#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 -0.51 0.27 3.38 -1.67 -0.88 115.31 115.90 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 0.01 0.00 -0.07 0.09 0.00 0.00 178.44 178.47 1b4w h LEU 3 N 0.00 0.00 0.17 1.67 3.38 -1.98 -0.33 115.31 118.21 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 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1b4w h LEU 3 CO 0.00 0.00 -1.82 1.56 0.09 0.00 0.00 178.44 178.27 1b4w h GLN 4 N 0.00 0.35 -0.56 1.13 4.20 -1.61 -3.19 115.11 115.43 1b4w h GLN 4 Ca 0.00 -0.60 0.04 0.00 0.06 0.00 0.00 58.65 58.15 1b4w h GLN 4 Cb 0.76 0.22 -0.04 0.00 0.30 0.00 0.00 27.48 28.72 1b4w h GLN 4 CO 0.00 1.29 0.31 0.35 -0.67 0.00 0.00 178.83 180.10 1b4w h PHE 5 N 0.08 0.57 -0.90 2.96 3.57 -1.20 -1.76 116.94 120.26 1b4w h PHE 5 Ca -0.37 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.20 1b4w h PHE 5 Cb 2.07 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 40.58 1b4w h PHE 5 CO 0.10 0.29 0.59 -0.09 -2.23 0.00 0.00 178.31 176.96 1b4w h ARG 6 N 0.59 1.05 -0.00 1.11 2.43 -1.15 -1.15 114.38 117.25 1b4w h ARG 6 Ca 0.24 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.24 1b4w h ARG 6 Cb 0.11 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 1b4w h ARG 6 CO -0.15 0.70 -0.48 0.87 -1.51 0.00 0.00 179.97 179.40 1b4w h LYS 7 N 1.09 0.01 -0.14 0.20 1.57 -1.32 -2.01 116.57 115.96 1b4w h LYS 7 Ca 0.37 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.09 1b4w h LYS 7 Cb 0.09 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1b4w h LYS 7 CO -0.12 0.49 -0.13 0.52 -0.57 0.00 0.00 179.45 179.64 1b4w h MET 8 N 0.01 0.34 -0.79 3.15 2.86 -0.66 -2.66 114.93 117.18 1b4w h MET 8 Ca -0.00 -0.18 -0.05 0.00 -2.06 0.00 0.00 59.70 57.41 1b4w h MET 8 Cb 0.86 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.49 1b4w h MET 8 CO 0.06 0.72 0.31 0.82 1.06 0.00 0.00 176.91 179.89 1b4w h ILE 9 N -0.03 1.26 0.15 -1.22 2.04 -1.28 -1.77 117.51 116.65 1b4w h ILE 9 Ca 0.02 -0.82 -0.01 0.00 1.00 0.00 0.00 64.86 65.06 1b4w h ILE 9 Cb 0.66 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1b4w h ILE 9 CO 0.03 0.34 -0.07 0.50 0.00 0.00 0.00 178.15 178.95 1b4w h LYS 10 N 1.15 -0.19 -0.70 2.37 1.63 -1.36 1.00 116.57 120.47 1b4w h LYS 10 Ca 0.26 0.01 -0.07 0.00 -0.85 0.00 0.00 60.65 60.01 1b4w h LYS 10 Cb 0.22 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 1b4w h LYS 10 CO -0.02 -0.06 0.18 -0.22 -3.45 0.00 0.00 179.45 175.87 1b4w h LYS 11 N -0.27 1.11 0.00 1.90 3.11 -1.40 1.20 116.57 122.21 1b4w h LYS 11 Ca -0.02 -0.26 0.00 0.00 -2.81 0.00 0.00 60.65 57.56 1b4w h LYS 11 Cb 0.21 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.29 1b4w h LYS 11 CO 0.03 0.97 -0.25 0.52 -2.81 0.00 0.00 179.45 177.92 1b4w h MET 12 N 1.06 0.00 0.00 1.90 2.86 -1.27 -3.38 114.93 116.10 1b4w h MET 12 Ca 0.22 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.78 1b4w h MET 12 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1b4w h MET 12 CO 0.00 0.00 -1.33 -2.37 1.06 0.00 0.00 176.91 174.27 1b4w n THR 13 N -2.77 0.33 -0.82 2.22 5.66 0.34 -4.66 114.28 114.58 1b4w n THR 13 Ca 0.03 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 1b4w n THR 13 Cb 0.51 -0.84 0.00 0.00 -1.55 0.00 0.00 70.33 68.45 1b4w n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1b4w n GLY 14 N 2.83 0.76 3.66 1.09 0.00 0.41 -5.03 105.19 108.90 1b4w n GLY 14 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.18 2.38 -0.44 1.61 1.02 -1.25 -5.04 119.74 117.84 1b4w s LYS 16 Ca 0.00 -1.24 -0.29 0.00 0.02 0.00 0.00 55.97 