#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aqw n PRO 2 N 0.00 -3.63 -4.51 0.54 -0.04 -1.26 -4.63 135.00 121.46 1aqw n PRO 2 Ca 0.00 -1.29 -0.30 0.00 -0.04 0.00 0.00 63.50 61.87 1aqw n PRO 2 Cb 0.00 -1.44 -0.13 0.00 -0.04 0.00 0.00 33.50 31.89 1aqw n PRO 2 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1aqw s TYR 3 N -2.22 2.45 -0.09 0.54 2.02 -1.25 -3.76 117.35 115.05 1aqw s TYR 3 Ca 0.56 -0.31 0.02 0.00 -0.37 0.00 0.00 57.07 56.97 1aqw s TYR 3 Cb -0.08 -1.36 0.01 0.00 -0.40 0.00 0.00 41.96 40.13 1aqw s TYR 3 CO 0.45 0.30 -0.15 0.99 -1.57 0.00 0.00 175.55 175.57 1aqw s THR 4 N -1.01 1.42 -0.21 -0.71 2.01 -0.69 -0.51 115.64 115.94 1aqw s THR 4 Ca 0.15 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.49 1aqw s THR 4 Cb -0.10 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 1aqw s THR 4 CO 0.07 0.42 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.70 1aqw s VAL 5 N 0.77 3.63 -0.30 3.82 1.01 0.02 -0.90 120.40 128.45 1aqw s VAL 5 Ca -0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 1aqw s VAL 5 Cb -0.16 -2.64 0.03 0.00 0.00 0.00 0.00 36.38 33.61 1aqw s VAL 5 CO 0.02 0.43 0.03 -0.69 0.00 0.00 0.00 175.10 174.89 1aqw s VAL 6 N 1.21 3.36 0.26 2.92 1.01 -0.17 -0.08 120.40 128.92 1aqw s VAL 6 Ca 0.03 -1.10 -0.15 0.00 0.00 0.00 0.00 61.98 60.76 1aqw s VAL 6 Cb -0.14 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1aqw s VAL 6 CO -0.00 -0.02 0.55 -0.47 0.00 0.00 0.00 175.10 175.15 1aqw s TYR 7 N 1.36 0.22 0.71 5.22 5.04 -0.92 -2.03 117.35 126.95 1aqw s TYR 7 Ca -0.02 -0.61 -0.11 0.00 -2.44 0.00 0.00 57.07 53.90 1aqw s TYR 7 Cb -0.18 0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.47 1aqw s TYR 7 CO -0.00 -1.07 1.06 -0.06 -1.34 0.00 0.00 175.55 174.15 1aqw s PHE 8 N -3.96 3.03 -1.38 4.97 0.08 -1.26 -0.40 117.98 119.06 1aqw s PHE 8 Ca 0.19 1.44 -0.13 0.00 0.12 0.00 0.00 56.93 58.55 1aqw s PHE 8 Cb -0.02 -2.91 -0.03 0.00 -0.57 0.00 0.00 43.02 39.49 1aqw s PHE 8 CO 0.09 -1.32 2.38 -0.35 -0.10 0.00 0.00 175.22 175.92 1aqw n PRO 9 N -3.17 2.85 -3.90 0.24 -0.04 -1.25 -4.79 135.00 124.93 1aqw n PRO 9 Ca 0.08 -2.31 -0.09 0.00 -0.04 0.00 0.00 63.50 61.13 1aqw n PRO 9 Cb 0.53 -3.05 -0.07 0.00 -0.04 0.00 0.00 33.50 30.87 1aqw n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1aqw s VAL 10 N 3.17 0.12 -0.02 0.52 -7.23 -1.26 -4.37 120.40 111.33 1aqw s VAL 10 Ca 0.54 -1.28 -0.08 0.00 -1.81 0.00 0.00 61.98 59.34 1aqw s VAL 10 Cb 0.15 -1.52 -0.05 0.00 0.56 0.00 0.00 36.38 35.52 1aqw s VAL 10 CO -0.05 -0.55 0.51 0.03 -0.31 0.00 0.00 175.10 174.73 1aqw h ARG 11 N 2.70 -0.29 0.00 4.82 3.08 -1.10 -3.46 114.38 120.14 1aqw h ARG 11 Ca -0.33 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1aqw h ARG 11 Cb 1.21 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1aqw h ARG 11 CO 0.54 -0.19 0.00 0.41 -1.07 0.00 0.00 179.97 179.66 1aqw n GLY 12 N 0.63 2.37 0.10 0.04 0.00 0.53 -1.25 105.19 107.61 1aqw n GLY 12 Ca -0.04 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.27 1aqw n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aqw n ARG 13 N 14.00 1.13 -0.00 1.61 1.74 -1.26 -3.32 116.66 130.56 1aqw n ARG 13 Ca 0.00 -0.20 0.07 0.00 -0.77 0.00 0.00 57.85 56.95 1aqw n ARG 13 Cb 0.00 -1.37 -0.09 0.00 -1.02 0.00 0.00 32.46 29.98 1aqw n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aqw h ALA 15 N 1.95 0.29 -0.43 0.00 0.00 -1.34 -1.97 119.26 117.76 1aqw h ALA 15 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1aqw h ALA 15 Cb 0.44 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1aqw h ALA 15 CO 0.00 -0.38 0.18 0.00 0.00 0.00 0.00 179.25 179.05 1aqw h ALA 16 N 1.23 0.56 0.00 0.00 0.00 -1.83 -1.21 119.26 118.02 1aqw h ALA 16 Ca 0.14 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1aqw h ALA 16 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1aqw h ALA 16 CO -0.21 0.15 -0.37 1.37 0.00 0.00 0.00 179.25 180.20 1aqw h LEU 17 N 0.56 0.00 -0.25 0.00 8.10 -1.82 -1.28 115.31 120.62 1aqw h LEU 17 Ca 0.15 0.00 -0.13 0.00 0.11 0.00 0.00 57.88 58.00 1aqw h LEU 17 Cb 0.17 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.39 1aqw h LEU 17 CO -0.01 0.37 -0.35 0.03 -4.11 0.00 0.00 178.44 174.36 1aqw h ARG 18 N 0.00 0.69 -0.73 0.17 3.08 -1.01 -1.60 114.38 114.98 1aqw h ARG 18 Ca -0.00 -0.40 -0.01 0.00 0.07 0.00 0.00 59.98 59.64 1aqw h ARG 18 Cb 0.67 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.72 1aqw h ARG 18 CO 0.05 1.02 0.43 0.52 -1.07 0.00 0.00 179.97 180.92 1aqw h MET 19 N 0.41 1.00 -0.06 0.04 2.86 -0.87 -0.94 114.93 117.37 1aqw h MET 19 Ca 0.03 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1aqw h MET 19 Cb 0.94 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 1aqw h MET 19 CO 0.08 0.72 0.03 1.25 1.06 0.00 0.00 176.91 180.05 1aqw h LEU 20 N 1.00 0.08 -0.72 1.22 6.46 -1.15 -1.19 115.31 121.01 1aqw h LEU 20 Ca 0.26 -0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1aqw h LEU 20 Cb -0.01 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 39.86 1aqw h LEU 20 CO -0.05 0.14 0.47 -0.07 -0.62 0.00 0.00 178.44 178.32 1aqw h LEU 21 N 0.00 0.81 -0.28 2.25 3.38 -0.94 -1.24 115.31 119.28 1aqw h LEU 21 Ca 0.02 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1aqw h LEU 21 Cb 0.09 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1aqw h LEU 21 CO -0.00 0.58 0.02 0.00 0.09 0.00 0.00 178.44 179.13 1aqw h ALA 22 N 1.27 0.38 0.00 1.53 0.00 -1.13 0.22 119.26 121.54 1aqw h ALA 22 Ca 0.27 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1aqw h ALA 22 Cb -0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1aqw h ALA 22 CO -0.07 0.10 -0.43 0.22 0.00 0.00 0.00 179.25 179.07 1aqw h ASP 23 N 0.28 0.00 -0.49 0.00 3.58 -1.09 -2.95 116.42 115.75 1aqw h ASP 23 Ca 0.08 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1aqw h ASP 23 Cb 0.39 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.44 1aqw h ASP 23 CO 0.01 0.43 0.00 0.00 -2.88 0.00 0.00 179.24 176.80 1aqw n GLN 24 N -3.64 3.91 -3.22 0.28 1.13 -0.48 -4.90 117.38 110.46 1aqw n GLN 24 Ca -0.01 -2.51 -0.23 0.00 -1.94 0.00 0.00 57.00 52.31 1aqw n GLN 24 Cb 0.52 -2.02 0.05 0.00 0.11 0.00 0.00 30.24 28.90 1aqw n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aqw n GLY 25 N 0.67 -0.53 3.95 1.08 0.00 -1.12 -5.01 105.19 104.23 1aqw n GLY 25 Ca 0.22 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.22 1aqw n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aqw s GLN 26 N -5.91 3.14 0.06 1.61 -1.52 0.06 -5.05 119.66 112.05 1aqw s GLN 26 Ca 0.40 -0.98 0.09 0.00 -1.95 0.00 0.00 55.36 52.92 1aqw s GLN 26 Cb -0.18 -2.77 -0.03 0.00 -0.22 0.00 0.00 33.01 29.81 1aqw s GLN 26 CO 0.49 0.21 -0.24 0.45 -0.25 0.00 0.00 175.29 175.95 1aqw s SER 27 N -4.06 2.94 0.10 5.90 0.15 -1.26 -4.57 113.70 112.91 1aqw s SER 27 Ca 0.40 -0.60 -0.15 0.00 0.70 0.00 0.00 55.95 56.30 1aqw s SER 27 Cb -0.09 -0.24 0.03 0.00 -1.71 0.00 0.00 66.02 64.01 1aqw s SER 27 CO 0.29 0.21 0.36 -1.66 1.20 0.00 0.00 173.24 173.63 1aqw s TRP 28 N -0.86 -0.14 -0.11 3.44 -2.14 -1.26 -3.85 118.94 114.02 1aqw s TRP 28 Ca 0.10 -0.16 -0.04 0.00 2.66 0.00 0.00 56.10 58.67 1aqw s TRP 28 Cb -0.10 0.18 -0.03 