#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pwe h LEU 7 N 0.00 0.66-10.78 -3.43 3.38 -1.93 -3.44 115.31 99.78 1pwe h LEU 7 Ca 0.00 -0.22 -0.46 0.00 0.09 0.00 0.00 57.88 57.29 1pwe h LEU 7 Cb 0.00 -0.17 0.12 0.00 0.09 0.00 0.00 40.66 40.69 1pwe h LEU 7 CO 0.00 0.70 0.23 -1.38 0.09 0.00 0.00 178.44 178.08 1pwe s HIS 8 N -5.37 1.39 0.10 1.13 -3.43 -1.26 -4.81 115.29 103.04 1pwe s HIS 8 Ca -0.13 -0.13 0.02 0.00 -0.80 0.00 0.00 55.06 54.03 1pwe s HIS 8 Cb 0.11 -3.42 -0.04 0.00 -1.43 0.00 0.00 32.58 27.80 1pwe s HIS 8 CO 0.78 -2.15 -0.08 0.14 -2.00 0.00 0.00 174.74 171.43 1pwe s VAL 9 N -3.44 0.78 -0.68 -5.38 -7.23 -1.26 -5.05 120.40 98.14 1pwe s VAL 9 Ca 0.70 -1.82 -0.27 0.00 -1.81 0.00 0.00 61.98 58.78 1pwe s VAL 9 Cb -0.04 -1.54 0.02 0.00 0.56 0.00 0.00 36.38 35.38 1pwe s VAL 9 CO 0.48 -0.76 1.37 -0.75 -0.31 0.00 0.00 175.10 175.13 1pwe s LYS 10 N -3.42 3.17 0.51 4.82 2.20 -1.26 -4.97 119.74 120.78 1pwe s LYS 10 Ca 0.09 0.03 -0.19 0.00 -0.36 0.00 0.00 55.97 55.54 1pwe s LYS 10 Cb 0.02 -4.18 -0.07 0.00 -1.51 0.00 0.00 37.83 32.09 1pwe s LYS 10 CO -0.03 -2.14 1.04 0.95 -0.36 0.00 0.00 175.35 174.81 1pwe s THR 11 N 6.13 3.84 0.94 3.43 -4.23 -1.26 -5.03 115.64 119.46 1pwe s THR 11 Ca 0.43 1.07 -0.11 0.00 -1.18 0.00 0.00 61.69 61.90 1pwe s THR 11 Cb -0.09 -3.45 0.16 0.00 1.34 0.00 0.00 72.50 70.46 1pwe s THR 11 CO 0.18 -0.32 1.11 -2.16 -0.54 0.00 0.00 174.62 172.90 1pwe s PRO 12 N -3.44 0.81 -0.35 3.99 0.04 -1.26 -4.76 135.00 130.02 1pwe s PRO 12 Ca 0.66 1.31 0.01 0.00 0.04 0.00 0.00 61.00 63.02 1pwe s PRO 12 Cb -0.16 -1.72 0.11 0.00 0.04 0.00 0.00 34.50 32.77 1pwe s PRO 12 CO 0.24 -2.70 0.12 -1.17 0.04 0.00 0.00 177.00 173.53 1pwe s LEU 13 N -6.61 2.99 0.33 -3.56 2.96 -1.26 -1.89 118.68 111.63 1pwe s LEU 13 Ca 0.66 -2.01 -0.27 0.00 -0.22 0.00 0.00 54.13 52.29 1pwe s LEU 13 Cb -0.22 -1.10 -0.09 0.00 0.50 0.00 0.00 46.19 45.27 1pwe s LEU 13 CO 0.59 -0.37 1.02 -0.13 -1.32 0.00 0.00 176.35 176.14 1pwe s ARG 14 N 1.12 4.48 -0.90 1.98 0.52 -0.08 -4.80 118.95 121.28 1pwe s ARG 14 Ca 0.12 1.54 -0.12 0.00 -0.52 0.00 0.00 55.73 56.74 1pwe s ARG 14 Cb -0.19 -2.87 0.23 0.00 0.52 0.00 0.00 34.95 32.64 1pwe s ARG 14 CO -0.15 0.14 0.85 0.34 0.02 0.00 0.00 175.30 176.50 1pwe s ASP 15 N -1.35 6.88 -0.30 0.23 3.68 -1.26 -0.17 116.67 124.37 1pwe s ASP 15 Ca 0.50 -2.94 -0.29 0.00 2.13 0.00 0.00 52.55 51.96 1pwe s ASP 15 Cb -0.24 -2.20 -0.02 0.00 -1.45 0.00 0.00 42.92 39.01 1pwe s ASP 15 CO 0.31 -0.49 1.71 -0.55 0.13 0.00 0.00 175.17 176.28 1pwe s SER 16 N 1.90 6.07 0.29 -0.34 0.15 -0.71 -4.86 113.70 116.20 1pwe s SER 16 Ca 0.21 1.36 0.03 0.00 0.70 0.00 0.00 55.95 58.25 1pwe s SER 16 Cb -0.10 -2.53 0.43 0.00 -1.71 0.00 0.00 66.02 62.11 1pwe s SER 16 CO -0.09 -1.55 1.72 -0.03 1.20 0.00 0.00 173.24 174.49 1pwe h MET 17 N 12.06 0.44 0.40 5.44 4.05 -1.95 -1.85 114.93 133.52 1pwe h MET 17 Ca -0.33 -0.17 -0.02 0.00 -0.28 0.00 0.00 59.70 58.90 1pwe h MET 17 Cb 1.16 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.94 1pwe h MET 17 CO 1.03 0.68 -0.19 0.00 0.23 0.00 0.00 176.91 178.65 1pwe h ALA 18 N 1.33 -0.54 0.00 0.39 0.00 -1.93 -2.21 119.26 116.30 1pwe h ALA 18 Ca 0.06 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1pwe h ALA 18 Cb 0.68 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1pwe h ALA 18 CO 0.05 -0.58 -0.30 -0.07 0.00 0.00 0.00 179.25 178.35 1pwe h LEU 19 N -0.99 0.00 -0.48 0.00 4.07 -1.93 -2.37 115.31 113.61 1pwe h LEU 19 Ca -0.06 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.84 1pwe h LEU 19 Cb 0.54 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.26 1pwe h LEU 19 CO 0.09 0.30 0.06 0.28 -1.08 0.00 0.00 178.44 178.09 1pwe h SER 20 N 0.00 0.78 -0.52 -0.43 0.02 -1.38 0.71 113.55 112.73 1pwe h SER 20 Ca -0.00 -0.27 0.02 0.00 -0.84 0.00 0.00 61.79 60.69 1pwe h SER 20 Cb 0.68 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1pwe h SER 20 CO 0.04 0.85 0.32 0.50 -1.14 0.00 0.00 176.83 177.41 1pwe h LYS 21 N 0.67 0.63 -0.30 3.45 3.64 -0.90 0.20 116.57 123.97 1pwe h LYS 21 Ca 0.14 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1pwe h LYS 21 Cb 0.42 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1pwe h LYS 21 CO 0.01 0.42 -0.02 0.28 -2.27 0.00 0.00 179.45 177.87 1pwe h VAL 22 N 0.65 1.26 0.00 2.00 2.07 -1.07 -3.14 116.25 118.02 1pwe h VAL 22 Ca 0.20 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1pwe h VAL 22 Cb -0.02 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1pwe h VAL 22 CO -0.07 0.32 0.00 0.00 0.02 0.00 0.00 177.57 177.83 1pwe h ALA 23 N 0.82 1.00 -1.28 1.67 0.00 -0.69 -3.47 119.26 117.31 1pwe h ALA 23 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 1pwe h ALA 23 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1pwe h ALA 23 CO 0.02 0.00 -0.23 0.41 0.00 0.00 0.00 179.25 179.45 1pwe n GLY 24 N 0.96 0.01 3.54 0.00 0.00 0.70 -4.83 105.19 105.57 1pwe n GLY 24 Ca 0.04 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.44 1pwe n GLY 24 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pwe s THR 25 N -2.45 0.00 0.04 2.61 -1.32 -1.15 -5.01 115.64 108.36 1pwe s THR 25 Ca 0.00 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.16 1pwe s THR 25 Cb -0.00 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.88 1pwe s THR 25 CO 0.00 0.00 1.86 -1.20 -2.21 0.00 0.00 174.62 173.08 1pwe n SER 26 N 0.38 3.79 -4.32 8.08 7.64 -1.26 -4.41 113.62 123.52 1pwe n SER 26 Ca -0.11 0.97 -0.34 0.00 1.01 0.00 0.00 58.87 60.40 1pwe n SER 26 Cb 0.59 -1.47 -0.14 0.00 -1.01 0.00 0.00 64.21 62.18 1pwe n SER 26 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1pwe s VAL 27 N 3.42 3.07 -0.10 0.44 1.01 -1.26 -2.04 120.40 124.93 1pwe s VAL 27 Ca 0.87 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 62.21 1pwe s VAL 27 Cb -0.56 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1pwe s VAL 27 CO 0.43 0.49 -0.04 -0.36 0.00 0.00 0.00 175.10 175.62 1pwe s PHE 28 N 0.88 3.02 -0.26 5.22 2.99 -0.05 -1.74 117.98 128.04 1pwe s PHE 28 Ca -0.03 -0.04 -0.07 0.00 0.00 0.00 0.00 56.93 56.80 1pwe s PHE 28 Cb -0.15 -1.81 -0.01 0.00 0.00 0.00 0.00 43.02 41.05 1pwe s PHE 28 CO 0.00 0.25 0.06 -0.51 -0.00 0.00 0.00 175.22 175.02 1pwe s LEU 29 N -0.46 3.51 -0.62 -0.37 1.43 0.76 -0.25 118.68 122.68 1pwe s LEU 29 Ca 0.07 -0.43 -0.23 0.00 -1.03 0.00 0.00 54.13 52.51 1pwe s LEU 29 Cb -0.12 -1.88 0.06 0.00 0.03 0.00 0.00 46.19 44.28 1pwe s LEU 29 CO 0.02 -0.09 0.95 -0.75 0.23 0.00 0.00 176.35 176.71 1pwe s LYS 30 N 1.55 3.18 -0.24 1.70 2.47 -0.73 -0.90 119.74 126.77 1pwe s LYS 30 Ca 0.05 -0.65 -0.04 0.00 -1.56 0.00 0.00 55.97 53.76 1pwe s LYS 30 Cb -0.16 -4.17 -0.13 0.00 -1.46 0.00 0.00 37.83 31.91 1pwe s LYS 30 CO 0.02 -1.70 2.30 -1.33 0.16 0.00 0.00 175.35 174.81 1pwe n MET 31 N 7.60 1.44 0.00 4.03 2.81 -0.79 -1.77 117.12 130.44 1pwe n MET 31 Ca -0.02 -0.82 0.02 0.00 -1.81 0.00 0.00 57.70 55.06 1pwe n MET 31 Cb 0.46 -1.97 0.07 0.00 -0.71 0.00 0.00 33.22 31.08 1pwe n MET 31 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1pwe n ASP 32 N 3.07 0.01 0.31 7.83 10.43 -0.97 -0.01 116.55 137.22 1pwe n ASP 32 Ca 0.31 0.51 0.19 0.00 2.57 0.00 0.00 54.79 58.36 1pwe n ASP 32 Cb 0.44 -0.51 0.98 0.00 1.84 0.00 0.00 41.12 43.87 1pwe n ASP 32 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 1pwe h SER 33 N 0.00 0.00 0.03 -2.24 4.64 -1.51 -0.68 113.55 113.80 1pwe h SER 33 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pwe h SER 33 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1pwe h SER 33 CO 0.00 0.02 -0.01 -1.20 -0.87 0.00 0.00 176.83 174.77 1pwe n SER 34 N -3.26 0.59 -4.76 4.97 7.64 0.98 -4.53 113.62 115.25 1pwe n SER 34 Ca -0.02 -1.14 -0.38 0.00 1.01 0.00 0.00 58.87 58.34 1pwe n SER 34 Cb 0.16 -0.01 0.01 0.00 -1.01 0.00 0.00 64.21 63.36 1pwe n SER 34 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1pwe s GLN 35 N -2.04 3.61 0.16 1.43 -1.52 -0.26 -4.91 119.66 116.12 1pwe s GLN 35 Ca 0.43 2.03 -0.28 0.00 -1.95 0.00 0.00 55.36 55.58 1pwe s GLN 35 Cb 0.21 -2.45 -0.02 0.00 -0.22 0.00 0.00 33.01 30.54 1pwe s GLN 35 CO 0.37 -0.75 1.56 -1.35 -0.25 0.00 0.00 175.29 174.87 1pwe h PRO 36 N 2.02 -0.24 -1.00 2.91 0.11 -1.87 0.15 132.00 134.09 1pwe h PRO 36 Ca -0.50 0.02 0.23 0.00 0.11 0.00 0.00 66.00 65.86 1pwe h PRO 36 Cb 1.26 0.05 -0.09 0.00 0.11 0.00 0.00 31.00 32.34 1pwe h PRO 36 CO 0.60 -0.16 0.64 1.03 -0.21 0.00 0.00 178.00 179.89 1pwe h SER 37 N -0.25 0.53 0.00 -2.05 0.87 -1.92 -3.44 113.55 107.29 1pwe h SER 37 Ca 0.15 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 1pwe h SER 37 Cb 0.56 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1pwe h SER 37 CO -0.70 0.15 0.00 0.61 -0.53 0.00 0.00 176.83 176.36 1pwe n GLY 38 N -1.44 1.06 3.69 5.77 0.00 0.54 -4.74 105.19 110.06 1pwe n GLY 38 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.17 1pwe n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pwe s SER 39 N -0.77 -0.20 0.53 1.61 1.04 -1.26 -1.06 113.70 113.59 1pwe s SER 39 Ca 0.00 -0.70 0.25 0.00 0.48 0.00 0.00 55.95 55.98 1pwe s SER 39 Cb 0.00 0.64 1.47 0.00 0.10 0.00 0.00 66.02 68.24 1pwe s SER 39 CO 0.00 -1.21 2.12 2.19 0.98 0.00 0.00 173.24 177.33 1pwe h PHE 40 N 2.14 0.00 -0.27 5.02 -5.15 -1.60 -3.17 116.94 113.91 1pwe h PHE 40 Ca -0.24 0.00 0.08 0.00 -0.20 0.00 0.00 57.97 57.61 1pwe h PHE 40 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.41 1pwe h PHE 40 CO 0.40 0.08 0.55 0.87 -2.00 0.00 0.00 178.31 178.21 1pwe h LYS 41 N 0.00 0.00 0.00 6.09 1.57 -1.92 0.21 116.57 122.52 1pwe h LYS 41 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1pwe h LYS 41 Cb 0.20 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 1pwe h LYS 41 CO 0.01 0.00 -0.08 0.97 -0.57 0.00 0.00 179.45 179.78 1pwe h ILE 42 N 0.00 0.32 0.00 1.86 6.09 -1.89 -1.74 117.51 122.15 1pwe h ILE 42 Ca 0.13 -0.50 0.00 0.00 -1.37 0.00 0.00 64.86 63.12 1pwe h ILE 42 Cb 1.22 1.37 0.00 0.00 0.47 0.00 0.00 36.82 39.88 1pwe h ILE 42 CO -0.00 0.08 0.00 0.54 -3.07 0.00 0.00 178.15 175.70 1pwe n ARG 43 N -3.37 0.00 -0.08 2.19 1.74 0.06 0.64 116.66 117.85 1pwe n ARG 43 Ca -0.01 0.53 -0.10 0.00 -0.77 0.00 0.00 57.85 57.50 1pwe n ARG 43 Cb 0.25 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 1pwe n ARG 43 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1pwe h GLY 44 N 0.00 0.40 0.94 -0.13 0.00 -1.54 0.05 103.07 102.80 1pwe h GLY 44 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 1pwe h GLY 44 CO 0.00 0.20 0.10 -2.22 0.00 0.00 0.00 176.54 174.62 1pwe h ILE 45 N 0.27 1.10 -1.00 2.60 1.08 -1.40 -1.45 117.51 118.70 1pwe h ILE 45 Ca 0.09 -0.28 0.01 0.00 -0.39 0.00 0.00 64.86 64.29 1pwe h ILE 45 Cb 0.15 0.94 -0.05 0.00 -3.07 0.00 0.00 36.82 34.80 1pwe h ILE 45 