#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qvg s GLN 2 N 0.00 3.17 -0.16 2.12 1.03 -1.26 -0.60 119.66 123.97 1qvg s GLN 2 Ca 0.00 -0.54 0.00 0.00 0.04 0.00 0.00 55.36 54.86 1qvg s GLN 2 Cb 0.00 -2.90 0.03 0.00 0.03 0.00 0.00 33.01 30.18 1qvg s GLN 2 CO 0.00 0.60 -0.10 0.00 -2.54 0.00 0.00 175.29 173.25 1qvg s ALA 3 N -1.43 1.71 -0.72 2.60 0.00 0.22 -4.67 121.76 119.47 1qvg s ALA 3 Ca 0.31 -0.90 -0.27 0.00 0.00 0.00 0.00 51.96 51.10 1qvg s ALA 3 Cb -0.13 -1.11 0.03 0.00 0.00 0.00 0.00 23.12 21.92 1qvg s ALA 3 CO 0.24 -0.60 1.25 0.99 0.00 0.00 0.00 175.76 177.64 1qvg s THR 4 N 1.54 3.79 0.37 0.00 2.01 -1.26 -0.89 115.64 121.19 1qvg s THR 4 Ca 0.02 0.40 -0.27 0.00 0.31 0.00 0.00 61.69 62.15 1qvg s THR 4 Cb -0.14 -4.89 -0.09 0.00 0.01 0.00 0.00 72.50 67.39 1qvg s THR 4 CO -0.09 -1.78 1.24 -0.63 -0.69 0.00 0.00 174.62 172.67 1qvg s ILE 5 N 5.55 2.91 0.06 1.82 1.01 -1.20 -4.40 121.20 126.95 1qvg s ILE 5 Ca 0.35 0.84 0.09 0.00 0.00 0.00 0.00 60.65 61.93 1qvg s ILE 5 Cb -0.09 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.85 1qvg s ILE 5 CO 0.16 0.15 -0.25 -0.31 0.00 0.00 0.00 174.94 174.68 1qvg s TYR 6 N -1.26 2.22 0.41 3.97 1.51 -0.76 -0.98 117.35 122.46 1qvg s TYR 6 Ca 0.53 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 56.20 1qvg s TYR 6 Cb -0.36 -1.31 -0.01 0.00 -0.11 0.00 0.00 41.96 40.18 1qvg s TYR 6 CO 0.46 0.15 0.61 0.16 -1.11 0.00 0.00 175.55 175.82 1qvg s ASP 7 N -1.37 5.96 0.00 2.29 -4.77 -0.87 -1.22 116.67 116.69 1qvg s ASP 7 Ca 0.11 0.25 0.00 0.00 -3.30 0.00 0.00 52.55 49.61 1qvg s ASP 7 Cb -0.10 -1.60 0.00 0.00 -1.09 0.00 0.00 42.92 40.13 1qvg s ASP 7 CO 0.03 -0.56 0.12 0.18 0.70 0.00 0.00 175.17 175.64 1qvg n LEU 8 N -1.94 0.00 -0.00 2.11 4.77 -1.26 0.71 117.00 121.39 1qvg n LEU 8 Ca -0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.03 1qvg n LEU 8 Cb 0.57 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.59 1qvg n LEU 8 CO 0.47 0.00 -0.17 0.47 -1.33 0.00 0.00 177.39 176.83 1qvg n ASP 9 N -0.58 0.93 0.00 -1.43 8.00 -1.26 -4.76 116.55 117.45 1qvg n ASP 9 Ca 0.00 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.89 1qvg n ASP 9 Cb 0.00 1.13 0.00 0.00 -0.02 0.00 0.00 41.12 42.23 1qvg n ASP 9 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qvg n GLY 10 N 1.40 0.83 3.90 0.44 0.00 0.22 -4.91 105.19 107.06 1qvg n GLY 10 Ca 0.01 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 1qvg n GLY 10 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qvg s ASN 11 N -2.10 6.38 0.40 1.61 0.01 -1.25 -4.85 114.94 115.14 1qvg s ASN 11 Ca 0.00 0.38 -0.26 0.00 -0.71 0.00 0.00 52.86 52.27 1qvg s ASN 11 Cb 0.00 -2.02 -0.10 0.00 0.41 0.00 0.00 41.25 39.54 1qvg s ASN 11 CO 0.00 0.31 1.27 0.35 -1.51 0.00 0.00 177.10 177.51 1qvg n THR 12 N 1.25 2.43 -3.04 1.60 -2.24 -1.26 -2.05 114.28 110.97 1qvg n THR 12 Ca -0.14 -0.50 -0.17 0.00 -2.27 0.00 0.00 64.05 60.97 1qvg n THR 12 Cb 0.53 -1.56 -0.02 0.00 -2.10 0.00 0.00 70.33 67.19 1qvg n THR 12 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1qvg n ASP 13 N 0.34 -0.72 0.00 3.42 -0.08 -0.15 -4.83 116.55 114.53 1qvg n ASP 13 Ca 0.06 -3.01 0.00 0.00 -1.51 0.00 0.00 54.79 50.34 1qvg n ASP 13 Cb 0.39 0.23 0.00 0.00 2.34 0.00 0.00 41.12 44.08 1qvg n ASP 13 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1qvg n GLY 14 N 1.15 -1.47 3.64 0.27 0.00 -1.26 -4.66 105.19 102.86 1qvg n GLY 14 Ca 0.17 -1.54 -0.04 0.00 0.00 0.00 0.00 46.02 44.60 1qvg n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qvg s GLU 15 N 0.00 0.17 0.36 1.61 -1.05 -1.26 -3.21 118.70 115.32 1qvg s GLU 15 Ca 0.00 0.18 0.08 0.00 -0.15 0.00 0.00 54.97 55.08 1qvg s GLU 15 Cb 0.00 0.08 -0.04 0.00 -0.44 0.00 0.00 34.13 33.73 1qvg s GLU 15 CO 0.00 -0.02 0.15 0.08 0.95 0.00 0.00 175.26 176.42 1qvg s VAL 16 N -0.05 2.81 0.02 1.83 1.01 -0.07 -4.86 120.40 121.08 1qvg s VAL 16 Ca 0.06 -1.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.04 1qvg s VAL 16 Cb -0.05 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1qvg s VAL 16 CO -0.13 -0.13 1.07 -1.81 0.00 0.00 0.00 175.10 174.10 1qvg s ASP 17 N -3.86 7.25 -0.32 3.32 1.01 -1.26 0.69 116.67 123.50 1qvg s ASP 17 Ca 0.39 1.79 -0.29 0.00 0.71 0.00 0.00 52.55 55.15 1qvg s ASP 17 Cb -0.01 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 1qvg s ASP 17 CO 0.23 -0.35 1.56 -0.22 0.21 0.00 0.00 175.17 176.60 1qvg s LEU 18 N 1.08 3.69 0.82 1.23 2.96 0.24 -4.84 118.68 123.86 1qvg s LEU 18 Ca 0.54 1.24 -0.16 0.00 -0.22 0.00 0.00 54.13 55.54 1qvg s LEU 18 Cb -0.24 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 42.86 1qvg s LEU 18 CO 0.28 -1.41 0.14 -0.81 -1.32 0.00 0.00 176.35 173.24 1qvg n PRO 19 N 7.95 0.04 -0.28 0.98 -0.04 -1.26 -4.05 135.00 138.34 1qvg n PRO 19 Ca 0.19 0.05 0.02 0.00 -0.04 0.00 0.00 63.50 63.72 1qvg n PRO 19 Cb 0.47 -1.57 0.16 0.00 -0.04 0.00 0.00 33.50 32.51 1qvg n PRO 19 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1qvg h ASP 20 N -0.79 0.65 -1.05 3.54 3.32 -1.92 -2.86 116.42 117.30 1qvg h ASP 20 Ca -0.44 0.05 0.28 0.00 0.02 0.00 0.00 57.03 56.93 1qvg h ASP 20 Cb 1.33 -0.08 -0.09 0.00 0.22 0.00 0.00 39.33 40.72 1qvg h ASP 20 CO 0.36 0.37 0.69 -0.37 -1.72 0.00 0.00 179.24 178.57 1qvg h VAL 21 N 0.77 0.51 0.00 -1.35 -1.51 -1.90 1.02 116.25 113.79 1qvg h VAL 21 Ca 0.39 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.74 1qvg h VAL 21 Cb 0.35 0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.66 1qvg h VAL 21 CO -0.25 0.06 0.00 0.49 -1.23 0.00 0.00 177.57 176.64 1qvg n PHE 22 N -4.56 0.00 0.65 5.19 3.01 -1.08 0.28 117.46 120.95 1qvg n PHE 22 Ca 0.25 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.78 1qvg n PHE 22 Cb 0.93 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.37 1qvg n PHE 22 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1qvg n GLU 23 N -0.83 1.99 -1.67 -1.08 1.02 0.35 -4.60 120.64 115.83 1qvg n GLU 23 Ca 0.05 -0.51 -0.46 0.00 -0.02 0.00 0.00 57.16 56.23 1qvg n GLU 23 Cb 0.02 -1.20 -0.04 0.00 -0.02 0.00 0.00 31.44 30.20 1qvg n GLU 23 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1qvg n THR 24 N -0.54 0.38 -1.76 2.62 -1.04 0.14 -4.86 114.28 109.22 1qvg n THR 24 Ca 0.05 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1qvg n THR 24 Cb 0.28 -1.50 -0.03 0.00 -1.82 0.00 0.00 70.33 67.26 1qvg n THR 24 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1qvg s PRO 25 N 0.37 4.15 -0.01 -2.82 0.04 -1.26 -4.71 135.00 130.76 1qvg s PRO 25 Ca 0.75 2.54 -0.30 0.00 0.04 0.00 0.00 61.00 64.03 1qvg s PRO 25 Cb -0.67 -3.69 -0.08 0.00 0.04 0.00 0.00 34.50 30.10 1qvg s PRO 25 CO 0.43 -0.84 1.93 0.08 0.04 0.00 0.00 177.00 178.63 1qvg s VAL 26 N 3.02 3.14 -0.65 -0.36 1.01 -1.26 -4.79 120.40 120.50 1qvg s VAL 26 Ca 0.80 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.99 1qvg s VAL 26 Cb -0.44 -3.11 0.16 0.00 0.00 0.00 0.00 36.38 32.99 1qvg s VAL 26 CO 0.36 -0.02 0.43 -0.60 0.00 0.00 0.00 175.10 175.27 1qvg s ARG 27 N 4.58 2.37 0.58 2.72 6.06 -1.26 -4.95 118.95 129.04 1qvg s ARG 27 Ca 0.86 -3.04 0.28 0.00 -2.50 0.00 0.00 55.73 51.34 1qvg s ARG 27 Cb -0.40 -3.45 1.73 0.00 0.06 0.00 0.00 34.95 32.89 1qvg s ARG 27 CO 0.38 -1.21 2.23 0.66 -2.50 0.00 0.00 175.30 174.86 1qvg h SER 28 N 5.94 0.00 -0.04 -2.12 4.64 -1.95 -2.04 113.55 117.99 1qvg h SER 28 Ca 0.06 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1qvg h SER 28 Cb 0.82 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1qvg h SER 28 CO 0.72 0.01 -0.03 -2.24 -0.87 0.00 0.00 176.83 174.43 1qvg h ASP 29 N 0.00 0.09 -0.76 4.97 2.03 -1.94 -0.55 116.42 120.27 1qvg h ASP 29 Ca -0.00 -0.44 -0.03 0.00 -0.73 0.00 0.00 57.03 55.84 1qvg h ASP 29 Cb 0.04 -0.03 -0.04 0.00 -0.83 0.00 0.00 39.33 38.48 1qvg h ASP 29 CO 0.00 0.51 0.37 -0.07 -1.03 0.00 0.00 179.24 179.03 1qvg h LEU 30 N -0.32 0.99 -0.26 0.15 3.38 -1.82 -1.22 115.31 116.20 1qvg h LEU 30 Ca 0.01 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1qvg h LEU 30 Cb 0.48 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1qvg h LEU 30 CO 0.01 0.84 0.05 0.40 0.09 0.00 0.00 178.44 179.82 1qvg h ILE 31 N 1.07 0.87 -0.55 1.22 2.04 -1.34 -1.51 117.51 119.31 1qvg h ILE 31 Ca 0.26 -0.05 0.07 0.00 1.00 0.00 0.00 64.86 66.14 1qvg h ILE 31 Cb 0.11 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 1qvg h ILE 31 CO -0.03 0.03 0.25 1.23 0.00 0.00 0.00 178.15 179.62 1qvg h GLY 32 N 0.14 0.78 1.43 5.37 0.00 -0.40 -1.65 103.07 108.74 1qvg h GLY 32 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.30 1qvg h GLY 32 CO -0.16 0.06 0.36 1.70 0.00 0.00 0.00 176.54 