0.00 -3.10 0.00 0.00 33.47 30.42 1aqw s TRP 28 CO 0.03 -0.64 0.03 0.15 -2.66 0.00 0.00 176.95 173.85 1aqw s LYS 29 N -3.59 3.28 -0.25 3.25 1.02 0.33 -4.99 119.74 118.79 1aqw s LYS 29 Ca 0.02 -0.37 -0.10 0.00 0.02 0.00 0.00 55.97 55.54 1aqw s LYS 29 Cb 0.02 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 1aqw s LYS 29 CO -0.10 0.60 0.14 -1.21 -0.92 0.00 0.00 175.35 173.86 1aqw s GLU 30 N -0.58 3.92 -0.43 1.68 0.41 -1.26 -0.80 118.70 121.64 1aqw s GLU 30 Ca 0.10 -0.34 -0.07 0.00 -0.41 0.00 0.00 54.97 54.25 1aqw s GLU 30 Cb -0.12 -3.52 0.10 0.00 -1.78 0.00 0.00 34.13 28.82 1aqw s GLU 30 CO 0.02 -0.08 0.26 -2.00 -0.49 0.00 0.00 175.26 172.97 1aqw s GLU 31 N 1.43 2.33 0.07 1.61 2.12 0.89 -4.96 118.70 122.19 1aqw s GLU 31 Ca 0.07 -1.70 -0.30 0.00 0.36 0.00 0.00 54.97 53.40 1aqw s GLU 31 Cb -0.15 -3.74 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 1aqw s GLU 31 CO 0.07 -1.07 1.00 0.08 -0.54 0.00 0.00 175.26 174.79 1aqw s VAL 32 N 1.29 4.58 -0.28 3.70 1.01 -1.26 -2.15 120.40 127.29 1aqw s VAL 32 Ca 0.05 1.99 -0.05 0.00 0.00 0.00 0.00 61.98 63.98 1aqw s VAL 32 Cb -0.24 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 31.88 1aqw s VAL 32 CO -0.01 0.23 0.02 -0.69 0.00 0.00 0.00 175.10 174.65 1aqw s VAL 33 N 0.48 3.49 0.50 2.92 1.01 0.46 -4.94 120.40 124.32 1aqw s VAL 33 Ca 0.50 -0.86 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 1aqw s VAL 33 Cb -0.23 -2.81 -0.07 0.00 0.00 0.00 0.00 36.38 33.27 1aqw s VAL 33 CO 0.29 0.11 0.95 0.42 0.00 0.00 0.00 175.10 176.87 1aqw s THR 34 N 1.42 4.59 0.34 3.92 -4.23 -1.26 -3.93 115.64 116.48 1aqw s THR 34 Ca 0.01 1.09 0.03 0.00 -1.18 0.00 0.00 61.69 61.65 1aqw s THR 34 Cb -0.17 -3.73 0.29 0.00 1.34 0.00 0.00 72.50 70.23 1aqw s THR 34 CO -0.00 -0.67 1.94 0.58 -0.54 0.00 0.00 174.62 175.93 1aqw h VAL 35 N 0.92 1.05 -0.76 2.29 2.07 -1.98 0.11 116.25 119.95 1aqw h VAL 35 Ca -0.47 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 66.69 1aqw h VAL 35 Cb 1.19 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1aqw h VAL 35 CO 0.62 0.16 0.26 1.05 0.02 0.00 0.00 177.57 179.68 1aqw h GLU 36 N 0.88 1.17 -0.28 1.57 4.11 -1.99 0.33 114.58 120.38 1aqw h GLU 36 Ca 0.34 -0.24 -0.08 0.00 0.07 0.00 0.00 59.36 59.45 1aqw h GLU 36 Cb 0.20 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1aqw h GLU 36 CO -0.11 0.98 -0.13 1.15 0.07 0.00 0.00 179.01 180.97 1aqw h THR 37 N 1.12 1.29 0.00 -1.06 2.02 -1.58 -3.02 112.91 111.69 1aqw h THR 37 Ca 0.25 -1.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1aqw h THR 37 Cb 0.28 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1aqw h THR 37 CO -0.01 0.38 -0.00 -0.25 0.37 0.00 0.00 175.52 176.01 1aqw h TRP 38 N 0.32 -0.01 0.00 3.16 2.91 -0.53 -2.74 115.95 119.06 1aqw h TRP 38 Ca 0.06 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.08 1aqw h TRP 38 Cb 0.64 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.29 1aqw h TRP 38 CO 0.06 0.06 0.00 1.96 -1.03 0.00 0.00 178.44 179.49 1aqw h GLN 39 N -0.07 0.00 -0.25 2.65 4.20 -0.97 -1.79 115.11 118.88 1aqw h GLN 39 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 1aqw h GLN 39 Cb 0.07 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1aqw h GLN 39 CO 0.00 0.00 -0.20 1.05 -0.67 0.00 0.00 178.83 179.01 1aqw h GLU 40 N 0.00 0.46 0.00 1.46 -0.00 -1.35 -3.48 114.58 111.67 1aqw h GLU 40 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 59.36 59.21 1aqw h GLU 40 Cb 0.05 -0.04 0.00 0.00 -0.00 0.00 0.00 28.75 28.76 1aqw h GLU 40 CO 0.00 0.64 0.00 0.41 -0.00 0.00 0.00 179.01 180.06 1aqw n GLY 41 N -0.50 2.47 0.11 1.06 0.00 -0.67 -4.99 105.19 102.65 1aqw n GLY 41 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1aqw n GLY 41 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1aqw h SER 42 N 0.43 0.19 -0.08 1.61 4.64 -1.84 -1.89 113.55 116.62 1aqw h SER 42 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1aqw h SER 42 Cb 0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1aqw h SER 42 CO 0.00 0.14 -0.01 0.25 -0.87 0.00 0.00 176.83 176.34 1aqw h LEU 43 N 0.24 0.15 -0.36 5.97 5.85 -1.89 -2.97 115.31 122.30 1aqw h LEU 43 Ca 0.08 -0.35 0.07 0.00 0.84 0.00 0.00 57.88 58.52 1aqw h LEU 43 Cb -0.01 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 1aqw h LEU 43 CO -0.03 0.46 -0.04 0.50 -0.34 0.00 0.00 178.44 178.99 1aqw h LYS 44 N -0.17 0.05 -0.01 1.25 3.64 -1.83 0.21 116.57 119.70 1aqw h LYS 44 Ca 0.02 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1aqw h LYS 44 Cb 0.39 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1aqw h LYS 44 CO 0.01 0.03 0.06 0.00 -2.27 0.00 0.00 179.45 177.27 1aqw h ALA 45 N 1.34 1.20 0.00 5.00 0.00 -1.35 -0.14 119.26 125.31 1aqw h ALA 45 Ca 0.18 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1aqw h ALA 45 Cb 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1aqw h ALA 45 CO -0.33 -0.06 -0.95 0.77 0.00 0.00 0.00 179.25 178.68 1aqw h SER 46 N 0.00 0.00 -3.29 0.00 0.02 -0.44 -3.46 113.55 106.37 1aqw h SER 46 Ca 0.01 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.43 1aqw h SER 46 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 1aqw h SER 46 CO -0.00 0.08 0.54 0.00 -1.14 0.00 0.00 176.83 176.31 1aqw h LEU 48 N 6.35 -0.83 -3.29 0.00 5.85 -1.88 0.67 115.31 122.18 1aqw h LEU 48 Ca -0.42 0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1aqw h LEU 48 Cb 1.21 0.54 0.00 0.00 0.37 0.00 0.00 40.66 42.79 1aqw h LEU 48 CO 0.79 -0.28 0.00 -1.22 -0.34 0.00 0.00 178.44 177.38 1aqw n TYR 49 N -5.55 1.10 -1.79 1.25 4.01 -1.26 -4.94 117.16 109.98 1aqw n TYR 49 Ca 0.12 -0.84 -0.17 0.00 -0.16 0.00 0.00 57.90 56.86 1aqw n TYR 49 Cb 0.43 -0.33 -0.05 0.00 -0.31 0.00 0.00 39.34 39.08 1aqw n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aqw n GLY 50 N -0.27 0.94 3.19 2.72 0.00 0.23 -5.00 105.19 107.00 1aqw n GLY 50 Ca 0.22 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 1aqw n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aqw s GLN 51 N -3.93 0.89 0.29 1.61 -0.21 -1.26 -4.93 119.66 112.11 1aqw s GLN 51 Ca 0.00 -1.24 0.08 0.00 0.02 0.00 0.00 55.36 54.22 1aqw s GLN 51 Cb 0.00 0.28 -0.04 0.00 1.00 0.00 0.00 33.01 34.26 1aqw s GLN 51 CO 0.00 -0.26 0.17 -0.51 -2.12 0.00 0.00 175.29 172.56 1aqw s LEU 52 N -2.97 3.53 0.70 2.90 1.43 -1.26 -4.70 118.68 118.31 1aqw s LEU 52 Ca 0.15 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.65 1aqw s LEU 52 Cb 0.06 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 44.23 1aqw s LEU 52 CO -0.04 -0.15 1.06 -2.16 0.23 0.00 0.00 176.35 175.30 1aqw s PRO 53 N -3.84 2.87 0.05 1.29 0.04 -1.26 -4.96 135.00 129.19 1aqw s PRO 53 Ca 0.35 1.01 0.09 0.00 0.04 0.00 0.00 61.00 62.49 1aqw s PRO 53 Cb -0.06 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 1aqw s PRO 53 CO 0.24 -1.15 -0.25 0.21 0.04 0.00 0.00 177.00 176.08 1aqw s LYS 54 N -4.93 1.67 -0.01 4.56 2.20 -0.86 -3.90 119.74 118.47 1aqw s LYS 54 Ca 0.59 -1.