#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qwv s ARG 6 N 0.00 0.35 0.09 1.09 0.52 -0.82 -4.92 118.95 115.26 2qwv s ARG 6 Ca 0.00 0.52 0.03 0.00 -0.52 0.00 0.00 55.73 55.76 2qwv s ARG 6 Cb 0.00 0.12 -0.03 0.00 0.52 0.00 0.00 34.95 35.55 2qwv s ARG 6 CO 0.00 -0.06 -0.09 -1.12 0.02 0.00 0.00 175.30 174.05 2qwv s SER 7 N 0.80 1.32 0.03 0.23 0.01 -0.38 -1.61 113.70 114.10 2qwv s SER 7 Ca -0.03 -0.80 0.01 0.00 1.31 0.00 0.00 55.95 56.45 2qwv s SER 7 Cb -0.04 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 66.19 2qwv s SER 7 CO -0.12 -0.28 -0.05 -0.36 0.41 0.00 0.00 173.24 172.84 2qwv s PHE 8 N -2.43 0.45 -0.07 2.43 0.08 -0.80 -1.60 117.98 116.05 2qwv s PHE 8 Ca 0.04 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.71 2qwv s PHE 8 Cb -0.03 -0.28 0.00 0.00 -0.57 0.00 0.00 43.02 42.14 2qwv s PHE 8 CO -0.01 -0.10 -0.19 0.42 -0.10 0.00 0.00 175.22 175.24 2qwv s ILE 9 N -1.13 1.67 -0.30 0.64 1.01 -0.65 -0.83 121.20 121.61 2qwv s ILE 9 Ca -0.10 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.75 2qwv s ILE 9 Cb -0.08 -1.46 0.07 0.00 0.01 0.00 0.00 42.46 41.00 2qwv s ILE 9 CO -0.00 0.47 -0.01 -0.22 0.00 0.00 0.00 174.94 175.18 2qwv s LEU 10 N 0.31 3.99 -0.84 2.97 2.96 -0.35 0.05 118.68 127.76 2qwv s LEU 10 Ca -0.13 -1.50 -0.25 0.00 -0.22 0.00 0.00 54.13 52.03 2qwv s LEU 10 Cb -0.16 -1.66 0.02 0.00 0.50 0.00 0.00 46.19 44.90 2qwv s LEU 10 CO 0.06 -0.28 1.48 -0.60 -1.32 0.00 0.00 176.35 175.69 2qwv s ARG 11 N 1.15 3.20 -1.19 1.98 3.52 -0.38 -1.24 118.95 125.98 2qwv s ARG 11 Ca -0.03 -0.46 -0.06 0.00 -0.13 0.00 0.00 55.73 55.05 2qwv s ARG 11 Cb -0.20 -4.72 0.22 0.00 -1.56 0.00 0.00 34.95 28.69 2qwv s ARG 11 CO -0.04 -2.37 1.84 0.00 -0.81 0.00 0.00 175.30 173.92 2qwv n ALA 12 N 10.11 5.66 -1.72 6.12 0.00 -0.36 -3.35 120.51 136.97 2qwv n ALA 12 Ca 0.20 -4.47 -0.43 0.00 0.00 0.00 0.00 53.44 48.74 2qwv n ALA 12 Cb 0.50 -2.64 -0.02 0.00 0.00 0.00 0.00 19.45 17.28 2qwv n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qwv n ARG 13 N 2.17 2.47 -0.98 0.00 1.74 -1.26 -1.11 116.66 119.69 2qwv n ARG 13 Ca 0.40 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 58.36 2qwv n ARG 13 Cb 0.32 -2.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.14 2qwv n ARG 13 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qwv n SER 14 N 2.23 -3.03 -4.60 0.55 3.41 -1.26 -4.92 113.62 106.00 2qwv n SER 14 Ca 0.10 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.29 2qwv n SER 14 Cb 0.35 -1.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.23 2qwv n SER 14 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qwv s ALA 15 N -2.05 3.53 0.39 7.33 0.00 -0.27 -4.74 121.76 125.95 2qwv s ALA 15 Ca 0.00 -0.56 -0.26 0.00 0.00 0.00 0.00 51.96 51.14 2qwv s ALA 15 Cb 0.00 -3.19 -0.11 0.00 0.00 0.00 0.00 23.12 19.83 2qwv s ALA 15 CO 0.00 -1.13 1.21 -0.35 0.00 0.00 0.00 175.76 175.49 2qwv n PRO 16 N 6.02 1.84 0.00 0.00 -0.04 -1.26 -1.75 135.00 139.80 2qwv n PRO 16 Ca 0.01 0.65 0.13 0.00 -0.04 0.00 0.00 63.50 64.25 2qwv n PRO 16 Cb 0.48 -2.27 0.42 0.00 -0.04 0.00 0.00 33.50 32.09 2qwv n PRO 16 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2qwv n THR 17 N -0.09 0.00 -3.25 0.52 -2.24 -1.06 -4.77 114.28 103.39 2qwv n THR 17 Ca 0.07 -0.14 -0.35 0.00 -2.27 0.00 0.00 64.05 61.37 2qwv n THR 17 Cb 0.38 0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 2qwv n THR 17 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qwv s ASP 18 N -2.43 6.86 0.03 3.42 -1.08 -1.26 -4.91 116.67 117.30 2qwv s ASP 18 Ca 0.27 1.19 -0.20 0.00 -0.52 0.00 0.00 52.55 53.29 2qwv s ASP 18 Cb 0.20 -2.33 -0.16 0.00 -1.46 0.00 0.00 42.92 39.16 2qwv s ASP 18 CO 0.49 0.00 1.27 0.28 0.52 0.00 0.00 175.17 177.73 2qwv h SER 19 N 3.14 0.46 0.21 -0.34 0.02 -1.91 -3.03 113.55 112.09 2qwv h SER 19 Ca -0.48 -0.57 -0.01 0.00 -0.84 0.00 0.00 61.79 59.89 2qwv h SER 19 Cb 1.19 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2qwv h SER 19 CO 0.66 0.94 -0.10 -0.61 -1.14 0.00 0.00 176.83 176.58 2qwv h GLN 20 N -0.01 -0.28 -0.00 3.45 5.75 -1.98 -2.97 115.11 119.06 2qwv h GLN 20 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2qwv h GLN 20 Cb 0.88 0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.49 2qwv h GLN 20 CO 0.06 -0.00 0.00 0.00 -2.65 0.00 0.00 178.83 176.24 2qwv h ARG 21 N -0.55 0.00 0.01 1.69 -0.00 -1.98 -1.02 114.38 112.54 2qwv h ARG 21 Ca -0.03 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.45 2qwv h ARG 21 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.38 2qwv h ARG 21 CO 0.05 0.00 -0.00 1.25 0.00 0.00 0.00 179.97 181.26 2qwv h LEU 22 N 0.00 -0.01 -1.05 3.04 5.85 -1.46 -2.50 115.31 119.19 2qwv h LEU 22 Ca 0.00 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.43 2qwv h LEU 22 Cb 0.01 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 2qwv h LEU 22 CO -0.00 0.32 0.64 -0.07 -0.34 0.00 0.00 178.44 178.99 2qwv h LEU 23 N -0.34 1.07 -1.81 2.25 3.38 -1.08 -1.60 115.31 117.18 2qwv h LEU 23 Ca -0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2qwv h LEU 23 Cb 0.34 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2qwv h LEU 23 CO 0.00 0.74 -0.08 0.44 0.09 0.00 0.00 178.44 179.63 2qwv h ASP 24 N 1.24 0.00 -0.12 -0.43 3.32 -1.21 -2.71 116.42 116.52 2qwv h ASP 24 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2qwv h ASP 24 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2qwv h ASP 24 CO -0.11 0.08 0.00 -0.62 -1.72 0.00 0.00 179.24 176.87 2qwv n GLU 25 N -3.33 1.59 -1.70 3.56 -0.58 -0.60 -4.55 120.64 115.03 2qwv n GLU 25 Ca -0.01 -0.89 -0.36 0.00 -0.42 0.00 0.00 57.16 55.49 2qwv n GLU 25 Cb 0.27 -1.39 -0.03 0.00 -0.57 0.00 0.00 31.44 29.72 2qwv n GLU 25 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2qwv s ILE 26 N -1.85 3.11 0.00 -3.67 -1.09 -1.02 0.11 121.20 116.79 2qwv s ILE 26 Ca 0.32 0.05 0.00 0.00 -2.23 0.00 0.00 60.65 58.80 2qwv s ILE 26 Cb 0.17 -3.29 0.00 0.00 -1.58 0.00 0.00 42.46 37.76 2qwv s ILE 26 CO 0.26 -0.29 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 2qwv n GLY 27 N 5.96 0.44 0.42 6.18 0.00 -1.26 -4.96 105.19 111.96 2qwv