178.49 1qvg h LYS 33 N 0.46 0.76 -0.07 4.80 3.64 -0.50 -0.70 116.57 124.97 1qvg h LYS 33 Ca 0.26 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.43 1qvg h LYS 33 Cb 0.24 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1qvg h LYS 33 CO -0.22 0.52 -0.67 0.00 -2.27 0.00 0.00 179.45 176.81 1qvg h ALA 34 N 1.62 0.74 -0.11 5.00 0.00 -0.43 -2.22 119.26 123.85 1qvg h ALA 34 Ca 0.21 -0.58 -0.21 0.00 0.00 0.00 0.00 54.91 54.33 1qvg h ALA 34 Cb -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1qvg h ALA 34 CO -0.04 0.76 -0.76 0.28 0.00 0.00 0.00 179.25 179.48 1qvg h VAL 35 N 0.21 1.32 0.28 0.00 2.07 -0.77 -2.35 116.25 117.01 1qvg h VAL 35 Ca -0.02 -2.06 -0.01 0.00 0.82 0.00 0.00 66.70 65.43 1qvg h VAL 35 Cb 1.20 2.05 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1qvg h VAL 35 CO 0.11 0.64 -0.16 -0.09 0.02 0.00 0.00 177.57 178.09 1qvg h ARG 36 N 0.41 -0.40 -0.61 1.57 2.43 -1.07 -1.03 114.38 115.68 1qvg h ARG 36 Ca -0.04 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1qvg h ARG 36 Cb 1.37 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.95 1qvg h ARG 36 CO 0.15 -0.27 0.31 0.00 -1.51 0.00 0.00 179.97 178.64 1qvg h ALA 37 N 0.30 0.80 -0.72 2.80 0.00 -1.40 0.24 119.26 121.29 1qvg h ALA 37 Ca -0.03 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1qvg h ALA 37 Cb 0.33 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1qvg h ALA 37 CO 0.04 -0.05 0.33 0.00 0.00 0.00 0.00 179.25 179.57 1qvg h ALA 38 N 1.34 1.23 -0.03 0.00 0.00 -1.17 0.08 119.26 120.72 1qvg h ALA 38 Ca 0.28 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 1qvg h ALA 38 Cb 0.22 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1qvg h ALA 38 CO -0.21 0.58 -0.76 1.96 0.00 0.00 0.00 179.25 180.83 1qvg h GLN 39 N 1.02 0.22 -0.03 0.00 4.20 -0.33 -3.20 115.11 117.00 1qvg h GLN 39 Ca 0.25 -0.20 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 1qvg h GLN 39 Cb 0.12 0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.96 1qvg h GLN 39 CO -0.03 0.88 -0.60 0.00 -0.67 0.00 0.00 178.83 178.41 1qvg h ALA 40 N 1.06 0.11 0.00 3.87 0.00 -0.61 -3.24 119.26 120.45 1qvg h ALA 40 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1qvg h ALA 40 Cb 1.33 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1qvg h ALA 40 CO 0.12 0.38 0.16 -0.91 0.00 0.00 0.00 179.25 179.00 1qvg h ASN 41 N -0.01 0.00 -0.12 0.00 2.35 -1.00 -0.28 115.58 116.52 1qvg h ASN 41 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 1qvg h ASN 41 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 1qvg h ASN 41 CO 0.12 0.00 0.00 -2.11 -1.65 0.00 0.00 177.43 173.79 1qvg n ARG 42 N -2.94 2.17 -2.42 0.81 1.85 -1.21 -4.93 116.66 109.98 1qvg n ARG 42 Ca -0.02 -1.72 -0.40 0.00 -1.00 0.00 0.00 57.85 54.70 1qvg n ARG 42 Cb 0.22 -1.47 -0.04 0.00 -1.05 0.00 0.00 32.46 30.12 1qvg n ARG 42 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1qvg s LYS 43 N -1.87 4.59 0.04 2.89 3.01 -0.12 -5.03 119.74 123.25 1qvg s LYS 43 Ca 0.33 1.85 -0.18 0.00 -1.01 0.00 0.00 55.97 56.96 1qvg s LYS 43 Cb 0.21 -3.19 -0.06 0.00 -1.01 0.00 0.00 37.83 33.78 1qvg s LYS 43 CO 0.31 0.13 0.51 -0.65 0.51 0.00 0.00 175.35 176.16 1qvg s GLN 44 N -1.29 4.12 0.27 1.68 -0.21 -1.26 -5.00 119.66 117.96 1qvg s GLN 44 Ca 0.46 0.62 -0.30 0.00 0.02 0.00 0.00 55.36 56.17 1qvg s GLN 44 Cb -0.33 -3.24 -0.10 0.00 1.00 0.00 0.00 33.01 30.34 1qvg s GLN 44 CO 0.42 0.63 1.41 -0.51 -2.12 0.00 0.00 175.29 175.12 1qvg s ASP 45 N -1.01 6.67 0.34 5.90 -0.00 -1.26 -5.02 116.67 122.29 1qvg s ASP 45 Ca 0.27 2.68 -0.00 0.00 -0.00 0.00 0.00 52.55 55.50 1qvg s ASP 45 Cb -0.18 -2.63 -0.00 0.00 -0.00 0.00 0.00 42.92 40.10 1qvg s ASP 45 CO 0.17 -0.67 0.43 -0.72 -0.00 0.00 0.00 175.17 174.38 1qvg s TYR 46 N -0.29 1.21 0.00 4.23 -0.85 -1.26 -4.99 117.35 115.40 1qvg s TYR 46 Ca 0.57 -1.38 0.00 0.00 -0.52 0.00 0.00 57.07 55.74 1qvg s TYR 46 Cb -0.41 -0.22 0.00 0.00 0.38 0.00 0.00 41.96 41.71 1qvg s TYR 46 CO 0.46 -1.08 0.00 0.41 -1.52 0.00 0.00 175.55 173.82 1qvg n GLY 47 N -0.58 3.72 3.78 5.49 0.00 -1.26 -1.76 105.19 114.59 1qvg n GLY 47 Ca 0.02 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 1qvg n GLY 47 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qvg s SER 48 N 0.00 5.08 0.26 1.61 1.04 -1.20 -4.81 113.70 115.68 1qvg s SER 48 Ca 0.00 1.86 -0.29 0.00 0.48 0.00 0.00 55.95 58.00 1qvg s SER 48 Cb 0.00 -2.53 -0.14 0.00 0.10 0.00 0.00 66.02 63.45 1qvg s SER 48 CO 0.00 -1.65 1.07 -0.67 0.98 0.00 0.00 173.24 172.97 1qvg n ASP 49 N -2.79 1.41 0.20 7.02 -0.08 -1.26 -4.84 116.55 116.20 1qvg n ASP 49 Ca 0.09 1.17 0.05 0.00 -1.51 0.00 0.00 54.79 54.59 1qvg n ASP 49 Cb 0.53 -1.28 0.49 0.00 2.34 0.00 0.00 41.12 43.19 1qvg n ASP 49 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1qvg h GLU 50 N 2.45 0.07 -0.41 -0.67 4.39 -1.99 -3.01 114.58 115.42 1qvg h GLU 50 Ca -0.41 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.28 1qvg h GLU 50 Cb 1.34 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1qvg h GLU 50 CO 0.64 0.21 0.00 0.66 -1.16 0.00 0.00 179.01 179.36 1qvg n TYR 51 N -4.34 0.85 -1.78 4.33 4.02 -1.26 -4.96 117.16 114.01 1qvg n TYR 51 Ca -0.02 -0.63 -0.42 0.00 -0.01 0.00 0.00 57.90 56.82 1qvg n TYR 51 Cb 0.23 -0.15 -0.03 0.00 -0.02 0.00 0.00 39.34 39.36 1qvg n TYR 51 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1qvg s ALA 52 N -1.70 3.55 0.00 -0.72 0.00 -1.14 -1.73 121.76 120.02 1qvg s ALA 52 Ca 0.36 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1qvg s ALA 52 Cb 0.23 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1qvg s ALA 52 CO 0.17 -1.58 0.00 0.41 0.00 0.00 0.00 175.76 174.75 1qvg n GLY 53 N 4.48 1.61 0.28 0.00 0.00 -1.26 -4.19 105.19 106.10 1qvg n GLY 53 Ca 0.20 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 1qvg n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qvg n LEU 54 N 0.00 1.44 -3.70 0.99 4.77 -0.71 -3.55 117.00 116.24 1qvg n LEU 54 Ca 0.00 -0.53 -0.42 0.00 -0.03 0.00 0.00 56.01 55.03 1qvg n LEU 54 Cb 0.00 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 1qvg n LEU 54 CO 0.00 0.29 2.68 0.54 -1.33 0.00 0.00 177.39 179.57 1qvg n ARG 55 N -0.66 2.78 -3.58 3.23 1.74 -1.24 -4.80 116.66 114.14 1qvg n ARG 55 Ca 0.08 -2.52 -0.10 0.00 -0.77 0.00 0.00 57.85 54.54 1qvg n ARG 55 Cb 0.40 -3.23 -0.05 0.00 -1.02 0.00 0.00 32.46 28.55 1qvg n ARG 55 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1qvg s THR 56 N 3.29 0.00 -2.20 0.55 -1.32 -1.26 -5.03 115.64 109.67 1qvg s THR 56 Ca 0.49 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 61.18 1qvg s THR 56 Cb 0.14 -1.00 0.50 0.00 -1.51 0.00 0.00 72.50 70.63 1qvg s THR 56 CO -0.07 0.00 1.45 -0.81 -2.21 0.00 0.00 174.62 172.98 1qvg n PRO 57 N 0.89 2.40 -0.86 7.08 -0.04 -1.26 -5.01 135.00 138.20 1qvg n PRO 57 Ca -0.10 -2.14 -0.30 0.00 -0.04 0.00 0.00 63.50 60.91 1qvg n PRO 57 Cb 0.58 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 1qvg n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qvg n ALA 58 N 1.28 -2.17 -2.45 0.55 0.00 -1.26 -4.98 120.51 111.48 1qvg n ALA 58 Ca 0.20 0.28 -0.10 0.00 0.00 0.00 0.00 53.44 53.82 1qvg n ALA 58 Cb 0.54 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.89 1qvg n ALA 58 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1qvg s GLU 59 N -0.58 0.60 -0.05 0.00 2.02 -0.62 -4.70 118.70 115.38 1qvg s GLU 59 Ca 0.40 -1.04 -0.17 0.00 0.02 0.00 0.00 54.97 54.18 1qvg s GLU 59 Cb -0.58 -0.04 -0.05 0.00 0.10 0.00 0.00 34.13 33.55 1qvg s GLU 59 CO 0.34 -0.04 0.48 0.45 0.02 0.00 0.00 175.26 176.51 1qvg s SER 60 N -2.40 6.79 0.47 -0.19 0.15 -1.26 -0.10 113.70 117.17 1qvg s SER 60 Ca 0.01 0.94 0.31 0.00 0.70 0.00 0.00 55.95 57.91 1qvg s SER 60 Cb -0.00 -2.29 1.22 0.00 -1.71 0.00 0.00 66.02 63.24 1qvg s SER 60 CO -0.05 0.15 1.90 -0.26 1.20 0.00 0.00 173.24 176.18 1qvg h PHE 61 N 5.72 0.00 0.00 3.44 -1.00 -1.90 -3.48 116.94 119.72 1qvg h PHE 61 Ca -0.46 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.32 1qvg h PHE 61 Cb 1.