#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 -0.80 0.27 3.38 -1.64 -1.19 115.31 115.34 1b4w h LEU 2 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1b4w h LEU 2 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1b4w h LEU 2 CO 0.00 0.04 0.00 -0.07 0.09 0.00 0.00 178.44 178.50 1b4w h LEU 3 N 0.00 0.00 0.13 1.67 -0.00 -1.99 0.31 115.31 115.43 1b4w h LEU 3 Ca -0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 57.53 1b4w h LEU 3 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 1b4w h LEU 3 CO 0.01 0.00 -1.87 1.56 -0.00 0.00 0.00 178.44 178.13 1b4w h GLN 4 N 0.00 0.28 -0.54 1.13 4.20 -1.67 -3.19 115.11 115.32 1b4w h GLN 4 Ca 0.00 -0.47 0.01 0.00 0.06 0.00 0.00 58.65 58.25 1b4w h GLN 4 Cb 0.62 0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.55 1b4w h GLN 4 CO 0.00 1.17 0.35 0.35 -0.67 0.00 0.00 178.83 180.03 1b4w h PHE 5 N 0.08 0.65 -0.94 2.96 3.57 -1.11 -1.98 116.94 120.17 1b4w h PHE 5 Ca -0.38 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.21 1b4w h PHE 5 Cb 2.05 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 40.51 1b4w h PHE 5 CO 0.08 0.40 0.61 -0.09 -2.23 0.00 0.00 178.31 177.07 1b4w h ARG 6 N 0.70 1.02 -0.03 1.11 2.43 -1.04 -1.48 114.38 117.09 1b4w h ARG 6 Ca 0.21 -0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 59.20 1b4w h ARG 6 Cb -0.05 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.26 1b4w h ARG 6 CO -0.06 0.68 -0.50 0.87 -1.51 0.00 0.00 179.97 179.45 1b4w h LYS 7 N 1.05 0.07 -0.13 0.20 1.57 -1.36 -2.10 116.57 115.87 1b4w h LYS 7 Ca 0.41 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 59.12 1b4w h LYS 7 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1b4w h LYS 7 CO -0.17 0.55 -0.08 0.52 -0.57 0.00 0.00 179.45 179.71 1b4w h MET 8 N 0.05 0.28 -0.78 3.15 2.86 -0.77 -2.59 114.93 117.14 1b4w h MET 8 Ca -0.00 -0.13 -0.03 0.00 -2.06 0.00 0.00 59.70 57.48 1b4w h MET 8 Cb 0.90 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.52 1b4w h MET 8 CO 0.07 0.63 0.37 0.82 1.06 0.00 0.00 176.91 179.86 1b4w h ILE 9 N -0.07 1.25 0.24 -1.22 2.04 -1.32 -1.68 117.51 116.75 1b4w h ILE 9 Ca 0.03 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1b4w h ILE 9 Cb 0.56 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 1b4w h ILE 9 CO 0.02 0.30 -0.11 0.50 0.00 0.00 0.00 178.15 178.86 1b4w h LYS 10 N 1.10 -0.31 -0.63 2.37 3.64 -1.36 0.13 116.57 121.52 1b4w h LYS 10 Ca 0.27 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.61 1b4w h LYS 10 Cb 0.13 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 1b4w h LYS 10 CO -0.03 -0.17 0.16 -0.22 -2.27 0.00 0.00 179.45 176.91 1b4w h LYS 11 N -0.36 0.99 0.00 1.90 1.63 -1.38 1.16 116.57 120.50 1b4w h LYS 11 Ca -0.03 -0.22 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 1b4w h LYS 11 Cb 0.28 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1b4w h LYS 11 CO 0.05 0.87 -0.31 0.52 -3.45 0.00 0.00 179.45 177.13 1b4w h MET 12 N 0.94 0.00 0.00 1.90 2.86 -1.24 -3.38 114.93 116.01 1b4w h MET 12 Ca 0.20 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.74 1b4w h MET 12 Cb 0.33 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1b4w h MET 12 CO -0.00 0.00 -1.40 2.41 1.06 0.00 0.00 176.91 178.98 1b4w n THR 13 N -2.79 0.40 -0.68 2.22 -1.04 0.44 -4.63 114.28 108.19 1b4w n THR 13 Ca 0.03 -0.19 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 1b4w n THR 13 Cb 0.51 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.23 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 2.92 0.76 3.65 3.41 0.00 0.40 -5.04 105.19 111.29 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 -0.32 2.33 -0.39 1.61 1.02 -1.25 -5.04 119.74 117.70 1b4w s LYS 16 Ca 0.00 -1.18 -0.29 0.00 0.02 0.00 0.00 55.97 54.52 1b4w s LYS 16 Cb 0.00 -2.30 0.01 0.00 -0.52 0.00 0.00 37.83 35.03 1b4w s LYS 16 CO 0.00 0.44 1.33 -2.00 -0.92 0.00 0.00 175.35 174.19 1b4w s GLU 17 N -3.05 3.71 0.24 1.68 2.56 -1.26 -4.22 118.70 118.35 1b4w s GLU 17 Ca 0.28 0.96 -0.05 0.00 0.00 0.00 0.00 54.97 56.16 1b4w s GLU 17 Cb -0.09 -3.96 0.38 0.00 2.00 0.00 0.00 34.13 32.47 1b4w s GLU 17 CO 0.18 -1.40 1.80 -1.35 -0.56 0.00 0.00 175.26 173.94 1b4w h PRO 18 N 9.99 0.71 -0.00 4.30 0.11 -1.93 -0.21 132.00 144.98 1b4w h PRO 18 Ca -0.26 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 1b4w h PRO 18 Cb 1.09 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 1b4w h PRO 18 CO 1.08 0.47 -0.03 0.28 -0.21 0.00 0.00 178.00 179.59 1b4w h VAL 19 N 0.74 1.02 0.02 3.15 2.07 -1.95 0.14 116.25 121.43 1b4w h VAL 19 Ca 0.38 -0.10 -0.28 0.00 0.82 0.00 0.00 66.70 67.52 1b4w h VAL 19 Cb 0.37 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1b4w h VAL 19 CO -0.25 0.03 -1.55 0.52 0.02 0.00 0.00 177.57 176.33 1b4w n VAL 20 N -4.50 1.57 0.30 2.57 0.31 -0.84 -4.12 118.33 113.62 1b4w n VAL 20 Ca -0.03 -0.17 0.12 0.00 -0.01 0.00 0.00 64.34 64.25 1b4w n VAL 20 Cb 0.12 -1.97 0.15 0.00 -0.91 0.00 0.00 33.84 31.23 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 -0.83 0.00 0.00 4.52 0.02 -1.03 -3.42 113.55 112.81 1b4w h SER 21 Ca -0.41 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1b4w h SER 21 Cb 1.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.00 1b4w h SER 21 CO -0.20 0.02 -0.50 -1.22 -1.14 0.00 0.00 176.83 173.80 1b4w n TYR 22 N -2.69 0.00 0.32 3.45 4.01 0.38 -4.64 117.16 118.00 1b4w n TYR 22 Ca 0.03 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.96 1b4w n TYR 22 Cb 0.51 0.00 1.07 0.00 -0.31 0.00 0.00 39.34 40.61 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 1.17 0.00 -0.72 0.00 -1.43 -2.97 119.26 115.31 1b4w h ALA 23 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b4w h ALA 23 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1b4w h ALA 23 CO 0.00 0.01 -0.29 1.19 0.00 0.00 0.00 179.25 180.16 1b4w n PHE 24 N -3.34 0.00 -2.44 0.00 3.01 -1.26 -3.51 117.46 109.93 1b4w n PHE 24 Ca -0.03 -0.40 -0.41 0.00 1.01 0.00 0.00 57.45 57.63 1b4w n PHE 24 Cb 0.10 -0.09 -0.04 0.00 -0.01 0.00 0.00 39.48 39.44 1b4w n PHE 24 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1b4w s TYR 25 N -1.14 3.52 0.00 1.38 6.14 -1.12 -0.93 117.35 125.20 1b4w s TYR 25 Ca 0.13 1.60 0.00 0.00 0.64 0.00 0.00 57.07 59.44 1b4w s TYR 25 Cb 0.11 -3.34 0.00 0.00 0.42 0.00 0.00 41.96 39.15 1b4w s TYR 25 CO 0.01 -0.78 0.00 0.41 0.64 0.00 0.00 175.55 175.83 1b4w n GLY 26 N 1.56 2.55 0.00 8.97 0.00 0.12 -2.65 105.19 115.74 1b4w n GLY 26 Ca 0.01 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.31 0.00 0.20 0.00 4.02 -1.26 -2.26 117.16 116.56 1b4w n TYR 28 Ca 0.01 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.95 1b4w n TYR 28 Cb 0.17 0.00 0.42 0.00 -0.02 0.00 0.00 39.34 39.90 1b4w n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b4w n GLY 30 N -0.52 -2.28 3.79 0.00 0.00 -1.23 -4.61 105.19 100.35 1b4w n GLY 30 Ca -0.02 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 1b4w n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b4w s SER 31 N -1.56 6.15 0.77 1.61 0.01 -1.26 -4.76 113.70 114.65 1b4w s SER 31 Ca 0.00 2.03 0.00 0.00 1.31 0.00 0.00 55.95 59.29 1b4w s SER 31 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1b4w s SER 31 CO 0.00 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.34 1b4w n GLY 32 N -0.07 2.25 