#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4w h LEU 2 N 0.00 0.00 -0.87 0.27 4.07 -1.67 -1.13 115.31 115.97 1b4w h LEU 2 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1b4w h LEU 2 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1b4w h LEU 2 CO 0.00 0.07 0.00 -0.07 -1.08 0.00 0.00 178.44 177.36 1b4w h LEU 3 N 0.00 0.00 0.16 1.67 3.38 -1.99 0.13 115.31 118.66 1b4w h LEU 3 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1b4w h LEU 3 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1b4w h LEU 3 CO 0.01 0.00 -1.83 1.56 0.09 0.00 0.00 178.44 178.27 1b4w h GLN 4 N 0.00 0.34 -0.49 1.13 4.20 -1.66 -3.19 115.11 115.44 1b4w h GLN 4 Ca 0.00 -0.57 0.03 0.00 0.06 0.00 0.00 58.65 58.16 1b4w h GLN 4 Cb 0.66 0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.62 1b4w h GLN 4 CO 0.00 1.26 0.28 0.35 -0.67 0.00 0.00 178.83 180.05 1b4w h PHE 5 N 0.09 0.52 -1.00 2.96 3.57 -1.11 -1.72 116.94 120.25 1b4w h PHE 5 Ca -0.37 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.24 1b4w h PHE 5 Cb 2.07 -0.16 -0.08 0.00 2.79 0.00 0.00 35.95 40.57 1b4w h PHE 5 CO 0.09 0.29 0.64 -0.09 -2.23 0.00 0.00 178.31 177.01 1b4w h ARG 6 N 0.55 1.05 -0.00 1.11 2.43 -1.07 -0.92 114.38 117.53 1b4w h ARG 6 Ca 0.20 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 1b4w h ARG 6 Cb 0.05 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1b4w h ARG 6 CO -0.11 0.69 -0.49 0.87 -1.51 0.00 0.00 179.97 179.42 1b4w h LYS 7 N 1.08 0.00 -0.19 0.20 1.57 -1.31 -1.99 116.57 115.92 1b4w h LYS 7 Ca 0.47 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.17 1b4w h LYS 7 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1b4w h LYS 7 CO -0.22 0.49 -0.18 0.52 -0.57 0.00 0.00 179.45 179.49 1b4w h MET 8 N 0.00 0.47 -0.64 3.15 2.86 -0.58 -2.67 114.93 117.52 1b4w h MET 8 Ca -0.00 -0.24 -0.06 0.00 -2.06 0.00 0.00 59.70 57.34 1b4w h MET 8 Cb 0.87 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 1b4w h MET 8 CO 0.06 0.81 0.18 0.82 1.06 0.00 0.00 176.91 179.84 1b4w h ILE 9 N 0.14 1.25 0.16 -1.22 2.04 -1.25 -1.87 117.51 116.76 1b4w h ILE 9 Ca 0.03 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.00 1b4w h ILE 9 Cb 0.72 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1b4w h ILE 9 CO 0.05 0.34 -0.10 0.50 0.00 0.00 0.00 178.15 178.94 1b4w h LYS 10 N 0.93 -0.24 -0.58 2.37 3.64 -1.36 0.14 116.57 121.46 1b4w h LYS 10 Ca 0.20 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.52 1b4w h LYS 10 Cb 0.33 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1b4w h LYS 10 CO -0.00 -0.16 0.07 -0.22 -2.27 0.00 0.00 179.45 176.86 1b4w h LYS 11 N -0.25 0.95 0.00 1.90 1.63 -1.42 1.10 116.57 120.49 1b4w h LYS 11 Ca -0.01 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.54 1b4w h LYS 11 Cb 0.21 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1b4w h LYS 11 CO 0.01 0.90 -0.32 0.52 -3.45 0.00 0.00 179.45 177.12 1b4w h MET 12 N 0.89 0.00 0.00 1.90 2.86 -1.27 -3.38 114.93 115.93 1b4w h MET 12 Ca 0.18 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.71 1b4w h MET 12 Cb 0.43 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1b4w h MET 12 CO 0.01 0.00 -1.42 2.41 1.06 0.00 0.00 176.91 178.98 1b4w n THR 13 N -2.93 0.42 -0.72 2.22 -1.04 0.49 -4.66 114.28 108.06 1b4w n THR 13 Ca 0.03 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1b4w n THR 13 Cb 0.53 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 68.22 1b4w n THR 13 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1b4w n GLY 14 N 2.79 0.80 3.70 3.41 0.00 0.38 -5.03 105.19 111.25 1b4w n GLY 14 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 1b4w n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b4w s LYS 16 N -0.28 2.54 -0.39 