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.76 1qvg h PHE 61 CO 0.66 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.77 1qvg n GLY 62 N 0.11 -1.76 3.67 -1.45 0.00 -1.26 -4.89 105.19 99.61 1qvg n GLY 62 Ca 0.01 -1.46 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 1qvg n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qvg s SER 63 N -4.00 2.64 0.00 1.61 0.01 -1.26 -4.56 113.70 108.14 1qvg s SER 63 Ca 0.00 1.23 0.00 0.00 1.31 0.00 0.00 55.95 58.49 1qvg s SER 63 Cb 0.00 -1.90 0.00 0.00 0.21 0.00 0.00 66.02 64.33 1qvg s SER 63 CO 0.00 -3.13 0.00 0.61 0.41 0.00 0.00 173.24 171.13 1qvg n GLY 64 N -1.03 1.82 0.12 3.44 0.00 -1.26 -4.93 105.19 103.36 1qvg n GLY 64 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1qvg n GLY 64 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1qvg n ARG 65 N -0.27 1.14 -3.49 1.61 1.85 -1.26 -4.98 116.66 111.25 1qvg n ARG 65 Ca 0.00 -2.41 -0.24 0.00 -1.00 0.00 0.00 57.85 54.20 1qvg n ARG 65 Cb 0.00 -1.39 0.06 0.00 -1.05 0.00 0.00 32.46 30.09 1qvg n ARG 65 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1qvg n GLY 66 N -1.28 -0.54 3.23 2.89 0.00 -1.26 -4.99 105.19 103.24 1qvg n GLY 66 Ca 0.14 0.22 -0.22 0.00 0.00 0.00 0.00 46.02 46.17 1qvg n GLY 66 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1qvg s GLN 67 N -6.20 1.03 0.54 1.61 0.74 -1.26 -5.13 119.66 110.98 1qvg s GLN 67 Ca 0.53 -1.02 -0.20 0.00 0.05 0.00 0.00 55.36 54.72 1qvg s GLN 67 Cb -0.24 -1.16 -0.06 0.00 1.10 0.00 0.00 33.01 32.66 1qvg s GLN 67 CO 0.65 0.27 1.16 0.00 -0.55 0.00 0.00 175.29 176.82 1qvg s ALA 68 N -1.12 2.72 -1.09 1.58 0.00 -1.26 -4.86 121.76 117.72 1qvg s ALA 68 Ca 0.03 0.90 -0.22 0.00 0.00 0.00 0.00 51.96 52.67 1qvg s ALA 68 Cb -0.10 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.63 1qvg s ALA 68 CO 0.03 -0.85 1.77 -1.01 0.00 0.00 0.00 175.76 175.70 1qvg s HIS 69 N -1.68 2.26 -0.08 0.00 0.09 -1.26 -4.88 115.29 109.74 1qvg s HIS 69 Ca 0.72 -0.32 0.02 0.00 -0.00 0.00 0.00 55.06 55.48 1qvg s HIS 69 Cb -0.27 -4.37 0.01 0.00 -0.00 0.00 0.00 32.58 27.96 1qvg s HIS 69 CO 0.30 -1.68 -0.13 0.08 -0.00 0.00 0.00 174.74 173.31 1qvg s VAL 70 N 7.63 1.24 0.21 -0.90 1.01 -1.26 -5.00 120.40 123.33 1qvg s VAL 70 Ca 0.60 -0.52 -0.32 0.00 0.00 0.00 0.00 61.98 61.73 1qvg s VAL 70 Cb -0.01 -1.14 -0.12 0.00 0.00 0.00 0.00 36.38 35.11 1qvg s VAL 70 CO 0.02 0.38 1.67 -2.65 0.00 0.00 0.00 175.10 174.53 1qvg n PRO 71 N 3.95 2.64 -4.25 2.72 -0.02 -1.26 -4.38 135.00 134.40 1qvg n PRO 71 Ca -0.21 0.95 -0.14 0.00 -2.02 0.00 0.00 63.50 62.08 1qvg n PRO 71 Cb 0.52 -2.77 -0.10 0.00 -0.02 0.00 0.00 33.50 31.13 1qvg n PRO 71 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1qvg s LYS 72 N 0.84 1.08 -0.10 -0.52 1.02 0.86 -1.01 119.74 121.91 1qvg s LYS 72 Ca 0.74 -1.47 -0.05 0.00 0.02 0.00 0.00 55.97 55.20 1qvg s LYS 72 Cb -0.54 -0.57 0.04 0.00 -0.52 0.00 0.00 37.83 36.24 1qvg s LYS 72 CO 0.36 0.04 0.24 -1.17 -0.92 0.00 0.00 175.35 173.90 1qvg s LEU 73 N -3.18 0.51 -1.53 3.17 2.96 0.14 -1.58 118.68 119.18 1qvg s LEU 73 Ca 0.18 0.51 -0.11 0.00 -0.22 0.00 0.00 54.13 54.49 1qvg s LEU 73 Cb 0.03 0.72 0.08 0.00 0.50 0.00 0.00 46.19 47.53 1qvg s LEU 73 CO 0.01 -0.15 0.82 0.47 -1.32 0.00 0.00 176.35 176.18 1qvg n ASP 74 N 4.08 -3.31 -0.64 3.68 8.00 -1.26 -0.81 116.55 126.29 1qvg n ASP 74 Ca -0.24 -0.87 -0.08 0.00 0.71 0.00 0.00 54.79 54.30 1qvg n ASP 74 Cb 0.54 -3.51 -0.04 0.00 -0.02 0.00 0.00 41.12 38.09 1qvg n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qvg n GLY 75 N -1.65 0.86 3.36 0.44 0.00 -1.26 -4.97 105.19 101.98 1qvg n GLY 75 Ca -0.05 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1qvg n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qvg s ARG 76 N -2.55 3.13 0.42 1.61 3.52 0.01 -5.08 118.95 120.01 1qvg s ARG 76 Ca 0.00 -0.73 -0.25 0.00 -0.13 0.00 0.00 55.73 54.63 1qvg s ARG 76 Cb 0.00 -2.51 -0.08 0.00 -1.56 0.00 0.00 34.95 30.80 1qvg s ARG 76 CO 0.00 0.29 1.17 0.00 -0.81 0.00 0.00 175.30 175.95 1qvg s ALA 77 N 0.13 3.10 0.28 6.12 0.00 -1.26 0.28 121.76 130.42 1qvg s ALA 77 Ca -0.08 0.96 -0.09 0.00 0.00 0.00 0.00 51.96 52.75 1qvg s ALA 77 Cb -0.15 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1qvg s ALA 77 CO 0.05 -0.57 0.48 1.03 0.00 0.00 0.00 175.76 176.75 1qvg s ARG 78 N -2.42 1.69 0.00 0.00 0.52 -0.18 -4.78 118.95 113.79 1qvg s ARG 78 Ca 0.59 -1.45 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 1qvg s ARG 78 Cb -0.30 0.46 0.00 0.00 0.52 0.00 0.00 34.95 35.63 1qvg s ARG 78 CO 0.38 -0.71 0.00 -2.13 0.02 0.00 0.00 175.30 172.86 1qvg n ARG 79 N -0.44 0.00 -1.57 3.54 0.63 -1.23 -4.56 116.66 113.03 1qvg n ARG 79 Ca -0.01 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.51 1qvg n ARG 79 Cb 0.62 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.55 1qvg n ARG 79 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1qvg n VAL 80 N 0.00 2.45 -0.29 5.15 0.24 -1.26 0.15 118.33 124.77 1qvg n VAL 80 Ca 0.00 -0.50 0.14 0.00 -2.04 0.00 0.00 64.34 61.94 1qvg n VAL 80 Cb 0.00 -0.98 0.39 0.00 -1.47 0.00 0.00 33.84 31.78 1qvg n VAL 80 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1qvg h PRO 81 N 1.15 0.63 -0.32 7.34 0.11 -1.89 -0.21 132.00 138.82 1qvg h PRO 81 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1qvg h PRO 81 Cb 1.36 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1qvg h PRO 81 CO 0.54 0.42 0.00 0.00 -0.21 0.00 0.00 178.00 178.75 1qvg n GLN 82 N -4.61 1.29 -4.48 1.05 0.00 -1.26 -4.78 117.38 104.58 1qvg n GLN 82 Ca 0.20 -0.35 -0.34 0.00 0.00 0.00 0.00 57.00 56.51 1qvg n GLN 82 Cb 0.56 -1.21 -0.12 0.00 0.00 0.00 0.00 30.24 29.47 1qvg n GLN 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1qvg s ALA 83 N -1.70 2.99 0.27 2.61 0.00 -0.09 -5.04 121.76 120.80 1qvg s ALA 83 Ca 0.06 -0.84 -0.30 0.00 0.00 0.00 0.00 51.96 50.88 1qvg s ALA 83 Cb 0.04 -1.44 -0.12 0.00 0.00 0.00 0.00 23.12 21.59 1qvg s ALA 83 CO 0.04 0.34 1.54 0.28 0.00 0.00 0.00 175.76 177.95 1qvg n VAL 84 N 3.09 0.96 -0.99 0.00 0.31 -1.26 0.62 118.33 121.06 1qvg n VAL 84 Ca -0.18 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 1qvg n VAL 84 Cb 0.53 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 1qvg n VAL 84 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1qvg n LYS 85 N 2.18 -0.02 -2.04 5.55 4.76 -1.26 -4.74 118.16 122.57 1qvg n LYS 85 Ca 0.10 0.01 -0.28 0.00 -2.87 0.00 0.00 58.31 55.27 1qvg n LYS 85 Cb 0.35 -2.76 0.10 0.00 -1.84 0.00 0.00 35.03 30.88 1qvg n LYS 85 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1qvg s GLY 86 N -2.00 1.66 0.84 0.72 0.00 0.20 -4.45 107.32 104.30 1qvg s GLY 86 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 44.72 43.73 1qvg s GLY 86 CO 0.00 -0.38 1.12 1.09 0.00 0.00 0.00 173.10 174.93 1qvg s ARG 87 N -5.49 1.64 -0.32 2.90 1.70 0.41 -4.70 118.95 115.08 1qvg s ARG 87 Ca 0.64 1.34 -0.21 0.00 -0.47 0.00 0.00 55.73 57.02 1qvg s ARG 87 Cb -0.09 -1.81 -0.00 0.00 -0.57 0.00 0.00 34.95 32.47 1qvg s ARG 87 CO 0.48 -2.13 0.66 0.45 -1.08 0.00 0.00 175.30 173.68 1qvg s SER 88 N -3.05 6.50 0.12 -2.89 0.15 -1.26 -3.86 113.70 109.41 1qvg s SER 88 Ca 0.64 0.38 -0.28 0.00 0.70 0.00 0.00 55.95 57.39 1qvg s SER 88 Cb -0.20 -2.34 -0.08 0.00 -1.71 0.00 0.00 66.02 61.69 1qvg s SER 88 CO 0.57 -0.54 1.48 0.00 1.20 0.00 0.00 173.24 175.95 1qvg h ALA 89 N 8.26 -0.63 -2.87 5.45 0.00 -1.93 -3.33 119.26 124.22 1qvg h ALA 89 Ca -0.26 0.04 -0.60 0.00 0.00 0.00 0.00 54.91 54.09 1qvg h ALA 89 Cb 1.11 1.18 -0.40 0.00 0.00 0.00 0.00 17.79 19.69 1qvg h ALA 89 CO 0.83 -0.91 -0.77 -1.01 0.00 0.00 0.00 179.25 177.38 1qvg s HIS 90 N -5.26 1.60 0.70 0.00 3.76 -1.26 -5.13 115.29 109.71 1qvg s HIS 90 Ca -0.12 -2.18 0.02 0.00 -0.15 0.00 0.00 55.06 52.63 1qvg s HIS 90 Cb 0.08 -1.60 0.13 0.00 1.11 0.00 0.00 32.58 32.31 1qvg s HIS 90 CO 0.54 -0.80 0.97 -1.25 -0.85 0.00 0.00 174.74 173.35 1qvg s PRO 91 N 0.57 1.72 0.58 8.40 0.04 -1.25 -5.07 135.00 139.98 1qvg s PRO 91 Ca 0.18 -1.36 -0.18 0.00 0.04 0.00 0.00 61.00 59.67 1qvg s PRO 91 Cb -0.24 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 1qvg s PRO 91 CO 0.00 -1.39 1.13 -2.14 0.04 0.00 0.00 177.00 174.64 1qvg s PRO 92 N -5.06 3.19 -0.05 0.56 0.02 -1.26 -4.96 135.00 127.44 1qvg s PRO 92 Ca 0.67 1.55 0.02 0.00 0.02 0.00 0.00 61.00 63.26 1qvg s PRO 92 Cb -0.04 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 32.50 1qvg s PRO 92 CO 0.44 -0.97 -0.10 0.15 -0.33 0.00 0.00 177.00 176.19 1qvg s LYS 93 N -3.52 1.30 0.27 5.54 1.02 -1.24 -3.27 119.74 119.84 1qvg s LYS 93 Ca 0.71 -0.31 -0.00 0.00 0.02 0.00 0.00 55.97 56.39 1qvg s LYS 93 Cb -0.23 -1.14 0.60 0.00 -0.52 0.00 0.00 37.83 36.54 1qvg s LYS 93 CO 0.31 0.03 1.71 1.15 -0.92 0.00 0.00 175.35 177.63 1qvg h THR 94 N 5.86 0.55 -0.03 2.17 2.02 -1.66 -2.22 112.91 119.60 1qvg h THR 94 Ca -0.34 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 66.71 1qvg h THR 94 Cb 1.17 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1qvg h THR 94 CO 0.48 0.08 0.04 -0.33 0.37 0.00 0.00 175.52 176.15 1qvg h GLU 95 N 0.42 0.00 -6.80 6.66 3.07 -1.95 -3.44 114.58 112.54 1qvg h GLU 95 Ca 0.49 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.80 