n GLY 27 Ca 0.32 -0.74 -0.03 0.00 0.00 0.00 0.00 46.02 45.58 2qwv n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qwv n GLY 28 N -2.96 0.02 0.22 -0.02 0.00 0.12 -4.96 105.19 97.60 2qwv n GLY 28 Ca 0.00 -1.85 -0.01 0.00 0.00 0.00 0.00 46.02 44.16 2qwv n GLY 28 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2qwv h LYS 29 N 0.00 0.09 -5.55 1.61 5.09 -1.92 -3.24 116.57 112.65 2qwv h LYS 29 Ca -0.04 -0.01 -0.59 0.00 0.09 0.00 0.00 60.65 60.10 2qwv h LYS 29 Cb 0.13 -0.02 -0.10 0.00 0.10 0.00 0.00 32.23 32.34 2qwv h LYS 29 CO 0.04 0.06 -0.12 0.00 -2.09 0.00 0.00 179.45 177.34 2qwv s HIS 31 N 1.28 3.05 0.55 0.00 0.09 -1.23 -4.62 115.29 114.41 2qwv s HIS 31 Ca 0.23 -1.44 0.39 0.00 -0.00 0.00 0.00 55.06 54.25 2qwv s HIS 31 Cb -0.15 -4.40 2.11 0.00 -0.00 0.00 0.00 32.58 30.14 2qwv s HIS 31 CO 0.09 -1.58 2.28 1.15 -0.00 0.00 0.00 174.74 176.68 2qwv h THR 32 N 5.79 0.13 -0.11 1.30 2.02 -1.77 -2.57 112.91 117.70 2qwv h THR 32 Ca 0.21 -0.13 0.02 0.00 0.77 0.00 0.00 66.41 67.29 2qwv h THR 32 Cb 0.98 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 2qwv h THR 32 CO 1.22 0.01 0.08 1.05 0.37 0.00 0.00 175.52 178.25 2qwv h GLU 33 N 0.00 0.05 0.00 6.66 9.09 -1.89 -2.52 114.58 125.97 2qwv h GLU 33 Ca -0.00 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2qwv h GLU 33 Cb 0.11 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.19 2qwv h GLU 33 CO 0.00 0.03 0.00 -0.84 0.05 0.00 0.00 179.01 178.26 2qwv h ILE 34 N 0.05 0.00 0.05 -1.06 3.07 -1.87 -2.10 117.51 115.64 2qwv h ILE 34 Ca 0.05 -0.40 -0.00 0.00 1.55 0.00 0.00 64.86 66.06 2qwv h ILE 34 Cb 0.14 1.26 0.00 0.00 -0.27 0.00 0.00 36.82 37.95 2qwv h ILE 34 CO -0.00 0.00 -0.02 -0.07 -1.05 0.00 0.00 178.15 177.00 2qwv h LEU 35 N 0.00 -0.06 -0.56 0.16 3.38 -1.66 -1.47 115.31 115.11 2qwv h LEU 35 Ca 0.00 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.57 2qwv h LEU 35 Cb 0.50 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2qwv h LEU 35 CO 0.00 0.42 0.32 0.00 0.09 0.00 0.00 178.44 179.27 2qwv h ALA 36 N 0.35 0.72 -0.49 1.53 0.00 -1.57 -2.75 119.26 117.04 2qwv h ALA 36 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2qwv h ALA 36 Cb 0.49 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2qwv h ALA 36 CO 0.01 0.01 0.03 0.45 0.00 0.00 0.00 179.25 179.75 2qwv h HIS 37 N 0.62 0.85 -0.01 0.00 3.86 -1.40 -3.42 115.15 115.65 2qwv h HIS 37 Ca 0.23 -0.11 -0.59 0.00 -1.16 0.00 0.00 60.37 58.75 2qwv h HIS 37 Cb 0.08 -0.24 0.12 0.00 1.06 0.00 0.00 27.41 28.43 2qwv h HIS 37 CO -0.08 0.77 1.57 0.00 0.86 0.00 0.00 177.93 181.05 2qwv n ASN 41 N 9.01 0.00 0.08 0.00 3.02 -1.26 -4.58 115.26 121.53 2qwv n ASN 41 Ca 0.47 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.98 2qwv n ASN 41 Cb 0.42 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.51 2qwv n ASN 41 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2qwv h SER 42 N 0.00 0.00 0.00 6.41 4.64 -1.91 -3.40 113.55 119.29 2qwv h SER 42 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2qwv h SER 42 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 2qwv h SER 42 CO 0.00 0.86 -2.08 0.18 -0.87 0.00 0.00 176.83 174.92 2qwv n LEU 43 N -3.31 0.00 -4.38 5.97 4.32 -1.26 -4.85 117.00 113.49 2qwv n LEU 43 Ca 0.01 0.00 -0.32 0.00 -0.02 0.00 0.00 56.01 55.68 2qwv n LEU 43 Cb 0.88 0.36 -0.15 0.00 -1.62 0.00 0.00 43.42 42.90 2qwv n LEU 43 CO 0.45 0.36 -0.52 -0.36 -1.22 0.00 0.00 177.39 176.10 2qwv s PHE 44 N -2.47 2.49 0.00 -1.77 0.08 -1.26 0.09 117.98 115.14 2qwv s PHE 44 Ca -0.08 -0.33 0.00 0.00 0.12 0.00 0.00 56.93 56.64 2qwv s PHE 44 Cb 0.05 -1.56 0.00 0.00 -0.57 0.00 0.00 43.02 40.95 2qwv s PHE 44 CO 0.67 0.05 0.00 0.25 -0.10 0.00 0.00 175.22 176.09 2qwv n THR 45 N 2.40 0.00 0.07 0.64 -2.24 0.00 -4.66 114.28 110.50 2qwv n THR 45 Ca -0.17 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 2qwv n THR 45 Cb 0.52 -0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 68.36 2qwv n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qwv h ALA 46 N 0.81 0.50 -0.08 6.98 0.00 -2.00 -3.33 119.26 122.14 2qwv h ALA 46 Ca -0.00 -0.69 -0.11 0.00 0.00 0.00 0.00 54.91 54.12 2qwv h ALA 46 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2qwv h ALA 46 CO 0.00 0.84 -0.36 -0.56 0.00 0.00 0.00 179.25 179.17 2qwv h GLN 47 N 0.18 0.39 0.00 0.00 -0.00 -2.03 -3.49 115.11 110.16 2qwv h GLN 47 Ca -0.05 -0.31 0.02 0.00 -0.00 0.00 0.00 58.65 58.31 2qwv h GLN 47 Cb 1.47 0.06 -0.00 0.00 -0.00 0.00 0.00 27.48 29.00 2qwv h GLN 47 CO 0.14 0.95 0.07 -1.13 -0.00 0.00 0.00 178.83 178.85 2qwv n SER 48 N -4.37 -0.11 -4.80 0.06 3.41 -1.25 -5.16 113.62 101.39 2qwv n SER 48 Ca -0.08 -1.04 -0.31 0.00 -0.26 0.00 0.00 58.87 57.18 2qwv n SER 48 Cb 0.52 0.17 0.06 0.00 -0.26 0.00 0.00 64.21 64.70 2qwv n SER 48 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 2qwv s HIS 49 N -3.76 2.93 0.44 7.33 -3.43 -1.26 -0.82 115.29 116.72 2qwv s HIS 49 Ca 0.02 1.47 -0.14 0.00 -0.80 0.00 0.00 55.06 55.62 2qwv s HIS 49 Cb -0.00 -2.95 -0.07 0.00 -1.43 0.00 0.00 32.58 28.12 2qwv s HIS 49 CO 0.00 -1.39 0.85 1.03 -2.00 0.00 0.00 174.74 173.23 2qwv s ARG 50 N -4.85 3.88 0.17 -0.38 0.52 0.11 -4.78 118.95 113.62 2qwv s ARG 50 Ca 0.60 0.69 -0.12 0.00 -0.52 0.00 0.00 55.73 56.38 2qwv s ARG 50 Cb -0.15 -2.30 -0.07 0.00 0.52 0.00 0.00 34.95 32.95 2qwv s ARG 50 CO 0.53 -0.10 0.54 -1.21 0.02 0.00 0.00 175.30 175.08 2qwv s GLU 51 N -3.80 3.90 -1.19 3.54 0.41 -1.26 -4.44 118.70 115.85 2qwv s GLU 51 Ca 0.55 0.39 -0.00 0.00 -0.41 0.00 0.00 54.97 55.50 2qwv s GLU 51 Cb -0.10 -2.84 -0.00 0.00 -1.78 0.00 0.00 34.13 29.41 2qwv s GLU 51 CO 0.29 0.43 0.99 -0.25 -0.49 0.00 0.00 175.26 176.23 2qwv n ASP 52 N 0.48 -2.28 -4.01 -0.19 10.43 -1.26 -4.91 116.55 114.81 2qwv n ASP 52 Ca -0.03 -0.63 -0.20 0.00 2.57 0.00 0.00 54.79 56.50 2qwv n ASP 52 Cb 0.52 -5.12 -0.15 0.00 1.84 0.00 0.00 41.12 38.20 2qwv n ASP 52 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2qwv s VAL 53 N -3.36 0.76 -0.03 2.53 1.01 -1.26 -1.95 120.40 118.09 2qwv s VAL 53 Ca 0.02 -0.38 0.03 0.00 0.00 0.00 0.00 61.98 61.66 2qwv s VAL 53 Cb -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2qwv s VAL 53 CO 0.73 0.23 -0.12 -0.69 0.00 0.00 0.00 175.10 175.25 2qwv s VAL 54 N -0.00 0.99 -0.09 2.92 1.01 -0.63 -0.55 120.40 124.04 2qwv s VAL 54 Ca 0.00 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.55 2qwv s VAL 54 Cb -0.06 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.46 2qwv s VAL 54 CO 0.00 0.30 -0.19 -0.51 0.00 0.00 0.00 175.10 174.69 2qwv s ILE 55 N 0.16 1.71 -0.24 2.22 2.07 0.06 -1.90 121.20 125.28 2qwv s ILE 55 Ca -0.04 -0.81 -0.08 0.00 -1.41 0.00 0.00 60.65 58.31 2qwv s ILE 55 Cb -0.10 -1.50 -0.04 0.00 0.13 0.00 0.00 42.46 40.95 2qwv s ILE 55 CO 0.01 0.48 0.11 -1.00 -1.91 0.00 0.00 174.94 172.63 2qwv s HIS 56 N 0.49 3.17 -0.29 3.50 3.76 -0.01 -0.87 115.29 125.03 2qwv s HIS 56 Ca -0.17 -0.14 -0.07 0.00 -0.15 0.00 0.00 55.06 54.53 2qwv s HIS 56 Cb -0.17 -2.25 0.00 0.00 1.11 0.00 0.00 32.58 31.28 2qwv s HIS 56 CO 0.07 -0.18 0.08 -0.51 -0.85 0.00 0.00 174.74 173.35 2qwv s LEU 57 N 1.37 3.82 -0.48 0.89 2.01 -0.24 -1.22 118.68 124.84 2qwv s LEU 57 Ca 0.06 -0.65 -0.16 0.00 0.01 0.00 0.00 54.13 53.39 2qwv s LEU 57 Cb -0.15 -1.89 0.08 0.00 0.01 0.00 0.00 46.19 44.24 2qwv s LEU 57 CO 0.05 -0.18 0.42 -0.69 1.01 0.00 0.00 176.35 176.97 2qwv s VAL 58 N 1.52 5.21 -0.17 -1.59 1.01 -0.37 -0.75 120.40 125.25 2qwv s VAL 58 Ca 0.03 -1.06 -0.18 0.00 0.00 0.00 0.00 61.98 60.77 2qwv s VAL 58 Cb -0.17 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2qwv s VAL 58 CO 0.03 -0.62 0.50 -0.76 0.00 0.00 0.00 175.10 174.24 2qwv s LEU 59 N 1.71 4.19 -0.01 3.92 1.02 0.15 -1.22 118.68 128.44 2qwv s LEU 59 Ca 0.05 0.71 0.02 0.00 0.02 0.00 0.00 54.13 54.93 2qwv s LEU 59 Cb -0.24 -2.69 -0.03 0.00 0.02 0.00 0.00 46.19 43.24 2qwv s LEU 59 CO 0.07 -0.12 0.04 -0.62 0.02 0.00 0.00 176.35 175.74 2qwv n GLU 60 N 4.42 1.56 -1.84 1.70 1.02 -0.90 -1.66 120.64 124.95 2qwv n GLU 60 Ca -0.06 -0.01 -0.30 0.00 -0.02 0.00 0.00 57.16 56.77 2qwv n GLU 60 Cb 0.51 -1.06 -0.07 0.00 -0.02 0.00 0.00 31.44 30.80 2qwv n GLU 60 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2qwv n SER 61 N -1.80 2.81 -4.50 1.62 2.88 -0.72 -4.75 113.62 109.16 2qwv n SER 61 Ca -0.02 -2.68 -0.27 0.00 -1.33 0.00 0.00 58.87 54.58 2qwv n SER 61 Cb 0.28 -1.61 -0.10 0.00 -0.75 0.00 0.00 64.21 62.03 2qwv n SER 61 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2qwv s THR 62 N 10.43 2.78 0.18 2.46 -1.32 -1.26 -2.56 115.64 126.34 2qwv s THR 62 Ca 0.68 -1.88 -0.05 0.00 -1.21 0.00 0.00 61.69 59.22 2qwv s THR 62 Cb 0.02 -2.36 -0.05 0.00 -1.51 0.00 0.00 72.50 68.59 2qwv s THR 62 CO 0.14 -0.14 1.49 0.08 -2.21 0.00 0.00 174.62 173.99 2qwv h ARG 63 N 2.98 0.66 0.00 7.08 -0.00 -1.99 -3.47 114.38 119.65 2qwv h ARG 63 Ca -0.46 -0.40 0.00 0.00 -0.00 0.00 0.00 59.98 59.12 2qwv h ARG 63 Cb 1.21 0.04 0.00 0.00 -0.00 0.00 0.00 29.97 31.22 2qwv h ARG 63 CO 0.52 1.02 0.00 -0.40 -0.00 0.00 0.00 179.97 181.11 2qwv n ASP 64 N -3.99 0.00 -4.62 0.08 3.85 -1.26 -5.12 116.55 105.49 2qwv n ASP 64 Ca -0.03 0.00 -0.32 0.00 -0.71 0.00 0.00 54.79 53.73 2qwv n ASP 64 Cb 0.59 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.27 2qwv n ASP 64 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 2qwv s TYR 65 N 0.00 2.94 0.69 2.11 2.02 -1.26 -5.11 117.35 118.74 2qwv s TYR 65 Ca 0.00 -0.01 -0.12 0.00 -0.37 0.00 0.00 57.07 56.57 2qwv s TYR 65 Cb 0.00 -1.62 0.01 0.00 -0.40 0.00 0.00 41.96 39.96 2qwv s TYR 65 CO 0.00 0.40 1.08 -1.54 -1.57 0.00 0.00 175.55 173.92 2qwv s SER 66 N -1.52 5.12 -0.16 2.29 1.04 -1.26 -4.85 113.70 114.36 2qwv s SER 66 Ca 0.18 1.79 -0.04 0.00 0.48 0.00 0.00 55.95 58.37 2qwv s SER 66 Cb -0.11 -2.52 -0.03 0.00 0.10 0.00 0.00 66.02 63.46 2qwv s SER 66 CO 0.09 -1.62 -0.03 -0.13 0.98 0.00 0.00 173.24 172.53 2qwv s ARG 67 N -4.64 3.66 -0.29 4.02 1.81 -0.66 -4.12 118.95 118.72 2qwv s ARG 67 Ca 0.62 -0.52 -0.09 0.00 -1.72 0.00 0.00 55.73 54.02 2qwv s ARG 67 Cb -0.17 -2.93 -0.02 0.00 -0.45 0.00 0.00 34.95 31.38 2qwv s ARG 67 CO 0.49 0.21 0.13 0.99 -0.68 0.00 0.00 175.30 176.44 2qwv s THR 68 N 0.45 4.55 -0.43 0.02 2.01 0.19 -0.67 115.64 121.76 2qwv s THR 68 Ca -0.03 -0.31 -0.12 0.00 0.31 0.00 0.00 61.69 61.53 2qwv s THR 68 Cb -0.14 -3.25 0.06 0.00 0.01 0.00 0.00 72.50 69.17 2qwv s THR 68 CO 0.03 0.16 0.30 -0.63 -0.69 0.00 0.00 174.62 173.79 2qwv s ILE 69 N 1.62 4.74 -0.17 1.82 1.09 0.07 -0.79 121.20 129.59 2qwv s ILE 69 Ca 0.05 -1.10 -0.19 0.00 -1.10 0.00 0.00 60.65 58.32 2qwv s ILE 69 Cb -0.16 -3.80 -0.03 0.00 -1.06 0.00 0.00 42.46 37.41 2qwv s ILE 69 CO 0.06 -0.45 0.52 -0.89 -0.10 0.00 0.00 174.94 174.08 2qwv s THR 70 N 1.55 5.12 -0.13 2.92 2.01 -0.22 -1.07 115.64 125.82 2qwv s THR 70 Ca 0.03 1.00 0.01 0.00 0.31 0.00 0.00 61.69 63.04 2qwv s THR 70 Cb -0.22 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.42 2qwv s THR 70 CO 0.05 0.22 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.37 2qwv s VAL 71 N 1.28 2.84 -0.29 3.82 1.01 -0.05 -1.59 120.40 127.42 2qwv s VAL 71 Ca 0.26 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 2qwv s VAL 71 Cb -0.15 -2.18 0.05 0.00 0.00 0.00 0.00 36.38 34.09 2qwv s VAL 71 CO 0.10 0.53 -0.02 -1.61 0.00 0.00 0.00 175.10 174.11 2qwv s GLU 72 N 0.38 2.49 0.32 2.72 2.02 -1.01 -0.76 118.70 124.87 2qwv s GLU 72 Ca -0.12 -1.22 0.10 0.00 0.02 0.00 0.00 54.97 53.75 2qwv s GLU 72 Cb -0.16 -3.13 0.90 0.00 0.10 0.00 0.00 34.13 31.83 2qwv s GLU 72 CO 0.06 -0.58 1.73 0.00 0.02 0.00 0.00 175.26 176.49 2qwv h ALA 73 N 7.99 1.81 -0.95 5.21 0.00 -1.13 0.37 119.26 132.55 2qwv h ALA 73 Ca -0.23 0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.88 2qwv h ALA 73 Cb 1.07 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 2qwv h ALA 73 CO 0.53 -0.29 0.61 -0.91 0.00 0.00 0.00 179.25 179.20 2qwv h ASN 74 N 0.57 0.96 0.00 0.00 2.35 -1.78 -3.35 115.58 114.33 2qwv h ASN 74 Ca 0.65 0.02 -0.15 0.00 -0.55 0.00 0.00 56.30 56.26 2qwv h ASN 74 Cb 1.25 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.41 2qwv h ASN 74 CO -0.48 0.60 -1.13 -0.62 -1.65 0.00 0.00 177.43 174.16 2qwv n GLU 75 N -4.55 0.52 0.00 0.81 -0.58 0.06 -5.09 120.64 111.81 2qwv n