#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wtf s SER 2 N 0.00 6.42 0.43 6.12 0.15 0.04 -4.71 113.70 122.15 2wtf s SER 2 Ca 0.00 1.31 0.19 0.00 0.70 0.00 0.00 55.95 58.15 2wtf s SER 2 Cb 0.00 -2.41 1.00 0.00 -1.71 0.00 0.00 66.02 62.90 2wtf s SER 2 CO 0.00 -0.63 1.92 0.50 1.20 0.00 0.00 173.24 176.23 2wtf h LYS 3 N 0.51 0.00 -5.91 5.44 3.64 -1.95 -3.39 116.57 114.90 2wtf h LYS 3 Ca -0.46 0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.29 2wtf h LYS 3 Cb 1.19 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 2wtf h LYS 3 CO 0.62 0.26 -0.51 -0.06 -2.27 0.00 0.00 179.45 177.49 2wtf s PHE 4 N -4.18 3.50 0.30 1.91 0.40 -1.26 -4.94 117.98 113.72 2wtf s PHE 4 Ca -0.03 0.26 -0.04 0.00 -0.60 0.00 0.00 56.93 56.52 2wtf s PHE 4 Cb 0.14 -1.76 -0.05 0.00 0.51 0.00 0.00 43.02 41.86 2wtf s PHE 4 CO 0.67 0.59 0.56 0.95 0.70 0.00 0.00 175.22 178.70 2wtf s THR 5 N -1.47 5.03 0.28 0.64 -4.23 -1.26 0.69 115.64 115.33 2wtf s THR 5 Ca 0.33 -0.01 0.02 0.00 -1.18 0.00 0.00 61.69 60.86 2wtf s THR 5 Cb -0.13 -3.76 0.27 0.00 1.34 0.00 0.00 72.50 70.23 2wtf s THR 5 CO 0.26 -0.38 1.71 -0.50 -0.54 0.00 0.00 174.62 175.17 2wtf h TRP 6 N 1.49 0.66 -0.79 3.99 4.06 -1.32 -1.22 115.95 122.81 2wtf h TRP 6 Ca -0.48 0.04 0.05 0.00 2.06 0.00 0.00 58.89 60.56 2wtf h TRP 6 Cb 1.19 -0.16 -0.05 0.00 -1.00 0.00 0.00 29.16 29.14 2wtf h TRP 6 CO 0.57 0.01 0.49 -0.22 -3.56 0.00 0.00 178.44 175.73 2wtf h LYS 7 N 0.45 0.90 -0.21 0.49 3.64 -1.41 0.06 116.57 120.48 2wtf h LYS 7 Ca 0.53 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.71 2wtf h LYS 7 Cb 0.94 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 2wtf h LYS 7 CO -0.49 0.59 -0.46 0.93 -2.27 0.00 0.00 179.45 177.76 2wtf h GLU 8 N 0.93 0.54 -0.05 1.90 5.08 -1.54 -2.01 114.58 119.43 2wtf h GLU 8 Ca 0.34 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2wtf h GLU 8 Cb 0.10 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2wtf h GLU 8 CO -0.15 0.89 -0.03 1.25 -1.00 0.00 0.00 179.01 179.97 2wtf h LEU 9 N 0.44 0.12 -1.17 1.33 5.85 -0.99 -3.28 115.31 117.61 2wtf h LEU 9 Ca 0.03 -0.44 -0.07 0.00 0.84 0.00 0.00 57.88 58.24 2wtf h LEU 9 Cb 0.97 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2wtf h LEU 9 CO 0.09 0.54 -0.22 0.40 -0.34 0.00 0.00 178.44 178.90 2wtf h ILE 10 N -0.29 1.23 -0.21 4.05 1.08 -0.95 -2.47 117.51 119.96 2wtf h ILE 10 Ca 0.01 -1.09 0.06 0.00 -0.39 0.00 0.00 64.86 63.45 2wtf h ILE 10 Cb 0.49 1.36 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 2wtf h ILE 10 CO 0.01 0.34 0.15 -0.61 -0.69 0.00 0.00 178.15 177.35 2wtf h GLN 11 N 0.27 0.01 -0.68 2.37 4.15 -1.42 -0.85 115.11 118.95 2wtf h GLN 11 Ca 0.05 -0.00 0.20 0.00 0.77 0.00 0.00 58.65 59.66 2wtf h GLN 11 Cb 0.55 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.21 2wtf h GLN 11 CO 0.04 0.00 0.55 -0.07 -1.93 0.00 0.00 178.83 177.43 2wtf h LEU 12 N 0.01 0.00 0.00 -2.39 3.38 -1.54 -0.36 115.31 114.41 2wtf h LEU 12 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2wtf h LEU 12 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2wtf h LEU 12 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2wtf n GLY 13 N -1.63 -0.91 3.31 0.83 0.00 -0.32 -2.61 105.19 103.86 2wtf n GLY 13 Ca 0.14 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2wtf n GLY 13 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wtf s SER 14 N -2.52 4.30 0.44 1.61 0.15 -0.15 -4.88 113.70 112.65 2wtf s SER 14 Ca 0.20 -0.39 0.12 0.00 0.70 0.00 0.00 55.95 56.57 2wtf s SER 14 Cb 0.13 -1.74 0.99 0.00 -1.71 0.00 0.00 66.02 63.70 2wtf s SER 14 CO 0.29 -0.02 2.04 -0.65 1.20 0.00 0.00 173.24 176.11 2wtf h PRO 15 N 8.11 0.21 -0.15 5.44 0.11 -1.84 0.43 132.00 144.32 2wtf h PRO 15 Ca -0.42 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.45 2wtf h PRO 15 Cb 1.16 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.24 2wtf h PRO 15 CO 0.60 0.22 -0.77 0.66 -0.21 0.00 0.00 178.00 178.50 2wtf h SER 16 N 0.21 0.93 -0.01 -2.05 4.64 -1.94 -3.36 113.55 111.98 2wtf h SER 16 Ca 0.05 -0.63 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 2wtf h SER 16 Cb 0.12 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2wtf h SER 16 CO 0.00 1.42 -0.18 0.29 -0.87 0.00 0.00 176.83 177.49 2wtf n LYS 17 N -3.95 1.67 -0.31 4.77 5.02 -1.14 -4.71 118.16 119.51 2wtf n LYS 17 Ca -0.08 -0.79 0.11 0.00 -2.02 0.00 0.00 58.31 55.54 2wtf n LYS 17 Cb 0.74 -1.15 0.29 0.00 -0.02 0.00 0.00 35.03 34.89 2wtf n LYS 17 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wtf h ALA 18 N 2.07 1.43 0.00 7.82 0.00 -0.93 -0.91 119.26 128.74 2wtf h ALA 18 Ca 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2wtf h ALA 18 Cb 0.41 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2wtf h ALA 18 CO 0.00 -0.23 -0.14 0.10 0.00 0.00 0.00 179.25 178.98 2wtf h TYR 19 N 0.52 0.00 0.00 0.00 -0.00 -1.85 -2.87 116.97 112.77 2wtf h TYR 19 Ca 0.53 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 59.19 2wtf h TYR 19 Cb 0.92 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.64 2wtf h TYR 19 CO -0.10 0.14 -0.35 0.93 -0.00 0.00 0.00 178.16 178.78 2wtf h GLU 20 N 0.00 0.00 -6.89 0.10 5.08 -1.50 -3.44 114.58 107.93 2wtf h GLU 20 Ca -0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2wtf h GLU 20 Cb 0.26 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.59 2wtf h GLU 20 CO 0.02 0.35 0.71 0.45 -1.00 0.00 0.00 179.01 179.54 2wtf s SER 21 N -6.35 6.59 0.02 1.42 0.15 -1.08 -4.85 113.70 109.60 2wtf s SER 21 Ca 0.02 2.83 0.15 0.00 0.70 0.00 0.00 55.95 59.65 2wtf s SER 21 Cb 0.09 -2.65 0.64 0.00 -1.71 0.00 0.00 66.02 62.39 2wtf s SER 21 CO 0.69 -0.69 1.48 -1.54 1.20 0.00 0.00 173.24 174.39 2wtf n SER 22 N 0.89 0.06 -0.53 5.45 3.41 -1.26 -1.40 113.62 120.23 2wtf n SER 22 Ca 0.01 0.51 0.09 0.00 -0.26 0.00 0.00 58.87 59.23 2wtf n SER 22 Cb 0.41 -0.53 0.34 0.00 -0.26 0.00 0.00 64.21 64.16 2wtf n SER 22 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2wtf n LEU 23 N -1.57 1.57 -4.58 1.04 4.77 -1.26 -4.90 117.00 112.08 2wtf n LEU 23 Ca 0.03 -0.69 -0.49 0.00 -0.03 0.00 0.00 56.01 54.83 2wtf n LEU 23 Cb 0.17 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 2wtf n LEU 23 CO 0.14 0.34 0.74 0.00 -1.33 0.00 0.00 177.39 177.28 2wtf n ALA 24 N 0.28 -0.84 -3.88 -1.18 0.00 -0.50 -4.92 120.51 109.47 2wtf n ALA 24 Ca 0.15 0.47 -0.33 0.00 0.00 0.00 0.00 53.44 53.73 2wtf n ALA 24 Cb 0.30 -2.03 -0.14 0.00 0.00 0.00 0.00 19.45 17.58 2wtf n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wtf s ILE 26 N 1.09 2.67 0.04 0.00 1.01 -0.06 -1.03 121.20 124.92 2wtf s ILE 26 Ca 0.02 -1.41 0.04 0.00 0.00 0.00 0.00 60.65 59.30 2wtf s ILE 26 Cb -0.20 -2.17 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 2wtf s ILE 26 CO -0.05 0.21 -0.13 0.00 0.00 0.00 0.00 174.94 174.97 2wtf s ALA 27 N -1.02 1.08 -0.12 9.38 0.00 -0.46 -2.28 121.76 128.34 2wtf s ALA 27 Ca 0.16 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.35 2wtf s ALA 27 Cb -0.10 -0.16 0.01 0.00 0.00 0.00 0.00 23.12 22.87 2wtf s ALA 27 CO 0.07 0.20 -0.17 -1.58 0.00 0.00 0.00 175.76 174.28 2wtf s HIS 28 N -0.84 2.19 -0.09 0.00 2.46 -0.47 -0.80 115.29 117.73 2wtf s HIS 28 Ca 0.01 -1.08 0.03 0.00 0.47 0.00 0.00 55.06 54.49 2wtf s HIS 28 Cb -0.08 -1.55 0.01 0.00 -0.13 0.00 0.00 32.58 30.83 2wtf s HIS 28 CO 0.01 -0.54 -0.18 0.42 -2.47 0.00 0.00 174.74 171.98 2wtf s ILE 29 N 1.01 1.60 -0.06 0.89 1.01 -0.28 -1.11 121.20 124.25 2wtf s ILE 29 Ca -0.05 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 59.87 2wtf s ILE 29 Cb -0.15 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.92 2wtf s ILE 29 CO -0.03 0.46 -0.10 -0.62 0.00 0.00 0.00 174.94 174.65 2wtf s ASP 30 N 0.61 1.59 0.12 3.58 -1.08 -0.14 -1.28 116.67 120.06 2wtf s ASP 30 Ca -0.14 -0.25 -0.30 0.00 -0.52 0.00 0.00 52.55 51.33 2wtf s ASP 30 Cb -0.16 -0.72 -0.07 0.00 -1.46 0.00 0.00 42.92 40.51 2wtf s ASP 30 CO 0.04 -0.01 1.19 -0.04 0.52 0.00 0.00 175.17 176.88 2wtf s MET 31 N 0.83 4.47 0.16 4.34 -1.94 -0.22 -0.80 119.30 126.15 2wtf s MET 31 Ca -0.12 1.81 -0.30 0.00 -1.71 0.00 0.00 55.69 55.37 2wtf s MET 31 Cb -0.15 -3.30 -0.08 0.00 2.01 0.00 0.00 34.83 33.31 2wtf s MET 31 CO 0.02 -0.16 1.23 -0.80 -0.01 0.00 0.00 175.02 175.29 2wtf s ASN 32 N 0.59 7.04 -1.37 3.03 0.01 -0.94 -3.96 114.94 119.34 2wtf s ASN 32 Ca 0.56 2.23 -0.14 0.00 -0.71 0.00 0.00 52.86 54.80 2wtf s ASN 32 Cb -0.31 -2.60 0.02 0.00 0.41 0.00 0.00 41.25 38.77 2wtf s ASN 32 CO 0.32 -0.43 0.38 0.00 -1.51 0.00 0.00 177.10 175.87 2wtf n ALA 33 N 2.82 -2.27 0.05 0.60 0.00 -1.26 -4.59 120.51 115.84 2wtf n ALA 33 Ca 0.06 -0.44 -0.11 0.00 0.00 0.00 0.00 53.44 52.94 2wtf n ALA 33 Cb 0.44 -1.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.01 2wtf n ALA 33 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2wtf h PHE 34 N -2.12 -0.72 0.00 0.00 3.57 -1.93 -0.55 116.94 115.19 2wtf h PHE 34 Ca -0.68 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 60.78 2wtf h PHE 34 Cb 1.40 0.32 -0.01 0.00 2.79 0.00 0.00 35.95 40.45 2wtf h PHE 34 CO 0.45 -0.36 -0.31 0.74 -2.23 0.00 0.00 178.31 176.60 2wtf h PHE 35 N -0.39 0.00 -0.31 0.41 -1.00 -1.92 -1.84 116.94 111.89 2wtf h PHE 35 Ca 0.07 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.68 2wtf h PHE 35 Cb 0.49 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.05 2wtf h PHE 35 CO -0.31 0.31 -0.50 0.00 -1.61 0.00 0.00 178.31 176.20 2wtf h ALA 36 N 1.69 0.47 -0.75 2.45 0.00 -1.43 -1.69 119.26 120.01 2wtf h ALA 36 Ca -0.00 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 2wtf h ALA 36 Cb 0.61 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2wtf h ALA 36 CO 0.04 0.66 0.24 1.96 0.00 0.00 0.00 179.25 182.14 2wtf h GLN 37 N 0.67 1.16 -0.46 0.00 4.20 -0.74 0.21 115.11 120.16 2wtf h GLN 37 Ca 0.03 -0.25 -0.10 0.00 0.06 0.00 0.00 58.65 58.39 2wtf h GLN 37 Cb 1.10 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 2wtf h GLN 37 CO 0.11 0.99 -0.10 -0.39 -0.67 0.00 0.00 178.83 178.77 2wtf h VAL 38 N 1.11 1.26 -0.28 -0.54 -1.51 -1.16 0.30 116.25 115.44 2wtf h VAL 38 Ca 0.24 -1.18 -0.15 0.00 -1.23 0.00 0.00 66.70 64.38 2wtf h VAL 38 Cb 0.31 1.02 -0.01 0.00 -2.13 0.00 0.00 31.29 30.48 2wtf h VAL 38 CO -0.01 0.41 -0.43 -0.33 -1.23 0.00 0.00 177.57 175.97 2wtf h GLU 39 N 0.75 0.71 -0.56 5.19 4.39 -1.14 -1.18 114.58 122.73 2wtf h GLU 39 Ca 0.13 -0.39 0.01 0.00 0.34 0.00 0.00 59.36 59.45 2wtf h GLU 39 Cb 0.60 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2wtf h GLU 39 CO 0.04 1.00 0.36 0.37 -1.16 0.00 0.00 179.01 179.62 2wtf h GLN 40 N 0.57 0.71 -0.14 2.33 4.15 -0.07 -2.01 115.11 120.65 2wtf h GLN 40 Ca 0.04 -0.04 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 2wtf h GLN 40 Cb 0.98 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 28.51 2wtf h GLN 40 CO 0.09 0.47 -0.14 1.98 -1.93 0.00 0.00 178.83 179.30 2wtf h MET 41 N 0.73 0.35 -0.68 1.69 4.05 -0.83 0.19 114.93 120.43 2wtf h MET 41 Ca 0.21 -0.19 0.04 0.00 -0.28 0.00 0.00 59.70 59.48 2wtf h MET 41 Cb -0.06 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.71 2wtf h MET 41 CO -0.06 0.74 0.45 -0.09 0.23 0.00 0.00 176.91 178.18 2wtf h ARG 42 N -0.03 0.77 -0.45 0.39 2.43 -1.09 -2.28 114.38 114.12 2wtf h ARG 42 Ca 0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2wtf h ARG 42 Cb 0.67 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2wtf h ARG 42 CO 0.04 0.51 0.00 0.00 -1.51 0.00 0.00 179.97 179.00 2wtf n GLY 44 N 1.22 0.03 3.84 0.00 0.00 -0.86 -5.01 105.19 104.41 2wtf n GLY 44 Ca 0.15 -0.33 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 2wtf n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wtf s LEU 45 N -3.64 3.59 0.57 0.99 1.43 0.02 -5.04 118.68 116.60 2wtf s LEU 45 Ca 0.13 -0.49 -0.08 0.00 -1.03 0.00 0.00 54.13 52.66 2wtf s LEU 45 Cb -0.06 -2.19 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 2wtf s LEU 45 CO 0.16 -0.31 0.92 -0.55 0.23 0.00 0.00 176.35 176.80 2wtf s SER 46 N -3.96 6.11 0.52 2.29 0.15 -1.26 -4.56 113.70 112.98 2wtf s SER 46 Ca 0.40 1.12 0.25 0.00 0.70 0.00 0.00 55.95 58.41 2wtf s SER 46 Cb -0.06 -2.25 1.36 0.00 -1.71 0.00 0.00 66.02 63.36 2wtf s SER 46 CO 0.26 -0.81 1.97 0.50 1.20 0.00 0.00 173.24 176.36 2wtf h LYS 47 N -0.11 0.06 -0.09 5.44 3.64 -1.97 -2.44 116.57 121.10 2wtf h LYS 47 Ca -0.45 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2wtf h LYS 47 Cb 1.21 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2wtf h LYS 47 CO 0.62 0.04 0.00 0.39 -2.27 0.00 0.00 179.45 178.23 2wtf n GLU 48 N -4.38 2.17 -2.40 1.90 4.71 -1.26 -4.47 120.64 116.91 2wtf n GLU 48 Ca 0.12 -1.72 -0.42 0.00 -0.01 0.00 0.00 57.16 55.13 2wtf n GLU 48 Cb 0.64 -1.47 -0.03 0.00 -1.01 0.00 0.00 31.44 29.57 2wtf n GLU 48 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2wtf s ASP 49 N -1.89 7.10 -1.22 1.62 -0.00 -0.92 -4.84 116.67 116.52 2wtf s ASP 49 Ca 0.32 2.13 -0.19 0.00 -0.00 0.00 0.00 52.55 54.81 2wtf s ASP 49 Cb 0.21 -2.59 0.07 0.00 -0.00 0.00 0.00 42.92 40.60 2wtf s ASP 49 CO 0.31 -0.40 1.64 -2.16 -0.00 0.00 0.00 175.17 174.55 2wtf s PRO 50 N 0.32 3.90 0.12 8.23 0.04 -1.26 -4.54 135.00 141.80 2wtf s PRO 50 Ca 0.55 -1.83 -0.00 0.00 0.04 0.00 0.00 61.00 59.76 2wtf s PRO 50 Cb -0.31 -5.45 -0.04 0.00 0.04 0.00 0.00 34.50 28.74 2wtf s PRO 50 CO 0.33 -2.20 0.28 0.14 0.04 0.00 0.00 177.00 175.59 2wtf s VAL 51 N 4.18 5.32 -0.01 -0.36 -7.23 -1.26 -1.08 120.40 119.95 2wtf s VAL 51 Ca 0.51 -0.41 0.02 0.00 -1.81 0.00 0.00 61.98 60.28 2wtf s VAL 51 Cb 0.02 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.29 2wtf s VAL 51 CO 0.03 0.02 -0.05 0.54 -0.31 0.00 0.00 175.10 175.33 2wtf s VAL 52 N -1.64 0.44 -0.20 1.32 0.11 -0.30 -2.21 120.40 117.92 2wtf s VAL 52 Ca 0.36 -0.19 -0.10 0.00 -2.93 0.00 0.00 61.98 59.11 2wtf s VAL 52 Cb -0.12 -0.40 -0.05 0.00 -1.53 0.00 0.00 36.38 34.28 2wtf s VAL 52 CO 0.28 0.14 0.14 0.00 -3.33 0.00 0.00 175.10 172.34 2wtf s VAL 54 N 0.35 1.32 -0.18 0.00 -7.23 0.47 -1.52 120.40 113.61 2wtf s VAL 54 Ca 0.09 -1.31 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2wtf s VAL 54 Cb -0.11 -1.22 0.04 0.00 0.56 0.00 0.00 36.38 35.64 2wtf s VAL 54 CO -0.01 -0.11 -0.09 -1.58 -0.31 0.00 0.00 175.10 173.00 2wtf s GLN 55 N -1.64 1.84 7.10 4.82 0.74 -0.28 -1.89 119.66 130.35 2wtf s GLN 55 Ca 0.02 -0.69 0.00 0.00 0.05 0.00 0.00 55.36 54.74 2wtf s GLN 55 Cb -0.10 -2.23 0.00 0.00 1.10 0.00 0.00 33.01 31.79 2wtf s GLN 55 CO 0.03 -0.41 0.00 0.91 -0.55 0.00 0.00 175.29 175.27 2wtf n TRP 56 N 4.76 0.00 0.30 1.67 5.03 -1.26 -0.83 117.44 127.11 2wtf n TRP 56 Ca -0.14 0.00 0.12 0.00 3.03 0.00 0.00 57.50 60.51 2wtf n TRP 56 Cb 0.47 0.00 0.21 0.00 -1.03 0.00 0.00 31.31 30.97 2wtf n TRP 56 CO 0.00 0.00 0.00 0.09 -0.03 0.00 0.00 177.69 177.75 2wtf n ASN 57 N 7.81 3.47 -4.93 -0.99 5.03 -1.26 -4.55 115.26 119.83 2wtf n ASN 57 Ca 0.00 -1.99 -0.27 0.00 0.87 0.00 0.00 54.58 53.19 2wtf n ASN 57 Cb 0.00 -0.25 -0.03 0.00 -1.02 0.00 0.00 39.78 38.48 2wtf n ASN 57 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2wtf s SER 58 N -1.47 6.29 -0.27 6.41 0.01 -0.01 -2.34 113.70 122.32 2wtf s SER 58 Ca 0.38 0.17 -0.10 0.00 1.31 0.00 0.00 55.95 57.72 2wtf s SER 58 Cb 0.23 -1.89 -0.04 0.00 0.21 0.00 0.00 66.02 64.52 2wtf s SER 58 CO 0.31 0.08 0.16 -0.63 0.41 0.00 0.00 173.24 173.56 2wtf s ILE 59 N -1.70 5.07 -0.51 1.44 1.01 -1.26 -1.13 121.20 124.12 2wtf s ILE 59 Ca 0.34 0.09 0.17 0.00 0.00 0.00 0.00 60.65 61.25 2wtf s ILE 59 Cb -0.11 -3.40 -0.22 0.00 0.01 0.00 0.00 42.46 38.74 2wtf s ILE 59 CO 0.28 0.29 0.60 2.30 0.00 0.00 0.00 174.94 178.41 2wtf n ILE 60 N 4.91 0.00 -3.68 2.92 -5.35 -0.58 -4.62 119.36 112.96 2wtf n ILE 60 Ca -0.15 -0.21 -0.14 0.00 -0.27 0.00 0.00 62.75 61.98 2wtf n ILE 60 Cb 0.52 0.65 -0.08 0.00 -1.74 0.00 0.00 39.64 38.99 2wtf n ILE 60 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wtf s ALA 61 N -2.87 -1.41 -0.11 -1.28 0.00 -1.19 -4.95 121.76 109.95 2wtf s ALA 61 Ca 0.02 1.61 0.01 0.00 0.00 0.00 0.00 51.96 53.60 2wtf s ALA 61 Cb 0.12 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.32 2wtf s ALA 61 CO 0.72 -0.27 -0.13 0.08 0.00 0.00 0.00 175.76 176.17 2wtf s VAL 62 N 0.31 1.35 0.55 0.00 1.01 -1.26 -0.97 120.40 121.39 2wtf s VAL 62 Ca -0.00 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.26 2wtf s VAL 62 Cb -0.04 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 2wtf s VAL 62 CO 0.01 0.41 1.11 -0.94 0.00 0.00 0.00 175.10 175.70 2wtf s SER 63 N 1.19 5.71 0.51 3.32 1.04 -0.94 -4.71 113.70 119.82 2wtf s SER 63 Ca -0.03 2.11 0.18 0.00 0.48 0.00 0.00 55.95 58.69 2wtf s SER 63 Cb -0.14 -2.57 1.26 0.00 0.10 0.00 0.00 66.02 64.66 2wtf s SER 63 CO -0.04 -1.22 2.08 1.88 0.98 0.00 0.00 173.24 176.92 2wtf h TYR 64 N 1.05 0.07 -0.57 5.02 -1.99 -1.90 -1.45 116.97 117.21 2wtf h TYR 64 Ca -0.49 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.16 2wtf h TYR 64 Cb 1.25 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.94 2wtf h TYR 64 CO 0.53 0.04 0.05 0.00 -0.00 0.00 0.00 178.16 178.77 2wtf h ALA 65 N 1.88 0.76 0.00 3.88 0.00 -1.82 -2.89 119.26 121.07 2wtf h ALA 65 Ca 0.11 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2wtf h ALA 65 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wtf h ALA 65 CO -0.01 0.55 -0.17 0.00 0.00 0.00 0.00 179.25 179.62 2wtf h ALA 66 N 0.99 1.47 0.00 0.00 0.00 -1.52 -2.87 119.26 117.32 2wtf h ALA 66 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2wtf h ALA 66 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wtf