#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4w s SER 2 N 0.00 4.07 -0.36 1.61 0.15 -1.26 -4.86 113.70 113.05 1x4w s SER 2 Ca 0.00 -0.67 -0.28 0.00 0.70 0.00 0.00 55.95 55.70 1x4w s SER 2 Cb 0.00 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.66 1x4w s SER 2 CO 0.00 -3.92 2.31 -1.20 1.20 0.00 0.00 173.24 171.63 1x4w n SER 3 N 17.74 2.66 -4.57 5.45 7.64 -1.26 -4.85 113.62 136.42 1x4w n SER 3 Ca 0.44 -0.03 -0.34 0.00 1.01 0.00 0.00 58.87 59.95 1x4w n SER 3 Cb 0.45 -1.50 -0.04 0.00 -1.01 0.00 0.00 64.21 62.11 1x4w n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4w s GLY 4 N 9.63 0.75 -0.19 0.23 0.00 -1.26 -4.71 107.32 111.78 1x4w s GLY 4 Ca 1.03 -2.14 -0.19 0.00 0.00 0.00 0.00 44.72 43.42 1x4w s GLY 4 CO 0.34 3.15 0.15 0.23 0.00 0.00 0.00 173.10 176.97 1x4w h SER 5 N 9.79 0.00 -2.76 1.64 0.87 -2.02 -3.50 113.55 117.57 1x4w h SER 5 Ca 0.22 -0.40 0.10 0.00 -1.23 0.00 0.00 61.79 60.48 1x4w h SER 5 Cb 0.96 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 62.65 1x4w h SER 5 CO 1.32 1.28 0.51 -0.94 -0.53 0.00 0.00 176.83 178.46 1x4w s SER 6 N -6.54 -0.39 0.00 6.23 1.04 -1.26 -5.04 113.70 107.74 1x4w s SER 6 Ca -0.24 0.70 0.00 0.00 0.48 0.00 0.00 55.95 56.88 1x4w s SER 6 Cb 0.04 0.88 0.00 0.00 0.10 0.00 0.00 66.02 67.05 1x4w s SER 6 CO 0.50 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.21 1x4w n GLY 7 N 2.67 0.83 3.83 7.32 0.00 -1.26 -5.15 105.19 113.43 1x4w n GLY 7 Ca -0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 1x4w n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4w s SER 8 N -1.05 5.98 -0.79 1.61 1.04 -1.26 -5.06 113.70 114.17 1x4w s SER 8 Ca 0.00 0.25 -0.00 0.00 0.48 0.00 0.00 55.95 56.68 1x4w s SER 8 Cb 0.00 -1.80 0.19 0.00 0.10 0.00 0.00 66.02 64.51 1x4w s SER 8 CO 0.00 0.29 0.63 -0.13 0.98 0.00 0.00 173.24 175.01 1x4w s ARG 9 N -1.71 2.91 -0.30 4.02 3.00 -1.26 -5.00 118.95 120.62 1x4w s ARG 9 Ca 0.23 -3.14 -0.13 0.00 0.00 0.00 0.00 55.73 52.70 1x4w s ARG 9 Cb -0.12 -3.77 0.14 0.00 0.00 0.00 0.00 34.95 31.19 1x4w s ARG 9 CO 0.14 -1.25 0.78 -1.12 0.00 0.00 0.00 175.30 173.86 1x4w s SER 10 N -0.30 -0.90 0.31 0.23 0.01 -1.26 -5.03 113.70 106.75 1x4w s SER 10 Ca 0.25 1.27 0.04 0.00 1.31 0.00 0.00 55.95 58.82 1x4w s SER 10 Cb -0.10 1.92 0.64 0.00 0.21 0.00 0.00 66.02 68.70 1x4w s SER 10 CO -0.11 -0.18 1.85 0.50 0.41 0.00 0.00 173.24 175.71 1x4w h LYS 11 N 7.59 0.87 -5.97 12.44 1.63 -1.96 -3.40 116.57 127.77 1x4w h LYS 11 Ca -0.19 -0.05 -0.62 0.00 -0.85 0.00 0.00 60.65 58.93 1x4w h LYS 11 Cb 1.13 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.55 1x4w h LYS 11 CO 0.11 0.57 1.47 0.94 -3.45 0.00 0.00 179.45 179.09 