#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hjo s PRO 2 N 0.00 2.39 -0.15 0.52 0.04 -1.26 -3.75 135.00 132.79 3hjo s PRO 2 Ca 0.00 1.35 -0.07 0.00 0.04 0.00 0.00 61.00 62.32 3hjo s PRO 2 Cb 0.00 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 3hjo s PRO 2 CO 0.00 -1.56 0.08 0.71 0.04 0.00 0.00 177.00 176.27 3hjo s TYR 3 N -2.55 3.36 -0.06 0.56 2.02 -1.26 -1.40 117.35 118.02 3hjo s TYR 3 Ca 0.65 0.27 0.02 0.00 -0.37 0.00 0.00 57.07 57.65 3hjo s TYR 3 Cb -0.20 -2.00 0.01 0.00 -0.40 0.00 0.00 41.96 39.37 3hjo s TYR 3 CO 0.49 0.41 -0.12 0.99 -1.57 0.00 0.00 175.55 175.74 3hjo s THR 4 N -0.28 1.12 -0.26 -0.71 2.01 -0.33 -0.64 115.64 116.54 3hjo s THR 4 Ca 0.09 -0.48 -0.08 0.00 0.31 0.00 0.00 61.69 61.53 3hjo s THR 4 Cb -0.12 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.35 3hjo s THR 4 CO 0.01 0.35 0.09 -0.69 -0.69 0.00 0.00 174.62 173.69 3hjo s VAL 5 N 0.56 4.47 -0.28 3.82 1.01 0.44 -1.49 120.40 128.92 3hjo s VAL 5 Ca -0.12 -0.15 -0.06 0.00 0.00 0.00 0.00 61.98 61.65 3hjo s VAL 5 Cb -0.15 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.13 3hjo s VAL 5 CO 0.03 0.30 0.05 -0.69 0.00 0.00 0.00 175.10 174.79 3hjo s VAL 6 N 1.63 3.79 0.18 2.92 1.01 -0.04 0.35 120.40 130.25 3hjo s VAL 6 Ca 0.06 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.12 3hjo s VAL 6 Cb -0.15 -2.93 0.05 0.00 0.00 0.00 0.00 36.38 33.35 3hjo s VAL 6 CO 0.05 0.14 0.72 -0.47 0.00 0.00 0.00 175.10 175.54 3hjo s TYR 7 N 1.48 -0.34 0.81 5.22 5.04 -0.92 -1.53 117.35 127.11 3hjo s TYR 7 Ca 0.03 0.04 -0.13 0.00 -2.44 0.00 0.00 57.07 54.57 3hjo s TYR 7 Cb -0.17 0.62 0.08 0.00 0.35 0.00 0.00 41.96 42.85 3hjo s TYR 7 CO 0.01 -0.95 1.18 -0.06 -1.34 0.00 0.00 175.55 174.39 3hjo s PHE 8 N -3.68 1.91 -0.94 4.97 0.08 -1.26 -1.25 117.98 117.81 3hjo s PHE 8 Ca 0.06 1.68 -0.10 0.00 0.12 0.00 0.00 56.93 58.69 3hjo s PHE 8 Cb -0.03 -3.40 -0.07 0.00 -0.57 0.00 0.00 43.02 38.95 3hjo s PHE 8 CO -0.03 -2.65 2.11 -0.35 -0.10 0.00 0.00 175.22 174.20 3hjo n PRO 9 N -3.40 2.06 -3.93 0.24 -0.04 -1.26 -4.80 135.00 123.88 3hjo n PRO 9 Ca 0.13 -1.62 -0.09 0.00 -0.04 0.00 0.00 63.50 61.87 3hjo n PRO 9 Cb 0.51 -2.60 -0.07 0.00 -0.04 0.00 0.00 33.50 31.30 3hjo n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3hjo s VAL 10 N 3.69 0.08 -0.04 0.52 -7.23 -1.26 -4.41 120.40 111.75 3hjo s VAL 10 Ca 0.45 -1.32 -0.08 0.00 -1.81 0.00 0.00 61.98 59.22 3hjo s VAL 10 Cb 0.12 -1.75 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 3hjo s VAL 10 CO -0.00 -0.34 0.44 0.03 -0.31 0.00 0.00 175.10 174.91 3hjo h ARG 11 N 2.56 -0.29 0.00 4.82 3.08 -0.88 -3.46 114.38 120.21 3hjo h ARG 11 Ca -0.32 