1qvg h GLU 95 Cb 0.85 0.00 0.10 0.00 -0.84 0.00 0.00 28.75 28.86 1qvg h GLU 95 CO -0.48 0.00 0.73 1.17 -1.40 0.00 0.00 179.01 179.03 1qvg n LYS 96 N -3.79 2.47 -2.97 2.33 4.81 -0.83 -4.94 118.16 115.25 1qvg n LYS 96 Ca -0.02 0.87 -0.43 0.00 -0.87 0.00 0.00 58.31 57.86 1qvg n LYS 96 Cb 0.13 -2.58 -0.05 0.00 0.02 0.00 0.00 35.03 32.55 1qvg n LYS 96 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1qvg s ASP 97 N 0.09 6.37 -0.14 3.14 3.68 -1.26 -4.89 116.67 123.67 1qvg s ASP 97 Ca 0.59 -0.24 0.18 0.00 2.13 0.00 0.00 52.55 55.21 1qvg s ASP 97 Cb -0.53 -2.38 0.75 0.00 -1.45 0.00 0.00 42.92 39.31 1qvg s ASP 97 CO 0.57 -0.96 1.66 0.54 0.13 0.00 0.00 175.17 177.10 1qvg n ARG 98 N 6.78 3.99 -3.59 4.34 1.74 -1.26 -4.96 116.66 123.70 1qvg n ARG 98 Ca 0.01 -2.96 -0.25 0.00 -0.77 0.00 0.00 57.85 53.88 1qvg n ARG 98 Cb 0.48 -1.98 -0.02 0.00 -1.02 0.00 0.00 32.46 29.92 1qvg n ARG 98 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1qvg s SER 99 N -0.89 6.35 -0.06 0.55 1.04 -1.26 -4.53 113.70 114.89 1qvg s SER 99 Ca 0.52 0.40 0.04 0.00 0.48 0.00 0.00 55.95 57.39 1qvg s SER 99 Cb 0.35 -2.01 0.00 0.00 0.10 0.00 0.00 66.02 64.46 1qvg s SER 99 CO 0.23 -0.15 -0.18 -0.76 0.98 0.00 0.00 173.24 173.36 1qvg s LEU 100 N -3.80 1.90 0.59 2.42 1.43 -1.26 -5.00 118.68 114.95 1qvg s LEU 100 Ca 0.39 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.04 1qvg s LEU 100 Cb -0.10 -1.07 0.02 0.00 0.03 0.00 0.00 46.19 45.07 1qvg s LEU 100 CO 0.32 0.13 0.88 -1.81 0.23 0.00 0.00 176.35 176.10 1qvg s ASP 101 N 0.24 5.42 -0.29 2.29 1.11 -1.26 -4.89 116.67 119.29 1qvg s ASP 101 Ca -0.10 0.52 -0.15 0.00 0.18 0.00 0.00 52.55 53.00 1qvg s ASP 101 Cb -0.14 -1.46 0.14 0.00 1.07 0.00 0.00 42.92 42.53 1qvg s ASP 101 CO 0.04 -1.14 0.92 -0.22 1.18 0.00 0.00 175.17 175.95 1qvg s LEU 102 N -4.96 -0.62 0.20 1.23 2.96 -1.26 -5.00 118.68 111.23 1qvg s LEU 102 Ca 0.55 0.95 -0.32 0.00 -0.22 0.00 0.00 54.13 55.09 1qvg s LEU 102 Cb -0.10 1.85 -0.11 0.00 0.50 0.00 0.00 46.19 48.32 1qvg s LEU 102 CO 0.43 -0.15 1.63 0.20 -1.32 0.00 0.00 176.35 177.15 1qvg s ASN 103 N 1.67 6.48 0.36 3.68 -0.87 -1.26 -4.83 114.94 120.17 1qvg s ASN 103 Ca -0.08 2.76 0.14 0.00 -1.57 0.00 0.00 52.86 54.11 1qvg s ASN 103 Cb -0.05 -2.60 0.98 0.00 -0.02 0.00 0.00 41.25 39.57 1qvg s ASN 103 CO -0.16 -0.89 1.76 0.44 -2.57 0.00 0.00 177.10 175.67 1qvg h ASP 104 N 6.55 0.57 -0.19 -1.22 3.32 -2.01 0.43 116.42 123.87 1qvg h ASP 104 Ca -0.43 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 1qvg h ASP 104 Cb 1.20 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 1qvg h ASP 104 CO 0.92 0.12 0.06 0.11 -1.72 0.00 0.00 179.24 178.72 1qvg h LYS 105 N 0.50 0.29 -0.81 3.56 1.57 -1.99 0.93 116.57 120.63 1qvg h LYS 105 Ca 0.61 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 59.29 1qvg h LYS 105 Cb 1.33 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.56 1qvg h LYS 105 CO -0.36 0.41 0.40 1.49 -0.57 0.00 0.00 179.45 180.81 1qvg h GLU 106 N 0.13 1.16 -0.27 3.15 4.81 -1.29 -1.20 114.58 121.07 1qvg h GLU 106 Ca 0.06 -0.17 -0.11 0.00 -0.13 0.00 0.00 59.36 59.01 1qvg h GLU 106 Cb 0.24 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1qvg h GLU 106 CO -0.00 0.89 -0.26 -0.09 -0.73 0.00 0.00 179.01 178.81 1qvg h ARG 107 N 1.14 0.65 -0.65 1.92 2.43 0.12 -2.33 114.38 117.66 1qvg h ARG 107 Ca 0.28 -0.34 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 1qvg h ARG 107 Cb 0.11 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 1qvg h ARG 107 CO -0.04 0.95 0.13 1.96 -1.51 0.00 0.00 179.97 181.46 1qvg h GLN 108 N 0.38 1.06 -0.98 0.20 4.20 -0.76 -2.00 115.11 117.20 1qvg h GLN 108 Ca 0.04 -0.26 0.03 0.00 0.06 0.00 0.00 58.65 58.53 1qvg h GLN 108 Cb 0.83 -0.14 -0.06 0.00 0.30 0.00 0.00 27.48 28.41 1qvg h GLN 108 CO 0.07 0.95 0.65 1.25 -0.67 0.00 0.00 178.83 181.07 1qvg h LEU 109 N 1.00 1.08 -1.17 1.46 5.85 -1.10 -0.16 115.31 122.26 1qvg h LEU 109 Ca 0.20 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 1qvg h LEU 109 Cb 0.39 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1qvg h LEU 109 CO 0.01 0.74 -0.40 0.00 -0.34 0.00 0.00 178.44 178.45 1qvg h ALA 110 N 1.42 1.23 -0.32 1.25 0.00 -0.87 -0.79 119.26 121.19 1qvg h ALA 110 Ca 0.39 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1qvg h ALA 110 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1qvg h ALA 110 CO -0.12 0.49 -0.30 0.28 0.00 0.00 0.00 179.25 179.61 1qvg h VAL 111 N 0.00 1.29 0.00 0.00 2.07 -0.39 -0.38 116.25 118.84 1qvg h VAL 111 Ca -0.00 -1.46 -0.00 0.00 0.82 0.00 0.00 66.70 66.05 1qvg h VAL 111 Cb 0.75 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1qvg h VAL 111 CO 0.05 0.48 -0.00 0.03 0.02 0.00 0.00 177.57 178.15 1qvg h ARG 112 N 0.54 -0.00 -0.03 1.57 3.08 -0.87 -1.56 114.38 117.10 1qvg h ARG 112 Ca 0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1qvg h ARG 112 Cb 0.87 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1qvg h ARG 112 CO 0.07 0.22 -0.14 1.03 -1.07 0.00 0.00 179.97 180.08 1qvg h SER 113 N -0.22 0.04 -0.05 7.04 0.87 -1.10 -1.12 113.55 119.01 1qvg h SER 113 Ca -0.00 -0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.35 1qvg h SER 113 Cb 0.22 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1qvg h SER 113 CO 0.00 0.19 -0.72 0.00 -0.53 0.00 0.00 176.83 175.77 1qvg h ALA 114 N 1.82 0.43 0.23 6.23 0.00 -0.91 -2.17 119.26 124.89 1qvg h ALA 114 Ca 0.01 -0.58 0.01 0.00 0.00 0.00 0.00 54.91 54.34 1qvg h ALA 114 Cb 0.28 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1qvg h ALA 114 CO 0.02 0.70 -0.40 1.25 0.00 0.00 0.00 179.25 180.82 1qvg h LEU 115 N 0.49 -1.14 -0.94 0.00 5.85 -0.20 -2.13 115.31 117.24 1qvg h LEU 115 Ca -0.03 0.12 0.16 0.00 0.84 0.00 0.00 57.88 58.96 1qvg h LEU 115 Cb 1.32 0.41 -0.10 0.00 0.37 0.00 0.00 40.66 42.67 1qvg h LEU 115 CO 0.14 -0.50 0.54 0.00 -0.34 0.00 0.00 178.44 178.28 1qvg h ALA 116 N -0.24 1.48 -0.30 1.25 0.00 -1.23 0.22 119.26 120.43 1qvg h ALA 116 Ca 0.00 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.07 1qvg h ALA 116 Cb 0.69 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1qvg h ALA 116 CO -0.17 -0.02 0.25 0.00 0.00 0.00 0.00 179.25 179.32 1qvg h ALA 117 N 1.59 2.16 0.00 0.00 0.00 -0.71 -0.51 119.26 121.79 1qvg h ALA 117 Ca 0.52 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.36 1qvg h ALA 117 Cb 0.72 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1qvg h ALA 117 CO -0.35 -0.40 -0.25 1.15 0.00 0.00 0.00 179.25 179.39 1qvg h THR 118 N 0.00 1.13 -0.22 0.00 2.02 -0.36 -3.09 112.91 112.39 1qvg h THR 118 Ca 0.14 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.44 1qvg h THR 118 Cb 0.64 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1qvg h THR 118 CO -0.00 0.25 0.00 0.00 0.37 0.00 0.00 175.52 176.14 1qvg n ALA 119 N -2.47 2.65 -3.95 6.16 0.00 -0.20 -3.57 120.51 119.12 1qvg n ALA 119 Ca -0.02 -0.50 -0.32 0.00 0.00 0.00 0.00 53.44 52.59 1qvg n ALA 119 Cb 0.31 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.62 1qvg n ALA 119 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qvg s ASP 120 N -0.72 4.83 0.41 0.00 -1.08 -1.17 -4.68 116.67 114.25 1qvg s ASP 120 Ca 0.17 -2.27 0.23 0.00 -0.52 0.00 0.00 52.55 50.16 1qvg s ASP 120 Cb 0.10 -1.68 1.23 0.00 -1.46 0.00 0.00 42.92 41.12 1qvg s ASP 120 CO 0.09 -0.39 1.70 0.00 0.52 0.00 0.00 175.17 177.09 1qvg h ALA 121 N 7.53 2.41 -0.02 3.66 0.00 -1.85 -0.66 119.26 130.33 1qvg h ALA 121 Ca -0.06 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1qvg h ALA 121 Cb 1.01 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1qvg h ALA 121 CO 0.58 -0.93 -0.02 -0.44 0.00 0.00 0.00 179.25 178.45 1qvg h ASP 122 N 0.26 0.06 -0.01 0.00 3.32 -1.95 -2.54 116.42 115.56 1qvg h ASP 122 Ca 0.70 -0.45 0.03 0.00 0.02 0.00 0.00 57.03 57.33 1qvg h ASP 122 Cb 1.95 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 41.44 1qvg h ASP 122 CO -0.37 0.49 -0.27 -0.07 -1.72 0.00 0.00 179.24 177.30 1qvg h LEU 123 N -0.38 -0.81 -2.00 1.55 3.38 -1.47 -0.69 115.31 114.90 1qvg h LEU 123 Ca 0.00 0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.25 1qvg h LEU 123 Cb 0.47 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 1qvg h LEU 123 CO 0.00 -0.34 0.45 0.58 0.09 0.00 0.00 178.44 179.22 1qvg h VAL 124 N -0.41 0.63 0.09 1.22 2.07 -1.46 0.19 116.25 118.58 1qvg h VAL 124 Ca 0.06 0.00 -0.25 0.00 0.82 0.00 0.00 66.70 67.33 1qvg h VAL 124 Cb 0.50 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1qvg h VAL 124 CO -0.24 0.00 -1.15 0.00 0.02 0.00 0.00 177.57 176.19 1qvg h ALA 125 N 1.66 0.19 -0.22 1.67 0.00 -0.73 -3.03 119.26 118.80 1qvg h ALA 125 Ca 0.28 -0.87 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 1qvg h ALA 125 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1qvg h ALA 125 CO -0.00 1.02 -0.46 -0.44 0.00 0.00 0.00 179.25 179.37 1qvg h ASP 126 N 0.07 0.78 -0.11 0.00 3.32 0.40 -1.96 116.42 118.91 1qvg h ASP 126 Ca -0.10 -0.55 0.03 0.00 0.02 0.00 0.00 57.03 56.43 1qvg h ASP 126 Cb 1.88 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 41.20 1qvg h ASP 126 CO 0.18 1.19 0.38 -0.09 -1.72 0.00 0.00 179.24 179.17 1qvg h ARG 127 N 0.40 0.00 0.00 3.56 2.43 -0.81 -3.44 114.38 116.51 1qvg h ARG 127 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1qvg h ARG 127 Cb 1.