0.00 3.44 0.00 -1.26 -4.93 105.19 104.62 1b4w n GLY 32 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 2.73 3.29 -0.02 0.00 -1.26 -4.65 105.19 105.27 1b4w n GLY 33 Ca 0.00 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1b4w n GLY 33 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b4w s ARG 34 N -1.90 0.92 4.38 1.61 3.03 -0.96 -5.00 118.95 121.03 1b4w s ARG 34 Ca 0.00 -0.56 0.00 0.00 2.03 0.00 0.00 55.73 57.20 1b4w s ARG 34 Cb 0.00 0.40 0.00 0.00 -1.03 0.00 0.00 34.95 34.32 1b4w s ARG 34 CO 0.00 -0.32 0.00 0.41 -1.13 0.00 0.00 175.30 174.26 1b4w n GLY 35 N 0.28 1.15 3.62 3.88 0.00 -1.18 -4.64 105.19 108.30 1b4w n GLY 35 Ca -0.18 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1b4w n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b4w s LYS 36 N 0.00 3.03 0.19 1.61 1.02 -1.26 -1.97 119.74 122.36 1b4w s LYS 36 Ca 0.00 -0.47 -0.33 0.00 0.02 0.00 0.00 55.97 55.19 1b4w s LYS 36 Cb 0.00 -2.75 -0.14 0.00 -0.52 0.00 0.00 37.83 34.42 1b4w s LYS 36 CO 0.00 0.61 1.47 -2.30 -0.92 0.00 0.00 175.35 174.21 1b4w n PRO 37 N 2.42 2.01 -0.21 -1.68 -0.02 -1.26 -4.78 135.00 131.48 1b4w n PRO 37 Ca -0.18 0.72 -0.09 0.00 -2.02 0.00 0.00 63.50 61.93 1b4w n PRO 37 Cb 0.53 -2.42 0.03 0.00 -0.02 0.00 0.00 33.50 31.61 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 4.96 1.03 0.00 -0.52 1.79 -1.96 -3.47 116.57 118.39 1b4w h LYS 38 Ca -0.45 -0.30 0.00 0.00 -2.18 0.00 0.00 60.65 57.72 1b4w h LYS 38 Cb 1.27 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 1b4w h LYS 38 CO 0.81 0.98 0.00 -0.40 -1.08 0.00 0.00 179.45 179.77 1b4w n ASP 39 N -4.25 0.00 0.18 0.86 5.75 -1.26 -5.01 116.55 112.81 1b4w n ASP 39 Ca 0.03 -0.40 -0.14 0.00 -0.01 0.00 0.00 54.79 54.27 1b4w n ASP 39 Cb 0.31 0.00 -0.08 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 1.82 -0.39 -0.77 2.12 0.00 -1.93 -0.32 119.26 119.80 1b4w h ALA 40 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1b4w h ALA 40 Cb 0.00 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1b4w h ALA 40 CO 0.00 -0.72 0.46 1.15 0.00 0.00 0.00 179.25 180.14 1b4w h THR 41 N -0.39 1.01 0.00 0.00 2.02 -1.90 -0.27 112.91 113.37 1b4w h THR 41 Ca -0.03 -0.29 -0.05 0.00 0.77 0.00 0.00 66.41 66.81 1b4w h THR 41 Cb 0.31 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 1b4w h THR 41 CO 0.05 0.15 -0.23 -0.78 0.37 0.00 0.00 175.52 175.09 1b4w h ASP 42 N 0.84 0.00 0.54 4.18 3.58 -1.87 -1.47 116.42 122.21 1b4w h ASP 42 Ca 0.34 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.67 1b4w h ASP 42 Cb 0.18 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 1b4w h ASP 42 CO -0.18 0.23 -0.55 0.03 -2.88 0.00 0.00 179.24 175.89 1b4w h ARG 43 N 0.00 0.01 -0.71 0.28 3.08 0.69 -1.47 114.38 116.27 1b4w h ARG 43 Ca -0.00 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.06 1b4w h ARG 43 Cb 0.42 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 1b4w h ARG 43 CO 0.03 0.56 0.45 0.00 -1.07 0.00 0.00 179.97 179.94 1b4w h PHE 46 N 0.27 0.52 -0.41 0.00 3.57 -0.75 -0.11 116.94 120.03 1b4w h PHE 46 Ca -0.01 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.37 1b4w h PHE 46 Cb 1.15 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1b4w h PHE 46 CO 0.03 0.56 0.02 0.28 -2.23 0.00 0.00 178.31 176.97 1b4w h VAL 47 N 0.33 1.26 -0.25 1.41 2.07 -0.98 -1.73 116.25 118.36 1b4w h VAL 47 Ca 0.10 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1b4w h VAL 47 Cb 0.31 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1b4w h VAL 47 CO 0.00 0.33 0.12 -0.74 0.02 0.00 0.00 177.57 177.31 1b4w h HIS 48 N 0.54 0.33 -0.42 1.57 -0.00 -1.05 0.92 115.15 117.05 1b4w h HIS 48 Ca 