54.46 1b4w s LYS 16 Cb 0.00 -2.28 0.02 0.00 -0.52 0.00 0.00 37.83 35.05 1b4w s LYS 16 CO 0.00 0.41 1.34 -2.00 -0.92 0.00 0.00 175.35 174.19 1b4w s GLU 17 N -3.32 3.58 0.25 1.68 2.56 -1.26 -4.23 118.70 117.97 1b4w s GLU 17 Ca 0.29 0.80 -0.02 0.00 0.00 0.00 0.00 54.97 56.04 1b4w s GLU 17 Cb -0.08 -4.01 0.47 0.00 2.00 0.00 0.00 34.13 32.52 1b4w s GLU 17 CO 0.19 -1.56 1.78 -1.35 -0.56 0.00 0.00 175.26 173.77 1b4w h PRO 18 N 10.38 0.67 -0.02 4.30 0.11 -1.92 -0.21 132.00 145.30 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 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 1b4w h PRO 18 CO 1.11 0.44 -0.03 0.28 -0.21 0.00 0.00 178.00 179.59 1b4w h VAL 19 N 0.69 1.04 0.03 3.15 2.07 -1.95 0.80 116.25 122.07 1b4w h VAL 19 Ca 0.43 -0.16 -0.30 0.00 0.82 0.00 0.00 66.70 67.50 1b4w h VAL 19 Cb 0.53 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 1b4w h VAL 19 CO -0.32 0.05 -1.63 0.52 0.02 0.00 0.00 177.57 176.21 1b4w n VAL 20 N -4.49 1.60 0.15 2.57 0.31 -0.83 -4.08 118.33 113.56 1b4w n VAL 20 Ca -0.03 -0.25 0.11 0.00 -0.01 0.00 0.00 64.34 64.16 1b4w n VAL 20 Cb 0.12 -1.92 0.07 0.00 -0.91 0.00 0.00 33.84 31.20 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 -0.68 0.00 0.00 4.52 0.02 -1.02 -3.42 113.55 112.96 1b4w h SER 21 Ca -0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1b4w h SER 21 Cb 1.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.09 1b4w h SER 21 CO -0.15 0.06 -0.55 -1.22 -1.14 0.00 0.00 176.83 173.83 1b4w n TYR 22 N -2.90 0.00 0.32 3.45 4.01 0.19 -4.61 117.16 117.61 1b4w n TYR 22 Ca 0.01 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.95 1b4w n TYR 22 Cb 0.57 0.00 1.04 0.00 -0.31 0.00 0.00 39.34 40.64 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 1.08 0.00 -0.72 0.00 -1.47 -3.00 119.26 115.15 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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1b4w h ALA 23 CO 0.00 0.01 -0.30 1.19 0.00 0.00 0.00 179.25 180.16 1b4w n PHE 24 N -3.21 0.00 -2.38 0.00 3.72 -1.26 -3.59 117.46 110.74 1b4w n PHE 24 Ca -0.02 -0.34 -0.41 0.00 -0.05 0.00 0.00 57.45 56.63 1b4w n PHE 24 Cb 0.13 -0.08 -0.04 0.00 -0.94 0.00 0.00 39.48 38.56 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 -0.96 3.44 0.00 1.38 6.14 -1.13 -1.03 117.35 125.19 1b4w s TYR 25 Ca 0.10 1.55 0.00 0.00 0.64 0.00 0.00 57.07 59.36 1b4w s TYR 25 Cb 0.09 -3.40 0.00 0.00 0.42 0.00 0.00 41.96 39.07 1b4w s TYR 25 CO 0.01 -1.00 0.00 0.41 0.64 0.00 0.00 175.55 175.61 1b4w n GLY 26 N 1.54 2.55 0.00 8.97 0.00 0.00 -2.60 105.19 115.65 1b4w n GLY 26 Ca 0.01 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.48 0.00 0.14 0.00 4.01 -1.26 -2.29 117.16 116.28 1b4w n TYR 28 Ca 0.01 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 1b4w n TYR 28 Cb 0.21 -0.04 0.31 0.00 -0.31 0.00 0.00 39.34 39.51 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 -0.41 -2.52 3.79 0.00 0.00 -1.24 -4.62 105.19 100.19 1b4w n GLY 30 Ca -0.02 -1.32 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 1b4w n GLY 30 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1b4w s SER 31 N -1.67 6.16 0.71 1.61 0.15 -1.26 -4.77 113.70 114.63 1b4w s SER 31 Ca 0.00 1.97 0.00 0.00 0.70 0.00 0.00 55.95 58.62 1b4w s SER 31 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1b4w s SER 31 CO 0.00 -0.91 0.00 0.61 1.20 0.00 0.00 173.24 174.14 1b4w n GLY 32 N -0.22 2.16 0.00 9.45 0.00 -1.26 -4.93 105.19 110.38 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 3.28 -0.02 0.00 -1.26 -4.64 105.19 105.27 