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1qvg h ARG 127 CO 0.10 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.97 1qvg n GLY 128 N -1.30 1.09 3.73 2.80 0.00 -0.74 -5.10 105.19 105.67 1qvg n GLY 128 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1qvg n GLY 128 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1qvg n HIS 129 N -0.54 2.40 -3.59 1.61 8.25 -1.15 -4.99 115.22 117.21 1qvg n HIS 129 Ca 0.00 0.47 -0.37 0.00 -0.26 0.00 0.00 57.72 57.56 1qvg n HIS 129 Cb 0.00 -2.42 -0.10 0.00 1.12 0.00 0.00 29.99 28.59 1qvg n HIS 129 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1qvg s GLU 130 N -2.30 4.03 -0.11 -0.41 0.41 -1.26 -4.65 118.70 114.40 1qvg s GLU 130 Ca 0.61 -0.23 -0.32 0.00 -0.41 0.00 0.00 54.97 54.62 1qvg s GLU 130 Cb -0.48 -3.59 0.12 0.00 -1.78 0.00 0.00 34.13 28.40 1qvg s GLU 130 CO 0.58 -0.06 1.06 -0.59 -0.49 0.00 0.00 175.26 175.76 1qvg s PHE 131 N 1.42 -0.24 -0.57 1.61 -0.12 -1.26 -1.66 117.98 117.16 1qvg s PHE 131 Ca 0.09 0.20 0.06 0.00 -0.05 0.00 0.00 56.93 57.22 1qvg s PHE 131 Cb -0.15 0.52 0.32 0.00 -0.63 0.00 0.00 43.02 43.08 1qvg s PHE 131 CO 0.08 -0.35 0.87 -0.25 -0.05 0.00 0.00 175.22 175.51 1qvg n ASP 132 N -0.03 3.81 -4.25 1.98 8.00 -0.66 -5.05 116.55 120.35 1qvg n ASP 132 Ca -0.05 -3.53 -0.14 0.00 0.71 0.00 0.00 54.79 51.78 1qvg n ASP 132 Cb 0.60 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1qvg n ASP 132 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1qvg s ARG 133 N -3.07 1.06 -0.14 -1.24 3.52 -1.26 -4.86 118.95 112.95 1qvg s ARG 133 Ca 0.46 -1.44 0.06 0.00 -0.13 0.00 0.00 55.73 54.68 1qvg s ARG 133 Cb 0.25 -0.63 -0.13 0.00 -1.56 0.00 0.00 34.95 32.88 1qvg s ARG 133 CO -0.10 0.08 -0.05 -0.25 -0.81 0.00 0.00 175.30 174.16 1qvg n ASP 134 N -0.15 2.38 -4.89 -2.12 8.00 -1.26 -4.98 116.55 113.52 1qvg n ASP 134 Ca -0.11 -0.05 -0.29 0.00 0.71 0.00 0.00 54.79 55.06 1qvg n ASP 134 Cb 0.60 0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.92 1qvg n ASP 134 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1qvg s GLU 135 N -2.31 3.69 -0.29 -1.24 2.02 -1.26 -4.76 118.70 114.55 1qvg s GLU 135 Ca -0.14 0.17 -0.25 0.00 0.02 0.00 0.00 54.97 54.77 1qvg s GLU 135 Cb 0.05 -2.56 0.16 0.00 0.10 0.00 0.00 34.13 31.87 1qvg s GLU 135 CO 0.43 0.13 1.25 0.54 0.02 0.00 0.00 175.26 177.64 1qvg s VAL 136 N -2.17 0.00 1.09 2.63 0.11 -1.26 -4.74 120.40 116.06 1qvg s VAL 136 Ca 0.46 0.00 -0.13 0.00 -2.93 0.00 0.00 61.98 59.38 1qvg s VAL 136 Cb -0.11 -1.00 0.24 0.00 -1.53 0.00 0.00 36.38 33.98 1qvg s VAL 136 CO 0.30 0.00 1.06 -2.16 -3.33 0.00 0.00 175.10 170.97 1qvg s PRO 137 N 0.12 -0.33 -0.34 1.54 0.04 -1.23 -4.29 135.00 130.50 1qvg s PRO 137 Ca 0.05 0.57 -0.20 0.00 0.04 0.00 0.00 61.00 61.46 1qvg s PRO 137 Cb -0.05 -1.64 -0.00 0.00 0.04 0.00 0.00 34.50 32.84 1qvg s PRO 137 CO -0.11 -3.26 0.61 0.08 0.04 0.00 0.00 177.00 174.36 1qvg s VAL 138 N -2.76 4.93 -0.11 -0.36 1.01 -1.02 -4.94 120.40 117.15 1qvg s VAL 138 Ca 0.67 0.60 -0.11 0.00 0.00 0.00 0.00 61.98 63.15 1qvg s VAL 138 Cb -0.21 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1qvg s VAL 138 CO 0.60 -0.25 0.24 -0.69 0.00 0.00 0.00 175.10 175.00 1qvg s VAL 139 N 2.62 5.34 0.08 2.92 1.01 -1.26 -0.30 120.40 130.80 1qvg s VAL 139 Ca 0.23 0.43 0.03 0.00 0.00 0.00 0.00 61.98 62.68 1qvg s VAL 139 Cb -0.15 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1qvg s VAL 139 CO 0.14 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.99 1qvg s VAL 140 N -0.59 0.84 0.42 2.92 1.01 -0.73 -1.83 120.40 122.43 1qvg s VAL 140 Ca 0.17 -1.47 -0.27 0.00 0.00 0.00 0.00 61.98 60.41 1qvg s VAL 140 Cb -0.13 -1.15 -0.10 0.00 0.00 0.00 0.00 36.38 35.00 1qvg s VAL 140 CO 0.06 -0.49 1.46 -0.94 0.00 0.00 0.00 175.10 175.19 1qvg s SER 141 N -2.17 6.09 0.09 3.32 1.04 -0.36 0.95 113.70 122.66 1qvg s SER 141 Ca 0.01 3.00 0.04 0.00 0.48 0.00 0.00 55.95 59.48 1qvg s SER 141 Cb -0.05 -2.66 0.23 0.00 0.10 0.00 0.00 66.02 63.64 1qvg s SER 141 CO -0.00 -1.04 1.01 0.47 0.98 0.00 0.00 173.24 174.66 1qvg n ASP 142 N 0.12 0.11 0.32 7.02 8.00 -1.26 -1.26 116.55 129.60 1qvg n ASP 142 Ca 0.03 0.43 0.20 0.00 0.71 0.00 0.00 54.79 56.17 1qvg n ASP 142 Cb 0.40 -0.43 1.06 0.00 -0.02 0.00 0.00 41.12 42.13 1qvg n ASP 142 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1qvg h ASP 143 N 0.00 0.00 -0.82 -2.24 3.32 -1.97 -2.26 116.42 112.46 1qvg h ASP 143 Ca 0.00 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 1qvg h ASP 143 Cb 0.31 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.80 1qvg h ASP 143 CO 0.00 0.01 0.48 0.15 -1.72 0.00 0.00 179.24 178.16 1qvg h PHE 144 N 0.00 0.87 0.00 4.55 3.57 -1.53 -0.53 116.94 123.87 1qvg h PHE 144 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1qvg h PHE 144 Cb 0.13 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.60 1qvg h PHE 144 CO 0.00 0.39 0.07 0.39 -2.23 0.00 0.00 178.31 176.93 1qvg n GLU 145 N -4.71 0.03 0.02 1.11 1.02 -0.85 -0.82 120.64 116.44 1qvg n GLU 145 Ca 0.13 0.48 0.11 0.00 -0.02 0.00 0.00 57.16 57.86 1qvg n GLU 145 Cb 0.24 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1qvg n GLU 145 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1qvg n ASP 146 N -1.62 0.63 -4.58 1.62 8.00 -0.21 -4.95 116.55 115.45 1qvg n ASP 146 Ca -0.00 -0.36 -0.33 0.00 0.71 0.00 0.00 54.79 54.81 1qvg n ASP 146 Cb 0.08 0.88 0.12 0.00 -0.02 0.00 0.00 41.12 42.18 1qvg n ASP 146 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1qvg n LEU 147 N -1.85 2.38 0.00 0.64 4.77 0.00 -4.94 117.00 118.00 1qvg n LEU 147 Ca 0.02 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1qvg n LEU 147 Cb 0.42 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.13 1qvg n LEU 147 CO 0.41 -2.54 -0.14 0.52 -1.33 0.00 0.00 177.39 174.31 1qvg n VAL 148 N -3.38 0.00 -3.33 4.08 0.31 -1.26 -4.58 118.33 110.16 1qvg n VAL 148 Ca 0.11 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 64.06 1qvg n VAL 148 Cb 0.51 -0.23 -0.06 0.00 -0.91 0.00 0.00 33.84 33.16 1qvg n VAL 148 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1qvg s LYS 149 N -1.29 4.17 0.15 5.55 -0.14 -1.26 -4.43 119.74 122.49 1qvg s LYS 149 Ca 0.00 0.58 -0.14 0.00 -1.36 0.00 0.00 55.97 55.04 1qvg s LYS 149 Cb 0.00 -3.30 0.03 0.00 -1.68 0.00 0.00 37.83 32.88 1qvg s LYS 149 CO 0.00 0.49 1.71 1.15 -0.76 0.00 0.00 175.35 177.94 1qvg h THR 150 N 3.97 1.20 -1.04 2.17 2.02 -1.92 -2.45 112.91 116.86 1qvg h THR 150 Ca -0.47 -0.61 0.27 0.00 0.77 0.00 0.00 66.41 66.37 1qvg h THR 150 Cb 1.21 0.72 -0.09 0.00 -1.74 0.00 0.00 68.15 68.25 1qvg h THR 150 CO 0.67 0.23 0.68 1.56 0.37 0.00 0.00 175.52 179.03 1qvg h GLN 151 N 0.62 0.34 -0.22 6.66 1.08 -1.93 0.21 115.11 121.86 1qvg h GLN 151 Ca 0.16 -0.02 -0.16 0.00 -1.45 0.00 0.00 58.65 57.18 1qvg h GLN 151 Cb 0.17 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 1qvg h GLN 151 CO -0.02 0.22 -0.51 0.93 -0.95 0.00 0.00 178.83 178.51 1qvg h GLU 152 N 0.35 0.63 -0.05 1.46 5.08 -1.82 -2.48 114.58 117.75 1qvg h GLU 152 Ca 0.58 -0.38 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1qvg h GLU 152 Cb 1.56 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.83 1qvg h GLU 152 CO -0.25 0.99 -0.23 0.28 -1.00 0.00 0.00 179.01 178.80 1qvg h VAL 153 N 0.49 1.19 0.46 3.13 2.07 -0.57 -2.29 116.25 120.73 1qvg h VAL 153 Ca 0.02 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 1qvg h VAL 153 Cb 1.06 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1qvg h VAL 153 CO 0.10 0.26 -0.22 0.58 0.02 0.00 0.00 177.57 178.31 1qvg h VAL 154 N 0.08 0.53 -0.28 2.57 2.07 -1.04 -1.25 116.25 118.92 1qvg h VAL 154 Ca 0.01 -0.26 0.06 0.00 0.82 0.00 0.00 66.70 67.34 1qvg h VAL 154 Cb 0.46 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.80 1qvg h VAL 154 CO 0.03 0.05 -0.16 0.28 0.02 0.00 0.00 177.57 177.79 1qvg