CO -0.01 0.10 0.66 1.23 -0.69 0.00 0.00 178.15 179.44 1pwe h GLY 46 N 0.20 1.42 0.83 5.37 0.00 0.30 0.77 103.07 111.97 1pwe h GLY 46 Ca 0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1pwe h GLY 46 CO -0.01 0.50 0.04 0.84 0.00 0.00 0.00 176.54 177.90 1pwe h HIS 47 N 1.34 0.23 -0.76 5.60 -0.00 -0.72 -0.92 115.15 119.92 1pwe h HIS 47 Ca 0.37 -0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.68 1pwe h HIS 47 Cb -0.13 -0.06 -0.03 0.00 -0.00 0.00 0.00 27.41 27.18 1pwe h HIS 47 CO -0.00 0.36 0.33 1.25 -0.00 0.00 0.00 177.93 179.88 1pwe h LEU 48 N 0.03 1.02 -0.34 0.26 7.12 -0.93 -2.04 115.31 120.43 1pwe h LEU 48 Ca 0.04 -0.15 -0.04 0.00 0.13 0.00 0.00 57.88 57.86 1pwe h LEU 48 Cb 0.25 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.10 1pwe h LEU 48 CO 0.00 0.89 0.05 0.00 -0.13 0.00 0.00 178.44 179.26 1pwe h LYS 50 N 0.40 0.66 -0.05 0.00 3.64 -1.03 0.16 116.57 120.36 1pwe h LYS 50 Ca 0.10 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1pwe h LYS 50 Cb 0.36 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1pwe h LYS 50 CO 0.01 0.55 0.01 1.98 -2.27 0.00 0.00 179.45 179.73 1pwe h MET 51 N 0.65 0.09 -0.55 1.90 4.05 -1.06 -2.33 114.93 117.69 1pwe h MET 51 Ca 0.16 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.48 1pwe h MET 51 Cb 0.15 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 1pwe h MET 51 CO -0.01 0.31 0.05 0.87 0.23 0.00 0.00 176.91 178.36 1pwe h LYS 52 N -0.15 0.91 -0.36 0.39 1.79 -0.72 -2.31 116.57 116.12 1pwe h LYS 52 Ca 0.02 -0.24 0.03 0.00 -2.18 0.00 0.00 60.65 58.28 1pwe h LYS 52 Cb 0.27 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.78 1pwe h LYS 52 CO 0.00 0.87 0.17 0.00 -1.08 0.00 0.00 179.45 179.41 1pwe h ALA 53 N 1.20 0.44 -0.91 3.86 0.00 -0.59 -0.48 119.26 122.78 1pwe h ALA 53 Ca 0.17 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1pwe h ALA 53 Cb 0.43 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1pwe h ALA 53 CO 0.02 -0.21 0.59 0.87 0.00 0.00 0.00 179.25 180.51 1pwe h LYS 54 N 0.35 1.08 -0.38 0.00 6.56 -1.14 -1.38 116.57 121.65 1pwe h LYS 54 Ca 0.15 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.68 1pwe h LYS 54 Cb 0.08 -0.24 0.00 0.00 -0.57 0.00 0.00 32.23 31.50 1pwe h LYS 54 CO -0.12 0.71 0.00 1.04 -2.06 0.00 0.00 179.45 179.02 1pwe n GLN 55 N -4.54 0.84 -0.34 3.15 6.02 -0.65 -4.83 117.38 117.04 1pwe n GLN 55 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1pwe n GLN 55 Cb 0.13 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1pwe n GLN 55 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1pwe n GLY 56 N 0.22 0.70 3.62 1.08 0.00 -0.52 -5.04 105.19 105.26 1pwe n GLY 56 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 1pwe n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwe n LYS 58 N 1.18 -0.86 -3.64 0.00 2.85 -0.31 -4.71 118.16 112.67 1pwe n LYS 58 Ca 0.10 -0.49 -0.04 0.00 -1.05 0.00 0.00 58.31 56.83 1pwe n LYS 58 Cb 0.31 -0.99 -0.07 0.00 -0.65 0.00 0.00 35.03 33.63 1pwe n LYS 58 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 1pwe s HIS 59 N -0.02 -0.58 -0.12 5.58 5.04 -1.22 -4.37 115.29 119.60 1pwe s HIS 59 Ca 0.00 1.20 -0.05 0.00 -1.54 0.00 0.00 55.06 54.67 1pwe s HIS 59 Cb 0.00 0.37 -0.04 0.00 0.04 0.00 0.00 32.58 32.95 1pwe s HIS 59 CO 0.00 -0.29 0.08 -0.06 -2.34 0.00 0.00 174.74 172.13 1pwe s PHE 60 N 1.12 3.39 -0.03 3.88 0.40 -0.63 -1.10 117.98 125.01 1pwe s PHE 60 Ca -0.06 0.34 0.04 0.00 -0.60 0.00 0.00 56.93 56.64 1pwe s PHE 60 Cb -0.04 -1.91 -0.00 0.00 0.51 0.00 0.00 43.02 41.57 1pwe s PHE 60 CO -0.13 0.55 -0.14 0.08 0.70 0.00 0.00 175.22 176.27 1pwe s VAL 61 N -0.74 1.19 0.01 -0.44 1.01 0.24 -0.04 120.40 121.63 1pwe s VAL 61 Ca 0.12 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 1pwe s VAL 61 Cb -0.12 -1.02 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 1pwe s VAL 61 CO 0.03 0.35 0.07 0.00 0.00 0.00 0.00 175.10 175.54 1pwe n SER 63 N 1.39 2.29 -4.20 0.00 3.41 -1.26 -0.73 113.62 114.52 1pwe n SER 63 Ca -0.23 -3.64 -0.32 0.00 -0.26 0.00 0.00 58.87 54.42 1pwe n SER 63 Cb 0.56 -0.55 -0.17 0.00 -0.26 0.00 0.00 64.21 63.79 1pwe n SER 63 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1pwe s SER 64 N -2.81 3.06 0.00 4.04 0.01 -1.26 -4.83 113.70 111.92 1pwe s SER 64 Ca 0.40 -0.56 0.28 0.00 1.31 0.00 0.00 55.95 57.37 1pwe s SER 64 Cb 0.36 -1.40 1.00 0.00 0.21 0.00 0.00 66.02 66.19 1pwe s SER 64 CO -0.01 0.14 1.73 0.00 0.41 0.00 0.00 173.24 175.50 1pwe n ALA 65 N 3.65 2.91 -1.62 1.44 0.00 -1.26 -2.80 120.51 122.83 1pwe n ALA 65 Ca -0.19 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1pwe n ALA 65 Cb 0.53 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1pwe n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pwe n GLY 66 N 1.36 1.52 0.36 0.00 0.00 -1.26 -4.73 105.19 102.44 1pwe n GLY 66 Ca 0.11 -1.64 0.10 0.00 0.00 0.00 0.00 46.02 44.59 1pwe n GLY 66 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1pwe h ASN 67 N 0.00 0.84 -0.43 1.61 2.35 -1.97 -0.99 115.58 116.99 1pwe h ASN 67 Ca 0.00 0.07 0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1pwe h ASN 67 Cb 0.00 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1pwe h ASN 67 CO 0.00 0.38 0.26 0.00 -1.65 0.00 0.00 177.43 176.42 1pwe h ALA 68 N 1.59 0.54 -0.43 -0.83 0.00 -1.92 0.29 119.26 118.51 1pwe h ALA 68 Ca 0.53 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.31 1pwe h ALA 68 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1pwe h ALA 68 CO -0.31 -0.05 -0.20 0.78 0.00 0.00 0.00 179.25 179.47 1pwe h GLY 69 N 0.53 0.96 1.00 0.00 0.00 -1.18 -0.16 103.07 104.21 1pwe h GLY 69 Ca 0.17 -0.86 0.01 0.00 0.00 0.00 0.00 47.33 46.65 1pwe h GLY 69 CO -0.07 0.78 0.42 -0.33 0.00 0.00 0.00 176.54 177.34 1pwe h MET 70 N 0.71 0.83 -0.62 4.80 2.07 -0.78 0.11 114.93 122.05 1pwe h MET 70 Ca 0.10 -0.05 0.01 0.00 -2.07 0.00 0.00 59.70 57.68 1pwe h MET 70 Cb 0.76 -0.19 -0.03 0.00 -1.87 0.00 0.00 31.60 30.27 1pwe h MET 70 CO 0.06 0.55 0.41 0.00 1.07 0.00 0.00 176.91 179.00 1pwe h ALA 71 N 1.24 0.79 0.27 6.32 0.00 -0.14 -0.38 119.26 127.36 1pwe h ALA 71 Ca 0.23 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1pwe h ALA 71 Cb -0.09 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1pwe h ALA 71 CO -0.05 0.22 -0.13 1.15 0.00 0.00 0.00 179.25 180.43 1pwe h THR 72 N 0.84 0.78 -0.74 0.00 2.02 -0.38 -0.64 112.91 114.79 1pwe h THR 72 Ca 0.23 -0.44 0.09 0.00 0.77 0.00 0.00 66.41 67.06 1pwe h THR 72 Cb -0.09 1.02 -0.07 0.00 -1.74 0.00 0.00 68.15 67.27 1pwe h THR 72 CO -0.05 0.09 0.39 0.00 0.37 0.00 0.00 175.52 176.32 1pwe h ALA 73 N 0.06 1.02 -0.43 6.16 0.00 -0.66 0.28 119.26 125.68 1pwe h ALA 73 Ca -0.04 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1pwe h ALA 73 Cb 0.43 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1pwe h ALA 73 CO 0.06 0.01 0.02 -0.92 0.00 0.00 0.00 179.25 178.43 1pwe h TYR 74 N 0.67 0.82 -0.35 0.00 3.20 -0.96 -0.92 116.97 119.43 1pwe h TYR 74 Ca 0.35 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1pwe h TYR 74 Cb 0.33 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1pwe h TYR 74 CO -0.09 0.80 0.17 0.00 -1.64 0.00 0.00 178.16 177.40 1pwe h ALA 75 N 0.91 0.45 0.08 1.82 0.00 -0.42 -1.49 119.26 120.62 1pwe h ALA 75 Ca 0.13 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1pwe h ALA 75 Cb 0.46 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1pwe h ALA 75 CO 0.02 0.01 -0.21 0.00 0.00 0.00 0.00 179.25 179.07 1pwe h ALA 76 N 1.03 -0.33 -0.41 0.00 0.00 -0.80 0.47 119.26 119.22 1pwe h ALA 76 Ca 0.12 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1pwe h ALA 76 Cb 0.11 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 1pwe h ALA 76 CO -0.02 -0.73 -0.11 -0.09 0.00 0.00 0.00 179.25 178.30 1pwe h ARG 77 N -0.38 -0.01 -0.05 0.00 2.43 -0.94 0.76 114.38 116.19 1pwe h ARG 77 Ca 0.03 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.16 1pwe h ARG 77 Cb 0.41 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1pwe h ARG 77 CO -0.13 -0.01 -0.16 0.00 -1.51 0.00 0.00 179.97 178.16 1pwe h ARG 78 N -0.01 0.08 -0.46 0.20 2.47 -0.85 -0.70 114.38 115.11 1pwe h ARG 78 Ca 0.20 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 1pwe h ARG 78 Cb 0.31 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 1pwe h ARG 78 CO -0.43 0.24 0.00 1.28 0.56 0.00 0.00 179.97 181.63 1pwe n LEU 79 N -4.31 2.35 -2.89 3.04 4.77 0.12 -4.91 117.00 115.18 1pwe n LEU 79 Ca -0.02 -1.18 -0.22 0.00 -0.03 0.00 0.00 56.01 54.56 1pwe n LEU 79 Cb 0.25 -0.32 0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1pwe n LEU 79 CO 0.37 0.52 -0.07 0.61 -1.33 0.00 0.00 177.39 177.49 1pwe n GLY 80 N 1.00 -0.52 3.34 -0.72 0.00 -0.27 -5.00 105.19 103.02 1pwe n GLY 80 Ca 0.13 0.10 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 1pwe n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwe s LEU 81 N -6.52 2.45 0.67 0.99 1.43 0.08 -5.01 118.68 112.77 1pwe s LEU 81 Ca 0.24 -0.88 -0.11 0.00 -1.03 0.00 0.00 54.13 52.35 1pwe s LEU 81 Cb -0.11 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.28 1pwe s LEU 81 CO 0.29 -0.04 1.05 -2.84 0.23 0.00 0.00 176.35 175.04 1pwe s PRO 82 N -2.89 3.20 -0.06 1.29 0.02 -1.26 -3.60 135.00 131.70 1pwe s PRO 82 Ca 0.17 0.86 -0.06 0.00 0.02 0.00 0.00 61.00 61.99 1pwe s PRO 82 Cb -0.05 -2.03 0.02 0.00 0.02 0.00 0.00 34.50 32.46 1pwe s PRO 82 CO 0.07 -0.89 0.16 0.00 -0.33 0.00 0.00 177.00 176.01 1pwe s ALA 83 N -3.11 -0.40 -0.08 -1.55 0.00 -1.26 -1.61 121.76 113.76 1pwe s ALA 83 Ca 0.57 0.46 0.02 0.00 0.00 0.00 0.00 51.96 53.01 1pwe s ALA 83 Cb -0.13 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.74 1pwe s ALA 83 CO 0.55 -0.08 -0.14 0.99 0.00 0.00 0.00 175.76 177.07 1pwe s THR 84 N 0.10 1.34 -0.19 0.00 2.01 0.94 -0.46 115.64 119.39 1pwe s THR 84 Ca -0.00 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.39 1pwe s THR 84 Cb -0.01 -1.22 -0.01 0.00 0.01 0.00 0.00 72.50 71.26 1pwe s THR 84 CO 0.00 0.40 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.65 1pwe s ILE 85 N 0.75 3.42 -0.28 1.82 -1.09 0.50 -1.54 121.20 124.79 1pwe s ILE 85 Ca -0.12 -0.50 -0.10 0.00 -2.23 0.00 0.00 60.65 57.70 1pwe s ILE 85 Cb -0.16 -2.52 -0.04 0.00 -1.58 0.00 0.00 42.46 38.16 1pwe s ILE 85 CO 0.03 0.46 0.16 -0.69 -1.23 0.00 0.00 174.94 173.66 1pwe s VAL 86 N 0.99 4.98 0.11 2.92 1.01 0.09 -0.04 120.40 130.46 1pwe s VAL 86 Ca -0.00 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.06 1pwe s VAL 86 Cb -0.15 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1pwe s VAL 86 CO 0.00 0.25 -0.16 0.68 0.00 0.00 0.00 175.10 175.88 1pwe s VAL 87 N 1.71 1.37 0.64 2.92 -7.23 -0.56 -4.30 120.40 114.96 1pwe s VAL 87 Ca 0.07 -1.59 -0.15 0.00 -1.81 0.00 0.00 61.98 