GLU 75 Ca 0.15 0.48 0.00 0.00 -0.42 0.00 0.00 57.16 57.36 2qwv n GLU 75 Cb 0.20 -1.66 0.00 0.00 -0.57 0.00 0.00 31.44 29.41 2qwv n GLU 75 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2qwv n ILE 76 N -4.48 0.00 0.00 -3.67 -0.00 -0.85 -4.74 119.36 105.61 2qwv n ILE 76 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.51 2qwv n ILE 76 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.18 2qwv n ILE 76 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2qwv n GLY 81 N 0.00 0.00 4.83 7.39 0.00 -1.26 -5.06 105.19 111.08 2qwv n GLY 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qwv n GLY 81 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qwv n PHE 82 N 0.00 0.00 -2.03 1.61 -1.74 -1.26 -4.96 117.46 109.08 2qwv n PHE 82 Ca 0.00 0.00 -0.32 0.00 -0.56 0.00 0.00 57.45 56.57 2qwv n PHE 82 Cb 0.00 -0.79 0.00 0.00 1.52 0.00 0.00 39.48 40.22 2qwv n PHE 82 CO 0.00 0.00 0.00 -3.38 -0.56 0.00 0.00 176.76 172.82 2qwv s HIS 83 N -0.61 3.25 0.23 2.97 -3.43 -1.26 -4.86 115.29 111.59 2qwv s HIS 83 Ca 0.00 1.45 -0.13 0.00 -0.80 0.00 0.00 55.06 55.58 2qwv s HIS 83 Cb 0.00 -2.87 0.30 0.00 -1.43 0.00 0.00 32.58 28.57 2qwv s HIS 83 CO 0.00 -0.85 1.60 1.49 -2.00 0.00 0.00 174.74 174.98 2qwv h GLU 84 N 0.23 -0.02 -0.22 -0.38 4.81 -1.93 -0.72 114.58 116.34 2qwv h GLU 84 Ca -0.46 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.74 2qwv h GLU 84 Cb 1.20 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 2qwv h GLU 84 CO 0.59 -0.01 -0.00 0.00 -0.73 0.00 0.00 179.01 178.86 2qwv h ALA 85 N 1.67 1.58 0.08 2.92 0.00 -1.97 -0.25 119.26 123.30 2qwv h ALA 85 Ca 0.35 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2qwv h ALA 85 Cb 0.56 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2qwv h ALA 85 CO -0.79 0.31 -0.04 0.00 0.00 0.00 0.00 179.25 178.73 2qwv h ALA 86 N 1.68 -0.11 -0.11 0.00 0.00 -1.50 -0.68 119.26 118.53 2qwv h ALA 86 Ca 0.07 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2qwv h ALA 86 Cb 0.22 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2qwv h ALA 86 CO 0.01 -0.31 -0.45 -0.07 0.00 0.00 0.00 179.25 178.42 2qwv h LEU 87 N -0.61 0.29 -0.64 0.00 3.38 -1.50 -2.19 115.31 114.04 2qwv h LEU 87 Ca -0.01 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2qwv h LEU 87 Cb 0.51 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2qwv h LEU 87 CO 0.02 0.71 0.15 0.40 0.09 0.00 0.00 178.44 179.81 2qwv h ILE 88 N 0.22 1.26 -0.53 1.22 1.08 -1.10 -2.90 117.51 116.76 2qwv h ILE 88 Ca 0.02 -0.94 -0.00 0.00 -0.39 0.00 0.00 64.86 63.55 2qwv h ILE 88 Cb 0.89 0.64 -0.03 0.00 -3.07 0.00 0.00 36.82 35.25 2qwv h ILE 88 CO 0.07 0.35 0.33 0.00 -0.69 0.00 0.00 178.15 178.21 2qwv h ALA 89 N 1.05 1.57 -0.86 1.87 0.00 -0.69 -1.31 119.26 120.90 2qwv h ALA 89 Ca 0.20 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2qwv h ALA 89 Cb 0.36 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2qwv h ALA 89 CO 0.00 0.38 0.56 1.25 0.00 0.00 0.00 179.25 181.44 2qwv h LEU 90 N 0.73 0.95 -0.36 0.00 5.85 -1.22 -1.65 115.31 119.62 2qwv h LEU 90 Ca 0.19 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.78 2qwv h LEU 90 Cb -0.04 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 2qwv h LEU 90 CO -0.04 0.68 -0.22 -0.07 -0.34 0.00 0.00 178.44 178.45 2qwv h LEU 91 N 1.12 0.81 -0.92 2.25 3.38 -1.12 -1.81 115.31 119.02 2qwv h LEU 91 Ca 0.33 -0.42 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 2qwv h LEU 91 Cb -0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2qwv h LEU 91 CO -0.09 1.06 0.05 -0.37 0.09 0.00 0.00 178.44 179.17 2qwv h VAL 92 N 0.57 1.24 -0.78 1.22 -1.51 -0.93 0.66 116.25 116.72 2qwv h VAL 92 Ca 0.07 -0.96 -0.02 0.00 -1.23 0.00 0.00 66.70 64.56 2qwv h VAL 92 Cb 0.77 0.80 -0.04 0.00 -2.13 0.00 0.00 31.29 30.69 2qwv h VAL 92 CO 0.06 0.35 0.40 0.50 -1.23 0.00 0.00 177.57 177.64 2qwv h LYS 93 N 0.79 1.11 -0.29 5.19 3.64 -1.21 -1.82 116.57 123.98 2qwv h LYS 93 Ca 0.16 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 2qwv h LYS 93 Cb 0.41 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2qwv h LYS 93 CO 0.01 0.85 -0.11 0.00 -2.27 0.00 0.00 179.45 177.93 2qwv h ALA 94 N 1.20 0.40 -0.25 5.00 0.00 -0.31 -2.29 119.26 123.01 2qwv h ALA 94 Ca 0.27 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2qwv h ALA 94 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2qwv h ALA 94 CO -0.04 0.26 -0.17 -0.07 0.00 0.00 0.00 179.25 179.23 2qwv h LEU 95 N 0.33 0.42 -1.10 0.00 -0.00 -0.83 -2.36 115.31 111.77 2qwv h LEU 95 Ca 0.07 -0.12 -0.09 0.00 -0.00 0.00 0.00 57.88 57.74 2qwv h LEU 95 Cb 0.62 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.15 2qwv h LEU 95 CO 0.04 0.61 -0.42 0.44 -0.00 0.00 0.00 178.44 179.11 2qwv h ASP 96 N 0.40 0.00 1.13 -0.43 3.32 -1.23 -1.69 116.42 117.92 2qwv h ASP 96 Ca 0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 2qwv h ASP 96 Cb 0.53 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 2qwv h ASP 96 CO 0.03 0.42 -0.06 0.00 -1.72 0.00 0.00 179.24 177.91 2qwv h ALA 97 N 1.58 1.00 -0.00 3.45 0.00 -0.89 -3.24 119.26 121.16 2qwv h ALA 97 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qwv h ALA 97 Cb 0.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2qwv h ALA 97 CO 0.05 0.08 -0.54 -1.13 0.00 0.00 0.00 179.25 177.71 2qwv n SER 98 N -3.17 0.57 -4.67 0.00 3.41 -0.65 -4.92 113.62 104.19 2qwv n SER 98 Ca 0.01 -0.34 -0.42 0.00 -0.26 0.00 0.00 58.87 57.85 2qwv n SER 98 Cb 0.37 0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 2qwv n SER 98 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qwv s VAL 99 N -2.98 3.11 0.00 -3.33 0.11 -1.15 -4.93 120.40 111.23 2qwv s VAL 99 Ca 0.11 0.35 0.00 0.00 -2.93 0.00 0.00 61.98 59.52 2qwv s VAL 99 Cb 0.17 -3.23 0.00 0.00 -1.53 0.00 0.00 36.38 31.80 2qwv s VAL 99 CO 0.71 -0.02 0.00 0.61 -3.33 0.00 0.00 175.10 173.07 2qwv n GLY 100 N 4.22 0.79 3.52 6.54 0.00 -1.26 -5.11 105.19 113.90 2qwv n GLY 100 Ca 0.18 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 2qwv n GLY 100 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qwv s GLY 102 N -1.62 2.50 0.29 -0.02 0.00 -1.26 -5.22 107.32 101.99 2qwv s GLY 102 Ca 0.00 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.03 2qwv s GLY 102 CO 0.00 -1.87 1.52 0.54 0.00 0.00 0.00 173.10 173.29 2qwv s LYS 103 N -3.78 4.17 -1.18 2.90 -0.14 -1.26 -3.22 119.74 117.23 2qwv s LYS 103 Ca 0.26 2.48 -0.05 0.00 -1.36 0.00 0.00 55.97 57.29 2qwv s LYS 103 Cb 0.04 -3.04 0.01 0.00 -1.68 0.00 0.00 37.83 33.16 2qwv s LYS 103 CO 0.14 -0.54 0.71 0.39 -0.76 0.00 0.00 175.35 175.29 2qwv n GLU 104 N 1.93 -5.15 -4.04 1.68 -0.58 -0.85 -5.01 120.64 108.62 2qwv n GLU 104 Ca 0.06 0.70 -0.23 0.00 -0.42 0.00 0.00 57.16 57.27 2qwv n GLU 104 Cb 0.39 -5.22 -0.04 0.00 -0.57 0.00 0.00 31.44 26.00 2qwv n GLU 104 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 2qwv s GLN 105 N -5.75 3.13 -0.04 3.49 0.00 -1.20 -4.90 119.66 114.39 2qwv s GLN 105 Ca 0.35 -0.86 0.04 0.00 -0.00 0.00 0.00 55.36 54.89 2qwv s GLN 105 Cb -0.16 -2.73 0.00 0.00 0.00 0.00 0.00 33.01 30.13 2qwv s GLN 105 CO 0.44 0.45 -0.14 0.99 0.00 0.00 0.00 175.29 177.02 2qwv s THR 106 N -1.94 1.20 -0.03 3.63 2.01 -1.26 -1.96 115.64 117.29 2qwv s THR 106 Ca 0.33 -0.58 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 2qwv s THR 106 Cb -0.09 -1.05 0.03 0.00 0.01 0.00 0.00 72.50 71.40 2qwv s THR 106 CO 0.26 0.36 0.04 -0.13 -0.69 0.00 0.00 174.62 174.46 2qwv s ARG 107 N 0.16 -0.00 -0.28 4.92 0.52 -0.42 -5.02 118.95 118.83 2qwv s ARG 107 Ca -0.05 0.28 -0.29 0.00 -0.52 0.00 0.00 55.73 55.15 2qwv s ARG 107 Cb -0.11 -0.44 0.01 0.00 0.52 0.00 0.00 34.95 34.92 2qwv s ARG 107 CO 0.02 -0.26 1.13 0.08 0.02 0.00 0.00 175.30 176.29 2qwv s VAL 108 N 1.70 4.45 -0.11 3.52 1.01 -1.26 -1.37 120.40 128.34 2qwv s VAL 108 Ca -0.01 1.70 -0.23 0.00 0.00 0.00 0.00 61.98 63.45 2qwv s VAL 108 Cb -0.12 -4.29 -0.27 0.00 0.00 0.00 0.00 36.38 31.69 2qwv s VAL 108 CO -0.03 -0.37 0.68 0.58 0.00 0.00 0.00 175.10 175.96 2qwv h VAL 109 N 5.68 1.41 -3.07 2.92 2.07 -1.61 -3.49 116.25 120.17 2qwv h VAL 109 Ca -0.22 -2.39 0.05 0.00 0.82 0.00 0.00 66.70 64.96 2qwv h VAL 109 Cb 1.07 3.02 -0.05 0.00 -1.52 0.00 0.00 31.29 33.81 2qwv h VAL 109 CO 1.01 0.62 0.20 0.00 0.02 0.00 0.00 177.57 179.42 2qwv s GLN 110 N -2.36 1.79 -0.37 1.57 -2.07 -1.17 -5.02 119.66 112.04 2qwv s GLN 110 Ca -0.19 -1.05 -0.41 0.00 -1.82 0.00 0.00 55.36 51.89 2qwv s GLN 110 Cb 0.01 0.60 -0.16 0.00 -1.09 0.00 0.00 33.01 32.36 2qwv s GLN 110 CO 0.74 -0.82 1.83 -2.30 -1.32 0.00 0.00 175.29 173.42 2qwv n PRO 111 N -0.46 0.75 -2.28 9.60 -0.02 -1.26 -1.05 135.00 140.29 2qwv n PRO 111 Ca -0.04 0.26 -0.08 0.00 -2.02 0.00 0.00 63.50 61.63 2qwv n PRO 111 Cb 0.59 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 2qwv n PRO 111 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qwv n GLY 112 N 4.92 0.13 2.95 -1.23 0.00 -1.26 -3.35 105.19 107.35 2qwv n GLY 112 Ca 0.33 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 2qwv n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qwv s LEU 113 N -2.36 0.61 -0.05 0.99 2.96 -0.21 -2.39 118.68 118.22 2qwv s LEU 113 Ca 0.04 0.35 -0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2qwv s LEU 113 Cb -0.02 0.45 0.01 0.00 0.50 0.00 0.00 46.19 47.13 2qwv s LEU 113 CO 0.05 -0.16 0.17 -0.89 -1.32 0.00 0.00 176.35 174.20 2qwv s THR 114 N 1.25 0.01 -0.06 3.68 2.01 -0.62 -1.46 115.64 120.46 2qwv s THR 114 Ca -0.09 -0.11 0.06 0.00 0.31 0.00 0.00 61.69 61.86 2qwv s THR 114 Cb -0.11 -0.28 -0.01 0.00 0.01 0.00 0.00 72.50 72.11 2qwv s THR 114 CO -0.07 -0.06 -0.24 0.54 -0.69 0.00 0.00 174.62 174.10 2qwv s VAL 115 N -0.16 1.97 0.01 3.82 0.11 -0.47 -1.05 120.40 124.63 2qwv s VAL 115 Ca -0.02 -1.02 0.01 0.00 -2.93 0.00 0.00 61.98 58.02 2qwv s VAL 115 Cb -0.02 -1.67 -0.01 0.00 -1.53 0.00 0.00 36.38 33.15 2qwv s VAL 115 CO 0.00 0.55 -0.05 -0.13 -3.33 0.00 0.00 175.10 172.15 2qwv s ARG 116 N -0.11 0.37 -0.73 1.54 0.52 0.03 -1.31 118.95 119.26 2qwv s ARG 116 Ca -0.04 -0.33 -0.02 0.00 -0.52 0.00 0.00 55.73 54.82 2qwv s ARG 116 Cb -0.14 -0.27 0.32 0.00 0.52 0.00 0.00 34.95 35.39 2qwv s ARG 116 CO 0.04 0.06 2.15 0.25 0.02 0.00 0.00 175.30 177.82 2qwv n THR 117 N 2.50 3.53 -4.04 0.02 -2.24 -0.83 0.55 114.28 113.77 2qwv n THR 117 Ca -0.16 -3.72 -0.32 0.00 -2.27 0.00 0.00 64.05 57.58 2qwv n THR 117 Cb 0.57 -1.28 -0.06 0.00 -2.10 0.00 0.00 70.33 67.46 2qwv n THR 117 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2qwv s ILE 118 N -4.48 4.84 0.94 2.28 2.07 -1.26 -2.00 121.20 123.60 2qwv s ILE 118 Ca 0.55 -0.46 -0.12 0.00 -1.41 0.00 0.00 60.65 59.20 2qwv s ILE 118 Cb 0.44 -3.27 0.15 0.00 0.13 0.00 0.00 42.46 39.91 2qwv s ILE 118 CO -0.29 0.27 1.11 -0.55 -1.91 0.00 0.00 174.94 173.56 2qwv s SER 119 N -2.01 3.20 0.07 4.50 0.15 -1.26 -4.54 113.70 113.81 2qwv s SER 119 Ca 0.26 1.15 -0.32 0.00 0.70 0.00 0.00 55.95 57.75 2qwv s SER 119 Cb -0.12 -1.80 -0.19 0.00 -1.71 0.00 0.00 66.02 62.20 2qwv s SER 119 CO 0.18 -2.76 1.60 0.15 1.20 0.00 0.00 173.24 173.61 2qwv h PHE 120 N -1.64 -0.78 -0.18 3.44 3.57 -1.98 -2.22 116.94 117.16 2qwv h PHE 120 Ca -0.52 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 60.90 2qwv h PHE 120 Cb 1.32 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 40.30 2qwv h PHE 120 CO 0.32 -0.48 -0.17 1.05 -2.23 0.00 0.00 178.31 176.81 2qwv h GLU 121 N -0.86 0.29 -0.83 1.11 9.09 -1.99 -1.10 114.58 120.30 2qwv h GLU 121 Ca -0.09 -0.08 -0.02 0.00 0.05 0.00 0.00 59.36 59.23 2qwv h GLU 121 Cb 0.65 -0.03 -0.04 0.00 -1.65 0.00 0.00 28.75 27.68 2qwv h GLU 121 CO 0.14 0.46 0.45 0.00 0.05 0.00 0.00 179.01 180.12 2qwv h ALA 122 N 1.56 1.24 -0.20 1.06 0.00 -1.93 -0.67 119.26 120.33 2qwv h ALA 122 Ca 0.05 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.63 2qwv h ALA 122 Cb 0.46 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qwv h ALA 122 CO 0.03 0.62 -0.68 1.25 0.00 0.00 0.00 179.25 180.46 2qwv h LEU 123 N 1.16 0.90 0.02 0.00 5.85 -0.62 -2.81 115.31 119.81 2qwv h LEU 123 Ca 0.29 -0.55 0.02 0.00 0.84 0.00 0.00 57.88 58.48 2qwv h LEU 123 Cb 0.03 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 2qwv h LEU 123 CO -0.05 1.34 -0.15 -0.07 -0.34 0.00 0.00 178.44 179.17 