h SER 155 N -0.77 -0.52 -0.57 0.57 0.02 -1.22 0.11 113.55 111.15 1qvg h SER 155 Ca -0.06 0.12 0.12 0.00 -0.84 0.00 0.00 61.79 61.12 1qvg h SER 155 Cb 0.55 0.28 -0.10 0.00 0.14 0.00 0.00 62.40 63.27 1qvg h SER 155 CO 0.10 -0.20 0.01 0.25 -1.14 0.00 0.00 176.83 175.85 1qvg h LEU 156 N -0.13 -0.24 -0.40 5.07 5.85 -1.32 0.46 115.31 124.60 1qvg h LEU 156 Ca 0.15 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 1qvg h LEU 156 Cb 0.35 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1qvg h LEU 156 CO -0.36 -0.09 0.22 -0.07 -0.34 0.00 0.00 178.44 177.80 1qvg h LEU 157 N 0.12 0.51 -1.68 2.25 3.38 -0.23 0.20 115.31 119.86 1qvg h LEU 157 Ca 0.30 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1qvg h LEU 157 Cb 0.47 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1qvg h LEU 157 CO -0.48 0.45 0.23 -0.33 0.09 0.00 0.00 178.44 178.40 1qvg h GLU 158 N 0.52 0.43 0.00 1.13 5.08 0.38 0.16 114.58 122.29 1qvg h GLU 158 Ca 0.14 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 1qvg h GLU 158 Cb 0.06 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1qvg h GLU 158 CO -0.02 0.28 -0.64 0.00 -1.00 0.00 0.00 179.01 177.63 1qvg h ALA 159 N 1.79 0.77 -0.18 3.43 0.00 -0.33 -2.74 119.26 122.00 1qvg h ALA 159 Ca 0.13 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1qvg h ALA 159 Cb -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1qvg h ALA 159 CO -0.03 0.79 0.00 1.28 0.00 0.00 0.00 179.25 181.30 1qvg n LEU 160 N -3.52 1.51 -2.96 0.00 4.77 0.44 -4.91 117.00 112.33 1qvg n LEU 160 Ca -0.00 -0.66 -0.22 0.00 -0.03 0.00 0.00 56.01 55.10 1qvg n LEU 160 Cb 0.69 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.69 1qvg n LEU 160 CO 0.42 0.33 -0.05 0.47 -1.33 0.00 0.00 177.39 177.23 1qvg n ASP 161 N 0.24 -5.67 -0.00 -1.43 8.00 -0.38 -4.82 116.55 112.48 1qvg n ASP 161 Ca 0.15 -0.24 0.01 0.00 0.71 0.00 0.00 54.79 55.41 1qvg n ASP 161 Cb 0.29 -4.62 -0.01 0.00 -0.02 0.00 0.00 41.12 36.77 1qvg n ASP 161 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1qvg n VAL 162 N -4.32 0.00 0.34 2.53 0.31 -0.82 -1.66 118.33 114.71 1qvg n VAL 162 Ca -0.12 -0.48 0.23 0.00 -0.01 0.00 0.00 64.34 63.96 1qvg n VAL 162 Cb 0.62 1.00 1.20 0.00 -0.91 0.00 0.00 33.84 35.76 1qvg n VAL 162 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 1qvg h HIS 163 N 0.02 0.00 0.00 3.52 6.17 -1.87 -2.56 115.15 120.44 1qvg h HIS 163 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.08 1qvg h HIS 163 Cb 0.03 0.00 -0.00 0.00 2.52 0.00 0.00 27.41 29.96 1qvg h HIS 163 CO 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 177.93 178.64 1qvg h ALA 164 N 2.00 1.47 -0.14 5.26 0.00 -1.83 -1.95 119.26 124.08 1qvg h ALA 164 Ca -0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 1qvg h ALA 164 Cb 0.02 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.82 1qvg h ALA 164 CO 0.00 0.00 -0.76 0.22 0.00 0.00 0.00 179.25 178.72 1qvg h ASP 165 N 0.00 0.83 0.42 0.00 3.58 -0.87 -2.40 116.42 117.97 1qvg h ASP 165 Ca -0.00 -0.54 -0.10 0.00 0.42 0.00 0.00 57.03 56.81 1qvg h ASP 165 Cb 0.01 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.80 1qvg h ASP 165 CO 0.00 1.32 -0.46 0.40 -2.88 0.00 0.00 179.24 177.63 1qvg h ILE 166 N 0.48 1.33 -0.19 2.25 2.04 -1.55 -1.13 117.51 120.74 1qvg h ILE 166 Ca -0.04 -1.59 -0.03 0.00 1.00 0.00 0.00 64.86 64.19 1qvg h ILE 166 Cb 1.37 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 39.27 1qvg h ILE 166 CO 0.15 0.46 -0.03 0.44 0.00 0.00 0.00 178.15 179.17 1qvg h ASP 167 N 0.05 0.26 -0.06 1.72 3.45 -1.20 -1.24 116.42 119.40 1qvg h ASP 167 Ca -0.00 -0.04 -0.02 0.00 0.43 0.00 0.00 57.03 57.40 1qvg h ASP 167 Cb 0.83 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.53 1qvg h ASP 167 CO 0.06 0.34 -0.05 -0.09 -1.57 0.00 0.00 179.24 177.93 1qvg h ARG 168 N 0.28 0.14 0.00 3.56 2.43 -0.74 -3.05 114.38 116.99 1qvg h ARG 168 Ca 0.06 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1qvg h ARG 168 Cb 0.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1qvg h ARG 168 CO 0.01 0.58 0.00 0.00 -1.51 0.00 0.00 179.97 179.05 1qvg n ALA 169 N -2.37 2.40 -0.98 2.80 0.00 -0.62 -3.98 120.51 117.77 1qvg n ALA 169 Ca -0.08 -0.15 -0.15 0.00 0.00 0.00 0.00 53.44 53.06 1qvg n ALA 169 Cb 0.29 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.32 1qvg n ALA 169 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1qvg n ASP 170 N -1.03 6.10 -3.55 0.00 4.64 -0.51 -4.34 116.55 117.86 1qvg n ASP 170 Ca 0.18 -2.90 -0.11 0.00 -1.38 0.00 0.00 54.79 50.58 1qvg n ASP 170 Cb 0.09 -1.17 -0.10 0.00 -1.04 0.00 0.00 41.12 38.90 1qvg n ASP 170 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1qvg s GLU 171 N -1.06 0.27 0.23 -0.67 2.02 -1.26 -5.05 118.70 113.18 1qvg s GLU 171 Ca 0.37 0.73 -0.12 0.00 0.02 0.00 0.00 54.97 55.97 1qvg s GLU 171 Cb 0.24 -0.16 -0.08 0.00 0.10 0.00 0.00 34.13 34.24 1qvg s GLU 171 CO -0.06 -0.42 0.60 0.95 0.02 0.00 0.00 175.26 176.36 1qvg s THR 172 N 2.51 4.84 -0.17 3.63 -4.23 -1.26 -4.44 115.64 116.52 1qvg s THR 172 Ca 0.04 0.69 -0.03 0.00 -1.18 0.00 0.00 61.69 61.22 1qvg s THR 172 Cb -0.13 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 70.03 1qvg s THR 172 CO -0.12 -0.01 -0.06 -0.75 -0.54 0.00 0.00 174.62 173.14 1qvg s LYS 173 N -2.62 3.53 -0.50 3.99 2.20 0.27 -4.95 119.74 121.65 1qvg s LYS 173 Ca 0.47 -0.58 -0.21 0.00 -0.36 0.00 0.00 55.97 55.28 1qvg s LYS 173 Cb -0.12 -2.89 0.05 0.00 -1.51 0.00 0.00 37.83 33.36 1qvg s LYS 173 CO 0.20 0.10 0.70 0.42 -0.36 0.00 0.00 175.35 176.41 1qvg s ILE 174 N 0.70 4.75 0.54 5.43 1.01 -1.26 -1.46 121.20 130.90 1qvg s ILE 174 Ca -0.03 -0.19 -0.21 0.00 0.00 0.00 0.00 60.65 60.23 1qvg s ILE 174 Cb -0.15 -4.33 -0.07 0.00 0.01 0.00 0.00 42.46 37.92 1qvg s ILE 174 CO 0.02 -0.83 1.06 0.29 0.00 0.00 0.00 174.94 175.48 1qvg n LYS 175 N 6.49 1.22 -3.23 2.79 5.02 0.07 -5.01 118.16 125.50 1qvg n LYS 175 Ca -0.04 0.45 -0.39 0.00 -2.02 0.00 0.00 58.31 56.32 1qvg n LYS 175 Cb 0.46 -2.22 -0.06 0.00 -0.02 0.00 0.00 35.03 33.20 1qvg n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qvg s ALA 176 N -1.40 3.51 0.00 7.82 0.00 -1.26 -4.88 121.76 125.55 1qvg s ALA 176 Ca 0.71 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.68 1qvg s ALA 176 Cb -0.46 -2.71 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1qvg s ALA 176 CO 0.51 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.89 1qvg n GLY 177 N 2.32 1.93 0.00 0.00 0.00 -1.26 -4.77 105.19 103.42 1qvg n GLY 177 Ca -0.08 -2.01 0.08 0.00 0.00 0.00 0.00 46.02 44.00 1qvg n GLY 177 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1qvg n GLN 178 N 1.06 0.40 -0.35 1.61 6.02 -1.26 -3.26 117.38 121.61 1qvg n GLN 178 Ca 0.00 0.04 0.23 0.00 -0.01 0.00 0.00 57.00 57.26 1qvg n GLN 178 Cb 0.00 -1.50 0.47 0.00 1.02 0.00 0.00 30.24 30.23 1qvg n GLN 178 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1qvg h GLY 179 N 2.43 1.70 -0.99 1.08 0.00 -1.87 0.61 103.07 106.03 1qvg h GLY 179 Ca 0.00 -0.24 0.25 0.00 0.00 0.00 0.00 47.33 47.33 1qvg h GLY 179 CO 0.00 -0.29 -0.07 0.23 0.00 0.00 0.00 176.54 176.40 1qvg h SER 180 N 0.41 -0.65 0.56 0.19 0.87 -1.70 1.02 113.55 114.26 1qvg h SER 180 Ca 0.67 0.29 0.00 0.00 -1.23 0.00 0.00 61.79 61.52 1qvg h SER 180 Cb 1.55 0.54 0.00 0.00 -0.44 0.00 0.00 62.40 64.05 1qvg h SER 180 CO -0.45 -0.35 0.00 0.00 -0.53 0.00 0.00 176.83 175.49 1qvg n ALA 181 N -3.32 1.82 -0.56 6.23 0.00 0.21 -2.20 120.51 122.69 1qvg n ALA 181 Ca 0.21 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.66 1qvg n ALA 181 Cb 0.67 -1.28 0.21 0.00 0.00 0.00 0.00 19.45 19.06 1qvg n ALA 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qvg n ARG 182 N -1.47 2.97 -0.85 0.00 1.74 0.35 -4.95 116.66 114.45 1qvg n ARG 182 Ca 0.05 -2.46 0.00 0.00 -0.77 0.00 0.00 57.85 54.67 1qvg n ARG 182 Cb 0.19 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 1qvg n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qvg n GLY 183 N 0.11 0.60 2.08 -0.13 0.00 -0.93 -4.97 105.19 101.94 1qvg n GLY 183 Ca 0.17 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 1qvg n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qvg n ARG 184 N -2.41 3.52 -0.23 1.61 1.74 -0.88 -4.81 116.66 115.21 1qvg n ARG 184 Ca 0.00 -4.11 -0.02 0.00 -0.77 0.00 0.00 57.85 52.95 1qvg n ARG 184 Cb 0.07 -2.28 0.09 0.00 -1.02 0.00 0.00 32.46 29.31 1qvg n ARG 184 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1qvg h LYS 185 N 2.19 0.69 -6.23 5.56 3.64 -1.76 -3.36 116.57 117.30 1qvg h LYS 185 Ca 0.39 -0.04 -0.48 0.00 -1.27 0.00 0.00 60.65 59.25 1qvg h LYS 185 Cb 