#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5w h SER 2 N 0.00 -0.16 -3.26 1.61 0.02 -2.08 -3.45 113.55 106.23 1x5w h SER 2 Ca 0.00 -0.30 -0.53 0.00 -0.84 0.00 0.00 61.79 60.13 1x5w h SER 2 Cb 0.00 0.04 0.03 0.00 0.14 0.00 0.00 62.40 62.62 1x5w h SER 2 CO 0.00 0.42 0.69 -0.44 -1.14 0.00 0.00 176.83 176.36 1x5w s SER 3 N -5.50 6.84 1.18 3.07 0.01 -1.26 -4.99 113.70 113.06 1x5w s SER 3 Ca -0.10 2.41 -0.16 0.00 1.31 0.00 0.00 55.95 59.41 1x5w s SER 3 Cb -0.00 -2.60 0.22 0.00 0.21 0.00 0.00 66.02 63.84 1x5w s SER 3 CO 0.35 -0.59 0.51 0.61 0.41 0.00 0.00 173.24 174.54 1x5w n GLY 4 N 2.71 -2.45 2.91 3.44 0.00 -1.26 -5.04 105.19 105.50 1x5w n GLY 4 Ca 0.08 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.92 1x5w n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5w s SER 5 N -2.16 -0.08 0.08 1.61 0.15 -1.26 -5.05 113.70 106.99 1x5w s SER 5 Ca 0.62 0.23 -0.18 0.00 0.70 0.00 0.00 55.95 57.32 1x5w s SER 5 Cb -0.18 0.15 -0.09 0.00 -1.71 0.00 0.00 66.02 64.20 1x5w s SER 5 CO 0.64 -0.11 1.47 0.77 1.20 0.00 0.00 173.24 177.20 1x5w h SER 6 N 6.91 0.51 0.00 5.45 4.64 -2.05 -3.47 113.55 125.53 1x5w h SER 6 Ca -0.39 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 60.56 1x5w h SER 6 Cb 1.15 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1x5w h SER 6 CO 0.44 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 177.78 1x5w n GLY 7 N -0.12 0.97 3.57 -0.77 0.00 -1.26 -5.11 105.19 102.46 1x5w n GLY 7 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1x5w n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1x5w n HIS 8 N 0.00 0.21 0.33 1.61 -0.00 -1.26 -4.87 115.22 111.23 1x5w n HIS 8 Ca 0.00 0.39 0.15 0.00 -0.00 0.00 0.00 57.72 58.26 1x5w n HIS 8 Cb 0.00 -2.04 0.63 0.00 -0.00 0.00 0.00 29.99 28.58 1x5w n HIS 8 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1x5w h PRO 9 N -0.15 0.00 -3.66 -0.41 0.13 -1.83 -3.44 132.00 122.64 1x5w h PRO 9 Ca -0.47 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.52 1x5w h PRO 9 Cb 1.35 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.28 1x5w h PRO 9 CO 0.46 0.00 -0.52 -1.21 -0.23 0.00 0.00 178.00 176.51 1x5w s GLU 10 N -3.54 0.52 0.22 0.86 0.41 -1.23 -5.06 118.70 110.88 1x5w s GLU 10 Ca 0.02 -0.56 -0.08 0.00 -0.41 0.00 0.00 54.97 53.94 1x5w s GLU 10 Cb 0.09 0.21 -0.02 0.00 -1.78 0.00 0.00 34.13 32.63 1x5w s GLU 10 CO 0.48 -0.13 0.32 -1.59 -0.49 0.00 0.00 175.26 173.85 1x5w s LYS 11 N -1.91 1.36 -0.14 1.61 -2.85 -1.26 -2.81 119.74 113.73 1x5w s LYS 11 Ca -0.11 -1.37 -0.07 0.00 -1.00 0.00 0.00 55.97 53.42 1x5w s LYS 11 Cb -0.05 0.38 -0.04 0.00 -2.06 0.00 0.00 37.83 36.06 1x5w s LYS 11 CO -0.01 -0.52 0.11 0.00 0.10 0.00 0.00 175.35 175.03 1x5w h SER 13 N 5.62 0.00 0.01 0.00 0.02 -2.02 -3.33 113.55 113.85 1x5w h SER 13 Ca -0.49 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.46 1x5w h SER 13 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1x5w h SER 13 CO 0.63 0.58 -0.01 -0.33 -1.14 0.00 0.00 176.83 176.57 1x5w h GLU 14 N 0.00 -0.02 -5.03 3.45 4.39 -1.96 -3.48 114.58 111.93 1x5w h GLU 14 Ca -0.01 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.11 1x5w h GLU 14 Cb 1.43 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.95 1x5w h GLU 14 CO 0.08 0.68 -0.50 0.00 -1.16 0.00 0.00 179.01 178.11 1x5w n SER 16 N -1.43 5.19 -4.60 0.00 7.64 -1.26 -4.06 113.62 115.09 1x5w n SER 16 Ca -0.07 -2.65 -0.39 0.00 1.01 0.00 0.00 58.87 56.77 1x5w n SER 16 Cb 0.65 -0.96 -0.09 0.00 -1.01 0.00 0.00 64.21 62.80 1x5w n SER 16 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1x5w s TYR 17 N -0.90 3.24 0.07 1.43 6.14 -1.26 -4.92 117.35 121.14 1x5w s TYR 17 Ca 0.15 0.39 0.06 0.00 0.64 0.00 0.00 57.07 58.31 1x5w s TYR 17 Cb 0.12 -2.58 -0.03 0.00 0.42 0.00 0.00 41.96 39.89 1x5w s TYR 17 CO 0.01 -0.24 -0.16 -1.54 0.64 0.00 0.00 175.55 174.25 1x5w s SER 18 N 1.65 1.92 0.21 4.32 1.04 -1.26 -0.01 113.70 121.57 1x5w s SER 18 Ca 0.15 -0.58 0.02 0.00 0.48 0.00 0.00 55.95 56.02 1x5w s SER 18 Cb -0.16 -0.10 -0.05 0.00 0.10 0.00 0.00 66.02 65.81 1x5w s SER 18 CO 0.10 0.01 0.03 0.00 0.98 0.00 0.00 173.24 174.36 1x5w h SER 20 N 2.54 0.00 -3.26 0.00 4.64 -1.98 -3.26 113.55 112.23 1x5w h SER 20 Ca -0.38 -0.55 -0.58 0.00 -0.47 0.00 0.00 61.79 59.81 1x5w h SER 20 Cb 1.22 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.25 1x5w h SER 20 CO 0.63 0.82 0.48 -0.44 -0.87 0.00 0.00 176.83 177.45 1x5w s SER 21 N -5.97 7.00 0.12 4.97 0.01 -1.26 -4.65 113.70 113.91 1x5w s SER 21 Ca -0.12 1.23 -0.31 0.00 1.31 0.00 0.00 55.95 58.07 1x5w s SER 21 Cb -0.01 -2.48 -0.11 0.00 0.21 0.00 0.00 66.02 63.63 1x5w s SER 21 CO 0.40 -0.46 1.51 0.50 0.41 0.00 0.00 173.24 175.60 1x5w h LYS 22 N 7.36 -0.43 -0.98 12.44 3.64 -1.97 0.41 116.57 137.04 1x5w h LYS 22 Ca -0.27 0.03 0.32 0.00 -1.27 0.00 0.00 60.65 59.46 1x5w h LYS 22 Cb 1.12 0.10 -0.16 0.00 -0.41 0.00 0.00 32.23 32.88 1x5w h LYS 22 CO 0.86 -0.29 0.46 0.00 -2.27 0.00 0.00 179.45 178.21 1x5w h ALA 23 N -0.25 1.80 -0.32 5.00 0.00 -2.00 0.32 119.26 123.82 1x5w h ALA 23 Ca 0.05 0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1x5w h ALA 23 Cb 0.59 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1x5w h ALA 23 CO -0.49 -0.63 0.06 0.00 0.00 0.00 0.00 179.25 178.19 1x5w h ALA 24 N 1.88 0.33 -0.21 0.00 0.00 -1.32 -2.72 119.26 117.22 1x5w h ALA 24 Ca 0.71 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.74 1x5w h ALA 24 Cb 1.65 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 19.45 1x5w h ALA 24 CO -0.67 -0.35 -0.30 1.25 0.00 0.00 0.00 179.25 179.17 1x5w h LEU 25 N 0.17 -0.95 -0.77 0.00 5.85 -0.03 -1.43 115.31 118.14 1x5w h LEU 25 Ca 0.15 0.15 0.18 0.00 0.84 0.00 0.00 57.88 59.20 1x5w h LEU 25 Cb 0.17 0.42 -0.14 0.00 0.37 0.00 0.00 40.66 41.48 1x5w h LEU 25 CO -0.20 -0.33 0.00 0.03 -0.34 0.00 0.00 178.44 177.60 1x5w h ARG 26 N -0.33 0.09 -0.91 1.25 3.08 -1.32 0.43 114.38 116.67 1x5w h ARG 26 Ca 0.12 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.24 1x5w h ARG 26 Cb 0.52 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.49 1x5w h ARG 26 CO -0.39 0.06 0.59 0.82 -1.07 0.00 0.00 179.97 179.98 1x5w h ILE 27 N 0.10 1.05 -0.63 2.04 2.04 -1.08 -1.80 117.51 119.22 1x5w h ILE 27 Ca 0.43 -0.35 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 1x5w h ILE 27 Cb 0.76 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 1x5w h ILE 27 CO -0.69 0.18 0.19 -0.74 0.00 0.00 0.00 178.15 177.09 1x5w h HIS 28 N 1.01 1.03 -1.41 1.37 -0.00 0.30 -2.59 115.15 114.86 1x5w h HIS 28 Ca 0.40 -0.11 0.41 0.00 -0.00 0.00 0.00 60.37 61.07 1x5w h HIS 28 Cb 0.24 -0.30 -0.06 0.00 -0.00 0.00 0.00 27.41 27.29 1x5w h HIS 28 CO -0.00 0.85 1.00 0.93 -0.00 0.00 0.00 177.93 180.71 1x5w h GLU 29 N 0.91 0.03 -0.98 5.26 5.08 -0.43 0.40 114.58 124.86 1x5w h GLU 29 Ca 0.20 -0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.78 1x5w h GLU 29 Cb 0.31 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.47 1x5w h GLU 29 CO -0.00 0.02 0.63 0.00 -1.00 0.00 0.00 179.01 178.66 1x5w h ARG 30 N 0.03 0.48 -1.26 2.33 3.08 -1.51 0.11 114.38 117.65 1x5w h ARG 30 Ca 0.69 -0.03 0.36 0.00 0.07 0.00 0.00 59.98 61.07 1x5w h ARG 30 Cb 2.66 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 32.53 1x5w h ARG 30 CO -0.05 0.32 0.88 0.97 -1.07 0.00 0.00 179.97 181.02 1x5w h ILE 31 N 0.50 0.36 -0.79 2.04 2.10 -0.39 0.75 117.51 122.08 1x5w h ILE 31 Ca 0.55 -0.03 -0.42 0.00 1.08 0.00 0.00 64.86 66.04 1x5w h ILE 31 Cb 1.23 0.26 -0.16 0.00 -1.09 0.00 0.00 36.82 37.06 1x5w h ILE 31 CO -0.28 0.02 0.35 1.41 -1.08 0.00 0.00 178.15 178.56 1x5w n HIS 32 N -4.30 1.46 -4.11 2.19 8.25 0.39 -4.92 115.22 114.19 1x5w n HIS 32 Ca 0.29 -1.92 -0.22 0.00 -0.26 0.00 0.00 57.72 55.61 1x5w n HIS 32 Cb 1.28 -1.25 -0.04 0.00 1.12 0.00 0.00 29.99 31.10 1x5w n HIS 32 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x5w s THR 34 N -2.10 0.00 -0.17 0.00 2.01 -1.26 -5.04 115.64 109.08 1x5w s THR 34 Ca 0.33 -0.04 0.16 0.00 0.31 0.00 0.00 61.69 62.45 1x5w s THR 34 Cb -0.08 -0.43 -0.22 0.00 0.01 0.00 0.00 72.50 71.78 1x5w s THR 34 CO 0.25 -0.02 0.07 0.47 -0.69 0.00 0.00 174.62 174.70 1x5w n ASP 35 N 2.80 0.62 -4.65 3.53 8.00 -1.26 -4.92 116.55 120.67 1x5w n ASP 35 Ca -0.13 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 54.94 1x5w n ASP 35 Cb 0.58 0.96 -0.03 0.00 -0.02 0.00 0.00 41.12 42.61 1x5w n ASP 35 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1x5w s ARG 36 N -2.45 4.24 0.09 -1.24 3.00 -1.26 -4.95 118.95 116.37 1x5w s ARG 36 Ca -0.09 1.11 -0.16 0.00 0.00 0.00 0.00 55.73 56.60 1x5w s ARG 36 Cb 0.05 -3.63 -0.09 0.00 0.00 0.00 0.00 34.95 31.28 1x5w s ARG 36 CO 0.73 -0.52 1.41 -1.00 0.00 0.00 0.00 175.30 175.92 1x5w h PRO 37 N 7.52 0.63 -6.30 3.54 0.13 -1.92 -3.43 132.00 132.18 1x5w h PRO 37 Ca -0.23 -0.33 -0.57 0.00 -0.87 0.00 0.00 66.00 64.00 1x5w h PRO 37 Cb 1.09 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 1x5w h PRO 37 CO 0.90 0.93 1.00 -0.06 -0.23 0.00 0.00 178.00 180.54 1x5w s PHE 38 N -4.37 2.56 0.11 1.56 0.08 -1.23 -5.01 117.98 111.69 1x5w s PHE 38 Ca -0.13 0.80 0.09 0.00 0.12 0.00 0.00 56.93 57.81 1x5w s PHE 38 Cb 0.08 -3.86 -0.04 0.00 -0.57 0.00 0.00 43.02 38.63 1x5w s PHE 38 CO 0.81 -2.05 -0.22 0.15 -0.10 0.00 0.00 175.22 173.82 1x5w s LYS 39 N 4.18 1.20 0.56 0.44 1.02 -1.26 -1.57 119.74 124.31 1x5w s LYS 39 Ca 0.60 -1.23 -0.10 0.00 0.02 0.00 0.00 55.97 55.26 1x5w s LYS 39 Cb -0.20 -1.51 -0.05 0.00 -0.52 0.00 0.00 37.83 35.56 1x5w s LYS 39 CO 0.23 0.35 0.94 0.00 -0.92 0.00 0.00 175.35 175.96 1x5w n ASN 41 N -2.36 0.60 -0.04 0.00 3.02 -1.26 -4.60 115.26 110.63 1x5w n ASN 41 Ca 0.04 -0.03 -0.11 0.00 -0.03 0.00 0.00 54.58 54.46 1x5w n ASN 41 Cb 0.54 0.69 -0.09 0.00 -0.61 0.00 0.00 39.78 40.32 1x5w n ASN 41 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1x5w h TYR 42 N 0.00 -0.04 -0.37 3.10 -1.99 -1.98 -3.48 