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.11 1aqw s LYS 54 Cb -0.15 -1.86 0.00 0.00 -1.51 0.00 0.00 37.83 34.32 1aqw s LYS 54 CO 0.53 0.48 -0.02 0.12 -0.36 0.00 0.00 175.35 176.11 1aqw s PHE 55 N -0.83 0.20 -0.04 4.03 5.36 0.17 -1.00 117.98 125.87 1aqw s PHE 55 Ca 0.11 -0.02 0.07 0.00 -0.96 0.00 0.00 56.93 56.13 1aqw s PHE 55 Cb -0.10 -0.17 -0.01 0.00 -0.34 0.00 0.00 43.02 42.40 1aqw s PHE 55 CO 0.02 -0.03 -0.25 -0.65 -1.46 0.00 0.00 175.22 172.86 1aqw s GLN 56 N 0.16 2.24 -0.41 10.12 -1.52 -0.08 -0.21 119.66 129.96 1aqw s GLN 56 Ca -0.01 -0.89 0.03 0.00 -1.95 0.00 0.00 55.36 52.54 1aqw s GLN 56 Cb -0.03 -2.03 0.16 0.00 -0.22 0.00 0.00 33.01 30.88 1aqw s GLN 56 CO -0.00 0.46 0.30 0.34 -0.25 0.00 0.00 175.29 176.13 1aqw s ASP 57 N -0.38 2.31 0.87 5.90 -1.08 -0.12 -1.70 116.67 122.47 1aqw s ASP 57 Ca 0.03 -2.79 0.00 0.00 -0.52 0.00 0.00 52.55 49.28 1aqw s ASP 57 Cb -0.11 -0.54 0.00 0.00 -1.46 0.00 0.00 42.92 40.80 1aqw s ASP 57 CO 0.01 -0.22 0.00 0.61 0.52 0.00 0.00 175.17 176.09 1aqw n GLY 58 N 3.25 1.10 0.40 2.66 0.00 -1.25 -2.52 105.19 108.84 1aqw n GLY 58 Ca 0.22 -0.64 0.14 0.00 0.00 0.00 0.00 46.02 45.74 1aqw n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aqw n ASP 59 N 5.19 1.30 -4.59 1.61 8.00 -1.26 -4.74 116.55 122.07 1aqw n ASP 59 Ca 0.00 -1.33 -0.43 0.00 0.71 0.00 0.00 54.79 53.75 1aqw n ASP 59 Cb 0.00 0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.10 1aqw n ASP 59 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1aqw s LEU 60 N -2.11 3.53 -0.21 0.64 2.96 -1.05 -5.00 118.68 117.45 1aqw s LEU 60 Ca 0.36 0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 54.40 1aqw s LEU 60 Cb 0.21 -3.30 -0.05 0.00 0.50 0.00 0.00 46.19 43.55 1aqw s LEU 60 CO 0.38 -1.39 0.12 -0.89 -1.32 0.00 0.00 176.35 173.25 1aqw s THR 61 N 4.75 5.22 0.18 3.68 2.01 -1.26 -0.94 115.64 129.27 1aqw s THR 61 Ca 0.45 0.12 0.08 0.00 0.31 0.00 0.00 61.69 62.65 1aqw s THR 61 Cb -0.07 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 1aqw s THR 61 CO 0.28 0.41 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.69 1aqw s LEU 62 N 0.61 2.48 0.30 4.42 1.43 0.70 -4.97 118.68 123.65 1aqw s LEU 62 Ca 0.07 -0.91 0.03 0.00 -1.03 0.00 0.00 54.13 52.28 1aqw s LEU 62 Cb -0.12 -0.76 -0.05 0.00 0.03 0.00 0.00 46.19 45.29 1aqw s LEU 62 CO 0.01 -0.09 0.10 -0.31 0.23 0.00 0.00 176.35 176.29 1aqw s TYR 63 N -2.36 1.71 0.00 0.29 2.02 -1.26 -0.66 117.35 117.09 1aqw s TYR 63 Ca 0.18 -1.14 -0.00 0.00 -0.37 0.00 0.00 57.07 55.73 1aqw s TYR 63 Cb -0.04 -1.05 0.00 0.00 -0.40 0.00 0.00 41.96 40.47 1aqw s TYR 63 CO 0.07 -0.24 0.00 1.04 -1.57 0.00 0.00 175.55 174.84 1aqw n GLN 64 N -0.60 -0.06 -0.21 -0.62 1.13 -1.25 -4.54 117.38 111.23 1aqw n GLN 64 Ca -0.01 0.53 0.01 0.00 -1.94 0.00 0.00 57.00 55.60 1aqw n GLN 64 Cb 0.66 -0.56 0.12 0.00 0.11 0.00 0.00 30.24 30.57 1aqw n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1aqw h SER 65 N 0.05 0.02 0.37 1.08 4.64 -1.89 -1.63 113.55 116.19 1aqw h SER 65 Ca -0.00 0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 1aqw h SER 65 Cb 0.00 0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1aqw h SER 65 CO 0.00 0.01 -0.32 0.78 -0.87 0.00 0.00 176.83 176.43 1aqw h ASN 66 N 0.28 0.00 -0.36 4.97 4.21 -1.93 -1.77 115.58 120.97 1aqw h ASN 66 Ca 0.33 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.76 1aqw h ASN 66 Cb 0.50 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.69 1aqw h ASN 66 CO -0.41 0.32 -0.10 0.74 -1.29 0.00 0.00 177.43 176.69 1aqw h THR 67 N 0.00 1.28 -0.41 2.81 2.02 -1.60 -1.18 112.91 115.83 1aqw h THR 67 Ca -0.00 -1.18 0.01 0.00 0.77 0.00 0.00 66.41 66.00 1aqw h THR 67 Cb 0.60 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 1aqw h THR 67 CO 0.04 0.39 0.27 0.40 0.37 0.00 0.00 175.52 176.99 1aqw h ILE 68 N 0.50 1.10 -0.36 3.11 2.04 -0.71 0.71 117.51 123.90 1aqw h ILE 68 Ca 0.09 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1aqw h ILE 68 Cb 0.62 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1aqw h ILE 68 CO 0.04 0.10 0.23 -0.07 0.00 0.00 0.00 178.15 178.45 1aqw h LEU 69 N 0.54 0.42 -0.88 1.44 3.38 -1.20 -0.87 115.31 118.14 1aqw h LEU 69 Ca 0.15 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1aqw h LEU 69 Cb -0.05 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1aqw h LEU 69 CO -0.04 0.31 -0.07 0.03 0.09 0.00 0.00 178.44 178.76 1aqw h ARG 70 N 0.48 0.75 0.01 1.13 3.08 -0.97 0.22 114.38 119.08 1aqw h ARG 70 Ca 0.13 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1aqw h ARG 70 Cb -0.04 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1aqw h ARG 70 CO -0.03 0.81 -0.00 1.25 -1.07 0.00 0.00 179.97 180.93 1aqw h HIS 71 N 0.69 -0.01 -0.50 3.04 2.76 -0.37 -0.10 115.15 120.65 1aqw h HIS 71 Ca 0.12 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.23 1aqw h HIS 71 Cb 0.53 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 1aqw h HIS 71 CO 0.03 0.03 0.07 -0.07 -1.30 0.00 0.00 177.93 176.68 1aqw h LEU 72 N -0.04 0.75 -0.10 0.26 3.38 -0.97 -1.91 115.31 116.68 1aqw h LEU 72 Ca -0.00 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.83 1aqw h LEU 72 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1aqw h LEU 72 CO 0.00 0.78 -0.00 1.23 0.09 0.00 0.00 178.44 180.54 1aqw h GLY 73 N 0.96 0.09 2.00 0.83 0.00 -0.11 0.65 103.07 107.49 1aqw h GLY 73 Ca 0.16 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1aqw h GLY 73 CO 0.01 -0.02 -0.04 0.07 0.00 0.00 0.00 176.54 176.56 1aqw h ARG 74 N 0.03 0.00 0.00 4.80 0.11 -0.80 0.15 114.38 118.67 1aqw h ARG 74 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 1aqw h ARG 74 Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 1aqw h ARG 74 CO -0.08 0.04 -1.21 0.25 0.10 0.00 0.00 179.97 179.08 1aqw n THR 75 N -3.12 0.45 -0.02 0.08 -2.24 -0.74 -4.07 114.28 104.63 1aqw n THR 75 Ca 0.03 -0.51 0.07 0.00 -2.27 0.00 0.00 64.05 61.37 1aqw n THR 75 Cb 0.47 -0.22 0.16 0.00 -2.10 0.00 0.00 70.33 68.63 1aqw n THR 75 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1aqw n LEU 76 N -2.53 2.93 -1.61 3.22 4.77 0.19 -4.98 117.00 118.99 1aqw n LEU 76 Ca -0.01 -1.74 -0.10 0.00 -0.03 0.00 0.00 56.01 54.13 1aqw n LEU 76 Cb 0.54 -0.22 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1aqw n LEU 76 CO 0.41 0.69 0.06 0.61 -1.33 0.00 0.00 177.39 177.83 1aqw n GLY 77 N 0.80 0.26 1.28 -0.72 0.00 -0.97 -4.95 105.19 100.89 1aqw n GLY 77 Ca 0.13 -0.34 -0.08 0.00 0.00 0.00 0.00 46.02 45.73 1aqw n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1aqw n LEU 78 N -2.12 4.10 -0.97 0.99 4.32 0.49 -4.69 117.00 119.11 1aqw n LEU 78 Ca -0.02 -4.11 0.03 0.00 -0.02 0.00 0.00 56.01 51.89 1aqw n LEU 78 Cb 0.54 -0.55 0.15 0.00 -1.62 0.00 0.00 43.42 41.94 1aqw n LEU 78 CO 0.24 1.55 0.27 0.00 -1.22 0.00 0.00 177.39 178.23 1aqw n TYR 79 N -1.00 0.26 0.00 -1.77 4.19 -1.21 -1.18 117.16 116.45 1aqw n TYR 79 Ca 0.33 -1.36 0.00 0.00 3.31 0.00 0.00 57.90 60.18 1aqw n TYR 79 Cb 0.89 -0.24 0.00 0.00 0.49 0.00 0.00 39.34 40.48 1aqw n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1aqw n GLY 80 N -0.73 -0.61 0.08 2.98 0.00 -1.26 -3.78 105.19 101.88 1aqw n GLY 80 Ca 0.18 -1.70 0.12 0.00 0.00 0.00 0.00 46.02 44.62 1aqw n GLY 80 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1aqw h LYS 81 N 0.00 0.00 0.00 1.61 2.10 -1.96 -3.46 116.57 114.86 1aqw h LYS 81 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 