0.12 -0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.38 1b4w h HIS 48 Cb 0.45 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.74 1b4w h HIS 48 CO 0.03 0.25 -0.16 -0.44 -0.00 0.00 0.00 177.93 177.62 1b4w h ASP 49 N 0.35 0.86 0.35 3.26 5.19 -0.59 -1.62 116.42 124.22 1b4w h ASP 49 Ca 0.09 -0.39 -0.08 0.00 -0.62 0.00 0.00 57.03 56.03 1b4w h ASP 49 Cb 0.04 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.30 1b4w h ASP 49 CO -0.01 1.06 -0.37 0.00 -3.12 0.00 0.00 179.24 176.80 1b4w h TYR 52 N -0.12 0.00 0.00 0.00 -1.99 -1.16 -2.53 116.97 111.17 1b4w h TYR 52 Ca 0.03 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.67 1b4w h TYR 52 Cb 0.50 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.22 1b4w h TYR 52 CO 0.06 0.14 -0.39 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 4.39 -1.40 -3.04 114.58 119.41 1b4w h GLU 53 Ca -0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1b4w h GLU 53 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1b4w h GLU 53 CO 0.02 0.39 -0.17 -0.22 -1.16 0.00 0.00 179.01 177.87 1b4w h LYS 54 N 0.00 0.00 -6.27 2.33 3.64 -1.37 -3.44 116.57 111.46 1b4w h LYS 54 Ca -0.00 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.82 1b4w h LYS 54 Cb 1.04 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1b4w h LYS 54 CO 0.05 0.17 0.91 0.08 -2.27 0.00 0.00 179.45 178.39 1b4w s VAL 55 N -3.16 3.89 -0.09 2.00 1.01 -1.15 -4.91 120.40 117.99 1b4w s VAL 55 Ca 0.06 1.16 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 1b4w s VAL 55 Cb 0.06 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 1b4w s VAL 55 CO 0.69 -0.06 -0.09 0.41 0.00 0.00 0.00 175.10 176.04 1b4w n THR 56 N 5.10 0.51 0.30 3.92 -1.04 -1.26 -4.78 114.28 117.03 1b4w n THR 56 Ca 0.14 -0.17 0.19 0.00 -2.04 0.00 0.00 64.05 62.17 1b4w n THR 56 Cb 0.44 -1.09 0.90 0.00 -1.82 0.00 0.00 70.33 68.75 1b4w n THR 56 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1b4w h GLY 59 N 0.33 0.00 -1.32 3.41 0.00 -1.96 -3.47 103.07 100.07 1b4w h GLY 59 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.83 1b4w h GLY 59 CO -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 176.54 176.24 1b4w s ASP 67 N -2.79 6.18 0.48 0.00 -1.08 -1.26 -4.94 116.67 113.26 1b4w s ASP 67 Ca 0.27 -1.44 0.14 0.00 -0.52 0.00 0.00 52.55 51.01 1b4w s ASP 67 Cb 0.00 -2.23 1.15 0.00 -1.46 0.00 0.00 42.92 40.38 1b4w s ASP 67 CO 0.19 -0.84 2.10 1.55 0.52 0.00 0.00 175.17 178.68 1b4w h PRO 68 N 8.92 0.18 0.01 4.34 0.13 -1.91 0.18 132.00 143.85 1b4w h PRO 68 Ca -0.29 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.77 1b4w h PRO 68 Cb 1.10 -0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.19 1b4w h PRO 68 CO 0.99 0.12 -0.24 0.87 -0.23 0.00 0.00 178.00 179.51 1b4w h LYS 69 N 0.19 0.14 -0.05 0.86 1.57 -1.95 -3.33 116.57 113.99 1b4w h LYS 69 Ca 0.09 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1b4w h LYS 69 Cb 0.13 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1b4w h LYS 69 CO -0.02 0.95 0.00 0.91 -0.57 0.00 0.00 179.45 180.72 1b4w n TRP 70 N -4.51 0.05 -3.28 -1.35 7.02 -1.17 -2.01 117.44 112.19 1b4w n TRP 70 Ca -0.10 -0.05 -0.38 0.00 -1.02 0.00 0.00 57.50 55.94 1b4w n TRP 70 Cb 0.52 -0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.35 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 -1.01 6.82 0.14 -0.99 1.01 0.62 -4.79 116.67 118.47 1b4w s ASP 71 Ca 0.15 0.97 -0.26 0.00 0.71 0.00 0.00 52.55 54.13 1b4w s ASP 71 Cb 0.10 -2.32 -0.07 0.00 1.01 0.00 0.00 42.92 41.65 1b4w s ASP 71 CO 0.15 0.07 0.80 -1.81 0.21 0.00 0.00 175.17 174.59 1b4w s ASP 72 N 0.15 7.38 0.32 0.27 1.01 -1.26 0.52 116.67 