#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aw4 s TYR 2 N 0.00 0.19 0.23 2.03 2.02 0.19 -4.54 117.35 117.48 2aw4 s TYR 2 Ca 0.00 0.46 0.00 0.00 -0.37 0.00 0.00 57.07 57.17 2aw4 s TYR 2 Cb 0.00 -3.40 -0.05 0.00 -0.40 0.00 0.00 41.96 38.12 2aw4 s TYR 2 CO 0.00 -4.11 0.10 0.00 -1.57 0.00 0.00 175.55 169.97 2aw4 s ALA 3 N -2.91 1.50 0.00 3.71 0.00 -1.25 -4.60 121.76 118.20 2aw4 s ALA 3 Ca 0.71 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2aw4 s ALA 3 Cb -0.09 1.15 0.00 0.00 0.00 0.00 0.00 23.12 24.18 2aw4 s ALA 3 CO 0.56 -0.50 0.00 1.55 0.00 0.00 0.00 175.76 177.37 2aw4 n VAL 4 N -0.38 0.00 0.00 0.00 3.14 -0.82 -4.46 118.33 115.81 2aw4 n VAL 4 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2aw4 n VAL 4 Cb 0.66 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.44 2aw4 n VAL 4 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 2aw4 n PHE 5 N -0.07 0.00 0.00 1.45 7.35 -1.26 -3.84 117.46 121.08 2aw4 n PHE 5 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2aw4 n PHE 5 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 2aw4 n PHE 5 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2aw4 n GLN 6 N -0.32 0.00 -3.01 -4.13 10.64 -1.26 -3.51 117.38 115.78 2aw4 n GLN 6 Ca 0.00 0.00 -0.05 0.00 -1.83 0.00 0.00 57.00 55.12 2aw4 n GLN 6 Cb 0.00 0.00 0.01 0.00 -0.86 0.00 0.00 30.24 29.39 2aw4 n GLN 6 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 2aw4 n SER 7 N 0.00 -7.15 -1.44 2.61 3.41 -1.26 -3.97 113.62 105.82 2aw4 n SER 7 Ca 0.00 0.75 -0.10 0.00 -0.26 0.00 0.00 58.87 59.26 2aw4 n SER 7 Cb 0.00 -3.37 0.01 0.00 -0.26 0.00 0.00 64.21 60.59 2aw4 n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aw4 n GLY 8 N 0.77 0.08 0.00 5.00 0.00 -1.26 -4.82 105.19 104.96 2aw4 n GLY 8 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2aw4 n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aw4 n GLY 9 N -1.09 3.55 0.42 -0.02 0.00 -1.25 -4.82 105.19 101.98 2aw4 n GLY 9 Ca -0.07 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.35 2aw4 n GLY 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2aw4 n LYS 10 N -0.55 0.31 -1.47 1.61 4.01 -1.26 -4.36 118.16 116.45 2aw4 n LYS 10 Ca 0.00 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.66 2aw4 n LYS 10 Cb 0.00 -1.13 -0.11 0.00 -0.51 0.00 0.00 35.03 33.28 2aw4 n LYS 10 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 2aw4 n GLN 11 N 0.21 0.24 -0.51 1.97 -0.06 -1.23 -4.20 117.38 113.80 2aw4 n GLN 11 Ca 0.00 -0.71 -0.01 0.00 -2.00 0.00 0.00 57.00 54.27 2aw4 n GLN 11 Cb 0.07 -2.71 -0.01 0.00 -4.06 0.00 0.00 30.24 23.52 2aw4 n GLN 11 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 2aw4 n HIS 12 N 13.80 0.00 0.37 3.69 8.25 -1.24 -4.77 115.22 135.31 2aw4 n HIS 12 Ca 0.44 -0.10 -0.14 0.00 -0.26 0.00 0.00 57.72 57.66 2aw4 n HIS 12 Cb 0.38 0.28 -0.07 0.00 1.12 0.00 0.00 29.99 31.70 2aw4 n HIS 12 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2aw4 h ARG 13 N 0.00 -0.89 -6.68 -0.41 1.12 -1.78 -2.17 114.38 103.57 2aw4 h ARG 13 Ca -0.11 0.06 -0.55 0.00 -1.11 0.00 0.00 59.98 58.27 2aw4 h ARG 13 Cb 0.88 0.20 0.20 0.00 -0.01 0.00 0.00 29.97 31.24 2aw4 h ARG 13 CO -0.06 -0.60 -0.55 0.28 -3.11 0.00 0.00 179.97 175.94 2aw4 n VAL 14 N -4.49 0.91 0.00 0.20 0.31 -1.26 -4.13 118.33 109.86 2aw4 n VAL 14 Ca -0.12 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2aw4 n VAL 14 Cb 0.37 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 