1aqw h LYS 81 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1aqw h LYS 81 CO 0.00 0.00 0.10 -0.40 -2.00 0.00 0.00 179.45 177.15 1aqw n ASP 82 N -2.24 -1.06 -0.11 7.07 5.68 -1.26 -5.03 116.55 119.59 1aqw n ASP 82 Ca 0.03 -1.81 -0.01 0.00 -0.50 0.00 0.00 54.79 52.50 1aqw n ASP 82 Cb 0.46 1.79 0.25 0.00 -1.14 0.00 0.00 41.12 42.49 1aqw n ASP 82 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1aqw h GLN 83 N 0.00 0.77 -0.39 0.11 4.20 -1.93 -0.38 115.11 117.49 1aqw h GLN 83 Ca -0.16 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.35 1aqw h GLN 83 Cb 0.61 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1aqw h GLN 83 CO 0.21 0.64 -0.09 0.37 -0.67 0.00 0.00 178.83 179.29 1aqw h GLN 84 N 0.76 0.75 -0.52 1.46 4.15 -1.98 -2.34 115.11 117.40 1aqw h GLN 84 Ca 0.18 -0.28 -0.10 0.00 0.77 0.00 0.00 58.65 59.22 1aqw h GLN 84 Cb 0.16 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1aqw h GLN 84 CO -0.02 0.89 -0.06 0.93 -1.93 0.00 0.00 178.83 178.64 1aqw h GLU 85 N 0.55 0.92 -0.76 1.69 5.08 -1.83 -2.35 114.58 117.88 1aqw h GLU 85 Ca 0.10 -0.30 0.04 0.00 -1.00 0.00 0.00 59.36 58.19 1aqw h GLU 85 Cb 0.61 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 1aqw h GLU 85 CO 0.04 0.95 0.48 0.00 -1.00 0.00 0.00 179.01 179.48 1aqw h ALA 86 N 1.09 1.01 -0.72 3.43 0.00 -0.97 0.55 119.26 123.64 1aqw h ALA 86 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1aqw h ALA 86 Cb 0.58 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1aqw h ALA 86 CO 0.04 0.27 0.41 0.00 0.00 0.00 0.00 179.25 179.96 1aqw h ALA 87 N 1.33 0.92 -0.41 0.00 0.00 -1.13 -1.17 119.26 118.81 1aqw h ALA 87 Ca 0.31 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 1aqw h ALA 87 Cb 0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1aqw h ALA 87 CO -0.12 0.42 -0.16 -0.07 0.00 0.00 0.00 179.25 179.32 1aqw h LEU 88 N 0.99 0.76 -0.53 0.00 3.38 -0.84 -1.05 115.31 118.02 1aqw h LEU 88 Ca 0.26 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1aqw h LEU 88 Cb 0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1aqw h LEU 88 CO -0.04 0.93 0.19 0.58 0.09 0.00 0.00 178.44 180.18 1aqw h VAL 89 N 0.68 1.23 -0.60 1.22 2.07 -0.52 -2.02 116.25 118.31 1aqw h VAL 89 Ca 0.11 -0.74 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 1aqw h VAL 89 Cb 0.65 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.11 1aqw h VAL 89 CO 0.05 0.28 0.18 0.44 0.02 0.00 0.00 177.57 178.53 1aqw h ASP 90 N 0.72 0.88 -0.75 0.57 3.32 -0.96 -0.97 116.42 119.23 1aqw h ASP 90 Ca 0.17 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 57.02 1aqw h ASP 90 Cb 0.24 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 1aqw h ASP 90 CO -0.01 0.86 0.49 -0.03 -1.72 0.00 0.00 179.24 178.82 1aqw h MET 91 N 0.85 0.96 -0.11 3.56 4.05 -0.94 -0.17 114.93 123.12 1aqw h MET 91 Ca 0.19 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.54 1aqw h MET 91 Cb 0.30 -0.22 -0.00 0.00 -0.80 0.00 0.00 31.60 30.88 1aqw h MET 91 CO -0.00 0.63 -0.00 0.28 0.23 0.00 0.00 176.91 178.04 1aqw h VAL 92 N 0.99 1.26 -0.78 -5.77 2.07 -1.17 -2.65 116.25 110.19 1aqw h VAL 92 Ca 0.28 -0.83 0.01 0.00 0.82 0.00 0.00 66.70 66.97 1aqw h VAL 92 Cb -0.08 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1aqw h VAL 92 CO -0.07 0.24 0.51 -1.13 0.02 0.00 0.00 177.57 177.14 1aqw h ASN 93 N -0.08 0.90 0.11 0.57 -0.73 -0.88 -0.76 115.58 114.72 1aqw h ASN 93 Ca 0.03 -0.03 -0.11 0.00 1.87 0.00 0.00 56.30 58.06 1aqw h ASN 93 Cb 0.37 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.72 1aqw h ASN 93 CO 0.01 0.66 -0.38 0.44 -0.37 0.00 0.00 177.43 177.79 1aqw h ASP 94 N 1.06 0.37 -0.38 1.15 3.32 -1.02 -0.38 116.42 120.55 1aqw h ASP 94 Ca 0.29 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1aqw h ASP 94 Cb -0.11 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1aqw h ASP 94 CO -0.06 0.72 -0.03 1.23 -1.72 0.00 0.00 179.24 179.38 1aqw h GLY 95 N 1.14 0.75 0.99 2.75 0.00 -1.00 -1.42 103.07 106.28 1aqw h GLY 95 Ca 0.03 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 1aqw h GLY 95 CO 0.06 0.52 0.29 -2.08 0.00 0.00 0.00 176.54 175.34 1aqw h VAL 96 N 0.51 1.15 -0.79 4.60 2.07 -0.87 -2.61 116.25 120.31 1aqw h VAL 96 Ca 0.10 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.31 1aqw h VAL 96 Cb 0.51 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 1aqw h VAL 96 CO 0.02 0.15 0.52 -0.08 0.02 0.00 0.00 177.57 178.20 1aqw h GLU 97 N 0.63 1.01 -0.32 1.57 4.57 -0.93 0.22 114.58 121.33 1aqw h GLU 97 Ca 0.17 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.31 1aqw h GLU 97 Cb -0.01 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 28.33 1aqw h GLU 97 CO -0.03 0.67 0.17 -0.44 -1.18 0.00 0.00 179.01 178.20 1aqw h ASP 98 N 1.04 0.27 -0.33 1.04 3.32 -1.00 -0.14 116.42 120.60 1aqw h ASP 98 Ca 0.30 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.22 1aqw h ASP 98 Cb -0.08 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1aqw h ASP 98 CO -0.08 0.20 -0.29 0.25 -1.72 0.00 0.00 179.24 177.60 1aqw h LEU 99 N 0.36 0.88 -0.94 1.55 5.85 -1.16 -2.71 115.31 119.13 1aqw h LEU 99 Ca 0.13 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1aqw h LEU 99 Cb 0.03 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.77 1aqw h LEU 99 CO -0.08 1.10 0.61 -0.09 -0.34 0.00 0.00 178.44 179.64 1aqw h ARG 100 N 0.72 1.25 -0.81 1.25 2.43 -0.58 -0.28 114.38 118.37 1aqw h ARG 100 Ca 0.08 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1aqw h ARG 100 Cb 0.84 -0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 1aqw h ARG 100 CO 0.07 0.85 0.51 0.00 -1.51 0.00 0.00 179.97 179.89 1aqw h LYS 102 N 1.11 1.00 -0.16 0.00 1.57 -1.08 -2.03 116.57 116.98 1aqw h LYS 102 Ca 0.29 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1aqw h LYS 102 Cb -0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1aqw h LYS 102 CO -0.06 1.01 0.10 -0.92 -0.57 0.00 0.00 179.45 179.01 1aqw h TYR 103 N 0.88 0.20 -0.87 -1.35 3.20 -0.66 -1.76 116.97 116.62 1aqw h TYR 103 Ca 0.15 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 1aqw h TYR 103 Cb 0.57 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 1aqw h TYR 103 CO 0.04 0.15 0.52 0.82 -1.64 0.00 0.00 178.16 178.05 1aqw h ILE 104 N 0.19 1.24 -0.24 1.81 2.04 -0.75 -0.08 117.51 121.73 1aqw h ILE 104 Ca 0.06 -0.52 -0.11 0.00 1.00 0.00 0.00 64.86 65.29 1aqw h ILE 104 Cb -0.00 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 1aqw h ILE 104 CO -0.01 0.25 -0.33 0.28 0.00 0.00 0.00 178.15 178.34 1aqw h SER 105 N 1.19 0.51 0.10 1.72 0.02 -1.19 -0.21 113.55 115.69 1aqw h SER 105 Ca 0.31 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1aqw h SER 105 Cb -0.05 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.35 1aqw h SER 105 CO -0.06 0.81 -0.05 0.25 -1.14 0.00 0.00 176.83 176.64 1aqw h LEU 106 N 0.42 -0.12 -0.38 5.07 5.85 -0.50 -0.38 115.31 125.27 1aqw h LEU 106 Ca 0.05 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.58 1aqw h LEU 106 Cb 0.78 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1aqw h LEU 106 CO 0.06 0.15 0.22 0.40 -0.34 0.00 0.00 178.44 178.93 1aqw h ILE 107 N -0.39 1.03 0.00 4.05 1.08 -0.89 0.63 