.13 0.00 3.49 1.08 -0.77 -3.42 115.11 115.61 2nqg h GLN 324 Ca 0.00 -0.22 -0.23 0.00 -1.45 0.00 0.00 58.65 56.76 2nqg h GLN 324 Cb 0.74 0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 28.21 2nqg h GLN 324 CO 0.00 1.04 -1.85 1.28 -0.95 0.00 0.00 178.83 178.34 2nqg n LEU 325 N -3.39 2.95 -4.74 1.46 4.77 -0.68 -4.99 117.00 112.38 2nqg n LEU 325 Ca -0.07 -0.08 -0.40 0.00 -0.03 0.00 0.00 56.01 55.43 2nqg n LEU 325 Cb 1.00 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 41.51 2nqg n LEU 325 CO 0.49 0.75 0.56 -0.60 -1.33 0.00 0.00 177.39 177.26 2nqg s ARG 326 N -2.30 4.59 -0.22 3.23 3.52 0.39 -5.03 118.95 123.13 2nqg s ARG 326 Ca -0.20 1.24 -0.00 0.00 -0.13 0.00 0.00 55.73 56.64 2nqg s ARG 326 Cb 0.05 -3.37 0.06 0.00 -1.56 0.00 0.00 34.95 30.13 2nqg s ARG 326 CO 0.34 0.24 -0.02 0.08 -0.81 0.00 0.00 175.30 175.14 2nqg s VAL 327 N -0.00 1.22 -0.75 7.11 1.01 -1.26 -4.78 120.40 122.95 2nqg s VAL 327 Ca 0.42 -1.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.11 2nqg s VAL 327 Cb -0.22 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.61 2nqg s VAL 327 CO 0.26 -0.15 1.46 -0.54 0.00 0.00 0.00 175.10 176.13 2nqg s LYS 328 N 1.53 3.09 -0.30 2.72 1.02 -1.26 -4.88 119.74 121.66 2nqg s LYS 328 Ca -0.04 -0.16 -0.15 0.00 0.02 0.00 0.00 55.97 55.64 2nqg s LYS 328 Cb -0.18 -4.41 0.15 0.00 -0.52 0.00 0.00 37.83 32.87 2nqg s LYS 328 CO -0.07 -2.34 0.96 1.41 -0.92 0.00 0.00 175.35 174.39 2nqg s MET 329 N 5.99 0.35 -1.01 1.68 1.75 -1.26 -5.08 119.30 121.72 2nqg s MET 329 Ca 0.45 0.75 -0.24 0.00 -1.25 0.00 0.00 55.69 55.40 2nqg s MET 329 Cb -0.08 0.31 -0.07 0.00 2.84 0.00 0.00 34.83 37.83 2nqg s MET 329 CO 0.13 -0.10 1.96 -2.00 -0.65 0.00 0.00 175.02 174.35 2nqg s GLU 330 N 2.00 2.48 0.00 4.11 2.56 -1.26 -4.61 118.70 123.98 2nqg s GLU 330 Ca -0.06 -0.61 0.00 0.00 0.00 0.00 0.00 54.97 54.30 2nqg s GLU 330 Cb -0.05 -5.12 0.00 0.00 2.00 0.00 0.00 34.13 30.95 2nqg s GLU 330 CO -0.17 -3.68 0.68 -0.40 -0.56 0.00 0.00 175.26 171.14 2nqg n ASP 331 N 14.37 1.26 0.00 -1.70 5.68 -1.26 -4.74 116.55 130.16 2nqg n ASP 331 Ca 0.42 -1.46 0.00 0.00 -0.50 0.00 0.00 54.79 53.26 2nqg n ASP 331 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2nqg n ASP 331 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2nqg n GLY 332 N -0.23 2.81 3.76 6.12 0.00 -1.17 -4.08 105.19 112.40 2nqg n GLY 332 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2nqg n GLY 332 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nqg s GLU 333 N -0.21 4.03 0.14 1.61 2.12 -1.26 -0.38 118.70 124.74 2nqg s GLU 333 Ca 0.00 -0.15 -0.17 0.00 0.36 0.00 0.00 54.97 55.00 2nqg s GLU 333 Cb 0.00 -3.37 0.04 0.00 0.26 0.00 0.00 34.13 31.06 2nqg s GLU 333 CO 0.00 0.41 0.44 -0.59 -0.54 0.00 0.00 175.26 174.98 2nqg s PHE 334 N 0.04 -0.26 0.06 5.30 -0.12 -0.07 -4.96 117.98 117.97 2nqg s PHE 334 Ca 0.11 -0.04 -0.12 0.00 -0.05 0.00 0.00 56.93 56.83 2nqg s PHE 334 Cb -0.12 0.32 -0.06 0.00 -0.63 0.00 0.00 43.02 42.53 2nqg s PHE 334 CO 0.00 -0.74 0.41 -1.58 -0.05 0.00 0.00 175.22 173.27 2nqg s TRP 335 N -3.80 3.63 0.21 3.49 0.52 -1.26 -1.71 118.94 120.02 2nqg s TRP 335 Ca 0.03 0.87 0.11 0.00 0.02 0.00 0.00 56.10 57.12 2nqg s TRP 335 Cb 0.01 -2.21 -0.04 0.00 -1.15 0.00 0.00 33.47 30.07 2nqg s TRP 335 CO -0.12 0.55 -0.21 -1.64 0.02 0.00 0.00 176.95 175.55 2nqg s MET 336 N -1.66 1.47 0.51 4.98 -1.94 -0.28 -3.31 119.30 119.07 2nqg s MET 336 Ca 0.30 -1.55 -0.22 0.00 -1.71 0.00 0.00 55.69 52.51 2nqg s MET 336 Cb -0.15 -1.64 -0.06 0.00 2.01 0.00 0.00 34.83 34.99 2nqg s MET 336 CO 0.17 0.33 1.27 -1.54 -0.01 0.00 0.00 175.02 175.24 2nqg s SER 337 N -2.89 5.68 0.36 3.03 1.04 -1.26 -1.40 113.70 118.25 2nqg s SER 337 Ca 0.21 2.56 0.09 0.00 0.48 0.00 0.00 55.95 59.30 2nqg s SER 337 Cb -0.06 -2.62 0.84 0.00 0.10 0.00 0.00 66.02 64.27 2nqg s SER 337 CO 0.10 -1.28 1.87 0.15 0.98 0.00 0.00 173.24 175.06 2nqg h PHE 338 N 1.72 0.80 -0.40 5.02 3.57 -1.44 -0.22 116.94 125.99 2nqg h PHE 338 Ca -0.50 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.04 2nqg h PHE 338 Cb 1.28 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.74 2nqg h PHE 338 CO 0.49 0.29 0.23 -0.09 -2.23 0.00 0.00 178.31 177.01 2nqg h ARG 339 N 0.67 0.46 -0.27 1.11 2.43 -1.92 -1.14 114.38 115.71 2nqg h ARG 339 Ca 0.45 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.53 2nqg h ARG 339 Cb 0.75 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2nqg h ARG 339 CO -0.21 0.31 -0.08 -0.44 -1.51 0.00 0.00 179.97 178.04 2nqg h ASP 340 N 0.48 0.54 -0.36 -3.80 3.32 -1.78 -2.86 116.42 111.96 2nqg h ASP 340 Ca 0.16 -0.38 0.08 0.00 0.02 0.00 0.00 57.03 56.91 2nqg h ASP 340 Cb 0.01 -0.15 -0.08 0.00 0.22 0.00 0.00 39.33 39.34 2nqg h ASP 340 CO -0.08 0.80 -0.18 0.15 -1.72 0.00 0.00 179.24 178.21 2nqg h PHE 341 N 0.29 -0.45 0.00 4.55 3.04 -0.82 0.42 116.94 123.97 2nqg h PHE 341 Ca 0.07 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.06 2nqg h PHE 341 Cb 0.57 0.25 0.00 0.00 2.56 0.00 0.00 35.95 39.33 2nqg h PHE 341 CO 0.05 -0.26 0.00 -0.84 -2.02 0.00 0.00 178.31 175.25 2nqg h ILE 342 N -0.12 0.00 0.14 1.41 3.07 -1.23 0.91 117.51 121.69 2nqg h ILE 342 Ca 0.18 -0.54 -0.23 0.00 1.55 0.00 0.00 64.86 65.82 2nqg h ILE 342 Cb 0.40 1.49 0.01 0.00 -0.27 0.00 0.00 36.82 38.45 2nqg h ILE 342 CO -0.44 0.00 -1.09 -0.09 -1.05 0.00 0.00 178.15 175.48 2nqg h ARG 343 N 0.00 0.30 0.04 0.16 2.43 -1.16 -3.41 114.38 112.74 2nqg h ARG 343 Ca 0.00 -0.52 -0.10 0.00 -0.81 0.00 