h ALA 66 CO 0.02 0.21 0.00 0.54 0.00 0.00 0.00 179.25 180.02 2wtf n ARG 67 N -3.98 0.20 0.17 0.00 1.74 -0.89 -2.34 116.66 111.56 2wtf n ARG 67 Ca -0.02 0.25 0.13 0.00 -0.77 0.00 0.00 57.85 57.44 2wtf n ARG 67 Cb 0.26 -1.77 0.60 0.00 -1.02 0.00 0.00 32.46 30.52 2wtf n ARG 67 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2wtf h LYS 68 N 0.00 0.00 -0.68 5.56 1.57 -1.52 -2.07 116.57 119.43 2wtf h LYS 68 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wtf h LYS 68 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2wtf h LYS 68 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2wtf n TYR 69 N -2.42 1.27 -1.44 -1.35 4.02 -0.99 -4.93 117.16 111.33 2wtf n TYR 69 Ca 0.00 -0.54 -0.12 0.00 -0.01 0.00 0.00 57.90 57.24 2wtf n TYR 69 Cb 0.17 -0.15 -0.04 0.00 -0.02 0.00 0.00 39.34 39.30 2wtf n TYR 69 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wtf n GLY 70 N 1.32 1.12 3.78 2.72 0.00 -0.78 -4.84 105.19 108.52 2wtf n GLY 70 Ca 0.25 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 2wtf n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wtf s ILE 71 N -2.45 4.22 0.30 -0.61 1.01 -1.24 -5.03 121.20 117.40 2wtf s ILE 71 Ca 0.00 1.82 -0.06 0.00 0.00 0.00 0.00 60.65 62.41 2wtf s ILE 71 Cb 0.00 -4.06 -0.00 0.00 0.01 0.00 0.00 42.46 38.41 2wtf s ILE 71 CO 0.00 0.22 0.45 -0.94 0.00 0.00 0.00 174.94 174.67 2wtf s SER 72 N -1.53 0.46 0.51 3.58 1.04 -1.26 -4.48 113.70 112.02 2wtf s SER 72 Ca 0.48 -1.27 0.16 0.00 0.48 0.00 0.00 55.95 55.79 2wtf s SER 72 Cb -0.20 0.62 1.23 0.00 0.10 0.00 0.00 66.02 67.77 2wtf s SER 72 CO 0.25 -1.21 2.12 -0.09 0.98 0.00 0.00 173.24 175.29 2wtf h ARG 73 N 2.21 0.00 -0.68 4.02 2.43 -1.97 -2.51 114.38 117.88 2wtf h ARG 73 Ca -0.28 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 2wtf h ARG 73 Cb 1.24 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.76 2wtf h ARG 73 CO 0.39 0.04 0.38 0.52 -1.51 0.00 0.00 179.97 179.79 2wtf h MET 74 N 0.00 0.93 -6.92 0.20 2.86 -1.96 -3.40 114.93 106.65 2wtf h MET 74 Ca -0.00 -0.10 -0.51 0.00 -2.06 0.00 0.00 59.70 57.03 2wtf h MET 74 Cb 0.07 -0.19 0.06 0.00 0.06 0.00 0.00 31.60 31.60 2wtf h MET 74 CO 0.01 0.68 0.55 -0.51 1.06 0.00 0.00 176.91 178.69 2wtf s ASP 75 N -6.44 6.56 0.74 1.22 -0.00 -0.95 -5.02 116.67 112.78 2wtf s ASP 75 Ca -0.11 2.47 -0.12 0.00 -0.00 0.00 0.00 52.55 54.80 2wtf s ASP 75 Cb 0.17 -2.63 0.04 0.00 -0.00 0.00 0.00 42.92 40.50 2wtf s ASP 75 CO 0.79 -0.66 1.11 0.42 -0.00 0.00 0.00 175.17 176.82 2wtf s THR 76 N -1.31 3.23 0.15 -1.27 -4.23 -1.26 -4.08 115.64 106.86 2wtf s THR 76 Ca 0.55 0.40 -0.21 0.00 -1.18 0.00 0.00 61.69 61.24 2wtf s THR 76 Cb -0.34 -3.33 0.04 0.00 1.34 0.00 0.00 72.50 70.22 2wtf s THR 76 CO 0.44 -0.52 1.64 0.40 -0.54 0.00 0.00 174.62 176.03 2wtf h ILE 77 N -0.81 0.42 -0.91 2.99 2.04 -1.79 -0.55 117.51 118.90 2wtf h ILE 77 Ca -0.46 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.47 2wtf h ILE 77 Cb 1.26 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 2wtf h ILE 77 CO 0.63 0.00 0.57 1.56 0.00 0.00 0.00 178.15 180.91 2wtf h GLN 78 N -0.20 1.01 -0.53 2.37 1.08 -1.93 -0.06 115.11 116.85 2wtf h GLN 78 Ca 0.15 -0.06 -0.06 0.00 -1.45 0.00 0.00 58.65 57.23 2wtf h GLN 78 Cb 0.43 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 2wtf h GLN 78 CO -0.40 0.67 0.08 0.93 -0.95 0.00 0.00 178.83 179.16 2wtf h GLU 79 N 1.04 0.84 -0.08 1.46 5.08 -1.71 -2.95 114.58 118.26 2wtf h GLU 79 Ca 0.40 -0.19 -0.17 0.00 -1.00 0.00 0.00 59.36 58.40 2wtf h GLU 79 Cb 0.17 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2wtf h GLU 79 CO -0.17 0.78 -0.69 0.00 -1.00 0.00 0.00 179.01 177.93 2wtf h ALA 80 N 1.30 0.68 0.00 3.43 0.00 0.37 -2.43 119.26 122.61 2wtf h ALA 80 Ca 0.17 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2wtf h ALA 80 Cb 0.36 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2wtf h ALA 80 CO 0.01 0.76 -0.05 -0.07 0.00 0.00 0.00 179.25 179.89 2wtf h LEU 81 N 0.24 0.00 0.00 0.00 3.38 -0.91 -1.48 115.31 116.54 2wtf h LEU 81 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2wtf h LEU 81 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2wtf h LEU 81 CO 0.11 0.05 -0.17 0.11 0.09 0.00 0.00 178.44 178.63 2wtf h LYS 82 N 0.00 0.00 0.00 1.13 1.79 -1.32 -3.07 116.57 115.10 2wtf h LYS 82 Ca -0.00 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 2wtf h LYS 82 Cb 0.16 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 2wtf h LYS 82 CO 0.01 0.00 -1.19 0.87 -1.08 0.00 0.00 179.45 178.06 2wtf h LYS 83 N 0.00 0.00 -1.08 3.15 1.57 -1.27 -3.45 116.57 115.48 2wtf h LYS 83 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2wtf h LYS 83 Cb 0.85 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.94 2wtf h LYS 83 CO 0.00 0.32 -0.41 0.00 -0.57 0.00 0.00 179.45 178.79 2wtf h SER 85 N 7.87 0.00 0.00 0.00 4.64 -1.83 -1.54 113.55 122.69 2wtf h SER 85 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2wtf h SER 85 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2wtf h SER 85 CO 0.16 0.24 0.00 0.59 -0.87 0.00 0.00 176.83 176.94 2wtf n ASN 86 N -4.01 0.00 -4.48 4.97 3.02 -1.26 -4.92 115.26 108.58 2wtf n ASN 86 Ca -0.02 -0.99 -0.43 0.00 -0.03 0.00 0.00 54.58 53.12 2wtf n ASN 86 Cb 0.31 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 2wtf n ASN 86 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2wtf n LEU 87 N -0.92 0.31 -4.00 3.41 7.94 -0.58 -4.86 117.00 118.31 2wtf n LEU 87 Ca 0.17 0.97 -0.32 0.00 -1.11 0.00 0.00 56.01 55.73 2wtf n LEU 87 Cb 0.08 -1.14 -0.13 0.00 0.53 0.00 0.00 43.42 42.75 2wtf n LEU 87 CO 0.13 -2.59 -0.17 -0.63 -1.11 0.00 0.00 177.39 173.02 2wtf s ILE 88 N -1.36 2.77 0.17 1.96 1.01 -0.24 -5.04 121.20 120.47 2wtf s ILE 88 Ca 0.63 -3.03 -0.22 0.00 0.00 0.00 0.00 60.65 58.03 2wtf s ILE 88 Cb -0.64 -2.92 -0.08 0.00 0.01 0.00 0.00 42.46 38.83 2wtf s ILE 88 CO 0.58 -0.77 0.71 -2.84 0.00 0.00 0.00 174.94 172.62 2wtf s PRO 89 N 0.03 4.37 -0.07 2.79 0.02 -1.26 -1.15 135.00 139.73 2wtf s PRO 89 Ca 0.15 0.96 -0.01 0.00 0.02 0.00 0.00 61.00 62.12 2wtf s PRO 89 Cb -0.24 -3.11 0.03 0.00 0.02 0.00 0.00 34.50 31.20 2wtf s PRO 89 CO -0.02 0.52 -0.00 0.42 -0.33 0.00 0.00 177.00 177.59 2wtf s ILE 90 N -1.28 0.37 0.29 2.83 1.01 0.50 -4.91 121.20 120.00 2wtf s ILE 90 Ca 0.37 0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.85 2wtf s ILE 90 Cb -0.20 -0.52 -0.09 0.00 0.01 0.00 0.00 42.46 41.66 2wtf s ILE 90 CO 0.23 0.25 1.00 -2.28 0.00 0.00 0.00 174.94 174.14 2wtf s HIS 91 N 1.88 3.73 0.99 3.97 2.46 -1.26 -0.39 115.29 126.67 2wtf s HIS 91 Ca 0.04 1.80 -0.13 0.00 0.47 0.00 0.00 55.06 57.24 2wtf s HIS 91 Cb -0.12 -3.08 0.11 0.00 -0.13 0.00 0.00 32.58 29.36 2wtf s HIS 91 CO -0.05 -0.00 0.66 0.25 -2.47 0.00 0.00 174.74 173.13 2wtf n THR 92 N 1.05 0.00 -1.33 0.89 -2.24 -0.79 -4.81 114.28 107.05 2wtf n THR 92 Ca -0.00 -0.17 -0.32 0.00 -2.27 0.00 0.00 64.05 61.29 2wtf n THR 92 Cb 0.47 -0.78 0.09 0.00 -2.10 0.00 0.00 70.33 68.01 2wtf n THR 92 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wtf s ALA 93 N -2.46 2.22 0.02 6.98 0.00 -1.26 -4.76 121.76 122.50 2wtf s ALA 93 Ca 0.61 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.98 2wtf s ALA 93 Cb -0.21 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.58 2wtf s ALA 93 CO 0.64 -1.76 -0.03 0.14 0.00 0.00 0.00 175.76 174.76 2wtf s VAL 94 N -2.69 0.12 0.06 0.00 -7.23 0.51 -1.48 120.40 109.68 2wtf s VAL 94 Ca 0.64 -0.64 -0.25 0.00 -1.81 0.00 0.00 61.98 59.92 2wtf s VAL 94 Cb -0.19 -0.22 -0.06 0.00 0.56 0.00 0.00 36.38 36.47 2wtf s VAL 94 CO 0.52 -0.33 0.77 -0.36 -0.31 0.00 0.00 175.10 175.39 2wtf s PHE 95 N -0.99 3.75 -0.11 2.82 0.40 0.98 -1.19 117.98 123.63 2wtf s PHE 95 Ca -0.10 1.49 -0.18 0.00 -0.60 0.00 0.00 56.93 57.54 2wtf s PHE 95 Cb -0.07 -2.82 -0.04 0.00 0.51 0.00 0.00 43.02 40.60 2wtf s PHE 95 CO -0.01 0.29 0.48 0.21 0.70 0.00 0.00 175.22 176.89 2wtf s LYS 96 N -0.15 4.33 -0.15 0.44 2.20 -1.26 -0.83 119.74 124.32 2wtf s LYS 96 Ca 0.38 0.45 -0.39 0.00 -0.36 0.00 0.00 55.97 56.05 2wtf s LYS 96 Cb -0.21 -3.43 -0.19 0.00 -1.51 0.00 0.00 37.83 32.50 2wtf s LYS 96 CO 0.23 0.17 1.16 1.17 -0.36 0.00 0.00 175.35 177.72 2wtf n LYS 97 N 3.62 0.00 -0.21 4.03 4.81 -0.52 -1.05 118.16 128.83 2wtf n LYS 97 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 2wtf n LYS 97 Cb 0.52 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 34.17 2wtf n LYS 97 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wtf n GLY 98 N 2.15 1.22 3.51 3.14 0.00 0.11 -4.96 105.19 110.36 2wtf n GLY 98 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2wtf n GLY 98 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wtf s GLU 99 N -0.49 2.05 -0.25 1.61 2.02 -0.22 -4.99 118.70 118.45 2wtf s GLU 99 Ca 0.00 -1.02 0.14 0.00 0.02 0.00 0.00 54.97 54.11 2wtf s GLU 99 Cb 0.00 -2.23 0.73 0.00 0.10 0.00 0.00 34.13 32.74 2wtf s GLU 99 CO 0.00 0.52 1.69 -0.40 0.02 0.00 0.00 175.26 177.09 2wtf n ASP 100 N 1.17 5.04 -4.01 -0.19 3.85 -1.26 -4.03 116.55 117.12 2wtf n ASP 100 Ca -0.15 -3.05 -0.14 0.00 -0.71 0.00 0.00 54.79 50.74 2wtf n ASP 100 Cb 0.52 -0.67 -0.13 0.00 -1.35 0.00 0.00 41.12 39.50 2wtf n ASP 100 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 2wtf s PHE 101 N -2.86 0.53 0.51 2.11 -0.12 -1.26 -4.79 117.98 112.09 2wtf s PHE 101 Ca 0.52 -0.32 -0.03 0.00 -0.05 0.00 0.00 56.93 57.05 2wtf s PHE 101 Cb 0.41 -0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.46 2wtf s PHE 101 CO 0.13 -0.06 0.77 1.67 -0.05 0.00 0.00 175.22 177.69 2wtf s TRP 102 N -0.84 3.31 0.17 3.49 1.48 -1.26 -4.35 118.94 120.93 2wtf s TRP 102 Ca -0.05 0.50 -0.21 0.00 -1.06 0.00 0.00 56.10 55.28 2wtf s TRP 102 Cb -0.06 -2.46 0.05 0.00 -1.16 0.00 0.00 33.47 29.84 2wtf s TRP 102 CO 0.00 -0.50 0.57 -1.14 -4.06 0.00 0.00 176.95 171.81 2wtf s GLN 103 N -4.75 1.31 -0.09 3.25 0.74 -0.33 -4.91 119.66 114.88 2wtf s GLN 103 Ca 0.50 -0.62 -0.11 0.00 0.05 0.00 0.00 55.36 55.18 2wtf s GLN 103 Cb -0.10 0.56 -0.05 0.00 1.10 0.00 0.00 33.01 34.52 2wtf s GLN 103 CO 0.42 -0.56 0.26 0.71 -0.55 0.00 0.00 175.29 175.57 2wtf s TYR 104 N -3.79 3.61 -0.85 1.67 1.51 -1.26 -0.37 117.35 117.87 2wtf s TYR 104 Ca 0.03 0.70 0.00 0.00 -1.01 0.00 0.00 57.07 56.80 2wtf s TYR 104 Cb -0.01 -2.15 0.23 0.00 -0.11 0.00 0.00 41.96 39.92 2wtf s TYR 104 CO -0.09 0.60 0.83 0.72 -1.11 0.00 0.00 175.55 176.49 2wtf n HIS 105 N 2.28 3.76 -2.40 2.71 8.25 -1.26 -5.01 115.22 123.54 2wtf n HIS 105 Ca -0.16 -3.98 -0.36 0.00 -0.26 0.00 0.00 57.72 52.96 2wtf n HIS 105 Cb 0.53 -0.97 -0.02 0.00 1.12 0.00 0.00 29.99 30.65 2wtf n HIS 105 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wtf s ASP 106 N -0.98 6.31 -1.40 0.41 1.01 -1.26 -1.46 116.67 119.30 2wtf s ASP 106 Ca 0.30 2.13 0.00 0.00 0.71 0.00 0.00 52.55 55.69 2wtf s ASP 106 Cb -0.01 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.34 2wtf s ASP 106 CO -0.08 -0.81 0.00 0.61 0.21 0.00 0.00 175.17 175.10 2wtf n GLY 107 N 0.23 1.32 3.49 0.21 0.00 -1.26 -5.00 105.19 104.17 2wtf n GLY 107 Ca 0.08 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 2wtf n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wtf n GLY 109 N 0.02 2.73 0.30 0.00 0.00 -0.97 -4.62 105.19 102.66 2wtf n GLY 109 Ca -0.11 -1.22 0.16 0.00 0.00 0.00 0.00 46.02 44.86 2wtf n GLY 109 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wtf h SER 110 N 0.00 0.00 1.43 1.61 4.64 -1.86 -1.37 113.55 118.00 2wtf h SER 110 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wtf h SER 110 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2wtf h SER 110 CO 0.00 0.01 -0.06 -2.67 -0.87 0.00 0.00 176.83 173.24 2wtf n TRP 111 N -3.74 0.92 -2.81 4.77 2.14 -1.26 -4.78 117.44 112.67 2wtf n TRP 111 Ca -0.03 0.27 -0.41 0.00 2.07 0.00 0.00 57.50 59.40 2wtf n TRP 111 Cb 0.09 -0.93 -0.03 0.00 -0.81 0.00 0.00 31.31 29.63 2wtf n TRP 111 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 2wtf s VAL 112 N -3.11 4.90 0.04 -1.67 1.01 -0.52 -4.96 120.40 116.09 2wtf s VAL 112 Ca 0.10 1.85 -0.27 0.00 0.00 0.00 0.00 61.98 63.66 2wtf s VAL 112 Cb 0.12 -4.23 -0.17 0.00 0.00 0.00 0.00 36.38 32.11 2wtf s VAL 112 CO 0.61 0.14 1.45 1.56 0.00 0.00 0.00 175.10 178.86 2wtf h GLN 113 N 6.90 -0.43 -6.12 2.72 1.08 -1.86 -3.43 115.11 113.97 2wtf h GLN 113 Ca -0.38 0.03 -0.77 0.00 -1.45 0.00 0.00 58.65 56.08 2wtf h GLN 113 Cb 1.19 0.10 0.03 0.00 -0.05 0.00 0.00 27.48 28.74 2wtf h GLN 113 CO 0.78 -0.17 0.66 -3.47 -0.95 0.00 0.00 178.83 175.68 2wtf n ASP 114 N -5.20 1.68 0.27 1.46 -0.08 -1.26 -4.85 116.55 108.56 2wtf n ASP 114 Ca -0.10 1.12 0.14 0.00 -1.51 0.00 0.00 54.79 54.45 2wtf n ASP 114 Cb 0.24 -1.06 0.73 0.00 2.34 0.00 0.00 41.12 43.37 2wtf n ASP 114 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wtf h PRO 115 N 5.65 0.00 -0.65 -0.67 0.11 -1.99 -2.97 132.00 131.48 2wtf h PRO 115 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2wtf h PRO 115 Cb 1.35 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.43 2wtf h PRO 115 CO 0.89 0.10 0.33 0.00 -0.21 0.00 0.00 178.00 179.11 2wtf h ALA 116 N 1.90 1.36 -1.82 -0.75 0.00 -1.96 -3.36 119.26 114.63 2wtf h ALA 116 Ca -0.00 -0.12 -0.75 0.00 0.00 0.00 0.00 54.91 54.04 2wtf h ALA 116 Cb 0.42 -0.26 -0.31 0.00 0.00 0.00 0.00 17.79 17.63 2wtf h ALA 116 CO 0.01 0.51 0.49 1.63 0.00 0.00 0.00 179.25 181.89 2wtf n LYS 117 N -4.36 4.30 -4.54 0.00 5.02 -1.12 -5.01 118.16 112.45 2wtf n LYS 117 Ca 0.06 -4.64 -0.26 0.00 -2.02 0.00 0.00 58.31 51.46 2wtf n LYS 117 Cb 0.12 -2.43 -0.11 0.00 -0.02 0.00 0.00 35.03 32.59 2wtf n LYS 117 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2wtf s GLN 118 N -3.22 1.81 -0.38 1.97 -1.52 -1.26 -2.30 119.66 114.75 2wtf s GLN 118 Ca 0.36 -1.94 0.02 0.00 -1.95 0.00 0.00 55.36 51.85 2wtf s GLN 118 Cb 0.13 -1.64 0.11 0.00 -0.22 0.00 0.00 33.01 31.39 2wtf s GLN 118 CO 0.00 0.11 0.14 0.42 -0.25 0.00 0.00 175.29 175.71 2wtf s ILE 119 N -2.67 1.69 0.18 1.08 1.01 -1.26 -4.75 121.20 116.48 2wtf s ILE 119 Ca 0.33 -2.26 -0.30 0.00 0.00 0.00 0.00 60.65 58.41 2wtf s ILE 119 Cb 0.04 -2.22 -0.08 0.00 0.01 0.00 0.00 42.46 40.21 2wtf s ILE 119 CO 0.16 -0.73 1.06 -0.94 0.00 0.00 0.00 174.94 174.49 2wtf s SER 120 N 0.80 7.35 0.39 3.58 1.04 -1.26 -4.88 113.70 120.71 2wtf s SER 120 Ca 0.13 2.04 0.15 0.00 0.48 0.00 0.00 55.95 58.75 2wtf s SER 120 Cb -0.21 -2.60 0.80 0.00 0.10 0.00 0.00 66.02 64.11 2wtf s SER 120 CO -0.10 -0.15 1.84 1.62 0.98 0.00 0.00 173.24 177.43 2wtf h VAL 121 N 3.67 1.12 -0.43 5.02 3.04 -1.99 -2.89 116.25 123.80 2wtf h VAL 121 Ca -0.44 -1.24 -0.04 0.00 -1.01 0.00 0.00 66.70 63.98 2wtf h VAL 121 Cb 1.21 1.69 -0.02 0.00 -2.01 0.00 0.00 31.29 32.16 2wtf h VAL 121 CO 0.71 0.34 0.13 -0.08 -1.01 0.00 0.00 177.57 177.66 2wtf h GLU 122 N 0.00 0.68 -0.64 4.17 4.81 -1.92 -3.26 114.58 118.42 2wtf h GLU 122 Ca -0.00 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2wtf h GLU 122 Cb 0.66 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2wtf h GLU 122 CO 0.04 0.66 0.00 -0.25 -0.73 0.00 0.00 179.01 178.74 2wtf n ASP 123 N -4.56 3.78 -4.15 1.04 8.00 -1.16 -4.93 116.55 114.57 2wtf n ASP 123 Ca 0.00 -2.00 -0.11 0.00 0.71 0.00 0.00 54.79 53.39 2wtf n ASP 123 Cb 0.19 -0.43 -0.10 0.00 -0.02 0.00 0.00 41.12 40.76 2wtf n ASP 123 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2wtf s HIS 124 N -1.15 0.86 -0.03 1.24 3.76 -1.10 -1.44 115.29 117.43 2wtf s HIS 124 Ca 0.46 -0.83 0.03 0.00 -0.15 0.00 0.00 55.06 54.57 2wtf s HIS 124 Cb 0.25 -0.50 0.00 0.00 1.11 0.00 0.00 32.58 33.44 2wtf s HIS 124 CO 0.33 -0.13 -0.11 0.21 -0.85 0.00 0.00 174.74 174.19 2wtf s LYS 125 N -3.40 1.13 0.26 1.40 2.20 -0.01 -4.84 119.74 116.47 2wtf s LYS 125 Ca 0.08 -0.36 -0.30 0.00 -0.36 0.00 0.00 55.97 55.03 2wtf s LYS 125 Cb 0.02 -1.03 -0.10 0.00 -1.51 0.00 0.00 37.83 35.21 2wtf s LYS 125 CO -0.04 0.13 1.44 0.08 -0.36 0.00 0.00 175.35 176.61 2wtf s VAL 126 N 0.19 2.61 -0.19 4.02 1.01 -1.26 -0.02 120.40 126.76 2wtf s VAL 126 Ca -0.04 0.52 -0.04 0.00 0.00 0.00 0.00 61.98 62.42 2wtf s VAL 126 Cb -0.09 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2wtf s VAL 126 CO 0.01 0.09 -0.03 -0.55 0.00 0.00 0.00 175.10 174.61 2wtf s SER 127 N 0.32 4.62 -0.01 3.32 0.15 -0.55 -4.81 113.70 116.75 2wtf s SER 127 Ca 0.59 -0.24 0.16 0.00 0.70 0.00 0.00 55.95 57.15 2wtf s SER 127 Cb -0.42 -1.78 0.46 0.00 -1.71 0.00 0.00 66.02 62.57 2wtf s SER 127 CO 0.44 0.08 1.38 0.18 1.20 0.00 0.00 173.24 176.52 2wtf n LEU 128 N 4.16 2.82 -0.26 3.45 4.77 -1.26 -4.07 117.00 126.60 2wtf n LEU 128 Ca -0.17 -1.41 -0.01 0.00 -0.03 0.00 0.00 56.01 54.38 2wtf n LEU 128 Cb 0.52 -0.36 0.11 0.00 -2.33 0.00 0.00 43.42 41.36 2wtf n LEU 128 CO 0.31 0.68 1.14 -0.08 -1.33 0.00 0.00 177.39 178.11 2wtf h GLU 129 N 3.00 0.80 -0.48 3.23 4.81 -1.96 -1.36 114.58 122.62 2wtf h GLU 129 Ca 0.00 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.23 2wtf h GLU 129 Cb 0.72 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2wtf h GLU 129 CO 0.01 0.53 0.32 -1.35 -0.73 0.00 0.00 179.01 177.79 2wtf h PRO 130 N 0.82 0.47 -0.03 0.92 0.11 -1.99 0.30 132.00 132.59 2wtf h PRO 130 Ca 0.32 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.24 2wtf h PRO 130 Cb 0.14 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 2wtf h PRO 130 CO -0.16 0.31 -0.69 1.88 -0.21 0.00 0.00 178.00 179.13 2wtf h TYR 131 N 0.48 0.24 -0.38 0.65 -1.99 -1.62 -1.69 116.97 112.66 2wtf h TYR 131 Ca 0.20 -0.10 -0.10 0.00 2.00 0.00 0.00 