2qwv h LEU 124 N 0.56 -0.43 -0.62 2.25 3.38 -0.97 -1.28 115.31 118.21 2qwv h LEU 124 Ca -0.02 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.13 2qwv h LEU 124 Cb 1.30 0.18 -0.11 0.00 0.09 0.00 0.00 40.66 42.11 2qwv h LEU 124 CO 0.14 -0.21 -0.13 1.23 0.09 0.00 0.00 178.44 179.56 2qwv h GLY 125 N -0.26 0.48 0.77 0.83 0.00 -1.07 0.35 103.07 104.17 2qwv h GLY 125 Ca 0.04 0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 2qwv h GLY 125 CO -0.13 -0.23 -0.40 0.83 0.00 0.00 0.00 176.54 176.61 2qwv h GLU 126 N 0.02 -0.92 -0.28 4.80 5.08 -1.27 -3.15 114.58 118.86 2qwv h GLU 126 Ca 0.30 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 2qwv h GLU 126 Cb 0.47 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 2qwv h GLU 126 CO -0.62 -0.61 0.18 -0.07 -1.00 0.00 0.00 179.01 176.89 2qwv h LEU 127 N -0.95 0.32 -2.53 1.33 3.38 -0.17 -2.25 115.31 114.43 2qwv h LEU 127 Ca -0.07 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.90 2qwv h LEU 127 Cb 0.79 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2qwv h LEU 127 CO 0.04 0.24 0.07 0.00 0.09 0.00 0.00 178.44 178.88 2qwv h ALA 128 N 1.82 1.43 -0.91 1.53 0.00 -0.30 -0.87 119.26 121.97 2qwv h ALA 128 Ca 0.10 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2qwv h ALA 128 Cb -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 2qwv h ALA 128 CO -0.02 -0.09 0.60 1.49 0.00 0.00 0.00 179.25 181.23 2qwv h GLU 129 N 0.00 1.20 0.00 0.00 4.81 -1.48 -3.38 114.58 115.72 2qwv h GLU 129 Ca 0.02 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2qwv h GLU 129 Cb 0.16 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.27 2qwv h GLU 129 CO -0.00 0.79 -0.54 0.72 -0.73 0.00 0.00 179.01 179.25 2qwv n HIS 130 N -4.45 0.00 -3.35 0.92 8.25 -1.06 -5.07 115.22 110.45 2qwv n HIS 130 Ca 0.10 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.25 2qwv n HIS 130 Cb 0.01 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.08 2qwv n HIS 130 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2qwv s HIS 131 N -1.08 3.44 -0.30 4.41 3.76 -0.35 -4.85 115.29 120.32 2qwv s HIS 131 Ca 0.00 0.82 -0.26 0.00 -0.15 0.00 0.00 55.06 55.47 2qwv s HIS 131 Cb 0.00 -2.23 0.01 0.00 1.11 0.00 0.00 32.58 31.47 2qwv s HIS 131 CO 0.00 0.21 0.93 -1.12 -0.85 0.00 0.00 174.74 173.91 2qwv s SER 132 N -2.65 6.83 0.02 1.40 0.01 -0.13 -4.71 113.70 114.47 2qwv s SER 132 Ca 0.47 0.92 -0.18 0.00 1.31 0.00 0.00 55.95 58.47 2qwv s SER 132 Cb -0.11 -2.47 -0.06 0.00 0.21 0.00 0.00 66.02 63.59 2qwv s SER 132 CO 0.24 -0.71 0.51 -0.76 0.41 0.00 0.00 173.24 172.94 2qwv s LEU 133 N 3.23 4.47 0.16 2.44 1.02 -1.26 -0.27 118.68 128.47 2qwv s LEU 133 Ca 0.39 1.11 0.00 0.00 0.02 0.00 0.00 54.13 55.64 2qwv s LEU 133 Cb -0.14 -2.78 -0.04 0.00 0.02 0.00 0.00 46.19 43.25 2qwv s LEU 133 CO 0.12 0.23 0.05 -0.31 0.02 0.00 0.00 176.35 176.47 2qwv s TYR 134 N -0.77 1.04 0.00 0.29 2.02 -0.43 -2.40 117.35 117.10 2qwv s TYR 134 Ca 0.27 -1.18 0.00 0.00 -0.37 0.00 0.00 57.07 55.80 2qwv s TYR 134 Cb -0.18 -0.58 0.00 0.00 -0.40 0.00 0.00 41.96 40.80 2qwv s TYR 134 CO 0.16 -0.42 0.00 -3.47 -1.57 0.00 0.00 175.55 170.25 2qwv n ASP 137 N -0.18 0.00 0.23 2.29 2.03 0.79 -0.70 116.55 121.01 2qwv n ASP 137 Ca -0.05 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.41 2qwv n ASP 137 Cb 0.64 0.00 0.78 0.00 -0.72 0.00 0.00 41.12 41.81 2qwv n ASP 137 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 2qwv h LYS 138 N 0.00 0.00 -0.01 -0.67 2.10 -1.93 0.59 116.57 116.65 2qwv h LYS 138 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2qwv h LYS 138 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2qwv h LYS 138 CO 0.00 0.00 -0.44 1.17 -2.00 0.00 0.00 179.45 178.18 2qwv n LYS 139 N -2.54 0.93 -1.29 0.07 4.81 -1.26 -4.90 118.16 113.98 2qwv n LYS 139 Ca -0.02 -0.70 -0.29 0.00 -0.87 0.00 0.00 58.31 56.43 2qwv n LYS 139 Cb 0.12 -1.49 0.16 0.00 0.02 0.00 0.00 35.03 33.84 2qwv n LYS 139 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2qwv s GLY 140 N -2.55 1.57 0.63 3.14 0.00 0.21 -4.97 107.32 105.34 2qwv s GLY 140 Ca 0.19 -0.39 -0.19 0.00 0.00 0.00 0.00 44.72 44.34 2qwv s GLY 140 CO 0.58 0.20 1.31 0.99 0.00 0.00 0.00 173.10 176.18 2qwv s ASP 141 N -3.64 4.72 0.13 1.64 1.01 -1.15 -3.93 116.67 115.46 2qwv s ASP 141 Ca 0.65 2.67 -0.31 0.00 0.71 0.00 0.00 52.55 56.26 2qwv s ASP 141 Cb -0.17 -2.62 -0.08 0.00 1.01 0.00 0.00 42.92 41.05 2qwv s ASP 141 CO 0.56 -1.93 1.40 -0.55 0.21 0.00 0.00 175.17 174.86 2qwv s SER 142 N -1.29 6.80 0.56 0.27 0.15 -1.26 -0.08 113.70 118.85 2qwv s SER 142 Ca 0.81 2.37 0.26 0.00 0.70 0.00 0.00 55.95 60.09 2qwv s SER 142 Cb -0.38 -2.59 1.47 0.00 -1.71 0.00 0.00 66.02 62.81 2qwv s SER 142 CO 0.42 -0.66 2.01 -0.29 1.20 0.00 0.00 173.24 175.91 2qwv h ILE 143 N 4.17 0.61 0.00 6.45 2.10 -1.79 -0.77 117.51 128.28 2qwv h ILE 143 Ca -0.42 0.00 -0.08 0.00 1.08 0.00 0.00 64.86 65.44 2qwv h ILE 143 Cb 1.21 0.75 -0.01 0.00 -1.09 0.00 0.00 36.82 37.67 2qwv h ILE 143 CO 0.86 0.00 -0.37 0.03 -1.08 0.00 0.00 178.15 177.59 2qwv h ARG 144 N 0.00 0.00 0.00 2.19 3.08 -1.90 -3.13 114.38 114.62 2qwv h ARG 144 Ca 0.20 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 2qwv h ARG 144 Cb 0.88 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 2qwv h ARG 144 CO -0.00 0.37 -0.89 -0.44 -1.07 0.00 0.00 179.97 177.94 2qwv h ASP 145 N 0.00 0.00 -3.06 7.04 3.32 -1.52 -3.47 116.42 118.73 2qwv h ASP 145 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 2qwv h ASP 145 Cb 0.69 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2qwv h ASP 145 CO 0.05 0.22 -0.21 0.27 -1.72 0.00 0.00 179.24 177.85 2qwv s ILE 146 N -3.17 5.09 -0.44 0.35 -4.36 -1.18 -5.06 121.20 112.42 2qwv s ILE 146 Ca 0.01 -0.11 -0.20 0.00 -0.26 0.00 0.00 60.65 60.09 2qwv s ILE 146 Cb 0.08 -3.74 0.03 0.00 1.25 0.00 0.00 42.46 40.08 2qwv s ILE 146 CO 0.77 -0.28 0.60 -0.75 0.24 0.00 0.00 174.94 175.52 2qwv s LYS 147 N -3.51 3.22 0.05 0.37 2.20 -1.26 -4.96 119.74 115.85 2qwv s LYS 147 Ca 0.42 -0.51 -0.36 0.00 -0.36 0.00 0.00 55.97 55.15 2qwv s LYS 147 Cb -0.11 -3.97 -0.15 0.00 -1.51 0.00 0.00 37.83 32.09 