1.61 1.02 -1.25 -5.03 119.74 117.96 1b4w s LYS 16 Ca 0.00 -1.07 -0.29 0.00 0.02 0.00 0.00 55.97 54.63 1b4w s LYS 16 Cb 0.00 -2.42 0.01 0.00 -0.52 0.00 0.00 37.83 34.90 1b4w s LYS 16 CO 0.00 0.45 1.35 -2.00 -0.92 0.00 0.00 175.35 174.23 1b4w s GLU 17 N -3.10 3.69 0.24 1.68 -6.30 -1.26 -4.20 118.70 109.45 1b4w s GLU 17 Ca 0.29 0.97 -0.05 0.00 -2.50 0.00 0.00 54.97 53.68 1b4w s GLU 17 Cb -0.09 -3.97 0.37 0.00 0.00 0.00 0.00 34.13 30.44 1b4w s GLU 17 CO 0.20 -1.42 1.81 -1.35 0.02 0.00 0.00 175.26 174.52 1b4w h PRO 18 N 10.13 0.75 -0.06 4.30 0.11 -1.93 0.15 132.00 145.45 1b4w h PRO 18 Ca -0.27 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.80 1b4w h PRO 18 Cb 1.10 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 1b4w h PRO 18 CO 1.08 0.49 0.02 -0.24 -0.21 0.00 0.00 178.00 179.14 1b4w h VAL 19 N 0.77 1.03 0.03 3.15 3.04 -1.95 0.16 116.25 122.47 1b4w h VAL 19 Ca 0.38 -0.09 -0.29 0.00 -1.01 0.00 0.00 66.70 65.69 1b4w h VAL 19 Cb 0.34 0.96 -0.04 0.00 -2.01 0.00 0.00 31.29 30.54 1b4w h VAL 19 CO -0.24 0.03 -1.58 0.52 -1.01 0.00 0.00 177.57 175.30 1b4w n VAL 20 N -4.51 1.59 0.15 1.51 0.31 -0.92 -4.11 118.33 112.35 1b4w n VAL 20 Ca -0.02 -0.21 0.09 0.00 -0.01 0.00 0.00 64.34 64.20 1b4w n VAL 20 Cb 0.10 -1.95 0.07 0.00 -0.91 0.00 0.00 33.84 31.15 1b4w n VAL 20 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1b4w h SER 21 N -0.76 0.00 0.00 4.52 0.02 -0.93 -3.42 113.55 112.98 1b4w h SER 21 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1b4w h SER 21 Cb 1.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.04 1b4w h SER 21 CO -0.17 0.13 -0.62 -1.22 -1.14 0.00 0.00 176.83 173.81 1b4w n TYR 22 N -2.97 0.00 0.32 3.45 4.01 0.45 -4.62 117.16 117.80 1b4w n TYR 22 Ca 0.01 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.96 1b4w n TYR 22 Cb 0.60 0.00 1.12 0.00 -0.31 0.00 0.00 39.34 40.74 1b4w n TYR 22 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b4w h ALA 23 N 0.00 1.18 0.00 -0.72 0.00 -1.43 -3.01 119.26 115.28 1b4w h ALA 23 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b4w h ALA 23 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1b4w h ALA 23 CO 0.00 -0.02 -0.33 1.19 0.00 0.00 0.00 179.25 180.09 1b4w n PHE 24 N -3.31 0.00 -2.40 0.00 3.72 -1.26 -3.53 117.46 110.68 1b4w n PHE 24 Ca -0.03 -0.29 -0.41 0.00 -0.05 0.00 0.00 57.45 56.68 1b4w n PHE 24 Cb 0.09 -0.08 -0.04 0.00 -0.94 0.00 0.00 39.48 38.52 1b4w n PHE 24 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1b4w s TYR 25 N -0.83 3.47 0.00 1.38 6.14 -1.14 -1.13 117.35 125.24 1b4w s TYR 25 Ca 0.09 1.57 0.00 0.00 0.64 0.00 0.00 57.07 59.37 1b4w s TYR 25 Cb 0.08 -3.38 0.00 0.00 0.42 0.00 0.00 41.96 39.08 1b4w s TYR 25 CO 0.01 -0.93 0.00 0.41 0.64 0.00 0.00 175.55 175.68 1b4w n GLY 26 N 1.53 2.34 0.00 8.97 0.00 0.10 -2.64 105.19 115.49 1b4w n GLY 26 Ca 0.01 -0.33 0.05 0.00 0.00 0.00 0.00 46.02 45.75 1b4w n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4w n TYR 28 N -1.34 0.00 0.17 0.00 4.01 -1.26 -2.34 117.16 116.40 1b4w n TYR 28 Ca 0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.78 1b4w n TYR 28 Cb 0.19 0.00 0.36 0.00 -0.31 0.00 0.00 39.34 39.58 1b4w n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b4w n GLY 30 N -0.52 -2.51 3.79 0.00 0.00 -1.23 -4.61 105.19 100.10 1b4w n GLY 30 Ca -0.02 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.31 1b4w n GLY 30 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b4w s SER 31 N -1.64 6.05 0.76 1.61 1.04 -1.26 -4.75 113.70 115.51 1b4w s SER 31 Ca 0.00 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.44 1b4w s SER 31 Cb 0.00 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1b4w s SER 31 CO 0.00 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1b4w