58.73 60.72 2wtf h TYR 131 Cb 0.19 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 2wtf h TYR 131 CO -0.00 0.81 -0.16 0.00 -0.00 0.00 0.00 178.16 178.81 2wtf h ARG 132 N 0.12 0.78 0.17 4.88 3.08 -0.53 -1.63 114.38 121.25 2wtf h ARG 132 Ca -0.02 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 2wtf h ARG 132 Cb 1.23 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 2wtf h ARG 132 CO 0.10 0.95 -0.09 0.00 -1.07 0.00 0.00 179.97 179.87 2wtf h ARG 133 N 0.58 -0.23 -0.88 0.04 3.08 -0.37 -1.58 114.38 115.01 2wtf h ARG 133 Ca 0.09 0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.16 2wtf h ARG 133 Cb 0.71 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.77 2wtf h ARG 133 CO 0.05 -0.16 0.58 0.93 -1.07 0.00 0.00 179.97 180.30 2wtf h GLU 134 N -0.24 1.17 -0.92 0.04 4.39 -1.28 -2.12 114.58 115.62 2wtf h GLU 134 Ca -0.02 -0.08 0.05 0.00 0.34 0.00 0.00 59.36 59.66 2wtf h GLU 134 Cb 0.19 -0.26 -0.06 0.00 -0.10 0.00 0.00 28.75 28.52 2wtf h GLU 134 CO 0.03 0.78 0.59 1.03 -1.16 0.00 0.00 179.01 180.28 2wtf h SER 135 N 1.20 0.94 -0.77 1.42 0.87 -1.10 -1.42 113.55 114.69 2wtf h SER 135 Ca 0.32 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.84 2wtf h SER 135 Cb -0.12 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.61 2wtf h SER 135 CO -0.07 0.62 0.31 -0.09 -0.53 0.00 0.00 176.83 177.07 2wtf h ARG 136 N 1.09 1.16 0.13 2.24 9.65 -0.65 -0.33 114.38 127.68 2wtf h ARG 136 Ca 0.39 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 59.05 2wtf h ARG 136 Cb 0.11 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 2wtf h ARG 136 CO -0.16 0.94 -0.06 0.87 2.80 0.00 0.00 179.97 184.36 2wtf h LYS 137 N 1.13 -0.17 -0.83 0.20 1.57 -0.92 -1.73 116.57 115.82 2wtf h LYS 137 Ca 0.26 0.01 0.16 0.00 -1.87 0.00 0.00 60.65 59.21 2wtf h LYS 137 Cb 0.22 0.04 -0.10 0.00 0.08 0.00 0.00 32.23 32.46 2wtf h LYS 137 CO -0.02 -0.06 0.38 0.00 -0.57 0.00 0.00 179.45 179.18 2wtf h ALA 138 N 0.63 1.25 -0.70 3.86 0.00 -1.01 -2.19 119.26 121.08 2wtf h ALA 138 Ca -0.02 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2wtf h ALA 138 Cb 0.19 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2wtf h ALA 138 CO 0.03 -0.19 0.17 1.25 0.00 0.00 0.00 179.25 180.50 2wtf h LEU 139 N 0.51 1.07 -1.07 0.00 5.85 -0.35 -1.40 115.31 119.92 2wtf h LEU 139 Ca 0.47 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.90 2wtf h LEU 139 Cb 0.75 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 2wtf h LEU 139 CO -0.42 1.03 0.02 0.11 -0.34 0.00 0.00 178.44 178.84 2wtf h LYS 140 N 1.07 0.68 -0.45 1.25 1.57 -0.75 0.68 116.57 120.61 2wtf h LYS 140 Ca 0.22 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2wtf h LYS 140 Cb 0.38 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2wtf h LYS 140 CO 0.00 0.68 0.06 0.82 -0.57 0.00 0.00 179.45 180.44 2wtf h ILE 141 N 0.65 1.25 -0.22 1.86 2.04 -0.87 -2.21 117.51 120.01 2wtf h ILE 141 Ca 0.13 -0.93 -0.06 0.00 1.00 0.00 0.00 64.86 65.00 2wtf h ILE 141 Cb 0.37 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 2wtf h ILE 141 CO 0.01 0.32 -0.10 -0.26 0.00 0.00 0.00 178.15 178.13 2wtf h PHE 142 N 0.61 0.51 -0.24 1.37 0.05 -0.63 -2.71 116.94 115.90 2wtf h PHE 142 Ca 0.13 -0.13 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 2wtf h PHE 142 Cb 0.41 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 38.23 2wtf h PHE 142 CO 0.03 0.72 0.09 0.87 -0.18 0.00 0.00 178.31 179.85 2wtf h LYS 143 N 0.16 0.33 -0.35 1.51 1.57 -0.89 -1.12 116.57 117.78 2wtf h LYS 143 Ca 0.05 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 2wtf h LYS 143 Cb 0.59 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2wtf h LYS 143 CO 0.03 0.28 -0.25 0.66 -0.57 0.00 0.00 179.45 179.60 2wtf h SER 144 N 0.34 0.73 0.36 0.86 4.64 -1.21 -3.26 113.55 116.00 2wtf h SER 144 Ca 0.09 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2wtf h SER 144 Cb 0.08 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2wtf h SER 144 CO -0.01 0.95 -0.68 0.00 -0.87 0.00 0.00 176.83 176.22 2wtf n ALA 145 N -2.50 3.88 -3.36 5.18 0.00 -0.56 -4.88 120.51 118.27 2wtf n ALA 145 Ca -0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 53.44 52.89 2wtf n ALA 145 Cb 0.44 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.76 2wtf n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wtf n ASP 147 N 3.41 0.45 -3.67 0.00 5.75 -1.26 -4.45 116.55 116.79 2wtf n ASP 147 Ca -0.17 -0.21 -0.28 0.00 -0.01 0.00 0.00 54.79 54.12 2wtf n ASP 147 Cb 0.56 0.03 -0.16 0.00 -1.03 0.00 0.00 41.12 40.53 2wtf n ASP 147 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2wtf s LEU 148 N -2.87 1.01 -0.12 -2.12 2.96 -1.26 -5.10 118.68 111.19 2wtf s LEU 148 Ca 0.16 -0.99 0.03 0.00 -0.22 0.00 0.00 54.13 53.11 2wtf s LEU 148 Cb 0.18 -0.50 0.01 0.00 0.50 0.00 0.00 46.19 46.38 2wtf s LEU 148 CO 0.61 -0.36 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.39 2wtf s VAL 149 N 1.94 1.89 -0.23 1.68 1.01 -1.26 -1.85 120.40 123.57 2wtf s VAL 149 Ca 0.03 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 2wtf s VAL 149 Cb -0.17 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2wtf s VAL 149 CO -0.17 0.52 0.11 -0.70 0.00 0.00 0.00 175.10 174.86 2wtf s GLU 150 N 0.69 3.91 -0.80 2.72 2.12 -0.56 -4.93 118.70 121.84 2wtf s GLU 150 Ca -0.11 -0.36 -0.26 0.00 0.36 0.00 0.00 54.97 54.60 2wtf s GLU 150 Cb -0.16 -3.40 0.04 0.00 0.26 0.00 0.00 34.13 30.86 2wtf s GLU 150 CO 0.02 0.02 1.31 0.50 -0.54 0.00 0.00 175.26 176.57 2wtf s ARG 151 N 1.12 3.28 0.11 4.30 3.52 -1.26 -0.79 118.95 129.23 2wtf s ARG 151 Ca 0.06 -0.47 -0.04 0.00 -0.13 0.00 0.00 55.73 55.15 2wtf s ARG 151 Cb -0.14 -4.46 -0.15 0.00 -1.56 0.00 0.00 34.95 28.64 2wtf s ARG 151 CO 0.04 -2.15 1.26 0.00 -0.81 0.00 0.00 175.30 173.63 2wtf h ALA 152 N 9.96 0.29 -2.09 6.12 0.00 -1.73 -3.46 119.26 128.35 2wtf h ALA 152 Ca -0.17 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.98 2wtf h ALA 152 Cb 1.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2wtf h ALA 152 CO 1.31 0.87 0.06 -1.13 0.00 0.00 0.00 179.25 180.36 2wtf n SER 153 N -3.67 -0.40 0.23 0.00 3.41 -1.15 -4.96 113.62 107.07 2wtf n SER 153 Ca -0.07 -1.26 0.07 0.00 -0.26 0.00 0.00 58.87 57.34 2wtf n SER 153 Cb 0.89 0.66 0.55 0.00 -0.26 0.00 0.00 64.21 66.05 2wtf n SER 153 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2wtf h ILE 154 N 1.18 1.00 0.00 -1.33 2.10 -1.99 -3.07 117.51 115.40 2wtf h ILE 154 Ca -0.06 -0.65 -0.06 0.00 1.08 0.00 0.00 64.86 65.17 2wtf h ILE 154 Cb 0.22 1.37 -0.12 0.00 -1.09 0.00 0.00 36.82 37.20 2wtf h ILE 154 CO 0.08 0.18 -0.58 -0.90 -1.08 0.00 0.00 178.15 175.84 2wtf n ASP 155 N -4.13 1.33 -4.02 2.19 3.85 -1.26 -4.65 116.55 109.86 2wtf n ASP 155 Ca -0.02 -2.87 -0.17 0.00 -0.71 0.00 0.00 54.79 51.03 2wtf n ASP 155 Cb 0.26 -0.39 -0.14 0.00 -1.35 0.00 0.00 41.12 39.50 2wtf n ASP 155 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 2wtf s GLU 156 N -1.65 0.59 0.07 0.11 2.02 -1.16 -1.05 118.70 117.63 2wtf s GLU 156 Ca 0.30 -0.41 0.01 0.00 0.02 0.00 0.00 54.97 54.89 2wtf s GLU 156 Cb 0.30 -0.54 -0.03 0.00 0.10 0.00 0.00 34.13 33.96 2wtf s GLU 156 CO -0.07 0.14 -0.06 0.14 0.02 0.00 0.00 175.26 175.42 2wtf s VAL 157 N -0.49 0.54 -0.00 2.63 -7.23 -0.41 -1.95 120.40 113.49 2wtf s VAL 157 Ca -0.00 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 2wtf s VAL 157 Cb -0.05 -1.15 -0.04 0.00 0.56 0.00 0.00 36.38 35.70 2wtf s VAL 157 CO 0.00 -0.67 0.05 -0.36 -0.31 0.00 0.00 175.10 173.80 2wtf s PHE 158 N -2.65 3.20 -0.05 2.82 0.40 0.03 -1.13 117.98 120.60 2wtf s PHE 158 Ca 0.01 0.16 0.04 0.00 -0.60 0.00 0.00 56.93 56.54 2wtf s PHE 158 Cb -0.01 -1.71 -0.00 0.00 0.51 0.00 0.00 43.02 41.80 2wtf s PHE 158 CO -0.03 0.52 -0.19 -0.51 0.70 0.00 0.00 175.22 175.71 2wtf s LEU 159 N -1.65 1.93 -0.46 -0.37 1.43 0.02 -1.50 118.68 118.08 2wtf s LEU 159 Ca 0.21 -0.39 -0.18 0.00 -1.03 0.00 0.00 54.13 52.74 2wtf s LEU 159 Cb -0.12 -1.07 0.04 0.00 0.03 0.00 0.00 46.19 45.08 2wtf s LEU 159 CO 0.12 0.16 0.52 -0.62 0.23 0.00 0.00 176.35 176.76 2wtf s ASP 160 N 0.09 6.21 0.00 2.29 -1.08 -0.77 -1.36 116.67 122.05 2wtf s ASP 160 Ca -0.06 -0.85 0.21 0.00 -0.52 0.00 0.00 52.55 51.33 2wtf s ASP 160 Cb -0.13 -2.25 0.89 0.00 -1.46 0.00 0.00 42.92 39.97 2wtf s ASP 160 CO 0.03 -0.72 1.62 0.18 0.52 0.00 0.00 175.17 176.80 2wtf n LEU 161 N 5.80 1.22 -0.27 -1.34 7.99 -0.20 -4.49 117.00 125.73 2wtf n LEU 161 Ca -0.07 -0.50 -0.10 0.00 -0.01 0.00 0.00 56.01 55.32 2wtf n LEU 161 Cb 0.46 -0.07 -0.09 0.00 -0.11 0.00 0.00 43.42 43.62 2wtf n LEU 161 CO 0.50 0.25 0.49 1.23 -1.51 0.00 0.00 177.39 178.35 2wtf h GLY 162 N 5.09 -1.13 0.76 -0.72 0.00 -1.80 0.90 103.07 106.16 2wtf h GLY 162 Ca 0.00 0.81 0.03 0.00 0.00 0.00 0.00 47.33 48.17 2wtf h GLY 162 CO 0.00 -0.15 0.10 3.21 0.00 0.00 0.00 176.54 179.70 2wtf h ARG 163 N -0.13 0.23 -0.56 4.80 -0.00 -1.75 0.10 114.38 117.07 2wtf h ARG 163 Ca 0.11 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.58 2wtf h ARG 163 Cb 0.41 -0.05 -0.03 0.00 0.00 0.00 0.00 29.97 30.30 2wtf h ARG 163 CO -0.69 0.15 0.36 0.82 0.00 0.00 0.00 179.97 180.61 2wtf h ILE 164 N 0.24 1.15 0.22 2.04 2.04 -1.76 0.13 117.51 121.58 2wtf h ILE 164 Ca 0.13 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2wtf h ILE 164 Cb 0.10 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2wtf h ILE 164 CO -0.13 0.15 -0.11 0.00 0.00 0.00 0.00 178.15 178.06 2wtf h PHE 166 N -0.45 -0.07 -0.39 0.00 3.57 -0.58 0.11 116.94 119.12 2wtf h PHE 166 Ca -0.03 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 2wtf h PHE 166 Cb 0.34 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.10 2wtf h PHE 166 CO -0.02 -0.05 0.09 -0.91 -2.23 0.00 0.00 178.31 175.19 2wtf h ASN 167 N -0.04 0.52 -0.16 0.41 2.35 -0.67 0.18 115.58 118.17 2wtf h ASN 167 Ca 0.02 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.55 2wtf h ASN 167 Cb 0.08 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2wtf h ASN 167 CO -0.05 0.53 -0.49 -0.03 -1.65 0.00 0.00 177.43 175.74 2wtf h MET 168 N 0.56 0.62 -0.12 0.81 4.05 -0.50 0.58 114.93 120.92 2wtf h MET 168 Ca 0.13 -0.45 0.03 0.00 -0.28 0.00 0.00 59.70 59.13 2wtf h MET 168 Cb 0.22 0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.06 2wtf h MET 168 CO -0.00 1.07 -0.08 1.25 0.23 0.00 0.00 176.91 179.38 2wtf h LEU 169 N 0.28 -0.25 0.05 3.39 5.85 -0.36 -2.82 115.31 121.45 2wtf h LEU 169 Ca -0.02 0.06 -0.28 0.00 0.84 0.00 0.00 57.88 58.49 2wtf h LEU 169 Cb 1.11 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 2wtf h LEU 169 CO 0.10 -0.11 -1.45 0.24 -0.34 0.00 0.00 178.44 176.89 2wtf h MET 170 N -0.08 0.10 0.00 1.25 2.86 -0.91 -3.41 114.93 114.74 2wtf h MET 170 Ca 0.07 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2wtf h MET 170 Cb 0.19 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2wtf h MET 170 CO -0.17 0.89 0.00 1.19 1.06 0.00 0.00 176.91 179.88 2wtf n PHE 171 N -3.30 0.00 -2.63 -0.22 3.01 0.19 -4.90 117.46 109.60 2wtf n PHE 171 Ca -0.12 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.91 2wtf n PHE 171 Cb 1.02 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.46 2wtf n PHE 171 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2wtf s ASP 172 N -0.05 6.43 0.00 4.37 -1.08 -1.06 -4.86 116.67 120.42 2wtf s ASP 172 Ca 0.00 0.02 0.25 0.00 -0.52 0.00 0.00 52.55 52.30 2wtf s ASP 172 Cb 0.00 -2.53 0.53 0.00 -1.46 0.00 0.00 42.92 39.46 2wtf s ASP 172 CO 0.00 -1.43 1.42 0.59 0.52 0.00 0.00 175.17 176.28 2wtf n ASN 173 N 8.24 1.29 -0.01 -0.34 3.02 -1.26 -4.22 115.26 121.98 2wtf n ASN 173 Ca 0.07 -1.05 -0.16 0.00 -0.03 0.00 0.00 54.58 53.41 2wtf n ASN 173 Cb 0.49 0.24 -0.12 0.00 -0.61 0.00 0.00 39.78 39.78 2wtf n ASN 173 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2wtf h GLU 174 N 1.50 0.25 -6.73 3.52 4.39 -1.99 -3.46 114.58 112.07 2wtf h GLU 174 Ca 0.00 -0.29 -0.56 0.00 0.34 0.00 0.00 59.36 58.85 2wtf h GLU 174 Cb 0.57 0.09 0.09 0.00 -0.10 0.00 0.00 28.75 29.40 2wtf h GLU 174 CO 0.00 1.02 0.70 0.98 -1.16 0.00 0.00 179.01 180.55 2wtf n TYR 175 N -4.38 2.52 -3.84 4.33 9.36 -1.26 -4.94 117.16 118.95 2wtf n TYR 175 Ca -0.10 0.40 -0.36 0.00 3.32 0.00 0.00 57.90 61.15 2wtf n TYR 175 Cb 0.59 -2.51 -0.12 0.00 -0.63 0.00 0.00 39.34 36.67 2wtf n TYR 175 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2wtf s GLU 176 N -0.95 3.68 0.10 2.98 2.02 -1.26 -2.60 118.70 122.67 2wtf s GLU 176 Ca 0.62 -0.47 -0.13 0.00 0.02 0.00 0.00 54.97 55.01 2wtf s GLU 176 Cb -0.56 -3.26 -0.15 0.00 0.10 0.00 0.00 34.13 30.26 2wtf s GLU 176 CO 0.54 -0.10 1.31 -0.07 0.02 0.00 0.00 175.26 176.95 2wtf h LEU 177 N 7.94 0.93 0.00 1.80 4.07 -1.43 -3.48 115.31 125.14 2wtf h LEU 177 Ca -0.38 -0.62 -0.14 0.00 0.08 0.00 0.00 57.88 56.83 2wtf h LEU 177 Cb 1.17 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 42.62 2wtf h LEU 177 CO 0.60 1.39 0.08 0.35 -1.08 0.00 0.00 178.44 179.78 2wtf n THR 178 N -3.98 0.00 -1.77 0.22 -2.24 -1.13 -4.85 114.28 100.54 2wtf n THR 178 Ca -0.07 -1.32 -0.41 0.00 -2.27 0.00 0.00 64.05 59.98 2wtf n THR 178 Cb 0.72 1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 69.96 2wtf n THR 178 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wtf n GLY 179 N -0.54 1.17 2.25 3.38 0.00 -1.26 -2.14 105.19 108.05 2wtf n GLY 179 Ca -0.04 0.32 -0.13 0.00 0.00 0.00 0.00 46.02 46.17 2wtf n GLY 179 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wtf n ASP 180 N 0.52 -3.70 -3.76 1.61 5.68 -1.26 -4.95 116.55 110.68 2wtf n ASP 180 Ca 0.02 0.24 -0.14 0.00 -0.50 0.00 0.00 54.79 54.40 2wtf n ASP 180 Cb 0.39 -3.27 -0.15 0.00 -1.14 0.00 0.00 41.12 36.95 2wtf n ASP 180 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2wtf s LEU 181 N -4.86 0.93 0.15 -2.12 2.96 -0.91 -5.11 118.68 109.72 2wtf s LEU 181 Ca 0.00 0.19 0.06 0.00 -0.22 0.00 0.00 54.13 54.16 2wtf s LEU 181 Cb 0.00 0.19 -0.04 0.00 0.50 0.00 0.00 46.19 46.83 2wtf s LEU 181 CO 0.00 -0.13 -0.12 -0.54 -1.32 0.00 0.00 176.35 174.23 2wtf s LYS 182 N 1.06 1.12 0.19 1.98 1.02 -1.26 -1.09 119.74 122.76 2wtf s LYS 182 Ca -0.08 -1.43 -0.12 0.00 0.02 0.00 0.00 55.97 54.36 2wtf s LYS 182 Cb -0.11 -0.83 0.12 0.00 -0.52 0.00 0.00 37.83 36.48 2wtf s LYS 182 CO -0.04 0.13 1.84 -0.07 -0.92 0.00 0.00 175.35 176.29 2wtf h LEU 183 N 2.93 0.78 -1.33 3.17 3.38 -1.79 0.24 115.31 122.70 2wtf h LEU 183 Ca -0.38 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2wtf h LEU 183 Cb 1.20 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 2wtf h LEU 183 CO 0.59 0.60 0.30 0.07 0.09 0.00 0.00 178.44 180.10 2wtf h LYS 184 N 0.90 0.76 0.14 1.13 2.10 -1.85 0.31 116.57 120.06 2wtf h LYS 184 Ca 0.24 -0.07 -0.29 0.00 -2.00 0.00 0.00 60.65 58.52 2wtf h LYS 184 Cb -0.05 -0.16 0.01 0.00 -0.90 0.00 0.00 32.23 31.13 2wtf h LYS 184 CO -0.05 0.56 -1.37 -0.44 -2.00 0.00 0.00 179.45 176.15 2wtf h ASP 185 N 0.77 0.47 0.89 7.07 3.32 -1.87 -2.73 116.42 124.34 2wtf h ASP 185 Ca 0.20 -0.55 -0.08 0.00 0.02 0.00 0.00 57.03 56.61 2wtf h ASP 185 Cb 0.02 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2wtf h ASP 185 CO -0.03 1.44 -0.40 0.00 -1.72 0.00 0.00 179.24 178.52 2wtf h ALA 186 N 0.49 0.96 -0.11 3.45 0.00 0.05 -3.25 119.26 120.85 2wtf h ALA 186 Ca -0.19 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2wtf h ALA 186 Cb 2.