58.50 1pwe s VAL 87 Cb -0.16 -1.44 -0.01 0.00 0.56 0.00 0.00 36.38 35.33 1pwe s VAL 87 CO 0.09 -0.30 1.08 -2.16 -0.31 0.00 0.00 175.10 173.50 1pwe s PRO 88 N -2.30 3.01 0.53 4.82 0.04 -1.26 -1.33 135.00 138.52 1pwe s PRO 88 Ca 0.06 1.26 0.36 0.00 0.04 0.00 0.00 61.00 62.71 1pwe s PRO 88 Cb -0.07 -1.99 1.95 0.00 0.04 0.00 0.00 34.50 34.43 1pwe s PRO 88 CO 0.03 -1.06 2.10 0.66 0.04 0.00 0.00 177.00 178.77 1pwe h SER 89 N 0.08 0.00 -0.38 6.66 4.64 0.57 -2.70 113.55 122.42 1pwe h SER 89 Ca -0.46 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.63 1pwe h SER 89 Cb 1.23 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.21 1pwe h SER 89 CO 0.56 0.00 0.30 0.35 -0.87 0.00 0.00 176.83 177.16 1pwe n THR 90 N -2.76 2.25 -4.42 2.95 -2.24 -1.26 -4.85 114.28 103.94 1pwe n THR 90 Ca -0.02 -1.10 -0.34 0.00 -2.27 0.00 0.00 64.05 60.32 1pwe n THR 90 Cb 0.06 -1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 67.09 1pwe n THR 90 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1pwe s THR 91 N -1.57 4.11 0.36 4.28 2.01 -1.02 -5.08 115.64 118.73 1pwe s THR 91 Ca 0.23 -0.31 -0.28 0.00 0.31 0.00 0.00 61.69 61.64 1pwe s THR 91 Cb 0.19 -2.74 -0.11 0.00 0.01 0.00 0.00 72.50 69.85 1pwe s THR 91 CO 0.02 0.58 1.49 -2.84 -0.69 0.00 0.00 174.62 173.17 1pwe s PRO 92 N -0.56 4.13 0.30 4.92 0.02 -1.26 -4.90 135.00 137.64 1pwe s PRO 92 Ca 0.09 2.55 -0.01 0.00 0.02 0.00 0.00 61.00 63.66 1pwe s PRO 92 Cb -0.12 -2.98 0.49 0.00 0.02 0.00 0.00 34.50 31.91 1pwe s PRO 92 CO 0.02 -0.53 1.93 0.00 -0.33 0.00 0.00 177.00 178.09 1pwe h ALA 93 N 3.31 1.47 -0.10 -1.55 0.00 -1.98 -1.10 119.26 119.31 1pwe h ALA 93 Ca -0.50 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1pwe h ALA 93 Cb 1.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1pwe h ALA 93 CO 0.67 0.43 -0.18 1.25 0.00 0.00 0.00 179.25 181.41 1pwe h LEU 94 N 1.08 0.15 -0.26 0.00 7.12 -2.00 -1.17 115.31 120.24 1pwe h LEU 94 Ca 0.36 -0.03 -0.20 0.00 0.13 0.00 0.00 57.88 58.14 1pwe h LEU 94 Cb 0.08 -0.04 0.00 0.00 -0.53 0.00 0.00 40.66 40.17 1pwe h LEU 94 CO -0.12 0.35 -0.70 0.74 -0.13 0.00 0.00 178.44 178.59 1pwe h THR 95 N 0.15 1.29 -0.53 1.05 2.02 -1.59 -2.68 112.91 112.62 1pwe h THR 95 Ca 0.03 -1.92 -0.08 0.00 0.77 0.00 0.00 66.41 65.21 1pwe h THR 95 Cb 0.41 1.89 -0.02 0.00 -1.74 0.00 0.00 68.15 68.69 1pwe h THR 95 CO 0.03 0.61 0.02 0.40 0.37 0.00 0.00 175.52 176.94 1pwe h ILE 96 N 0.53 1.25 -0.72 3.11 2.04 -0.93 -2.76 117.51 120.04 1pwe h ILE 96 Ca -0.03 -1.03 -0.02 0.00 1.00 0.00 0.00 64.86 64.78 1pwe h ILE 96 Cb 1.31 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1pwe h ILE 96 CO 0.14 0.37 0.39 -0.33 0.00 0.00 0.00 178.15 178.72 1pwe h GLU 97 N 0.83 1.01 -0.62 2.37 4.39 -1.15 0.74 114.58 122.15 1pwe h GLU 97 Ca 0.16 -0.12 0.06 0.00 0.34 0.00 0.00 59.36 59.80 1pwe h GLU 97 Cb 0.47 -0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 28.87 1pwe h GLU 97 CO 0.02 0.76 0.33 -0.09 -1.16 0.00 0.00 179.01 178.87 1pwe h ARG 98 N 1.00 0.59 0.25 2.33 2.43 -1.20 0.17 114.38 119.94 1pwe h ARG 98 Ca 0.25 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1pwe h ARG 98 Cb 0.05 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1pwe h ARG 98 CO -0.04 0.39 -0.12 -0.07 -1.51 0.00 0.00 179.97 178.62 1pwe h LEU 99 N 0.61 -0.28 -1.18 3.80 4.07 -1.10 -2.97 115.31 118.26 1pwe h LEU 99 Ca 0.28 -0.02 0.05 0.00 0.08 0.00 0.00 57.88 58.26 1pwe h LEU 99 Cb 0.19 0.07 -0.05 0.00 1.08 0.00 0.00 40.66 41.95 1pwe h LEU 99 CO -0.19 -0.17 0.57 0.11 -1.08 0.00 0.00 178.44 177.69 1pwe h LYS 100 N -0.38 1.01 0.00 1.13 1.57 -0.17 -1.33 116.57 118.39 1pwe h LYS 100 Ca -0.03 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1pwe h LYS 100 Cb 0.29 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1pwe h LYS 100 CO 0.06 0.67 0.00 0.09 -0.57 0.00 0.00 179.45 179.69 1pwe n ASN 101 N -4.46 0.00 -1.23 0.86 3.02 0.54 -1.03 115.26 112.96 1pwe n ASN 101 Ca 0.12 -0.12 0.12 0.00 -0.03 0.00 0.00 54.58 54.67 1pwe n ASN 101 Cb 0.15 -0.17 0.26 0.00 -0.61 0.00 0.00 39.78 39.42 1pwe n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1pwe n GLU 102 N -1.17 2.57 -0.74 3.52 -0.58 -0.51 -4.91 120.64 118.83 1pwe n GLU 102 Ca 0.08 -2.41 0.00 0.00 -0.42 0.00 0.00 57.16 54.41 1pwe n GLU 102 Cb 0.08 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.41 1pwe n GLU 102 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1pwe n GLY 103 N 1.57 0.62 3.92 0.62 0.00 -0.20 -4.63 105.19 107.09 1pwe n GLY 103 Ca 0.21 -0.13 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1pwe n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwe s ALA 104 N -2.00 3.61 -0.05 4.61 0.00 -1.22 -4.63 121.76 122.08 1pwe s ALA 104 Ca 0.00 -0.67 -0.16 0.00 0.00 0.00 0.00 51.96 51.13 1pwe s ALA 104 Cb 0.00 -2.29 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 1pwe s ALA 104 CO 0.00 0.05 0.42 0.99 0.00 0.00 0.00 175.76 177.22 1pwe s THR 105 N -2.28 5.09 -0.20 0.00 2.01 0.39 -4.36 115.64 116.29 1pwe s THR 105 Ca 0.43 0.86 -0.01 0.00 0.31 0.00 0.00 61.69 63.28 1pwe s THR 105 Cb -0.10 -3.74 0.01 0.00 0.01 0.00 0.00 72.50 68.68 1pwe s THR 105 CO 0.35 0.48 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.94 1pwe s VAL 106 N -0.42 2.55 -0.53 3.82 1.01 -1.26 -0.37 120.40 125.20 1pwe s VAL 106 Ca 0.24 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 61.19 1pwe s VAL 106 Cb -0.16 -2.15 0.08 0.00 0.00 0.00 0.00 36.38 34.15 1pwe s VAL 106 CO 0.12 0.44 0.61 -0.70 0.00 0.00 0.00 175.10 175.56 1pwe s GLU 107 N 1.34 3.06 -0.40 2.72 2.56 0.94 -4.96 118.70 123.97 1pwe s GLU 107 Ca 0.04 -1.18 -0.25 0.00 0.00 0.00 0.00 54.97 53.59 1pwe s GLU 107 Cb -0.14 -4.18 0.02 0.00 2.00 0.00 0.00 34.13 31.83 1pwe s GLU 107 CO -0.09 -1.31 0.86 0.08 -0.56 0.00 0.00 175.26 174.24 1pwe s VAL 108 N 2.41 4.62 0.00 3.70 1.01 -1.26 -1.49 120.40 129.39 1pwe s VAL 108 Ca 0.11 0.91 0.00 0.00 0.00 0.00 0.00 61.98 63.00 1pwe s VAL 108 Cb -0.23 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 31.84 1pwe s VAL 108 CO 0.08 -0.58 0.00 0.55 0.00 0.00 0.00 175.10 175.15 1pwe n VAL 109 N 6.02 0.00 0.00 2.92 3.14 -0.44 -4.92 118.33 125.05 1pwe n VAL 109 Ca 0.05 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 1pwe n VAL 109 Cb 0.48 -1.05 0.00 0.00 -1.06 0.00 0.00 33.84 32.21 1pwe n VAL 109 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pwe n GLY 110 N 5.00 -1.33 0.05 7.55 0.00 -1.26 -2.55 105.19 112.64 1pwe n GLY 110 Ca 0.00 -1.45 0.11 0.00 0.00 0.00 0.00 46.02 44.69 1pwe n GLY 110 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1pwe n GLU 111 N 0.00 0.50 -2.73 1.61 0.28 -1.26 0.71 120.64 119.74 1pwe n GLU 111 Ca 0.00 -0.03 -0.43 0.00 -0.16 0.00 0.00 57.16 56.55 1pwe n GLU 111 Cb 0.00 -1.64 -0.03 0.00 1.43 0.00 0.00 31.44 31.20 1pwe n GLU 111 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1pwe s MET 112 N -3.35 4.01 0.35 3.44 -1.94 -1.26 -4.82 119.30 115.73 1pwe s MET 112 Ca -0.01 0.89 0.14 0.00 -1.71 0.00 0.00 55.69 55.00 1pwe s MET 112 Cb 0.13 -3.74 1.02 0.00 2.01 0.00 0.00 34.83 34.24 1pwe s MET 112 CO 0.83 -0.85 1.72 -0.07 -0.01 0.00 0.00 175.02 176.64 1pwe h LEU 113 N 9.93 0.56 -1.87 -0.03 4.07 -2.02 0.25 115.31 126.21 1pwe h LEU 113 Ca -0.22 0.14 0.04 0.00 0.08 0.00 0.00 57.88 57.91 1pwe h LEU 113 Cb 1.07 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.85 1pwe h LEU 113 CO 0.99 0.03 0.17 0.44 -1.08 0.00 0.00 178.44 178.99 1pwe h ASP 114 N 0.45 0.15 -0.14 -0.43 3.32 -2.00 -1.93 116.42 115.84 1pwe h ASP 114 Ca 0.66 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.71 1pwe h ASP 114 Cb 1.48 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.99 1pwe h ASP 114 CO -0.46 0.10 0.08 -0.08 -1.72 0.00 0.00 179.24 177.16 1pwe h GLU 115 N 0.18 0.19 -0.16 3.56 4.81 -0.89 -0.61 114.58 121.66 1pwe h GLU 115 Ca 0.10 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1pwe h GLU 115 Cb 0.20 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1pwe h GLU 115 CO -0.02 0.20 -0.01 0.00 -0.73 0.00 0.00 179.01 178.46 1pwe h ALA 116 N 0.98 0.13 -0.35 2.92 0.00 -1.40 -1.36 119.26 120.17 1pwe h ALA 116 Ca 0.05 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1pwe h ALA 116 Cb 0.07 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1pwe h ALA 116 CO -0.01 -0.45 0.22 0.82 0.00 0.00 0.00 179.25 179.83 1pwe h ILE 117 N 0.04 1.07 -0.48 0.00 2.04 -1.21 -2.38 117.51 116.59 1pwe h ILE 117 Ca 0.07 -0.16 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 1pwe h ILE 117 Cb 0.09 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1pwe h ILE 117 CO -0.13 0.08 -0.23 1.56 0.00 0.00 0.00 178.15 179.44 1pwe h GLN 118 N 0.45 1.00 -0.72 2.37 4.20 -0.93 -1.85 115.11 119.64 1pwe h GLN 118 Ca 0.13 -0.43 -0.01 0.00 0.06 0.00 0.00 58.65 58.40 1pwe h GLN 118 Cb -0.03 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 1pwe h GLN 118 CO -0.04 1.11 0.42 1.25 -0.67 0.00 0.00 178.83 180.90 1pwe h LEU 119 N 0.86 0.88 0.20 1.46 5.85 -1.19 0.39 115.31 123.75 1pwe h LEU 119 Ca 0.11 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1pwe h LEU 119 Cb 0.81 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1pwe h LEU 119 CO 0.07 0.70 -0.17 0.00 -0.34 0.00 0.00 178.44 178.69 1pwe h ALA 120 N 1.22 -0.37 -0.89 1.25 0.00 -1.27 -1.06 119.26 118.13 1pwe h ALA 120 Ca 0.26 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1pwe h ALA 120 Cb -0.01 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1pwe h ALA 120 CO -0.05 -0.73 0.54 0.87 0.00 0.00 0.00 179.25 179.89 1pwe h LYS 121 N -0.39 1.21 -0.67 0.00 1.57 -0.89 -1.99 116.57 115.41 1pwe h LYS 121 Ca -0.00 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1pwe h LYS 121 Cb 0.36 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1pwe h LYS 121 CO -0.03 0.85 0.36 0.00 -0.57 0.00 0.00 179.45 180.06 1pwe h ALA 122 N 1.29 0.86 -0.84 3.86 0.00 -0.01 0.61 119.26 125.03 1pwe h ALA 122 Ca 0.32 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1pwe h ALA 122 Cb -0.05 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.42 1pwe h ALA 122 CO -0.06 0.39 0.55 -0.07 0.00 0.00 0.00 179.25 180.05 1pwe h LEU 123 N 0.92 0.92 0.00 0.00 3.38 -0.75 0.28 115.31 120.06 1pwe h LEU 123 Ca 0.24 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1pwe h LEU 123 Cb 0.05 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1pwe h LEU 123 CO -0.04 0.65 -0.00 -0.08 0.09 0.00 0.00 178.44 179.06 1pwe h GLU 124 N 1.09 -0.00 -0.49 1.13 4.81 -0.71 -2.26 114.58 118.15 1pwe h GLU 124 Ca 0.32 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.49 1pwe h GLU 124 Cb -0.05 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1pwe h GLU 124 CO -0.09 0.29 0.05 -0.22 -0.73 0.00 0.00 179.01 178.31 1pwe h LYS 125 N -0.29 0.79 0.00 1.92 3.64 -0.52 -3.04 116.57 119.06 1pwe h LYS 125 Ca -0.00 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1pwe h LYS 125 Cb 0.29 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1pwe h LYS 125 CO 0.00 0.76 -0.15 0.09 -2.27 0.00 0.00 179.45 177.88 1pwe n ASN 126 N -4.24 0.26 -3.98 4.20 4.13 0.94 -4.75 115.26 111.82 1pwe n ASN 126 Ca 0.03 0.32 -0.30 0.00 1.68 0.00 0.00 54.58 56.30 1pwe n ASN 126 Cb 0.27 -0.33 -0.16 0.00 -1.54 0.00 0.00 39.78 38.02 1pwe n ASN 126 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1pwe s ASN 127 N -3.27 3.39 0.07 6.41 0.01 -0.85 -5.06 114.94 115.63 1pwe s ASN 127 Ca 0.12 -0.89 -0.32 0.00 -0.71 0.00 0.00 52.86 51.06 1pwe s ASN 127 Cb 0.17 -1.20 -0.11 0.00 0.41 0.00 0.00 41.25 40.52 1pwe s ASN 127 CO 0.59 -0.16 1.82 -2.65 -1.51 0.00 0.00 177.10 175.19 1pwe n PRO 128 N 4.70 2.54 -0.07 -0.60 -0.02 -1.26 -1.96 135.00 138.33 1pwe n PRO 128 Ca -0.14 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1pwe n PRO 128 Cb 0.46 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 1pwe n PRO 128 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pwe n GLY 129 N 4.17 0.48 3.75 -1.23 0.00 -1.26 -4.84 105.19 106.25 1pwe n GLY 129 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1pwe n GLY 129 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pwe s TRP 130 N -2.19 3.75 -0.11 1.61 0.52 -0.83 -1.16 118.94 120.54 1pwe s TRP 130 Ca 0.00 1.46 0.03 0.00 0.02 0.00 0.00 56.10 57.61 1pwe s TRP 130 Cb 0.00 -2.78 0.01 0.00 -1.15 0.00 0.00 33.47 29.54 1pwe s TRP 130 CO 0.00 0.32 -0.21 0.08 0.02 0.00 0.00 176.95 177.16 1pwe s VAL 131 N -0.23 1.88 -0.29 4.03 1.01 -0.26 -4.82 120.40 121.71 1pwe s VAL 131 Ca 0.37 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 1pwe s VAL 131 Cb -0.21 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 1pwe s VAL 131 CO 0.23 0.52 0.64 -0.47 0.00 0.00 0.00 175.10 176.02 1pwe s TYR 132 N 0.59 3.23 -0.54 5.22 6.04 -1.26 -0.59 117.35 130.04 1pwe s TYR 132 Ca -0.14 0.66 -0.22 0.00 0.04 0.00 0.00 57.07 57.41 1pwe s TYR 132 Cb -0.17 -2.97 0.05 0.00 -1.04 0.00 0.00 41.96 37.83 1pwe s TYR 132 CO 0.04 -0.44 0.81 0.42 -1.54 0.00 0.00 175.55 174.84 1pwe s ILE 133 N 2.61 4.58 -0.43 3.14 -1.09 0.13 -4.95 121.20 125.20 1pwe s ILE 133 Ca 0.26 -0.06 0.03 0.00 -2.23 0.00 0.00 60.65 58.64 1pwe s ILE 133 Cb -0.15 -4.45 0.12 0.00 -1.58 0.00 0.00 42.46 36.41 1pwe s ILE 133 CO 0.11 -1.00 0.19 -0.55 -1.23 0.00 0.00 174.94 172.46 1pwe s SER 134 N 2.82 4.08 0.60 3.58 0.15 -1.26 -4.52 113.70 119.14 1pwe s SER 134 Ca 0.24 -2.51 0.30 0.00 0.70 0.00 0.00 55.95 54.68 1pwe s SER 134 Cb -0.15 -1.28 1.84 0.00 -1.71 0.00 0.00 66.02 64.72 1pwe s SER 134 CO 0.16 -0.30 2.24 -0.65 1.20 0.00 0.00 173.24 175.89 1pwe h PRO 135 N 7.01 0.00 -0.46 5.44 0.11 -1.94 -2.28 132.00 139.88 1pwe h PRO 135 Ca -0.05 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1pwe h PRO 135 Cb 0.95 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1pwe h PRO 135 CO 0.55 0.00 0.30 0.35 -0.21 0.00 0.00 178.00 178.98 1pwe h PHE 136 N 0.00 0.59 0.00 0.65 3.04 -1.97 -3.34 116.94 115.91 1pwe h PHE 136 Ca 0.01 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.97 1pwe h PHE 136 Cb 0.07 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 38.38 1pwe h PHE 136 CO 0.00 0.38 0.00 -0.40 -2.02 0.00 0.00 178.31 176.27 1pwe n ASP 137 N -4.46 0.34 -4.28 0.41 5.68 -1.08 -0.81 116.55 112.35 1pwe n ASP 137 Ca 0.04 -1.15 -0.44 0.00 -0.50 0.00 0.00 54.79 52.73 1pwe n ASP 137 Cb 0.06 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 39.98 1pwe n ASP 137 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1pwe s ASP 138 N -0.15 6.09 0.66 -1.12 3.68 -0.88 -4.89 116.67 120.06 1pwe s ASP 138 Ca 0.00 -1.94 0.35 0.00 2.13 0.00 0.00 52.55 53.09 1pwe s ASP 138 Cb 0.00 -2.15 1.90 0.00 -1.45 0.00 0.00 42.92 41.23 1pwe s ASP 138 CO 0.00 -0.77 2.08 1.55 0.13 0.00 0.00 175.17 178.16 1pwe h PRO 139 N 8.61 0.00 -0.03 4.34 0.13 -1.90 -0.97 132.00 142.19 1pwe h PRO 139 Ca -0.23 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.85 1pwe h PRO 139 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1pwe h PRO 139 CO 0.95 0.00 -0.21 -0.07 -0.23 0.00 0.00 178.00 178.44 1pwe h LEU 140 N 0.00 0.05 -0.16 1.56 4.07 -1.97 -2.50 115.31 116.36 1pwe h LEU 140 Ca 0.01 -0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.86 1pwe h LEU 140 Cb 0.45 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.17 1pwe h LEU 140 CO -0.00 0.26 -0.27 0.40 -1.08 0.00 0.00 178.44 177.75 1pwe h ILE 141 N 0.05 1.35 -0.81 1.22 2.04 -1.45 -2.82 117.51 117.08 1pwe h ILE 141 Ca 0.01 -1.51 -0.04 0.00 1.00 0.00 0.00 64.86 64.33 1pwe h ILE 141 Cb 0.40 1.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 1pwe h ILE 141 CO 0.03 0.45 0.37 -0.50 0.00 0.00 0.00 178.15 178.50 1pwe h TRP 142 N 0.09 1.19 -0.02 1.37 6.55 -1.64 -0.78 115.95 122.71 1pwe h TRP 142 Ca 0.01 -0.07 0.01 0.00 0.95 0.00 0.00 58.89 59.79 1pwe h TRP 142 Cb 0.85 -0.37 -0.00 0.00 -0.86 0.00 0.00 29.16 28.79 1pwe h TRP 142 CO 0.09 0.88 0.02 0.93 -1.05 0.00 0.00 178.44 179.31 1pwe h GLU 143 N 1.16 0.00 0.00 0.49 5.08 -1.45 -1.27 114.58 118.59 1pwe h GLU 143 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1pwe h GLU 143 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1pwe h GLU 143 CO -0.03 0.00 0.00 0.78 -1.00 0.00 0.00 179.01 178.76 1pwe h GLY 144 N 0.00 0.00 2.00 -3.84 0.00 -0.87 -2.66 103.07 97.70 1pwe h GLY 144 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1pwe h GLY 144 CO -0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.54 176.99 1pwe h HIS 145 N 0.00 0.00 -1.57 5.60 3.86 -1.15 -3.13 115.15 118.75 1pwe h HIS 145 Ca 0.00 0.00 0.48 0.00 -1.16 0.00 0.00 60.37 59.69 1pwe h HIS 145 Cb 0.51 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.88 1pwe h HIS 145 CO 0.00 0.00 1.08 0.00 0.86 0.00 0.00 177.93 179.87 1pwe h THR 146 N 0.00 0.10 -0.90 2.45 1.03 -1.56 -0.51 112.91 113.52 1pwe h THR 146 Ca 0.00 -0.01 0.22 0.00 -0.01 0.00 0.00 66.41 66.61 1pwe h THR 146 Cb 0.91 0.06 -0.06 0.00 -1.07 0.00 0.00 68.15 67.99 1pwe h THR 146 CO 0.00 0.01 0.61 0.77 -0.01 0.00 0.00 175.52 176.90 1pwe h SER 147 N 0.04 0.30 -0.34 0.00 4.64 -1.82 -1.21 113.55 115.15 1pwe h SER 147 Ca 0.84 0.03 0.05 0.00 -0.47 0.00 0.00 61.79 62.25 1pwe h SER 147 Cb 3.04 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 65.06 1pwe h SER 147 CO -0.21 0.11 0.05 0.25 -0.87 0.00 0.00 176.83 176.16 1pwe h LEU 148 N 0.29 -0.02 -0.45 5.97 6.46 -1.40 -1.09 115.31 125.07 1pwe h LEU 148 Ca 0.46 0.06 -0.15 0.00 -0.12 0.00 0.00 57.88 58.14 1pwe h LEU 148 Cb 1.34 0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 41.34 1pwe h LEU 148 CO -0.14 0.03 -0.34 0.58 -0.62 0.00 0.00 178.44 177.95 1pwe h VAL 149 N 0.17 1.27 -0.88 1.05 2.07 -1.43 -2.53 116.25 115.96 1pwe h VAL 149 Ca 0.16 -1.51 0.07 0.00 0.82 0.00 0.00 66.70 66.25 1pwe h VAL 149 Cb 0.19 1.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.21 1pwe h VAL 149 CO -0.22 0.51 0.57 0.11 0.02 0.00 0.00 177.57 178.56 1pwe h LYS 150 N 0.77 0.94 -0.59 1.57 1.57 -1.18 0.31 116.57 119.97 1pwe h LYS 150 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1pwe h LYS 150 Cb 0.92 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.99 1pwe h LYS 150 CO 0.09 0.62 0.23 0.93 -0.57 0.00 0.00 179.45 180.75 1pwe h GLU 151 N 0.97 0.88 -0.76 3.15 5.08 -0.88 -1.41 114.58 121.61 1pwe h GLU 151 Ca 0.39 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1pwe h GLU 151 Cb 0.25 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1pwe h GLU 151 CO -0.15 0.76 0.42 -0.07 -1.00 0.00 0.00 179.01 178.97 1pwe h LEU 152 N 0.82 0.96 -0.38 1.33 3.38 -0.78 -1.48 115.31 119.16 1pwe h LEU 152 Ca 0.20 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1pwe h LEU 152 Cb 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1pwe h LEU 152 CO -0.02 0.78 0.20 0.50 0.09 0.00 0.00 178.44 179.99 1pwe h LYS 153 N 1.06 0.39 0.00 1.13 1.63 -0.50 0.15 116.57 120.42 1pwe h LYS 153 Ca 0.27 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.04 1pwe h LYS 153 Cb 0.04 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 1pwe h LYS 153 CO -0.04 0.26 0.00 1.05 -3.45 0.00 0.00 179.45 177.27 1pwe h GLU 154 N 0.40 0.00 0.01 1.90 4.11 -0.93 -3.35 114.58 116.72 1pwe h GLU 154 Ca 0.16 0.00 -0.42 0.00 0.07 0.00 0.00 59.36 59.17 1pwe h GLU 154 Cb 0.05 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.24 1pwe h GLU 154 CO -0.10 0.00 -2.39 2.41 0.07 0.00 0.00 179.01 179.00 1pwe n THR 155 N -2.44 1.53 -2.31 -1.06 -1.04 -0.59 -4.96 114.28 103.42 1pwe n THR 155 Ca 0.04 -0.44 -0.40 0.00 -2.04 0.00 0.00 64.05 61.22 1pwe n THR 155 Cb 0.39 -1.73 -0.03 0.00 -1.82 0.00 0.00 70.33 67.14 1pwe n THR 155 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1pwe s LEU 156 N -7.18 4.38 0.09 -4.42 1.43 0.49 -4.94 118.68 108.53 1pwe s LEU 156 Ca -0.36 2.41 -0.05 0.00 -1.03 0.00 0.00 54.13 55.10 1pwe s LEU 156 Cb 0.12 -3.79 -0.23 0.00 0.03 0.00 0.00 46.19 42.32 1pwe s LEU 156 CO 0.55 -0.45 1.18 0.77 0.23 0.00 0.00 176.35 178.63 1pwe h SER 157 N 3.23 0.50 -4.30 2.29 4.64 -1.88 -3.46 113.55 114.58 1pwe h SER 157 Ca -0.48 -0.49 -0.48 0.00 -0.47 0.00 0.00 61.79 59.87 1pwe h SER 157 Cb 1.22 -0.16 -0.26 0.00 -0.31 0.00 0.00 62.40 62.90 1pwe h SER 157 CO 0.65 1.35 -0.81 0.00 -0.87 0.00 0.00 176.83 177.15 1pwe s ALA 158 N -2.84 1.29 0.32 5.18 0.00 -1.26 -5.11 121.76 119.34 1pwe s ALA 158 Ca -0.05 -0.84 -0.29 0.00 0.00 0.00 0.00 51.96 50.78 1pwe s ALA 158 Cb 0.07 -0.23 -0.12 0.00 0.00 0.00 0.00 23.12 22.84 1pwe s ALA 158 CO 0.89 0.27 1.52 0.36 0.00 0.00 0.00 175.76 178.79 1pwe n LYS 159 N 2.02 2.59 -1.35 0.00 2.85 -1.26 -4.92 118.16 118.09 1pwe n LYS 159 Ca -0.17 0.92 -0.34 0.00 -1.05 0.00 0.00 58.31 57.66 1pwe n LYS 159 Cb 0.54 -2.65 0.10 0.00 -0.65 0.00 0.00 35.03 32.37 1pwe n LYS 159 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1pwe s PRO 160 N -1.16 1.98 0.23 -1.58 0.04 -1.26 -4.82 135.00 128.43 1pwe s PRO 160 Ca 0.60 1.83 -0.02 0.00 0.04 0.00 0.00 61.00 63.45 1pwe s PRO 160 Cb -0.51 -1.81 0.23 0.00 0.04 0.00 0.00 34.50 32.45 1pwe s PRO 160 CO 0.55 -1.97 1.62 0.78 0.04 0.00 0.00 177.00 178.02 1pwe h GLY 161 N -0.40 0.68 -2.45 0.56 0.00 -0.85 -3.46 103.07 97.16 1pwe h GLY 161 Ca -0.48 -0.63 0.08 0.00 0.00 0.00 0.00 47.33 46.30 1pwe h GLY 161 CO 0.49 0.57 0.31 0.00 0.00 0.00 0.00 176.54 177.91 1pwe s ALA 162 N -4.39 -1.47 -0.11 3.60 0.00 -1.26 -4.43 121.76 113.70 1pwe s ALA 162 Ca -0.08 0.11 -0.02 0.00 0.00 0.00 0.00 51.96 51.98 1pwe s ALA 162 Cb 0.13 0.77 0.04 0.00 0.00 0.00 0.00 23.12 24.05 1pwe s ALA 162 CO 0.82 -0.94 -0.00 -1.50 0.00 0.00 0.00 175.76 174.14 1pwe s ILE 163 N -3.65 0.53 -0.20 0.00 -1.16 -0.41 -1.59 121.20 114.71 1pwe s ILE 163 Ca 0.08 -0.14 -0.15 0.00 -0.51 0.00 0.00 60.65 59.93 1pwe s ILE 163 Cb -0.03 -0.76 -0.04 0.00 0.61 0.00 0.00 42.46 42.24 1pwe s ILE 163 CO -0.00 0.15 0.37 -0.69 -2.81 0.00 0.00 174.94 171.95 1pwe s VAL 164 N 1.89 5.22 0.05 4.00 1.01 0.85 -1.51 120.40 131.92 1pwe s VAL 164 Ca 0.03 0.64 -0.03 0.00 0.00 0.00 0.00 61.98 62.62 1pwe s VAL 164 Cb -0.14 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1pwe s VAL 164 CO -0.06 0.27 0.04 -1.48 0.00 0.00 0.00 175.10 173.87 1pwe s LEU 165 N 1.20 2.13 -0.36 3.92 0.05 -0.95 -0.78 118.68 123.89 1pwe s LEU 165 Ca 0.18 -0.82 -0.18 0.00 0.05 0.00 0.00 54.13 53.36 1pwe s LEU 165 Cb -0.14 0.44 -0.00 0.00 -2.05 0.00 0.00 46.19 44.44 1pwe s LEU 165 CO 0.07 -0.60 0.49 -0.55 -0.55 0.00 0.00 176.35 175.22 1pwe s SER 166 N -2.69 6.29 0.22 1.48 0.15 -1.26 -1.35 113.70 116.54 1pwe s SER 166 Ca 0.03 -0.11 -0.08 0.00 0.70 0.00 0.00 55.95 56.49 1pwe s SER 166 Cb 0.05 -2.26 0.35 0.00 -1.71 0.00 0.00 66.02 62.45 1pwe s SER 166 CO -0.09 -0.48 1.70 0.58 1.20 0.00 0.00 173.24 176.15 1pwe h VAL 167 N 5.62 0.59 0.00 4.45 2.07 -1.54 -3.44 116.25 124.00 1pwe h VAL 167 Ca -0.28 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1pwe h VAL 167 Cb 1.13 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1pwe h VAL 167 CO 0.77 0.05 0.00 0.61 0.02 0.00 0.00 177.57 179.02 1pwe n GLY 168 N -1.33 3.37 0.01 2.17 0.00 -1.26 -0.32 105.19 107.82 1pwe n GLY 168 Ca 0.11 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1pwe n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwe n GLY 169 N 0.00 -1.33 0.00 -0.02 0.00 -1.26 -4.91 105.19 97.66 1pwe n GLY 169 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1pwe n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwe n GLY 170 N 1.36 1.83 0.26 -0.02 0.00 0.57 -4.58 105.19 104.61 1pwe n GLY 170 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.09 1pwe n GLY 170 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1pwe h GLY 171 N 0.00 0.08 0.90 -0.02 0.00 -1.90 -0.88 103.07 101.24 1pwe h GLY 171 Ca 0.00 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.63 1pwe h GLY 171 CO 0.00 -0.20 0.51 -2.00 0.00 0.00 0.00 176.54 174.84 1pwe h LEU 172 N -0.13 0.85 0.53 3.11 5.85 -1.89 -0.10 115.31 123.53 1pwe h LEU 172 Ca 0.21 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1pwe h LEU 172 Cb 0.45 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 41.30 1pwe h LEU 172 CO -0.51 0.59 -0.25 0.25 -0.34 0.00 0.00 178.44 178.17 1pwe h LEU 173 N 1.00 -0.60 -0.35 2.25 5.85 -1.53 -1.23 115.31 120.70 1pwe h LEU 173 Ca 0.31 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.10 1pwe h LEU 173 Cb -0.01 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.13 1pwe h LEU 173 CO -0.10 -0.43 0.07 0.00 -0.34 0.00 0.00 178.44 177.64 1pwe h GLY 175 N 0.19 1.19 1.06 0.00 0.00 -0.93 -1.94 103.07 102.64 1pwe h GLY 175 Ca 0.17 -0.48 -0.10 0.00 0.00 0.00 0.00 47.33 46.92 1pwe h GLY 175 CO -0.22 0.47 -0.07 -2.08 0.00 0.00 0.00 176.54 174.63 1pwe h VAL 176 N 1.14 1.27 -0.22 4.60 2.07 -0.57 0.41 116.25 124.94 1pwe h VAL 176 Ca 0.30 -1.21 -0.21 0.00 0.82 0.00 0.00 66.70 66.40 1pwe h VAL 176 Cb -0.07 0.98 0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1pwe h VAL 176 CO -0.06 0.43 -0.67 -0.37 0.02 0.00 0.00 177.57 176.91 1pwe h VAL 177 N 0.84 1.27 -0.31 2.57 -1.51 -1.18 0.37 116.25 118.31 1pwe h VAL 177 Ca 0.14 -1.86 -0.01 0.00 -1.23 0.00 0.00 66.70 63.74 1pwe h VAL 177 Cb 0.63 1.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.58 1pwe h VAL 177 CO 0.04 0.60 0.13 1.56 -1.23 0.00 0.00 177.57 178.67 1pwe h GLN 178 N 0.61 0.43 0.05 5.19 4.20 -1.26 -0.08 115.11 124.24 1pwe h GLN 178 Ca -0.02 -0.05 -0.20 0.00 0.06 0.00 0.00 58.65 58.44 1pwe h GLN 178 Cb 1.29 -0.09 0.02 0.00 0.30 0.00 0.00 27.48 29.01 1pwe h GLN 178 CO 0.14 0.35 -0.83 0.78 -0.67 0.00 0.00 178.83 178.61 1pwe h GLY 179 N 0.56 0.53 0.87 3.46 0.00 -0.65 -2.48 103.07 105.37 1pwe h GLY 179 Ca 0.11 -1.02 0.10 0.00 0.00 0.00 0.00 47.33 46.52 1pwe h GLY 179 CO -0.01 0.90 0.48 -2.00 0.00 0.00 0.00 176.54 175.91 1pwe h LEU 180 N -0.02 0.53 0.47 3.11 5.85 0.31 -0.86 115.31 124.71 1pwe h LEU 180 Ca -0.12 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1pwe h LEU 180 Cb 1.55 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.49 1pwe h LEU 180 CO 0.16 0.31 -0.23 0.03 -0.34 0.00 0.00 178.44 178.37 1pwe h ARG 181 N 0.58 -0.61 0.00 1.25 3.08 -0.95 0.57 114.38 118.30 1pwe h ARG 181 Ca 0.34 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.43 1pwe h ARG 181 Cb 0.54 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1pwe h ARG 181 CO -0.12 -0.34 0.00 -0.85 -1.07 0.00 0.00 179.97 177.59 1pwe n GLU 182 N -5.21 0.09 0.02 0.04 0.28 -0.94 -1.13 120.64 113.79 1pwe n GLU 182 Ca -0.09 0.49 0.11 0.00 -0.16 0.00 0.00 57.16 57.51 1pwe n GLU 182 Cb 0.29 -1.74 0.08 0.00 1.43 0.00 0.00 31.44 31.49 1pwe n GLU 182 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1pwe n VAL 183 N -1.93 0.13 -0.33 3.84 0.31 -0.36 -4.96 118.33 115.02 1pwe n VAL 183 Ca 0.01 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1pwe n VAL 183 Cb 0.10 0.27 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 1pwe n VAL 183 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pwe n GLY 184 N 1.41 0.83 2.22 2.92 0.00 -0.28 -4.98 105.19 107.31 1pwe n GLY 184 Ca 0.03 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1pwe n GLY 184 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pwe n TRP 185 N -2.33 3.05 0.00 1.61 8.01 0.16 -4.79 117.44 123.15 1pwe n TRP 185 Ca 0.00 -2.71 0.00 0.00 -1.31 0.00 0.00 57.50 53.48 1pwe n TRP 185 Cb 0.00 -1.00 0.00 0.00 -2.01 0.00 0.00 31.31 28.30 1pwe n TRP 185 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.69 175.83 1pwe n GLU 186 N -0.83 0.00 0.00 -0.99 0.00 -1.18 -1.33 120.64 116.31 1pwe n GLU 186 Ca 0.55 0.34 0.06 0.00 0.00 0.00 0.00 57.16 58.12 1pwe n GLU 186 Cb 0.77 -1.64 0.02 0.00 0.00 0.00 0.00 31.44 30.60 1pwe n GLU 186 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1pwe n ASP 187 N -1.34 1.70 -4.65 -1.84 3.85 -1.26 -4.76 116.55 108.25 1pwe n ASP 187 Ca 0.00 -1.35 -0.43 0.00 -0.71 0.00 0.00 54.79 52.31 1pwe n ASP 187 Cb 0.14 0.27 -0.02 0.00 -1.35 0.00 0.00 41.12 40.16 1pwe n ASP 187 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1pwe s VAL 188 N -1.39 3.82 0.49 2.12 1.01 -0.45 -4.93 120.40 121.08 1pwe s VAL 188 Ca 0.13 0.97 -0.23 0.00 0.00 0.00 0.00 61.98 62.85 1pwe s VAL 188 Cb 0.11 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.73 1pwe s VAL 188 CO 0.25 -0.16 1.25 -2.16 0.00 0.00 0.00 175.10 174.29 1pwe s PRO 189 N 4.06 3.54 -0.19 2.72 0.04 -1.26 -4.82 135.00 139.09 1pwe s PRO 189 Ca 0.67 1.99 -0.02 0.00 0.04 0.00 0.00 61.00 63.68 1pwe s PRO 189 Cb -0.27 -2.38 -0.01 0.00 0.04 0.00 0.00 34.50 31.88 1pwe s PRO 189 CO 0.25 -0.79 -0.08 0.42 0.04 0.00 0.00 177.00 176.84 1pwe s ILE 190 N -1.43 3.19 -0.62 0.56 1.01 0.07 -1.29 121.20 122.69 1pwe s ILE 190 Ca 0.66 -0.57 -0.17 0.00 0.00 0.00 0.00 60.65 60.57 1pwe s ILE 190 Cb -0.34 -2.41 0.13 0.00 0.01 0.00 0.00 42.46 39.85 1pwe s ILE 190 CO 0.41 0.46 0.65 -0.63 0.00 0.00 0.00 174.94 175.83 1pwe s ILE 191 N 1.11 5.10 -0.58 2.92 1.01 -0.57 -0.09 121.20 130.11 1pwe s ILE 191 Ca 0.01 -1.46 -0.23 0.00 0.00 0.00 0.00 60.65 58.97 1pwe s ILE 191 Cb -0.15 -4.44 0.05 0.00 0.01 0.00 0.00 42.46 37.94 1pwe s ILE 191 CO -0.02 -1.02 0.92 0.00 0.00 0.00 0.00 174.94 174.82 1pwe s ALA 192 N 1.84 3.17 0.36 9.38 0.00 -0.23 -2.24 121.76 134.04 1pwe s ALA 192 Ca 0.10 -1.46 -0.14 0.00 0.00 0.00 0.00 51.96 50.46 1pwe s ALA 192 Cb -0.24 -3.73 -0.08 0.00 0.00 0.00 0.00 23.12 19.07 1pwe s ALA 192 CO 0.02 -2.46 0.77 -1.64 0.00 0.00 0.00 175.76 172.45 1pwe s MET 193 N 3.85 3.96 0.14 0.00 -1.94 -0.46 -1.58 119.30 123.27 1pwe s MET 193 Ca 0.26 0.66 -0.24 0.00 -1.71 0.00 0.00 55.69 54.66 1pwe s MET 193 Cb -0.14 -2.39 0.07 0.00 2.01 0.00 0.00 34.83 34.37 1pwe s MET 193 CO 0.16 0.08 0.71 -1.83 -0.01 0.00 0.00 175.02 174.12 1pwe s GLU 194 N -3.26 1.26 0.16 2.03 -1.05 -0.92 -1.37 118.70 115.56 1pwe s GLU 194 Ca 0.54 -0.53 0.03 0.00 -0.15 0.00 0.00 54.97 54.86 1pwe s GLU 194 Cb -0.10 0.54 -0.03 0.00 -0.44 0.00 0.00 34.13 34.09 1pwe s GLU 194 CO 0.21 -0.56 0.28 0.95 0.95 0.00 0.00 175.26 177.09 1pwe s THR 195 N -3.61 5.24 0.63 1.83 -4.23 -1.25 -0.13 115.64 114.11 1pwe s THR 195 Ca 0.04 -0.77 -0.19 0.00 -1.18 0.00 0.00 61.69 59.60 1pwe s THR 195 Cb -0.02 -3.72 -0.02 0.00 1.34 0.00 0.00 72.50 70.08 1pwe s THR 195 CO -0.08 -0.13 1.29 -0.36 -0.54 0.00 0.00 174.62 174.80 1pwe s PHE 196 N -1.78 2.16 0.00 3.99 0.08 0.23 -4.80 117.98 117.86 1pwe s PHE 196 Ca 0.34 1.48 0.00 0.00 0.12 0.00 0.00 56.93 58.87 1pwe s PHE 196 Cb -0.11 -3.67 0.00 0.00 -0.57 0.00 0.00 43.02 38.67 1pwe s PHE 196 CO 0.28 -2.80 0.00 0.41 -0.10 0.00 0.00 175.22 173.01 1pwe n GLY 197 N 0.81 3.56 0.09 4.36 0.00 -1.26 -4.82 105.19 107.94 1pwe n GLY 197 Ca 0.15 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 1pwe n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pwe n ALA 198 N -3.00 1.56 -2.50 4.61 0.00 -1.26 -4.96 120.51 114.96 1pwe n ALA 198 Ca 0.00 -1.23 -0.23 0.00 0.00 0.00 0.00 53.44 51.99 1pwe n ALA 198 Cb 0.00 -0.16 -0.12 0.00 0.00 0.00 0.00 19.45 19.17 1pwe n ALA 198 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1pwe s HIS 199 N -2.47 1.78 0.28 0.00 3.76 -1.26 -5.15 115.29 112.23 1pwe s HIS 199 Ca -0.09 -0.45 0.02 0.00 -0.15 0.00 0.00 55.06 54.40 1pwe s HIS 199 Cb 0.06 -0.93 -0.06 0.00 1.11 0.00 0.00 32.58 32.76 1pwe s HIS 199 CO 0.77 0.26 0.07 -1.54 -0.85 0.00 0.00 174.74 173.45 1pwe s SER 200 N -2.28 1.71 0.35 1.40 1.04 -1.26 -5.14 113.70 109.53 1pwe s SER 200 Ca 0.11 -1.36 0.08 0.00 0.48 0.00 0.00 55.95 55.26 1pwe s SER 200 Cb -0.08 0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.06 1pwe s SER 200 CO 0.05 -0.65 0.24 -0.36 0.98 0.00 0.00 173.24 173.50 1pwe s PHE 201 N -3.54 2.78 0.10 5.02 0.08 -1.26 -5.07 117.98 116.09 1pwe s PHE 201 Ca 0.36 -0.38 -0.31 0.00 0.12 0.00 0.00 56.93 56.72 1pwe s PHE 201 Cb 0.08 -1.80 -0.09 0.00 -0.57 0.00 0.00 43.02 40.64 1pwe s PHE 201 CO 0.14 0.20 1.66 -1.01 -0.10 0.00 0.00 175.22 176.10 1pwe s HIS 202 N -2.40 2.54 1.07 0.36 3.76 -1.26 -4.97 115.29 114.39 1pwe s HIS 202 Ca 0.41 0.35 -0.15 0.00 -0.15 0.00 0.00 55.06 55.51 1pwe s HIS 202 Cb -0.03 -3.98 0.13 0.00 1.11 0.00 0.00 32.58 29.80 1pwe s HIS 202 CO 0.25 -3.89 0.44 0.00 -0.85 0.00 0.00 174.74 170.68 1pwe n ALA 203 N 5.21 -3.16 -2.45 -1.40 0.00 -1.26 -4.92 120.51 112.53 1pwe n ALA 203 Ca 0.16 -1.02 -0.22 0.00 0.00 0.00 0.00 53.44 52.36 1pwe n ALA 203 Cb 0.40 -1.76 