0.00 59.98 58.55 2nqg h ARG 343 Cb 0.59 0.19 0.01 0.00 -0.42 0.00 0.00 29.97 30.34 2nqg h ARG 343 CO 0.00 1.25 -0.42 0.93 -1.51 0.00 0.00 179.97 180.22 2nqg h GLU 344 N -0.30 0.21 -6.78 0.20 4.39 0.13 -3.46 114.58 108.97 2nqg h GLU 344 Ca -0.21 -0.28 -0.50 0.00 0.34 0.00 0.00 59.36 58.71 2nqg h GLU 344 Cb 1.74 0.09 0.01 0.00 -0.10 0.00 0.00 28.75 30.49 2nqg h GLU 344 CO 0.13 1.06 0.06 -0.06 -1.16 0.00 0.00 179.01 179.03 2nqg s PHE 345 N -2.77 3.49 -0.02 4.33 0.40 0.29 -4.85 117.98 118.85 2nqg s PHE 345 Ca -0.15 0.91 0.08 0.00 -0.60 0.00 0.00 56.93 57.17 2nqg s PHE 345 Cb 0.01 -2.34 -0.12 0.00 0.51 0.00 0.00 43.02 41.07 2nqg s PHE 345 CO 0.77 -0.07 0.16 0.25 0.70 0.00 0.00 175.22 177.03 2nqg n THR 346 N -1.39 0.04 -3.80 0.64 -2.24 -0.67 -4.72 114.28 102.14 2nqg n THR 346 Ca 0.01 -0.20 -0.14 0.00 -2.27 0.00 0.00 64.05 61.46 2nqg n THR 346 Cb 0.54 0.22 -0.15 0.00 -2.10 0.00 0.00 70.33 68.84 2nqg n THR 346 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2nqg s LYS 347 N -2.53 -0.01 -0.07 -0.78 2.20 -0.93 -1.48 119.74 116.14 2nqg s LYS 347 Ca -0.03 0.14 0.05 0.00 -0.36 0.00 0.00 55.97 55.77 2nqg s LYS 347 Cb 0.05 -0.15 -0.01 0.00 -1.51 0.00 0.00 37.83 36.21 2nqg s LYS 347 CO 0.33 -0.11 -0.24 -1.17 -0.36 0.00 0.00 175.35 173.80 2nqg s LEU 348 N 0.70 2.06 -0.12 5.43 2.96 -0.87 -1.93 118.68 126.90 2nqg s LEU 348 Ca -0.06 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.34 2nqg s LEU 348 Cb -0.08 -1.35 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 2nqg s LEU 348 CO -0.02 0.21 -0.13 -1.61 -1.32 0.00 0.00 176.35 173.48 2nqg s GLU 349 N 0.01 3.28 -0.09 1.98 2.02 -0.03 0.57 118.70 126.45 2nqg s GLU 349 Ca -0.08 -0.67 0.02 0.00 0.02 0.00 0.00 54.97 54.25 2nqg s GLU 349 Cb -0.15 -2.62 0.01 0.00 0.10 0.00 0.00 34.13 31.48 2nqg s GLU 349 CO 0.05 0.27 -0.15 0.42 0.02 0.00 0.00 175.26 175.88 2nqg s ILE 350 N 0.20 1.40 -0.27 -1.63 1.01 0.10 -1.46 121.20 120.54 2nqg s ILE 350 Ca -0.07 -0.61 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 2nqg s ILE 350 Cb -0.15 -1.27 0.02 0.00 0.01 0.00 0.00 42.46 41.07 2nqg s ILE 350 CO 0.05 0.42 0.00 0.00 0.00 0.00 0.00 174.94 175.41 2nqg s ASN 352 N 1.39 6.37 0.00 0.00 -0.87 -0.37 -1.26 114.94 120.20 2nqg s ASN 352 Ca 0.01 0.43 0.00 0.00 -1.57 0.00 0.00 52.86 51.72 2nqg s ASN 352 Cb -0.17 -2.15 0.00 0.00 -0.02 0.00 0.00 41.25 38.91 2nqg s ASN 352 CO -0.01 0.15 0.00 0.00 -2.57 0.00 0.00 177.10 174.66 2nqg n LEU 353 N 3.43 0.00 -0.94 0.60 -0.00 -1.26 -1.95 117.00 116.88 2nqg n LEU 353 Ca -0.14 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 55.99 2nqg n LEU 353 Cb 0.52 0.00 0.12 0.00 -0.00 0.00 0.00 43.42 44.06 2nqg n LEU 353 CO 0.38 -0.12 0.64 0.41 -0.00 0.00 0.00 177.39 178.71