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 -1.91 0.90 4.39 1.61 3.03 -0.97 -5.00 118.95 121.00 1b4w s ARG 34 Ca 0.00 -0.55 0.00 0.00 2.03 0.00 0.00 55.73 57.21 1b4w s ARG 34 Cb 0.00 0.39 0.00 0.00 -1.03 0.00 0.00 34.95 34.31 1b4w s ARG 34 CO 0.00 -0.31 0.00 0.41 -1.13 0.00 0.00 175.30 174.27 1b4w n GLY 35 N 0.33 1.13 3.58 3.88 0.00 -1.18 -4.65 105.19 108.28 1b4w n GLY 35 Ca -0.18 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 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 3.08 0.20 1.61 2.20 -1.26 -2.00 119.74 123.57 1b4w s LYS 36 Ca 0.00 -0.51 -0.33 0.00 -0.36 0.00 0.00 55.97 54.78 1b4w s LYS 36 Cb 0.00 -2.73 -0.14 0.00 -1.51 0.00 0.00 37.83 33.45 1b4w s LYS 36 CO 0.00 0.55 1.41 -2.30 -0.36 0.00 0.00 175.35 174.65 1b4w n PRO 37 N 2.59 1.87 -0.21 4.03 -0.02 -1.26 -4.78 135.00 137.22 1b4w n PRO 37 Ca -0.18 0.67 -0.09 0.00 -2.02 0.00 0.00 63.50 61.88 1b4w n PRO 37 Cb 0.53 -2.33 0.02 0.00 -0.02 0.00 0.00 33.50 31.70 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 4.55 1.07 0.00 -0.52 1.79 -1.96 -3.48 116.57 118.03 1b4w h LYS 38 Ca -0.45 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 57.66 1b4w h LYS 38 Cb 1.28 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1b4w h LYS 38 CO 0.78 1.06 0.00 -0.40 -1.08 0.00 0.00 179.45 179.81 1b4w n ASP 39 N -4.17 0.00 0.07 0.86 5.68 -1.26 -5.01 116.55 112.72 1b4w n ASP 39 Ca 0.03 -0.54 -0.12 0.00 -0.50 0.00 0.00 54.79 53.65 1b4w n ASP 39 Cb 0.36 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.28 1b4w n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1b4w h ALA 40 N 1.86 -0.14 -0.74 2.12 0.00 -1.93 0.15 119.26 120.59 1b4w h ALA 40 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1b4w h ALA 40 Cb 0.00 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1b4w h ALA 40 CO 0.00 -0.59 0.46 1.15 0.00 0.00 0.00 179.25 180.27 1b4w h THR 41 N -0.17 1.09 -0.00 0.00 2.02 -1.90 -0.86 112.91 113.09 1b4w h THR 41 Ca 0.01 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.83 1b4w h THR 41 Cb 0.18 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1b4w h THR 41 CO -0.04 0.16 -0.25 -0.78 0.37 0.00 0.00 175.52 174.99 1b4w h ASP 42 N 0.90 0.00 0.42 4.18 3.58 -1.85 -1.39 116.42 122.27 1b4w h ASP 42 Ca 0.30 -0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.64 1b4w h ASP 42 Cb 0.04 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1b4w h ASP 42 CO -0.12 0.25 -0.50 -0.09 -2.88 0.00 0.00 179.24 175.90 1b4w h ARG 43 N 0.00 0.09 -0.71 0.28 2.43 0.42 -1.35 114.38 115.55 1b4w h ARG 43 Ca -0.00 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1b4w h ARG 43 Cb 0.44 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 1b4w h ARG 43 CO 0.03 0.58 0.46 0.00 -1.51 0.00 0.00 179.97 179.52 1b4w h PHE 46 N 0.31 0.55 -0.40 0.00 3.57 -0.72 -0.14 116.94 120.12 1b4w h PHE 46 Ca -0.01 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.37 1b4w h PHE 46 Cb 1.16 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 1b4w h PHE 46 CO 0.04 0.53 -0.01 0.28 -2.23 0.00 0.00 178.31 176.92 1b4w h VAL 47 N 0.41 1.26 -0.26 1.41 2.07 -1.00 -1.69 116.25 118.46 1b4w h VAL 47 Ca 0.11 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 1b4w h VAL 47 Cb 0.23 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1b4w h VAL 47 CO -0.01 0.35 0.12 -0.74 0.02 0.00 0.00 177.57 177.32 1b4w h HIS 48 N 0.53 0.34 -0.37 1.57 -0.00 -1.07 0.11 115.15 116.27 1b4w h HIS 48 Ca 0.11 -0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.37 1b4w h HIS 48 Cb 0.49 