117.51 123.02 1aqw h ILE 107 Ca -0.01 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1aqw h ILE 107 Cb 0.32 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.62 1aqw h ILE 107 CO 0.02 0.08 -0.82 -1.22 -0.69 0.00 0.00 178.15 175.53 1aqw n TYR 108 N -4.88 0.29 0.00 1.37 4.01 -0.10 -4.46 117.16 113.38 1aqw n TYR 108 Ca 0.01 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1aqw n TYR 108 Cb 0.07 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 38.65 1aqw n TYR 108 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1aqw n THR 109 N -1.90 0.00 -2.61 -0.72 -2.24 -0.16 -4.93 114.28 101.72 1aqw n THR 109 Ca 0.03 -0.09 -0.02 0.00 -2.27 0.00 0.00 64.05 61.70 1aqw n THR 109 Cb 0.41 0.52 0.08 0.00 -2.10 0.00 0.00 70.33 69.25 1aqw n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aqw n ASN 110 N -0.65 -0.57 0.23 3.42 5.15 -0.91 -4.99 115.26 116.93 1aqw n ASN 110 Ca 0.00 -2.13 -0.16 0.00 -0.60 0.00 0.00 54.58 51.69 1aqw n ASN 110 Cb 0.00 0.32 -0.08 0.00 -0.53 0.00 0.00 39.78 39.48 1aqw n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1aqw h TYR 111 N 1.24 -1.09 -0.23 1.20 3.20 -1.11 0.15 116.97 120.34 1aqw h TYR 111 Ca -0.38 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.50 1aqw h TYR 111 Cb 1.34 0.43 -0.01 0.00 1.54 0.00 0.00 36.73 40.02 1aqw h TYR 111 CO 0.06 -0.55 0.14 0.93 -1.64 0.00 0.00 178.16 177.11 1aqw h GLU 112 N -0.80 0.29 0.00 1.82 3.07 -1.94 -2.41 114.58 114.60 1aqw h GLU 112 Ca -0.03 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1aqw h GLU 112 Cb 0.72 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 1aqw h GLU 112 CO -0.08 0.19 -0.88 0.00 -1.40 0.00 0.00 179.01 176.84 1aqw h ALA 113 N 1.09 0.54 0.00 3.43 0.00 -1.97 -3.39 119.26 118.96 1aqw h ALA 113 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1aqw h ALA 113 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1aqw h ALA 113 CO -0.03 0.00 -1.06 0.41 0.00 0.00 0.00 179.25 178.57 1aqw n GLY 114 N 1.20 -0.72 0.19 0.00 0.00 0.52 -4.68 105.19 101.70 1aqw n GLY 114 Ca 0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 46.02 45.51 1aqw n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1aqw h LYS 115 N 0.00 0.09 -0.38 1.61 3.64 -1.55 -1.86 116.57 118.12 1aqw h LYS 115 Ca 0.00 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 1aqw h LYS 115 Cb 0.51 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.28 1aqw h LYS 115 CO 0.00 0.06 0.20 -0.44 -2.27 0.00 0.00 179.45 177.01 1aqw h ASP 116 N 0.10 0.31 -0.69 4.20 3.32 -1.87 -0.00 116.42 121.79 1aqw h ASP 116 Ca 0.23 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.25 1aqw h ASP 116 Cb 0.34 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 1aqw h ASP 116 CO -0.40 0.23 0.26 0.44 -1.72 0.00 0.00 179.24 178.05 1aqw h ASP 117 N 0.42 0.97 0.19 6.45 3.32 -1.80 -1.44 116.42 124.52 1aqw h ASP 117 Ca 0.16 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1aqw h ASP 117 Cb 0.04 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1aqw h ASP 117 CO -0.10 0.89 -0.14 0.22 -1.72 0.00 0.00 179.24 178.39 1aqw h TYR 118 N 0.99 -0.36 -0.58 4.55 5.03 -0.78 -2.30 116.97 123.52 1aqw h TYR 118 Ca 0.23 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.54 1aqw h TYR 118 Cb 0.23 0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.62 1aqw h TYR 118 CO 0.02 -0.22 0.36 0.28 -1.32 0.00 0.00 178.16 177.28 1aqw h VAL 119 N -0.33 1.16 -0.13 1.81 2.07 -0.80 -1.52 116.25 118.50 1aqw h VAL 119 Ca -0.01 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1aqw h VAL 119 Cb 0.29 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1aqw h VAL 119 CO -0.01 0.16 -0.24 0.11 0.02 0.00 0.00 177.57 177.61 1aqw h LYS 120 N 0.79 0.22 -0.01 1.57 1.79 -0.89 -2.43 116.57 117.62 1aqw h LYS 120 Ca 0.21 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1aqw h LYS 120 Cb -0.05 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1aqw h LYS 120 CO -0.04 0.46 -0.31 0.00 -1.08 0.00 0.00 179.45 178.48 1aqw n ALA 121 N -2.48 3.18 -0.35 3.86 0.00 -0.75 -4.41 120.51 119.57 1aqw n ALA 121 Ca -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 53.44 53.02 1aqw n ALA 121 Cb 0.35 -1.14 0.10 0.00 0.00 0.00 0.00 19.45 18.75 1aqw n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1aqw h LEU 122 N 0.85 1.14 -0.89 0.00 5.85 -0.78 -2.93 115.31 118.55 1aqw h LEU 122 Ca 0.00 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1aqw h LEU 122 Cb 0.50 -0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1aqw h LEU 122 CO 0.00 0.89 0.57 -0.65 -0.34 0.00 0.00 178.44 178.90 1aqw h PRO 123 N 1.30 1.04 -0.05 5.25 0.11 -1.77 -0.72 132.00 137.16 1aqw h PRO 123 Ca 0.33 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.33 1aqw h PRO 123 Cb -0.02 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.84 1aqw h PRO 123 CO -0.06 0.68 -0.21 0.78 -0.21 0.00 0.00 178.00 178.98 1aqw h GLY 124 N 1.07 0.09 2.00 -0.55 0.00 -1.83 -1.22 103.07 102.63 1aqw h GLY 124 Ca 0.37 -0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.50 1aqw h GLY 124 CO -0.14 0.05 -0.67 1.46 0.00 0.00 0.00 176.54 177.24 1aqw h GLN 125 N 0.08 0.00 0.00 4.80 1.08 -1.10 -3.32 115.11 116.65 1aqw h GLN 125 Ca 0.01 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.08 1aqw h GLN 125 Cb 0.43 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.83 1aqw h GLN 125 CO 0.03 0.67 -1.22 -0.07 -0.95 0.00 0.00 178.83 177.29 1aqw h LEU 126 N 0.00 0.00 -0.95 1.46 3.38 -0.67 -3.39 115.31 115.14 1aqw h LEU 126 Ca -0.01 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.15 1aqw h LEU 126 Cb 1.43 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.07 1aqw h LEU 126 CO 0.09 0.48 0.54 0.11 0.09 0.00 0.00 178.44 179.75 1aqw h LYS 127 N 0.00 0.66 -0.51 1.13 1.57 -1.33 -1.70 116.57 116.38 1aqw h LYS 127 Ca -0.12 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1aqw h LYS 127 Cb 1.47 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.60 1aqw h LYS 127 CO 0.04 0.44 0.34 -1.00 -0.57 0.00 0.00 179.45 178.70 1aqw h PRO 128 N 0.68 0.53 -0.19 3.15 0.13 -1.78 -0.07 132.00 134.45 1aqw h PRO 128 Ca 0.55 -0.03 -0.17 0.00 -0.87 0.00 0.00 66.00 65.48 1aqw h PRO 128 Cb 0.87 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 1aqw h PRO 128 CO -0.40 0.35 -0.56 0.74 -0.23 0.00 0.00 178.00 177.90 1aqw h PHE 129 N 0.54 0.74 -0.71 1.56 0.04 -1.59 0.53 116.94 118.05 1aqw h PHE 129 Ca 0.21 -0.27 -0.06 0.00 2.80 0.00 0.00 57.97 60.66 1aqw h PHE 129 Cb 0.16 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 1aqw h PHE 129 CO -0.00 1.01 0.23 1.49 -0.60 0.00 0.00 178.31 180.44 1aqw h GLU 130 N 0.45 1.10 -0.21 1.51 4.57 -1.25 -1.78 114.58 118.98 1aqw h GLU 130 Ca 0.01 -0.23 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 1aqw h GLU 130 Cb 1.11 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.53 1aqw h GLU 130 CO 0.11 0.94 0.08 1.15 -1.18 0.00 0.00 179.01 180.11 1aqw h THR 131 N 1.05 1.17 -0.31 0.32 2.02 -0.58 -2.03 112.91 114.55 1aqw h THR 131 Ca 0.23 -0.52 0.04 0.00 0.77 0.00 0.00 66.41 66.93 1aqw h THR 131 Cb 0.30 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 1aqw h THR 131 CO -0.01 0.17 0.09 -0.07 0.37 