116.97 112.21 1x5w h TYR 42 Ca -0.53 -0.00 -0.67 0.00 2.00 0.00 0.00 58.73 59.53 1x5w h TYR 42 Cb 2.13 0.01 -0.12 0.00 2.00 0.00 0.00 36.73 40.75 1x5w h TYR 42 CO 0.01 0.61 -0.49 0.00 -0.00 0.00 0.00 178.16 178.29 1x5w n SER 44 N -1.32 6.41 -4.60 0.00 2.88 -1.26 -4.26 113.62 111.48 1x5w n SER 44 Ca -0.18 -3.08 -0.40 0.00 -1.33 0.00 0.00 58.87 53.88 1x5w n SER 44 Cb 0.67 -1.13 -0.08 0.00 -0.75 0.00 0.00 64.21 62.91 1x5w n SER 44 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1x5w s PHE 45 N -1.65 3.24 -0.08 0.66 5.36 -1.26 -4.94 117.98 119.31 1x5w s PHE 45 Ca 0.42 0.47 0.04 0.00 -0.96 0.00 0.00 56.93 56.90 1x5w s PHE 45 Cb 0.29 -2.74 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 1x5w s PHE 45 CO -0.08 -0.34 -0.21 0.16 -1.46 0.00 0.00 175.22 173.29 1x5w s ASP 46 N 1.62 2.77 0.05 6.13 -4.77 -1.26 -0.52 116.67 120.69 1x5w s ASP 46 Ca 0.19 -0.49 0.05 0.00 -3.30 0.00 0.00 52.55 49.00 1x5w s ASP 46 Cb -0.16 -1.13 -0.02 0.00 -1.09 0.00 0.00 42.92 40.52 1x5w s ASP 46 CO 0.10 0.15 -0.13 0.28 0.70 0.00 0.00 175.17 176.27 1x5w s THR 47 N 0.28 1.05 -0.15 2.11 -1.32 -0.61 -4.97 115.64 112.03 1x5w s THR 47 Ca -0.14 -1.08 0.01 0.00 -1.21 0.00 0.00 61.69 59.28 1x5w s THR 47 Cb -0.16 -0.98 0.20 0.00 -1.51 0.00 0.00 72.50 70.05 1x5w s THR 47 CO 0.07 -0.09 1.26 1.17 -2.21 0.00 0.00 174.62 174.81 1x5w n LYS 48 N 1.71 1.40 -3.78 7.08 4.81 -1.26 -3.47 118.16 124.63 1x5w n LYS 48 Ca -0.19 -0.89 -0.13 0.00 -0.87 0.00 0.00 58.31 56.23 1x5w n LYS 48 Cb 0.55 -1.36 -0.11 0.00 0.02 0.00 0.00 35.03 34.13 1x5w n LYS 48 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1x5w s GLN 49 N -0.99 0.38 0.23 1.64 -0.21 -1.26 -5.00 119.66 114.45 1x5w s GLN 49 Ca 0.17 0.24 -0.00 0.00 0.02 0.00 0.00 55.36 55.79 1x5w s GLN 49 Cb 0.14 0.18 0.24 0.00 1.00 0.00 0.00 33.01 34.57 1x5w s GLN 49 CO 0.03 -0.06 1.60 -1.00 -2.12 0.00 0.00 175.29 173.74 1x5w h PRO 50 N 5.36 0.49 0.02 2.91 0.13 -1.99 -3.15 132.00 135.77 1x5w h PRO 50 Ca -0.27 -0.26 -0.20 0.00 -0.87 0.00 0.00 66.00 64.40 1x5w h PRO 50 Cb 1.19 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.35 1x5w h PRO 50 CO 0.35 0.83 -0.79 0.66 -0.23 0.00 0.00 178.00 178.82 1x5w h SER 51 N 0.40 0.66 -0.97 1.44 4.64 -1.98 -2.77 113.55 114.97 1x5w h SER 51 Ca 0.03 -0.77 0.21 0.00 -0.47 0.00 0.00 61.79 60.78 1x5w h SER 51 Cb 0.93 -0.20 -0.09 0.00 -0.31 0.00 0.00 62.40 62.73 1x5w h SER 51 CO 0.08 1.35 0.62 0.78 -0.87 0.00 0.00 176.83 178.79 1x5w h