n GLY 32 N -0.16 2.14 0.00 7.32 0.00 -1.26 -4.93 105.19 108.30 1b4w n GLY 32 Ca 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1b4w n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4w n GLY 33 N 0.00 2.77 3.27 -0.02 0.00 -1.26 -4.65 105.19 105.31 1b4w n GLY 33 Ca 0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 1b4w n GLY 33 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1b4w s ARG 34 N -1.81 0.92 4.12 1.61 6.06 -0.99 -5.00 118.95 123.86 1b4w s ARG 34 Ca 0.00 -0.63 0.00 0.00 -2.50 0.00 0.00 55.73 52.60 1b4w s ARG 34 Cb 0.00 0.40 0.00 0.00 0.06 0.00 0.00 34.95 35.41 1b4w s ARG 34 CO 0.00 -0.32 0.00 0.41 -2.50 0.00 0.00 175.30 172.89 1b4w n GLY 35 N 0.19 0.92 3.66 8.12 0.00 -1.17 -4.65 105.19 112.26 1b4w n GLY 35 Ca -0.17 -0.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 1b4w n GLY 35 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b4w s LYS 36 N 0.00 3.07 0.20 1.61 2.20 -1.26 -2.22 119.74 123.34 1b4w s LYS 36 Ca 0.00 -0.42 -0.33 0.00 -0.36 0.00 0.00 55.97 54.86 1b4w s LYS 36 Cb 0.00 -2.81 -0.14 0.00 -1.51 0.00 0.00 37.83 33.38 1b4w s LYS 36 CO 0.00 0.64 1.51 -2.30 -0.36 0.00 0.00 175.35 174.84 1b4w n PRO 37 N 2.32 2.13 -0.23 4.03 -0.02 -1.26 -4.78 135.00 137.19 1b4w n PRO 37 Ca -0.18 0.76 -0.08 0.00 -2.02 0.00 0.00 63.50 61.97 1b4w n PRO 37 Cb 0.53 -2.49 0.03 0.00 -0.02 0.00 0.00 33.50 31.56 1b4w n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1b4w h LYS 38 N 5.17 1.06 0.00 -0.52 1.79 -1.96 -3.47 116.57 118.64 1b4w h LYS 38 Ca -0.45 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 57.73 1b4w h LYS 38 Cb 1.26 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 1b4w h LYS 38 CO 0.83 0.99 0.00 -0.40 -1.08 0.00 0.00 179.45 179.79 1b4w n ASP 39 N -4.24 0.00 0.09 0.86 5.75 -1.26 -5.01 116.55 112.74 1b4w n ASP 39 Ca 0.04 -0.58 -0.12 0.00 -0.01 0.00 0.00 54.79 54.11 1b4w n ASP 39 Cb 0.30 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.32 1b4w n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1b4w h ALA 40 N 1.83 -0.21 -0.85 2.12 0.00 -1.93 -0.26 119.26 119.96 1b4w h ALA 40 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1b4w h ALA 40 Cb 0.00 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1b4w h ALA 40 CO 0.00 -0.64 0.54 1.15 0.00 0.00 0.00 179.25 180.30 1b4w h THR 41 N -0.25 1.11 0.00 0.00 2.02 -1.90 -0.65 112.91 113.24 1b4w h THR 41 Ca 0.01 -0.36 -0.05 0.00 0.77 0.00 0.00 66.41 66.78 1b4w h THR 41 Cb 0.25 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.63 1b4w h THR 41 CO -0.05 0.19 -0.25 -0.78 0.37 0.00 0.00 175.52 175.00 1b4w h ASP 42 N 1.04 0.00 0.36 4.18 1.82 -1.85 -1.45 116.42 120.52 1b4w h ASP 42 Ca 0.35 0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.86 1b4w h ASP 42 Cb 0.05 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 1b4w h ASP 42 CO -0.13 0.25 -0.54 0.03 -1.61 0.00 0.00 179.24 177.25 1b4w h ARG 43 N 0.00 0.20 -0.70 0.28 3.08 0.46 -1.29 114.38 116.41 1b4w h ARG 43 Ca -0.00 -0.12 0.04 0.00 0.07 0.00 0.00 59.98 59.97 1b4w h ARG 43 Cb 0.52 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.53 1b4w h ARG 43 CO 0.03 0.69 0.43 0.00 -1.07 0.00 0.00 179.97 180.05 1b4w h PHE 46 N 0.22 0.55 -0.43 0.00 3.57 -0.58 -0.41 116.94 119.85 1b4w h PHE 46 Ca -0.00 -0.08 -0.08 0.00 3.53 0.00 0.00 57.97 61.34 1b4w h PHE 46 Cb 1.09 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1b4w h PHE 46 CO 0.02 0.60 -0.05 0.28 -2.23 0.00 0.00 178.31 176.93 1b4w h VAL 47 N 0.35 1.27 -0.28 1.41 2.07 -0.99 -1.52 116.25 118.56 1b4w h VAL 47 Ca 0.10 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1b4w h VAL 47 Cb 0.34 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1b4w h VAL 47 CO 0.01 0.38 