2aw4 n VAL 14 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2aw4 n SER 15 N -0.53 0.00 -0.02 4.52 2.88 -1.26 -3.75 113.62 115.45 2aw4 n SER 15 Ca 0.08 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.53 2aw4 n SER 15 Cb 0.52 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.90 2aw4 n SER 15 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2aw4 h GLU 16 N 0.00 -0.07 0.00 -1.46 4.11 -1.84 -3.38 114.58 111.94 2aw4 h GLU 16 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.44 2aw4 h GLU 16 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2aw4 h GLU 16 CO 0.00 0.43 0.00 0.41 0.07 0.00 0.00 179.01 179.92 2aw4 n GLY 17 N 1.30 0.00 3.52 1.06 0.00 -1.26 -4.45 105.19 105.36 2aw4 n GLY 17 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 2aw4 n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aw4 n GLN 18 N -0.14 -1.81 -4.42 1.61 0.00 -1.18 -5.00 117.38 106.45 2aw4 n GLN 18 Ca 0.00 1.27 -0.26 0.00 0.00 0.00 0.00 57.00 58.01 2aw4 n GLN 18 Cb 0.00 -2.72 -0.11 0.00 0.00 0.00 0.00 30.24 27.41 2aw4 n GLN 18 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 2aw4 s THR 19 N -2.20 2.31 1.16 -0.39 -1.32 -1.11 -4.87 115.64 109.22 2aw4 s THR 19 Ca 0.22 -2.10 -0.15 0.00 -1.21 0.00 0.00 61.69 58.45 2aw4 s THR 19 Cb -0.03 -2.13 0.23 0.00 -1.51 0.00 0.00 72.50 69.06 2aw4 s THR 19 CO 0.87 -0.20 0.65 1.33 -2.21 0.00 0.00 174.62 175.05 2aw4 n VAL 20 N 0.09 0.00 0.00 5.08 0.24 -1.24 -4.31 118.33 118.18 2aw4 n VAL 20 Ca -0.11 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 2aw4 n VAL 20 Cb 0.57 -0.85 0.00 0.00 -1.47 0.00 0.00 33.84 32.09 2aw4 n VAL 20 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2aw4 n ARG 21 N -3.93 0.00 0.00 7.34 1.74 0.52 -4.91 116.66 117.42 2aw4 n ARG 21 Ca 0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 2aw4 n ARG 21 Cb 0.57 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.01 2aw4 n ARG 21 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2aw4 n LEU 22 N 0.00 0.00 -4.18 0.55 4.77 -1.26 -4.19 117.00 112.69 2aw4 n LEU 22 Ca 0.00 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.78 2aw4 n LEU 22 Cb 0.00 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 40.97 2aw4 n LEU 22 CO 0.00 0.00 -0.47 -1.83 -1.33 0.00 0.00 177.39 173.76 2aw4 s GLU 23 N 3.18 0.92 0.00 3.23 1.03 -1.26 0.15 118.70 125.95 2aw4 s GLU 23 Ca 0.00 -0.93 0.00 0.00 0.03 0.00 0.00 54.97 54.07 2aw4 s GLU 23 Cb 0.00 -0.97 0.00 0.00 -0.80 0.00 0.00 34.13 32.36 2aw4 s GLU 23 CO 0.00 0.23 0.00 1.63 -1.33 0.00 0.00 175.26 175.79 2aw4 n LYS 24 N 1.45 0.00 0.00 -4.83 5.02 -1.26 -5.02 118.16 113.52 2aw4 n LYS 24 Ca -0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 2aw4 n LYS 24 Cb 0.54 -0.28 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 2aw4 n LYS 24 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2aw4 n LEU 25 N 0.00 0.00 0.16 -0.35 4.77 -1.26 -4.97 117.00 115.34 2aw4 n LEU 25 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 2aw4 n LEU 25 Cb 0.00 0.01 0.42 0.00 -2.33 0.00 0.00 43.42 41.52 2aw4 n LEU 25 CO 0.00 -0.01 0.88 -2.24 -1.33 0.00 0.00 177.39 174.70 2aw4 h ASP 26 N 0.00 0.14 0.00 -1.43 2.03 -2.08 -3.46 116.42 111.61 2aw4 h ASP 26 Ca 0.00 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.27 2aw4 h ASP 26 Cb 0.00 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 38.46 2aw4 h ASP 26 CO 0.00 0.32 0.00 0.00 -1.03 0.00 0.00 179.24 178.53 2aw4 n