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.75 3hjo h ARG 11 Cb 1.23 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3hjo h ARG 11 CO 0.49 -0.20 0.00 0.41 -1.07 0.00 0.00 179.97 179.60 3hjo n GLY 12 N 0.81 2.49 0.08 0.04 0.00 0.48 -1.91 105.19 107.19 3hjo n GLY 12 Ca -0.04 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 45.99 3hjo n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hjo n ARG 13 N 14.00 1.10 0.00 1.61 1.74 -1.26 -3.08 116.66 130.77 3hjo n ARG 13 Ca 0.00 -0.15 0.09 0.00 -0.77 0.00 0.00 57.85 57.02 3hjo n ARG 13 Cb 0.00 -1.41 -0.10 0.00 -1.02 0.00 0.00 32.46 29.93 3hjo n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hjo h ALA 15 N 2.57 0.35 -0.29 0.00 0.00 -1.32 -1.53 119.26 119.04 3hjo h ALA 15 Ca 0.00 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3hjo h ALA 15 Cb 0.43 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hjo h ALA 15 CO 0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 179.25 178.80 3hjo h ALA 16 N 1.36 0.39 0.00 0.00 0.00 -1.82 -1.67 119.26 117.52 3hjo h ALA 16 Ca 0.20 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 3hjo h ALA 16 Cb 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hjo h ALA 16 CO -0.35 0.18 -0.41 1.37 0.00 0.00 0.00 179.25 180.05 3hjo h LEU 17 N 0.31 0.00 -0.20 0.00 8.10 -1.80 -0.75 115.31 120.96 3hjo h LEU 17 Ca 0.08 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.99 3hjo h LEU 17 Cb 0.50 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.72 3hjo h LEU 17 CO 0.02 0.41 -0.17 0.03 -4.11 0.00 0.00 178.44 174.62 3hjo h ARG 18 N 0.00 0.48 -0.76 0.17 3.08 -1.17 -1.19 114.38 114.98 3hjo h ARG 18 Ca -0.00 -0.24 0.03 0.00 0.07 0.00 0.00 59.98 59.84 3hjo h ARG 18 Cb 0.77 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.78 3hjo h ARG 18 CO 0.05 0.80 0.48 0.52 -1.07 0.00 0.00 179.97 180.76 3hjo h MET 19 N 0.16 0.91 0.11 0.04 2.86 -0.97 -1.00 114.93 117.04 3hjo h MET 19 Ca 0.04 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3hjo h MET 19 Cb 0.70 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 3hjo h MET 19 CO 0.04 0.60 -0.15 1.25 1.06 0.00 0.00 176.91 179.72 3hjo h LEU 20 N 0.94 -0.39 -0.27 1.22 6.46 -1.06 -0.08 115.31 122.13 3hjo h LEU 20 Ca 0.30 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 58.10 3hjo h LEU 20 Cb 0.02 0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.08 3hjo h LEU 20 CO -0.11 -0.22 0.14 -0.07 -0.62 0.00 0.00 178.44 177.57 3hjo h LEU 21 N -0.30 0.34 -0.53 2.25 3.38 -0.90 -1.43 115.31 118.13 3hjo h LEU 21 Ca 0.01 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.91 3hjo h LEU 21 Cb 0.30 