125.05 1b4w s ASP 72 Ca 0.28 1.63 0.08 0.00 0.71 0.00 0.00 52.55 55.25 1b4w s ASP 72 Cb -0.17 -2.51 -0.06 0.00 1.01 0.00 0.00 42.92 41.19 1b4w s ASP 72 CO 0.13 0.13 -0.06 -0.72 0.21 0.00 0.00 175.17 174.86 1b4w s TYR 73 N -0.77 2.20 -0.11 4.23 -0.85 -1.26 -4.87 117.35 115.92 1b4w s TYR 73 Ca 0.38 -0.62 -0.04 0.00 -0.52 0.00 0.00 57.07 56.27 1b4w s TYR 73 Cb -0.23 -1.29 -0.03 0.00 0.38 0.00 0.00 41.96 40.79 1b4w s TYR 73 CO 0.26 0.42 0.03 0.95 -1.52 0.00 0.00 175.55 175.69 1b4w s THR 74 N -2.82 4.52 0.23 -3.49 -4.23 -1.26 -4.94 115.64 103.64 1b4w s THR 74 Ca 0.32 -0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.51 1b4w s THR 74 Cb 0.04 -2.95 0.01 0.00 1.34 0.00 0.00 72.50 70.94 1b4w s THR 74 CO 0.15 0.57 0.53 -0.72 -0.54 0.00 0.00 174.62 174.61 1b4w s TYR 75 N -0.56 0.08 0.15 3.99 1.13 -1.26 -1.44 117.35 119.43 1b4w s TYR 75 Ca 0.10 -0.45 -0.07 0.00 -1.41 0.00 0.00 57.07 55.24 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 -1.00 0.22 -1.12 -2.51 0.00 0.00 175.55 171.17 1b4w s SER 76 N -2.94 0.12 -0.54 -0.18 0.01 0.10 -4.94 113.70 105.33 1b4w s SER 76 Ca 0.15 -0.93 0.01 0.00 1.31 0.00 0.00 55.95 56.49 1b4w s SER 76 Cb -0.02 0.39 0.55 0.00 0.21 0.00 0.00 66.02 67.16 1b4w s SER 76 CO 0.04 -0.84 1.93 0.79 0.41 0.00 0.00 173.24 175.56 1b4w n TRP 77 N -0.17 3.04 -1.36 2.43 7.02 -1.26 0.13 117.44 127.27 1b4w n TRP 77 Ca -0.08 -2.42 -0.54 0.00 -1.02 0.00 0.00 57.50 53.44 1b4w n TRP 77 Cb 0.63 -1.15 -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 1.63 -2.02 0.00 0.00 177.69 177.30 1b4w n LYS 78 N -1.02 0.53 -3.17 -0.99 4.76 -1.05 -2.16 118.16 115.05 1b4w n LYS 78 Ca 0.59 0.14 -0.11 0.00 -2.87 0.00 0.00 58.31 56.06 1b4w n LYS 78 Cb 1.13 -1.99 0.05 0.00 -1.84 0.00 0.00 35.03 32.38 1b4w n LYS 78 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1b4w n ASN 79 N 8.96 -6.81 0.00 4.39 5.03 -1.26 -2.95 115.26 122.61 1b4w n ASN 79 Ca 0.49 -0.55 0.00 0.00 0.87 0.00 0.00 54.58 55.38 1b4w n ASN 79 Cb 0.10 -5.14 0.00 0.00 -1.02 0.00 0.00 39.78 33.72 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 -1.35 0.00 3.33 7.41 0.00 -0.92 -4.90 105.19 108.76 1b4w n GLY 80 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 1b4w n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b4w s THR 81 N -0.75 2.11 0.12 2.61 2.01 -1.15 -5.08 115.64 115.50 1b4w s THR 81 Ca 0.00 -1.21 -0.31 0.00 0.31 0.00 0.00 61.69 60.48 1b4w s THR 81 Cb 0.00 -1.76 -0.08 0.00 0.01 0.00 0.00 72.50 70.67 1b4w s THR 81 CO 0.00 0.50 1.33 -0.63 -0.69 0.00 0.00 174.62 175.13 1b4w s ILE 82 N -0.69 3.43 -0.14 1.82 1.01 -1.26 -2.54 121.20 122.84 1b4w s ILE 82 Ca 0.11 1.06 0.01 0.00 0.00 0.00 0.00 60.65 61.83 1b4w s ILE 82 Cb -0.10 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.71 1b4w s ILE 82 CO 0.00 0.10 -0.15 -0.69 0.00 0.00 0.00 174.94 174.20 1b4w s VAL 83 N 0.85 1.60 -0.09 2.92 1.01 0.34 -4.94 120.40 122.09 1b4w s VAL 83 Ca 0.61 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.74 1b4w s VAL 83 Cb -0.35 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1b4w s VAL 83 CO 0.32 0.46 0.51 0.00 0.00 0.00 0.00 175.10 176.39 1b4w n GLY 85 N 3.00 5.77 0.00 0.00 0.00 -0.52 -4.98 105.19 108.46 1b4w n GLY 85 Ca -0.07 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.24 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 3.71 0.59 0.03 -0.02 0.00 -1.26 -4.57 105.19 103.66 1b4w n GLY 86 Ca 0.00 -1.80 0.11 0.00 0.00 0.00 0.00 46.02 44.33 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 -0.67 0.57 -4.59 1.61 8.00 -1.26 -4.84 116.55 115.37 1b4w n ASP 88 Ca 0.00 -0.30 -0.43 0.00 0.71 0.00 0.00 54.79 54.78 1b4w n ASP 88 Cb 0.00 1.