0.11 -0.74 0.02 0.00 0.00 177.57 177.35 1b4w h HIS 48 N 0.63 0.37 -0.42 1.57 -0.00 -1.03 0.85 115.15 117.12 1b4w h HIS 48 Ca 0.12 -0.01 -0.10 0.00 -0.00 0.00 0.00 60.37 60.38 1b4w h HIS 48 Cb 0.57 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 1b4w h HIS 48 CO 0.04 0.30 -0.12 0.22 -0.00 0.00 0.00 177.93 178.38 1b4w h ASP 49 N 0.38 0.83 0.14 3.26 3.58 -0.65 -1.76 116.42 122.20 1b4w h ASP 49 Ca 0.10 -0.37 -0.08 0.00 0.42 0.00 0.00 57.03 57.10 1b4w h ASP 49 Cb 0.08 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.90 1b4w h ASP 49 CO -0.01 1.01 -0.27 0.00 -2.88 0.00 0.00 179.24 177.09 1b4w h TYR 52 N 0.01 0.00 0.00 0.00 -1.99 -1.23 -2.65 116.97 111.11 1b4w h TYR 52 Ca 0.04 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.68 1b4w h TYR 52 Cb 0.45 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.16 1b4w h TYR 52 CO 0.05 0.20 -0.43 0.93 -0.00 0.00 0.00 178.16 178.91 1b4w h GLU 53 N 0.00 0.00 0.00 4.88 3.07 -1.43 -2.99 114.58 118.11 1b4w h GLU 53 Ca -0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 1b4w h GLU 53 Cb 0.44 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 1b4w h GLU 53 CO 0.03 0.43 -0.17 0.87 -1.40 0.00 0.00 179.01 178.77 1b4w h LYS 54 N 0.00 0.00 -6.29 2.33 1.57 -1.40 -3.44 116.57 109.34 1b4w h LYS 54 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1b4w h LYS 54 Cb 1.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 1b4w h LYS 54 CO 0.06 0.17 0.89 0.08 -0.57 0.00 0.00 179.45 180.08 1b4w s VAL 55 N -3.25 3.87 -0.07 0.50 1.01 -1.13 -4.91 120.40 116.42 1b4w s VAL 55 Ca 0.05 1.17 -0.01 0.00 0.00 0.00 0.00 61.98 63.18 1b4w s VAL 55 Cb 0.07 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1b4w s VAL 55 CO 0.67 -0.05 -0.07 0.35 0.00 0.00 0.00 175.10 176.01 1b4w n THR 56 N 4.99 0.38 0.30 3.92 -2.24 -1.26 -4.79 114.28 115.57 1b4w n THR 56 Ca 0.14 -0.13 0.19 0.00 -2.27 0.00 0.00 64.05 61.98 1b4w n THR 56 Cb 0.44 -1.04 0.88 0.00 -2.10 0.00 0.00 70.33 68.51 1b4w n THR 56 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1b4w h GLY 59 N 0.23 0.00 -1.39 3.38 0.00 -1.96 -3.47 103.07 99.87 1b4w h GLY 59 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.86 1b4w h GLY 59 CO -0.05 0.00 -0.26 0.00 0.00 0.00 0.00 176.54 176.23 1b4w s ASP 67 N -2.86 6.18 0.50 0.00 -1.08 -1.26 -4.94 116.67 113.21 1b4w s ASP 67 Ca 0.29 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 51.13 1b4w s ASP 67 Cb 0.00 -2.23 1.19 0.00 -1.46 0.00 0.00 42.92 40.42 1b4w s ASP 67 CO 0.20 -0.81 2.13 1.55 0.52 0.00 0.00 175.17 178.76 1b4w h PRO 68 N 8.90 0.11 0.05 4.34 0.13 -1.91 0.23 132.00 143.86 1b4w h PRO 68 Ca -0.29 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.73 1b4w h PRO 68 Cb 1.10 -0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.22 1b4w h PRO 68 CO 0.96 0.08 -0.46 0.87 -0.23 0.00 0.00 178.00 179.22 1b4w h LYS 69 N 0.12 0.22 -0.04 0.86 1.57 -1.96 -3.33 116.57 114.01 1b4w h LYS 69 Ca 0.04 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1b4w h LYS 69 Cb 0.02 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1b4w h LYS 69 CO -0.01 1.08 0.00 0.91 -0.57 0.00 0.00 179.45 180.87 1b4w n TRP 70 N -4.34 0.03 -3.21 -1.35 7.02 -1.16 -2.18 117.44 112.25 1b4w n TRP 70 Ca -0.11 -0.03 -0.39 0.00 -1.02 0.00 0.00 57.50 55.94 1b4w n TRP 70 Cb 0.64 -0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.47 1b4w n TRP 70 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1b4w s ASP 71 N -0.98 6.94 0.14 -0.99 1.11 0.79 -4.77 116.67 118.92 1b4w s ASP 71 Ca 0.14 1.12 -0.24 0.00 0.18 0.00 0.00 52.55 53.75 1b4w s ASP 71 Cb 0.10 -2.36 -0.08 0.00 1.07 0.00 0.00 42.92 41.65 1b4w s ASP 71 CO 0.15 0.07 0.73 -1.81 1.18 0.00 0.00 175.17 175.48 1b4w s ASP 72 N 0.00 7.31 