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 1pwe n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pwe s ALA 204 N -2.35 2.44 0.05 0.00 0.00 -0.90 -4.94 121.76 116.06 1pwe s ALA 204 Ca 0.60 -1.79 -0.18 0.00 0.00 0.00 0.00 51.96 50.59 1pwe s ALA 204 Cb -0.18 0.74 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 1pwe s ALA 204 CO 0.66 -0.34 0.52 0.14 0.00 0.00 0.00 175.76 176.74 1pwe s VAL 205 N -3.34 4.83 0.00 0.00 -7.23 -1.25 -2.26 120.40 111.16 1pwe s VAL 205 Ca 0.33 1.11 0.00 0.00 -1.81 0.00 0.00 61.98 61.61 1pwe s VAL 205 Cb 0.07 -3.84 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1pwe s VAL 205 CO 0.15 0.55 0.00 1.17 -0.31 0.00 0.00 175.10 176.66 1pwe n LYS 206 N 1.81 0.00 -3.51 4.82 4.81 0.20 -4.95 118.16 121.35 1pwe n LYS 206 Ca -0.11 0.00 -0.40 0.00 -0.87 0.00 0.00 58.31 56.93 1pwe n LYS 206 Cb 0.51 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.52 1pwe n LYS 206 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1pwe s GLU 207 N 1.89 3.63 0.00 1.64 -1.05 -1.26 -4.62 118.70 118.92 1pwe s GLU 207 Ca 0.00 -3.19 0.00 0.00 -0.15 0.00 0.00 54.97 51.63 1pwe s GLU 207 Cb 0.00 -4.20 0.00 0.00 -0.44 0.00 0.00 34.13 29.49 1pwe s GLU 207 CO 0.00 -1.25 0.00 0.41 0.95 0.00 0.00 175.26 175.37 1pwe n GLY 208 N 2.59 2.10 0.00 -3.83 0.00 -1.26 -5.03 105.19 99.75 1pwe n GLY 208 Ca 0.21 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1pwe n GLY 208 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1pwe n LYS 209 N 0.00 0.00 -1.04 1.61 2.85 -1.26 -5.05 118.16 115.26 1pwe n LYS 209 Ca 0.00 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.92 1pwe n LYS 209 Cb 0.00 0.00 0.10 0.00 -0.65 0.00 0.00 35.03 34.48 1pwe n LYS 209 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 1pwe n LEU 210 N 0.00 0.71 0.00 -5.58 -0.00 -1.22 0.61 117.00 111.51 1pwe n LEU 210 Ca 0.00 0.48 0.00 0.00 -0.00 0.00 0.00 56.01 56.49 1pwe n LEU 210 Cb 0.00 -1.24 0.00 0.00 -0.00 0.00 0.00 43.42 42.18 1pwe n LEU 210 CO 0.00 -3.21 0.00 0.55 -0.00 0.00 0.00 177.39 174.73 1pwe n VAL 211 N -3.00 0.00 -3.33 1.47 3.14 -0.96 -4.76 118.33 110.90 1pwe n VAL 211 Ca 0.09 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.09 1pwe n VAL 211 Cb 0.52 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 33.24 1pwe n VAL 211 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1pwe s THR 212 N -1.35 5.13 0.54 1.55 2.01 -1.26 -2.11 115.64 120.15 1pwe s THR 212 Ca 0.00 0.97 -0.12 0.00 0.31 0.00 0.00 61.69 62.85 1pwe s THR 212 Cb 0.00 -3.82 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 1pwe s THR 212 CO 0.00 0.37 0.96 -0.76 -0.69 0.00 0.00 174.62 174.50 1pwe s LEU 213 N 0.30 3.48 0.22 4.42 1.43 -1.26 -4.72 118.68 122.55 1pwe s LEU 213 Ca 0.26 1.38 -0.31 0.00 -1.03 0.00 0.00 54.13 54.43 1pwe s LEU 213 Cb -0.16 -4.36 -0.11 0.00 0.03 0.00 0.00 46.19 41.59 1pwe s LEU 213 CO 0.11 -0.68 1.62 -2.84 0.23 0.00 0.00 176.35 174.80 1pwe s PRO 214 N -4.59 4.16 0.31 1.29 0.02 -1.26 -4.81 135.00 130.12 1pwe s PRO 214 Ca 0.55 2.50 0.03 0.00 0.02 0.00 0.00 61.00 64.10 1pwe s PRO 214 Cb -0.10 -3.09 0.78 0.00 0.02 0.00 0.00 34.50 32.10 1pwe s PRO 214 CO 0.42 -0.66 1.58 -0.22 -0.33 0.00 0.00 177.00 177.80 1pwe h LYS 215 N 6.26 0.03 -0.85 5.54 3.64 -1.96 0.60 116.57 129.83 1pwe h LYS 215 Ca -0.44 -0.00 0.25 0.00 -1.27 0.00 0.00 60.65 59.19 1pwe h LYS 215 Cb 1.21 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1pwe h LYS 215 CO 0.90 0.02 0.75 0.82 -2.27 0.00 0.00 179.45 179.66 1pwe h ILE 216 N 0.03 0.33 0.00 2.00 1.08 -1.91 -1.41 117.51 117.63 1pwe h ILE 216 Ca 0.60 0.00 -0.33 0.00 -0.39 0.00 0.00 64.86 64.75 1pwe h ILE 216 Cb 1.27 0.44 -0.06 0.00 -3.07 0.00 0.00 36.82 35.40 1pwe h ILE 216 CO -0.88 0.00 -2.02 0.35 -0.69 0.00 0.00 178.15 174.91 1pwe n THR 217 N -3.84 1.51 -0.18 -0.27 -2.24 0.21 -3.30 114.28 106.16 1pwe n THR 217 Ca 0.18 -0.82 0.04 0.00 -2.27 0.00 0.00 64.05 61.17 1pwe n THR 217 Cb 1.04 -0.79 0.31 0.00 -2.10 0.00 0.00 70.33 68.79 1pwe n THR 217 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1pwe h SER 218 N 0.00 0.74 -0.17 3.42 0.02 -1.11 0.29 113.55 116.73 1pwe h SER 218 Ca -0.41 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.33 1pwe h SER 218 Cb 2.12 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 64.50 1pwe h SER 218 CO 0.06 0.51 -0.67 1.62 -1.14 0.00 0.00 176.83 177.20 1pwe h VAL 219 N 0.86 1.29 -0.39 2.27 3.04 -1.66 -0.60 116.25 121.06 1pwe h VAL 219 Ca 0.29 -1.88 -0.07 0.00 -1.01 0.00 0.00 66.70 64.02 1pwe h VAL 219 Cb 0.07 1.94 -0.02 0.00 -2.01 0.00 0.00 31.29 31.27 1pwe h VAL 219 CO -0.08 0.60 -0.04 0.00 -1.01 0.00 0.00 177.57 177.03 1pwe h ALA 220 N 0.56 1.21 -0.14 3.17 0.00 -1.34 -2.21 119.26 120.52 1pwe h ALA 220 Ca -0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1pwe h ALA 220 Cb 1.30 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1pwe h ALA 220 CO 0.14 0.52 -0.12 -0.22 0.00 0.00 0.00 179.25 179.57 1pwe h LYS 221 N 0.60 0.32 0.00 0.00 3.64 -0.39 0.26 116.57 121.00 1pwe h LYS 221 Ca 0.12 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1pwe h LYS 221 Cb 0.44 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1pwe h LYS 221 CO 0.02 0.70 -0.07 0.00 -2.27 0.00 0.00 179.45 177.83 1pwe h ALA 222 N 0.62 1.79 0.00 5.00 0.00 -0.91 -2.74 119.26 123.01 1pwe h ALA 222 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1pwe h ALA 222 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1pwe h ALA 222 CO 0.03 0.09 -1.88 1.28 0.00 0.00 0.00 179.25 178.77 1pwe n LEU 223 N -4.31 0.09 -3.61 0.00 4.77 -0.85 -5.01 117.00 108.08 1pwe n LEU 223 Ca -0.03 -0.05 -0.23 0.00 -0.03 0.00 0.00 56.01 55.68 1pwe n LEU 223 Cb 0.15 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.31 1pwe n LEU 223 CO 0.34 0.02 0.14 0.61 -1.33 0.00 0.00 177.39 177.17 1pwe n GLY 224 N 1.31 -0.45 3.79 -0.72 0.00 0.91 -5.01 105.19 105.02 1pwe n GLY 224 Ca -0.03 0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1pwe n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwe s VAL 225 N -3.37 3.46 -0.94 1.61 0.11 -1.19 -5.06 120.40 115.02 1pwe s VAL 225 Ca 0.35 -1.52 -0.12 0.00 -2.93 0.00 0.00 61.98 57.76 1pwe s VAL 225 Cb -0.16 -3.12 0.24 0.00 -1.53 0.00 0.00 36.38 31.81 1pwe s VAL 225 CO 0.76 -0.21 0.90 0.20 -3.33 0.00 0.00 175.10 173.41 1pwe s ASN 226 N -3.90 6.94 0.48 3.54 0.01 -1.26 -4.58 114.94 116.17 1pwe s ASN 226 Ca 0.38 -3.07 0.03 0.00 -0.71 0.00 0.00 52.86 49.49 1pwe s ASN 226 Cb -0.05 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.38 1pwe s ASN 226 CO 0.25 -0.45 0.01 0.42 -1.51 0.00 0.00 177.10 175.81 1pwe s THR 227 N -0.44 1.42 0.54 1.60 -4.23 -1.26 -4.86 115.64 108.41 1pwe s THR 227 Ca 0.23 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.98 1pwe s THR 227 Cb -0.10 -2.43 0.31 0.00 1.34 0.00 0.00 72.50 71.62 1pwe s THR 227 CO -0.09 0.00 2.19 1.62 -0.54 0.00 0.00 174.62 177.80 1pwe h VAL 228 N 1.49 0.73 -0.43 2.29 3.04 -1.26 0.32 116.25 122.42 1pwe h VAL 228 Ca -0.44 -0.10 -0.10 0.00 -1.01 0.00 0.00 66.70 65.05 1pwe h VAL 228 Cb 1.29 1.06 -0.02 0.00 -2.01 0.00 0.00 31.29 31.61 1pwe h VAL 228 CO 0.76 0.02 -0.15 1.23 -1.01 0.00 0.00 177.57 178.43 1pwe h GLY 229 N 0.12 0.88 0.86 3.17 0.00 -1.81 0.41 103.07 106.70 1pwe h GLY 229 Ca -0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.58 1pwe h GLY 229 CO 0.00 0.64 -0.07 0.00 0.00 0.00 0.00 176.54 177.11 1pwe h ALA 230 N 1.11 0.36 -0.69 3.60 0.00 -0.68 -1.36 119.26 121.59 1pwe h ALA 230 Ca 0.11 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1pwe h ALA 230 Cb 0.65 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1pwe h ALA 230 CO 0.05 0.17 0.46 0.37 0.00 0.00 0.00 179.25 180.30 1pwe h GLN 231 N 0.26 0.91 -0.52 0.00 5.75 -0.91 -0.90 115.11 119.69 1pwe h GLN 231 Ca 0.07 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.45 1pwe h GLN 231 Cb 0.54 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 1pwe h GLN 231 CO 0.03 0.60 0.11 1.15 -2.65 0.00 0.00 178.83 178.06 1pwe h THR 232 N 0.94 1.25 -0.06 2.39 2.02 -0.56 -0.64 112.91 118.24 1pwe h THR 232 Ca 0.26 -0.91 0.01 0.00 0.77 0.00 0.00 66.41 66.54 1pwe h THR 232 Cb -0.10 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1pwe h THR 232 CO -0.06 0.33 0.00 0.25 0.37 0.00 0.00 175.52 176.42 1pwe h LEU 233 N 0.74 -0.01 0.26 2.58 5.85 -0.23 -0.45 115.31 124.04 1pwe h LEU 233 Ca 0.16 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1pwe h LEU 233 Cb 0.37 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1pwe h LEU 233 CO 0.01 0.00 -0.37 0.50 -0.34 0.00 0.00 178.44 178.24 1pwe h LYS 234 N 0.03 -0.66 -0.14 1.25 3.64 -1.05 -2.32 116.57 117.31 1pwe h LYS 234 Ca 0.03 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1pwe h LYS 234 Cb 0.03 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1pwe h LYS 234 CO -0.04 -0.44 0.11 -0.07 -2.27 0.00 0.00 179.45 176.74 1pwe h LEU 235 N -0.68 0.00 -2.36 5.20 4.07 -0.93 -1.63 115.31 118.97 1pwe h LEU 235 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1pwe h LEU 235 Cb 0.66 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 1pwe h LEU 235 CO -0.13 0.00 -0.03 0.15 -1.08 0.00 0.00 178.44 177.35 1pwe h PHE 236 N 0.00 0.00 0.00 1.13 -0.00 -0.49 -1.46 116.94 116.12 1pwe h PHE 236 Ca 0.06 0.00 -0.06 0.00 -0.00 0.00 0.00 57.97 57.98 1pwe h PHE 236 Cb 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.23 1pwe h PHE 236 CO 0.00 0.03 -1.77 0.66 -0.00 0.00 0.00 178.31 177.24 1pwe n TYR 237 N -3.71 0.31 1.30 0.41 4.02 -0.63 -4.28 117.16 114.59 1pwe n TYR 237 Ca -0.03 0.09 0.13 0.00 -0.01 0.00 0.00 57.90 58.09 1pwe n TYR 237 Cb 0.12 -0.71 0.36 0.00 -0.02 0.00 0.00 39.34 39.09 1pwe n TYR 237 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1pwe n GLU 238 N -2.47 1.88 -3.76 -0.72 1.02 -0.68 -4.94 120.64 110.97 1pwe n GLU 238 Ca -0.07 -1.30 -0.13 0.00 -0.02 0.00 0.00 57.16 55.64 1pwe n GLU 238 Cb 0.66 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.51 1pwe n GLU 238 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1pwe s HIS 239 N -2.02 -0.22 -0.75 -0.32 2.46 -0.64 -5.05 115.29 108.74 1pwe s HIS 239 Ca 0.34 0.42 -0.26 0.00 0.47 0.00 0.00 55.06 56.03 1pwe s HIS 239 Cb 0.21 0.10 -0.07 0.00 -0.13 0.00 0.00 32.58 32.68 1pwe s HIS 239 CO 0.33 -0.33 2.14 -1.25 -2.47 0.00 0.00 174.74 173.17 1pwe s PRO 240 N -0.91 2.21 -0.10 2.88 0.04 -1.26 -4.78 135.00 133.08 1pwe s PRO 240 Ca -0.10 0.36 0.03 0.00 0.04 0.00 0.00 61.00 61.33 1pwe s PRO 240 Cb -0.05 -4.79 0.01 0.00 0.04 0.00 0.00 34.50 29.72 1pwe s PRO 240 CO 0.03 -3.58 -0.19 0.42 0.04 0.00 0.00 177.00 173.72 1pwe s ILE 241 N 11.66 1.74 -0.43 0.56 1.01 -1.26 -0.75 121.20 133.73 1pwe s ILE 241 Ca 0.80 -0.82 -0.13 0.00 0.00 0.00 0.00 60.65 60.51 1pwe s ILE 241 