ASN 52 N 0.04 0.58 0.02 4.97 2.35 -1.97 -0.97 115.58 120.60 1x5w h ASN 52 Ca -0.10 0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 1x5w h ASN 52 Cb 1.49 -0.03 0.01 0.00 0.05 0.00 0.00 38.32 39.84 1x5w h ASN 52 CO 0.15 0.20 -0.33 0.25 -1.65 0.00 0.00 177.43 176.06 1x5w h LEU 53 N 0.56 0.26 0.09 1.61 5.85 -1.58 -2.76 115.31 119.34 1x5w h LEU 53 Ca 0.53 -0.82 0.01 0.00 0.84 0.00 0.00 57.88 58.44 1x5w h LEU 53 Cb 1.10 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1x5w h LEU 53 CO -0.28 1.05 -0.40 0.28 -0.34 0.00 0.00 178.44 178.76 1x5w h SER 54 N -0.49 -1.20 -0.55 1.25 0.02 -0.98 0.16 113.55 111.76 1x5w h SER 54 Ca -0.05 0.13 0.09 0.00 -0.84 0.00 0.00 61.79 61.12 1x5w h SER 54 Cb 1.12 0.44 -0.03 0.00 0.14 0.00 0.00 62.40 64.07 1x5w h SER 54 CO 0.06 -0.42 0.37 0.07 -1.14 0.00 0.00 176.83 175.77 1x5w h LYS 55 N -0.57 0.36 -0.42 3.45 2.10 -1.37 -0.64 116.57 119.48 1x5w h LYS 55 Ca -0.00 -0.02 -0.08 0.00 -2.00 0.00 0.00 60.65 58.54 1x5w h LYS 55 Cb 0.57 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 31.80 1x5w h LYS 55 CO -0.22 0.24 -0.08 1.25 -2.00 0.00 0.00 179.45 178.64 1x5w h HIS 56 N 0.37 0.80 -0.56 0.07 2.76 -0.93 0.31 115.15 117.97 1x5w h HIS 56 Ca 0.25 -0.13 0.10 0.00 -2.20 0.00 0.00 60.37 58.38 1x5w h HIS 56 Cb 0.50 -0.21 -0.07 0.00 1.55 0.00 0.00 27.41 29.18 1x5w h HIS 56 CO -0.00 0.79 0.14 0.52 -1.30 0.00 0.00 177.93 178.08 1x5w h MET 57 N 0.68 0.28 0.10 5.26 2.86 0.91 -1.70 114.93 123.31 1x5w h MET 57 Ca 0.12 -0.02 -0.31 0.00 -2.06 0.00 0.00 59.70 57.44 1x5w h MET 57 Cb 0.54 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 1x5w h MET 57 CO 0.03 0.18 -1.58 0.87 1.06 0.00 0.00 176.91 177.48 1x5w h LYS 58 N 0.29 0.22 -0.78 1.72 1.57 -1.53 0.76 116.57 118.81 1x5w h LYS 58 Ca 0.28 -0.38 0.17 0.00 -1.87 0.00 0.00 60.65 58.86 1x5w h LYS 58 Cb 0.39 0.14 -0.11 0.00 0.08 0.00 0.00 32.23 32.73 1x5w h LYS 58 CO -0.34 1.06 0.25 -0.22 -0.57 0.00 0.00 179.45 179.63 1x5w h LYS 59 N 0.06 0.32 0.00 3.15 3.64 0.02 -1.70 116.57 122.06 1x5w h LYS 59 Ca -0.26 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 58.90 1x5w h LYS 59 Cb 2.01 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 33.73 1x5w h LYS 59 CO 0.15 0.21 -1.57 1.19 -2.27 0.00 0.00 179.45 177.16 1x5w n PHE 60 N -5.10 0.00 -2.25 1.91 3.72 -0.68 -4.71 117.46 110.36 1x5w n PHE 60 Ca 0.16 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.17 1x5w n PHE 60 Cb 0.50 -0.54 0.01 0.00 -0.94 0.00 