ILE 27 N -4.28 0.00 -4.47 4.15 0.13 -1.26 -5.17 119.36 108.46 2aw4 n ILE 27 Ca -0.01 0.00 -0.25 0.00 -1.10 0.00 0.00 62.75 61.38 2aw4 n ILE 27 Cb 0.27 0.00 -0.13 0.00 -0.84 0.00 0.00 39.64 38.94 2aw4 n ILE 27 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2aw4 s ALA 28 N -2.00 1.87 0.00 1.51 0.00 -1.26 -4.73 121.76 117.15 2aw4 s ALA 28 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2aw4 s ALA 28 Cb 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.81 2aw4 s ALA 28 CO 0.00 0.40 0.00 -2.37 0.00 0.00 0.00 175.76 173.79 2aw4 n THR 29 N 1.40 0.00 0.00 0.00 5.66 -1.26 -5.05 114.28 115.03 2aw4 n THR 29 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 2aw4 n THR 29 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 2aw4 n THR 29 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2aw4 n GLY 30 N -0.27 0.14 7.00 1.09 0.00 -1.26 -4.90 105.19 106.98 2aw4 n GLY 30 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.32 2aw4 n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2aw4 n GLU 31 N 0.00 0.00 0.00 1.61 4.71 -1.26 -4.93 120.64 120.77 2aw4 n GLU 31 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 2aw4 n GLU 31 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2aw4 n GLU 31 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85 2aw4 n THR 32 N 0.00 0.00 -0.41 2.62 5.66 -1.26 -4.57 114.28 116.32 2aw4 n THR 32 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2aw4 n THR 32 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2aw4 n THR 32 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2aw4 n VAL 33 N -0.11 0.00 -2.00 1.08 0.31 -1.26 -5.08 118.33 111.27 2aw4 n VAL 33 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 2aw4 n VAL 33 Cb 0.00 1.05 0.00 0.00 -0.91 0.00 0.00 33.84 33.98 2aw4 n VAL 33 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2aw4 n GLU 34 N 0.00 -0.89 -3.67 5.55 -0.58 -1.26 -5.02 120.64 114.77 2aw4 n GLU 34 Ca 0.00 1.11 -0.39 0.00 -0.42 0.00 0.00 57.16 57.45 2aw4 n GLU 34 Cb 0.06 -3.06 -0.12 0.00 -0.57 0.00 0.00 31.44 27.75 2aw4 n GLU 34 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2aw4 s PHE 35 N -1.61 3.26 0.52 -0.32 2.99 -1.26 -4.91 117.98 116.64 2aw4 s PHE 35 Ca 0.09 -1.21 -0.20 0.00 0.00 0.00 0.00 56.93 55.61 2aw4 s PHE 35 Cb -0.03 -2.40 -0.07 0.00 0.00 0.00 0.00 43.02 40.53 2aw4 s PHE 35 CO 0.29 -0.70 1.11 0.00 -0.00 0.00 0.00 175.22 175.92 2aw4 s ALA 36 N 1.48 2.78 0.00 5.36 0.00 -1.26 -0.84 121.76 129.28 2aw4 s ALA 36 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.74 2aw4 s ALA 36 Cb -0.20 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2aw4 s ALA 36 CO 0.05 -0.63 0.00 -0.85 0.00 0.00 0.00 175.76 174.33 2aw4 n GLU 37 N -1.09 3.52 -4.29 0.00 0.28 0.88 -4.90 120.64 115.04 2aw4 n GLU 37 Ca 0.10 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.94 2aw4 n GLU 37 Cb 0.51 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.28 2aw4 n GLU 37 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2aw4 s VAL 38 N 0.00 0.31 -0.15 3.84 -7.23 -1.26 -4.79 120.40 111.11 2aw4 s VAL 38 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 2aw4 s VAL 38 Cb 0.00 -2.55 -0.15 0.00 0.56 0.00 0.00 36.38 34.24 2aw4 s VAL 38 CO 0.00 0.00 2.35 -0.11 -0.31 0.00 0.00 175.10 177.03 2aw4 n LEU 39 N -0.46 3.47 0.04 1.32 0.00 -1.05 -3.42 117.00 116.90 2aw4 n LEU 39 Ca 0.01 -2.25 0.13 0.00 0.00 0.00 0.00 56.01 53.90 2aw4 n LEU 39 Cb 0.66 -0.90 