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.74 2wtf h ALA 186 CO 0.20 0.50 -0.02 1.28 0.00 0.00 0.00 179.25 181.21 2wtf n LEU 187 N -3.52 2.98 -0.26 0.00 4.77 0.10 -4.51 117.00 116.57 2wtf n LEU 187 Ca -0.00 -3.12 0.15 0.00 -0.03 0.00 0.00 56.01 53.01 2wtf n LEU 187 Cb 0.54 -0.48 0.44 0.00 -2.33 0.00 0.00 43.42 41.59 2wtf n LEU 187 CO 0.37 0.74 1.22 0.77 -1.33 0.00 0.00 177.39 179.16 2wtf h SER 188 N 0.72 0.54 0.16 -1.43 4.64 -1.52 -1.93 113.55 114.72 2wtf h SER 188 Ca 0.01 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2wtf h SER 188 Cb 1.18 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2wtf h SER 188 CO 0.09 0.24 -0.08 -1.13 -0.87 0.00 0.00 176.83 175.08 2wtf h ASN 189 N 0.55 -0.20 -0.30 4.97 -0.73 -1.88 -0.19 115.58 117.80 2wtf h ASN 189 Ca 0.46 0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.64 2wtf h ASN 189 Cb 0.95 0.05 -0.02 0.00 0.27 0.00 0.00 38.32 39.57 2wtf h ASN 189 CO -0.20 -0.13 0.19 -0.29 -0.37 0.00 0.00 177.43 176.62 2wtf h ILE 190 N -0.22 1.09 -0.07 2.57 2.10 -1.91 0.63 117.51 121.70 2wtf h ILE 190 Ca -0.02 -0.21 -0.01 0.00 1.08 0.00 0.00 64.86 65.69 2wtf h ILE 190 Cb 0.17 0.65 -0.00 0.00 -1.09 0.00 0.00 36.82 36.55 2wtf h ILE 190 CO 0.03 0.10 -0.01 0.03 -1.08 0.00 0.00 178.15 177.22 2wtf h ARG 191 N 0.43 0.13 -0.14 2.19 3.08 -1.38 -0.53 114.38 118.16 2wtf h ARG 191 Ca 0.11 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2wtf h ARG 191 Cb -0.01 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2wtf h ARG 191 CO -0.02 0.45 0.09 0.93 -1.07 0.00 0.00 179.97 180.35 2wtf h GLU 192 N -0.20 0.19 -0.05 0.04 5.08 -0.45 -2.39 114.58 116.81 2wtf h GLU 192 Ca 0.02 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.15 2wtf h GLU 192 Cb 0.40 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2wtf h GLU 192 CO 0.01 0.13 -0.85 0.00 -1.00 0.00 0.00 179.01 177.29 2wtf h ALA 193 N 1.91 0.42 -0.05 3.43 0.00 -0.58 -1.30 119.26 123.09 2wtf h ALA 193 Ca 0.05 -0.66 -0.07 0.00 0.00 0.00 0.00 54.91 54.23 2wtf h ALA 193 Cb -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2wtf h ALA 193 CO -0.01 0.77 -0.25 0.35 0.00 0.00 0.00 179.25 180.11 2wtf h PHE 194 N 0.30 0.35 -0.51 0.00 3.57 -0.79 -2.74 116.94 117.12 2wtf h PHE 194 Ca -0.06 -0.15 -0.05 0.00 3.53 0.00 0.00 57.97 61.24 2wtf h PHE 194 Cb 1.47 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 40.13 2wtf h PHE 194 CO 0.06 0.88 0.14 0.82 -2.23 0.00 0.00 178.31 177.98 2wtf h ILE 195 N -0.28 1.24 -1.12 1.41 2.04 -1.50 -2.75 117.51 116.55 2wtf h ILE 195 Ca -0.02 -0.82 0.33 0.00 1.00 0.00 0.00 64.86 65.34 2wtf h ILE 195 Cb 0.91 0.81 -0.11 0.00 -0.74 0.00 0.00 36.82 37.69 2wtf h ILE 195 CO 0.05 0.30 0.71 1.23 0.00 0.00 0.00 178.15 180.44 2wtf h GLY 196 N 0.70 1.40 0.00 5.37 0.00 -1.18 -3.46 103.07 105.90 2wtf h GLY 196 Ca 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2wtf h GLY 196 CO -0.00 -0.28 0.00 0.61 0.00 0.00 0.00 176.54 176.87 2wtf n GLY 197 N -1.45 0.25 0.75 4.60 0.00 -1.04 -4.85 105.19 103.45 2wtf n GLY 197 Ca 0.30 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.42 2wtf n GLY 197 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wtf n ASN 198 N -0.49 2.24 -4.85 1.61 5.03 -1.26 -4.86 115.26 112.67 2wtf n ASN 198 Ca 0.00 -1.85 -0.32 0.00 0.87 0.00 0.00 54.58 53.28 2wtf n ASN 198 Cb 0.25 -0.19 -0.06 0.00 -1.02 0.00 0.00 39.78 38.76 2wtf n ASN 198 CO 0.00 0.00 0.00 -0.72 -1.83 0.00 0.00 177.26 174.71 2wtf s TYR 199 N -1.62 3.39 0.24 3.10 -0.85 -1.26 -5.08 117.35 115.26 2wtf s TYR 199 Ca 0.33 1.16 -0.19 0.00 -0.52 0.00 0.00 57.07 57.84 2wtf s TYR 199 Cb 0.18 -2.49 -0.08 0.00 0.38 0.00 0.00 41.96 39.95 2wtf s TYR 199 CO 0.26 0.10 0.73 0.34 -1.52 0.00 0.00 175.55 175.46 2wtf s ASP 200 N -2.36 7.03 0.28 -0.18 2.15 -1.26 -5.00 116.67 117.33 2wtf s ASP 200 Ca 0.53 1.41 0.06 0.00 0.43 0.00 0.00 52.55 54.98 2wtf s ASP 200 Cb -0.10 -2.42 0.41 0.00 -0.30 0.00 0.00 42.92 40.51 2wtf s ASP 200 CO 0.19 -0.00 1.67 0.16 -0.17 0.00 0.00 175.17 177.02 2wtf h ILE 201 N 2.64 1.32 -0.00 4.11 3.07 -1.98 -1.92 117.51 124.76 2wtf h ILE 201 Ca -0.48 -1.61 0.00 0.00 1.55 0.00 0.00 64.86 64.33 2wtf h ILE 201 Cb 1.19 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 39.48 2wtf h ILE 201 CO 0.65 0.48 -0.00 0.59 -1.05 0.00 0.00 178.15 178.82 2wtf n ASN 202 N -4.00 0.12 -4.77 2.16 3.02 -1.26 -1.17 115.26 109.36 2wtf n ASN 202 Ca -0.02 -1.03 -0.41 0.00 -0.03 0.00 0.00 54.58 53.10 2wtf n ASN 202 Cb 0.50 -0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.64 2wtf n ASN 202 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2wtf s SER 203 N -2.00 6.98 0.80 6.41 0.01 -0.72 -4.87 113.70 120.30 2wtf s SER 203 Ca 0.47 2.52 -0.11 0.00 1.31 0.00 0.00 55.95 60.14 2wtf s SER 203 Cb 0.22 -2.64 0.08 0.00 0.21 0.00 0.00 66.02 63.89 2wtf s SER 203 CO 0.37 -0.37 1.11 -1.00 0.41 0.00 0.00 173.24 173.76 2wtf s HIS 204 N -1.15 2.28 0.48 2.43 3.76 -1.26 -1.80 115.29 120.03 2wtf s HIS 204 Ca 0.47 1.63 -0.12 0.00 -0.15 0.00 0.00 55.06 56.88 2wtf s HIS 204 Cb -0.37 -3.16 -0.06 0.00 1.11 0.00 0.00 32.58 30.10 2wtf s HIS 204 CO 0.48 -2.12 0.89 -0.51 -0.85 0.00 0.00 174.74 172.63 2wtf s LEU 205 N -5.99 3.66 0.73 0.89 1.43 0.22 -4.67 118.68 114.95 2wtf s LEU 205 Ca 0.64 1.32 -0.13 0.00 -1.03 0.00 0.00 54.13 54.93 2wtf s LEU 205 Cb -0.20 -4.25 0.04 0.00 0.03 0.00 0.00 46.19 41.81 2wtf s LEU 205 CO 0.55 -0.55 1.11 -2.16 0.23 0.00 0.00 176.35 175.54 2wtf s PRO 206 N -4.18 2.40 0.37 1.29 0.04 -1.26 -0.78 135.00 132.88 2wtf s PRO 206 Ca 0.54 1.34 -0.28 0.00 0.04 0.00 0.00 61.00 62.65 2wtf s PRO 206 Cb -0.10 -1.90 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 2wtf s PRO 206 CO 0.35 -1.56 1.36 -0.51 0.04 0.00 0.00 177.00 176.69 2wtf s LEU 207 N -5.44 4.32 0.45 -3.56 1.43 -1.26 -4.31 118.68 110.32 2wtf s LEU 207 Ca 0.65 2.79 -0.23 0.00 -1.03 0.00 0.00 54.13 56.31 2wtf s LEU 207 Cb -0.20 -3.74 -0.10 0.00 0.03 0.00 0.00 46.19 42.18 2wtf s LEU 207 CO 0.49 -0.75 0.93 2.30 0.23 0.00 0.00 176.35 179.55 2wtf n ILE 208 N 0.46 2.55 -2.74 -0.59 -5.35 -1.26 -4.92 119.36 107.51 2wtf n ILE 208 Ca 0.02 -0.50 -0.41 0.00 -0.27 0.00 0.00 62.75 61.58 2wtf n ILE 208 Cb 0.42 -1.07 -0.04 0.00 -1.74 0.00 0.00 39.64 37.21 2wtf n ILE 208 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2wtf s PRO 209 N -2.08 4.60 0.36 6.28 0.05 -1.26 -4.94 135.00 138.00 2wtf s PRO 209 Ca 0.65 1.39 0.18 0.00 0.05 0.00 0.00 61.00 63.27 2wtf s PRO 209 Cb -0.53 -3.42 1.24 0.00 0.05 0.00 0.00 34.50 31.83 2wtf s PRO 209 CO 0.55 0.07 1.59 1.49 0.05 0.00 0.00 177.00 180.75 2wtf h GLU 210 N 6.28 0.04 0.00 4.56 4.57 -1.92 1.01 114.58 129.12 2wtf h GLU 210 Ca -0.42 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.76 2wtf h GLU 210 Cb 1.21 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2wtf h GLU 210 CO 0.74 0.02 -0.00 0.87 -1.18 0.00 0.00 179.01 179.46 2wtf h LYS 211 N 0.04 0.00 0.00 1.92 1.57 -1.92 -2.35 116.57 115.83 2wtf h LYS 211 Ca 0.80 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.46 2wtf h LYS 211 Cb 2.05 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 34.34 2wtf h LYS 211 CO -0.77 0.00 -0.60 0.97 -0.57 0.00 0.00 179.45 178.48 2wtf h ILE 212 N 0.00 1.28 -0.04 1.86 6.09 0.86 -3.28 117.51 124.29 2wtf h ILE 212 Ca -0.00 -2.18 0.01 0.00 -1.37 0.00 0.00 64.86 61.32 2wtf h ILE 212 Cb 0.01 2.22 -0.00 0.00 0.47 0.00 0.00 36.82 39.53 2wtf h ILE 212 CO 0.00 0.59 0.06 0.11 -3.07 0.00 0.00 178.15 175.84 2wtf h LYS 213 N 0.00 0.00 0.00 2.19 1.57 -1.53 0.12 116.57 118.92 2wtf h LYS 213 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2wtf h LYS 213 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2wtf h LYS 213 CO 0.08 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.83 2wtf n SER 214 N -3.56 0.00 -4.70 0.86 3.41 -1.24 -4.83 113.62 103.56 2wtf n SER 214 Ca -0.02 -1.19 -0.42 0.00 -0.26 0.00 0.00 58.87 56.97 2wtf n SER 214 Cb 0.14 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 2wtf n SER 214 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2wtf s LEU 215 N -1.23 4.34 -0.14 1.04 2.96 0.41 -4.86 118.68 121.20 2wtf s LEU 215 Ca 0.07 1.62 -0.18 0.00 -0.22 0.00 0.00 54.13 55.42 2wtf s LEU 215 Cb 0.03 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 2wtf s LEU 215 CO 0.06 -0.31 0.50 -0.54 -1.32 0.00 0.00 176.35 174.73 2wtf s LYS 216 N 1.29 4.29 0.35 1.98 -0.14 -1.26 -4.95 119.74 121.29 2wtf s LYS 216 Ca 0.51 0.45 -0.29 0.00 -1.36 0.00 0.00 55.97 55.29 2wtf s LYS 216 Cb -0.20 -3.48 -0.11 0.00 -1.68 0.00 0.00 37.83 32.36 2wtf s LYS 216 CO 0.25 0.05 1.44 -0.06 -0.76 0.00 0.00 175.35 176.27 2wtf s PHE 217 N 0.98 2.77 -0.22 3.18 0.40 -1.26 -4.80 117.98 119.02 2wtf s PHE 217 Ca 0.26 1.20 -0.11 0.00 -0.60 0.00 0.00 56.93 57.68 2wtf s PHE 217 Cb -0.15 -3.91 -0.05 0.00 0.51 0.00 0.00 43.02 39.42 2wtf s PHE 217 CO 0.10 -2.67 0.19 -2.00 0.70 0.00 0.00 175.22 171.55 2wtf s GLU 218 N -1.76 4.12 0.07 0.44 2.56 -1.26 -4.99 118.70 117.88 2wtf s GLU 218 Ca 0.53 -0.17 0.00 0.00 0.00 0.00 0.00 54.97 55.32 2wtf s GLU 218 Cb -0.44 -3.51 0.00 0.00 2.00 0.00 0.00 34.13 32.18 2wtf s GLU 218 CO 0.57 0.11 0.00 0.41 -0.56 0.00 0.00 175.26 175.79 2wtf n GLY 219 N 4.02 -1.72 3.58 -1.50 0.00 -1.26 -4.77 105.19 103.54 2wtf n GLY 219 Ca -0.14 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 2wtf n GLY 219 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wtf s ASP 220 N -4.00 6.39 -0.23 1.61 1.11 -0.00 -4.94 116.67 116.61 2wtf s ASP 220 Ca 0.00 0.22 -0.22 0.00 0.18 0.00 0.00 52.55 52.73 2wtf s ASP 220 Cb 0.00 -2.29 -0.02 0.00 1.07 0.00 0.00 42.92 41.68 2wtf s ASP 220 CO 0.00 -0.44 0.70 -0.69 1.18 0.00 0.00 175.17 175.91 2wtf s VAL 221 N 2.45 4.95 -1.07 -1.27 1.01 -1.26 -1.59 120.40 123.61 2wtf s VAL 221 Ca 0.21 1.29 -0.19 0.00 0.00 0.00 0.00 61.98 63.29 2wtf s VAL 221 Cb -0.15 -4.00 0.10 0.00 0.00 0.00 0.00 36.38 32.33 2wtf s VAL 221 CO 0.12 0.02 1.39 0.12 0.00 0.00 0.00 175.10 176.75 2wtf s PHE 222 N 2.43 2.95 -0.51 5.22 5.36 -0.77 -4.88 117.98 127.79 2wtf s PHE 222 Ca 0.30 -1.40 0.04 0.00 -0.96 0.00 0.00 56.93 54.90 2wtf s PHE 222 Cb -0.16 -4.50 0.13 0.00 -0.34 0.00 0.00 43.02 38.16 2wtf s PHE 222 CO 0.09 -1.67 0.27 0.54 -1.46 0.00 0.00 175.22 172.99 2wtf s ASN 223 N 4.00 4.17 0.26 6.13 4.22 -1.26 -4.81 114.94 127.66 2wtf s ASN 223 Ca 0.42 -2.98 -0.04 0.00 -2.14 0.00 0.00 52.86 48.12 2wtf s ASN 223 Cb -0.01 -1.49 0.53 0.00 1.28 0.00 0.00 41.25 41.55 2wtf s ASN 223 CO -0.05 -0.23 1.62 -0.65 -2.04 0.00 0.00 177.10 175.75 2wtf h PRO 224 N 6.48 0.09 0.00 3.55 0.11 -1.96 -1.95 132.00 138.33 2wtf h PRO 224 Ca -0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.06 2wtf h PRO 224 Cb 0.89 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2wtf h PRO 224 CO 0.64 0.06 0.00 0.39 -0.21 0.00 0.00 178.00 178.88 2wtf n GLU 225 N -5.37 0.59 -3.97 1.05 -0.58 -1.26 -4.88 120.64 106.22 2wtf n GLU 225 Ca 0.16 0.00 -0.28 0.00 -0.42 0.00 0.00 57.16 56.63 2wtf n GLU 225 Cb 0.55 -1.16 -0.01 0.00 -0.57 0.00 0.00 31.44 30.26 2wtf n GLU 225 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wtf n GLY 226 N 0.12 -0.33 3.67 0.62 0.00 -0.73 -4.96 105.19 103.59 2wtf n GLY 226 Ca 0.05 0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2wtf n GLY 226 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wtf s ARG 227 N -6.56 1.01 0.33 1.61 0.52 -1.26 -4.97 118.95 109.63 2wtf s ARG 227 Ca 0.28 1.23 -0.28 0.00 -0.52 0.00 0.00 55.73 56.45 2wtf s ARG 227 Cb -0.15 -1.75 -0.09 0.00 0.52 0.00 0.00 34.95 33.48 2wtf s ARG 227 CO 0.87 -2.53 1.15 -0.51 0.02 0.00 0.00 175.30 174.30 2wtf s ASP 228 N -2.93 6.95 0.03 0.23 -0.00 -1.26 -4.97 116.67 114.73 2wtf s ASP 228 Ca 0.65 2.34 -0.30 0.00 -0.00 0.00 0.00 52.55 55.24 2wtf s ASP 228 Cb -0.21 -2.62 -0.17 0.00 -0.00 0.00 0.00 42.92 39.91 2wtf s ASP 228 CO 0.58 -0.37 1.33 -0.07 -0.00 0.00 0.00 175.17 176.64 2wtf h LEU 229 N 3.32 -0.78 -7.86 1.23 3.38 -1.96 -3.39 115.31 109.25 2wtf h LEU 229 Ca -0.48 -0.01 -0.70 0.00 0.09 0.00 0.00 57.88 56.79 2wtf h LEU 229 Cb 1.22 0.20 -0.34 0.00 0.09 0.00 0.00 40.66 41.83 2wtf h LEU 229 CO 0.65 -0.45 -0.55 -0.63 0.09 0.00 0.00 178.44 177.56 2wtf s ILE 230 N -5.23 3.36 -0.03 1.22 1.01 -1.26 -4.87 121.20 115.40 2wtf s ILE 230 Ca -0.16 -1.96 0.10 0.00 0.00 0.00 0.00 60.65 58.63 2wtf s ILE 230 Cb 0.02 -3.26 -0.16 0.00 0.01 0.00 0.00 42.46 39.07 2wtf s ILE 230 CO 0.52 -0.65 0.19 0.35 0.00 0.00 0.00 174.94 175.36 2wtf n THR 231 N 4.63 0.15 -3.99 2.92 -2.24 -1.26 -4.85 114.28 109.65 2wtf n THR 231 Ca -0.04 -0.29 -0.13 0.00 -2.27 0.00 0.00 64.05 61.33 2wtf n THR 231 Cb 0.41 0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.65 2wtf n THR 231 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2wtf n ASP 232 N -1.99 -1.30 0.04 3.42 2.03 -1.26 -4.80 116.55 112.69 2wtf n ASP 232 Ca -0.05 -2.69 -0.03 0.00 0.52 0.00 0.00 54.79 52.54 2wtf n ASP 232 Cb 0.40 2.39 0.21 0.00 -0.72 0.00 0.00 41.12 43.40 2wtf n ASP 232 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 2wtf h TRP 233 N 1.91 0.47 -0.86 -0.67 4.06 -1.98 -2.22 115.95 116.67 2wtf h TRP 233 Ca -0.25 -0.11 0.12 0.00 2.06 0.00 0.00 58.89 60.72 2wtf h TRP 233 Cb 1.08 -0.11 -0.08 0.00 -1.00 0.00 0.00 29.16 29.04 2wtf h TRP 233 CO 0.00 0.68 0.48 0.38 -3.56 0.00 0.00 178.44 176.41 2wtf h ASP 234 N 0.36 0.64 0.29 -3.49 2.03 -1.94 0.19 116.42 114.51 2wtf h ASP 234 Ca 0.05 0.07 -0.09 0.00 -0.73 0.00 0.00 57.03 56.32 2wtf h ASP 234 Cb 0.71 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.15 2wtf h ASP 234 CO 0.05 0.32 -0.39 0.44 -1.03 0.00 0.00 179.24 178.63 2wtf h ASP 235 N 0.74 0.14 -0.26 4.15 3.32 -1.75 0.82 116.42 123.58 2wtf h ASP 235 Ca 0.44 -0.06 -0.14 0.00 0.02 0.00 0.00 57.03 57.30 2wtf h ASP 235 Cb 0.52 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 2wtf h ASP 235 CO -0.30 0.53 -0.38 0.58 -1.72 0.00 0.00 179.24 177.94 2wtf h VAL 236 N 0.12 1.30 -0.42 -1.35 2.07 -0.63 -1.62 116.25 115.72 2wtf h VAL 236 Ca 0.01 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 65.92 2wtf h VAL 236 Cb 0.75 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 2wtf h VAL 236 CO 0.06 0.50 0.12 0.40 0.02 0.00 0.00 177.57 178.66 2wtf h ILE 237 N 0.45 1.23 -0.56 4.57 1.08 -0.36 -1.91 117.51 121.99 2wtf h ILE 237 Ca 0.03 -0.76 -0.10 0.00 -0.39 0.00 0.00 64.86 63.63 2wtf h ILE 237 Cb 0.97 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.63 2wtf h ILE 237 CO 0.09 0.27 -0.05 0.25 -0.69 0.00 0.00 178.15 178.01 2wtf h LEU 238 N 0.54 1.01 -0.56 1.44 5.85 -0.82 0.21 115.31 122.99 2wtf h LEU 238 Ca 0.13 -0.31 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 2wtf h LEU 238 Cb 0.29 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2wtf h LEU 238 CO -0.00 1.09 0.13 0.00 -0.34 0.00 0.00 178.44 179.32 2wtf h ALA 239 N 1.00 0.73 -0.43 1.25 0.00 -1.25 0.70 119.26 121.26 2wtf h ALA 239 Ca 0.16 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2wtf h ALA 239 Cb 0.61 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2wtf h ALA 239 CO 0.04 0.44 0.13 -0.07 0.00 0.00 0.00 179.25 179.79 2wtf h LEU 240 N 0.79 0.63 -0.63 0.00 3.38 -0.76 -2.53 115.31 116.19 2wtf h LEU 240 Ca 0.17 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.06 2wtf h LEU 240 Cb 0.35 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 2wtf h LEU 240 CO 0.00 0.67 0.14 1.23 0.09 0.00 0.00 178.44 180.58 2wtf h GLY 241 N 0.56 0.83 1.29 0.83 0.00 -0.33 -1.74 103.07 104.52 2wtf h GLY 241 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 2wtf h GLY 241 CO -0.00 -0.13 0.41 1.48 0.00 0.00 0.00 176.54 178.30 2wtf h SER 242 N 0.27 0.84 -0.23 0.19 4.64 -0.45 0.40 113.55 119.21 2wtf h SER 242 Ca 0.34 -0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.51 2wtf h SER 242 Cb 0.52 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2wtf h SER 242 CO -0.43 0.65 -0.23 1.56 -0.87 0.00 0.00 176.83 177.51 2wtf h GLN 243 N 0.96 0.56 -0.14 4.77 1.08 -1.15 -0.69 115.11 120.49 2wtf h GLN 243 Ca 0.25 -0.30 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2wtf h GLN 243 Cb -0.03 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 2wtf h GLN 243 CO -0.05 0.89 0.08 0.28 -0.95 0.00 0.00 178.83 179.08 2wtf h VAL 244 N 0.25 1.10 -0.66 -0.54 2.07 -0.85 -2.70 116.25 114.93 2wtf h VAL 244 Ca 0.03 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.35 2wtf h VAL 244 Cb 0.79 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 2wtf h VAL 244 CO 0.06 0.09 0.34 0.00 0.02 0.00 0.00 177.57 178.08 2wtf h LYS 246 N 0.62 0.45 -0.57 0.00 1.63 -0.99 -0.24 116.57 117.48 2wtf h LYS 246 Ca 0.31 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 60.13 2wtf h LYS 246 Cb 0.25 -0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 31.73 2wtf h LYS 246 CO -0.21 0.31 0.28 0.78 -3.45 0.00 0.00 179.45 177.16 2wtf h GLY 247 N 0.46 0.81 1.00 5.01 0.00 -1.19 0.28 103.07 109.44 2wtf h GLY 247 Ca 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2wtf h GLY 247 CO -0.03 0.10 0.34 -2.22 0.00 0.00 0.00 176.54 174.74 2wtf h ILE 248 N 0.54 1.13 -0.25 2.60 2.04 -0.93 -0.79 117.51 121.85 2wtf h ILE 248 Ca 0.26 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 2wtf h ILE 248 Cb 0.19 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2wtf h ILE 248 CO -0.19 0.13 -0.09 0.03 0.00 0.00 0.00 178.15 178.03 2wtf h ARG 249 N 0.70 0.40 -0.02 2.37 3.08 -0.49 -1.84 114.38 118.58 2wtf h ARG 249 Ca 0.19 -0.10 -0.16 0.00 0.07 0.00 0.00 59.98 59.99 2wtf h ARG 249 Cb -0.08 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2wtf h ARG 249 CO -0.04 0.50 -0.70 -0.44 -1.07 0.00 0.00 179.97 178.21 2wtf h ASP 250 N 0.38 0.16 -0.51 7.04 3.32 -0.24 -1.15 116.42 125.42 2wtf h ASP 250 Ca 0.08 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.04 2wtf h ASP 250 Cb 0.39 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2wtf h ASP 250 CO 0.02 0.81 0.32 0.28 -1.72 0.00 0.00 179.24 178.95 2wtf h SER 251 N 0.09 0.52 -0.42 6.45 0.02 -0.37 0.18 113.55 120.03 2wtf h SER 251 Ca -0.02 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 2wtf h SER 251 Cb 1.25 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.66 2wtf h SER 251 CO 0.10 0.37 0.03 0.40 -1.14 0.00 0.00 176.83 176.60 2wtf h ILE 252 N 0.63 1.25 -0.72 3.27 1.08 -1.04 0.25 117.51 122.24 2wtf h ILE 252 Ca 0.20 -0.96 -0.06 0.00 -0.39 0.00 0.00 64.86 63.65 2wtf h ILE 252 Cb -0.01 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 34.76 2wtf h ILE 252 CO -0.07 0.33 0.23 0.50 -0.69 0.00 0.00 178.15 178.45 2wtf h LYS 253 N 0.57 1.11 0.21 2.37 3.64 -1.07 -1.36 116.57 122.03 2wtf h LYS 253 Ca 0.12 -0.23 -0.32 0.00 -1.27 0.00 0.00 60.65 58.95 2wtf h LYS 253 Cb 0.44 -0.17 0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2wtf h LYS 253 CO 0.02 0.94 -1.48 -0.44 -2.27 0.00 0.00 179.45 176.22 2wtf h ASP 254 N 1.07 0.69 0.38 4.20 3.32 -0.28 -0.33 116.42 125.46 2wtf h ASP 254 Ca 0.23 -0.78 -0.27 0.00 0.02 0.00 0.00 57.03 56.23 2wtf h ASP 254 Cb 0.29 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.63 2wtf h ASP 254 CO -0.01 1.62 -1.18 0.40 -1.72 0.00 0.00 179.24 178.36 2wtf h ILE 255 N 0.12 1.39 0.00 0.35 1.08 -1.00 -3.41 117.51 116.05 2wtf h ILE 255 Ca -0.24 -2.68 -0.00 0.00 -0.39 0.00 0.00 64.86 61.54 2wtf h ILE 255 Cb 2.11 2.73 -0.00 0.00 -3.07 0.00 0.00 36.82 38.59 2wtf h ILE 255 CO 0.24 0.80 -1.01 0.18 -0.69 0.00 0.00 178.15 177.66 2wtf n LEU 256 N -3.68 0.00 0.00 1.44 4.77 -0.54 -5.04 117.00 113.95 2wtf n LEU 256 Ca -0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2wtf n LEU 256 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 2wtf n LEU 256 CO 0.55 