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.78 1b4w h HIS 48 CO 0.04 0.26 -0.18 0.22 -0.00 0.00 0.00 177.93 178.27 1b4w h ASP 49 N 0.36 0.80 0.28 3.26 3.58 -0.62 -1.77 116.42 122.30 1b4w h ASP 49 Ca 0.09 -0.40 -0.07 0.00 0.42 0.00 0.00 57.03 57.07 1b4w h ASP 49 Cb 0.04 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 1b4w h ASP 49 CO -0.01 1.03 -0.31 0.00 -2.88 0.00 0.00 179.24 177.06 1b4w h TYR 52 N -0.04 0.00 0.00 0.00 -1.99 -1.20 -2.63 116.97 111.11 1b4w h TYR 52 Ca 0.03 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.67 1b4w h TYR 52 Cb 0.57 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.29 1b4w h TYR 52 CO 0.07 0.19 -0.42 0.93 -0.00 0.00 0.00 178.16 178.94 1b4w h GLU 53 N 0.00 0.00 0.00 4.88 4.39 -1.44 -3.06 114.58 119.35 1b4w h GLU 53 Ca -0.00 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 1b4w h GLU 53 Cb 0.44 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1b4w h GLU 53 CO 0.02 0.42 -0.29 0.87 -1.16 0.00 0.00 179.01 178.87 1b4w h LYS 54 N 0.00 0.00 -6.30 2.33 1.57 -1.39 -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 1.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1b4w h LYS 54 CO 0.05 0.29 0.92 0.08 -0.57 0.00 0.00 179.45 180.22 1b4w s VAL 55 N -3.20 3.79 -0.08 0.50 1.01 -1.16 -4.91 120.40 116.36 1b4w s VAL 55 Ca 0.04 1.08 -0.01 0.00 0.00 0.00 0.00 61.98 63.09 1b4w s VAL 55 Cb 0.07 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 1b4w s VAL 55 CO 0.70 -0.05 -0.08 1.07 0.00 0.00 0.00 175.10 176.74 1b4w n THR 56 N 5.02 0.45 0.30 3.92 5.66 -1.26 -4.78 114.28 123.59 1b4w n THR 56 Ca 0.14 -0.15 0.18 0.00 -3.05 0.00 0.00 64.05 61.17 1b4w n THR 56 Cb 0.44 -1.07 0.81 0.00 -1.55 0.00 0.00 70.33 68.95 1b4w n THR 56 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1b4w h GLY 59 N 0.28 0.00 -1.17 1.09 0.00 -1.96 -3.46 103.07 97.85 1b4w h GLY 59 Ca -0.19 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 46.89 1b4w h GLY 59 CO -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 176.54 176.28 1b4w s ASP 67 N -2.60 6.18 0.47 0.00 -1.08 -1.26 -4.94 116.67 113.43 1b4w s ASP 67 Ca 0.24 -1.71 0.16 0.00 -0.52 0.00 0.00 52.55 50.72 1b4w s ASP 67 Cb 0.00 -2.20 1.14 0.00 -1.46 0.00 0.00 42.92 40.39 1b4w s ASP 67 CO 0.17 -0.82 2.01 1.55 0.52 0.00 0.00 175.17 178.60 1b4w h PRO 68 N 8.86 0.26 0.01 4.34 0.13 -1.91 0.25 132.00 143.95 1b4w h PRO 68 Ca -0.30 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.77 1b4w h PRO 68 Cb 1.10 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1b4w h PRO 68 CO 1.01 0.17 -0.19 -0.22 -0.23 0.00 0.00 178.00 178.54 1b4w h LYS 69 N 0.27 0.11 -0.01 0.86 3.64 -1.96 -3.32 116.57 116.16 1b4w h LYS 69 Ca 0.23 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1b4w h LYS 69 Cb 0.56 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1b4w h LYS 69 CO -0.05 0.92 -0.02 0.91 -2.27 0.00 0.00 179.45 178.95 1b4w n TRP 70 N -4.54 0.00 -3.20 1.91 5.03 -1.15 -2.20 117.44 113.28 1b4w n TRP 70 Ca -0.10 0.00 -0.39 0.00 3.03 0.00 0.00 57.50 60.04 1b4w n TRP 70 Cb 0.49 0.00 -0.05 0.00 -1.03 0.00 0.00 31.31 30.72 1b4w n TRP 70 CO 0.00 0.00 0.00 -0.51 -0.03 0.00 0.00 177.69 177.15 1b4w s ASP 71 N -1.05 6.91 0.15 -0.99 1.01 0.87 -4.78 116.67 118.80 1b4w s ASP 71 Ca 0.14 1.09 -0.26 0.00 0.71 0.00 0.00 52.55 54.23 1b4w s ASP 71 Cb 0.10 -2.36 -0.07 0.00 1.01 0.00 0.00 42.92 41.60 1b4w s ASP 71 CO 0.16 0.04 0.81 -1.81 0.21 0.00 0.00 175.17 174.58 1b4w s ASP 72 N 0.18 7.40 0.33 0.27 1.01 -1.26 0.71 116.67 125.30 1b4w s ASP 72 Ca 0.31 1.66 0.07 0.00 0.71 0.00 0.00 52.55 55.30 