0.31 0.00 0.00 0.00 0.00 43.42 43.49 2aw4 n LEU 39 CO 0.35 0.81 0.58 0.80 0.00 0.00 0.00 177.39 179.93 2aw4 n MET 40 N 2.92 0.15 -0.66 1.96 0.00 -1.26 -4.76 117.12 115.48 2aw4 n MET 40 Ca 0.29 0.07 -0.23 0.00 -0.00 0.00 0.00 57.70 57.83 2aw4 n MET 40 Cb 0.49 -1.62 -0.02 0.00 0.00 0.00 0.00 33.22 32.07 2aw4 n MET 40 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 2aw4 n ILE 41 N -1.86 0.88 -0.12 1.12 -6.64 -1.22 -4.69 119.36 106.83 2aw4 n ILE 41 Ca 0.05 -0.22 -0.06 0.00 -1.77 0.00 0.00 62.75 60.75 2aw4 n ILE 41 Cb 0.39 0.00 0.02 0.00 -1.44 0.00 0.00 39.64 38.62 2aw4 n ILE 41 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2aw4 n ALA 42 N 0.05 3.86 -1.13 -1.28 0.00 -1.26 -3.92 120.51 116.82 2aw4 n ALA 42 Ca 0.09 -0.63 -0.05 0.00 0.00 0.00 0.00 53.44 52.85 2aw4 n ALA 42 Cb 0.11 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.42 2aw4 n ALA 42 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2aw4 n ASN 43 N 0.64 -4.32 0.00 0.00 4.05 -0.77 0.11 115.26 114.98 2aw4 n ASN 43 Ca 0.12 0.11 0.00 0.00 0.45 0.00 0.00 54.58 55.26 2aw4 n ASN 43 Cb 0.62 -2.23 0.00 0.00 1.23 0.00 0.00 39.78 39.41 2aw4 n ASN 43 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2aw4 n GLY 44 N -1.40 2.28 4.15 8.20 0.00 -1.26 -4.36 105.19 112.80 2aw4 n GLY 44 Ca -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2aw4 n GLY 44 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2aw4 n GLU 45 N 0.00 0.00 -3.52 1.61 2.13 0.31 -0.64 120.64 120.53 2aw4 n GLU 45 Ca 0.00 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.41 2aw4 n GLU 45 Cb 0.00 -2.33 -0.05 0.00 0.27 0.00 0.00 31.44 29.33 2aw4 n GLU 45 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2aw4 s GLU 46 N 0.00 3.37 0.00 5.31 0.41 -1.26 -3.51 118.70 123.02 2aw4 s GLU 46 Ca 0.00 -2.88 0.00 0.00 -0.41 0.00 0.00 54.97 51.68 2aw4 s GLU 46 Cb 0.00 -4.14 0.00 0.00 -1.78 0.00 0.00 34.13 28.21 2aw4 s GLU 46 CO 0.00 -1.24 0.00 1.55 -0.49 0.00 0.00 175.26 175.08 2aw4 n VAL 47 N 3.11 0.00 0.35 2.63 3.14 -1.26 -4.37 118.33 121.92 2aw4 n VAL 47 Ca 0.17 0.00 0.03 0.00 -2.96 0.00 0.00 64.34 61.58 2aw4 n VAL 47 Cb 0.40 0.00 0.18 0.00 -1.06 0.00 0.00 33.84 33.36 2aw4 n VAL 47 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2aw4 n LYS 48 N 0.00 0.14 -2.59 1.45 2.85 -1.26 -2.59 118.16 116.16 2aw4 n LYS 48 Ca 0.00 0.13 -0.28 0.00 -1.05 0.00 0.00 58.31 57.12 2aw4 n LYS 48 Cb 0.00 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 32.87 2aw4 n LYS 48 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2aw4 n ILE 49 N -1.17 2.69 -2.39 0.58 2.08 -1.26 -5.01 119.36 114.88 2aw4 n ILE 49 Ca 0.04 -5.11 -0.41 0.00 0.56 0.00 0.00 62.75 57.82 2aw4 n ILE 49 Cb 0.04 -1.31 -0.03 0.00 -0.75 0.00 0.00 39.64 37.59 2aw4 n ILE 49 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 2aw4 s GLY 50 N -3.38 2.61 0.06 7.39 0.00 -1.07 -4.60 107.32 108.34 2aw4 s GLY 50 Ca 0.48 0.93 0.07 0.00 0.00 0.00 0.00 44.72 46.20 2aw4 s GLY 50 CO -0.18 1.89 -0.18 0.14 0.00 0.00 0.00 173.10 174.76 2aw4 s VAL 51 N 0.18 1.48 0.04 1.40 1.01 -1.26 -5.04 120.40 118.21 2aw4 s VAL 51 Ca 0.54 -1.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.09 2aw4 s VAL 51 Cb -0.32 -1.