0.30 0.27 1.11 -1.26 0.11 116.67 124.52 1b4w s ASP 72 Ca 0.31 1.56 0.07 0.00 0.18 0.00 0.00 52.55 54.67 1b4w s ASP 72 Cb -0.18 -2.47 -0.06 0.00 1.07 0.00 0.00 42.92 41.29 1b4w s ASP 72 CO 0.16 0.23 -0.05 -0.72 1.18 0.00 0.00 175.17 175.97 1b4w s TYR 73 N -1.14 2.08 -0.11 4.23 -0.85 -1.26 -4.86 117.35 115.44 1b4w s TYR 73 Ca 0.34 -0.68 -0.03 0.00 -0.52 0.00 0.00 57.07 56.18 1b4w s TYR 73 Cb -0.22 -1.22 -0.03 0.00 0.38 0.00 0.00 41.96 40.86 1b4w s TYR 73 CO 0.25 0.33 0.03 0.95 -1.52 0.00 0.00 175.55 175.58 1b4w s THR 74 N -2.94 4.52 0.23 -3.49 -4.23 -1.26 -4.94 115.64 103.53 1b4w s THR 74 Ca 0.31 -0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.50 1b4w s THR 74 Cb 0.04 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.96 1b4w s THR 74 CO 0.13 0.58 0.54 -0.72 -0.54 0.00 0.00 174.62 174.61 1b4w s TYR 75 N -0.64 0.10 0.14 3.99 1.13 -1.26 -1.47 117.35 119.34 1b4w s TYR 75 Ca 0.11 -0.47 -0.07 0.00 -1.41 0.00 0.00 57.07 55.23 1b4w s TYR 75 Cb -0.12 0.35 -0.02 0.00 -1.10 0.00 0.00 41.96 41.08 1b4w s TYR 75 CO 0.02 -1.01 0.20 -1.12 -2.51 0.00 0.00 175.55 171.13 1b4w s SER 76 N -2.95 0.14 -0.53 -0.18 0.01 0.12 -4.94 113.70 105.36 1b4w s SER 76 Ca 0.16 -0.91 0.02 0.00 1.31 0.00 0.00 55.95 56.52 1b4w s SER 76 Cb -0.02 0.37 0.57 0.00 0.21 0.00 0.00 66.02 67.15 1b4w s SER 76 CO 0.05 -0.81 1.94 0.79 0.41 0.00 0.00 173.24 175.62 1b4w n TRP 77 N -0.14 3.07 -1.35 2.43 7.02 -1.26 0.14 117.44 127.35 1b4w n TRP 77 Ca -0.09 -2.35 -0.55 0.00 -1.02 0.00 0.00 57.50 53.49 1b4w n TRP 77 Cb 0.63 -1.14 -0.10 0.00 -2.42 0.00 0.00 31.31 28.28 1b4w n TRP 77 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1b4w n LYS 78 N -1.04 0.50 -3.17 -0.99 0.00 -1.03 -2.08 118.16 110.34 1b4w n LYS 78 Ca 0.60 0.13 -0.12 0.00 0.00 0.00 0.00 58.31 58.92 1b4w n LYS 78 Cb 1.22 -1.95 0.06 0.00 0.00 0.00 0.00 35.03 34.35 1b4w n LYS 78 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1b4w n ASN 79 N 8.71 -6.68 0.00 3.14 5.03 -1.26 -2.92 115.26 121.29 1b4w n ASN 79 Ca 0.49 -0.59 0.00 0.00 0.87 0.00 0.00 54.58 55.34 1b4w n ASN 79 Cb 0.09 -5.09 0.00 0.00 -1.02 0.00 0.00 39.78 33.76 1b4w n ASN 79 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1b4w n GLY 80 N -1.32 0.00 3.37 7.41 0.00 -0.88 -4.89 105.19 108.88 1b4w n GLY 80 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1b4w n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1b4w s THR 81 N -0.78 2.36 0.10 2.61 -1.32 -1.15 -5.08 115.64 112.39 1b4w s THR 81 Ca 0.00 -1.12 -0.31 0.00 -1.21 0.00 0.00 61.69 59.05 1b4w s THR 81 Cb 0.00 -1.89 -0.07 0.00 -1.51 0.00 0.00 72.50 69.03 1b4w s THR 81 CO 0.00 0.49 1.31 -0.63 -2.21 0.00 0.00 174.62 173.58 1b4w s ILE 82 N -0.73 3.57 -0.13 5.08 1.01 -1.26 -2.48 121.20 126.26 1b4w s ILE 82 Ca 0.11 1.14 0.01 0.00 0.00 0.00 0.00 60.65 61.92 1b4w s ILE 82 Cb -0.10 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.65 1b4w s ILE 82 CO 0.01 0.10 -0.16 0.68 0.00 0.00 0.00 174.94 175.56 1b4w s VAL 83 N 0.97 1.66 -0.08 2.92 -7.23 0.36 -4.94 120.40 114.07 1b4w s VAL 83 Ca 0.61 -0.72 -0.18 0.00 -1.81 0.00 0.00 61.98 59.89 1b4w s VAL 83 Cb -0.34 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.03 1b4w s VAL 83 CO 0.31 0.47 0.49 0.00 -0.31 0.00 0.00 175.10 176.06 1b4w n GLY 85 N 2.89 5.70 0.00 0.00 0.00 -0.54 -4.98 105.19 108.26 1b4w n GLY 85 Ca -0.08 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1b4w n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4w n GLY 86 N 3.45 0.70 0.01 -0.02 0.00 -1.26 -4.56 105.19 103.51 1b4w n GLY 86 Ca 0.00 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.30 1b4w n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b4w n ASP 88 N -0.60 0.61 -4.59 1.61 9.92 -1.26 -4.85 116.55 117.40 