1b4w s ASP 72 Cb -0.17 -2.51 -0.06 0.00 1.01 0.00 0.00 42.92 41.18 1b4w s ASP 72 CO 0.16 0.15 -0.04 -0.72 0.21 0.00 0.00 175.17 174.93 1b4w s TYR 73 N -0.86 2.18 -0.11 4.23 -0.85 -1.26 -4.87 117.35 115.82 1b4w s TYR 73 Ca 0.38 -0.68 -0.03 0.00 -0.52 0.00 0.00 57.07 56.23 1b4w s TYR 73 Cb -0.23 -1.33 -0.03 0.00 0.38 0.00 0.00 41.96 40.75 1b4w s TYR 73 CO 0.27 0.36 0.00 -0.08 -1.52 0.00 0.00 175.55 174.57 1b4w s THR 74 N -2.89 4.29 0.22 -3.49 -1.32 -1.26 -4.95 115.64 106.25 1b4w s THR 74 Ca 0.32 -0.24 -0.16 0.00 -1.21 0.00 0.00 61.69 60.40 1b4w s THR 74 Cb 0.05 -2.83 0.01 0.00 -1.51 0.00 0.00 72.50 68.23 1b4w s THR 74 CO 0.15 0.58 0.52 -0.72 -2.21 0.00 0.00 174.62 172.93 1b4w s TYR 75 N -0.57 0.07 0.15 9.09 1.13 -1.26 -1.46 117.35 124.49 1b4w s TYR 75 Ca 0.10 -0.44 -0.06 0.00 -1.41 0.00 0.00 57.07 55.26 1b4w s TYR 75 Cb -0.12 0.33 -0.02 0.00 -1.10 0.00 0.00 41.96 41.06 1b4w s TYR 75 CO 0.02 -0.97 0.19 -1.54 -2.51 0.00 0.00 175.55 170.74 1b4w s SER 76 N -2.93 0.15 -0.55 -0.18 1.04 0.13 -4.94 113.70 106.42 1b4w s SER 76 Ca 0.14 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 55.60 1b4w s SER 76 Cb -0.01 0.37 0.52 0.00 0.10 0.00 0.00 66.02 67.00 1b4w s SER 76 CO 0.03 -0.82 1.89 0.79 0.98 0.00 0.00 173.24 176.11 1b4w n TRP 77 N -0.15 3.00 -1.36 5.02 7.02 -1.26 0.13 117.44 129.84 1b4w n TRP 77 Ca -0.07 -2.53 -0.55 0.00 -1.02 0.00 0.00 57.50 53.33 1b4w n TRP 77 Cb 0.63 -1.15 -0.10 0.00 -2.42 0.00 0.00 31.31 28.27 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 -0.98 0.55 -3.20 -0.99 4.81 -1.03 -2.16 118.16 115.16 1b4w n LYS 78 Ca 0.58 0.15 -0.11 0.00 -0.87 0.00 0.00 58.31 58.06 1b4w n LYS 78 Cb 1.01 -2.00 0.05 0.00 0.02 0.00 0.00 35.03 34.11 1b4w n LYS 78 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1b4w n ASN 79 N 8.83 -6.97 0.00 3.14 4.05 -1.26 -2.89 115.26 120.16 1b4w n ASN 79 Ca 0.48 -0.54 0.00 0.00 0.45 0.00 0.00 54.58 54.97 1b4w n ASN 79 Cb 0.10 -5.24 0.00 0.00 1.23 0.00 0.00 39.78 35.87 1b4w n ASN 79 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1b4w n GLY 80 N -1.38 0.00 3.35 8.20 0.00 -0.92 -4.89 105.19 109.55 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 -0.74 2.22 0.12 2.61 2.01 -1.14 -5.08 115.64 115.64 1b4w s THR 81 Ca 0.00 -1.17 -0.31 0.00 0.31 0.00 0.00 61.69 60.53 1b4w s THR 81 Cb 0.00 -1.82 -0.07 0.00 0.01 0.00 0.00 72.50 70.62 1b4w s THR 81 CO 0.00 0.50 1.30 -0.63 -0.69 0.00 0.00 174.62 175.10 1b4w s ILE 82 N -0.70 3.53 -0.13 1.82 1.09 -1.26 -2.47 121.20 123.08 1b4w s ILE 82 Ca 0.11 1.15 0.01 0.00 -1.10 0.00 0.00 60.65 60.82 1b4w s ILE 82 Cb -0.10 -3.73 0.02 0.00 -1.06 0.00 0.00 42.46 37.58 1b4w s ILE 82 CO 0.00 0.11 -0.15 0.54 -0.10 0.00 0.00 174.94 175.35 1b4w s VAL 83 N 0.78 1.55 -0.09 2.92 0.11 0.36 -4.94 120.40 121.09 1b4w s VAL 83 Ca 0.60 -0.65 -0.18 0.00 -2.93 0.00 0.00 61.98 58.82 1b4w s VAL 83 Cb -0.34 -1.43 -0.05 0.00 -1.53 0.00 0.00 36.38 33.03 1b4w s VAL 83 CO 0.32 0.45 0.48 0.00 -3.33 0.00 0.00 175.10 173.02 1b4w n GLY 85 N 3.00 5.76 0.00 0.00 0.00 -0.54 -4.98 105.19 108.44 1b4w n GLY 85 Ca -0.08 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 3.74 0.62 0.02 -0.02 0.00 -1.26 -4.57 105.19 103.72 1b4w n GLY 86 Ca 0.00 -1.81 0.11 0.00 0.00 0.00 0.00 46.02 44.32 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 -0.64 0.60 -4.58 1.61 9.92 -1.26 -4.85 116.55 117.35 1b4w n ASP 88 Ca 0.00 -0.42 -0.43 0.00 -0.53 0.00 0.00 54.79 53.41 1b4w n ASP 88 Cb 0.00 1.10 -0.03 0.00 -0.64 0.00 0.00 41.12 41.55 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 -3.73 6.56 0.50 -2.24 -1.08 -1.26 -4.91 116.67 110.51 1b4w s ASP 89 Ca 0.03 0.29 0.24 0.00 -0.52 0.00 0.00 52.55 52.59 1b4w s ASP 89 Cb 0.15 -2.52 1.33 0.00 -1.46 0.00 0.00 42.92 40.42 1b4w s ASP 89 CO 0.84 -1.23 2.04 -0.65 0.52 0.00 0.00 175.17 176.69 1b4w h PRO 90 N 9.24 0.00 0.15 4.34 0.11 -1.95 -1.84 132.00 142.05 1b4w h PRO 90 Ca -0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.87 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 -0.07 0.00 -0.21 0.00 0.00 178.00 178.97 1b4w h LYS 92 N -0.88 0.47 -0.26 0.00 1.79 -1.93 -0.22 116.57 115.54 1b4w h LYS 92 Ca -0.02 -0.07 -0.15 0.00 -2.18 0.00 0.00 60.65 58.23 1b4w h LYS 92 Cb 0.53 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.08 1b4w h LYS 92 CO 0.03 0.44 -0.44 -0.22 -1.08 0.00 0.00 179.45 178.18 1b4w h LYS 93 N 0.47 0.65 -0.55 3.15 3.64 -1.39 -1.52 116.57 121.02 1b4w h LYS 93 Ca 0.11 -0.36 0.04 0.00 -1.27 0.00 0.00 60.65 59.17 1b4w h LYS 93 Cb 0.18 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.98 1b4w h LYS 93 CO -0.00 0.97 0.31 1.49 -2.27 0.00 0.00 179.45 179.94 1b4w h GLU 94 N 0.53 0.58 0.00 1.90 4.81 0.43 -1.01 114.58 121.82 1b4w h GLU 94 Ca 0.04 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1b4w h GLU 94 Cb 0.98 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 1b4w h GLU 94 CO 0.09 0.39 -0.27 -0.39 -0.73 0.00 0.00 179.01 178.10 1b4w h VAL 95 N 0.60 0.59 -0.23 0.32 -1.51 -1.05 -2.84 116.25 112.13 1b4w h VAL 95 Ca 0.23 -1.35 -0.12 0.00 -1.23 0.00 0.00 66.70 64.24 1b4w h VAL 95 Cb 0.08 1.92 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 1b4w h VAL 95 CO -0.13 0.27 -0.35 0.00 -1.23 0.00 0.00 177.57 176.13 1b4w h GLU 97 N 0.42 0.22 -0.16 0.00 4.39 -1.04 -0.01 114.58 118.40 1b4w h GLU 97 Ca 0.05 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1b4w h GLU 97 Cb 0.81 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 1b4w h GLU 97 CO 0.07 0.75 0.10 0.00 -1.16 0.00 0.00 179.01 178.77 1b4w h ASP 99 N 0.19 0.00 -0.77 0.00 3.32 -1.30 -2.20 116.42 115.66 1b4w h ASP 99 Ca 0.06 -0.19 0.11 0.00 0.02 0.00 0.00 57.03 57.03 1b4w h ASP 99 Cb 0.02 -0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.49 1b4w h ASP 99 CO -0.01 0.20 0.40 0.50 -1.72 0.00 0.00 179.24 178.60 1b4w h LYS 100 N -0.19 0.62 -0.61 3.56 3.64 -0.87 -0.58 116.57 122.13 1b4w h LYS 100 Ca 0.00 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 1b4w h LYS 100 Cb 0.19 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1b4w h LYS 100 CO -0.00 0.41 0.01 0.00 -2.27 0.00 0.00 179.45 177.60 1b4w h ALA 101 N 1.48 0.82 -0.25 5.00 0.00 -1.13 -2.45 119.26 122.73 1b4w h ALA 101 Ca 0.39 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1b4w h ALA 101 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1b4w h ALA 101 CO -0.30 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.64 1b4w h ALA 102 N 0.99 0.33 -0.90 0.00 0.00 -0.65 0.08 119.26 119.11 1b4w h ALA 102 Ca 0.17 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1b4w h ALA 102 Cb 0.55 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1b4w h ALA 102 CO 0.03 0.02 0.58 0.00 0.00 0.00 0.00 179.25 179.89 1b4w h ALA 103 N 0.84 1.20 -0.17 0.00 0.00 -1.11 0.13 119.26 120.14 1b4w h ALA 103 Ca 0.07 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1b4w h ALA 103 Cb 0.35 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1b4w h ALA 103 CO 0.01 0.42 -0.42 0.82 0.00 0.00 0.00 179.25 180.08 1b4w h ILE 104 N 1.12 1.31 -0.62 0.00 2.04 -1.28 -2.09 117.51 117.99 1b4w h ILE 104 Ca 0.37 -1.58 