Cb -0.11 -1.54 0.06 0.00 0.01 0.00 0.00 42.46 40.88 1pwe s ILE 241 CO 0.10 0.49 0.30 -0.36 0.00 0.00 0.00 174.94 175.47 1pwe s PHE 242 N 0.61 3.27 -0.51 3.97 0.40 0.87 -4.96 117.98 121.63 1pwe s PHE 242 Ca -0.14 -1.03 -0.27 0.00 -0.60 0.00 0.00 56.93 54.89 1pwe s PHE 242 Cb -0.17 -2.86 0.03 0.00 0.51 0.00 0.00 43.02 40.53 1pwe s PHE 242 CO 0.04 -0.74 1.08 0.45 0.70 0.00 0.00 175.22 176.75 1pwe s SER 243 N 2.10 6.51 -0.11 1.36 0.15 -1.26 -1.07 113.70 121.38 1pwe s SER 243 Ca 0.03 0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.88 1pwe s SER 243 Cb -0.22 -2.51 -0.01 0.00 -1.71 0.00 0.00 66.02 61.56 1pwe s SER 243 CO 0.06 -1.27 -0.16 -0.70 1.20 0.00 0.00 173.24 172.37 1pwe s GLU 244 N 4.38 3.20 0.06 5.44 2.56 -0.62 -4.90 118.70 128.83 1pwe s GLU 244 Ca 0.42 -0.73 0.02 0.00 0.00 0.00 0.00 54.97 54.67 1pwe s GLU 244 Cb -0.08 -2.52 -0.04 0.00 2.00 0.00 0.00 34.13 33.48 1pwe s GLU 244 CO 0.27 0.25 0.11 0.54 -0.56 0.00 0.00 175.26 175.87 1pwe s VAL 245 N 0.22 4.75 0.09 3.70 0.11 -1.26 -2.15 120.40 125.87 1pwe s VAL 245 Ca -0.10 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.33 1pwe s VAL 245 Cb -0.16 -3.28 -0.04 0.00 -1.53 0.00 0.00 36.38 31.37 1pwe s VAL 245 CO 0.06 0.17 -0.03 -0.51 -3.33 0.00 0.00 175.10 171.45 1pwe s ILE 246 N -1.38 0.46 0.39 7.04 1.10 0.82 -4.92 121.20 124.71 1pwe s ILE 246 Ca 0.29 -1.89 -0.11 0.00 -0.51 0.00 0.00 60.65 58.43 1pwe s ILE 246 Cb -0.12 -1.71 -0.07 0.00 0.15 0.00 0.00 42.46 40.71 1pwe s ILE 246 CO 0.22 -0.83 0.76 -0.94 -2.11 0.00 0.00 174.94 172.04 1pwe s SER 247 N -3.01 6.54 0.39 4.50 1.04 -1.26 -0.60 113.70 121.30 1pwe s SER 247 Ca 0.13 1.14 0.13 0.00 0.48 0.00 0.00 55.95 57.82 1pwe s SER 247 Cb 0.07 -2.32 0.94 0.00 0.10 0.00 0.00 66.02 64.80 1pwe s SER 247 CO -0.05 -0.37 1.88 0.44 0.98 0.00 0.00 173.24 176.12 1pwe h ASP 248 N 1.37 0.52 0.10 7.02 3.45 -1.95 -0.77 116.42 126.16 1pwe h ASP 248 Ca -0.47 0.03 -0.00 0.00 0.43 0.00 0.00 57.03 57.02 1pwe h ASP 248 Cb 1.19 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.89 1pwe h ASP 248 CO 0.64 0.26 -0.05 1.56 -1.57 0.00 0.00 179.24 180.08 1pwe h GLN 249 N 0.55 -0.13 -0.48 3.56 7.50 -1.99 -1.10 115.11 123.03 1pwe h GLN 249 Ca 0.42 0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.57 1pwe h GLN 249 Cb 0.83 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 28.37 1pwe h GLN 249 CO -0.17 0.07 0.26 0.93 -1.50 0.00 0.00 178.83 178.42 1pwe h GLU 250 N -0.31 0.65 0.02 1.46 5.08 -1.66 0.66 114.58 120.49 1pwe h GLU 250 Ca -0.01 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1pwe h GLU 250 Cb 0.26 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1pwe h GLU 250 CO 0.02 0.48 -0.01 0.00 -1.00 0.00 0.00 179.01 178.50 1pwe h ALA 251 N 1.63 -0.03 -0.47 3.43 0.00 -0.97 -0.78 119.26 122.06 1pwe h ALA 251 Ca 0.17 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1pwe h ALA 251 Cb 0.02 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1pwe h ALA 251 CO -0.03 -0.39 0.10 0.28 0.00 0.00 0.00 179.25 179.21 1pwe h VAL 252 N -0.29 1.21 -0.53 0.00 2.07 -0.75 -1.38 116.25 116.59 1pwe h VAL 252 Ca -0.00 -0.77 -0.10 0.00 0.82 0.00 0.00 66.70 66.65 1pwe h VAL 252 Cb 0.27 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1pwe h VAL 252 CO 0.01 0.28 -0.07 0.74 0.02 0.00 0.00 177.57 178.55 1pwe h THR 253 N 0.69 1.26 -0.81 2.57 2.02 -0.77 -2.13 112.91 115.74 1pwe h THR 253 Ca 0.15 -1.19 0.08 0.00 0.77 0.00 0.00 66.41 66.23 1pwe h THR 253 Cb 0.28 0.93 -0.07 0.00 -1.74 0.00 0.00 68.15 67.55 1pwe h THR 253 CO 0.00 0.42 0.47 0.00 0.37 0.00 0.00 175.52 176.78 1pwe h ALA 254 N 1.06 1.13 0.23 6.16 0.00 -0.08 0.91 119.26 128.66 1pwe h ALA 254 Ca 0.15 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1pwe h ALA 254 Cb 0.60 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1pwe h ALA 254 CO 0.04 0.14 -0.33 0.82 0.00 0.00 0.00 179.25 179.92 1pwe h ILE 255 N 0.83 0.32 -0.08 0.00 2.04 -0.72 0.35 117.51 120.24 1pwe h ILE 255 Ca 0.37 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.26 1pwe h ILE 255 Cb 0.28 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1pwe h ILE 255 CO -0.22 0.00 -0.09 -0.33 0.00 0.00 0.00 178.15 177.52 1pwe h GLU 256 N -0.62 -0.11 -0.75 2.37 5.08 -0.90 -0.35 114.58 119.31 1pwe h GLU 256 Ca 0.00 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 1pwe h GLU 256 Cb 0.60 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1pwe h GLU 256 CO -0.12 -0.07 0.46 0.87 -1.00 0.00 0.00 179.01 179.15 1pwe h LYS 257 N -0.11 0.85 -0.45 2.33 1.57 -0.59 -2.50 116.57 117.67 1pwe h LYS 257 Ca 0.06 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 1pwe h LYS 257 Cb 0.20 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1pwe h LYS 257 CO -0.15 0.56 -0.24 0.35 -0.57 0.00 0.00 179.45 179.40 1pwe h PHE 258 N 0.87 1.07 0.00 -1.35 3.57 0.20 -0.62 116.94 120.69 1pwe h PHE 258 Ca 0.32 -0.27 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1pwe h PHE 258 Cb 0.10 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1pwe h PHE 258 CO -0.05 1.07 -0.23 -0.24 -2.23 0.00 0.00 178.31 176.63 1pwe h VAL 259 N 0.80 0.88 0.23 1.41 3.04 -0.83 0.19 116.25 121.96 1pwe h VAL 259 Ca 0.10 -0.90 -0.33 0.00 -1.01 0.00 0.00 66.70 64.56 1pwe h VAL 259 Cb 0.81 1.53 0.03 0.00 -2.01 0.00 0.00 31.29 31.65 1pwe h VAL 259 CO 0.07 0.23 -1.48 0.44 -1.01 0.00 0.00 177.57 175.82 1pwe h ASP 260 N 0.00 0.77 0.06 3.17 3.45 -1.24 -1.07 116.42 121.56 1pwe h ASP 260 Ca -0.00 -0.93 -0.18 0.00 0.43 0.00 0.00 57.03 56.35 1pwe h ASP 260 Cb 0.51 -0.25 0.02 0.00 -0.56 0.00 0.00 39.33 39.05 1pwe h ASP 260 CO 0.03 1.70 -0.73 0.44 -1.57 0.00 0.00 179.24 179.11 1pwe h ASP 261 N 0.08 0.54 -0.03 6.45 3.45 -0.91 -3.39 116.42 122.61 1pwe h ASP 261 Ca -0.27 -0.84 0.00 0.00 0.43 0.00 0.00 57.03 56.36 1pwe h ASP 261 Cb 2.11 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 40.71 1pwe h ASP 261 CO 0.24 1.32 0.00 -0.62 -1.57 0.00 0.00 179.24 178.61 1pwe n GLU 262 N -4.15 0.19 -2.62 3.56 4.71 0.64 -4.96 120.64 118.01 1pwe n GLU 262 Ca -0.12 -0.93 -0.20 0.00 -0.01 0.00 0.00 57.16 55.90 1pwe n GLU 262 Cb 0.75 -1.09 0.01 0.00 -1.01 0.00 0.00 31.44 30.10 1pwe n GLU 262 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1pwe n LYS 263 N 0.20 -2.83 -4.68 3.49 4.01 -0.40 -4.97 118.16 112.98 1pwe n LYS 263 Ca 0.03 0.89 -0.27 0.00 -0.51 0.00 0.00 58.31 58.45 1pwe n LYS 263 Cb 0.15 -5.52 -0.17 0.00 -0.51 0.00 0.00 35.03 28.98 1pwe n LYS 263 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1pwe s ILE 264 N -3.03 1.42 -0.36 -0.18 -1.09 -1.25 -4.98 121.20 111.72 1pwe s ILE 264 Ca 0.12 -0.63 -0.18 0.00 -2.23 0.00 0.00 60.65 57.73 1pwe s ILE 264 Cb -0.05 -1.28 0.00 0.00 -1.58 0.00 0.00 42.46 39.55 1pwe s ILE 264 CO 0.15 0.42 0.50 -0.22 -1.23 0.00 0.00 174.94 174.56 1pwe s LEU 265 N 0.69 4.43 0.39 2.97 2.96 -1.26 -3.33 118.68 125.53 1pwe s LEU 265 Ca -0.13 -0.16 0.08 0.00 -0.22 0.00 0.00 54.13 53.70 1pwe s LEU 265 Cb -0.16 -2.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.94 1pwe s LEU 265 CO 0.03 -0.50 0.16 0.68 -1.32 0.00 0.00 176.35 175.41 1pwe s VAL 266 N 2.35 2.53 0.64 1.68 -7.23 -1.26 -4.90 120.40 114.21 1pwe s VAL 266 Ca 0.17 -1.71 -0.12 0.00 -1.81 0.00 0.00 61.98 58.52 1pwe s VAL 266 Cb -0.16 -2.97 -0.03 0.00 0.56 0.00 0.00 36.38 33.79 1pwe s VAL 266 CO 0.14 -0.07 1.04 -1.61 -0.31 0.00 0.00 175.10 174.29 1pwe s GLU 267 N -3.88 3.39 0.29 4.82 2.02 -0.97 -4.84 118.70 119.53 1pwe s GLU 267 Ca 0.40 0.86 0.05 0.00 0.02 0.00 0.00 54.97 56.29 1pwe s GLU 267 Cb 0.02 -2.05 0.72 0.00 0.10 0.00 0.00 34.13 32.92 1pwe s GLU 267 CO 0.23 -0.74 1.74 -1.35 0.02 0.00 0.00 175.26 175.16 1pwe h PRO 268 N -0.32 0.58 -0.22 0.39 0.11 -1.90 -0.32 132.00 130.33 1pwe h PRO 268 Ca -0.44 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.68 1pwe h PRO 268 Cb 1.20 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 1pwe h PRO 268 CO 0.60 0.39 -0.08 0.00 -0.21 0.00 0.00 178.00 178.69 1pwe h ALA 269 N 1.66 0.11 -0.58 -0.75 0.00 -1.93 0.27 119.26 118.04 1pwe h ALA 269 Ca 0.56 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.56 1pwe h ALA 269 Cb 0.96 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1pwe h ALA 269 CO -0.44 -0.50 0.37 0.00 0.00 0.00 0.00 179.25 178.68 1pwe h GLY 271 N 0.81 1.21 0.23 0.00 0.00 0.10 -0.56 103.07 104.87 1pwe h GLY 271 Ca 0.21 -0.25 0.09 0.00 0.00 0.00 0.00 47.33 47.39 1pwe h GLY 271 CO -0.04 0.04 0.04 0.00 0.00 0.00 0.00 176.54 176.58 1pwe h ALA 272 N 1.48 0.52 0.14 3.60 0.00 0.92 0.24 119.26 126.16 1pwe h ALA 272 Ca 0.40 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.45 1pwe h ALA 272 Cb 0.46 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1pwe h ALA 272 CO -0.30 -0.36 -0.17 0.00 0.00 0.00 0.00 179.25 178.42 1pwe h ALA 273 N 1.43 -0.31 -0.56 0.00 0.00 -1.06 -2.18 119.26 116.57 1pwe h ALA 273 Ca 0.26 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.18 1pwe h ALA 273 Cb 0.37 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1pwe h ALA 273 CO -0.39 -0.71 0.38 -0.07 0.00 0.00 0.00 179.25 178.46 1pwe h LEU 274 N -0.35 0.48 -2.09 0.00 3.38 -0.49 -0.07 115.31 116.17 1pwe h LEU 274 Ca 0.01 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.08 1pwe h LEU 274 Cb 0.35 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1pwe h LEU 274 CO -0.07 0.32 0.32 0.00 0.09 0.00 0.00 178.44 179.10 1pwe h ALA 275 N 1.69 2.03 -0.95 1.53 0.00 0.12 -0.15 119.26 123.52 1pwe h ALA 275 Ca 0.24 -0.01 0.20 0.00 0.00 0.00 0.00 54.91 55.34 1pwe h ALA 275 Cb 0.25 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.98 1pwe h ALA 275 CO -0.07 -0.48 0.61 0.00 0.00 0.00 0.00 179.25 179.31 1pwe h ALA 276 N 1.66 1.97 0.00 0.00 0.00 -0.93 0.67 119.26 122.63 1pwe h ALA 276 Ca 0.15 0.04 -0.45 0.00 0.00 0.00 0.00 54.91 54.65 1pwe h ALA 276 Cb 0.79 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1pwe h ALA 276 CO -0.00 -0.29 -2.52 1.55 0.00 0.00 0.00 179.25 177.99 1pwe n VAL 277 N -4.61 1.53 -0.09 0.00 3.14 -0.16 -0.55 118.33 117.59 1pwe n VAL 277 Ca 0.21 -0.41 0.18 0.00 -2.96 0.00 0.00 64.34 61.36 1pwe n VAL 277 Cb 0.64 -1.82 0.60 0.00 -1.06 0.00 0.00 33.84 32.20 1pwe n VAL 277 CO 0.00 0.00 0.00 1.88 -6.46 0.00 0.00 176.83 172.25 1pwe h TYR 278 N -0.86 0.24 -0.60 1.45 0.99 -1.17 -0.20 116.97 116.82 1pwe h TYR 278 Ca -0.68 0.01 -0.20 0.00 2.00 0.00 0.00 58.73 59.85 1pwe h TYR 278 Cb 1.65 -0.08 -0.12 0.00 1.00 0.00 0.00 36.73 39.19 1pwe h TYR 278 CO -0.07 0.09 0.19 0.43 -0.00 0.00 0.00 178.16 178.81 1pwe n SER 279 N -4.42 4.08 -3.08 3.88 7.64 0.23 -4.97 113.62 116.98 1pwe n SER 279 Ca 0.12 -3.34 -0.20 0.00 1.01 0.00 0.00 58.87 56.46 1pwe n SER 279 Cb 0.57 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 1pwe