1x4w n GLN 12 N -4.60 1.54 -0.05 1.90 -0.06 -1.26 -4.85 117.38 110.01 1x4w n GLN 12 Ca 0.18 0.41 -0.13 0.00 -2.00 0.00 0.00 57.00 55.46 1x4w n GLN 12 Cb 0.39 -2.91 -0.12 0.00 -4.06 0.00 0.00 30.24 23.54 1x4w n GLN 12 CO 0.00 0.00 0.00 -0.22 -0.20 0.00 0.00 177.06 176.64 1x4w h LYS 13 N 14.10 -0.01 -1.63 3.69 1.63 -1.86 -3.47 116.57 129.01 1x4w h LYS 13 Ca -0.34 0.00 0.10 0.00 -0.85 0.00 0.00 60.65 59.55 1x4w h LYS 13 Cb 1.28 0.00 -0.23 0.00 -0.60 0.00 0.00 32.23 32.67 1x4w h LYS 13 CO 0.99 0.80 0.15 -1.12 -3.45 0.00 0.00 179.45 176.82 1x4w s SER 14 N -6.02 -0.77 0.31 4.20 0.01 -1.26 -5.03 113.70 105.13 1x4w s SER 14 Ca -0.17 1.15 0.07 0.00 1.31 0.00 0.00 55.95 58.30 1x4w s SER 14 Cb -0.01 1.58 0.83 0.00 0.21 0.00 0.00 66.02 68.62 1x4w s SER 14 CO 0.66 -0.17 1.70 0.03 0.41 0.00 0.00 173.24 175.87 1x4w h ARG 15 N 7.01 0.42 -1.61 12.44 -0.00 -1.91 0.21 114.38 130.94 1x4w h ARG 15 Ca -0.24 -0.03 0.47 0.00 -0.50 0.00 0.00 59.98 59.68 1x4w h ARG 15 Cb 1.17 -0.09 -0.06 0.00 0.00 0.00 0.00 29.97 30.98 1x4w h ARG 15 CO 0.14 0.28 1.30 -0.09 0.00 0.00 0.00 179.97 181.60 1x4w h ARG 16 N 0.43 0.00 -5.41 0.04 2.43 -1.95 -3.39 114.38 106.54 1x4w h ARG 16 Ca 0.61 0.00 -0.43 0.00 -0.81 0.00 0.00 59.98 59.36 1x4w h ARG 16 Cb 1.21 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 30.62 1x4w h ARG 16 CO -0.53 0.00 -0.71 1.03 -1.51 0.00 0.00 179.97 178.25 1x4w s ARG 17 N -4.75 1.32 1.06 0.20 0.52 0.75 -1.66 118.95 116.40 1x4w s ARG 17 Ca -0.04 -1.61 -0.17 0.00 -0.52 0.00 0.00 55.73 53.39 1x4w s ARG 17 Cb 0.23 -0.98 0.07 0.00 0.52 0.00 0.00 34.95 34.79 1x4w s ARG 17 CO 0.76 0.11 0.05 0.00 0.02 0.00 0.00 175.30 176.24 1x4w n PHE 19 N -4.08 0.00 -0.02 0.00 -0.00 -0.78 -3.02 117.46 109.57 1x4w n PHE 19 Ca 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.45 1x4w n PHE 19 Cb 0.60 0.00 -0.01 0.00 -0.00 0.00 0.00 39.48 40.06 1x4w n PHE 19 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 1x4w n GLN 20 N -0.59 0.08 -0.00 -4.13 -0.06 -1.26 -4.74 117.38 106.67 1x4w n GLN 20 Ca 0.06 0.02 0.05 0.00 -2.00 0.00 0.00 57.00 55.13 1x4w n GLN 20 Cb 0.36 -1.04 0.05 0.00 -4.06 0.00 0.00 30.24 25.54 1x4w n GLN 20 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1x4w n GLN 22 N 0.61 -0.85 -3.11 0.00 3.00 -1.17 -4.84 117.38 111.02 1x4w n GLN 22 Ca 0.06 0.11 -0.29 0.00 -0.01 0.00 0.00 57.00 56.87 1x4w n GLN 22 Cb 0.28 -3.92 -0.03 0.00 0.00 0.00 0.00 30.24 26.57 1x4w n GLN 22 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 1x4w s THR 23 N -3.89 4.94 -0.10 5.09 -1.32 -1.26 -4.55 115.64 114.54 1x4w s THR 23 Ca 0.32 0.23 -0.29 0.00 -1.21 0.00 0.00 61.69 60.74 1x4w s THR 23 Cb -0.19 -3.75 -0.06 0.00 -1.51 0.00 0.00 72.50 66.99 1x4w s THR 23 CO 0.98 -0.45 1.84 -1.59 -2.21 0.00 0.00 174.62 173.20 1x4w s LYS 24 N -3.80 3.87 -0.15 7.08 -2.85 -1.26 -1.63 119.74 121.00 1x4w s LYS 24 Ca 0.47 2.14 -0.07 0.00 -1.00 0.00 0.00 55.97 57.51 1x4w s LYS 24 Cb -0.10 -4.12 -0.04 0.00 -2.06 0.00 0.00 37.83 31.50 1x4w s LYS 24 CO 0.32 -1.23 0.08 -0.51 0.10 0.00 0.00 175.35 174.11 1x4w s LEU 25 N 5.26 3.97 0.57 2.77 1.43 -0.66 -4.95 118.68 127.07 1x4w s LEU 25 Ca 0.82 0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 53.98 1x4w s LEU 25 Cb -0.34 -1.98 -0.05 0.00 0.03 0.00 0.00 46.19 43.85 1x4w s LEU 25 CO 0.34 0.26 1.03 -1.61 0.23 0.00 0.00 176.35 176.60 1x4w s GLU 26 N -0.16 3.55 0.35 1.70 2.02 -1.26 -4.61 118.70 120.28 1x4w s GLU 26 Ca 0.08 1.05 0.15 0.00 0.02 0.00 0.00 54.97 56.27 1x4w s GLU 26 Cb -0.12 -2.07 1.06 0.00 0.10 0.00 0.00 34.13 33.10 1x4w s GLU 26 CO 0.01 -0.61 1.69 -0.07 0.02 0.00 0.00 175.26 176.30 1x4w h LEU 27 N 0.46 0.53 -0.51 1.80 -0.00 -1.98 1.13 115.31 116.74 1x4w h LEU 27 Ca -0.46 0.16 -0.11 0.00 -0.00 0.00 0.00 57.88 57.46 1x4w h LEU 27 Cb 1.20 0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.94 1x4w h LEU 27 CO 0.59 -0.04 -0.54 1.62 -0.00 0.00 0.00 178.44 180.08 1x4w h VAL 28 N 0.39 1.07 0.04 1.22 3.04 -2.01 -3.30 116.25 116.70 1x4w h VAL 28 Ca 0.70 -2.08 -0.00 0.00 -1.01 0.00 0.00 66.70 64.30 1x4w h VAL 28 Cb 1.59 2.24 0.00 0.00 -2.01 0.00 0.00 31.29 33.11 1x4w h VAL 28 CO -0.51 0.52 -0.02 -0.61 -1.01 0.00 0.00 177.57 175.94 1x4w h GLN 29 N 0.00 -0.06 -0.80 4.17 -0.00 0.80 -2.78 115.11 116.44 1x4w h GLN 29 Ca -0.01 0.00 0.30 0.00 -0.00 0.00 0.00 58.65 58.95 1x4w h GLN 29 Cb 1.19 0.01 -0.11 0.00 0.00 0.00 0.00 27.48 28.58 1x4w h GLN 29 CO 0.07 -0.04 0.48 1.04 0.00 0.00 0.00 178.83 180.38 1x4w n GLN 30 N -3.60 -0.03 -0.04 1.69 6.02 0.58 0.16 117.38 122.16 1x4w n GLN 30 Ca -0.01 0.88 -0.13 0.00 -0.01 0.00 0.00 57.00 57.73 1x4w n GLN 30 Cb 0.02 -1.65 -0.11 0.00 1.02 0.00 0.00 30.24 29.52 1x4w n GLN 30 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1x4w h GLU 31 N 0.00 -0.02 0.58 -1.09 4.39 -1.67 -3.11 114.58 113.67 1x4w h GLU 31 Ca 0.58 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 60.25 1x4w h GLU 31 Cb 1.70 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.36 1x4w h GLU 31 CO -0.41 0.74 -0.28 -0.07 -1.16 0.00 0.00 179.01 177.83 1x4w h LEU 32 N -0.87 -0.67 -1.53 1.33 4.07 0.19 -3.06 115.31 114.77 1x4w h LEU 32 Ca -0.00 0.02 0.41 0.00 0.08 0.00 0.00 57.88 58.39 1x4w h LEU 32 Cb 0.77 0.17 -0.11 0.00 1.08 0.00 0.00 40.66 42.58 1x4w h LEU 32 CO 0.00 -0.38 0.88 1.23 -1.08 0.00 0.00 178.44 179.09 1x4w h GLY 33 N -0.97 