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2wtf n GLY 257 N 2.49 0.51 3.74 -0.72 0.00 -0.13 -5.00 105.19 106.08 2wtf n GLY 257 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 2wtf n GLY 257 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wtf s TYR 258 N -2.22 3.59 0.41 1.61 4.12 -1.24 -4.88 117.35 118.73 2wtf s TYR 258 Ca 0.00 1.06 -0.11 0.00 0.02 0.00 0.00 57.07 58.04 2wtf s TYR 258 Cb 0.00 -2.60 -0.07 0.00 -1.52 0.00 0.00 41.96 37.78 2wtf s TYR 258 CO 0.00 0.25 0.78 0.95 0.02 0.00 0.00 175.55 177.55 2wtf s THR 259 N 0.27 4.76 0.07 -0.71 -4.23 -1.26 -3.59 115.64 110.96 2wtf s THR 259 Ca 0.29 0.68 -0.01 0.00 -1.18 0.00 0.00 61.69 61.48 2wtf s THR 259 Cb -0.17 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 69.91 2wtf s THR 259 CO 0.14 -0.51 -0.01 0.42 -0.54 0.00 0.00 174.62 174.11 2wtf s THR 260 N -2.37 0.24 0.04 3.99 -4.23 -1.26 -2.21 115.64 109.84 2wtf s THR 260 Ca 0.52 -1.85 0.06 0.00 -1.18 0.00 0.00 61.69 59.24 2wtf s THR 260 Cb -0.10 -1.66 -0.03 0.00 1.34 0.00 0.00 72.50 72.04 2wtf s THR 260 CO 0.31 -0.86 -0.12 -0.44 -0.54 0.00 0.00 174.62 172.97 2wtf s SER 261 N -2.96 4.26 -0.04 3.99 0.01 0.02 -2.62 113.70 116.36 2wtf s SER 261 Ca 0.12 -0.30 -0.02 0.00 1.31 0.00 0.00 55.95 57.05 2wtf s SER 261 Cb 0.08 -0.85 0.02 0.00 0.21 0.00 0.00 66.02 65.48 2wtf s SER 261 CO -0.07 0.25 0.08 0.00 0.41 0.00 0.00 173.24 173.92 2wtf s GLY 263 N 0.61 1.65 -0.15 0.00 0.00 -0.27 0.44 107.32 109.59 2wtf s GLY 263 Ca -0.05 -0.88 -0.00 0.00 0.00 0.00 0.00 44.72 43.79 2wtf s GLY 263 CO -0.02 -0.39 -0.09 1.08 0.00 0.00 0.00 173.10 173.67 2wtf s LEU 264 N -0.19 1.64 0.00 0.66 1.43 0.29 -1.37 118.68 121.13 2wtf s LEU 264 Ca 0.02 -0.56 -0.06 0.00 -1.03 0.00 0.00 54.13 52.49 2wtf s LEU 264 Cb -0.13 -1.02 0.03 0.00 0.03 0.00 0.00 46.19 45.09 2wtf s LEU 264 CO 0.03 -0.13 0.45 -1.54 0.23 0.00 0.00 176.35 175.39 2wtf n SER 265 N 4.83 -1.28 0.00 2.29 3.41 -0.97 -0.31 113.62 121.60 2wtf n SER 265 Ca -0.14 -2.16 0.10 0.00 -0.26 0.00 0.00 58.87 56.41 2wtf n SER 265 Cb 0.49 2.21 0.60 0.00 -0.26 0.00 0.00 64.21 67.25 2wtf n SER 265 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wtf n SER 266 N -1.54 0.00 -3.74 4.04 3.41 -1.25 -0.88 113.62 113.67 2wtf n SER 266 Ca -0.03 -1.33 -0.13 0.00 -0.26 0.00 0.00 58.87 57.11 2wtf n SER 266 Cb 0.40 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.26 2wtf n SER 266 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2wtf s THR 267 N -2.00 0.03 0.06 6.66 2.01 -1.26 -4.57 115.64 116.57 2wtf s THR 267 Ca 0.30 -0.24 -0.23 0.00 0.31 0.00 0.00 61.69 61.83 2wtf s THR 267 Cb 0.14 -0.59 -0.16 0.00 0.01 0.00 0.00 72.50 71.90 2wtf s THR 267 CO 0.23 -0.13 1.60 0.11 -0.69 0.00 0.00 174.62 175.74 2wtf h LYS 268 N 4.56 0.04 -0.66 4.92 1.57 -1.86 -1.04 116.57 124.10 2wtf h LYS 268 Ca -0.28 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.51 2wtf h LYS 268 Cb 1.18 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.44 2wtf h LYS 268 CO 0.34 0.18 0.42 -0.91 -0.57 0.00 0.00 179.45 178.91 2wtf h ASN 269 N -0.11 0.71 0.30 0.86 2.35 -1.96 0.11 115.58 117.83 2wtf h ASN 269 Ca 0.01 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.60 2wtf h ASN 269 Cb 0.15 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 2wtf h ASN 269 CO -0.00 0.50 -0.60 0.58 -1.65 0.00 0.00 177.43 176.26 2wtf h VAL 270 N 0.84 1.37 -0.70 2.81 2.07 -1.90 -2.75 116.25 118.00 2wtf h VAL 270 Ca 0.25 -1.95 -0.01 0.00 0.82 0.00 0.00 66.70 65.81 2wtf h VAL 270 Cb -0.04 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2wtf h VAL 270 CO -0.08 0.58 0.40 0.00 0.02 0.00 0.00 177.57 178.49 2wtf h LYS 272 N 0.96 0.84 -0.27 0.00 1.63 -0.64 -0.38 116.57 118.71 2wtf h LYS 272 Ca 0.25 -0.08 -0.05 0.00 -0.85 0.00 0.00 60.65 59.92 2wtf h LYS 272 Cb 0.01 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 2wtf h LYS 272 CO -0.04 0.61 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.48 2wtf h LEU 273 N 0.83 0.49 -1.07 5.20 3.38 -1.35 -3.20 115.31 119.59 2wtf h LEU 273 Ca 0.22 -0.33 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2wtf h LEU 273 Cb -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2wtf h LEU 273 CO -0.04 0.70 -0.25 0.00 0.09 0.00 0.00 178.44 178.94 2wtf h ALA 274 N 0.81 1.22 -0.46 1.53 0.00 -0.70 -1.34 119.26 120.32 2wtf h ALA 274 Ca 0.08 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2wtf h ALA 274 Cb 0.46 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2wtf h ALA 274 CO 0.02 0.51 0.10 0.66 0.00 0.00 0.00 179.25 180.54 2wtf h SER 275 N 0.32 0.65 0.64 0.00 4.64 -1.11 -1.74 113.55 116.95 2wtf h SER 275 Ca 0.05 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2wtf h SER 275 Cb 0.61 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2wtf h SER 275 CO 0.04 0.65 0.00 -3.20 -0.87 0.00 0.00 176.83 173.45 2wtf n ASN 276 N -4.30 0.00 0.04 4.97 5.15 -0.54 -4.01 115.26 116.58 2wtf n ASN 276 Ca 0.03 0.12 -0.11 0.00 -0.60 0.00 0.00 54.58 54.02 2wtf n ASN 276 Cb 0.21 -0.36 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 2wtf n ASN 276 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2wtf h TYR 277 N 0.00 0.64 -3.39 1.20 3.20 -0.93 -3.42 116.97 114.28 2wtf h TYR 277 Ca 0.00 -0.29 -0.50 0.00 3.14 0.00 0.00 58.73 61.08 2wtf h TYR 277 Cb 0.32 -0.10 -0.34 0.00 1.54 0.00 0.00 36.73 38.15 2wtf h TYR 277 CO 0.00 1.07 -0.80 0.21 -1.64 0.00 0.00 178.16 176.99 2wtf s LYS 278 N -3.60 1.51 -0.02 1.82 2.20 -1.26 -5.14 119.74 115.26 2wtf s LYS 278 Ca -0.06 -0.33 -0.02 0.00 -0.36 0.00 0.00 55.97 55.20 2wtf s LYS 278 Cb 0.10 -1.33 0.01 0.00 -1.51 0.00 0.00 37.83 35.09 2wtf s LYS 278 CO 0.85 -0.04 0.06 0.15 -0.36 0.00 0.00 175.35 176.01 2wtf s LYS 279 N 0.88 0.07 0.58 4.03 1.02 -1.26 -4.41 119.74 120.66 2wtf s LYS 279 Ca -0.11 0.07 0.09 0.00 0.02 0.00 0.00 55.97 56.04 2wtf s LYS 279 Cb -0.15 0.03 0.08 0.00 -0.52 0.00 0.00 37.83 37.28 2wtf s LYS 279 CO 0.01 -0.01 0.71 -1.25 -0.92 0.00 0.00 175.35 173.89 2wtf s PRO 280 N 0.01 2.24 -1.31 -1.68 0.04 -1.26 -5.03 135.00 128.01 2wtf s PRO 280 Ca -0.00 -1.80 -0.04 0.00 0.04 0.00 0.00 61.00 59.19 2wtf s PRO 280 Cb -0.01 -2.48 -0.00 0.00 0.04 0.00 0.00 34.50 32.05 2wtf s PRO 280 CO 0.00 -0.86 0.60 -3.47 0.04 0.00 0.00 177.00 173.31 2wtf n ASP 281 N -2.16 -1.74 -4.04 6.66 2.03 -1.08 -4.97 116.55 111.26 2wtf n ASP 281 Ca 0.11 -0.94 -0.11 0.00 0.52 0.00 0.00 54.79 54.38 2wtf n ASP 281 Cb 0.63 -3.52 -0.11 0.00 -0.72 0.00 0.00 41.12 37.39 2wtf n ASP 281 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wtf s ALA 282 N -3.75 0.40 -0.19 -1.67 0.00 -1.17 -4.98 121.76 110.40 2wtf s ALA 282 Ca 0.11 -0.78 -0.00 0.00 0.00 0.00 0.00 51.96 51.29 2wtf s ALA 282 Cb -0.04 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.21 2wtf s ALA 282 CO 0.85 -0.13 -0.15 -1.14 0.00 0.00 0.00 175.76 175.19 2wtf s GLN 283 N -1.92 3.13 -0.26 0.00 0.74 -1.26 -1.15 119.66 118.94 2wtf s GLN 283 Ca -0.09 -0.76 -0.06 0.00 0.05 0.00 0.00 55.36 54.49 2wtf s GLN 283 Cb -0.07 -2.70 -0.01 0.00 1.10 0.00 0.00 33.01 31.33 2wtf s GLN 283 CO -0.02 -0.17 0.05 0.99 -0.55 0.00 0.00 175.29 175.59 2wtf s THR 284 N 1.27 3.95 -0.22 -0.34 2.01 0.17 -0.82 115.64 121.67 2wtf s THR 284 Ca 0.04 -0.46 -0.13 0.00 0.31 0.00 0.00 61.69 61.44 2wtf s THR 284 Cb -0.14 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2wtf s THR 284 CO -0.08 0.25 0.27 -0.63 -0.69 0.00 0.00 174.62 173.73 2wtf s ILE 285 N 1.54 5.29 -0.29 1.82 1.01 -0.62 -0.55 121.20 129.39 2wtf s ILE 285 Ca 0.05 0.43 0.02 0.00 0.00 0.00 0.00 60.65 61.15 2wtf s ILE 285 Cb -0.16 -3.61 0.07 0.00 0.01 0.00 0.00 42.46 38.78 2wtf s ILE 285 CO 0.02 0.31 -0.04 -0.69 0.00 0.00 0.00 174.94 174.53 2wtf s VAL 286 N 1.10 2.35 0.69 2.92 1.01 0.58 -1.85 120.40 127.20 2wtf s VAL 286 Ca 0.13 -1.80 -0.13 0.00 0.00 0.00 0.00 61.98 60.19 2wtf s VAL 286 Cb -0.14 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.77 2wtf s VAL 286 CO 0.06 -0.21 1.08 -0.54 0.00 0.00 0.00 175.10 175.48 2wtf s LYS 287 N 1.07 2.80 0.21 2.72 1.02 -1.26 -4.39 119.74 121.92 2wtf s LYS 287 Ca -0.03 1.15 -0.09 0.00 0.02 0.00 0.00 55.97 57.03 2wtf s LYS 287 Cb -0.20 -1.97 0.17 0.00 -0.52 0.00 0.00 37.83 35.31 2wtf s LYS 287 CO -0.05 -1.22 1.83 -0.91 -0.92 0.00 0.00 175.35 174.07 2wtf h ASN 288 N -0.44 1.02 -0.50 2.83 -0.26 -1.97 -1.76 115.58 114.50 2wtf h ASN 288 Ca -0.45 -0.11 0.04 0.00 -0.56 0.00 0.00 56.30 55.23 2wtf h ASN 288 Cb 1.22 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 38.20 2wtf h ASN 288 CO 0.55 0.83 0.34 0.44 -1.06 0.00 0.00 177.43 178.53 2wtf h ASP 289 N 1.12 0.44 -0.30 5.81 3.32 -2.00 -1.71 116.42 123.10 2wtf h ASP 289 Ca 0.28 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.33 2wtf h ASP 289 Cb 0.05 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2wtf h ASP 289 CO -0.04 0.30 0.00 0.00 -1.72 0.00 0.00 179.24 177.78 2wtf h LEU 291 N 2.40 0.02 -0.03 0.00 3.38 -0.72 -0.25 115.31 120.12 2wtf h LEU 291 Ca 0.00 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2wtf h LEU 291 Cb 0.54 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2wtf h LEU 291 CO 0.00 0.05 -0.01 -0.07 0.09 0.00 0.00 178.44 178.50 2wtf h LEU 292 N 0.16 0.05 -1.00 1.67 3.38 -1.78 -0.42 115.31 117.37 2wtf h LEU 292 Ca 0.12 -0.38 0.15 0.00 0.09 0.00 0.00 57.88 57.86 2wtf h LEU 292 Cb 0.12 -0.01 -0.16 0.00 0.09 0.00 0.00 40.66 40.70 2wtf h LEU 292 CO -0.15 0.42 -0.41 0.47 0.09 0.00 0.00 178.44 178.86 2wtf n ASP 293 N -4.87 -0.69 0.34 -0.43 8.00 -1.16 -1.01 116.55 116.73 2wtf n ASP 293 Ca -0.08 1.74 -0.17 0.00 0.71 0.00 0.00 54.79 57.00 2wtf n ASP 293 Cb 0.21 -0.38 -0.09 0.00 -0.02 0.00 0.00 41.12 40.85 2wtf n ASP 293 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 2wtf h PHE 294 N 0.00 -0.79 -0.09 1.24 3.57 -0.44 -1.12 116.94 119.31 2wtf h PHE 294 Ca 0.33 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.83 2wtf h PHE 294 Cb 0.58 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.57 2wtf h PHE 294 CO -0.89 -0.46 0.08 -0.07 -2.23 0.00 0.00 178.31 174.73 2wtf h LEU 295 N -0.93 0.00 -1.16 0.59 4.07 -0.90 -2.41 115.31 114.57 2wtf h LEU 295 Ca -0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.87 2wtf h LEU 295 Cb 0.68 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.42 2wtf h LEU 295 CO 0.14 0.00 -0.16 0.47 -1.08 0.00 0.00 178.44 177.81 2wtf n ASP 296 N -4.28 1.97 0.26 -0.43 8.00 -0.18 -4.49 116.55 117.40 2wtf n ASP 296 Ca -0.01 -1.53 0.13 0.00 0.71 0.00 0.00 54.79 54.10 2wtf n ASP 296 Cb 0.19 0.14 0.72 0.00 -0.02 0.00 0.00 41.12 42.15 2wtf n ASP 296 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wtf n GLY 298 N -1.23 0.59 0.06 0.00 0.00 -1.26 -4.95 105.19 98.40 2wtf n GLY 298 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.13 2wtf n GLY 298 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2wtf n LYS 299 N -1.35 0.18 -4.37 1.61 4.81 -1.26 -4.95 118.16 112.84 2wtf n LYS 299 Ca 0.00 0.10 -0.27 0.00 -0.87 0.00 0.00 58.31 57.27 2wtf n LYS 299 Cb 0.00 -1.66 -0.11 0.00 0.02 0.00 0.00 35.03 33.28 2wtf n LYS 299 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 2wtf s PHE 300 N -3.09 2.44 0.12 5.64 0.40 -1.26 -5.04 117.98 117.19 2wtf s PHE 300 Ca 0.10 -0.30 -0.01 0.00 -0.60 0.00 0.00 56.93 56.12 2wtf s PHE 300 Cb 0.15 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.43 2wtf s PHE 300 CO 0.64 0.50 0.03 -1.21 0.70 0.00 0.00 175.22 175.88 2wtf s GLU 301 N -2.72 0.89 0.36 0.44 0.41 -1.26 -4.70 118.70 112.12 2wtf s GLU 301 Ca 0.22 -1.41 0.20 0.00 -0.41 0.00 0.00 54.97 53.58 2wtf s GLU 301 Cb -0.08 0.15 1.31 0.00 -1.78 0.00 0.00 34.13 33.73 2wtf s GLU 301 CO 0.12 -0.21 1.53 1.51 -0.49 0.00 0.00 175.26 177.72 2wtf n ILE 302 N -0.07 -0.41 0.28 -1.63 0.13 -1.26 0.12 119.36 116.52 2wtf n ILE 302 Ca -0.07 1.96 0.17 0.00 -1.10 0.00 0.00 62.75 63.71 2wtf n ILE 302 Cb 0.63 -3.19 0.78 0.00 -0.84 0.00 0.00 39.64 37.01 2wtf n ILE 302 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2wtf h THR 303 N 0.00 0.17 -0.05 9.51 1.03 -1.91 -2.74 112.91 118.92 2wtf h THR 303 Ca 0.82 -0.49 -0.09 0.00 -0.01 0.00 0.00 66.41 66.65 2wtf h THR 303 Cb 2.19 1.41 -0.01 0.00 -1.07 0.00 0.00 68.15 70.66 2wtf h THR 303 CO -0.74 0.05 -0.40 0.28 -0.01 0.00 0.00 175.52 174.69 2wtf h SER 304 N 0.00 0.11 -3.98 0.00 0.02 0.60 -2.95 113.55 107.36 2wtf h SER 304 Ca -0.00 -0.04 -0.52 0.00 -0.84 0.00 0.00 61.79 60.38 2wtf h SER 304 Cb 0.41 -0.03 0.08 0.00 0.14 0.00 0.00 62.40 63.00 2wtf h SER 304 CO 0.01 0.50 0.57 -0.36 -1.14 0.00 0.00 176.83 176.42 2wtf s PHE 305 N -4.14 2.76 0.13 3.45 2.99 -1.03 -4.82 117.98 117.31 2wtf s PHE 305 Ca -0.03 1.44 -0.31 0.00 0.00 0.00 0.00 56.93 58.03 2wtf s PHE 305 Cb 0.14 -3.60 -0.09 0.00 0.00 0.00 0.00 43.02 39.46 2wtf s PHE 305 CO 0.75 -2.03 1.53 -0.46 -0.00 0.00 0.00 175.22 175.00 2wtf s TRP 306 N -1.34 3.00 0.00 0.36 -0.00 -1.26 -1.28 118.94 118.41 2wtf s TRP 306 Ca 0.61 0.67 0.00 0.00 -0.00 0.00 0.00 56.10 57.38 2wtf s TRP 306 Cb -0.36 -3.86 0.00 0.00 -0.00 0.00 0.00 33.47 29.25 2wtf s TRP 306 CO 0.45 -3.19 0.00 0.25 -0.00 0.00 0.00 176.95 174.46 2wtf n THR 307 N 4.11 0.00 0.00 5.86 -2.24 -1.26 -4.84 114.28 115.92 2wtf n THR 307 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2wtf n THR 307 Cb 0.40 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2wtf n THR 307 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2wtf n LEU 308 N 0.00 1.56 -0.40 3.22 4.32 -0.41 -4.58 117.00 120.71 2wtf n LEU 308 Ca 0.00 -1.55 0.14 0.00 -0.02 0.00 0.00 56.01 54.58 2wtf n LEU 308 Cb 0.00 -0.00 0.57 0.00 -1.62 0.00 0.00 43.42 42.36 2wtf n LEU 308 CO 0.00 0.39 0.89 0.61 -1.22 0.00 0.00 177.39 178.06 2wtf n GLY 309 N -0.26 -0.14 0.00 -0.72 0.00 -1.01 -3.76 105.19 99.29 2wtf n GLY 309 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2wtf n GLY 309 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wtf n GLY 310 N 1.13 2.29 0.23 -0.02 0.00 -1.26 -4.95 105.19 102.61 2wtf n GLY 310 Ca 0.19 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2wtf n GLY 310 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2wtf h VAL 311 N 0.00 1.22 -0.79 1.61 -1.51 -1.93 -2.25 116.25 112.60 2wtf h VAL 311 Ca 0.00 -1.02 0.08 0.00 -1.23 0.00 0.00 66.70 64.53 2wtf h VAL 311 Cb 0.00 1.30 -0.05 0.00 -2.13 0.00 0.00 31.29 30.40 2wtf h VAL 311 CO 0.00 0.32 0.52 0.25 -1.23 0.00 0.00 177.57 177.42 2wtf h LEU 312 N 0.29 0.71 -0.68 4.19 5.85 -1.90 -0.88 115.31 122.88 2wtf h LEU 312 Ca 0.05 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 2wtf h LEU 312 Cb 0.51 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2wtf h LEU 312 CO 0.03 0.44 -0.01 1.23 -0.34 0.00 0.00 178.44 179.80 2wtf h GLY 313 N 0.80 1.09 0.94 3.75 0.00 -1.50 -2.27 103.07 105.89 2wtf h GLY 313 Ca 0.35 -0.79 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 2wtf h GLY 313 CO -0.13 0.73 -0.22 0.50 0.00 0.00 0.00 176.54 177.42 2wtf h LYS 314 N 0.92 -0.60 -1.00 4.80 6.56 -1.19 -1.39 116.57 124.68 2wtf h LYS 314 Ca 0.16 0.04 0.23 0.00 -1.06 0.00 0.00 60.65 60.02 2wtf h LYS 314 Cb 0.55 0.14 -0.10 0.00 -0.57 0.00 0.00 32.23 32.25 2wtf h LYS 314 CO 0.03 -0.36 0.63 1.49 -2.06 0.00 0.00 179.45 179.17 2wtf h GLU 315 N -0.69 0.54 -0.29 3.15 4.81 -1.18 0.35 114.58 121.28 2wtf h GLU 315 Ca -0.06 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.01 2wtf h GLU 315 Cb 0.51 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2wtf h GLU 315 CO 0.10 0.36 -0.34 -0.07 -0.73 0.00 0.00 179.01 178.34 2wtf h LEU 316 N 0.56 0.65 0.26 1.64 3.38 -1.12 0.85 115.31 121.53 2wtf h LEU 316 Ca 0.58 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.28 2wtf h LEU 316 Cb 1.19 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2wtf h LEU 316 CO -0.34 0.93 -0.18 0.40 0.09 0.00 0.00 178.44 179.35 2wtf h ILE 317 N 0.52 0.62 0.45 1.22 2.04 0.76 -1.92 117.51 121.20 2wtf h ILE 317 Ca 0.06 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 2wtf h ILE 317 Cb 0.83 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 2wtf h ILE 317 CO 0.07 0.00 -0.22 -0.78 0.00 0.00 0.00 178.15 177.22 2wtf h ASP 318 N -0.43 -0.52 0.40 1.72 3.58 -0.97 0.23 116.42 120.43 2wtf h ASP 318 Ca -0.02 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2wtf h ASP 318 Cb 0.37 0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2wtf h ASP 318 CO 0.01 -0.34 0.00 0.52 -2.88 0.00 0.00 179.24 176.55 2wtf n VAL 319 N -5.34 0.63 -0.60 2.25 0.31 0.29 -1.42 118.33 114.46 2wtf n VAL 319 Ca -0.11 0.16 0.02 0.00 -0.01 0.00 0.00 64.34 64.39 2wtf n VAL 319 Cb 0.27 -0.88 0.02 0.00 -0.91 0.00 0.00 33.84 32.34 2wtf n VAL 319 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2wtf n LEU 320 N -1.36 1.39 -3.86 7.52 4.32 -0.73 -4.96 117.00 119.33 2wtf n LEU 320 Ca 0.07 -1.60 -0.34 0.00 -0.02 0.00 0.00 56.01 54.11 2wtf n LEU 320 Cb 0.15 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 41.90 2wtf n LEU 320 CO 0.14 0.39 -0.14 0.47 -1.22 0.00 0.00 177.39 177.02 2wtf n ASP 321 N -0.49 -3.85 -4.78 -1.43 9.92 -0.18 -4.86 116.55 110.87 2wtf n ASP 321 Ca 0.03 -1.10 -0.37 0.00 -0.53 0.00 0.00 54.79 52.82 2wtf n ASP 321 Cb 0.42 -2.81 -0.06 0.00 -0.64 0.00 0.00 41.12 38.02 2wtf n ASP 321 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2wtf s LEU 322 N -6.86 4.32 0.62 0.64 1.43 0.64 -5.03 118.68 114.43 2wtf s LEU 322 Ca 0.38 1.81 -0.18 0.00 -1.03 0.00 0.00 54.13 55.10 2wtf s LEU 322 Cb -0.16 -4.03 -0.02 0.00 0.03 0.00 0.00 46.19 42.01 2wtf s LEU 322 CO 0.90 -0.08 1.24 -2.84 0.23 