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.65 2aw4 s VAL 51 CO 0.35 0.02 1.25 -0.65 0.00 0.00 0.00 175.10 176.07 2aw4 h PRO 52 N 4.57 -0.42 -6.73 2.72 0.11 -1.94 -3.34 132.00 126.97 2aw4 h PRO 52 Ca -0.42 0.03 -0.50 0.00 0.11 0.00 0.00 66.00 65.21 2aw4 h PRO 52 Cb 1.17 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2aw4 h PRO 52 CO 0.42 -0.28 0.06 0.12 -0.21 0.00 0.00 178.00 178.11 2aw4 s PHE 53 N -4.27 3.44 0.00 0.65 5.36 -1.26 -4.79 117.98 117.11 2aw4 s PHE 53 Ca -0.08 1.03 -0.07 0.00 -0.96 0.00 0.00 56.93 56.85 2aw4 s PHE 53 Cb 0.02 -2.41 -0.04 0.00 -0.34 0.00 0.00 43.02 40.25 2aw4 s PHE 53 CO 0.27 0.02 0.74 0.28 -1.46 0.00 0.00 175.22 175.07 2aw4 h VAL 54 N 1.45 0.00 -0.14 3.12 2.07 -1.69 -3.34 116.25 117.72 2aw4 h VAL 54 Ca -0.47 -0.10 -0.56 0.00 0.82 0.00 0.00 66.70 66.39 2aw4 h VAL 54 Cb 1.18 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 2aw4 h VAL 54 CO 0.65 0.00 1.65 0.47 0.02 0.00 0.00 177.57 180.36 2aw4 n ASP 55 N -2.90 0.57 -3.11 0.57 8.00 -1.26 -1.84 116.55 116.58 2aw4 n ASP 55 Ca -0.03 0.24 -0.18 0.00 0.71 0.00 0.00 54.79 55.54 2aw4 n ASP 55 Cb 0.09 -0.97 -0.02 0.00 -0.02 0.00 0.00 41.12 40.20 2aw4 n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2aw4 n GLY 56 N 6.67 2.87 0.00 0.44 0.00 -1.25 -4.98 105.19 108.93 2aw4 n GLY 56 Ca 0.61 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2aw4 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aw4 n GLY 57 N 0.63 2.24 3.73 -0.02 0.00 -1.26 -5.03 105.19 105.48 2aw4 n GLY 57 Ca 0.21 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 2aw4 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aw4 s VAL 58 N -2.66 2.68 0.00 1.61 0.11 -1.26 -4.74 120.40 116.13 2aw4 s VAL 58 Ca 0.00 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 2aw4 s VAL 58 Cb 0.00 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.09 2aw4 s VAL 58 CO 0.00 -0.29 0.00 2.30 -3.33 0.00 0.00 175.10 173.78 2aw4 n ILE 59 N -3.81 0.00 -3.15 7.04 -5.35 -1.26 -5.04 119.36 107.79 2aw4 n ILE 59 Ca 0.07 0.00 0.05 0.00 -0.27 0.00 0.00 62.75 62.59 2aw4 n ILE 59 Cb 0.56 -1.21 -0.00 0.00 -1.74 0.00 0.00 39.64 37.24 2aw4 n ILE 59 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2aw4 s LYS 60 N 0.00 0.41 0.07 6.28 -0.14 -1.26 -5.03 119.74 120.07 2aw4 s LYS 60 Ca 0.00 0.53 -0.17 0.00 -1.36 0.00 0.00 55.97 54.97 2aw4 s LYS 60 Cb 0.00 0.27 0.03 0.00 -1.68 0.00 0.00 37.83 36.45 2aw4 s LYS 60 CO 0.00 -0.66 0.39 0.00 -0.76 0.00 0.00 175.35 174.32 2aw4 s ALA 61 N 2.88 -0.92 0.11 5.17 0.00 -1.26 -2.54 121.76 125.19 2aw4 s ALA 61 Ca 0.15 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.28 2aw4 s ALA 61 Cb -0.09 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 2aw4 s ALA 61 CO -0.22 -0.51 0.17 -1.21 0.00 0.00 0.00 175.76 173.99 2aw4 s GLU 62 N -2.91 3.16 0.11 0.00 8.01 -1.26 -4.73 118.70 121.08 2aw4 s GLU 62 Ca -0.03 -0.64 -0.22 0.00 0.01 0.00 0.00 54.97 54.09 2aw4 s GLU 62 Cb 0.00 -2.85 -0.07 0.00 -4.31 0.00 0.00 34.13 26.90 2aw4 s GLU 62 CO -0.05 0.55 0.67 0.08 0.01 0.00 0.00 175.26 176.52 2aw4 s VAL 63 N -1.58 4.57 0.23 2.63 1.01 -1.26 -0.08 120.40 125.92 2aw4 s VAL 63 Ca 0.32 1.46 -0.30 0.00 0.00 0.00 0.00 61.98 63.46 2aw4 s VAL 63 Cb -0.12 -4.02 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 2aw4 s VAL 63 CO 0.25 0.53 0.99 0.68 0.00 0.00 0.00 175.10 177.55 2aw4 s VAL 64 N -1.07 3.99 -0.12 2.92 -7.23 -0.02 -2.40 120.40 116.48 2aw4 s VAL 64 Ca 0.32 1.93 -0.19 0.00 -1.81 0.00 0.00 61.98 62.23 2aw4 s VAL 64 Cb -0.21 -4.23 -0.26 0.00 0.56 0.00 0.00 36.38 32.24 2aw4 s VAL 64 CO 0.22 0.43 0.57 0.00 -0.31 0.00 0.00 175.10 176.02 2aw4 h ALA 65 N 4.35 0.14 -4.02 1.32 0.00 -1.90 -3.40 119.26 115.74 2aw4 h ALA 65 Ca -0.45 -0.99 -0.08 0.00 0.00 0.00 0.00 54.91 53.39 2aw4 h ALA 65 Cb 1.20 0.41 0.07 0.00 0.00 0.00 0.00 17.79 19.47 2aw4 h ALA 65 CO 0.69 0.66 -0.28 0.72 0.00 0.00 0.00 179.25 181.03 2aw4 n HIS 66 N -4.10 -1.08 0.17 0.00 8.25 -1.26 -4.69 115.22 112.51 2aw4 n HIS 66 Ca -0.23 0.39 -0.07 0.00 -0.26 0.00 0.00 57.72 57.54 2aw4 n HIS 66 Cb 0.81 -3.06 -0.03 0.00 1.12 0.00 0.00 29.99 28.83 2aw4 n HIS 66 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2aw4 h GLY 67 N -0.31 -0.49 -6.07 -1.41 0.00 -1.87 -3.38 103.07 89.54 2aw4 h GLY 67 Ca -0.20 0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 2aw4 h GLY 67 CO 0.17 -0.18 -0.37 -1.60 0.00 0.00 0.00 176.54 174.57 2aw4 s ARG 68 N -3.27 0.42 -0.77 4.80 6.06 -1.26 -4.86 118.95 120.07 2aw4 s ARG 68 Ca -0.07 0.86 -0.03 0.00 -2.50 0.00 0.00 55.73 54.00 2aw4 s ARG 68 Cb 0.01 0.10 0.19 0.00 0.06 0.00 0.00 34.95 35.31 2aw4 s ARG 68 CO 0.21 -0.50 0.63 0.20 -2.50 0.00 0.00 175.30 173.33 2aw4 s GLY 69 N 2.68 2.82 0.00 8.12 0.00 -1.26 -0.10 107.32 119.57 2aw4 s GLY 69 Ca 0.10 -3.58 0.00 0.00 0.00 0.00 0.00 44.72 41.24 2aw4 s GLY 69 CO -0.17 1.16 0.00 1.18 0.00 0.00 0.00 173.10 175.27 2aw4 n GLU 70 N 2.88 0.00 -1.25 2.90 1.02 -1.26 -4.57 120.64 120.36 2aw4 n GLU 70 Ca 0.15 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.46 2aw4 n GLU 70 Cb 0.38 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.74 2aw4 n GLU 70 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2aw4 n LYS 71 N 0.00 -2.70 0.00 3.49 4.01 -1.26 -4.45 118.16 117.24 2aw4 n LYS 71 Ca 0.00 2.00 0.00 0.00 -0.51 0.00 0.00 58.31 59.80 2aw4 n LYS 71 Cb 0.00 -3.23 0.00 0.00 -0.51 0.00 0.00 35.03 31.29 2aw4 n LYS 71 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 2aw4 n VAL 72 N -4.05 0.00 0.00 -0.18 0.24 -1.26 -3.95 118.33 109.13 2aw4 n VAL 72 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2aw4 n VAL 72 Cb 0.58 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.95 2aw4 n VAL 72 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2aw4 n LYS 73 N 0.00 0.00 -1.60 7.34 4.81 -1.26 -4.99 118.16 122.45 2aw4 n LYS 73 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2aw4 n LYS 73 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2aw4 n LYS 73 CO 0.00 0.00 0.00 1.51 1.17 0.00 0.00 177.40 180.08 2aw4 n ILE 74 N -0.11 -2.18 -3.69 3.15 3.06 -1.26 -5.05 119.36 113.28 2aw4 n ILE 74 Ca 0.00 0.59 -0.15 0.00 -2.50 0.00 0.00 62.75 60.69 2aw4 n ILE 74 Cb 0.00 -1.26 -0.15 0.00 0.54 0.00 0.00 39.64 38.78 2aw4 n ILE 74 CO 0.00 0.00 0.00 0.68 -2.50 0.00 0.00 176.55 174.73 2aw4 s VAL 75 N -0.28 -0.21 0.00 9.51 -7.23 -1.26 -5.09 120.40 115.83 2aw4 s VAL 75 Ca 0.00 0.28 0.00 0.00 -1.81 0.00 0.00 61.98 60.45 2aw4 s VAL 75 Cb 0.00 -0.32 0.00 0.00 0.56 0.00 0.00 36.38 36.62 2aw4 s VAL 75 CO 0.00 0.11 0.88 1.17 -0.31 0.00 0.00 175.10 176.96 2aw4 n LYS 76 N 4.93 0.00 -2.77 4.82 4.81 -1.26 -4.75 118.16 123.93 2aw4 n LYS 76 Ca -0.13 0.56 -0.01 0.00 -0.87 0.00 0.00 58.31 57.87 2aw4 n LYS 76 Cb 0.51 -1.38 -0.00 0.00 0.02 0.00 0.00 35.03 34.17 2aw4 n LYS 76 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2aw4 n PHE 77 N -1.96 -3.51 -3.77 5.64 3.01 -1.26 -4.53 117.46 111.08 2aw4 n PHE 77 Ca 0.00 1.62 -0.15 0.00 1.01 0.00 0.00 57.45 59.92 2aw4 n PHE 77 Cb 0.00 -3.59 -0.16 0.00 -0.01 0.00 0.00 39.48 35.72 2aw4 n PHE 77 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2aw4 