0.00 0.00 175.52 176.07 1aqw h LEU 132 N 0.18 0.07 -0.35 2.58 3.38 -0.69 -2.01 115.31 118.46 1aqw h LEU 132 Ca 0.07 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.13 1aqw h LEU 132 Cb 0.19 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1aqw h LEU 132 CO -0.00 0.08 0.09 -0.07 0.09 0.00 0.00 178.44 178.62 1aqw h LEU 133 N 0.21 0.05 -1.51 1.67 3.38 -1.24 -2.01 115.31 115.88 1aqw h LEU 133 Ca 0.14 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.23 1aqw h LEU 133 Cb 0.13 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1aqw h LEU 133 CO -0.16 0.07 0.42 0.77 0.09 0.00 0.00 178.44 179.62 1aqw h SER 134 N 0.22 0.52 1.02 -0.43 4.64 -0.95 0.31 113.55 118.87 1aqw h SER 134 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1aqw h SER 134 Cb 0.17 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1aqw h SER 134 CO -0.20 0.33 0.00 0.00 -0.87 0.00 0.00 176.83 176.09 1aqw n GLN 135 N -4.48 0.12 -3.62 4.77 6.02 -0.79 -3.10 117.38 116.31 1aqw n GLN 135 Ca 0.09 0.20 -0.38 0.00 -0.01 0.00 0.00 57.00 56.90 1aqw n GLN 135 Cb 0.27 -1.67 -0.07 0.00 1.02 0.00 0.00 30.24 29.78 1aqw n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1aqw s ASN 136 N -3.75 5.83 -1.38 1.08 2.47 -0.32 -4.77 114.94 114.10 1aqw s ASN 136 Ca 0.10 -3.22 -0.02 0.00 0.42 0.00 0.00 52.86 50.15 1aqw s ASN 136 Cb 0.13 -1.94 0.01 0.00 -1.45 0.00 0.00 41.25 38.01 1aqw s ASN 136 CO 0.48 -0.32 0.59 0.00 -3.72 0.00 0.00 177.10 174.13 1aqw n GLN 137 N 3.05 -4.12 -1.59 0.43 1.13 -1.26 -0.92 117.38 114.11 1aqw n GLN 137 Ca 0.15 0.51 -0.20 0.00 -1.94 0.00 0.00 57.00 55.51 1aqw n GLN 137 Cb 0.39 -4.89 -0.09 0.00 0.11 0.00 0.00 30.24 25.76 1aqw n GLN 137 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aqw n GLY 138 N -1.77 1.92 2.27 1.08 0.00 -1.18 -2.18 105.19 105.34 1aqw n GLY 138 Ca -0.27 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 1aqw n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aqw n GLY 139 N -0.36 0.32 0.04 -0.02 0.00 0.94 -4.72 105.19 101.39 1aqw n GLY 139 Ca -0.20 -0.40 0.14 0.00 0.00 0.00 0.00 46.02 45.56 1aqw n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aqw n LYS 140 N -2.33 0.35 0.00 1.61 4.01 -0.92 -4.85 118.16 116.03 1aqw n LYS 140 Ca -0.14 -0.07 0.00 0.00 -0.51 0.00 0.00 58.31 57.59 1aqw n LYS 140 Cb 0.55 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.57 1aqw n LYS 140 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1aqw n THR 141 N -1.26 0.00 -4.06 -0.18 -2.24 -1.26 -5.12 114.28 100.16 1aqw n THR 141 Ca 0.11 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.62 1aqw n THR 141 Cb 0.29 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 1aqw n THR 141 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1aqw s PHE 142 N 1.16 1.82 0.21 4.78 0.08 -1.25 -5.02 117.98 119.75 1aqw s PHE 142 Ca 0.00 -0.82 -0.05 0.00 0.12 0.00 0.00 56.93 56.18 1aqw s PHE 142 Cb 0.00 -1.87 0.16 0.00 -0.57 0.00 0.00 43.02 40.74 1aqw s PHE 142 CO 0.00 -0.26 1.61 0.97 -0.10 0.00 0.00 175.22 177.44 1aqw h ILE 143 N 0.95 1.27 -3.32 0.64 6.09 -1.97 -3.43 117.51 117.75 1aqw h ILE 143 Ca -0.39 -1.38 -0.45 0.00 -1.37 0.00 0.00 64.86 61.27 1aqw h ILE 143 Cb 1.30 1.25 -0.36 0.00 0.47 0.00 0.00 36.82 39.48 1aqw h ILE 143 CO 0.62 0.46 -0.78 -0.69 -3.07 0.00 0.00 178.15 174.69 1aqw s VAL 144 N -4.55 0.57 0.00 2.19 1.01 -1.26 -4.67 120.40 113.68 1aqw s VAL 144 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1aqw s VAL 144 Cb 0.13 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.86 1aqw s VAL 144 CO 0.84 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.82 1aqw n GLY 145 N 4.69 -0.79 1.01 4.51 0.00 -1.26 -4.37 105.19 108.98 1aqw n GLY 145 Ca -0.15 -1.11 -0.01 0.00 0.00 0.00 0.00 46.02 44.76 1aqw n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1aqw n ASP 146 N -1.49 2.59 -3.95 1.61 5.68 -1.26 -3.89 116.55 115.84 1aqw n ASP 146 Ca 0.00 -3.64 -0.10 0.00 -0.50 0.00 0.00 54.79 50.55 1aqw n ASP 146 Cb 0.00 -0.60 -0.11 0.00 -1.14 0.00 0.00 41.12 39.27 1aqw n ASP 146 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1aqw s GLN 147 N -3.17 0.35 0.45 0.11 0.00 -1.26 -4.93 119.66 111.22 1aqw s GLN 147 Ca 0.43 -0.56 -0.24 0.00 -0.00 0.00 0.00 55.36 54.99 1aqw s GLN 147 Cb 0.39 0.13 -0.07 0.00 0.00 0.00 0.00 33.01 33.46 1aqw s GLN 147 CO 0.01 -0.07 1.25 -1.50 0.00 0.00 0.00 175.29 174.98 1aqw s ILE 148 N -1.45 2.73 0.35 3.63 2.07 -1.26 -4.81 121.20 122.47 1aqw s ILE 148 Ca -0.16 0.60 0.04 0.00 -1.41 0.00 0.00 60.65 59.72 1aqw s ILE 148 Cb -0.09 -3.32 -0.06 0.00 0.13 0.00 0.00 42.46 39.12 1aqw s ILE 148 CO -0.00 0.04 0.07 -0.94 -1.91 0.00 0.00 174.94 172.19 1aqw s SER 149 N -1.03 2.51 0.53 4.50 1.04 -1.26 -4.67 113.70 115.31 1aqw s SER 149 Ca 0.62 -1.43 0.28 0.00 0.48 0.00 0.00 55.95 55.90 1aqw s SER 149 Cb -0.34 0.03 1.46 0.00 0.10 0.00 0.00 66.02 67.26 1aqw s SER 149 CO 0.43 -0.67 2.06 2.19 0.98 0.00 0.00 173.24 178.23 1aqw h PHE 150 N 2.03 0.00 -0.17 5.02 -5.15 -1.49 -2.28 116.94 114.90 1aqw h PHE 150 Ca -0.40 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.31 1aqw h PHE 150 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.41 1aqw h PHE 150 CO 0.76 0.11 -0.16 0.00 -2.00 0.00 0.00 178.31 177.02 1aqw h ALA 151 N 1.89 1.41 -0.39 12.09 0.00 -1.87 -2.63 119.26 129.75 1aqw h ALA 151 Ca -0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1aqw h ALA 151 Cb 0.36 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1aqw h ALA 151 CO 0.01 0.41 0.24 -0.44 0.00 0.00 0.00 179.25 179.47 1aqw h ASP 152 N 0.27 0.46 -0.51 0.00 3.32 -1.81 0.66 116.42 118.81 1aqw h ASP 152 Ca 0.05 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1aqw h ASP 152 Cb 0.44 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1aqw h ASP 152 CO 0.03 0.37 0.24 1.88 -1.72 0.00 0.00 179.24 180.03 1aqw h TYR 153 N 0.52 0.73 -0.38 4.55 0.05 -1.58 0.24 116.97 121.10 1aqw h TYR 153 Ca 0.14 -0.04 -0.05 0.00 0.05 0.00 0.00 58.73 58.84 1aqw h TYR 153 Cb -0.02 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.48 1aqw h TYR 153 CO -0.04 0.58 0.06 -0.97 -1.05 0.00 0.00 178.16 176.75 1aqw h ASN 154 N 0.67 0.61 -0.57 3.88 -0.00 -1.25 -1.91 115.58 117.01 1aqw h ASN 154 Ca 0.17 -0.26 -0.05 0.00 -0.00 0.00 0.00 56.30 56.17 1aqw h ASN 154 Cb 0.13 -0.16 -0.02 0.00 -0.00 0.00 0.00 38.32 38.26 1aqw h ASN 154 CO -0.02 0.71 0.18 0.25 -0.00 0.00 0.00 177.43 178.55 1aqw h LEU 155 N 0.48 0.84 -0.53 0.34 5.85 -0.68 -1.97 115.31 119.65 1aqw h LEU 155 Ca 0.12 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1aqw h LEU 155 Cb 0.36 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1aqw h LEU 155 CO 0.01 0.82 0.30 0.25 -0.34 0.00 0.00 178.44 179.48 1aqw h LEU 156 N 0.81 0.47 -0.60 2.25 5.85 -0.81 -1.27 115.31 122.01 1aqw h LEU 156 Ca 0.18 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1aqw h LEU 156 Cb 0.29 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1aqw h LEU 156 CO -0.01 0.32 0.26 -0.78 -0.34 0.00 0.00 178.44 177.90 1aqw h ASP 157 N 0.59 0.81 -0.58 1.25 3.58 -1.10 -1.01 116.42 119.96 1aqw h ASP 157 Ca 0.22 -0.15 0.03 0.00 0.42 0.00 0.00 57.03 57.54 1aqw h ASP 157 Cb 0.07 -0.21 