0.00 0.00 176.35 175.80 2wtf s PRO 323 N -2.12 2.80 0.32 1.29 0.02 -1.26 -4.92 135.00 131.13 2wtf s PRO 323 Ca 0.51 1.90 0.07 0.00 0.02 0.00 0.00 61.00 63.49 2wtf s PRO 323 Cb -0.18 -1.90 0.55 0.00 0.02 0.00 0.00 34.50 32.99 2wtf s PRO 323 CO 0.23 -1.36 1.77 1.25 -0.33 0.00 0.00 177.00 178.56 2wtf h HIS 324 N 0.72 0.31 -2.74 6.54 2.76 -2.00 -3.40 115.15 117.35 2wtf h HIS 324 Ca -0.50 -0.07 -0.61 0.00 -2.20 0.00 0.00 60.37 56.99 2wtf h HIS 324 Cb 1.31 -0.08 -0.13 0.00 1.55 0.00 0.00 27.41 30.06 2wtf h HIS 324 CO 0.45 0.55 -0.71 -1.21 -1.30 0.00 0.00 177.93 175.71 2wtf s GLU 325 N -4.38 2.08 -1.28 5.26 2.02 -1.26 -4.69 118.70 116.44 2wtf s GLU 325 Ca -0.05 -1.35 -0.08 0.00 0.02 0.00 0.00 54.97 53.51 2wtf s GLU 325 Cb 0.14 -2.12 0.06 0.00 0.10 0.00 0.00 34.13 32.30 2wtf s GLU 325 CO 0.76 0.41 0.45 0.09 0.02 0.00 0.00 175.26 176.99 2wtf n ASN 326 N -0.25 -4.00 0.25 -0.19 3.02 -1.26 -4.86 115.26 107.96 2wtf n ASN 326 Ca -0.09 -0.31 0.11 0.00 -0.03 0.00 0.00 54.58 54.26 2wtf n ASN 326 Cb 0.57 -3.31 0.63 0.00 -0.61 0.00 0.00 39.78 37.06 2wtf n ASN 326 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2wtf h SER 327 N -0.91 0.00 0.62 6.41 4.64 -1.84 -2.22 113.55 120.25 2wtf h SER 327 Ca -0.42 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 2wtf h SER 327 Cb 1.29 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2wtf h SER 327 CO 0.51 0.17 -0.30 0.40 -0.87 0.00 0.00 176.83 176.74 2wtf h ILE 328 N 0.00 0.26 -0.64 0.95 1.08 -1.89 -1.39 117.51 115.88 2wtf h ILE 328 Ca -0.00 -0.28 0.12 0.00 -0.39 0.00 0.00 64.86 64.31 2wtf h ILE 328 Cb 0.46 0.34 -0.09 0.00 -3.07 0.00 0.00 36.82 34.46 2wtf h ILE 328 CO 0.02 0.03 0.16 0.50 -0.69 0.00 0.00 178.15 178.17 2wtf h LYS 329 N -1.05 0.28 -0.23 2.37 3.64 -1.87 -2.44 116.57 117.26 2wtf h LYS 329 Ca -0.09 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.34 2wtf h LYS 329 Cb 0.69 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.37 2wtf h LYS 329 CO 0.14 0.19 -0.30 1.25 -2.27 0.00 0.00 179.45 178.46 2wtf h HIS 330 N 0.29 -0.82 -0.43 1.91 2.76 -1.24 0.38 115.15 118.01 2wtf h HIS 330 Ca 0.34 0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.53 2wtf h HIS 330 Cb 0.51 0.39 -0.02 0.00 1.55 0.00 0.00 27.41 29.85 2wtf h HIS 330 CO -0.24 -0.37 0.18 0.82 -1.30 0.00 0.00 177.93 177.02 2wtf h ILE 331 N -0.32 1.16 -0.17 6.26 2.04 -0.92 0.24 117.51 125.80 2wtf h ILE 331 Ca 0.13 -0.48 -0.19 0.00 1.00 0.00 0.00 64.86 65.32 2wtf h ILE 331 Cb 0.52 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2wtf h ILE 331 CO -0.41 0.19 -0.67 -0.09 0.00 0.00 0.00 178.15 177.17 2wtf h ARG 332 N 0.60 0.66 -0.14 2.37 2.43 -0.81 -3.13 114.38 116.36 2wtf h ARG 332 Ca 0.15 -0.48 -0.12 0.00 -0.81 0.00 0.00 59.98 58.71 2wtf h ARG 332 Cb 0.11 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2wtf h ARG 332 CO -0.02 1.10 -0.40 0.93 -1.51 0.00 0.00 179.97 180.07 2wtf h GLU 333 N 0.48 0.51 -0.66 0.20 4.39 0.62 -3.12 114.58 117.00 2wtf h GLU 333 Ca -0.02 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.31 2wtf h GLU 333 Cb 1.26 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.94 2wtf h GLU 333 CO 0.13 0.99 0.39 1.15 -1.16 0.00 0.00 179.01 180.50 2wtf h THR 334 N 0.12 1.19 -2.13 1.13 2.02 -0.66 -3.34 112.91 111.24 2wtf h THR 334 Ca -0.01 -0.43 -0.56 0.00 0.77 0.00 0.00 66.41 66.18 2wtf h THR 334 Cb 1.02 0.27 -0.41 0.00 -1.74 0.00 0.00 68.15 67.30 2wtf h THR 334 CO 0.09 0.20 -0.87 0.79 0.37 0.00 0.00 175.52 176.10 2wtf n TRP 335 N -4.40 2.09 0.60 3.16 8.01 -1.18 -4.96 117.44 120.76 2wtf n TRP 335 Ca 0.07 -3.90 0.11 0.00 -1.31 0.00 0.00 57.50 52.46 2wtf n TRP 335 Cb 0.08 -0.46 0.45 0.00 -2.01 0.00 0.00 31.31 29.36 2wtf n TRP 335 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.69 174.38 2wtf n PRO 336 N 0.45 0.11 -0.08 -0.99 -0.02 -1.18 -3.87 135.00 129.42 2wtf n PRO 336 Ca 0.27 0.24 -0.13 0.00 -2.02 0.00 0.00 63.50 61.86 2wtf n PRO 336 Cb 0.49 -1.67 -0.09 0.00 -0.02 0.00 0.00 33.50 32.22 2wtf n PRO 336 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2wtf h ASP 337 N 0.00 0.00 -4.68 2.55 3.04 -1.93 -3.51 116.42 111.90 2wtf h ASP 337 Ca 0.00 -0.50 0.16 0.00 -3.24 0.00 0.00 57.03 53.44 2wtf h ASP 337 Cb 0.43 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 38.57 2wtf h ASP 337 CO 0.00 1.07 0.57 0.54 -2.04 0.00 0.00 179.24 179.38 2wtf s ASN 338 N -6.28 -0.28 0.28 4.15 4.22 -1.25 -5.02 114.94 110.76 2wtf s ASN 338 Ca -0.19 -0.05 0.01 0.00 -2.14 0.00 0.00 52.86 50.49 2wtf s ASN 338 Cb 0.02 0.33 0.66 0.00 1.28 0.00 0.00 41.25 43.54 2wtf s ASN 338 CO 0.47 -0.55 1.66 0.00 -2.04 0.00 0.00 177.10 176.64 2wtf h ALA 339 N 2.00 1.24 -0.59 3.54 0.00 -1.87 -2.80 119.26 120.77 2wtf h ALA 339 Ca -0.20 0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2wtf h ALA 339 Cb 1.22 0.27 -0.11 0.00 0.00 0.00 0.00 17.79 19.17 2wtf h ALA 339 CO 0.28 -0.42 -0.16 0.78 0.00 0.00 0.00 179.25 179.73 2wtf h GLY 340 N 0.25 0.39 0.78 0.00 0.00 -1.95 0.33 103.07 102.87 2wtf h GLY 340 Ca 0.53 0.21 0.04 0.00 0.00 0.00 0.00 47.33 48.11 2wtf h GLY 340 CO -0.61 -0.23 0.34 -1.61 0.00 0.00 0.00 176.54 174.43 2wtf h GLN 341 N -0.02 0.63 -0.01 4.80 5.75 -1.88 -0.54 115.11 123.84 2wtf h GLN 341 Ca 0.28 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.64 2wtf h GLN 341 Cb 0.45 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.84 2wtf h GLN 341 CO -0.62 0.42 -0.50 1.25 -2.65 0.00 0.00 178.83 176.72 2wtf h LEU 342 N 0.65 0.04 -0.40 -2.39 6.46 -1.42 -2.48 115.31 115.77 2wtf h LEU 342 Ca 0.25 -0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2wtf h LEU 342 Cb 0.10 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 2wtf h LEU 342 CO -0.14 0.54 0.16 0.50 -0.62 0.00 0.00 178.44 178.88 2wtf h LYS 343 N 0.03 0.60 -0.81 1.25 1.63 0.09 -1.48 116.57 117.89 2wtf h LYS 343 Ca -0.00 -0.11 -0.03 0.00 -0.85 0.00 0.00 60.65 59.66 2wtf h LYS 343 Cb 0.90 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.40 2wtf h LYS 343 CO 0.07 0.57 0.40 0.93 -3.45 0.00 0.00 179.45 177.97 2wtf h GLU 344 N 0.50 1.15 -0.72 1.90 4.39 -1.05 -1.11 114.58 119.64 2wtf h GLU 344 Ca 0.13 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 2wtf h GLU 344 Cb 0.20 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2wtf h GLU 344 CO -0.01 0.88 0.36 0.35 -1.16 0.00 0.00 179.01 179.43 2wtf h PHE 345 N 1.14 1.03 -0.59 4.33 3.57 -1.18 -0.66 116.94 124.58 2wtf h PHE 345 Ca 0.28 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 2wtf h PHE 345 Cb 0.09 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2wtf h PHE 345 CO 0.01 0.75 0.28 -0.07 -2.23 0.00 0.00 178.31 177.05 2wtf h LEU 346 N 1.01 0.78 -0.58 0.59 3.38 -0.45 -0.26 115.31 119.78 2wtf h LEU 346 Ca 0.25 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2wtf h LEU 346 Cb 0.10 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2wtf h LEU 346 CO -0.03 0.70 0.34 0.44 0.09 0.00 0.00 178.44 179.97 2wtf h ASP 347 N 0.81 0.71 -0.70 -0.43 3.32 -0.64 -0.80 116.42 118.69 2wtf h ASP 347 Ca 0.20 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 2wtf h ASP 347 Cb 0.13 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 2wtf h ASP 347 CO -0.02 0.57 0.30 0.00 -1.72 0.00 0.00 179.24 178.37 2wtf h ALA 348 N 1.16 0.91 -0.40 3.45 0.00 -0.69 -2.64 119.26 121.05 2wtf h ALA 348 Ca 0.21 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2wtf h ALA 348 Cb 0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2wtf h ALA 348 CO -0.04 0.51 0.03 1.57 0.00 0.00 0.00 179.25 181.32 2wtf h LYS 349 N 0.99 0.63 -0.65 0.00 5.09 -0.59 -3.24 116.57 118.80 2wtf h LYS 349 Ca 0.24 -0.14 -0.01 0.00 0.09 0.00 0.00 60.65 60.83 2wtf h LYS 349 Cb 0.18 -0.09 -0.03 0.00 0.10 0.00 0.00 32.23 32.39 2wtf h LYS 349 CO -0.02 0.63 0.38 -0.39 -2.09 0.00 0.00 179.45 177.96 2wtf h VAL 350 N 0.60 1.19 0.00 0.07 -1.51 -0.77 -3.36 116.25 112.47 2wtf h VAL 350 Ca 0.13 -0.43 -0.01 0.00 -1.23 0.00 0.00 66.70 65.16 2wtf h VAL 350 Cb 0.34 0.28 -0.00 0.00 -2.13 0.00 0.00 31.29 29.78 2wtf h VAL 350 CO 0.01 0.20 -0.06 0.11 -1.23 0.00 0.00 177.57 176.60 2wtf h LYS 351 N 0.90 0.01 -6.46 5.19 1.57 -1.60 -3.45 116.57 112.72 2wtf h LYS 351 Ca 0.23 -0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 58.39 2wtf h LYS 351 Cb -0.02 0.01 0.09 0.00 0.08 0.00 0.00 32.23 32.39 2wtf h LYS 351 CO -0.04 1.01 0.31 0.94 -0.57 0.00 0.00 179.45 181.09 2wtf n GLN 352 N -4.59 1.48 -0.90 3.15 7.27 -1.26 -4.78 117.38 117.75 2wtf n GLN 352 Ca -0.11 0.52 -0.28 0.00 0.07 0.00 0.00 57.00 57.21 2wtf n GLN 352 Cb 0.50 -2.02 -0.02 0.00 2.41 0.00 0.00 30.24 31.11 2wtf n GLN 352 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 2wtf n SER 353 N 1.69 5.07 -0.16 1.69 3.41 -1.26 -4.22 113.62 119.83 2wtf n SER 353 Ca 0.12 -2.42 0.13 0.00 -0.26 0.00 0.00 58.87 56.44 2wtf n SER 353 Cb 0.29 -1.18 0.47 0.00 -0.26 0.00 0.00 64.21 63.53 2wtf n SER 353 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2wtf n ASP 354 N 4.63 0.70 -3.59 4.04 5.68 -1.26 -4.95 116.55 121.81 2wtf n ASP 354 Ca 0.50 -0.63 -0.04 0.00 -0.50 0.00 0.00 54.79 54.11 2wtf n ASP 354 Cb 0.19 0.04 -0.02 0.00 -1.14 0.00 0.00 41.12 40.19 2wtf n ASP 354 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2wtf s TYR 355 N -2.57 -0.16 -0.00 2.11 5.04 -1.26 -5.10 117.35 115.41 2wtf s TYR 355 Ca 0.24 0.08 0.04 0.00 -2.44 0.00 0.00 57.07 54.99 2wtf s TYR 355 Cb 0.19 0.53 -0.03 0.00 0.35 0.00 0.00 41.96 43.00 2wtf s TYR 355 CO 0.52 -0.31 -0.11 -0.51 -1.34 0.00 0.00 175.55 173.81 2wtf s ASP 356 N -2.37 4.33 0.00 4.32 1.01 -1.26 -5.01 116.67 117.68 2wtf s ASP 356 Ca 0.09 -0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.14 2wtf s ASP 356 Cb -0.00 -0.93 0.00 0.00 1.01 0.00 0.00 42.92 42.99 2wtf s ASP 356 CO -0.05 0.29 0.41 0.54 0.21 0.00 0.00 175.17 176.57 2wtf n ARG 357 N 1.74 0.48 0.01 8.23 1.74 -1.26 -2.72 116.66 124.88 2wtf n ARG 357 Ca -0.16 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.70 2wtf n ARG 357 Cb 0.52 -1.07 -0.14 0.00 -1.02 0.00 0.00 32.46 30.75 2wtf n ARG 357 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2wtf h SER 358 N 0.16 0.40 -0.37 0.55 0.87 -2.02 -3.38 113.55 109.76 2wtf h SER 358 Ca 0.00 -0.86 0.00 0.00 -1.23 0.00 0.00 61.79 59.70 2wtf h SER 358 Cb 0.07 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2wtf h SER 358 CO 0.00 1.64 0.00 0.35 -0.53 0.00 0.00 176.83 178.29 2wtf n THR 359 N -3.88 2.38 -3.88 2.23 -2.24 -1.10 -5.01 114.28 102.78 2wtf n THR 359 Ca -0.25 -1.69 -0.37 0.00 -2.27 0.00 0.00 64.05 59.46 2wtf n THR 359 Cb 0.92 -0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 68.86 2wtf n THR 359 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2wtf s SER 360 N -1.54 6.39 0.00 3.42 0.15 -1.22 -4.98 113.70 115.92 2wtf s SER 360 Ca 0.46 0.47 0.19 0.00 0.70 0.00 0.00 55.95 57.77 2wtf s SER 360 Cb 0.36 -2.07 0.35 0.00 -1.71 0.00 0.00 66.02 62.94 2wtf s SER 360 CO 0.12 0.41 1.28 0.59 1.20 0.00 0.00 173.24 176.83 2wtf n ASN 361 N 1.96 3.11 -4.62 5.45 4.13 -1.26 -4.94 115.26 119.10 2wtf n ASN 361 Ca -0.20 -1.90 -0.38 0.00 1.68 0.00 0.00 54.58 53.78 2wtf n ASN 361 Cb 0.55 -0.21 -0.10 0.00 -1.54 0.00 0.00 39.78 38.48 2wtf n ASN 361 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2wtf s ILE 362 N -1.28 5.28 -0.35 2.41 1.01 -1.26 -5.03 121.20 121.98 2wtf s ILE 362 Ca 0.31 0.32 -0.24 0.00 0.00 0.00 0.00 60.65 61.04 2wtf s ILE 362 Cb 0.18 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 39.08 2wtf s ILE 362 CO 0.25 0.26 0.83 -0.62 0.00 0.00 0.00 174.94 175.66 2wtf s ASP 363 N 1.45 6.62 0.12 3.58 2.15 -1.26 -4.98 116.67 124.36 2wtf s ASP 363 Ca 0.10 0.51 -0.18 0.00 0.43 0.00 0.00 52.55 53.41 2wtf s ASP 363 Cb -0.15 -2.42 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 2wtf s ASP 363 CO 0.09 -0.74 1.70 -0.65 -0.17 0.00 0.00 175.17 175.40 2wtf h PRO 364 N 8.38 0.40 -0.28 4.34 0.11 -1.99 -3.06 132.00 139.90 2wtf h PRO 364 Ca -0.24 -0.06 0.07 0.00 0.11 0.00 0.00 66.00 65.88 2wtf h PRO 364 Cb 1.09 -0.08 -0.08 0.00 0.11 0.00 0.00 31.00 32.05 2wtf h PRO 364 CO 0.93 0.38 -0.30 -0.07 -0.21 0.00 0.00 178.00 178.72 2wtf h LEU 365 N 0.33 -0.97 -3.64 2.35 3.38 -2.06 -2.80 115.31 111.90 2wtf h LEU 365 Ca 0.10 0.16 -0.44 0.00 0.09 0.00 0.00 57.88 57.79 2wtf h LEU 365 Cb 0.10 0.44 -0.19 0.00 0.09 0.00 0.00 40.66 41.10 2wtf h LEU 365 CO -0.01 -0.32 0.57 0.29 0.09 0.00 0.00 178.44 179.06 2wtf n LYS 366 N -5.40 2.10 0.22 1.13 5.02 -1.19 -4.54 118.16 115.50 2wtf n LYS 366 Ca -0.01 -2.15 0.08 0.00 -2.02 0.00 0.00 58.31 54.21 2wtf n LYS 366 Cb 0.32 -1.84 0.50 0.00 -0.02 0.00 0.00 35.03 33.99 2wtf n LYS 366 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wtf h THR 367 N 0.99 0.78 0.37 -0.18 1.03 -1.39 -3.02 112.91 111.48 2wtf h THR 367 Ca 0.40 -1.04 -0.02 0.00 -0.01 0.00 0.00 66.41 65.74 2wtf h THR 367 Cb 0.93 1.64 0.00 0.00 -1.07 0.00 0.00 68.15 69.66 2wtf h THR 367 CO 1.04 0.25 -0.18 0.00 -0.01 0.00 0.00 175.52 176.62 2wtf h ALA 368 N 1.75 -0.49 -0.70 0.00 0.00 -1.86 -2.58 119.26 115.37 2wtf h ALA 368 Ca -0.00 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.88 2wtf h ALA 368 Cb 0.62 0.19 -0.13 0.00 0.00 0.00 0.00 17.79 18.47 2wtf h ALA 368 CO 0.03 -0.68 -0.19 -0.44 0.00 0.00 0.00 179.25 177.97 2wtf h ASP 369 N -0.70 -0.71 -0.74 0.00 3.32 -1.91 0.43 116.42 116.12 2wtf h ASP 369 Ca -0.05 0.21 0.06 0.00 0.02 0.00 0.00 57.03 57.28 2wtf h ASP 369 Cb 0.49 0.46 -0.06 0.00 0.22 0.00 0.00 39.33 40.44 2wtf h ASP 369 CO 0.08 -0.24 0.43 0.25 -1.72 0.00 0.00 179.24 178.04 2wtf h LEU 370 N -0.02 0.65 -0.36 1.55 5.85 -1.53 -0.22 115.31 121.23 2wtf h LEU 370 Ca 0.33 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.97 2wtf h LEU 370 Cb 0.52 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2wtf h LEU 370 CO -0.73 0.42 -0.18 0.00 -0.34 0.00 0.00 178.44 177.61 2wtf h ALA 371 N 1.37 0.51 0.04 1.25 0.00 0.10 -1.12 119.26 121.41 2wtf h ALA 371 Ca 0.33 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2wtf h ALA 371 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2wtf h ALA 371 CO -0.18 0.45 -0.08 1.49 0.00 0.00 0.00 179.25 180.93 2wtf h GLU 372 N 0.55 -0.15 -0.12 0.00 4.22 -0.40 -1.38 114.58 117.31 2wtf h GLU 372 Ca 0.08 0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.58 2wtf h GLU 372 Cb 0.72 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.95 2wtf h GLU 372 CO 0.05 -0.10 -0.33 -0.22 -2.18 0.00 0.00 179.01 176.23 2wtf h LYS 373 N -0.15 -0.40 -0.37 1.92 3.64 -0.83 0.18 116.57 120.55 2wtf h LYS 373 Ca 0.02 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2wtf h LYS 373 Cb 0.17 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2wtf h LYS 373 CO -0.05 -0.27 0.01 -0.07 -2.27 0.00 0.00 179.45 176.80 2wtf h LEU 374 N -0.42 0.64 -0.31 5.20 3.38 -1.20 0.42 115.31 123.02 2wtf h LEU 374 Ca 0.09 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.80 2wtf h LEU 374 Cb 0.56 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2wtf h LEU 374 CO -0.35 0.78 0.08 0.15 0.09 0.00 0.00 178.44 179.19 2wtf h PHE 375 N 0.47 0.14 0.08 1.13 3.57 -0.98 0.11 116.94 121.46 2wtf h PHE 375 Ca 0.11 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 2wtf h PHE 375 Cb 0.45 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2wtf h PHE 375 CO 0.04 0.05 -0.04 0.87 -2.23 0.00 0.00 178.31 176.99 2wtf h LYS 376 N 0.20 -0.11 -0.98 1.11 1.79 -0.50 -3.14 116.57 114.94 2wtf h LYS 376 Ca 0.14 0.01 0.13 0.00 -2.18 0.00 0.00 60.65 58.74 2wtf h LYS 376 Cb 0.14 0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 30.73 2wtf h LYS 376 CO -0.17 0.09 0.62 -0.07 -1.08 0.00 0.00 179.45 178.84 2wtf h LEU 377 N -0.29 0.88 -1.49 2.94 3.38 0.06 0.85 115.31 121.64 2wtf h LEU 377 Ca -0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2wtf h LEU 377 Cb 0.25 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2wtf h LEU 377 CO 0.02 0.46 -0.10 0.77 0.09 0.00 0.00 178.44 179.68 2wtf h SER 378 N 0.94 0.00 -0.02 -0.43 4.64 -0.93 -2.09 113.55 115.66 2wtf h SER 378 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2wtf h SER 378 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2wtf h SER 378 CO -0.26 0.10 -0.35 0.54 -0.87 0.00 0.00 176.83 176.00 2wtf n ARG 379 N -3.29 1.51 -2.95 4.77 1.74 -0.81 -4.84 116.66 112.79 2wtf n ARG 379 Ca -0.00 -1.02 -0.10 0.00 -0.77 0.00 0.00 57.85 55.96 2wtf n ARG 379 Cb 0.33 -1.38 0.04 0.00 -1.02 0.00 0.00 32.46 30.43 2wtf n ARG 379 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wtf n GLY 380 N 1.26 0.29 0.09 -0.13 0.00 -0.52 -4.70 105.19 101.48 2wtf n GLY 380 Ca 0.08 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.87 2wtf n GLY 380 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wtf n ARG 381 N -2.45 1.58 -2.75 1.61 1.74 0.18 -4.86 116.66 111.71 2wtf n ARG 381 Ca -0.01 -1.64 -0.42 0.00 -0.77 0.00 0.00 57.85 55.01 2wtf n ARG 381 Cb 0.53 -1.03 -0.03 0.00 -1.02 0.00 0.00 32.46 30.91 2wtf n ARG 381 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2wtf s TYR 382 N -1.34 2.55 -0.41 -1.55 5.04 -1.19 -4.87 117.35 115.57 2wtf s TYR 382 Ca 0.11 -0.42 -0.16 0.00 -2.44 0.00 0.00 57.07 54.15 2wtf s TYR 382 Cb 0.09 -4.41 0.02 0.00 0.35 0.00 0.00 41.96 38.01 2wtf s TYR 382 CO 0.01 -1.79 0.39 0.20 -1.34 0.00 0.00 175.55 173.02 2wtf s GLY 383 N 3.73 1.93 0.21 8.97 0.00 -1.26 -4.58 107.32 116.32 2wtf s GLY 383 Ca 0.27 -1.56 -0.12 0.00 0.00 0.00 0.00 44.72 43.31 2wtf s GLY 383 CO 0.11 1.08 0.57 1.08 0.00 0.00 0.00 173.10 175.94 2wtf