1.43 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 33.07 1qvg h LYS 185 CO 0.84 0.46 -0.39 0.71 -2.27 0.00 0.00 179.45 178.80 1qvg s TYR 186 N -6.10 2.85 -0.08 1.91 1.51 -1.26 -0.75 117.35 115.42 1qvg s TYR 186 Ca -0.13 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.26 1qvg s TYR 186 Cb 0.16 -2.01 0.10 0.00 -0.11 0.00 0.00 41.96 40.10 1qvg s TYR 186 CO 0.76 -0.00 0.84 -0.98 -1.11 0.00 0.00 175.55 175.05 1qvg s ARG 187 N -4.10 0.84 -0.02 -0.62 1.04 -0.54 -4.88 118.95 110.68 1qvg s ARG 187 Ca 0.45 0.11 -0.14 0.00 -1.04 0.00 0.00 55.73 55.10 1qvg s ARG 187 Cb -0.06 0.40 0.02 0.00 -2.04 0.00 0.00 34.95 33.27 1qvg s ARG 187 CO 0.28 -0.28 0.30 -0.98 -0.04 0.00 0.00 175.30 174.58 1qvg s ARG 188 N -1.52 0.65 0.72 3.89 1.70 -1.26 0.96 118.95 124.09 1qvg s ARG 188 Ca -0.05 -0.18 -0.16 0.00 -0.47 0.00 0.00 55.73 54.87 1qvg s ARG 188 Cb -0.00 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.65 1qvg s ARG 188 CO 0.03 -0.18 0.71 -2.30 -1.08 0.00 0.00 175.30 172.48 1qvg n PRO 189 N 1.33 0.39 -3.37 3.89 -0.02 -1.26 -4.95 135.00 131.00 1qvg n PRO 189 Ca -0.21 0.18 -0.38 0.00 -2.02 0.00 0.00 63.50 61.06 1qvg n PRO 189 Cb 0.56 -1.99 -0.06 0.00 -0.02 0.00 0.00 33.50 31.99 1qvg n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qvg s ALA 190 N -1.87 3.61 0.00 3.55 0.00 -1.26 -4.46 121.76 121.32 1qvg s ALA 190 Ca 0.69 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.54 1qvg s ALA 190 Cb -0.35 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.23 1qvg s ALA 190 CO 0.55 0.34 0.00 -1.13 0.00 0.00 0.00 175.76 175.52 1qvg n SER 191 N 2.20 0.00 -4.77 0.00 3.41 0.93 -4.89 113.62 110.50 1qvg n SER 191 Ca -0.11 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.11 1qvg n SER 191 Cb 0.52 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.40 1qvg n SER 191 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1qvg s ILE 192 N 3.45 4.22 -0.21 -1.33 1.01 -1.26 -4.55 121.20 122.53 1qvg s ILE 192 Ca 0.00 1.86 -0.07 0.00 0.00 0.00 0.00 60.65 62.45 1qvg s ILE 192 Cb 0.00 -4.17 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 1qvg s ILE 192 CO 0.00 0.40 0.05 -0.22 0.00 0.00 0.00 174.94 175.17 1qvg s LEU 193 N -1.44 3.56 -0.30 2.97 2.96 -1.06 -1.36 118.68 124.00 1qvg s LEU 193 Ca 0.42 -0.08 -0.08 0.00 -0.22 0.00 0.00 54.13 54.18 1qvg s LEU 193 Cb -0.23 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.55 1qvg s LEU 193 CO 0.28 0.09 0.10 -0.36 -1.32 0.00 0.00 176.35 175.13 1qvg s PHE 194 N 0.89 3.15 -0.29 5.38 0.40 0.10 -1.21 117.98 126.40 1qvg s PHE 194 Ca 0.03 -0.87 -0.09 0.00 -0.60 0.00 0.00 56.93 55.40 1qvg s PHE 194 Cb -0.14 -2.28 -0.01 0.00 0.51 0.00 0.00 43.02 41.10 1qvg s PHE 194 CO 0.02 -0.54 0.12 0.08 0.70 0.00 0.00 175.22 175.60 1qvg s VAL 195 N 1.53 4.43 0.00 -0.44 1.01 -0.73 -0.29 120.40 125.91 1qvg s VAL 195 Ca 0.03 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1qvg s VAL 195 Cb -0.17 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1qvg s VAL 195 CO 0.03 0.14 0.00 0.35 0.00 0.00 0.00 175.10 175.62 1qvg n THR 196 N 4.95 0.00 0.00 3.92 -2.24 0.15 -2.52 114.28 118.54 1qvg n THR 196 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1qvg n THR 196 Cb 0.50 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 1qvg n THR 196 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1qvg n SER 197 N -0.06 2.46 -0.02 3.42 2.88 -1.26 -1.65 113.62 119.39 1qvg n SER 197 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 1qvg n SER 197 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1qvg n SER 197 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1qvg h ASP 198 N 0.00 0.28 -5.02 -3.46 3.32 -1.99 -3.44 116.42 106.11 1qvg h ASP 198 Ca 0.00 -0.80 -0.06 0.00 0.02 0.00 0.00 57.03 56.19 1qvg h ASP 198 Cb 0.73 -0.09 -0.16 0.00 0.22 0.00 0.00 39.33 40.03 1qvg h ASP 198 CO 0.00 1.58 0.03 -1.61 -1.72 0.00 0.00 179.24 177.53 1qvg s GLU 199 N -2.45 1.05 0.47 3.56 2.02 -1.26 -5.11 118.70 116.98 1qvg s GLU 199 Ca -0.22 -0.30 -0.25 0.00 0.02 0.00 0.00 54.97 54.22 1qvg s GLU 199 Cb 0.05 0.48 -0.08 0.00 0.10 0.00 0.00 34.13 34.67 1qvg s GLU 199 CO 0.72 -0.39 1.41 -2.30 0.02 0.00 0.00 175.26 174.73 1qvg n PRO 200 N 0.30 2.14 -1.74 0.39 -0.02 -1.26 -4.71 135.00 130.11 1qvg n PRO 200 Ca -0.18 0.77 -0.31 0.00 -2.02 0.00 0.00 63.50 61.76 1qvg n PRO 200 Cb 0.61 -2.61 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 1qvg n PRO 200 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1qvg s SER 201 N -0.55 4.61 0.26 2.55 0.15 -1.26 -4.80 113.70 114.66 1qvg s SER 201 Ca 0.63 0.47 -0.03 0.00 0.70 0.00 0.00 55.95 57.71 1qvg s SER 201 Cb -0.45 -2.53 0.39 0.00 -1.71 0.00 0.00 66.02 61.73 1qvg s SER 201 CO 0.56 -2.95 1.87 0.74 1.20 0.00 0.00 173.24 174.66 1qvg h THR 202 N 7.44 1.07 0.00 6.45 2.02 -1.91 -0.44 112.91 127.54 1qvg h THR 202 Ca -0.15 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.61 1qvg h THR 202 Cb 1.15 -0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1qvg h THR 202 CO 1.15 0.20 -0.13 0.00 0.37 0.00 0.00 175.52 177.11 1qvg h ALA 203 N 1.44 1.17 0.00 6.16 0.00 -1.81 -3.29 119.26 122.94 1qvg h ALA 203 Ca 0.42 -0.12 -0.32 0.00 0.00 0.00 0.00 54.91 54.89 1qvg h ALA 203 Cb 0.18 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1qvg h ALA 203 CO -0.18 0.16 -2.23 0.00 0.00 0.00 0.00 179.25 177.01 1qvg n ALA 204 N -2.24 1.57 -0.27 0.00 0.00 -0.70 -3.59 120.51 115.28 1qvg n ALA 204 Ca -0.01 -1.18 0.06 0.00 0.00 0.00 0.00 53.44 52.31 1qvg n ALA 204 Cb 0.28 -0.14 0.17 0.00 0.00 0.00 0.00 19.45 19.76 1qvg n ALA 204 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1qvg h ARG 205 N 0.00 0.09 0.00 0.00 0.11 -1.18 0.77 114.38 114.17 1qvg h ARG 205 Ca -0.48 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.59 1qvg h ARG 205 Cb 2.10 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 33.15 1qvg h ARG 205 CO 0.03 0.06 0.00 -1.71 0.10 0.00 0.00 179.97 178.45 1qvg n ASN 206 N -5.36 0.00 -4.73 0.08 5.15 -1.26 -4.66 115.26 104.48 1qvg n ASN 206 Ca 0.14 -0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.70 1qvg n ASN 206 Cb 0.50 -0.24 -0.02 0.00 -0.53 0.00 0.00 39.78 39.49 1qvg n ASN 206 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1qvg s LEU 207 N -2.47 4.37 -0.46 1.20 1.43 0.26 -4.84 118.68 118.17 1qvg s LEU 207 Ca 0.14 2.73 -0.42 0.00 -1.03 0.00 0.00 54.13 55.55 1qvg s LEU 207 Cb 0.09 -3.61 -0.17 0.00 0.03 0.00 0.00 46.19 42.53 1qvg s LEU 207 CO 0.20 -0.82 2.08 0.00 0.23 0.00 0.00 176.35 178.04 1qvg n ALA 208 N 3.06 0.21 -0.79 4.21 0.00 -1.26 0.27 120.51 126.20 1qvg n ALA 208 Ca 0.11 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1qvg n ALA 208 Cb 0.38 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1qvg n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qvg n GLY 209 N 6.79 1.28 3.83 0.00 0.00 -1.26 -4.53 105.19 111.30 1qvg n GLY 209 Ca 0.48 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.18 1qvg n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qvg s ALA 210 N -3.64 2.97 -0.00 4.61 0.00 0.14 -0.05 121.76 125.80 1qvg s ALA 210 Ca 0.00 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.22 1qvg s ALA 210 Cb 0.00 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 19.96 1qvg s ALA 210 CO 0.00 -0.40 -0.04 -0.51 0.00 0.00 0.00 175.76 174.81 1qvg s ASP 211 N -2.98 0.47 0.03 0.00 1.01 -0.46 -4.86 116.67 109.88 1qvg s ASP 211 Ca 0.60 -0.09 0.05 0.00 0.71 0.00 0.00 52.55 53.82 1qvg s ASP 211 Cb -0.12 -0.05 -0.03 0.00 1.01 0.00 0.00 42.92 43.73 1qvg s ASP 211 CO 0.33 0.03 -0.10 0.68 0.21 0.00 0.00 175.17 176.32 1qvg s VAL 212 N -0.16 3.36 0.16 -1.27 -7.23 -1.26 -0.72 120.40 113.28 1qvg s VAL 212 Ca 0.01 -0.98 -0.17 0.00 -1.81 0.00 0.00 61.98 59.03 1qvg s VAL 212 Cb -0.02 -2.47 0.03 0.00 0.56 0.00 0.00 36.38 34.48 1qvg s VAL 212 CO -0.00 0.33 0.46 0.00 -0.31 0.00 0.00 175.10 175.58 1qvg s ALA 213 N -1.02 -0.94 -0.07 1.32 0.00 0.60 -4.92 121.76 116.75 1qvg s ALA 213 Ca 0.17 -0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.02 1qvg s ALA 213 Cb -0.11 0.79 -0.03 0.00 0.00 0.00 0.00 23.12 23.77 1qvg s ALA 213 CO 0.08 -0.72 -0.07 0.99 0.00 0.00 0.00 175.76 176.03 1qvg s THR 214 N -3.84 3.66 0.44 0.00 2.01 -1.26 -0.67 115.64 115.98 1qvg s THR 214 Ca 0.06 -0.50 0.23 0.00 0.31 0.00 0.00 61.69 61.79 1qvg s THR 214 Cb 0.00 -2.49 0.43 0.00 0.01 0.00 0.00 72.50 70.45 1qvg s THR 214 CO -0.08 0.59 1.80 0.00 -0.69 0.00 0.00 174.62 176.25 1qvg h ALA 215 N 5.24 2.44 0.00 7.40 0.00 -1.60 0.12 119.26 132.85 1qvg h ALA 215 Ca -0.49 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 