0.99 -3.95 0.83 0.00 -0.23 -3.42 103.07 96.31 1x4w h GLY 33 Ca -0.08 -0.11 -0.58 0.00 0.00 0.00 0.00 47.33 46.56 1x4w h GLY 33 CO 0.13 -0.26 -1.04 -1.14 0.00 0.00 0.00 176.54 174.23 1x4w n SER 34 N -4.54 -3.27 -4.73 0.19 3.41 -1.16 -3.61 113.62 99.92 1x4w n SER 34 Ca 0.34 0.68 -0.33 0.00 -0.26 0.00 0.00 58.87 59.31 1x4w n SER 34 Cb 1.36 -0.83 -0.08 0.00 -0.26 0.00 0.00 64.21 64.41 1x4w n SER 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x4w h ARG 36 N 1.36 0.25 -0.87 0.00 3.08 -1.94 -3.36 114.38 112.90 1x4w h ARG 36 Ca -0.43 -0.43 0.18 0.00 0.07 0.00 0.00 59.98 59.37 1x4w h ARG 36 Cb 1.32 0.16 -0.11 0.00 0.08 0.00 0.00 29.97 31.41 1x4w h ARG 36 CO 0.73 1.10 0.41 0.00 -1.07 0.00 0.00 179.97 181.13 1x4w n GLY 38 N -1.33 0.71 3.19 0.00 0.00 -1.26 -5.01 105.19 101.48 1x4w n GLY 38 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 1x4w n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x4w s TYR 39 N -0.71 1.12 -0.14 1.61 2.02 -1.26 -5.01 117.35 114.99 1x4w s TYR 39 Ca 0.00 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 56.06 1x4w s TYR 39 Cb 0.00 -0.61 -0.00 0.00 -0.40 0.00 0.00 41.96 40.95 1x4w s TYR 39 CO 0.00 0.03 -0.16 0.08 -1.57 0.00 0.00 175.55 173.92 1x4w s VAL 40 N -2.44 2.63 0.39 0.71 1.01 -1.26 -0.77 120.40 120.68 1x4w s VAL 40 Ca 0.06 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.29 1x4w s VAL 40 Cb -0.03 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1x4w s VAL 40 CO 0.01 0.53 0.05 -0.36 0.00 0.00 0.00 175.10 175.32 1x4w s PHE 41 N 0.61 2.04 0.82 5.22 0.40 -1.24 -1.86 117.98 123.98 1x4w s PHE 41 Ca -0.09 -0.96 -0.10 0.00 -0.60 0.00 0.00 56.93 55.18 1x4w s PHE 41 Cb -0.16 -1.42 0.13 0.00 0.51 0.00 0.00 43.02 42.07 1x4w s PHE 41 CO 0.03 0.08 1.16 0.00 0.70 0.00 0.00 175.22 177.19 1x4w n MET 43 N -3.30 0.12 -0.01 0.00 1.56 -1.26 0.19 117.12 114.43 1x4w n MET 43 Ca 0.12 0.61 -0.19 0.00 -0.27 0.00 0.00 57.70 57.98 1x4w n MET 43 Cb 0.60 -1.98 -0.14 0.00 2.15 0.00 0.00 33.22 33.85 1x4w n MET 43 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 1x4w n LEU 44 N -2.17 2.28 -0.84 -0.89 4.77 -1.26 -4.26 117.00 114.63 1x4w n LEU 44 Ca -0.01 0.22 0.08 0.00 -0.03 0.00 0.00 56.01 56.27 1x4w n LEU 44 Cb 0.11 -0.83 0.25 0.00 -2.33 0.00 0.00 43.42 40.62 1x4w n LEU 44 CO 0.08 0.77 0.70 1.41 -1.33 0.00 0.00 177.39 179.02 1x4w n HIS 45 N -3.37 0.87 0.12 -1.77 8.25 -0.22 -4.58 115.22 114.52 1x4w n HIS 45 Ca -0.30 -0.93 -0.02 0.00 -0.26 0.00 0.00 57.72 56.21 1x4w n HIS 45 Cb 1.05 -0.31 0.18 0.00 1.12 0.00 0.00 29.99 32.02 1x4w n HIS 45 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1x4w h ARG 46 N 1.59 0.10 -7.16 -0.41 0.11 0.20 -3.41 