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.11 1b4w n ASP 88 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1b4w s ASP 89 N -3.91 6.56 0.49 -2.24 -1.08 -1.26 -4.91 116.67 110.32 1b4w s ASP 89 Ca 0.02 0.29 0.22 0.00 -0.52 0.00 0.00 52.55 52.56 1b4w s ASP 89 Cb 0.14 -2.52 1.27 0.00 -1.46 0.00 0.00 42.92 40.35 1b4w s ASP 89 CO 0.83 -1.24 2.04 -0.65 0.52 0.00 0.00 175.17 176.67 1b4w h PRO 90 N 9.25 0.00 0.17 4.34 0.11 -1.95 -1.93 132.00 141.99 1b4w h PRO 90 Ca -0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.86 1b4w h PRO 90 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1b4w h PRO 90 CO 1.11 0.15 -0.08 0.00 -0.21 0.00 0.00 178.00 178.97 1b4w h LYS 92 N -0.87 0.71 -0.23 0.00 6.56 -1.93 -0.02 116.57 120.80 1b4w h LYS 92 Ca -0.02 -0.09 -0.14 0.00 -1.06 0.00 0.00 60.65 59.34 1b4w h LYS 92 Cb 0.52 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 32.03 1b4w h LYS 92 CO 0.04 0.56 -0.43 -0.22 -2.06 0.00 0.00 179.45 177.34 1b4w h LYS 93 N 0.71 0.55 -0.46 3.15 3.64 -1.42 -1.39 116.57 121.35 1b4w h LYS 93 Ca 0.18 -0.29 0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1b4w h LYS 93 Cb 0.09 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 1b4w h LYS 93 CO -0.02 0.88 0.30 1.49 -2.27 0.00 0.00 179.45 179.82 1b4w h GLU 94 N 0.45 0.58 0.00 1.90 4.81 0.49 -1.36 114.58 121.45 1b4w h GLU 94 Ca 0.03 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1b4w h GLU 94 Cb 0.93 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1b4w h GLU 94 CO 0.08 0.39 -0.30 -0.39 -0.73 0.00 0.00 179.01 178.06 1b4w h VAL 95 N 0.60 0.70 -0.20 0.32 -1.51 -0.97 -2.72 116.25 112.46 1b4w h VAL 95 Ca 0.18 -1.34 -0.11 0.00 -1.23 0.00 0.00 66.70 64.20 1b4w h VAL 95 Cb -0.04 1.87 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 1b4w h VAL 95 CO -0.05 0.29 -0.35 0.00 -1.23 0.00 0.00 177.57 176.23 1b4w h GLU 97 N 0.37 0.33 -0.21 0.00 4.39 -0.99 -0.42 114.58 118.05 1b4w h GLU 97 Ca 0.04 -0.23 0.01 0.00 0.34 0.00 0.00 59.36 59.52 1b4w h GLU 97 Cb 0.79 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 1b4w h GLU 97 CO 0.06 0.85 0.12 0.00 -1.16 0.00 0.00 179.01 178.88 1b4w h ASP 99 N 0.25 -0.06 -0.68 0.00 5.19 -1.32 -2.22 116.42 117.58 1b4w h ASP 99 Ca 0.08 -0.19 0.12 0.00 -0.62 0.00 0.00 57.03 56.42 1b4w h ASP 99 Cb -0.00 0.01 -0.08 0.00 0.18 0.00 0.00 39.33 39.44 1b4w h ASP 99 CO -0.04 0.16 0.25 0.50 -3.12 0.00 0.00 179.24 176.99 1b4w h LYS 100 N -0.27 0.40 -0.61 3.56 3.64 -0.94 -0.49 116.57 121.86 1b4w h LYS 100 Ca -0.01 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1b4w h LYS 100 Cb 0.24 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 1b4w h LYS 100 CO 0.01 0.26 0.09 0.00 -2.27 0.00 0.00 179.45 177.54 1b4w h ALA 101 N 1.49 1.01 -0.18 5.00 0.00 -1.12 -2.44 119.26 123.01 1b4w h ALA 101 Ca 0.36 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1b4w h ALA 101 Cb 0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1b4w h ALA 101 CO -0.36 0.63 -0.02 0.00 0.00 0.00 0.00 179.25 179.49 1b4w h ALA 102 N 1.16 0.24 -0.94 0.00 0.00 -0.58 -0.42 119.26 118.71 1b4w h ALA 102 Ca 0.19 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.92 1b4w h ALA 102 Cb 0.42 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1b4w h ALA 102 CO 0.01 -0.02 0.60 0.00 0.00 0.00 0.00 179.25 179.84 1b4w h ALA 103 N 0.75 1.26 -0.06 0.00 0.00 -1.08 0.06 119.26 120.19 1b4w h ALA 103 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1b4w h ALA 103 Cb 0.43 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1b4w h ALA 103 CO 0.01 0.44 -0.54 0.82 0.00 0.00 0.00 179.25 179.99 1b4w h ILE 104 N 1.15 