s LEU 384 N 1.99 4.23 0.64 0.66 1.43 -1.26 -4.90 118.68 121.47 2wtf s LEU 384 Ca 0.10 1.03 -0.14 0.00 -1.03 0.00 0.00 54.13 54.09 2wtf s LEU 384 Cb -0.18 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 2wtf s LEU 384 CO 0.12 -0.01 1.06 -2.16 0.23 0.00 0.00 176.35 175.59 2wtf s PRO 385 N -2.47 3.11 0.16 1.29 0.04 -1.26 -4.77 135.00 131.11 2wtf s PRO 385 Ca 0.44 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 2wtf s PRO 385 Cb -0.13 -2.01 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 2wtf s PRO 385 CO 0.20 -0.97 1.13 -0.51 0.04 0.00 0.00 177.00 176.89 2wtf s LEU 386 N -4.91 4.47 0.17 -3.56 1.02 -1.26 -5.05 118.68 109.55 2wtf s LEU 386 Ca 0.62 2.11 0.04 0.00 0.02 0.00 0.00 54.13 56.92 2wtf s LEU 386 Cb -0.16 -3.60 -0.05 0.00 0.02 0.00 0.00 46.19 42.40 2wtf s LEU 386 CO 0.43 -0.28 -0.07 -0.94 0.02 0.00 0.00 176.35 175.52 2wtf s SER 387 N 0.08 1.72 0.73 2.29 1.04 -1.26 -5.01 113.70 113.29 2wtf s SER 387 Ca 0.51 -1.08 -0.07 0.00 0.48 0.00 0.00 55.95 55.79 2wtf s SER 387 Cb -0.30 0.01 0.07 0.00 0.10 0.00 0.00 66.02 65.90 2wtf s SER 387 CO 0.35 -0.40 1.04 -0.55 0.98 0.00 0.00 173.24 174.66 2wtf s SER 388 N -3.20 4.70 0.33 7.02 0.15 -1.26 -4.64 113.70 116.79 2wtf s SER 388 Ca 0.20 0.45 -0.18 0.00 0.70 0.00 0.00 55.95 57.12 2wtf s SER 388 Cb 0.04 -1.05 -0.09 0.00 -1.71 0.00 0.00 66.02 63.20 2wtf s SER 388 CO 0.03 -1.68 0.80 -0.60 1.20 0.00 0.00 173.24 172.98 2wtf s ARG 389 N -5.30 4.15 0.45 5.44 3.52 -1.26 -5.00 118.95 120.94 2wtf s ARG 389 Ca 0.61 0.86 -0.25 0.00 -0.13 0.00 0.00 55.73 56.82 2wtf s ARG 389 Cb -0.10 -2.50 -0.08 0.00 -1.56 0.00 0.00 34.95 30.70 2wtf s ARG 389 CO 0.45 0.18 1.43 -2.14 -0.81 0.00 0.00 175.30 174.41 2wtf s PRO 390 N -2.74 3.70 0.62 5.12 0.02 -1.26 -4.92 135.00 135.55 2wtf s PRO 390 Ca 0.53 2.42 -0.18 0.00 0.02 0.00 0.00 61.00 63.80 2wtf s PRO 390 Cb -0.12 -2.67 -0.06 0.00 0.02 0.00 0.00 34.50 31.68 2wtf s PRO 390 CO 0.18 -0.81 0.72 1.55 -0.33 0.00 0.00 177.00 178.31 2wtf n VAL 391 N -0.17 2.82 -2.63 3.83 3.14 -1.26 -4.87 118.33 119.19 2wtf n VAL 391 Ca 0.05 -0.47 -0.42 0.00 -2.96 0.00 0.00 64.34 60.53 2wtf n VAL 391 Cb 0.42 -0.90 -0.03 0.00 -1.06 0.00 0.00 33.84 32.27 2wtf n VAL 391 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2wtf s VAL 392 N -1.68 4.64 -0.07 1.55 0.11 -1.26 -4.94 120.40 118.74 2wtf s VAL 392 Ca 0.72 1.90 -0.13 0.00 -2.93 0.00 0.00 61.98 61.54 2wtf s VAL 392 Cb -0.41 -4.22 -0.29 0.00 -1.53 0.00 0.00 36.38 29.93 2wtf s VAL 392 CO 0.51 0.10 0.60 0.11 -3.33 0.00 0.00 175.10 173.10 2wtf h LYS 393 N 6.94 0.33 -2.81 1.54 1.79 -1.96 -3.45 116.57 118.96 2wtf h LYS 393 Ca -0.38 -0.57 -0.07 0.00 -2.18 0.00 0.00 60.65 57.46 2wtf h LYS 393 Cb 1.20 0.21 -0.16 0.00 -1.58 0.00 0.00 32.23 31.89 2wtf h LYS 393 CO 0.80 1.27 -0.00 -1.54 -1.08 0.00 0.00 179.45 178.90 2wtf s SER 394 N -7.18 -0.40 -0.06 0.86 1.04 -1.26 -4.00 113.70 102.69 2wtf s SER 394 Ca -0.18 0.15 0.03 0.00 0.48 0.00 0.00 55.95 56.42 2wtf s SER 394 Cb 0.05 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.65 2wtf s SER 394 CO 0.82 -0.69 -0.13 -0.04 0.98 0.00 0.00 173.24 174.18 2wtf s MET 395 N -2.37 1.65 -0.04 4.02 -1.94 -0.22 -4.97 119.30 115.42 2wtf s MET 395 Ca -0.06 -0.43 0.06 0.00 -1.71 0.00 0.00 55.69 53.55 2wtf s MET 395 Cb -0.01 -1.38 -0.01 0.00 2.01 0.00 0.00 34.83 35.44 2wtf s MET 395 CO -0.01 0.06 -0.21 1.41 -0.01 0.00 0.00 175.02 176.26 2wtf s MET 396 N 0.55 2.01 -0.22 2.03 0.00 -1.26 0.23 119.30 122.65 2wtf s MET 396 Ca -0.12 -0.75 0.02 0.00 0.00 0.00 0.00 55.69 54.83 2wtf s MET 396 Cb -0.15 -1.79 0.04 0.00 0.00 0.00 0.00 34.83 32.94 2wtf s MET 396 CO 0.03 0.36 -0.15 0.45 0.00 0.00 0.00 175.02 175.71 2wtf s SER 397 N -0.20 3.70 0.20 1.11 0.15 0.04 -4.99 113.70 113.72 2wtf s SER 397 Ca 0.00 -0.99 0.11 0.00 0.70 0.00 0.00 55.95 55.77 2wtf s SER 397 Cb -0.11 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.69 2wtf s SER 397 CO 0.02 -0.10 -0.23 0.21 1.20 0.00 0.00 173.24 174.34 2wtf s ASN 398 N 1.23 3.33 -0.11 5.45 2.47 -1.26 -1.73 114.94 124.31 2wtf s ASN 398 Ca -0.02 -0.88 -0.03 0.00 0.42 0.00 0.00 52.86 52.35 2wtf s ASN 398 Cb -0.16 -0.24 0.04 0.00 -1.45 0.00 0.00 41.25 39.44 2wtf s ASN 398 CO -0.09 0.09 0.04 -0.75 -3.72 0.00 0.00 177.10 172.67 2wtf s LYS 399 N -2.78 0.35 -0.31 0.43 2.47 -0.62 -5.01 119.74 114.28 2wtf s LYS 399 Ca 0.21 0.00 -0.29 0.00 -1.56 0.00 0.00 55.97 54.33 2wtf s LYS 399 Cb -0.07 -1.32 0.00 0.00 -1.46 0.00 0.00 37.83 34.98 2wtf s LYS 399 CO 0.10 -0.47 1.26 -0.80 0.16 0.00 0.00 175.35 175.60 2wtf s ASN 400 N 2.02 6.72 -0.08 1.43 0.02 -1.26 -2.49 114.94 121.30 2wtf s ASN 400 Ca 0.03 1.16 -0.16 0.00 -1.02 0.00 0.00 52.86 52.87 2wtf s ASN 400 Cb -0.14 -2.54 -0.05 0.00 0.02 0.00 0.00 41.25 38.54 2wtf s ASN 400 CO -0.06 -1.05 0.42 -0.76 0.02 0.00 0.00 177.10 175.67 2wtf s LEU 401 N 4.24 4.35 0.18 0.60 1.43 0.43 -4.97 118.68 124.94 2wtf s LEU 401 Ca 0.54 0.82 0.10 0.00 -1.03 0.00 0.00 54.13 54.56 2wtf s LEU 401 Cb -0.16 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.42 2wtf s LEU 401 CO 0.22 0.14 -0.21 -0.13 0.23 0.00 0.00 176.35 176.60 2wtf s ARG 402 N -0.04 1.39 2.09 1.70 3.00 -1.26 -4.48 118.95 121.35 2wtf s ARG 402 Ca 0.23 -1.47 0.00 0.00 0.00 0.00 0.00 55.73 54.49 2wtf s ARG 402 Cb -0.15 -1.56 0.00 0.00 0.00 0.00 0.00 34.95 33.24 2wtf s ARG 402 CO 0.10 0.33 0.00 0.41 0.00 0.00 0.00 175.30 176.14 2wtf n GLY 403 N 0.24 -1.11 1.42 -3.53 0.00 -1.26 -4.04 105.19 96.92 2wtf n GLY 403 Ca -0.13 -1.23 0.08 0.00 0.00 0.00 0.00 46.02 44.74 2wtf n GLY 403 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wtf n LYS 404 N -0.04 3.97 -0.06 1.61 5.02 -1.26 -4.68 118.16 122.71 2wtf n LYS 404 Ca 0.00 -3.01 -0.08 0.00 -2.02 0.00 0.00 58.31 53.20 2wtf n LYS 404 Cb 0.00 -2.07 -0.01 0.00 -0.02 0.00 0.00 35.03 32.93 2wtf n LYS 404 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wtf h SER 405 N 2.98 -0.06 -2.44 4.39 0.87 -1.92 -3.23 113.55 114.13 2wtf h SER 405 Ca 0.00 0.05 -0.73 0.00 -1.23 0.00 0.00 61.79 59.88 2wtf h SER 405 Cb 1.73 0.08 -0.19 0.00 -0.44 0.00 0.00 62.40 63.58 2wtf h SER 405 CO 0.36 0.00 1.07 0.00 -0.53 0.00 0.00 176.83 177.74 2wtf n ASN 407 N 5.53 2.46 -3.86 0.00 3.02 -1.22 -1.56 115.26 119.63 2wtf n ASN 407 Ca 0.31 -1.74 -0.07 0.00 -0.03 0.00 0.00 54.58 53.04 2wtf n ASN 407 Cb 0.44 -0.12 -0.02 0.00 -0.61 0.00 0.00 39.78 39.47 2wtf n ASN 407 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wtf s SER 408 N -0.97 -0.26 0.29 6.41 1.04 -1.26 -4.94 113.70 114.01 2wtf s SER 408 Ca 0.19 -0.61 -0.00 0.00 0.48 0.00 0.00 55.95 56.00 2wtf s SER 408 Cb 0.11 0.72 0.50 0.00 0.10 0.00 0.00 66.02 67.45 2wtf s SER 408 CO 0.15 -1.33 1.91 0.40 0.98 0.00 0.00 173.24 175.35 2wtf h ILE 409 N 2.01 1.09 -0.02 -1.02 2.04 -1.96 -2.23 117.51 117.41 2wtf h ILE 409 Ca -0.20 -0.37 -0.13 0.00 1.00 0.00 0.00 64.86 65.17 2wtf h ILE 409 Cb 1.25 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2wtf h ILE 409 CO 0.24 0.19 -0.59 -0.37 0.00 0.00 0.00 178.15 177.62 2wtf h VAL 410 N 1.07 1.41 0.07 1.67 -1.51 -1.98 -0.21 116.25 116.77 2wtf h VAL 410 Ca 0.39 -2.01 -0.00 0.00 -1.23 0.00 0.00 66.70 63.84 2wtf h VAL 410 Cb 0.16 2.07 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 2wtf h VAL 410 CO -0.14 0.58 -0.03 0.44 -1.23 0.00 0.00 177.57 177.19 2wtf h ASP 411 N 0.05 -0.08 -0.20 4.19 3.45 -1.80 0.45 116.42 122.49 2wtf h ASP 411 Ca -0.01 -0.11 0.05 0.00 0.43 0.00 0.00 57.03 57.39 2wtf h ASP 411 Cb 1.06 0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 39.81 2wtf h ASP 411 CO 0.08 0.07 -0.11 0.00 -1.57 0.00 0.00 179.24 177.71 2wtf h ILE 413 N -0.09 1.05 -0.21 0.00 2.04 -0.84 0.32 117.51 119.78 2wtf h ILE 413 Ca 0.11 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.58 2wtf h ILE 413 Cb 0.25 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 2wtf h ILE 413 CO -0.26 0.18 -0.12 0.28 0.00 0.00 0.00 178.15 178.23 2wtf h SER 414 N 0.97 0.32 0.56 1.72 0.02 0.34 -1.99 113.55 115.50 2wtf h SER 414 Ca 0.38 -0.07 -0.22 0.00 -0.84 0.00 0.00 61.79 61.04 2wtf h SER 414 Cb 0.23 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2wtf h SER 414 CO -0.14 0.48 -0.96 -0.50 -1.14 0.00 0.00 176.83 174.56 2wtf h TRP 415 N 0.32 0.38 -0.30 3.45 4.06 0.39 0.32 115.95 124.57 2wtf h TRP 415 Ca 0.06 -0.22 -0.03 0.00 2.06 0.00 0.00 58.89 60.76 2wtf h TRP 415 Cb 0.41 -0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.52 2wtf h TRP 415 CO 0.01 1.07 0.06 -0.07 -3.56 0.00 0.00 178.44 175.95 2wtf h LEU 416 N 0.12 0.39 -1.30 -4.49 3.38 -0.00 -1.28 115.31 112.13 2wtf h LEU 416 Ca -0.07 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 2wtf h LEU 416 Cb 1.62 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 42.25 2wtf h LEU 416 CO 0.15 0.41 0.07 -0.33 0.09 0.00 0.00 178.44 178.83 2wtf h GLU 417 N 0.43 0.55 -0.04 1.13 5.08 -1.41 0.15 114.58 120.46 2wtf h GLU 417 Ca 0.10 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2wtf h GLU 417 Cb 0.19 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2wtf h GLU 417 CO -0.00 0.52 -0.31 0.28 -1.00 0.00 0.00 179.01 178.50 2wtf h VAL 418 N 0.53 1.46 -0.73 3.13 2.07 -1.43 -1.72 116.25 119.57 2wtf h VAL 418 Ca 0.12 -1.80 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 2wtf h VAL 418 Cb 0.23 2.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.45 2wtf h VAL 418 CO -0.00 0.51 0.44 -0.26 0.02 0.00 0.00 177.57 178.27 2wtf h PHE 419 N -0.28 0.97 -0.27 1.57 0.04 -1.00 -1.38 116.94 116.60 2wtf h PHE 419 Ca -0.03 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.70 2wtf h PHE 419 Cb 0.99 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.81 2wtf h PHE 419 CO 0.15 0.66 0.03 0.00 -0.60 0.00 0.00 178.31 178.54 2wtf h ALA 421 N 0.85 1.24 -0.39 0.00 0.00 -1.20 -0.43 119.26 119.33 2wtf h ALA 421 Ca 0.08 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 2wtf h ALA 421 Cb 0.37 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2wtf h ALA 421 CO 0.01 0.52 -0.28 1.49 0.00 0.00 0.00 179.25 180.99 2wtf h GLU 422 N 1.22 0.84 -0.08 0.00 4.81 -0.78 -1.34 114.58 119.25 2wtf h GLU 422 Ca 0.37 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2wtf h GLU 422 Cb -0.03 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 2wtf h GLU 422 CO -0.11 1.02 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.07 2wtf h LEU 423 N 0.72 0.18 -0.67 1.64 3.38 -0.51 -1.55 115.31 118.50 2wtf h LEU 423 Ca 0.08 -0.44 0.14 0.00 0.09 0.00 0.00 57.88 57.76 2wtf h LEU 423 Cb 0.83 -0.05 -0.12 0.00 0.09 0.00 0.00 40.66 41.41 2wtf h LEU 423 CO 0.07 0.58 -0.03 0.74 0.09 0.00 0.00 178.44 179.89 2wtf h THR 424 N -0.21 0.41 -0.67 0.22 2.02 -1.08 0.17 112.91 113.76 2wtf h THR 424 Ca 0.02 -0.03 0.04 0.00 0.77 0.00 0.00 66.41 67.21 2wtf h THR 424 Cb 0.52 0.31 -0.05 0.00 -1.74 0.00 0.00 68.15 67.19 2wtf h THR 424 CO 0.01 0.02 0.40 -1.28 0.37 0.00 0.00 175.52 175.04 2wtf h SER 425 N 0.09 0.64 1.20 4.18 0.87 -0.89 -2.71 113.55 116.92 2wtf h SER 425 Ca 0.35 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.88 2wtf h SER 425 Cb 0.58 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2wtf h SER 425 CO -0.60 0.43 -0.22 0.03 -0.53 0.00 0.00 176.83 175.94 2wtf h ARG 426 N 0.77 0.00 -0.59 2.24 3.08 0.20 -2.10 114.38 117.99 2wtf h ARG 426 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 2wtf h ARG 426 Cb 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 2wtf h ARG 426 CO -0.14 0.22 0.37 0.82 -1.07 0.00 0.00 179.97 180.17 2wtf h ILE 427 N 0.00 1.17 -0.38 2.04 1.08 -0.48 -2.91 117.51 118.03 2wtf h ILE 427 Ca -0.00 -0.35 -0.05 0.00 -0.39 0.00 0.00 64.86 64.07 2wtf h ILE 427 Cb 0.88 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 2wtf h ILE 427 CO 0.03 0.17 0.03 1.56 -0.69 0.00 0.00 178.15 179.24 2wtf h GLN 428 N 0.80 0.65 -0.19 2.37 4.20 -1.30 0.17 115.11 121.81 2wtf h GLN 428 Ca 0.21 -0.19 0.05 0.00 0.06 0.00 0.00 58.65 58.78 2wtf h GLN 428 Cb -0.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 2wtf h GLN 428 CO -0.04 0.74 0.17 0.22 -0.67 0.00 0.00 178.83 179.24 2wtf h ASP 429 N 0.48 0.00 0.44 1.46 3.58 -1.36 -1.08 116.42 119.94 2wtf h ASP 429 Ca 0.11 0.00 -0.31 0.00 0.42 0.00 0.00 57.03 57.25 2wtf h ASP 429 Cb 0.42 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.48 2wtf h ASP 429 CO 0.01 0.00 -1.48 -0.07 -2.88 0.00 0.00 179.24 174.83 2wtf h LEU 430 N 0.00 0.50 -1.21 2.28 3.38 -1.07 -2.44 115.31 116.76 2wtf h LEU 430 Ca 0.09 -0.62 0.01 0.00 0.09 0.00 0.00 57.88 57.45 2wtf h LEU 430 Cb 0.43 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2wtf h LEU 430 CO -0.00 1.50 0.53 -0.33 0.09 0.00 0.00 178.44 180.24 2wtf h GLU 431 N 0.09 1.06 0.00 1.13 5.08 0.20 0.12 114.58 122.26 2wtf h GLU 431 Ca -0.23 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 2wtf h GLU 431 Cb 2.04 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 31.04 2wtf h GLU 431 CO 0.19 0.71 -0.23 1.96 -1.00 0.00 0.00 179.01 180.63 2wtf h GLN 432 N 1.09 0.00 0.16 2.33 4.20 -1.29 0.94 115.11 122.55 2wtf h GLN 432 Ca 0.30 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.71 2wtf h GLN 432 Cb -0.12 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.68 2wtf h GLN 432 CO -0.06 0.23 -1.31 1.49 -0.67 0.00 0.00 178.83 178.51 2wtf h GLU 433 N 0.00 0.47 0.00 1.46 4.81 -0.85 -3.33 114.58 117.14 2wtf h GLU 433 Ca -0.00 -0.72 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 2wtf h GLU 433 Cb 1.08 0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.72 2wtf h GLU 433 CO 0.03 1.33 -1.02 0.66 -0.73 0.00 0.00 179.01 179.29 2wtf n TYR 434 N -3.68 0.25 -2.90 0.92 4.01 -0.04 -4.95 117.16 110.78 2wtf n TYR 434 Ca -0.13 0.07 -0.16 0.00 -0.16 0.00 0.00 57.90 57.53 2wtf n TYR 434 Cb 1.03 -0.42 -0.01 0.00 -0.31 0.00 0.00 39.34 39.63 2wtf n TYR 434 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2wtf n ASN 435 N -1.94 -3.30 -4.21 7.72 5.15 0.32 -4.96 115.26 114.03 2wtf n ASN 435 Ca 0.02 -0.04 -0.13 0.00 -0.60 0.00 0.00 54.58 53.82 2wtf n ASN 435 Cb 0.43 -2.80 -0.10 0.00 -0.53 0.00 0.00 39.78 36.78 2wtf n ASN 435 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2wtf s LYS 436 N -5.50 0.94 -0.04 1.20 3.01 -1.19 -5.04 119.74 113.11 2wtf s LYS 436 Ca 0.19 -1.32 -0.28 0.00 -1.01 0.00 0.00 55.97 53.55 2wtf s LYS 436 Cb -0.10 -0.50 -0.03 0.00 -1.01 0.00 0.00 37.83 36.19 2wtf s LYS 436 CO 0.24 0.06 0.90 0.42 0.51 0.00 0.00 175.35 177.48 2wtf s ILE 437 N -3.08 4.90 -0.18 2.17 -1.09 -1.26 -4.46 121.20 118.20 2wtf s ILE 437 Ca 0.12 1.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.41 2wtf s ILE 437 Cb 0.01 -4.23 0.01 0.00 -1.58 0.00 0.00 42.46 36.67 2wtf s ILE 437 CO -0.01 0.15 -0.18 0.68 -1.23 0.00 0.00 174.94 174.36 2wtf s VAL 438 N 1.18 2.28 -0.07 2.92 -7.23 -1.26 -1.43 120.40 116.79 2wtf s VAL 438 Ca 0.47 -0.87 0.02 0.00 -1.81 0.00 0.00 61.98 59.79 2wtf s VAL 438 Cb -0.19 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.79 2wtf s VAL 438 CO 0.23 0.52 -0.14 -0.63 -0.31 0.00 0.00 175.10 174.78 2wtf s ILE 439 N 1.24 1.25 0.01 -0.62 1.01 -0.76 -4.96 121.20 118.37 2wtf s ILE 439 Ca 0.03 -0.54 -0.26 0.00 0.00 0.00 0.00 60.65 59.88 2wtf s ILE 439 Cb -0.14 -1.13 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 2wtf s ILE 439 CO -0.10 0.38 0.80 -2.16 0.00 0.00 0.00 174.94 173.86 2wtf s PRO 440 N 0.67 4.51 0.15 2.79 0.04 -1.26 0.54 135.00 142.44 2wtf s PRO 440 Ca -0.14 1.11 0.20 0.00 0.04 0.00 0.00 61.00 62.21 2wtf s PRO 440 Cb -0.16 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.93 2wtf s PRO 440 CO 0.04 0.16 0.97 0.00 0.04 0.00 0.00 177.00 178.22 2wtf h ARG 441 N 6.14 0.00 -5.60 4.56 -0.00 -0.87 -3.45 114.38 115.14 2wtf h ARG 441 Ca -0.43 0.00 -0.49 0.00 -0.50 0.00 0.00 59.98 58.56 2wtf h ARG 441 Cb 1.21 0.00 -0.25 0.00 0.00 0.00 0.00 29.97 30.93 2wtf h ARG 441 CO 0.73 0.12 -0.81 -0.08 0.00 0.00 0.00 179.97 179.93 2wtf s THR 442 N -3.19 1.32 0.11 2.04 -1.32 -0.99 -0.49 115.64 113.13 2wtf s THR 442 Ca -0.01 -1.09 0.10 0.00 -1.21 0.00 0.00 61.69 59.47 2wtf s THR 442 Cb 0.09 -1.18 -0.04 0.00 -1.51 0.00 0.00 72.50 69.87 2wtf s THR 442 CO 0.80 0.06 -0.25 -0.69 -2.21 0.00 0.00 174.62 172.33 2wtf s VAL 443 N -0.85 2.06 -0.03 5.08 1.01 0.19 -1.92 120.40 125.92 2wtf s VAL 443 Ca 0.04 -1.64 -0.00 0.00 0.00 0.00 0.00 61.98 60.38 2wtf s VAL 443 Cb -0.08 -1.83 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2wtf s VAL 443 CO 0.02 0.08 0.02 -0.55 0.00 0.00 0.00 175.10 174.66 2wtf s SER 444 N -1.90 0.64 -0.15 3.32 0.15 0.19 -0.82 113.70 115.12 2wtf s SER 444 Ca 0.11 0.00 -0.06 0.00 0.70 0.00 0.00 55.95 56.71 2wtf s SER 444 Cb -0.10 -0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 2wtf s SER 444 CO 0.05 -0.15 0.04 -0.63 1.20 0.00 0.00 173.24 173.75 2wtf s ILE 445 N 1.38 4.60 0.09 6.45 1.01 -0.46 -0.99 121.20 133.28 2wtf s ILE 445 Ca -0.05 -0.11 0.06 0.00 0.00 0.00 0.00 60.65 60.54 2wtf s ILE 445 Cb -0.13 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 2wtf s ILE 445 CO -0.03 0.51 -0.14 -0.44 0.00 0.00 0.00 174.94 174.84 2wtf s SER 446 N 0.02 1.85 0.07 3.58 0.01 -0.36 -1.80 113.70 117.07 2wtf s SER 446 Ca 0.05 -0.70 -0.15 0.00 1.31 0.00 0.00 55.95 56.45 2wtf s SER 446 Cb -0.12 -0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.07 2wtf s SER 446 CO 0.01 -0.10 0.35 -1.48 0.41 0.00 0.00 173.24 172.44 2wtf s LEU 447 N -2.05 0.65 -0.08 2.44 0.05 0.17 -0.57 118.68 119.30 2wtf s LEU 447 Ca 0.03 -0.21 0.02 0.00 0.05 0.00 0.00 54.13 54.02 2wtf s LEU 447 Cb -0.08 