114.38 105.40 1x4w h ARG 46 Ca 0.01 -0.06 -0.52 0.00 0.10 0.00 0.00 59.98 59.51 1x4w h ARG 46 Cb 1.42 0.01 0.11 0.00 1.11 0.00 0.00 29.97 32.62 1x4w h ARG 46 CO 0.21 0.64 0.40 -0.51 0.10 0.00 0.00 179.97 180.82 1x4w s LEU 47 N -7.83 3.47 -0.01 0.08 1.43 -1.26 -4.87 118.68 109.69 1x4w s LEU 47 Ca -0.03 2.17 -0.25 0.00 -1.03 0.00 0.00 54.13 55.00 1x4w s LEU 47 Cb 0.13 -4.57 -0.19 0.00 0.03 0.00 0.00 46.19 41.58 1x4w s LEU 47 CO 0.77 -1.72 1.28 1.55 0.23 0.00 0.00 176.35 178.47 1x4w h PRO 48 N 0.26 0.07 -0.19 1.29 0.13 -1.96 -3.11 132.00 128.49 1x4w h PRO 48 Ca -0.48 -0.04 0.06 0.00 -0.87 0.00 0.00 66.00 64.67 1x4w h PRO 48 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1x4w h PRO 48 CO 0.54 0.54 0.16 1.05 -0.23 0.00 0.00 178.00 180.05 1x4w h GLU 49 N -0.39 0.00 -0.57 0.86 9.09 -1.93 0.19 114.58 121.83 1x4w h GLU 49 Ca 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.37 1x4w h GLU 49 Cb 0.53 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.60 1x4w h GLU 49 CO 0.01 0.00 0.18 1.96 0.05 0.00 0.00 179.01 181.20 1x4w h GLN 50 N 0.00 0.89 -0.66 1.06 1.08 -1.88 -3.03 115.11 112.56 1x4w h GLN 50 Ca 0.09 -0.19 -0.43 0.00 -1.45 0.00 0.00 58.65 56.67 1x4w h GLN 50 Cb 0.41 -0.13 -0.26 0.00 -0.05 0.00 0.00 27.48 27.45 1x4w h GLN 50 CO -0.00 0.80 -0.06 -2.39 -0.95 0.00 0.00 178.83 176.23 1x4w n HIS 51 N -4.43 2.21 -3.75 2.96 1.44 -0.54 -4.94 115.22 108.16 1x4w n HIS 51 Ca 0.03 -2.15 -0.27 0.00 -2.01 0.00 0.00 57.72 53.32 1x4w n HIS 51 Cb 0.20 -0.69 -0.06 0.00 0.12 0.00 0.00 29.99 29.56 1x4w n HIS 51 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1x4w n ASP 52 N -0.95 -0.40 -3.12 4.39 -0.08 -0.36 -4.68 116.55 111.36 1x4w n ASP 52 Ca 0.45 -0.91 -0.32 0.00 -1.51 0.00 0.00 54.79 52.50 1x4w n ASP 52 Cb 0.96 -1.15 -0.01 0.00 2.34 0.00 0.00 41.12 43.26 1x4w n ASP 52 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1x4w n THR 54 N -0.41 1.57 -0.39 0.00 5.66 -1.26 -4.94 114.28 114.50 1x4w n THR 54 Ca 0.10 -0.79 -0.29 0.00 -3.05 0.00 0.00 64.05 60.03 1x4w n THR 54 Cb 0.24 -1.01 0.27 0.00 -1.55 0.00 0.00 70.33 68.29 1x4w n THR 54 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 1x4w n PHE 55 N -3.03 -2.14 -3.60 1.09 7.35 -1.26 -5.00 117.46 110.87 1x4w n PHE 55 Ca -0.16 -0.38 -0.27 0.00 -0.76 0.00 0.00 57.45 55.88 1x4w n PHE 55 Cb 1.04 -1.57 -0.10 0.00 0.35 0.00 0.00 39.48 39.19 1x4w n PHE 55 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1x4w n ASP 56 N -5.20 1.42 -4.71 -2.13 9.92 -1.26 -5.08 116.55 109.51 1x4w n ASP 56 Ca 0.05 -2.85 -0.28 0.00 -0.53 0.00 0.00 54.79 51.19 1x4w n ASP 56 Cb 0.56 -0.66 -0.08 0.00 -0.64 0.00 0.00 41.12 40.30 1x4w n ASP 