0.00 39.48 38.51 1x5w n PHE 60 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1x5w n HIS 61 N -3.88 2.66 -0.09 1.38 8.25 0.25 -4.51 115.22 119.29 1x5w n HIS 61 Ca -0.27 -2.51 -0.17 0.00 -0.26 0.00 0.00 57.72 54.51 1x5w n HIS 61 Cb 0.62 -1.36 -0.07 0.00 1.12 0.00 0.00 29.99 30.31 1x5w n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5w n GLY 62 N 0.33 -0.26 1.94 -1.41 0.00 -0.64 -4.17 105.19 100.98 1x5w n GLY 62 Ca 0.52 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 46.27 1x5w n GLY 62 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x5w n ASP 63 N -3.56 6.51 -4.66 1.61 8.00 -1.26 -4.90 116.55 118.28 1x5w n ASP 63 Ca -0.33 -3.09 -0.26 0.00 0.71 0.00 0.00 54.79 51.82 1x5w n ASP 63 Cb 0.76 -1.07 -0.08 0.00 -0.02 0.00 0.00 41.12 40.71 1x5w n ASP 63 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1x5w s MET 64 N -1.86 2.37 -1.16 -1.24 -1.94 -1.26 -5.05 119.30 109.16 1x5w s MET 64 Ca 0.34 -1.17 -0.18 0.00 -1.71 0.00 0.00 55.69 52.96 1x5w s MET 64 Cb 0.26 -2.31 0.09 0.00 2.01 0.00 0.00 34.83 34.88 1x5w s MET 64 CO -0.02 0.44 1.52 0.45 -0.01 0.00 0.00 175.02 177.40 1x5w s SER 65 N -3.08 6.77 0.00 3.03 0.15 -1.26 -4.77 113.70 114.55 1x5w s SER 65 Ca 0.28 -2.25 0.00 0.00 0.70 0.00 0.00 55.95 54.68 1x5w s SER 65 Cb -0.09 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1x5w s SER 65 CO 0.19 -1.15 0.00 0.61 1.20 0.00 0.00 173.24 174.08 1x5w n GLY 66 N 5.52 -0.33 3.77 9.45 0.00 -1.26 -5.01 105.19 117.33 1x5w n GLY 66 Ca 0.39 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 1x5w n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5w s PRO 67 N -0.26 3.46 -0.34 1.61 0.04 -1.26 -4.93 135.00 133.31 1x5w s PRO 67 Ca 0.00 1.65 -0.02 0.00 0.04 0.00 0.00 61.00 62.67 1x5w s PRO 67 Cb 0.00 -2.11 0.14 0.00 0.04 0.00 0.00 34.50 32.57 1x5w s PRO 67 CO 0.00 -0.77 2.35 -1.13 0.04 0.00 0.00 177.00 177.49 1x5w n SER 68 N -1.09 6.40 -3.73 6.66 3.41 -1.26 -4.82 113.62 119.20 1x5w n SER 68 Ca 0.11 -3.08 -0.13 0.00 -0.26 0.00 0.00 58.87 55.51 1x5w n SER 68 Cb 0.50 -1.13 -0.14 0.00 -0.26 0.00 0.00 64.21 63.18 1x5w n SER 68 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x5w s SER 69 N 0.35 -0.14 0.00 4.04 0.01 -1.26 -5.32 113.70 111.38 1x5w s SER 69 Ca 0.42 0.46 0.00 0.00 1.31 0.00 0.00 55.95 58.13 1x5w s SER 69 Cb 0.29 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.88 1x5w s SER 69 CO -0.08 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.01