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 1aqw h ASP 157 CO -0.12 0.74 0.35 0.25 -2.88 0.00 0.00 179.24 177.58 1aqw h LEU 158 N 0.83 0.57 -0.46 2.28 5.85 -0.70 -1.37 115.31 122.30 1aqw h LEU 158 Ca 0.20 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 1aqw h LEU 158 Cb 0.17 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1aqw h LEU 158 CO -0.02 0.40 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.32 1aqw h LEU 159 N 0.69 0.88 -0.34 2.25 3.38 -1.03 -2.14 115.31 119.00 1aqw h LEU 159 Ca 0.23 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1aqw h LEU 159 Cb 0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1aqw h LEU 159 CO -0.10 1.03 0.21 -0.07 0.09 0.00 0.00 178.44 179.60 1aqw h LEU 160 N 0.72 0.40 -1.19 1.67 3.38 -0.82 -0.67 115.31 118.80 1aqw h LEU 160 Ca 0.12 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1aqw h LEU 160 Cb 0.63 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1aqw h LEU 160 CO 0.04 0.32 -0.30 0.16 0.09 0.00 0.00 178.44 178.75 1aqw h ILE 161 N 0.45 0.79 0.00 1.22 3.07 -1.23 -2.84 117.51 118.97 1aqw h ILE 161 Ca 0.12 -1.23 -0.15 0.00 1.55 0.00 0.00 64.86 65.16 1aqw h ILE 161 Cb -0.02 1.76 -0.02 0.00 -0.27 0.00 0.00 36.82 38.28 1aqw h ILE 161 CO -0.02 0.29 -0.69 0.45 -1.05 0.00 0.00 178.15 177.12 1aqw h HIS 162 N 0.00 0.00 0.00 0.16 3.86 -0.80 -2.41 115.15 115.96 1aqw h HIS 162 Ca -0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 1aqw h HIS 162 Cb 0.74 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.20 1aqw h HIS 162 CO 0.00 0.69 -0.17 1.49 0.86 0.00 0.00 177.93 180.80 1aqw h GLU 163 N 0.00 0.00 0.25 2.45 4.57 -0.90 0.21 114.58 121.15 1aqw h GLU 163 Ca -0.01 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 57.83 1aqw h GLU 163 Cb 1.47 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 30.10 1aqw h GLU 163 CO 0.09 0.17 -1.52 0.28 -1.18 0.00 0.00 179.01 176.85 1aqw h VAL 164 N 0.00 1.23 -0.34 0.32 2.07 -1.40 -2.77 116.25 115.36 1aqw h VAL 164 Ca -0.00 -2.67 -0.13 0.00 0.82 0.00 0.00 66.70 64.73 1aqw h VAL 164 Cb 0.69 3.01 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 1aqw h VAL 164 CO 0.02 0.82 -0.28 0.25 0.02 0.00 0.00 177.57 178.40 1aqw h LEU 165 N 0.13 0.83 -6.60 2.57 5.85 -1.13 -3.39 115.31 113.58 1aqw h LEU 165 Ca -0.27 -0.45 -0.59 0.00 0.84 0.00 0.00 57.88 57.41 1aqw h LEU 165 Cb 2.16 -0.23 -0.39 0.00 0.37 0.00 0.00 40.66 42.56 1aqw h LEU 165 CO 0.26 1.11 -0.86 0.00 -0.34 0.00 0.00 178.44 178.61 1aqw s ALA 166 N -4.45 1.62 0.06 1.25 0.00 0.71 -5.10 121.76 115.86 1aqw s ALA 166 Ca -0.12 -2.44 -0.37 0.00 0.00 0.00 0.00 51.96 49.04 1aqw s ALA 166 Cb 0.10 -1.70 -0.16 0.00 0.00 0.00 0.00 23.12 21.36 1aqw s ALA 166 CO 0.84 -2.04 1.42 -2.30 0.00 0.00 0.00 175.76 173.69 1aqw n PRO 167 N 3.22 1.32 -0.78 0.00 -0.02 -1.04 -1.67 135.00 136.03 1aqw n PRO 167 Ca 0.20 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 1aqw n PRO 167 Cb 0.41 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1aqw n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aqw n GLY 168 N 2.84 0.88 0.33 -1.23 0.00 -1.26 -4.94 105.19 101.80 1aqw n GLY 168 Ca 0.19 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.37 1aqw n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aqw n LEU 170 N -3.95 0.91 0.28 0.00 4.77 -1.26 -4.16 117.00 113.59 1aqw n LEU 170 Ca 0.02 -0.21 0.11 0.00 -0.03 0.00 0.00 56.01 55.90 1aqw n LEU 170 Cb 0.32 -0.13 0.76 0.00 -2.33 0.00 0.00 43.42 42.04 1aqw n LEU 170 CO 0.29 0.17 1.08 0.44 -1.33 0.00 0.00 177.39 178.05 1aqw h ASP 171 N 1.09 0.00 1.30 -1.43 5.19 -1.56 -0.22 116.42 120.79 1aqw h ASP 171 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1aqw h ASP 171 Cb 0.48 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.99 1aqw h ASP 171 CO 0.00 0.02 -0.01 0.00 -3.12 0.00 0.00 179.24 176.13 1aqw n ALA 172 N -2.43 2.31 -3.82 3.45 0.00 -1.26 -4.50 120.51 114.26 1aqw n ALA 172 Ca -0.03 -0.05 -0.33 0.00 0.00 0.00 0.00 53.44 53.03 1aqw n ALA 172 Cb 0.10 -1.47 -0.11 0.00 0.00 0.00 0.00 19.45 17.97 1aqw n ALA 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1aqw s PHE 173 N -3.07 3.35 0.24 0.00 0.08 -0.09 -4.98 117.98 113.51 1aqw s PHE 173 Ca 0.12 -2.98 -0.05 0.00 0.12 0.00 0.00 56.93 54.15 1aqw s PHE 173 Cb 0.15 -3.01 0.43 0.00 -0.57 0.00 0.00 43.02 40.02 1aqw s PHE 173 CO 0.58 -0.77 1.75 -1.00 -0.10 0.00 0.00 175.22 175.68 1aqw h PRO 174 N 6.61 0.50 -0.42 0.24 0.13 -1.79 -0.59 132.00 136.69 1aqw h PRO 174 Ca -0.02 -0.03 -0.15 0.00 -0.87 0.00 0.00 66.00 64.93 1aqw h PRO 174 Cb 0.90 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 1aqw h PRO 174 CO 0.71 0.33 -0.31 -0.07 -0.23 0.00 0.00 178.00 178.43 1aqw h LEU 175 N 0.52 1.00 -0.52 1.56 3.38 -1.93 -1.99 115.31 117.33 1aqw h LEU 175 Ca 0.40 -0.44 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 1aqw h LEU 175 Cb 0.55 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1aqw h LEU 175 CO -0.35 1.23 -0.30 -0.07 0.09 0.00 0.00 178.44 179.03 1aqw h LEU 176 N 0.79 0.92 0.06 1.67 3.38 -1.82 -0.91 115.31 119.39 1aqw h LEU 176 Ca 0.08 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 1aqw h LEU 176 Cb 0.90 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1aqw h LEU 176 CO 0.08 1.14 -0.03 0.28 0.09 0.00 0.00 178.44 180.01 1aqw h SER 177 N 0.74 -0.07 -0.77 -0.43 0.02 -1.07 -1.42 113.55 110.56 1aqw h SER 177 Ca 0.08 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1aqw h SER 177 Cb 0.86 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.38 1aqw h SER 177 CO 0.08 -0.02 0.39 0.00 -1.14 0.00 0.00 176.83 176.13 1aqw h ALA 178 N 0.84 0.99 -0.42 3.77 0.00 -1.28 -2.25 119.26 120.91 1aqw h ALA 178 Ca -0.01 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1aqw h ALA 178 Cb 0.08 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1aqw h ALA 178 CO 0.01 0.53 0.26 -0.92 0.00 0.00 0.00 179.25 179.13 1aqw h TYR 179 N 1.07 0.49 -0.43 0.00 3.20 -0.99 -0.37 116.97 119.94 1aqw h TYR 179 Ca 0.27 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.08 1aqw h TYR 179 Cb 0.08 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.17 1aqw h TYR 179 CO 0.01 0.29 -0.02 0.28 -1.64 0.00 0.00 178.16 177.08 1aqw h VAL 180 N 0.53 1.23 -0.34 1.81 2.07 -1.10 -1.54 116.25 118.91 1aqw h VAL 180 Ca 0.16 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1aqw h VAL 180 Cb -0.01 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1aqw h VAL 180 CO -0.06 0.34 0.09 1.23 0.02 0.00 0.00 177.57 179.18 1aqw h GLY 181 N 0.95 0.58 0.89 2.17 0.00 -0.84 -1.20 103.07 105.62 1aqw h GLY 181 Ca 0.13 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1aqw h GLY 181 CO 0.02 0.33 -0.13 3.21 0.00 0.00 0.00 176.54 179.97 1aqw h ARG 182 N 0.40 -0.36 -0.84 4.80 3.08 -0.82 -2.94 114.38 117.69 1aqw h ARG 182 Ca 0.11 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1aqw h ARG 182 Cb 0.28 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1aqw h ARG 182 CO -0.00 -0.16 0.50 -0.07 -1.07 0.00 0.00 179.97 179.17 1aqw h LEU 183 N -0.48 1.02 -1.88 3.04 4.07 -1.29 -2.76 115.31 117.03 1aqw h LEU 183 Ca -0.04 -0.07 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 1aqw h LEU 183 