1b4w n ASP 88 Ca 0.00 -0.47 -0.43 0.00 -0.53 0.00 0.00 54.79 53.36 1b4w n ASP 88 Cb 0.00 1.14 -0.03 0.00 -0.64 0.00 0.00 41.12 41.59 1b4w n ASP 88 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1b4w s ASP 89 N -3.68 6.59 0.50 -2.24 -1.08 -1.26 -4.91 116.67 110.59 1b4w s ASP 89 Ca 0.03 0.36 0.25 0.00 -0.52 0.00 0.00 52.55 52.67 1b4w s ASP 89 Cb 0.15 -2.52 1.30 0.00 -1.46 0.00 0.00 42.92 40.39 1b4w s ASP 89 CO 0.85 -1.19 2.02 1.55 0.52 0.00 0.00 175.17 178.91 1b4w h PRO 90 N 9.18 0.00 0.12 4.34 0.13 -1.95 -1.93 132.00 141.89 1b4w h PRO 90 Ca -0.23 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.89 1b4w h PRO 90 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1b4w h PRO 90 CO 1.10 0.16 -0.06 0.00 -0.23 0.00 0.00 178.00 178.96 1b4w h LYS 92 N -0.86 0.49 -0.21 0.00 1.57 -1.93 -0.39 116.57 115.24 1b4w h LYS 92 Ca -0.02 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.53 1b4w h LYS 92 Cb 0.55 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1b4w h LYS 92 CO 0.03 0.48 -0.47 -0.22 -0.57 0.00 0.00 179.45 178.69 1b4w h LYS 93 N 0.48 0.55 -0.47 3.15 3.64 -1.42 -1.52 116.57 120.99 1b4w h LYS 93 Ca 0.11 -0.31 0.02 0.00 -1.27 0.00 0.00 60.65 59.20 1b4w h LYS 93 Cb 0.23 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 1b4w h LYS 93 CO 0.00 0.91 0.28 1.49 -2.27 0.00 0.00 179.45 179.86 1b4w h GLU 94 N 0.44 0.54 0.00 1.90 4.81 0.33 -1.24 114.58 121.36 1b4w h GLU 94 Ca 0.02 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1b4w h GLU 94 Cb 0.99 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1b4w h GLU 94 CO 0.09 0.36 -0.26 -0.39 -0.73 0.00 0.00 179.01 178.08 1b4w h VAL 95 N 0.56 0.59 -0.21 0.32 -1.51 -1.00 -2.79 116.25 112.20 1b4w h VAL 95 Ca 0.19 -1.30 -0.13 0.00 -1.23 0.00 0.00 66.70 64.24 1b4w h VAL 95 Cb 0.02 1.88 -0.01 0.00 -2.13 0.00 0.00 31.29 31.05 1b4w h VAL 95 CO -0.09 0.26 -0.40 0.00 -1.23 0.00 0.00 177.57 176.11 1b4w h GLU 97 N 0.40 0.25 -0.14 0.00 4.39 -1.04 -0.43 114.58 118.02 1b4w h GLU 97 Ca 0.04 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1b4w h GLU 97 Cb 0.88 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 1b4w h GLU 97 CO 0.07 0.76 0.08 0.00 -1.16 0.00 0.00 179.01 178.77 1b4w h ASP 99 N 0.17 0.23 -0.68 0.00 3.32 -1.31 -2.14 116.42 116.00 1b4w h ASP 99 Ca 0.05 -0.23 0.08 0.00 0.02 0.00 0.00 57.03 56.95 1b4w h ASP 99 Cb -0.01 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 39.41 1b4w h ASP 99 CO -0.02 0.40 0.34 0.50 -1.72 0.00 0.00 179.24 178.75 1b4w h LYS 100 N 0.04 0.59 -0.54 3.56 3.64 -0.94 -0.38 116.57 122.53 1b4w h LYS 100 Ca 0.05 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1b4w h LYS 100 Cb 0.26 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1b4w h LYS 100 CO 0.00 0.39 -0.01 0.00 -2.27 0.00 0.00 179.45 177.56 1b4w h ALA 101 N 1.40 0.96 -0.15 5.00 0.00 -1.11 -2.43 119.26 122.94 1b4w h ALA 101 Ca 0.33 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1b4w h ALA 101 Cb 0.31 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1b4w h ALA 101 CO -0.24 0.63 -0.01 0.00 0.00 0.00 0.00 179.25 179.62 1b4w h ALA 102 N 1.12 0.20 -0.85 0.00 0.00 -0.63 -0.53 119.26 118.57 1b4w h ALA 102 Ca 0.16 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1b4w h ALA 102 Cb 0.52 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1b4w h ALA 102 CO 0.03 -0.08 0.53 0.00 0.00 0.00 0.00 179.25 179.72 1b4w h ALA 103 N 0.74 1.18 -0.16 0.00 0.00 -1.05 0.23 119.26 120.20 1b4w h ALA 103 Ca 0.04 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1b4w h ALA 103 Cb 0.40 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1b4w h ALA 103 CO 0.01 0.26 -0.39 0.82 0.00 0.00 0.00 179.25 179.95 1b4w h ILE 104 N 0.95 1.30 -0.55 0.00 2.04 -1.35 -2.15 117.51 117.76 1b4w h ILE 104 Ca 0.38 -1.50 -0.08 0.00 1.00 0.00 0.00 64.86 64.65 1b4w h ILE 104 Cb 0.19 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1b4w h ILE 104 CO -0.18 0.46 0.01 0.00 0.00 0.00 0.00 178.15 178.44 1b4w h PHE 106 N 0.86 0.86 -0.46 0.00 0.04 -0.79 -2.76 116.94 114.69 1b4w h PHE 106 Ca 0.16 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1b4w h PHE 106 Cb 0.50 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.42 1b4w h PHE 106 CO 0.03 0.91 0.29 -0.09 -0.60 0.00 0.00 178.31 178.85 1b4w h ARG 107 N 0.57 0.62 -0.03 1.51 2.43 -1.09 -1.38 114.38 117.02 1b4w h ARG 107 Ca 0.10 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.15 1b4w h ARG 107 Cb 0.64 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1b4w h ARG 107 CO 0.04 0.43 -0.32 -0.44 -1.51 0.00 0.00 179.97 178.18 1b4w h ASP 108 N 0.62 0.05 -0.54 -3.80 3.32 -1.22 -3.06 116.42 111.78 1b4w h ASP 108 Ca 0.17 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1b4w h ASP 108 Cb -0.03 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1b4w h ASP 108 CO -0.03 0.37 0.00 0.59 -1.72 0.00 0.00 179.24 178.45 1b4w n ASN 109 N -4.15 4.09 -0.28 6.45 3.02 -1.05 -4.53 115.26 118.82 1b4w n ASN 109 Ca -0.02 -2.34 0.16 0.00 -0.03 0.00 0.00 54.58 52.35 1b4w n ASN 109 Cb 0.37 -0.48 0.42 0.00 -0.61 0.00 0.00 39.78 39.49 1b4w n ASN 109 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1b4w h LEU 110 N 3.35 0.58 -2.39 3.41 5.85 -1.15 -0.46 115.31 124.50 1b4w h LEU 110 Ca 0.00 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1b4w h LEU 110 Cb 1.21 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 1b4w h LEU 110 CO 0.14 0.24 0.05 0.50 -0.34 0.00 0.00 178.44 179.03 1b4w h LYS 111 N 0.58 0.00 -0.51 1.25 3.64 -1.84 -1.64 116.57 118.05 1b4w h LYS 111 Ca 0.50 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.88 1b4w h LYS 111 Cb 0.99 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1b4w h LYS 111 CO -0.24 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.19 1b4w n THR 112 N -3.88 0.84 -1.90 1.00 -2.24 -0.19 -4.99 114.28 102.93 1b4w n THR 112 Ca -0.02 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.42 1b4w n THR 112 Cb 0.14 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 68.98 1b4w n THR 112 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1b4w s TYR 113 N -1.10 2.63 -0.17 4.78 6.14 -0.62 -4.90 117.35 124.12 1b4w s TYR 113 Ca 0.37 0.40 0.00 0.00 0.64 0.00 0.00 57.07 58.48 1b4w s TYR 113 Cb 0.20 -3.98 0.01 0.00 0.42 0.00 0.00 41.96 38.61 1b4w s TYR 113 CO 0.27 -3.81 -0.16 0.15 0.64 0.00 0.00 175.55 172.63 1b4w s LYS 114 N 2.09 3.14 0.48 4.97 1.02 -1.26 -5.00 119.74 125.17 1b4w s LYS 114 Ca 0.73 -0.77 0.14 0.00 0.02 0.00 0.00 55.97 56.09 1b4w s LYS 114 Cb -0.42 -2.64 1.11 0.00 -0.52 0.00 0.00 37.83 35.35 1b4w s LYS 114 CO 0.32 -0.10 2.08 0.87 -0.92 0.00 0.00 175.35 177.60 1b4w h LYS 115 N 7.64 0.09 0.00 1.68 1.57 -1.96 -1.10 116.57 124.49 1b4w h LYS 115 Ca -0.38 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1b4w h LYS 115 Cb 1.17 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1b4w h LYS 115 CO 0.60 0.13 0.00 2.89 -0.57 0.00 0.00 179.45 182.49 1b4w n ARG 116 N -4.45 0.13 0.01 3.15 1.85 -1.26 -2.05 116.66 114.04 1b4w n ARG 116 Ca -0.02 0.57 0.11 0.00 -1.00 0.00 0.00 57.85 57.51 1b4w n ARG 116 Cb 0.14 -1.88 -0.10 0.00 -1.05 0.00 0.00 32.46 29.57 1b4w n ARG 116 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1b4w n TYR 117 N -2.15 0.14 -2.21 2.89 4.01 -0.42 -4.74 117.16 114.68 1b4w n TYR 117 Ca -0.00 0.04 -0.34 0.00 -0.16 0.00 0.00 57.90 57.44 1b4w n TYR 117 Cb 0.08 -0.41 0.00 0.00 -0.31 0.00 0.00 39.34 38.70 1b4w n TYR 117 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b4w