56 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 1x4w s HIS 57 N -0.91 2.33 -0.21 1.24 -3.43 -1.26 -5.13 115.29 107.92 1x4w s HIS 57 Ca 0.30 -0.72 -0.01 0.00 -0.80 0.00 0.00 55.06 53.83 1x4w s HIS 57 Cb 0.02 -1.81 0.06 0.00 -1.43 0.00 0.00 32.58 29.42 1x4w s HIS 57 CO -0.17 0.24 -0.01 -1.64 -2.00 0.00 0.00 174.74 171.16 1x4w s MET 58 N -3.86 1.17 -0.09 -0.38 -1.94 -1.26 -5.01 119.30 107.93 1x4w s MET 58 Ca 0.30 -0.70 -0.26 0.00 -1.71 0.00 0.00 55.69 53.33 1x4w s MET 58 Cb 0.05 -2.33 -0.29 0.00 2.01 0.00 0.00 34.83 34.28 1x4w s MET 58 CO 0.16 -0.60 0.83 0.78 -0.01 0.00 0.00 175.02 176.18 1x4w h GLY 59 N 8.10 0.17 -5.18 -0.03 0.00 -2.06 -3.46 103.07 100.61 1x4w h GLY 59 Ca -0.18 -0.43 -0.68 0.00 0.00 0.00 0.00 47.33 46.05 1x4w h GLY 59 CO 0.38 0.37 -0.74 0.50 0.00 0.00 0.00 176.54 177.05 1x4w s ARG 60 N -2.33 2.84 0.97 4.80 3.00 -1.26 -5.11 118.95 121.86 1x4w s ARG 60 Ca -0.16 -0.64 -0.13 0.00 0.00 0.00 0.00 55.73 54.80 1x4w s ARG 60 Cb -0.01 -2.53 0.06 0.00 0.00 0.00 0.00 34.95 32.47 1x4w s ARG 60 CO 0.76 0.52 0.46 0.41 0.00 0.00 0.00 175.30 177.45 1x4w n GLY 61 N 2.62 -1.88 3.54 -3.53 0.00 -1.26 -4.84 105.19 99.84 1x4w n GLY 61 Ca -0.18 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 1x4w n GLY 61 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4w s SER 62 N -2.08 6.84 0.45 1.61 0.15 -1.26 -4.95 113.70 114.47 1x4w s SER 62 Ca 0.58 -2.42 0.02 0.00 0.70 0.00 0.00 55.95 54.83 1x4w s SER 62 Cb -0.21 -2.52 0.02 0.00 -1.71 0.00 0.00 66.02 61.61 1x4w s SER 62 CO 0.66 -1.10 0.17 0.61 1.20 0.00 0.00 173.24 174.78 1x4w n GLY 63 N 5.28 3.23 0.00 9.45 0.00 -1.26 -5.00 105.19 116.89 1x4w n GLY 63 Ca 0.42 -2.32 0.07 0.00 0.00 0.00 0.00 46.02 44.20 1x4w n GLY 63 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4w n PRO 64 N -1.34 0.30 -1.69 1.61 -0.04 -1.26 -4.83 135.00 127.75 1x4w n PRO 64 Ca -0.10 0.10 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 1x4w n PRO 64 Cb 0.55 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.50 1x4w n PRO 64 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x4w n SER 65 N -1.20 2.61 -4.08 3.54 7.64 -1.26 -4.96 113.62 115.91 1x4w n SER 65 Ca 0.08 1.20 -0.35 0.00 1.01 0.00 0.00 58.87 60.82 1x4w n SER 65 Cb 0.10 -1.46 -0.11 0.00 -1.01 0.00 0.00 64.21 61.72 1x4w n SER 65 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x4w s SER 66 N -0.33 5.11 0.00 6.43 0.15 -1.26 -5.16 113.70 118.65 1x4w s SER 66 Ca 0.56 -2.58 0.00 0.00 0.70 0.00 0.00 55.95 54.63 1x4w s SER 66 Cb -0.58 -1.81 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 1x4w s SER 66 CO 0.62 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 175.26