Cb 0.36 -0.26 -0.00 0.00 1.08 0.00 0.00 40.66 41.84 1aqw h LEU 183 CO 0.06 0.80 -0.08 0.28 -1.08 0.00 0.00 178.44 178.42 1aqw h SER 184 N 1.16 0.00 1.24 -0.43 0.02 -1.22 -2.60 113.55 111.71 1aqw h SER 184 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 1aqw h SER 184 Cb -0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1aqw h SER 184 CO -0.05 0.08 -0.05 0.00 -1.14 0.00 0.00 176.83 175.66 1aqw n ALA 185 N -2.19 2.38 -1.68 3.77 0.00 -1.04 -3.80 120.51 117.95 1aqw n ALA 185 Ca -0.01 -0.08 -0.46 0.00 0.00 0.00 0.00 53.44 52.90 1aqw n ALA 185 Cb 0.25 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.22 1aqw n ALA 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1aqw n ARG 186 N -1.95 2.46 -0.17 0.00 1.74 -0.98 -4.79 116.66 112.96 1aqw n ARG 186 Ca 0.06 0.90 -0.04 0.00 -0.77 0.00 0.00 57.85 57.99 1aqw n ARG 186 Cb 0.40 -2.78 -0.04 0.00 -1.02 0.00 0.00 32.46 29.02 1aqw n ARG 186 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1aqw n PRO 187 N 6.58 -0.18 -0.29 5.56 -0.04 -1.26 0.04 135.00 145.41 1aqw n PRO 187 Ca 0.21 0.99 -0.05 0.00 -0.04 0.00 0.00 63.50 64.61 1aqw n PRO 187 Cb 0.34 -1.46 0.09 0.00 -0.04 0.00 0.00 33.50 32.42 1aqw n PRO 187 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1aqw h LYS 188 N 0.00 1.19 -0.24 0.54 6.56 -1.91 -1.43 116.57 121.28 1aqw h LYS 188 Ca 0.06 -0.19 -0.05 0.00 -1.06 0.00 0.00 60.65 59.42 1aqw h LYS 188 Cb 0.16 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 31.61 1aqw h LYS 188 CO -0.38 0.93 -0.03 1.25 -2.06 0.00 0.00 179.45 179.16 1aqw h LEU 189 N 1.17 0.45 -0.33 2.94 5.85 -1.66 -1.70 115.31 122.02 1aqw h LEU 189 Ca 0.28 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1aqw h LEU 189 Cb 0.15 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1aqw h LEU 189 CO -0.03 0.69 0.09 0.50 -0.34 0.00 0.00 178.44 179.35 1aqw h LYS 190 N 0.21 0.21 -0.64 1.25 3.64 -0.18 0.49 116.57 121.55 1aqw h LYS 190 Ca 0.07 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1aqw h LYS 190 Cb 0.47 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1aqw h LYS 190 CO 0.02 0.14 0.40 0.00 -2.27 0.00 0.00 179.45 177.74 1aqw h ALA 191 N 1.23 0.82 -0.46 5.00 0.00 -1.20 -2.19 119.26 122.46 1aqw h ALA 191 Ca 0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1aqw h ALA 191 Cb 0.15 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1aqw h ALA 191 CO -0.18 0.28 0.16 0.35 0.00 0.00 0.00 179.25 179.86 1aqw h PHE 192 N 0.87 0.73 0.00 0.00 3.57 -0.73 -1.99 116.94 119.40 1aqw h PHE 192 Ca 0.23 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1aqw h PHE 192 Cb -0.05 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1aqw h PHE 192 CO -0.02 0.65 0.00 -0.07 -2.23 0.00 0.00 178.31 176.64 1aqw h LEU 193 N 0.61 0.00 0.00 0.59 3.38 -0.58 -2.01 115.31 117.30 1aqw h LEU 193 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1aqw h LEU 193 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1aqw h LEU 193 CO -0.01 0.00 -0.74 0.00 0.09 0.00 0.00 178.44 177.78 1aqw n ALA 194 N -2.06 4.13 -1.77 1.53 0.00 -0.85 -4.44 120.51 117.05 1aqw n ALA 194 Ca -0.00 -0.47 -0.32 0.00 0.00 0.00 0.00 53.44 52.65 1aqw n ALA 194 Cb 0.23 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1aqw n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1aqw s SER 195 N -3.00 6.13 0.29 0.00 1.04 -0.76 -4.84 113.70 112.56 1aqw s SER 195 Ca 0.10 1.59 -0.01 0.00 0.48 0.00 0.00 55.95 58.10 1aqw s SER 195 Cb 0.17 -2.50 0.45 0.00 0.10 0.00 0.00 66.02 64.24 1aqw s SER 195 CO 0.78 -0.93 1.94 -0.65 0.98 0.00 0.00 173.24 175.36 1aqw h PRO 196 N 0.20 1.09 0.00 4.02 0.11 -1.92 0.21 132.00 135.71 1aqw h PRO 196 Ca -0.46 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1aqw h PRO 196 Cb 1.20 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1aqw h PRO 196 CO 0.60 0.72 -0.00 1.05 -0.21 0.00 0.00 178.00 180.16 1aqw h GLU 197 N 1.12 0.00 0.00 1.05 4.11 -1.93 0.11 114.58 119.04 1aqw h GLU 197 Ca 0.35 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.72 1aqw h GLU 197 Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1aqw h GLU 197 CO -0.11 0.00 -1.17 0.98 0.07 0.00 0.00 179.01 178.79 1aqw n TYR 198 N -3.12 0.00 -0.07 2.06 9.36 -0.86 -4.58 117.16 119.95 1aqw n TYR 198 Ca -0.02 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.32 1aqw n TYR 198 Cb 0.12 -0.55 0.51 0.00 -0.63 0.00 0.00 39.34 38.80 1aqw n TYR 198 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1aqw h VAL 199 N -0.95 0.90 -0.23 2.97 2.07 -0.94 -2.46 116.25 117.61 1aqw h VAL 199 Ca -0.10 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1aqw h VAL 199 Cb 1.05 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1aqw h VAL 199 CO -0.06 0.07 0.00 0.59 0.02 0.00 0.00 177.57 178.19 1aqw n ASN 200 N -4.47 1.61 -4.82 0.57 3.02 0.37 -4.81 115.26 106.73 1aqw n ASN 200 Ca 0.09 -1.84 -0.36 0.00 -0.03 0.00 0.00 54.58 52.44 1aqw n ASN 200 Cb 0.36 -0.15 -0.07 0.00 -0.61 0.00 0.00 39.78 39.30 1aqw n ASN 200 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1aqw s LEU 201 N -1.29 4.14 0.56 3.41 1.43 -0.93 -5.06 118.68 120.94 1aqw s LEU 201 Ca 0.27 0.37 -0.18 0.00 -1.03 0.00 0.00 54.13 53.56 1aqw s LEU 201 Cb 0.14 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1aqw s LEU 201 CO 0.20 0.40 1.07 -2.16 0.23 0.00 0.00 176.35 176.09 1aqw s PRO 202 N -0.96 3.43 0.10 1.29 0.04 -1.26 -4.70 135.00 132.93 1aqw s PRO 202 Ca 0.14 1.34 -0.20 0.00 0.04 0.00 0.00 61.00 62.32 1aqw s PRO 202 Cb -0.12 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 1aqw s PRO 202 CO 0.03 -0.74 1.68 0.82 0.04 0.00 0.00 177.00 178.84 1aqw h ILE 203 N 0.88 1.11 -2.78 0.56 2.04 -1.96 -0.37 117.51 117.00 1aqw h ILE 203 Ca -0.48 -0.32 -0.54 0.00 1.00 0.00 0.00 64.86 64.52 1aqw h ILE 203 Cb 1.23 1.00 -0.15 0.00 -0.74 0.00 0.00 36.82 38.16 1aqw h ILE 203 CO 0.57 0.11 -0.76 0.20 0.00 0.00 0.00 178.15 178.27 1aqw s ASN 204 N -5.49 3.01 0.33 1.72 0.02 -1.26 -0.35 114.94 112.93 1aqw s ASN 204 Ca -0.13 -0.97 0.12 0.00 -1.02 0.00 0.00 52.86 50.85 1aqw s ASN 204 Cb 0.07 -0.21 0.57 0.00 0.02 0.00 0.00 41.25 41.71 1aqw s ASN 204 CO 0.70 -0.04 1.73 1.23 0.02 0.00 0.00 177.10 180.74 1aqw h GLY 205 N 2.68 0.00 -0.63 0.66 0.00 -1.90 -3.17 103.07 100.71 1aqw h GLY 205 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1aqw h GLY 205 CO 0.57 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.27 1aqw n ASN 206 N -3.94 0.91 -0.07 0.19 6.94 -1.26 -4.89 115.26 113.13 1aqw n ASN 206 Ca -0.01 -2.01 -0.01 0.00 -0.02 0.00 0.00 54.58 52.53 1aqw n ASN 206 Cb 0.50 -0.13 -0.00 0.00 -2.36 0.00 0.00 39.78 37.79 1aqw n ASN 206 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1aqw n GLY 207 N 0.72 0.39 3.74 4.83 0.00 -1.20 -5.02 105.19 108.66 1aqw n GLY 207 Ca 0.05 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1aqw n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aqw s LYS 208 N -0.99 2.72 0.00 1.61 1.02 -1.26 -5.04 119.74 117.80 1aqw s LYS 208 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.16 1aqw s LYS 208 Cb 0.00 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 1aqw s LYS 208 CO 0.00 0.52 0.00 0.00 -0.92 0.00 0.00 175.35 174.95