s MET 118 N -3.31 3.38 -1.54 -0.72 0.23 -0.87 -0.72 119.30 115.75 1b4w s MET 118 Ca -0.01 1.41 -0.01 0.00 -1.03 0.00 0.00 55.69 56.06 1b4w s MET 118 Cb 0.14 -2.03 0.00 0.00 -1.53 0.00 0.00 34.83 31.42 1b4w s MET 118 CO 0.86 -0.79 0.06 0.00 -2.03 0.00 0.00 175.02 173.13 1b4w n ALA 119 N -1.56 -0.71 -2.35 3.16 0.00 -0.28 -4.87 120.51 113.91 1b4w n ALA 119 Ca 0.10 0.16 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1b4w n ALA 119 Cb 0.52 -2.14 -0.03 0.00 0.00 0.00 0.00 19.45 17.80 1b4w n ALA 119 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1b4w s TYR 120 N -2.92 3.06 -0.01 0.00 5.04 -1.08 -4.96 117.35 116.48 1b4w s TYR 120 Ca 0.03 1.04 -0.30 0.00 -2.44 0.00 0.00 57.07 55.41 1b4w s TYR 120 Cb -0.02 -3.53 -0.07 0.00 0.35 0.00 0.00 41.96 38.69 1b4w s TYR 120 CO 0.04 -1.83 1.80 -2.14 -1.34 0.00 0.00 175.55 172.08 1b4w s PRO 121 N 2.19 4.16 0.59 4.97 0.02 -1.26 -4.79 135.00 140.88 1b4w s PRO 121 Ca 0.60 2.40 0.33 0.00 0.02 0.00 0.00 61.00 64.35 1b4w s PRO 121 Cb -0.28 -4.05 1.85 0.00 0.02 0.00 0.00 34.50 32.03 1b4w s PRO 121 CO 0.25 -0.89 2.21 0.38 -0.33 0.00 0.00 177.00 178.62 1b4w h ASP 122 N 9.99 0.00 0.38 2.53 3.04 -1.93 -1.82 116.42 128.61 1b4w h ASP 122 Ca -0.44 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.34 1b4w h ASP 122 Cb 1.21 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.50 1b4w h ASP 122 CO 0.95 0.04 -0.06 -0.29 -2.04 0.00 0.00 179.24 177.84 1b4w h ILE 124 N 0.00 0.30 -0.05 4.15 6.09 -2.00 -1.15 117.51 124.85 1b4w h ILE 124 Ca -0.00 -0.35 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 1b4w h ILE 124 Cb 0.14 1.26 0.00 0.00 0.47 0.00 0.00 36.82 38.70 1b4w h ILE 124 CO 0.00 0.06 0.00 0.18 -3.07 0.00 0.00 178.15 175.32 1b4w n LEU 125 N -3.40 1.29 -4.78 2.19 4.32 -0.68 -4.90 117.00 111.04 1b4w n LEU 125 Ca -0.02 -0.46 -0.37 0.00 -0.02 0.00 0.00 56.01 55.13 1b4w n LEU 125 Cb 0.20 -0.03 -0.06 0.00 -1.62 0.00 0.00 43.42 41.91 1b4w n LEU 125 CO 0.27 0.23 0.63 0.00 -1.22 0.00 0.00 177.39 177.30 1b4w n SER 127 N 0.74 -1.78 0.08 0.00 3.41 -1.26 -4.80 113.62 110.02 1b4w n SER 127 Ca 0.01 0.62 -0.05 0.00 -0.26 0.00 0.00 58.87 59.18 1b4w n SER 127 Cb 0.50 -1.13 -0.04 0.00 -0.26 0.00 0.00 64.21 63.28 1b4w n SER 127 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1b4w h SER 128 N -0.18 0.00 -3.63 4.04 0.02 -1.95 -3.11 113.55 108.75 1b4w h SER 128 Ca -0.45 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 59.81 1b4w h SER 128 Cb 1.38 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.71 1b4w h SER 128 CO 0.43 0.90 -0.48 -0.75 -1.14 0.00 0.00 176.83 175.79 1b4w s LYS 129 N -2.95 3.24 0.20 3.45 2.20 -1.26 -4.76 119.74 119.86 1b4w s LYS 129 Ca 0.00 -0.82 -0.24 0.00 -0.36 0.00 0.00 55.97 54.56 1b4w s LYS 129 Cb 0.11 -3.83 -0.08 0.00 -1.51 0.00 0.00 37.83 32.52 1b4w s LYS 129 CO 0.80 -0.57 0.78 -1.54 -0.36 0.00 0.00 175.35 174.47 1b4w s SER 130 N 1.68 7.29 0.50 1.43 1.04 -1.26 -4.15 113.70 120.22 1b4w s SER 130 Ca 0.05 1.60 -0.22 0.00 0.48 0.00 0.00 55.95 57.87 1b4w s SER 130 Cb -0.18 -2.49 -0.06 0.00 0.10 0.00 0.00 66.02 63.39 1b4w s SER 130 CO 0.09 0.12 1.18 -0.70 0.98 0.00 0.00 173.24 174.92 1b4w s GLU 131 N -1.51 3.54 0.03 4.02 2.12 -0.94 -4.91 118.70 121.06 1b4w s GLU 131 Ca 0.40 1.79 -0.08 0.00 0.36 0.00 0.00 54.97 57.44 1b4w s GLU 131 Cb -0.21 -2.27 -0.05 0.00 0.26 0.00 0.00 34.13 31.86 1b4w s GLU 131 CO 0.24 -0.73 0.32 0.15 -0.54 0.00 0.00 175.26 174.70 1b4w s LYS 132 N -2.89 3.65 0.00 4.30 3.01 -1.26 -5.01 119.74 121.54 1b4w s LYS 132 Ca 0.67 0.02 0.11 0.00 -1.01 0.00 0.00 55.97 55.77 1b4w s LYS 132 Cb -0.29 -3.05 0.63 0.00 -1.01 0.00 0.00 37.83 34.11 1b4w s LYS 132 CO 0.34 0.62 1.07 0.00 0.51 0.00 0.00 175.35 177.90