1qvg h ALA 215 Cb 1.17 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1qvg h ALA 215 CO 0.52 -0.80 -0.34 0.66 0.00 0.00 0.00 179.25 179.29 1qvg h SER 216 N 0.29 0.00 0.00 0.00 4.64 -1.88 -3.35 113.55 113.25 1qvg h SER 216 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1qvg h SER 216 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1qvg h SER 216 CO -0.20 0.34 0.00 -1.84 -0.87 0.00 0.00 176.83 174.26 1qvg n GLU 217 N -3.49 0.99 -1.71 4.77 0.28 -0.81 -5.06 120.64 115.61 1qvg n GLU 217 Ca -0.00 -0.81 -0.43 0.00 -0.16 0.00 0.00 57.16 55.76 1qvg n GLU 217 Cb 0.49 -0.69 -0.01 0.00 1.43 0.00 0.00 31.44 32.66 1qvg n GLU 217 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 177.13 178.52 1qvg n VAL 218 N -0.17 1.76 -4.69 3.84 3.14 0.34 -4.92 118.33 117.63 1qvg n VAL 218 Ca 0.00 -0.44 -0.31 0.00 -2.96 0.00 0.00 64.34 60.63 1qvg n VAL 218 Cb 0.38 -1.63 -0.08 0.00 -1.06 0.00 0.00 33.84 31.45 1qvg n VAL 218 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1qvg s ASN 219 N -0.13 3.70 0.54 6.55 2.20 -1.26 -5.01 114.94 121.53 1qvg s ASN 219 Ca 0.58 -1.69 0.23 0.00 -0.94 0.00 0.00 52.86 51.04 1qvg s ASN 219 Cb -0.57 0.59 1.43 0.00 -2.00 0.00 0.00 41.25 40.71 1qvg s ASN 219 CO 0.59 -0.92 2.08 0.74 -2.94 0.00 0.00 177.10 176.65 1qvg h THR 220 N 1.47 0.74 -0.05 0.54 2.02 -1.91 0.92 112.91 116.64 1qvg h THR 220 Ca -0.41 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.73 1qvg h THR 220 Cb 1.31 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 1qvg h THR 220 CO 0.67 0.00 -0.15 -0.33 0.37 0.00 0.00 175.52 176.08 1qvg h GLU 221 N 0.00 0.19 -0.38 6.66 5.08 -1.92 0.40 114.58 124.60 1qvg h GLU 221 Ca 0.13 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1qvg h GLU 221 Cb 0.55 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1qvg h GLU 221 CO -0.00 0.76 0.06 -0.44 -1.00 0.00 0.00 179.01 178.39 1qvg h ASP 222 N -0.35 0.60 -0.36 1.42 3.32 -1.77 -0.14 116.42 119.15 1qvg h ASP 222 Ca -0.00 -0.26 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 1qvg h ASP 222 Cb 0.77 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1qvg h ASP 222 CO 0.03 0.71 -0.01 -0.07 -1.72 0.00 0.00 179.24 178.18 1qvg h LEU 223 N 0.47 0.70 -6.13 1.55 4.07 -0.89 -3.37 115.31 111.71 1qvg h LEU 223 Ca 0.11 -0.17 -0.57 0.00 0.08 0.00 0.00 57.88 57.34 1qvg h LEU 223 Cb 0.36 -0.19 -0.38 0.00 1.08 0.00 0.00 40.66 41.54 1qvg h LEU 223 CO 0.01 0.78 -1.04 0.00 -1.08 0.00 0.00 178.44 177.11 1qvg n ALA 224 N -2.48 2.53 -1.64 1.53 0.00 0.13 -3.64 120.51 116.94 1qvg n ALA 224 Ca 0.02 -3.23 -0.47 0.00 0.00 0.00 0.00 53.44 49.76 1qvg n ALA 224 Cb 0.30 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 18.91 1qvg n ALA 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1qvg n PRO 225 N 2.03 1.79 -1.19 0.00 -0.04 -0.08 -0.99 135.00 136.52 1qvg n PRO 225 Ca 0.25 0.64 -0.07 0.00 -0.04 0.00 0.00 63.50 64.28 1qvg n PRO 225 Cb 0.51 -2.31 -0.03 0.00 -0.04 0.00 0.00 33.50 31.63 1qvg n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qvg n GLY 226 N 2.65 0.82 2.86 0.55 0.00 -1.26 -2.52 105.19 108.30 1qvg n GLY 226 Ca 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1qvg n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qvg n GLY 227 N -1.20 0.98 3.61 -0.02 0.00 -0.16 -5.01 105.19 103.39 1qvg n GLY 227 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 1qvg n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qvg s ALA 228 N -3.90 3.56 0.68 4.61 0.00 -1.05 -4.15 121.76 121.51 1qvg s ALA 228 Ca 0.00 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.24 1qvg s ALA 228 Cb 0.00 -3.07 0.01 0.00 0.00 0.00 0.00 23.12 20.06 1qvg s ALA 228 CO 0.00 -0.98 1.09 -2.14 0.00 0.00 0.00 175.76 173.73 1qvg s PRO 229 N 2.56 2.76 0.00 0.00 0.02 -1.26 -3.87 135.00 135.20 1qvg s PRO 229 Ca 0.25 1.26 0.00 0.00 0.02 0.00 0.00 61.00 62.53 1qvg s PRO 229 Cb -0.15 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1qvg s PRO 229 CO 0.11 -1.27 0.00 0.41 -0.33 0.00 0.00 177.00 175.92 1qvg n GLY 230 N -0.91 0.63 3.74 0.52 0.00 -1.26 -4.63 105.19 103.29 1qvg n GLY 230 Ca 0.09 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 1qvg n GLY 230 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qvg s ARG 231 N -1.94 4.29 -0.59 1.61 3.52 -1.24 -3.96 118.95 120.64 1qvg s ARG 231 Ca 0.00 0.46 -0.26 0.00 -0.13 0.00 0.00 55.73 55.80 1qvg s ARG 231 Cb 0.00 -3.40 -0.08 0.00 -1.56 0.00 0.00 34.95 29.90 1qvg s ARG 231 CO 0.00 0.24 2.38 -1.17 -0.81 0.00 0.00 175.30 175.94 1qvg s LEU 232 N 0.34 3.25 0.30 -0.88 2.96 -1.26 -4.80 118.68 118.58 1qvg s LEU 232 Ca 0.26 0.74 0.07 0.00 -0.22 0.00 0.00 54.13 54.97 1qvg s LEU 232 Cb -0.15 -2.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.99 1qvg s LEU 232 CO 0.11 -3.13 0.30 -0.89 -1.32 0.00 0.00 176.35 171.42 1qvg s THR 233 N 12.75 4.09 -0.14 3.68 2.01 -1.26 -2.58 115.64 134.19 1qvg s THR 233 Ca 0.94 -1.27 -0.04 0.00 0.31 0.00 0.00 61.69 61.63 1qvg s THR 233 Cb -0.15 -3.36 0.05 0.00 0.01 0.00 0.00 72.50 69.05 1qvg s THR 233 CO 0.20 -0.24 0.08 0.54 -0.69 0.00 0.00 174.62 174.51 1qvg s VAL 234 N -2.20 -0.04 0.67 3.82 0.11 -0.35 -2.42 120.40 119.98 1qvg s VAL 234 Ca 0.38 -0.07 -0.00 0.00 -2.93 0.00 0.00 61.98 59.36 1qvg s VAL 234 Cb -0.07 -0.52 0.09 0.00 -1.53 0.00 0.00 36.38 34.35 1qvg s VAL 234 CO 0.27 -0.18 0.92 -0.36 -3.33 0.00 0.00 175.10 172.43 1qvg s PHE 235 N 2.12 2.06 -0.07 1.54 0.40 0.59 -1.77 117.98 122.84 1qvg s PHE 235 Ca 0.02 -0.16 0.02 0.00 -0.60 0.00 0.00 56.93 56.21 1qvg s PHE 235 Cb -0.15 -2.92 -0.03 0.00 0.51 0.00 0.00 43.02 40.43 1qvg s PHE 235 CO -0.08 -1.43 -0.11 -0.08 0.70 0.00 0.00 175.22 174.23 1qvg s THR 236 N -3.03 3.33 0.09 0.64 -1.32 -1.05 -1.77 115.64 112.53 1qvg s THR 236 Ca 0.63 -0.61 -0.15 0.00 -1.21 0.00 0.00 61.69 60.35 1qvg s THR 236 Cb -0.07 -2.35 -0.00 0.00 -1.51 0.00 0.00 72.50 68.57 1qvg s THR 236 CO 0.42 0.58 0.81 1.21 -2.21 0.00 0.00 174.62 175.43 1qvg n GLU 237 N 2.53 -0.21 -0.05 7.08 4.07 0.27 0.82 120.64 135.14 1qvg n GLU 237 Ca -0.18 0.80 -0.11 0.00 -0.06 0.00 0.00 57.16 57.62 1qvg n GLU 237 Cb 0.53 -1.17 -0.04 0.00 -0.06 0.00 0.00 31.44 30.69 1qvg n GLU 237 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1qvg h SER 238 N 0.00 0.26 -0.09 4.31 0.02 -1.95 -2.91 113.55 113.19 1qvg h SER 238 Ca 0.10 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1qvg h SER 238 Cb 0.24 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.65 1qvg h SER 238 CO -0.50 0.32 -0.49 0.00 -1.14 0.00 0.00 176.83 175.02 1qvg h ALA 239 N 0.95 -0.87 -0.96 3.77 0.00 0.17 -0.07 119.26 122.24 1qvg h ALA 239 Ca 0.07 -0.06 0.31 0.00 0.00 0.00 0.00 54.91 55.22 1qvg h ALA 239 Cb 0.13 0.96 -0.16 0.00 0.00 0.00 0.00 17.79 18.71 1qvg h ALA 239 CO -0.01 -1.04 0.31 1.25 0.00 0.00 0.00 179.25 179.76 1qvg h LEU 240 N -0.56 0.03 -0.39 0.00 6.46 -0.22 0.47 115.31 121.09 1qvg h LEU 240 Ca 0.02 0.24 -0.10 0.00 -0.12 0.00 0.00 57.88 57.92 1qvg h LEU 240 Cb 0.63 0.31 -0.01 0.00 -0.73 0.00 0.00 40.66 40.86 1qvg h LEU 240 CO -0.38 -0.29 -0.13 0.00 -0.62 0.00 0.00 178.44 177.03 1qvg h ALA 241 N 1.91 0.54 -0.00 1.25 0.00 -1.00 -3.17 119.26 118.79 1qvg h ALA 241 Ca 0.67 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1qvg h ALA 241 Cb 1.53 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1qvg h ALA 241 CO -0.76 0.44 0.00 0.93 0.00 0.00 0.00 179.25 179.87 1qvg h GLU 242 N 0.59 0.00 -1.04 0.00 5.08 0.16 -2.93 114.58 116.43 1qvg h GLU 242 Ca 0.09 -0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.75 1qvg h GLU 242 Cb 0.66 -0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.79 1qvg h GLU 242 CO 0.05 0.22 0.63 0.28 -1.00 0.00 0.00 179.01 179.19 1qvg h VAL 243 N -0.22 0.42 -1.07 3.13 2.07 -1.00 -2.00 116.25 117.59 1qvg h VAL 243 Ca 0.00 -0.14 0.31 0.00 0.82 0.00 0.00 66.70 67.69 1qvg h VAL 243 Cb 0.22 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.92 1qvg h VAL 243 CO -0.00 0.07 0.77 0.00 0.02 0.00 0.00 177.57 178.44 1qvg h ALA 244 N 1.73 3.01 -0.13 1.67 0.00 -1.49 0.34 119.26 124.40 1qvg h ALA 244 Ca 0.68 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.55 1qvg h ALA 244 Cb 1.57 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1qvg h ALA 244 CO -0.47 -1.33 0.00 0.39 0.00 0.00 0.00 179.25 177.85 1qvg n GLU 245 N -4.20 2.18 0.00 0.00 1.02 -0.75 -4.73 120.64 114.16 1qvg n GLU 245 Ca 0.23 -1.74 0.13 0.00 -0.02 0.00 0.00 57.16 55.76 1qvg n GLU 245 Cb 1.14 -1.47 0.78 0.00 -0.02 0.00 0.00 31.44 31.87 1qvg n GLU 245 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85