2qwv s LYS 147 CO 0.30 -1.01 1.51 -0.89 -0.36 0.00 0.00 175.35 174.90 2qwv n ILE 148 N 5.75 0.09 -1.20 5.43 2.08 -1.26 -4.94 119.36 125.31 2qwv n ILE 148 Ca -0.03 -0.02 -0.29 0.00 0.56 0.00 0.00 62.75 62.97 2qwv n ILE 148 Cb 0.47 -1.18 0.18 0.00 -0.75 0.00 0.00 39.64 38.37 2qwv n ILE 148 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 2qwv s GLY 149 N 1.30 1.57 0.52 7.39 0.00 -1.26 -4.99 107.32 111.84 2qwv s GLY 149 Ca 0.85 -0.47 -0.20 0.00 0.00 0.00 0.00 44.72 44.90 2qwv s GLY 149 CO 0.47 0.17 1.11 2.56 0.00 0.00 0.00 173.10 177.42 2qwv s PRO 150 N -5.06 3.49 -0.90 2.90 0.04 -1.26 -3.99 135.00 130.22 2qwv s PRO 150 Ca 0.66 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 63.21 2qwv s PRO 150 Cb -0.17 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.31 2qwv s PRO 150 CO 0.57 -0.73 0.63 -1.71 0.04 0.00 0.00 177.00 175.80 2qwv n ASN 151 N -1.15 -4.98 -4.81 6.66 2.85 -1.26 -3.65 115.26 108.92 2qwv n ASN 151 Ca 0.11 -0.96 -0.36 0.00 -0.11 0.00 0.00 54.58 53.26 2qwv n ASN 151 Cb 0.51 -2.01 -0.06 0.00 1.24 0.00 0.00 39.78 39.45 2qwv n ASN 151 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2qwv s PRO 152 N -5.24 4.32 -0.08 1.20 0.04 -1.26 -0.95 135.00 133.03 2qwv s PRO 152 Ca 0.10 1.00 0.02 0.00 0.04 0.00 0.00 61.00 62.15 2qwv s PRO 152 Cb -0.05 -2.77 0.02 0.00 0.04 0.00 0.00 34.50 31.73 2qwv s PRO 152 CO 0.90 0.31 -0.12 0.00 0.04 0.00 0.00 177.00 178.13 2qwv s PHE 154 N 0.93 3.12 0.05 0.00 0.08 -0.62 -1.31 117.98 120.21 2qwv s PHE 154 Ca -0.09 -1.33 -0.30 0.00 0.12 0.00 0.00 56.93 55.33 2qwv s PHE 154 Cb -0.15 -2.15 -0.04 0.00 -0.57 0.00 0.00 43.02 40.11 2qwv s PHE 154 CO 0.00 -0.67 1.04 0.42 -0.10 0.00 0.00 175.22 175.91 2qwv s ILE 155 N 1.40 4.54 -0.08 0.64 1.01 0.12 -1.64 121.20 127.18 2qwv s ILE 155 Ca 0.01 1.89 0.00 0.00 0.00 0.00 0.00 60.65 62.55 2qwv s ILE 155 Cb -0.17 -4.21 0.02 0.00 0.01 0.00 0.00 42.46 38.11 2qwv s ILE 155 CO -0.01 0.18 -0.07 -0.76 0.00 0.00 0.00 174.94 174.28 2qwv s LEU 156 N 0.76 1.22 0.65 2.97 1.43 0.11 -4.94 118.68 120.87 2qwv s LEU 156 Ca 0.53 -0.22 -0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2qwv s LEU 156 Cb -0.24 -0.68 0.08 0.00 0.03 0.00 0.00 46.19 45.39 2qwv s LEU 156 CO 0.29 -0.08 0.90 -0.89 0.23 0.00 0.00 176.35 176.80 2qwv s THR 157 N 1.33 2.36 -0.52 5.49 2.01 -1.26 -1.25 115.64 123.81 2qwv s THR 157 Ca -0.03 -0.61 0.24 0.00 0.31 0.00 0.00 61.69 61.60 2qwv s THR 157 Cb -0.14 -2.75 0.17 0.00 0.01 0.00 0.00 72.50 69.79 2qwv s THR 157 CO -0.03 0.00 1.44 0.44 -0.69 0.00 0.00 174.62 175.78 2qwv h ASP 158 N -0.27 0.00 -0.04 3.53 3.32 -1.93 -3.42 116.42 117.61 2qwv h ASP 158 Ca -0.39 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 2qwv h ASP 158 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 2qwv h ASP 158 CO 0.46 0.03 -0.01 -0.24 -1.72 0.00 0.00 179.24 177.76 2qwv n SER 169 N -2.53 -4.70 0.00 6.45 2.88 -1.26 -5.07 113.62 109.39 2qwv n SER 169 Ca 0.03 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2qwv n SER 169 Cb 0.49 -2.27 0.00 0.00 -0.75 0.00 0.00 64.21 61.68 2qwv n SER 169 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2qwv n LYS 171 N -0.84 0.00 -0.34 -1.46 0.00 -1.26 -2.06 118.16 112.21 2qwv n LYS 171 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 58.31 58.27 2qwv n LYS 171 Cb 0.29 0.00 0.10 0.00 0.00 0.00 0.00 35.03 35.42 2qwv n LYS 171 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 2qwv h ARG 172 N 0.00 1.26 0.00 1.64 1.12 -2.09 -1.95 114.38 114.36 2qwv h ARG 172 Ca 0.00 -0.14 0.00 0.00 -1.11 0.00 0.00 59.98 58.73 2qwv h ARG 172 Cb 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 29.97 29.71 2qwv h ARG 172 CO 0.00 0.91 0.00 -0.11 -3.11 0.00 0.00 179.97 177.66 2qwv n LEU 173 N -4.33 0.26 0.00 3.80 0.00 -0.87 -4.90 117.00 110.95 2qwv n LEU 173 Ca 0.10 0.55 0.00 0.00 0.00 0.00 0.00 56.01 56.66 2qwv n LEU 173 Cb 0.09 -0.49 0.00 0.00 0.00 0.00 0.00 43.42 43.02 2qwv n LEU 173 CO 0.39 -0.25 0.00 0.61 0.00 0.00 0.00 177.39 178.14 2qwv n GLY 174 N 0.55 0.66 3.73 -3.96 0.00 -0.73 -4.97 105.19 100.47 2qwv n GLY 174 Ca 0.04 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2qwv n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qwv s VAL 175 N -2.00 3.22 -0.03 1.61 0.11 -1.26 -4.79 120.40 117.26 2qwv s VAL 175 Ca 0.00 0.97 0.03 0.00 -2.93 0.00 0.00 61.98 60.04 2qwv s VAL 175 Cb 0.00 -3.62 -0.03 0.00 -1.53 0.00 0.00 36.38 31.20 2qwv s VAL 175 CO 0.00 0.12 -0.09 -1.83 -3.33 0.00 0.00 175.10 169.97 2qwv s GLU 176 N 0.23 2.59 0.15 1.54 -1.05 -1.01 -4.65 118.70 116.51 2qwv s GLU 176 Ca 0.59 -0.66 -0.27 0.00 -0.15 0.00 0.00 54.97 54.48 2qwv s GLU 176 Cb -0.37 -2.49 -0.07 0.00 -0.44 0.00 0.00 34.13 30.75 2qwv s GLU 176 CO 0.36 0.63 0.83 0.15 0.95 0.00 0.00 175.26 178.18 2qwv s LYS 177 N -1.02 4.63 0.07 -4.83 1.02 -1.26 -4.37 119.74 113.98 2qwv s LYS 177 Ca 0.14 1.25 0.01 0.00 0.02 0.00 0.00 55.97 57.39 2qwv s LYS 177 Cb -0.11 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2qwv s LYS 177 CO 0.03 0.47 -0.06 0.96 -0.92 0.00 0.00 175.35 175.83 2qwv s ILE 178 N -0.82 0.56 -0.07 2.17 -4.36 -1.26 -2.92 121.20 114.50 2qwv s ILE 178 Ca 0.39 -1.57 0.05 0.00 -0.26 0.00 0.00 60.65 59.25 2qwv s ILE 178 Cb -0.23 -1.22 -0.00 0.00 1.25 0.00 0.00 42.46 42.26 2qwv s ILE 178 CO 0.27 -0.70 -0.21 -0.55 0.24 0.00 0.00 174.94 173.99 2qwv s SER 179 N -2.44 2.72 0.00 4.36 0.15 0.88 -0.15 113.70 119.22 2qwv s SER 179 Ca 0.02 -0.47 0.28 0.00 0.70 0.00 0.00 55.95 56.49 2qwv s SER 179 Cb -0.00 -0.99 1.13 0.00 -1.71 0.00 0.00 66.02 64.45 2qwv s SER 179 CO -0.03 0.17 1.79 0.18 1.20 0.00 0.00 173.24 176.55 2qwv n LEU 180 N 3.30 1.12 0.00 3.45 4.77 -1.26 -2.15 117.00 126.24 2qwv n LEU 180 Ca -0.19 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 2qwv n LEU 180 Cb 0.52 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2qwv n LEU 180 CO 0.26 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2qwv n GLY 181 N 1.19 0.30 0.25 -0.72 0.00 -1.26 -4.96 105.19 99.99 2qwv n GLY 181 Ca 0.18 -1.71 0.16 0.00 0.00 0.00 0.00 46.02 44.66 2qwv n GLY 181 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qwv h PRO 182 N 0.00 0.00 0.00 1.61 0.11 -1.95 -3.48 132.00 128.28 2qwv h PRO 182 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2qwv h PRO 182 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2qwv h PRO 182 CO 0.00 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.42 2qwv n LYS 183 N -2.95 0.00 -3.61 1.05 5.02 -1.26 -5.13 118.16 111.29 2qwv n LYS 183 Ca 0.01 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.25 2qwv n LYS 183 Cb 0.29 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.27 2qwv n LYS 183 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qwv s LEU 185 N 0.00 -0.15 0.50 -0.35 1.43 -1.26 -4.97 118.68 113.88 2qwv s LEU 185 Ca 0.00 0.