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 1b4w h ILE 104 Cb 0.03 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1b4w h ILE 104 CO -0.13 0.48 0.15 0.00 0.00 0.00 0.00 178.15 178.66 1b4w h PHE 106 N 0.92 0.92 -0.32 0.00 0.04 -0.75 -2.82 116.94 114.93 1b4w h PHE 106 Ca 0.20 -0.22 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1b4w h PHE 106 Cb 0.33 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 1b4w h PHE 106 CO 0.02 0.96 0.21 -0.09 -0.60 0.00 0.00 178.31 178.82 1b4w h ARG 107 N 0.61 0.42 -0.07 1.51 2.43 -1.02 -1.35 114.38 116.91 1b4w h ARG 107 Ca 0.09 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 1b4w h ARG 107 Cb 0.70 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 1b4w h ARG 107 CO 0.05 0.28 -0.24 -0.44 -1.51 0.00 0.00 179.97 178.11 1b4w h ASP 108 N 0.44 0.12 -0.49 -3.80 3.32 -1.26 -3.01 116.42 111.73 1b4w h ASP 108 Ca 0.12 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1b4w h ASP 108 Cb -0.05 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1b4w h ASP 108 CO -0.03 0.36 0.00 0.59 -1.72 0.00 0.00 179.24 178.45 1b4w n ASN 109 N -4.21 4.14 -0.23 6.45 3.02 -1.07 -4.52 115.26 118.84 1b4w n ASN 109 Ca -0.02 -2.46 0.15 0.00 -0.03 0.00 0.00 54.58 52.22 1b4w n ASN 109 Cb 0.32 -0.49 0.45 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 3.09 0.52 -2.38 3.41 5.85 -1.11 -0.62 115.31 124.06 1b4w h LEU 110 Ca 0.00 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1b4w h LEU 110 Cb 1.28 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 1b4w h LEU 110 CO 0.17 0.25 0.06 0.07 -0.34 0.00 0.00 178.44 178.66 1b4w h LYS 111 N 0.54 0.00 -0.56 1.25 2.10 -1.83 -1.56 116.57 116.50 1b4w h LYS 111 Ca 0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.08 1b4w h LYS 111 Cb 0.86 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.19 1b4w h LYS 111 CO -0.17 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 177.53 1b4w n THR 112 N -3.85 0.97 -1.91 0.07 -2.24 -0.25 -4.99 114.28 102.08 1b4w n THR 112 Ca -0.02 -0.99 -0.42 0.00 -2.27 0.00 0.00 64.05 60.36 1b4w n THR 112 Cb 0.15 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 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 -1.02 2.61 -0.18 4.78 6.14 -0.59 -4.89 117.35 124.19 1b4w s TYR 113 Ca 0.38 0.39 -0.01 0.00 0.64 0.00 0.00 57.07 58.48 1b4w s TYR 113 Cb 0.20 -3.97 0.01 0.00 0.42 0.00 0.00 41.96 38.61 1b4w s TYR 113 CO 0.26 -3.81 -0.14 0.15 0.64 0.00 0.00 175.55 172.65 1b4w s LYS 114 N 2.17 3.17 0.46 4.97 1.02 -1.26 -5.00 119.74 125.26 1b4w s LYS 114 Ca 0.73 -0.75 0.12 0.00 0.02 0.00 0.00 55.97 56.09 1b4w s LYS 114 Cb -0.42 -2.71 1.04 0.00 -0.52 0.00 0.00 37.83 35.23 1b4w s LYS 114 CO 0.32 -0.13 2.08 0.87 -0.92 0.00 0.00 175.35 177.57 1b4w h LYS 115 N 7.78 0.25 0.00 1.68 1.57 -1.96 -0.82 116.57 125.07 1b4w h LYS 115 Ca -0.40 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1b4w h LYS 115 Cb 1.16 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1b4w h LYS 115 CO 0.61 0.19 0.00 2.89 -0.57 0.00 0.00 179.45 182.57 1b4w n ARG 116 N -4.48 0.06 -0.01 3.15 1.85 -1.26 -1.95 116.66 114.03 1b4w n ARG 116 Ca -0.00 0.50 0.11 0.00 -1.00 0.00 0.00 57.85 57.45 1b4w n ARG 116 Cb 0.10 -1.68 -0.15 0.00 -1.05 0.00 0.00 32.46 29.68 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 -1.81 0.01 -2.37 2.89 4.01 -0.31 -4.74 117.16 114.85 1b4w n TYR 117 Ca 0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.40 1b4w n TYR 117 Cb 0.06 -0.35 -0.01 0.00 -0.31 0.00 0.00 39.34 38.73 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 -3.35 3.56 -1.85 -0.72 0.23 -0.82 -0.82 119.30 115.53 1b4w s MET 118 Ca -0.03 1.53 0.00 0.00 -1.03 0.00 0.00 55.69 56.17 1b4w s MET 118 Cb 0.15 -2.08 0.00 0.00 -1.53 0.00 0.00 34.83 31.37 1b4w s MET 118 CO 0.90 -0.66 0.00 0.00 -2.03 0.00 0.00 175.02 173.22 1b4w n ALA 119 N -1.09 -0.53 -2.20 3.16 0.00 -0.20 -4.87 120.51 114.77 1b4w n ALA 119 Ca 0.10 0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.33 1b4w n ALA 119 Cb 0.51 -2.13 -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 -2.96 3.17 -0.07 0.00 5.04 -1.08 -4.96 117.35 116.49 1b4w s TYR 120 Ca 0.00 0.95 -0.30 0.00 -2.44 0.00 0.00 57.07 55.28 1b4w s TYR 120 Cb 0.00 -3.66 -0.05 0.00 0.35 0.00 0.00 41.96 38.60 1b4w s TYR 120 CO 0.00 -2.31 1.66 -1.25 -1.34 0.00 0.00 175.55 172.31 1b4w s PRO 121 N 1.38 4.12 0.59 4.97 0.04 -1.26 -4.79 135.00 140.05 1b4w s PRO 121 Ca 0.64 2.13 0.34 0.00 0.04 0.00 0.00 61.00 64.15 1b4w s PRO 121 Cb -0.35 -4.00 1.86 0.00 0.04 0.00 0.00 34.50 32.05 1b4w s PRO 121 CO 0.29 -0.92 2.22 -0.44 0.04 0.00 0.00 177.00 178.20 1b4w h ASP 122 N 9.76 0.00 0.26 6.66 3.32 -1.93 -1.93 116.42 132.56 1b4w h ASP 122 Ca -0.39 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 1b4w h ASP 122 Cb 1.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1b4w h ASP 122 CO 0.96 0.03 -0.08 0.16 -1.72 0.00 0.00 179.24 178.59 1b4w h ILE 124 N 0.00 0.52 -0.01 0.35 -2.65 -2.00 -1.03 117.51 112.69 1b4w h ILE 124 Ca -0.00 -0.36 0.00 0.00 1.03 0.00 0.00 64.86 65.53 1b4w h ILE 124 Cb 0.13 1.24 0.00 0.00 -2.05 0.00 0.00 36.82 36.14 1b4w h ILE 124 CO 0.00 0.08 -0.01 0.18 0.03 0.00 0.00 178.15 178.43 1b4w n LEU 125 N -3.67 1.01 -4.77 0.16 4.77 -0.73 -4.89 117.00 108.88 1b4w n LEU 125 Ca -0.02 -0.33 -0.38 0.00 -0.03 0.00 0.00 56.01 55.25 1b4w n LEU 125 Cb 0.19 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.21 1b4w n LEU 125 CO 0.29 0.17 0.67 0.00 -1.33 0.00 0.00 177.39 177.19 1b4w n SER 127 N 0.78 -1.97 0.09 0.00 2.88 -1.26 -4.79 113.62 109.34 1b4w n SER 127 Ca 0.01 0.63 -0.06 0.00 -1.33 0.00 0.00 58.87 58.12 1b4w n SER 127 Cb 0.49 -1.09 -0.03 0.00 -0.75 0.00 0.00 64.21 62.83 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 -0.11 0.05 -3.63 -3.46 0.02 -1.96 -3.12 113.55 101.33 1b4w h SER 128 Ca -0.44 -0.04 -0.69 0.00 -0.84 0.00 0.00 61.79 59.77 1b4w h SER 128 Cb 1.39 -0.01 -0.20 0.00 0.14 0.00 0.00 62.40 63.71 1b4w h SER 128 CO 0.43 0.91 -0.47 -0.75 -1.14 0.00 0.00 176.83 175.80 1b4w s LYS 129 N -3.02 3.27 0.20 3.45 2.47 -1.26 -4.76 119.74 120.09 1b4w s LYS 129 Ca -0.00 -0.80 -0.25 0.00 -1.56 0.00 0.00 55.97 53.36 1b4w s LYS 129 Cb 0.11 -3.83 -0.08 0.00 -1.46 0.00 0.00 37.83 32.56 1b4w s LYS 129 CO 0.81 -0.55 0.81 -1.12 0.16 0.00 0.00 175.35 175.46 1b4w s SER 130 N 1.69 7.38 0.50 1.43 0.01 -1.26 -4.15 113.70 119.29 1b4w s SER 130 Ca 0.05 1.68 -0.21 0.00 1.31 0.00 0.00 55.95 58.78 1b4w s SER 130 Cb -0.18 -2.51 -0.07 0.00 0.21 0.00 0.00 66.02 63.47 1b4w s SER 130 CO 0.10 0.15 1.16 -0.70 0.41 0.00 0.00 173.24 174.36 1b4w s GLU 131 N -1.37 3.54 0.03 12.44 2.12 -0.85 -4.91 118.70 129.70 1b4w s GLU 131 Ca 0.39 1.74 -0.07 0.00 0.36 0.00 0.00 54.97 57.39 1b4w s GLU 131 Cb -0.22 -2.23 -0.05 0.00 0.26 0.00 0.00 34.13 31.89 1b4w s GLU 131 CO 0.26 -0.72 0.29 0.15 -0.54 0.00 0.00 175.26 174.70 1b4w s LYS 132 N -2.95 3.61 0.00 4.30 -0.14 -1.26 -5.01 119.74 118.28 1b4w s LYS 132 Ca 0.68 -0.05 0.12 0.00 -1.36 0.00 0.00 55.97 55.35 1b4w s LYS 132 Cb -0.27 -3.05 0.70 0.00 -1.68 0.00 0.00 37.83 33.52 1b4w s LYS 132 CO 0.32 0.62 1.13 0.00 -0.76 0.00 0.00 175.35 176.66