1.37 -0.54 0.00 2.04 -1.35 -2.11 117.51 118.06 1b4w h ILE 104 Ca 0.38 -1.84 -0.08 0.00 1.00 0.00 0.00 64.86 64.33 1b4w h ILE 104 Cb 0.06 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1b4w h ILE 104 CO -0.14 0.54 0.02 0.00 0.00 0.00 0.00 178.15 178.57 1b4w h PHE 106 N 0.85 0.80 -0.25 0.00 0.04 -0.82 -2.88 116.94 114.67 1b4w h PHE 106 Ca 0.16 -0.19 0.01 0.00 2.80 0.00 0.00 57.97 60.74 1b4w h PHE 106 Cb 0.48 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1b4w h PHE 106 CO 0.03 0.90 0.16 -0.09 -0.60 0.00 0.00 178.31 178.70 1b4w h ARG 107 N 0.48 0.32 0.00 1.51 2.43 -1.12 -1.47 114.38 116.53 1b4w h ARG 107 Ca 0.08 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 1b4w h ARG 107 Cb 0.67 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 1b4w h ARG 107 CO 0.05 0.21 -0.24 -0.44 -1.51 0.00 0.00 179.97 178.04 1b4w h ASP 108 N 0.33 0.00 -0.47 -3.80 3.32 -1.27 -3.01 116.42 111.52 1b4w h ASP 108 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1b4w h ASP 108 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1b4w h ASP 108 CO -0.03 0.24 0.00 0.59 -1.72 0.00 0.00 179.24 178.32 1b4w n ASN 109 N -4.25 3.95 -0.27 6.45 3.02 -1.09 -4.54 115.26 118.53 1b4w n ASN 109 Ca -0.02 -2.40 0.16 0.00 -0.03 0.00 0.00 54.58 52.29 1b4w n ASN 109 Cb 0.29 -0.46 0.44 0.00 -0.61 0.00 0.00 39.78 39.45 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 2.95 0.54 -2.36 3.41 5.85 -1.13 -0.50 115.31 124.07 1b4w h LEU 110 Ca 0.00 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1b4w h LEU 110 Cb 1.19 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1b4w h LEU 110 CO 0.14 0.23 0.04 0.50 -0.34 0.00 0.00 178.44 179.00 1b4w h LYS 111 N 0.55 0.00 -0.48 1.25 3.64 -1.83 -1.80 116.57 117.89 1b4w h LYS 111 Ca 0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1b4w h LYS 111 Cb 1.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1b4w h LYS 111 CO -0.22 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.21 1b4w n THR 112 N -3.95 0.78 -1.87 1.00 -2.24 -0.21 -4.98 114.28 102.80 1b4w n THR 112 Ca -0.02 -0.89 -0.42 0.00 -2.27 0.00 0.00 64.05 60.45 1b4w n THR 112 Cb 0.13 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.03 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 -1.14 2.62 -0.17 4.78 6.14 -0.68 -4.90 117.35 124.00 1b4w s TYR 113 Ca 0.37 0.36 -0.00 0.00 0.64 0.00 0.00 57.07 58.43 1b4w s TYR 113 Cb 0.20 -4.01 0.00 0.00 0.42 0.00 0.00 41.96 38.57 1b4w s TYR 113 CO 0.27 -3.95 -0.15 0.15 0.64 0.00 0.00 175.55 172.52 1b4w s LYS 114 N 2.04 3.19 0.45 4.97 1.02 -1.26 -5.00 119.74 125.14 1b4w s LYS 114 Ca 0.74 -0.75 0.11 0.00 0.02 0.00 0.00 55.97 56.10 1b4w s LYS 114 Cb -0.43 -2.68 1.00 0.00 -0.52 0.00 0.00 37.83 35.20 1b4w s LYS 114 CO 0.33 -0.07 2.05 0.87 -0.92 0.00 0.00 175.35 177.60 1b4w h LYS 115 N 7.58 0.23 0.00 1.68 1.57 -1.96 -1.23 116.57 124.44 1b4w h LYS 115 Ca -0.37 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1b4w h LYS 115 Cb 1.17 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1b4w h LYS 115 CO 0.59 0.22 0.00 2.89 -0.57 0.00 0.00 179.45 182.58 1b4w n ARG 116 N -4.43 0.11 0.00 3.15 1.85 -1.26 -2.03 116.66 114.04 1b4w n ARG 116 Ca -0.01 0.55 0.11 0.00 -1.00 0.00 0.00 57.85 57.50 1b4w n ARG 116 Cb 0.14 -1.81 -0.13 0.00 -1.05 0.00 0.00 32.46 29.61 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 -2.03 0.08 -2.38 2.89 4.01 -0.46 -4.74 117.16 114.53 1b4w n TYR 117 Ca -0.00 0.02 -0.35 0.00 -0.16 0.00 0.00 57.90 57.42 1b4w n TYR 117 Cb 0.06 -0.39 -0.01 0.00 -0.31 0.00 0.00 39.34 38.69 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 -3.34 3.55 -1.77 -0.72 0.23 -0.86 -0.70 119.30 115.69 1b4w s MET 118 Ca -0.02 1.49 0.00 0.00 -1.03 0.00 0.00 55.69 56.13 1b4w s MET 118 Cb 0.14 -2.04 0.00 0.00 -1.53 0.00 0.00 34.83 31.40 1b4w s MET 118 CO 0.88 -0.67 0.00 0.00 -2.03 0.00 0.00 175.02 173.21 1b4w n ALA 119 N -1.17 -0.60 -2.26 3.16 0.00 -0.11 -4.87 120.51 114.66 1b4w n ALA 119 Ca 0.11 0.18 -0.42 0.00 0.00 0.00 0.00 53.44 53.31 1b4w n ALA 119 Cb 0.52 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 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 -2.97 3.32 -0.07 0.00 5.04 -1.08 -4.97 117.35 116.61 1b4w s TYR 120 Ca 0.00 1.08 -0.30 0.00 -2.44 0.00 0.00 57.07 55.42 1b4w s TYR 120 Cb 0.00 -3.59 -0.05 0.00 0.35 0.00 0.00 41.96 38.68 1b4w s TYR 120 CO 0.00 -1.98 1.57 -2.14 -1.34 0.00 0.00 175.55 171.67 1b4w s PRO 121 N 1.07 4.19 0.58 4.97 0.02 -1.26 -4.79 135.00 139.78 1b4w s PRO 121 Ca 0.62 2.09 0.32 0.00 0.02 0.00 0.00 61.00 64.05 1b4w s PRO 121 Cb -0.34 -3.93 1.80 0.00 0.02 0.00 0.00 34.50 32.05 1b4w s PRO 121 CO 0.30 -0.81 2.20 -0.44 -0.33 0.00 0.00 177.00 177.92 1b4w h ASP 122 N 9.24 0.00 0.23 2.53 5.19 -1.93 -1.84 116.42 129.84 1b4w h ASP 122 Ca -0.37 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.03 1b4w h ASP 122 Cb 1.16 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.67 1b4w h ASP 122 CO 0.96 0.04 -0.06 0.40 -3.12 0.00 0.00 179.24 177.46 1b4w h ILE 124 N 0.00 0.45 -0.01 0.35 2.04 -2.00 -1.10 117.51 117.24 1b4w h ILE 124 Ca -0.00 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1b4w h ILE 124 Cb 0.14 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1b4w h ILE 124 CO 0.01 0.06 0.00 0.18 0.00 0.00 0.00 178.15 178.39 1b4w n LEU 125 N -3.61 1.07 -4.77 1.44 4.77 -0.69 -4.89 117.00 110.31 1b4w n LEU 125 Ca -0.02 -0.36 -0.38 0.00 -0.03 0.00 0.00 56.01 55.22 1b4w n LEU 125 Cb 0.17 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1b4w n LEU 125 CO 0.28 0.18 0.66 0.00 -1.33 0.00 0.00 177.39 177.17 1b4w n SER 127 N 0.82 -2.11 0.09 0.00 2.88 -1.26 -4.79 113.62 109.26 1b4w n SER 127 Ca 0.01 0.63 -0.04 0.00 -1.33 0.00 0.00 58.87 58.14 1b4w n SER 127 Cb 0.49 -1.08 -0.02 0.00 -0.75 0.00 0.00 64.21 62.85 1b4w n SER 127 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1b4w h SER 128 N -0.12 0.00 -3.63 -3.46 0.02 -1.95 -3.11 113.55 101.30 1b4w h SER 128 Ca -0.44 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 59.82 1b4w h SER 128 Cb 1.39 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.71 1b4w h SER 128 CO 0.42 0.82 -0.50 -0.75 -1.14 0.00 0.00 176.83 175.69 1b4w s LYS 129 N -2.96 3.22 0.19 3.45 2.20 -1.26 -4.77 119.74 119.81 1b4w s LYS 129 Ca 0.01 -0.82 -0.23 0.00 -0.36 0.00 0.00 55.97 54.56 1b4w s LYS 129 Cb 0.10 -3.77 -0.08 0.00 -1.51 0.00 0.00 37.83 32.57 1b4w s LYS 129 CO 0.79 -0.55 0.76 -1.12 -0.36 0.00 0.00 175.35 174.87 1b4w s SER 130 N 1.65 7.27 0.51 1.43 0.01 -1.26 -4.13 113.70 119.19 1b4w s SER 130 Ca 0.05 1.57 -0.21 0.00 1.31 0.00 0.00 55.95 58.67 1b4w s SER 130 Cb -0.18 -2.47 -0.06 0.00 0.21 0.00 0.00 66.02 63.52 1b4w s SER 130 CO 0.09 0.14 1.17 -0.70 0.41 0.00 0.00 173.24 174.35 1b4w s GLU 131 N -1.45 3.48 0.04 12.44 2.12 -0.83 -4.91 118.70 129.58 1b4w s GLU 131 Ca 0.38 1.75 -0.07 0.00 0.36 0.00 0.00 54.97 57.39 1b4w s GLU 131 Cb -0.21 -2.19 -0.05 0.00 0.26 0.00 0.00 34.13 31.94 1b4w s GLU 131 CO 0.24 -0.78 0.31 0.15 -0.54 0.00 0.00 175.26 174.64 1b4w s LYS 132 N -3.00 3.63 0.00 4.30 3.01 -1.26 -5.01 119.74 121.41 1b4w s LYS 132 Ca 0.69 -0.01 0.10 0.00 -1.01 0.00 0.00 55.97 55.74 1b4w s LYS 132 Cb -0.28 -3.04 0.60 0.00 -1.01 0.00 0.00 37.83 34.10 1b4w s LYS 132 CO 0.32 0.61 1.04 0.00 0.51 0.00 0.00 175.35 177.83