s ARG 78 N -1.44 -0.02 0.40 -1.08 0.52 -1.26 -4.64 118.95 111.43 2aw4 s ARG 78 Ca -0.03 0.20 0.06 0.00 -0.52 0.00 0.00 55.73 55.44 2aw4 s ARG 78 Cb 0.00 -0.28 0.00 0.00 0.52 0.00 0.00 34.95 35.19 2aw4 s ARG 78 CO 0.68 -0.18 0.56 1.03 0.02 0.00 0.00 175.30 177.41 2aw4 s ARG 79 N 1.16 2.93 -0.29 3.54 0.52 -1.26 -4.80 118.95 120.75 2aw4 s ARG 79 Ca -0.08 -1.05 -0.18 0.00 -0.52 0.00 0.00 55.73 53.91 2aw4 s ARG 79 Cb -0.13 -2.74 0.15 0.00 0.52 0.00 0.00 34.95 32.75 2aw4 s ARG 79 CO -0.03 -0.19 1.01 -0.98 0.02 0.00 0.00 175.30 175.13 2aw4 s ARG 80 N -4.34 0.37 0.00 3.54 1.70 -1.26 -1.59 118.95 117.37 2aw4 s ARG 80 Ca 0.51 0.60 0.00 0.00 -0.47 0.00 0.00 55.73 56.37 2aw4 s ARG 80 Cb -0.10 0.09 0.00 0.00 -0.57 0.00 0.00 34.95 34.37 2aw4 s ARG 80 CO 0.33 -0.07 0.00 1.63 -1.08 0.00 0.00 175.30 176.11 2aw4 n LYS 81 N 3.39 3.55 -0.00 3.89 4.76 -1.18 -4.94 118.16 127.63 2aw4 n LYS 81 Ca -0.17 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.35 2aw4 n LYS 81 Cb 0.57 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.66 2aw4 n LYS 81 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 2aw4 n HIS 82 N 0.00 0.00 -0.15 2.13 -0.00 -1.26 -4.50 115.22 111.44 2aw4 n HIS 82 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2aw4 n HIS 82 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 29.99 29.97 2aw4 n HIS 82 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 2aw4 n TYR 83 N -1.45 0.00 -3.94 1.57 4.01 -1.26 -5.10 117.16 110.99 2aw4 n TYR 83 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 2aw4 n TYR 83 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 2aw4 n TYR 83 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 2aw4 n ARG 84 N -0.37 0.04 -2.95 -0.72 1.85 -1.26 -5.15 116.66 108.09 2aw4 n ARG 84 Ca 0.00 0.00 0.04 0.00 -1.00 0.00 0.00 57.85 56.89 2aw4 n ARG 84 Cb 0.04 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.45 2aw4 n ARG 84 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 2aw4 s LYS 85 N -1.81 0.12 0.00 2.89 -2.85 -1.26 -3.08 119.74 113.75 2aw4 s LYS 85 Ca 0.00 0.03 0.07 0.00 -1.00 0.00 0.00 55.97 55.06 2aw4 s LYS 85 Cb 0.00 0.03 0.37 0.00 -2.06 0.00 0.00 37.83 36.17 2aw4 s LYS 85 CO 0.00 -0.20 0.97 0.00 0.10 0.00 0.00 175.35 176.22 2aw4 n GLN 86 N 4.37 0.15 -1.48 1.78 10.64 -0.62 -4.68 117.38 127.54 2aw4 n GLN 86 Ca 0.08 0.12 -0.31 0.00 -1.83 0.00 0.00 57.00 55.06 2aw4 n GLN 86 Cb 0.61 -1.50 -0.19 0.00 -0.86 0.00 0.00 30.24 28.30 2aw4 n GLN 86 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 2aw4 n GLN 87 N -1.15 0.00 0.00 2.61 0.00 -0.98 -4.38 117.38 113.47 2aw4 n GLN 87 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.04 2aw4 n GLN 87 Cb 0.04 -1.23 0.00 0.00 0.00 0.00 0.00 30.24 29.05 2aw4 n GLN 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2aw4 n GLY 88 N 5.92 1.53 3.64 1.69 0.00 -1.26 -5.04 105.19 111.67 2aw4 n GLY 88 Ca 0.66 0.25 -0.02 0.00 0.00 0.00 0.00 46.02 46.91 2aw4 n GLY 88 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2aw4 s HIS 89 N 0.00 -0.03 -0.30 1.61 5.04 -1.26 -5.06 115.29 115.30 2aw4 s HIS 89 Ca 0.00 0.03 -0.16 0.00 -1.54 0.00 0.00 55.06 53.39 2aw4 s HIS 89 Cb 0.00 0.50 0.18 0.00 0.04 0.00 0.00 32.58 33.30 2aw4 s HIS 89 CO 0.00 -0.04 1.12 0.50 -2.34 0.00 0.00 174.74 173.98 2aw4 s ARG 90 N -1.64 0.20 -0.18 2.88 6.06 -1.26 -4.74 118.95 120.27 2aw4 s ARG 90 Ca 0.10 0.40 -0.04 0.00 -2.50 0.00 0.00 55.73 53.69 2aw4 s ARG 90 Cb -0.01 0.12 0.07 0.00 0.06 0.00 0.00 34.95 35.20 2aw4 s ARG 90 CO -0.05 -0.05 0.15 -0.65 -2.50 0.00 0.00 175.30 172.20 2aw4 s GLN 91 N 1.57 0.12 0.31 5.12 -1.52 -1.26 -5.13 119.66 118.86 2aw4 s GLN 91 Ca -0.06 0.07 0.03 0.00 -1.95 0.00 0.00 55.36 53.45 2aw4 s GLN 91 Cb -0.03 -1.49 -0.05 0.00 -0.22 0.00 0.00 33.01 31.22 2aw4 s GLN 91 CO -0.14 -0.65 0.10 1.67 -0.25 0.00 0.00 175.29 176.02 2aw4 s TRP 92 N 2.23 1.70 0.41 0.91 1.48 -1.26 -4.98 118.94 119.43 2aw4 s TRP 92 Ca 0.04 -1.18 0.03 0.00 -1.06 0.00 0.00 56.10 53.94 2aw4 s TRP 92 Cb -0.16 -1.03 -0.03 0.00 -1.16 0.00 0.00 33.47 31.10 2aw4 s TRP 92 CO -0.10 -0.28 0.11 -0.59 -4.06 0.00 0.00 176.95 172.02 2aw4 s PHE 93 N -3.53 1.82 -0.26 1.66 -0.12 -1.26 -5.07 117.98 111.22 2aw4 s PHE 93 Ca 0.35 -1.20 0.10 0.00 -0.05 0.00 0.00 56.93 56.13 2aw4 s PHE 93 Cb 0.07 -1.23 -0.14 0.00 -0.63 0.00 0.00 43.02 41.09 2aw4 s PHE 93 CO 0.15 -0.19 0.34 0.25 -0.05 0.00 0.00 175.22 175.71 2aw4 n THR 94 N -0.92 0.00 -2.93 -4.49 -2.24 -1.25 -4.29 114.28 98.15 2aw4 n THR 94 Ca -0.07 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2aw4 n THR 94 Cb 0.65 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 2aw4 n THR 94 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2aw4 n ASP 95 N -1.55 -6.83 -4.77 3.42 5.75 -1.26 -3.98 116.55 107.34 2aw4 n ASP 95 Ca 0.00 0.72 -0.41 0.00 -0.01 0.00 0.00 54.79 55.10 2aw4 n ASP 95 Cb 0.22 -1.45 -0.01 0.00 -1.03 0.00 0.00 41.12 38.85 2aw4 n ASP 95 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2aw4 s VAL 96 N -0.32 2.35 0.00 2.12 -7.23 0.40 -4.29 120.40 113.44 2aw4 s VAL 96 Ca 0.00 0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 2aw4 s VAL 96 Cb 0.00 -3.22 0.00 0.00 0.56 0.00 0.00 36.38 33.72 2aw4 s VAL 96 CO 0.00 0.08 0.18 1.17 -0.31 0.00 0.00 175.10 176.22 2aw4 n LYS 97 N 0.48 0.00 -0.20 4.82 3.00 0.86 -0.35 118.16 126.76 2aw4 n LYS 97 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 2aw4 n LYS 97 Cb 0.41 -0.67 0.00 0.00 0.00 0.00 0.00 35.03 34.77 2aw4 n LYS 97 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2aw4 n ILE 98 N -0.19 -1.36 -0.09 3.15 2.08 -1.26 -3.68 119.36 118.01 2aw4 n ILE 98 Ca 0.00 0.00 -0.13 0.00 0.56 0.00 0.00 62.75 63.18 2aw4 n ILE 98 Cb 0.00 -1.36 -0.14 0.00 -0.75 0.00 0.00 39.64 37.39 2aw4 n ILE 98 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2aw4 n THR 99 N -0.13 1.49 -1.64 1.39 -2.24 -1.26 -2.77 114.28 109.12 2aw4 n THR 99 Ca 0.00 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 2aw4 n THR 99 Cb 0.00 -0.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 2aw4 n THR 99 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2aw4 n GLY 100 N 1.90 -4.90 0.00 3.38 0.00 -1.26 -3.09 105.19 101.22 2aw4 n GLY 100 Ca -0.35 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2aw4 n GLY 100 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2aw4 n ILE 101 N 1.35 0.00 -3.46 -0.61 2.08 -1.01 -4.80 119.36 112.92 2aw4 n ILE 101 Ca 0.00 0.00 -0.23 0.00 0.56 0.00 0.00 62.75 63.08 2aw4 n ILE 101 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 39.64 38.88 2aw4 n ILE 101 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 2aw4 s SER 102 N -1.85 6.22 0.00 4.38 0.01 -1.26 -4.72 113.70 116.48 2aw4 s SER 102 Ca 0.00 0.31 0.09 0.00 1.31 0.00 0.00 55.95 57.65 2aw4 s SER 102 Cb 0.00 -1.88 0.51 0.00 0.21 0.00 0.00 66.02 64.86 2aw4 s SER 102 CO 0.00 -0.31 0.97 0.00 0.41 0.00 0.00 173.24 174.31