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.94 2qwv s LEU 185 Cb 0.00 1.38 -0.07 0.00 0.03 0.00 0.00 46.19 47.53 2qwv s LEU 185 CO 0.00 -0.20 1.36 0.49 0.23 0.00 0.00 176.35 178.23 2qwv n PHE 186 N 0.22 2.36 -0.31 0.29 3.72 -1.26 -4.85 117.46 117.63 2qwv n PHE 186 Ca -0.01 0.44 0.15 0.00 -0.05 0.00 0.00 57.45 57.98 2qwv n PHE 186 Cb 0.58 -2.39 0.33 0.00 -0.94 0.00 0.00 39.48 37.06 2qwv n PHE 186 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qwv h ALA 187 N 1.78 1.42 -0.11 4.37 0.00 -1.95 0.15 119.26 124.92 2qwv h ALA 187 Ca -0.50 0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 2qwv h ALA 187 Cb 1.29 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2qwv h ALA 187 CO 0.59 -0.47 -0.23 0.66 0.00 0.00 0.00 179.25 179.79 2qwv h SER 188 N 0.25 0.19 -0.11 0.00 4.64 -1.90 -1.36 113.55 115.27 2qwv h SER 188 Ca 0.59 -0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 61.69 2qwv h SER 188 Cb 1.21 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2qwv h SER 188 CO -0.63 0.43 -0.52 1.56 -0.87 0.00 0.00 176.83 176.79 2qwv h GLN 189 N 0.18 0.69 -0.33 4.77 4.20 -1.08 -2.97 115.11 120.56 2qwv h GLN 189 Ca 0.03 -0.42 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 2qwv h GLN 189 Cb 0.51 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2qwv h GLN 189 CO 0.04 1.04 0.13 0.00 -0.67 0.00 0.00 178.83 179.37 2qwv h VAL 191 N 0.46 1.21 -0.66 0.00 2.07 -1.24 -1.61 116.25 116.48 2qwv h VAL 191 Ca 0.11 -0.71 0.10 0.00 0.82 0.00 0.00 66.70 67.03 2qwv h VAL 191 Cb 0.09 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.88 2qwv h VAL 191 CO -0.01 0.24 0.28 0.74 0.02 0.00 0.00 177.57 178.83 2qwv h THR 192 N 0.34 0.78 0.00 2.57 2.02 -1.34 -0.82 112.91 116.46 2qwv h THR 192 Ca 0.10 -0.16 -0.19 0.00 0.77 0.00 0.00 66.41 66.93 2qwv h THR 192 Cb 0.28 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2qwv h THR 192 CO -0.00 0.09 -0.86 -0.07 0.37 0.00 0.00 175.52 175.05 2qwv h LEU 193 N 0.47 0.18 0.30 2.58 3.38 -1.36 -1.73 115.31 119.12 2qwv h LEU 193 Ca 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2qwv h LEU 193 Cb 0.41 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2qwv h LEU 193 CO -0.31 0.95 -0.14 0.40 0.09 0.00 0.00 178.44 179.43 2qwv h ILE 194 N 0.07 0.70 -0.81 1.22 2.04 -0.91 -2.04 117.51 117.79 2qwv h ILE 194 Ca -0.03 -0.64 0.17 0.00 1.00 0.00 0.00 64.86 65.35 2qwv h ILE 194 Cb 1.48 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 38.48 2qwv h ILE 194 CO 0.12 0.12 0.33 0.45 0.00 0.00 0.00 178.15 179.18 2qwv h HIS 195 N -0.77 0.56 -0.20 1.37 3.86 -1.15 -1.88 115.15 116.94 2qwv h HIS 195 Ca -0.04 0.04 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 2qwv h HIS 195 Cb 0.50 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 2qwv h HIS 195 CO 0.03 0.03 -0.32 -0.97 0.86 0.00 0.00 177.93 177.56 2qwv h ASN 196 N 0.44 0.40 -0.20 2.45 -0.73 -1.28 -0.02 115.58 116.65 2qwv h ASN 196 Ca 0.46 -0.15 -0.09 0.00 1.87 0.00 0.00 56.30 58.39 2qwv h ASN 196 Cb 0.76 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 39.23 2qwv h ASN 196 CO -0.45 0.71 -0.22 -0.08 -0.37 0.00 0.00 177.43 177.02 2qwv h GLU 197 N 0.34 0.50 -0.76 6.67 4.57 -0.78 -2.11 114.58 123.01 2qwv h GLU 197 Ca 0.04 -0.27 0.01 0.00 -1.18 0.00 0.00 59.36 57.96 2qwv h GLU 197 Cb 0.73 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.30 2qwv h GLU 197 CO 0.06 0.85 0.50 0.82 -1.18 0.00 0.00 179.01 180.05 2qwv h ILE 198 N 0.17 1.20 -0.63 2.32 1.08 -1.14 -1.41 117.51 119.09 2qwv h ILE 198 Ca 0.03 -0.37 0.10 0.00 -0.39 0.00 0.00 64.86 64.22 2qwv h ILE 198 Cb 0.77 0.09 -0.07 0.00 -3.07 0.00 0.00 36.82 34.53 2qwv h ILE 198 CO 0.05 0.19 0.25 0.44 -0.69 0.00 0.00 178.15 178.39 2qwv h ASP 199 N 1.03 0.26 0.26 1.72 3.32 -0.94 -1.31 116.42 120.76 2qwv h ASP 199 Ca 0.28 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.39 2qwv h ASP 199 Cb -0.11 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2qwv h ASP 199 CO -0.06 0.15 -0.13 0.45 -1.72 0.00 0.00 179.24 177.93 2qwv h HIS 200 N 0.43 -0.33 -0.02 4.55 3.86 -1.04 -2.71 115.15 119.89 2qwv h HIS 200 Ca 0.32 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.49 2qwv h HIS 200 Cb 0.40 0.11 -0.00 0.00 1.06 0.00 0.00 27.41 28.97 2qwv h HIS 200 CO -0.16 -0.10 -0.12 1.96 0.86 0.00 0.00 177.93 180.37 2qwv h GLN 201 N -0.50 0.03 0.00 2.45 4.20 -0.95 -2.37 115.11 117.97 2qwv h GLN 201 Ca -0.04 -0.01 -0.18 0.00 0.06 0.00 0.00 58.65 58.49 2qwv h GLN 201 Cb 0.38 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 2qwv h GLN 201 CO 0.06 0.16 -1.00 0.93 -0.67 0.00 0.00 178.83 178.31 2qwv h GLU 202 N 0.03 0.00 -0.01 1.46 5.08 -1.26 -3.23 114.58 116.65 2qwv h GLU 202 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2qwv h GLU 202 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2qwv h GLU 202 CO 0.02 0.63 -0.14 0.00 -1.00 0.00 0.00 179.01 178.52 2qwv n ALA 203 N -2.34 2.85 -1.13 3.43 0.00 -1.02 -4.94 120.51 117.35 2qwv n ALA 203 Ca -0.03 -0.39 -0.05 0.00 0.00 0.00 0.00 53.44 52.97 2qwv n ALA 203 Cb 0.87 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 19.11 2qwv n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qwv n GLY 204 N 1.27 0.73 0.00 0.00 0.00 -0.94 -5.09 105.19 101.16 2qwv n GLY 204 Ca 0.15 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.56 2qwv n GLY 204 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11