1.58 -0.02 0.00 -2.05 0.00 0.00 46.19 45.62 2wtf s LEU 447 CO 0.03 -0.71 -0.13 -0.54 -0.55 0.00 0.00 176.35 174.45 2wtf s LYS 448 N -2.99 2.83 0.98 1.48 1.02 -0.24 -1.18 119.74 121.63 2wtf s LYS 448 Ca -0.02 -0.68 -0.15 0.00 0.02 0.00 0.00 55.97 55.13 2wtf s LYS 448 Cb 0.00 -2.48 0.19 0.00 -0.52 0.00 0.00 37.83 35.02 2wtf s LYS 448 CO -0.06 0.48 1.22 0.95 -0.92 0.00 0.00 175.35 177.02 2wtf s THR 449 N -0.35 1.92 0.34 2.17 -4.23 0.35 -1.31 115.64 114.54 2wtf s THR 449 Ca 0.04 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.70 2wtf s THR 449 Cb -0.12 -2.85 0.34 0.00 1.34 0.00 0.00 72.50 71.21 2wtf s THR 449 CO 0.02 0.00 1.64 0.50 -0.54 0.00 0.00 174.62 176.24 2wtf h LYS 450 N -1.72 0.22 -0.68 3.99 3.64 -0.13 0.22 116.57 122.12 2wtf h LYS 450 Ca -0.46 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 58.80 2wtf h LYS 450 Cb 1.28 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.99 2wtf h LYS 450 CO 0.46 0.14 0.13 -1.13 -2.27 0.00 0.00 179.45 176.79 2wtf n SER 451 N -5.13 5.23 -0.71 4.20 3.41 -1.26 -4.91 113.62 114.46 2wtf n SER 451 Ca 0.32 -3.04 -0.09 0.00 -0.26 0.00 0.00 58.87 55.80 2wtf n SER 451 Cb 1.04 -0.71 -0.04 0.00 -0.26 0.00 0.00 64.21 64.24 2wtf n SER 451 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2wtf n TYR 452 N 0.26 0.00 -2.69 7.33 4.02 0.79 -4.99 117.16 121.88 2wtf n TYR 452 Ca 0.33 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.84 2wtf n TYR 452 Cb 1.27 -1.88 -0.06 0.00 -0.02 0.00 0.00 39.34 38.66 2wtf n TYR 452 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2wtf s GLU 453 N -2.66 4.58 -0.12 -0.72 2.02 -1.26 -4.63 118.70 115.91 2wtf s GLU 453 Ca 0.00 1.46 -0.22 0.00 0.02 0.00 0.00 54.97 56.23 2wtf s GLU 453 Cb 0.00 -2.92 -0.03 0.00 0.10 0.00 0.00 34.13 31.28 2wtf s GLU 453 CO 0.00 0.25 0.65 0.08 0.02 0.00 0.00 175.26 176.26 2wtf s VAL 454 N -1.46 5.05 0.03 2.63 1.01 -1.26 -0.49 120.40 125.90 2wtf s VAL 454 Ca 0.49 1.29 0.07 0.00 0.00 0.00 0.00 61.98 63.83 2wtf s VAL 454 Cb -0.23 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 2wtf s VAL 454 CO 0.29 0.20 -0.20 -0.31 0.00 0.00 0.00 175.10 175.08 2wtf s TYR 455 N 1.21 2.50 -0.19 5.22 1.51 -0.33 -4.99 117.35 122.29 2wtf s TYR 455 Ca 0.33 -0.29 -0.12 0.00 -1.01 0.00 0.00 57.07 55.97 2wtf s TYR 455 Cb -0.17 -1.47 0.06 0.00 -0.11 0.00 0.00 41.96 40.28 2wtf s TYR 455 CO 0.14 0.20 0.48 0.50 -1.11 0.00 0.00 175.55 175.75 2wtf s ARG 456 N -1.27 0.49 -0.04 -0.62 3.52 -1.26 -0.66 118.95 119.10 2wtf s ARG 456 Ca 0.13 0.83 0.04 0.00 -0.13 0.00 0.00 55.73 56.60 2wtf s ARG 456 Cb -0.10 0.09 0.00 0.00 -1.56 0.00 0.00 34.95 33.37 2wtf s ARG 456 CO 0.04 -0.13 -0.15 0.21 -0.81 0.00 0.00 175.30 174.45 2wtf s LYS 457 N 1.12 1.67 -0.02 5.12 2.20 -0.74 -5.00 119.74 124.09 2wtf s LYS 457 Ca -0.07 -0.54 0.04 0.00 -0.36 0.00 0.00 55.97 55.04 2wtf s LYS 457 Cb -0.06 -1.45 -0.00 0.00 -1.51 0.00 0.00 37.83 34.80 2wtf s LYS 457 CO -0.10 0.19 -0.12 0.45 -0.36 0.00 0.00 175.35 175.40 2wtf s SER 458 N 0.16 1.53 0.26 1.43 0.15 -1.26 -1.35 113.70 114.61 2wtf s SER 458 Ca -0.06 -0.24 -0.20 0.00 0.70 0.00 0.00 55.95 56.16 2wtf s SER 458 Cb -0.12 -0.29 0.07 0.00 -1.71 0.00 0.00 66.02 63.97 2wtf s SER 458 CO 0.02 0.13 0.95 -0.83 1.20 0.00 0.00 173.24 174.71 2wtf s GLY 459 N -0.09 0.19 0.43 9.45 0.00 -0.00 -5.00 107.32 112.31 2wtf s GLY 459 Ca 0.01 -0.47 -0.23 0.00 0.00 0.00 0.00 44.72 44.03 2wtf s GLY 459 CO 0.00 1.37 1.08 2.56 0.00 0.00 0.00 173.10 178.12 2wtf s PRO 460 N -2.27 3.98 -0.21 2.90 0.04 -1.26 -0.64 135.00 137.55 2wtf s PRO 460 Ca 0.19 1.56 -0.06 0.00 0.04 0.00 0.00 61.00 62.74 2wtf s PRO 460 Cb -0.03 -2.43 -0.03 0.00 0.04 0.00 0.00 34.50 32.05 2wtf s PRO 460 CO 0.07 -0.31 0.02 0.54 0.04 0.00 0.00 177.00 177.36 2wtf s VAL 461 N -1.68 4.08 -0.06 -0.36 0.11 0.36 -4.82 120.40 118.03 2wtf s VAL 461 Ca 0.61 -0.27 -0.22 0.00 -2.93 0.00 0.00 61.98 59.17 2wtf s VAL 461 Cb -0.23 -2.86 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 2wtf s VAL 461 CO 0.28 0.41 0.66 0.00 -3.33 0.00 0.00 175.10 173.12 2wtf s ALA 462 N 1.08 3.37 -0.22 1.54 0.00 -1.26 -4.89 121.76 121.38 2wtf s ALA 462 Ca 0.03 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.03 2wtf s ALA 462 Cb -0.14 -2.89 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 2wtf s ALA 462 CO 0.02 -0.05 -0.05 0.71 0.00 0.00 0.00 175.76 176.39 2wtf s TYR 463 N 0.62 2.95 -1.31 0.00 2.02 -1.26 -4.89 117.35 115.49 2wtf s TYR 463 Ca 0.35 -0.96 -0.12 0.00 -0.37 0.00 0.00 57.07 55.98 2wtf s TYR 463 Cb -0.17 -2.10 0.13 0.00 -0.40 0.00 0.00 41.96 39.42 2wtf s TYR 463 CO 0.17 -0.55 1.85 1.63 -1.57 0.00 0.00 175.55 177.08 2wtf n LYS 464 N 4.77 3.37 0.00 -0.62 4.76 -1.26 -4.76 118.16 124.42 2wtf n LYS 464 Ca -0.18 -3.37 0.00 0.00 -2.87 0.00 0.00 58.31 51.89 2wtf n LYS 464 Cb 0.51 -3.08 0.00 0.00 -1.84 0.00 0.00 35.03 30.62 2wtf n LYS 464 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wtf n GLY 465 N 3.56 1.41 0.08 0.72 0.00 -1.26 -4.99 105.19 104.72 2wtf n GLY 465 Ca 0.43 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.75 2wtf n GLY 465 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2wtf n ILE 466 N -1.71 1.12 -3.18 -0.61 0.00 -1.26 -4.91 119.36 108.82 2wtf n ILE 466 Ca 0.00 -0.72 -0.39 0.00 0.00 0.00 0.00 62.75 61.64 2wtf n ILE 466 Cb 0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 39.64 38.98 2wtf n ILE 466 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 2wtf s ASN 467 N -5.58 7.04 0.17 9.51 -0.87 -1.26 -5.04 114.94 118.91 2wtf s ASN 467 Ca -0.05 1.23 -0.33 0.00 -1.57 0.00 0.00 52.86 52.14 2wtf s ASN 467 Cb 0.09 -2.38 -0.12 0.00 -0.02 0.00 0.00 41.25 38.81 2wtf s ASN 467 CO 0.83 0.13 1.70 0.33 -2.57 0.00 0.00 177.10 177.52 2wtf n PHE 468 N 2.51 2.55 -5.01 2.20 7.35 -1.26 -4.90 117.46 120.91 2wtf n PHE 468 Ca -0.07 0.09 -0.28 0.00 -0.76 0.00 0.00 57.45 56.42 2wtf n PHE 468 Cb 0.51 -2.64 -0.16 0.00 0.35 0.00 0.00 39.48 37.54 2wtf n PHE 468 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2wtf s GLN 469 N 1.44 2.13 0.17 -4.13 -1.52 -1.26 -5.05 119.66 111.44 2wtf s GLN 469 Ca 0.78 -0.73 -0.15 0.00 -1.95 0.00 0.00 55.36 53.31 2wtf s GLN 469 Cb -0.57 -1.81 0.13 0.00 -0.22 0.00 0.00 33.01 30.54 2wtf s GLN 469 CO 0.36 0.29 1.69 0.66 -0.25 0.00 0.00 175.29 178.03 2wtf h SER 470 N 6.22 -0.22 -0.12 5.90 4.64 -1.95 -1.80 113.55 126.21 2wtf h SER 470 Ca -0.32 0.11 0.03 0.00 -0.47 0.00 0.00 61.79 61.14 2wtf h SER 470 Cb 1.18 0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2wtf h SER 470 CO 0.47 -0.07 0.11 1.12 -0.87 0.00 0.00 176.83 177.59 2wtf h HIS 471 N 0.08 0.00 -0.25 4.77 2.07 -1.97 0.96 115.15 120.81 2wtf h HIS 471 Ca 0.21 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.56 2wtf h HIS 471 Cb 0.31 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.29 2wtf h HIS 471 CO -0.30 0.00 -0.54 0.93 -3.07 0.00 0.00 177.93 174.95 2wtf h GLU 472 N 0.00 0.73 -0.29 5.12 4.39 -1.68 -1.94 114.58 120.91 2wtf h GLU 472 Ca 0.05 -0.46 -0.05 0.00 0.34 0.00 0.00 59.36 59.24 2wtf h GLU 472 Cb 0.27 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 2wtf h GLU 472 CO -0.00 1.09 -0.01 1.25 -1.16 0.00 0.00 179.01 180.18 2wtf h LEU 473 N 0.56 0.51 -0.23 1.33 6.46 -0.78 -2.94 115.31 120.23 2wtf h LEU 473 Ca 0.01 -0.32 0.03 0.00 -0.12 0.00 0.00 57.88 57.49 2wtf h LEU 473 Cb 1.12 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 2wtf h LEU 473 CO 0.11 0.70 0.02 0.25 -0.62 0.00 0.00 178.44 178.91 2wtf h LEU 474 N 0.31 -0.04 -0.63 2.25 5.85 -1.37 -2.26 115.31 119.42 2wtf h LEU 474 Ca 0.08 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.96 2wtf h LEU 474 Cb 0.45 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.46 2wtf h LEU 474 CO 0.02 0.01 0.17 0.50 -0.34 0.00 0.00 178.44 178.80 2wtf h LYS 475 N 0.10 0.30 -0.24 1.25 3.64 -1.27 0.23 116.57 120.57 2wtf h LYS 475 Ca 0.10 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2wtf h LYS 475 Cb 0.12 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2wtf h LYS 475 CO -0.16 0.20 -0.11 0.28 -2.27 0.00 0.00 179.45 177.38 2wtf h VAL 476 N 0.31 1.30 -0.59 2.00 2.07 -1.40 -2.34 116.25 117.59 2wtf h VAL 476 Ca 0.33 -1.19 0.12 0.00 0.82 0.00 0.00 66.70 66.79 2wtf h VAL 476 Cb 0.49 1.56 -0.11 0.00 -1.52 0.00 0.00 31.29 31.72 2wtf h VAL 476 CO -0.40 0.37 -0.07 1.23 0.02 0.00 0.00 177.57 178.72 2wtf h GLY 477 N 0.23 0.53 1.04 2.17 0.00 -0.74 -0.68 103.07 105.62 2wtf h GLY 477 Ca 0.05 0.14 0.03 0.00 0.00 0.00 0.00 47.33 47.55 2wtf h GLY 477 CO 0.04 -0.21 0.57 -2.22 0.00 0.00 0.00 176.54 174.72 2wtf h ILE 478 N 0.06 1.16 -0.22 2.60 2.04 -0.46 -0.88 117.51 121.80 2wtf h ILE 478 Ca 0.30 -0.38 -0.07 0.00 1.00 0.00 0.00 64.86 65.71 2wtf h ILE 478 Cb 0.47 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2wtf h ILE 478 CO -0.56 0.20 -0.13 0.50 0.00 0.00 0.00 178.15 178.17 2wtf h LYS 479 N 1.09 0.47 -0.68 2.37 3.64 -0.68 -0.99 116.57 121.79 2wtf h LYS 479 Ca 0.34 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 2wtf h LYS 479 Cb 0.00 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2wtf h LYS 479 CO -0.10 0.76 0.20 0.74 -2.27 0.00 0.00 179.45 178.79 2wtf h PHE 480 N 0.18 1.10 -0.49 1.91 -1.00 -0.77 0.19 116.94 118.06 2wtf h PHE 480 Ca 0.05 -0.11 -0.10 0.00 2.81 0.00 0.00 57.97 60.61 2wtf h PHE 480 Cb 0.63 -0.32 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 2wtf h PHE 480 CO 0.07 0.89 -0.11 0.28 -1.61 0.00 0.00 178.31 177.83 2wtf h VAL 481 N 1.00 1.26 -0.30 -0.55 2.07 -1.12 -0.90 116.25 117.71 2wtf h VAL 481 Ca 0.22 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 2wtf h VAL 481 Cb 0.31 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2wtf h VAL 481 CO -0.01 0.43 0.11 0.74 0.02 0.00 0.00 177.57 178.86 2wtf h THR 482 N 0.81 1.19 -0.53 2.57 2.02 -0.65 -0.67 112.91 117.66 2wtf h THR 482 Ca 0.13 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.72 2wtf h THR 482 Cb 0.63 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 2wtf h THR 482 CO 0.04 0.20 0.34 0.44 0.37 0.00 0.00 175.52 176.91 2wtf h ASP 483 N 0.33 0.61 0.66 4.18 3.45 -0.34 -2.45 116.42 122.86 2wtf h ASP 483 Ca 0.10 -0.02 -0.20 0.00 0.43 0.00 0.00 57.03 57.33 2wtf h ASP 483 Cb 0.21 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 2wtf h ASP 483 CO -0.01 0.45 -0.93 -0.07 -1.57 0.00 0.00 179.24 177.12 2wtf h LEU 484 N 0.72 0.22 -0.67 1.55 3.38 -0.87 -2.11 115.31 117.52 2wtf h LEU 484 Ca 0.19 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wtf h LEU 484 Cb -0.06 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2wtf h LEU 484 CO -0.04 1.03 0.35 -0.78 0.09 0.00 0.00 178.44 179.09 2wtf h ASP 485 N 0.08 0.85 -0.52 -0.43 3.58 -0.68 -1.63 116.42 117.67 2wtf h ASP 485 Ca -0.05 -0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.24 2wtf h ASP 485 Cb 1.58 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 42.39 2wtf h ASP 485 CO 0.14 0.72 0.13 0.40 -2.88 0.00 0.00 179.24 177.75 2wtf h ILE 486 N 0.92 1.23 -0.49 2.25 2.04 -1.30 -2.73 117.51 119.43 2wtf h ILE 486 Ca 0.23 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.21 2wtf h ILE 486 Cb 0.07 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 2wtf h ILE 486 CO -0.03 0.32 0.19 0.11 0.00 0.00 0.00 178.15 178.73 2wtf h LYS 487 N 0.85 0.71 -0.21 2.37 1.57 -0.66 -3.09 116.57 118.11 2wtf h LYS 487 Ca 0.18 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2wtf h LYS 487 Cb 0.32 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2wtf h LYS 487 CO -0.00 0.59 0.00 0.41 -0.57 0.00 0.00 179.45 179.88 2wtf n GLY 488 N -1.10 0.42 3.75 3.86 0.00 -0.69 -4.96 105.19 106.49 2wtf n GLY 488 Ca 0.04 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 2wtf n GLY 488 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wtf s LYS 489 N -1.73 4.15 -1.55 1.61 -0.14 -1.17 -2.02 119.74 118.89 2wtf s LYS 489 Ca 0.31 2.52 -0.00 0.00 -1.36 0.00 0.00 55.97 57.44 2wtf s LYS 489 Cb 0.17 -3.03 0.00 0.00 -1.68 0.00 0.00 37.83 33.29 2wtf s LYS 489 CO 0.25 -0.56 0.01 -1.71 -0.76 0.00 0.00 175.35 172.58 2wtf n ASN 490 N 1.90 -5.28 -4.05 2.83 5.15 -1.26 -4.98 115.26 109.56 2wtf n ASN 490 Ca 0.07 -0.02 -0.08 0.00 -0.60 0.00 0.00 54.58 53.94 2wtf n ASN 490 Cb 0.38 -4.35 -0.09 0.00 -0.53 0.00 0.00 39.78 35.19 2wtf n ASN 490 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2wtf s LYS 491 N -4.92 0.78 0.24 1.20 1.02 -0.86 -5.11 119.74 112.09 2wtf s LYS 491 Ca 0.01 -1.23 -0.31 0.00 0.02 0.00 0.00 55.97 54.46 2wtf s LYS 491 Cb -0.00 0.26 -0.12 0.00 -0.52 0.00 0.00 37.83 37.44 2wtf s LYS 491 CO 0.01 -0.20 1.64 0.45 -0.92 0.00 0.00 175.35 176.32 2wtf n SER 492 N -0.00 3.77 0.00 2.83 2.88 -1.26 -4.78 113.62 117.06 2wtf n SER 492 Ca -0.11 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 2wtf n SER 492 Cb 0.62 -1.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.52 2wtf n SER 492 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wtf n TYR 493 N 3.01 0.00 -2.42 0.66 4.19 -1.26 -4.78 117.16 116.55 2wtf n TYR 493 Ca 0.13 0.00 -0.36 0.00 3.31 0.00 0.00 57.90 60.97 2wtf n TYR 493 Cb 0.35 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 40.15 2wtf n TYR 493 CO 0.00 0.00 0.00 0.71 0.91 0.00 0.00 176.86 178.48 2wtf s TYR 494 N 0.65 3.07 0.38 2.98 2.02 -1.26 -0.18 117.35 125.00 2wtf s TYR 494 Ca 0.00 1.59 -0.24 0.00 -0.37 0.00 0.00 57.07 58.05 2wtf s TYR 494 Cb 0.00 -3.22 -0.09 0.00 -0.40 0.00 0.00 41.96 38.24 2wtf s TYR 494 CO 0.00 -1.02 1.01 -2.14 -1.57 0.00 0.00 175.55 171.83 2wtf s PRO 495 N -2.68 4.31 0.56 -1.71 0.02 -1.26 -4.75 135.00 129.49 2wtf s PRO 495 Ca 0.62 1.41 -0.14 0.00 0.02 0.00 0.00 61.00 62.90 2wtf s PRO 495 Cb -0.24 -2.58 -0.06 0.00 0.02 0.00 0.00 34.50 31.64 2wtf s PRO 495 CO 0.29 0.01 1.01 -0.51 -0.33 0.00 0.00 177.00 177.47 2wtf s LEU 496 N -2.52 3.46 0.00 -5.54 1.43 -0.60 -2.28 118.68 112.62 2wtf s LEU 496 Ca 0.56 1.54 0.09 0.00 -1.03 0.00 0.00 54.13 55.29 2wtf s LEU 496 Cb -0.19 -4.50 -0.09 0.00 0.03 0.00 0.00 46.19 41.44 2wtf s LEU 496 CO 0.25 -0.76 0.41 0.35 0.23 0.00 0.00 176.35 176.82 2wtf n THR 497 N -2.09 0.00 -3.55 5.49 -2.24 -0.42 -4.70 114.28 106.77 2wtf n THR 497 Ca 0.07 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.39 2wtf n THR 497 Cb 0.54 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 2wtf n THR 497 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2wtf s LYS 498 N -1.82 0.92 -0.11 -0.78 2.20 -1.17 -0.43 119.74 118.55 2wtf s LYS 498 Ca 0.04 0.33 -0.09 0.00 -0.36 0.00 0.00 55.97 55.89 2wtf s LYS 498 Cb 0.07 0.44 0.03 0.00 -1.51 0.00 0.00 37.83 36.86 2wtf s LYS 498 CO 0.36 -0.27 0.28 -1.17 -0.36 0.00 0.00 175.35 174.20 2wtf s LEU 499 N -0.95 0.73 0.17 5.43 2.96 -1.04 -1.08 118.68 124.90 2wtf s LEU 499 Ca -0.07 0.58 -0.17 0.00 -0.22 0.00 0.00 54.13 54.25 2wtf s LEU 499 Cb -0.01 0.94 0.03 0.00 0.50 0.00 0.00 46.19 47.65 2wtf s LEU 499 CO 0.07 -0.12 0.47 -0.94 -1.32 0.00 0.00 176.35 174.51 2wtf s SER 500 N 0.51 -0.24 -0.07 3.68 1.04 0.27 -1.59 113.70 117.29 2wtf s SER 500 Ca -0.03 -0.43 -0.01 0.00 0.48 0.00 0.00 55.95 55.96 2wtf s SER 500 Cb -0.04 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.64 2wtf s SER 500 CO -0.03 -0.97 -0.00 -0.32 0.98 0.00 0.00 173.24 172.90 2wtf s MET 501 N -3.85 0.59 -0.10 4.02 1.75 -0.71 -1.23 119.30 119.77 2wtf s MET 501 Ca 0.07 0.10 0.04 0.00 -1.25 0.00 0.00 55.69 54.65 2wtf s MET 501 Cb 0.00 -0.93 -0.00 0.00 2.84 0.00 0.00 34.83 36.74 2wtf s MET 501 CO -0.06 -0.28 -0.22 0.99 -0.65 0.00 0.00 175.02 174.80 2wtf s THR 502 N 1.85 2.23 0.00 10.11 2.01 -0.16 -0.78 115.64 130.90 2wtf s THR 502 Ca 0.03 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 61.07 2wtf s THR 502 Cb -0.12 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 2wtf s THR 502 CO -0.05 0.56 0.05 0.27 -0.69 0.00 0.00 174.62 174.76 2wtf s ILE 503 N 0.28 4.48 0.37 1.82 -4.36 0.14 -0.64 121.20 123.29 2wtf s ILE 503 Ca -0.16 -0.51 -0.04 0.00 -0.26 0.00 0.00 60.65 59.68 2wtf s ILE 503 Cb -0.17 -3.04 0.02 0.00 1.25 0.00 0.00 42.46 40.52 2wtf s ILE 503 CO 0.08 0.35 0.56 0.35 0.24 0.00 0.00 174.94 176.52 2wtf n THR 504 N 1.23 0.00 -3.50 8.37 -2.24 -0.81 -1.06 114.28 116.26 2wtf n THR 504 Ca -0.13 -1.68 -0.23 0.00 -2.27 0.00 0.00 64.05 59.73 2wtf n THR 504 Cb 0.53 1.11 0.04 0.00 -2.10 0.00 0.00 70.33 69.91 2wtf n THR 504 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wtf n ASN 505 N -1.59 -5.95 -4.69 3.42 3.02 -1.26 -2.34 115.26 105.87 2wtf n ASN 505 Ca -0.01 -0.83 -0.42 0.00 -0.03 0.00 0.00 54.58 53.29 2wtf n ASN 505 Cb 0.61 -4.00 -0.03 0.00 -0.61 0.00 0.00 39.78 35.75 2wtf n ASN 505 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2wtf s PHE 506 N -3.37 3.30 -0.37 3.10 0.08 -1.26 -0.88 117.98 118.59 2wtf s PHE 506 Ca 0.40 1.31 -0.19 0.00 0.12 0.00 0.00 56.93 58.57 2wtf s PHE 506 Cb -0.11 -3.37 0.00 0.00 -0.57 0.00 0.00 43.02 38.97 2wtf s PHE 506 CO 0.82 -1.09 0.54 -0.51 -0.10 0.00 0.00 175.22 174.87 2wtf s ASP 507 N 1.33 6.32 -1.11 1.36 1.11 0.19 -4.94 116.67 120.93 2wtf s ASP 507 Ca 0.55 -0.12 -0.13 0.00 0.18 0.00 0.00 52.55 53.03 2wtf s ASP 507 Cb -0.24 -2.28 0.19 0.00 1.07 0.00 0.00 42.92 41.66 2wtf s ASP 507 CO 0.23 -0.55 1.25 -0.63 1.18 0.00 0.00 175.17 176.66 2wtf s ILE 508 N 2.47 5.27 -2.15 0.77 1.01 -1.26 -1.83 121.20 125.48 2wtf s ILE 508 Ca 0.19 -2.64 0.31 0.00 0.00 0.00 0.00 60.65 58.51 2wtf s ILE 508 Cb -0.15 -4.78 0.81 0.00 0.01 0.00 0.00 42.46 38.34 2wtf s ILE 508 CO 0.14 -1.45 2.09 2.30 0.00 0.00 0.00 174.94 178.02