n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pwe n GLY 280 N -0.53 -0.50 0.12 0.23 0.00 -0.09 -4.91 105.19 99.52 1pwe n GLY 280 Ca 0.38 0.08 -0.14 0.00 0.00 0.00 0.00 46.02 46.34 1pwe n GLY 280 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1pwe h VAL 281 N -0.82 1.41 -0.24 1.61 2.07 -1.02 -2.31 116.25 116.94 1pwe h VAL 281 Ca -0.42 -1.52 0.04 0.00 0.82 0.00 0.00 66.70 65.63 1pwe h VAL 281 Cb 1.29 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 33.21 1pwe h VAL 281 CO 0.50 0.43 -0.02 -0.37 0.02 0.00 0.00 177.57 178.13 1pwe h VAL 282 N -0.20 0.81 -0.42 2.57 -1.51 -1.80 -0.81 116.25 114.90 1pwe h VAL 282 Ca -0.00 -0.02 0.06 0.00 -1.23 0.00 0.00 66.70 65.50 1pwe h VAL 282 Cb 0.80 0.75 -0.05 0.00 -2.13 0.00 0.00 31.29 30.65 1pwe h VAL 282 CO 0.04 0.01 0.13 0.00 -1.23 0.00 0.00 177.57 176.53 1pwe h ARG 284 N 0.29 1.03 -0.05 0.00 1.12 -0.81 1.95 114.38 117.90 1pwe h ARG 284 Ca 0.20 -0.06 -0.12 0.00 -1.11 0.00 0.00 59.98 58.89 1pwe h ARG 284 Cb 0.20 -0.23 -0.01 0.00 -0.01 0.00 0.00 29.97 29.91 1pwe h ARG 284 CO -0.21 0.68 -0.51 -0.07 -3.11 0.00 0.00 179.97 176.75 1pwe h LEU 285 N 1.06 0.15 -0.21 3.80 3.38 -0.01 -1.79 115.31 121.70 1pwe h LEU 285 Ca 0.44 -0.07 -0.22 0.00 0.09 0.00 0.00 57.88 58.11 1pwe h LEU 285 Cb 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1pwe h LEU 285 CO -0.20 0.64 -0.89 1.56 0.09 0.00 0.00 178.44 179.63 1pwe h GLN 286 N 0.11 0.47 -0.82 1.13 4.20 0.24 -2.94 115.11 117.50 1pwe h GLN 286 Ca 0.00 -0.47 0.05 0.00 0.06 0.00 0.00 58.65 58.29 1pwe h GLN 286 Cb 0.94 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 28.79 1pwe h GLN 286 CO 0.07 1.11 0.51 0.00 -0.67 0.00 0.00 178.83 179.86 1pwe h ALA 287 N 0.73 1.11 -3.26 3.87 0.00 0.32 -3.41 119.26 118.62 1pwe h ALA 287 Ca -0.07 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1pwe h ALA 287 Cb 1.51 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.08 1pwe h ALA 287 CO 0.16 0.27 0.02 0.39 0.00 0.00 0.00 179.25 180.09 1pwe n GLU 288 N -4.63 0.12 0.00 0.00 1.02 -0.70 -5.04 120.64 111.41 1pwe n GLU 288 Ca 0.11 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1pwe n GLU 288 Cb 0.15 -0.07 0.00 0.00 -0.02 0.00 0.00 31.44 31.50 1pwe n GLU 288 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pwe n ALA 289 N -3.04 -0.14 0.00 0.62 0.00 -1.25 -4.57 120.51 112.12 1pwe n ALA 289 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1pwe n ALA 289 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 1pwe n ALA 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1pwe n ARG 290 N -1.48 0.00 -3.82 0.00 5.12 -1.25 -4.11 116.66 111.12 1pwe n ARG 290 Ca 0.00 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.56 1pwe n ARG 290 Cb 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.23 1pwe n ARG 290 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1pwe s LEU 291 N 0.00 4.33 0.69 0.55 1.43 -1.13 -5.03 118.68 119.53 1pwe s LEU 291 Ca 0.00 0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 53.37 1pwe s LEU 291 Cb 0.00 -2.09 0.01 0.00 0.03 0.00 0.00 46.19 44.15 1pwe s LEU 291 CO 0.00 0.33 1.09 0.00 0.23 0.00 0.00 176.35 178.00 1pwe s GLN 292 N -0.59 2.73 -0.05 1.70 -2.07 -1.26 -4.26 119.66 115.86 1pwe s GLN 292 Ca 0.13 1.23 0.01 0.00 -1.82 0.00 0.00 55.36 54.91 1pwe s GLN 292 Cb -0.12 -1.95 0.02 0.00 -1.09 0.00 0.00 33.01 29.87 1pwe s GLN 292 CO 0.02 -1.28 -0.04 0.99 -1.32 0.00 0.00 175.29 173.66 1pwe s THR 293 N -2.63 0.51 0.58 3.63 2.01 -1.26 -3.20 115.64 115.27 1pwe s THR 293 Ca 0.63 -0.09 -0.18 0.00 0.31 0.00 0.00 61.69 62.36 1pwe s THR 293 Cb -0.18 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.74 1pwe s THR 293 CO 0.47 0.22 1.14 -2.16 -0.69 0.00 0.00 174.62 173.61 1pwe s PRO 294 N 1.02 3.16 -0.17 4.92 0.04 -1.26 -5.13 135.00 137.58 1pwe s PRO 294 Ca -0.09 1.60 -0.14 0.00 0.04 0.00 0.00 61.00 62.41 1pwe s PRO 294 Cb -0.14 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1pwe s PRO 294 CO -0.01 -1.00 0.30 -1.17 0.04 0.00 0.00 177.00 175.16 1pwe s LEU 295 N -4.08 4.22 0.00 -3.56 2.96 -1.19 -5.03 118.68 112.00 1pwe s LEU 295 Ca 0.72 0.48 0.00 0.00 -0.22 0.00 0.00 54.13 55.12 1pwe s LEU 295 Cb -0.24 -2.38 0.00 0.00 0.50 0.00 0.00 46.19 44.07 1pwe s LEU 295 CO 0.31 0.07 0.00 0.00 -1.32 0.00 0.00 176.35 175.41 1pwe n ALA 296 N 3.74 0.00 -3.40 5.97 0.00 -1.26 -4.78 120.51 120.77 1pwe n ALA 296 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.34 1pwe n ALA 296 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1pwe n ALA 296 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pwe s SER 297 N -2.68 -1.23 0.27 0.00 0.15 -1.26 -4.56 113.70 104.39 1pwe s SER 297 Ca 0.00 1.21 -0.06 0.00 0.70 0.00 0.00 55.95 57.80 1pwe s SER 297 Cb 0.00 2.21 -0.06 0.00 -1.71 0.00 0.00 66.02 66.46 1pwe s SER 297 CO 0.00 -0.23 0.54 -1.48 1.20 0.00 0.00 173.24 173.27 1pwe s LEU 298 N 2.87 4.09 -0.13 3.45 0.05 -0.87 -0.12 118.68 128.03 1pwe s LEU 298 Ca 0.07 0.74 0.01 0.00 0.05 0.00 0.00 54.13 55.00 1pwe s LEU 298 Cb -0.13 -3.54 -0.00 0.00 -2.05 0.00 0.00 46.19 40.46 1pwe s LEU 298 CO -0.20 -0.15 -0.17 -0.69 -0.55 0.00 0.00 176.35 174.58 1pwe s VAL 299 N -2.00 2.57 -0.19 1.48 1.01 -0.62 -0.87 120.40 121.77 1pwe s VAL 299 Ca 0.44 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 1pwe s VAL 299 Cb -0.11 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1pwe s VAL 299 CO 0.28 0.53 0.03 -0.69 0.00 0.00 0.00 175.10 175.25 1pwe s VAL 300 N 0.54 4.31 -0.57 2.92 1.01 0.66 -0.11 120.40 129.16 1pwe s VAL 300 Ca -0.11 -0.19 -0.25 0.00 0.00 0.00 0.00 61.98 61.43 1pwe s VAL 300 Cb -0.16 -2.95 0.04 0.00 0.00 0.00 0.00 36.38 33.31 1pwe s VAL 300 CO 0.04 0.43 1.00 -0.63 0.00 0.00 0.00 175.10 175.94 1pwe s ILE 301 N 0.77 4.29 -1.08 2.22 1.01 0.04 -1.77 121.20 126.67 1pwe s ILE 301 Ca 0.02 0.33 -0.21 0.00 0.00 0.00 0.00 60.65 60.79 1pwe s ILE 301 Cb -0.14 -4.60 0.07 0.00 0.01 0.00 0.00 42.46 37.80 1pwe s ILE 301 CO 0.02 -1.21 1.48 -0.69 0.00 0.00 0.00 174.94 174.54 1pwe s VAL 302 N 4.20 4.10 0.49 2.92 1.01 -0.73 -4.64 120.40 127.76 1pwe s VAL 302 Ca 0.32 -1.20 0.41 0.00 0.00 0.00 0.00 61.98 61.52 1pwe s VAL 302 Cb -0.12 -5.06 0.43 0.00 0.00 0.00 0.00 36.38 31.63 1pwe s VAL 302 CO 0.19 -1.90 2.25 0.00 0.00 0.00 0.00 175.10 175.64 1pwe n GLY 304 N -0.82 1.14 0.00 0.00 0.00 -1.26 -2.51 105.19 101.74 1pwe n GLY 304 Ca -0.02 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1pwe n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwe n GLY 305 N 0.00 3.02 0.05 -0.02 0.00 -0.22 -2.28 105.19 105.74 1pwe n GLY 305 Ca 0.00 -1.42 -0.00 0.00 0.00 0.00 0.00 46.02 44.60 1pwe n GLY 305 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pwe n SER 306 N 0.00 0.38 -3.89 1.61 3.41 -1.26 -4.40 113.62 109.47 1pwe n SER 306 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 1pwe n SER 306 Cb 0.00 1.41 -0.02 0.00 -0.26 0.00 0.00 64.21 65.34 1pwe n SER 306 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1pwe n ASN 307 N -2.46 3.55 -3.48 4.04 5.15 -1.26 -4.80 115.26 116.00 1pwe n ASN 307 Ca -0.18 -2.79 -0.12 0.00 -0.60 0.00 0.00 54.58 50.88 1pwe n ASN 307 Cb 0.84 -1.51 -0.03 0.00 -0.53 0.00 0.00 39.78 38.54 1pwe n ASN 307 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1pwe s ILE 308 N 4.51 0.00 0.10 -1.44 1.10 -1.26 -4.86 121.20 119.34 1pwe s ILE 308 Ca 0.53 0.00 -0.27 0.00 -0.51 0.00 0.00 60.65 60.40 1pwe s ILE 308 Cb 0.12 -1.00 0.08 0.00 0.15 0.00 0.00 42.46 41.81 1pwe s ILE 308 CO 0.01 0.00 1.08 -0.94 -2.11 0.00 0.00 174.94 172.98 1pwe s SER 309 N -2.18 -0.13 0.17 4.50 1.04 -1.26 -4.98 113.70 110.86 1pwe s SER 309 Ca -0.01 -0.32 -0.14 0.00 0.48 0.00 0.00 55.95 55.95 1pwe s SER 309 Cb -0.01 0.37 0.11 0.00 0.10 0.00 0.00 66.02 66.59 1pwe s SER 309 CO -0.05 -0.69 1.76 -0.07 0.98 0.00 0.00 173.24 175.17 1pwe h LEU 310 N 2.00 0.24 0.55 2.42 4.07 -2.03 0.17 115.31 122.73 1pwe h LEU 310 Ca -0.26 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.71 1pwe h LEU 310 Cb 1.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.97 1pwe h LEU 310 CO 0.27 0.17 -0.27 0.00 -1.08 0.00 0.00 178.44 177.53 1pwe h ALA 311 N 1.26 -0.74 -0.33 1.53 0.00 -2.01 -2.37 119.26 116.61 1pwe h ALA 311 Ca 0.20 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.02 1pwe h ALA 311 Cb 0.15 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1pwe h ALA 311 CO -0.17 -0.92 0.23 1.96 0.00 0.00 0.00 179.25 180.35 1pwe h GLN 312 N -0.74 0.09 -0.39 0.00 4.20 -1.87 -0.74 115.11 115.66 1pwe h GLN 312 Ca -0.07 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1pwe h GLN 312 Cb 0.57 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1pwe h GLN 312 CO 0.12 0.06 0.25 1.25 -0.67 0.00 0.00 178.83 179.84 1pwe h LEU 313 N 0.09 0.45 0.10 1.46 6.46 -0.15 -1.09 115.31 122.63 1pwe h LEU 313 Ca 0.15 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1pwe h LEU 313 Cb 0.49 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1pwe h LEU 313 CO -0.01 0.33 -0.05 1.56 -0.62 0.00 0.00 178.44 179.65 1pwe h GLN 314 N 0.52 -0.13 -1.25 1.25 7.50 -0.88 0.14 115.11 122.27 1pwe h GLN 314 Ca 0.14 0.01 0.38 0.00 0.50 0.00 0.00 58.65 59.68 1pwe h GLN 314 Cb -0.05 0.03 -0.11 0.00 0.05 0.00 0.00 27.48 27.40 1pwe h GLN 314 CO -0.03 0.03 0.82 0.00 -1.50 0.00 0.00 178.83 178.15 1pwe h ALA 315 N 0.60 2.66 0.05 3.87 0.00 -0.86 0.48 119.26 126.06 1pwe h ALA 315 Ca -0.01 0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 1pwe h ALA 315 Cb 0.23 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1pwe h ALA 315 CO 0.02 -1.19 -0.71 -0.07 0.00 0.00 0.00 179.25 177.30 1pwe h LEU 316 N 0.17 0.16 -2.07 0.00 4.07 -0.58 -1.59 115.31 115.47 1pwe h LEU 316 Ca 0.73 -0.85 0.10 0.00 0.08 0.00 0.00 57.88 57.94 1pwe h LEU 316 Cb 2.26 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 43.93 1pwe h LEU 316 CO -0.33 1.31 0.27 0.11 -1.08 0.00 0.00 178.44 178.72 1pwe h LYS 317 N -0.75 0.00 0.00 1.13 1.57 0.12 0.58 116.57 119.22 1pwe h LYS 317 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1pwe h LYS 317 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1pwe h LYS 317 CO -0.01 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.87 1pwe n ALA 318 N -2.51 0.00 -0.26 3.86 0.00 0.15 -4.30 120.51 117.45 1pwe n ALA 318 Ca 0.05 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.59 1pwe n ALA 318 Cb 0.44 0.00 0.22 0.00 0.00 0.00 0.00 19.45 20.10 1pwe n ALA 318 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1pwe n GLN 319 N -1.07 -0.06 0.00 0.00 7.27 -0.60 -5.09 117.38 117.84 1pwe n GLN 319 Ca 0.00 1.14 0.15 0.00 0.07 0.00 0.00 57.00 58.36 1pwe n GLN 319 Cb 0.00 -1.81 0.64 0.00 2.41 0.00 0.00 30.24 31.48 1pwe n GLN 319 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02