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3hjo h LEU 21 CO -0.06 0.34 0.32 0.00 0.09 0.00 0.00 178.44 179.13 3hjo h ALA 22 N 1.02 0.68 -0.24 1.53 0.00 -1.07 -0.23 119.26 120.94 3hjo h ALA 22 Ca 0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3hjo h ALA 22 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3hjo h ALA 22 CO -0.01 0.04 -0.19 0.22 0.00 0.00 0.00 179.25 179.30 3hjo h ASP 23 N 0.64 0.42 -0.08 0.00 3.58 -0.81 -2.37 116.42 117.80 3hjo h ASP 23 Ca 0.21 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.54 3hjo h ASP 23 Cb 0.01 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 40.95 3hjo h ASP 23 CO -0.09 0.63 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 3hjo n GLN 24 N -4.17 1.25 -1.54 0.28 1.13 -0.56 -4.80 117.38 108.97 3hjo n GLN 24 Ca -0.00 -0.38 -0.11 0.00 -1.94 0.00 0.00 57.00 54.57 3hjo n GLN 24 Cb 0.36 -1.21 -0.03 0.00 0.11 0.00 0.00 30.24 29.46 3hjo n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hjo n GLY 25 N 0.79 0.87 3.84 1.08 0.00 -0.89 -5.02 105.19 105.86 3hjo n GLY 25 Ca 0.09 -0.52 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 3hjo n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hjo s GLN 26 N -3.33 4.00 0.23 1.61 -1.52 -0.12 -5.03 119.66 115.50 3hjo s GLN 26 Ca 0.00 0.52 0.06 0.00 -1.95 0.00 0.00 55.36 53.99 3hjo s GLN 26 Cb 0.00 -2.87 -0.03 0.00 -0.22 0.00 0.00 33.01 29.89 3hjo s GLN 26 CO 0.00 0.43 0.25 -1.54 -0.25 0.00 0.00 175.29 174.18 3hjo s SER 27 N -1.81 5.84 0.08 5.90 1.04 -1.26 -4.29 113.70 119.19 3hjo s SER 27 Ca 0.40 -0.10 -0.23 0.00 0.48 0.00 0.00 55.95 56.50 3hjo s SER 27 Cb -0.15 -1.59 0.06 0.00 0.10 0.00 0.00 66.02 64.44 3hjo s SER 27 CO 0.20 -0.03 0.56 -1.66 0.98 0.00 0.00 173.24 173.28 3hjo s TRP 28 N -2.02 -0.47 0.02 5.02 -2.14 -1.26 -4.34 118.94 113.76 3hjo s TRP 28 Ca 0.33 0.47 -0.16 0.00 2.66 0.00 0.00 56.10 59.40 3hjo s TRP 28 Cb -0.09 0.41 -0.06 0.00 -3.10 0.00 0.00 33.47 30.64 3hjo s TRP 28 CO 0.26 -0.71 0.45 0.21 -2.66 0.00 0.00 176.95 174.51 3hjo s LYS 29 N -2.81 3.98 -0.34 3.25 2.20 0.18 -4.98 119.74 121.23 3hjo s LYS 29 Ca -0.03 0.49 -0.14 0.00 -0.36 0.00 0.00 55.97 55.93 3hjo s LYS 29 Cb -0.00 -3.21 -0.02 0.00 -1.51 0.00 0.00 37.83 33.09 3hjo s LYS 29 CO -0.05 0.67 0.28 -1.21 -0.36 0.00 0.00 175.35 174.69 3hjo s GLU 30 N -1.13 3.54 -0.36 4.03 0.41 -1.26 -0.42 118.70 123.51 3hjo s GLU 30 Ca 0.26 -0.55 -0.12 0.00 -0.41 0.00 0.00 54.97 54.15 3hjo s GLU 30 Cb -0.17 -3.80 0.01 0.00 -1.78 0.00 0.00 34.13 28.38 3hjo s GLU 30 CO 0.15 -0.46 0.21 -2.00 -0.49 0.00 0.00 175.26 172.68 3hjo s GLU 31 N 1.82 3.14 -0.10 1.61 2.56 0.15 -4.96 118.70 122.93 3hjo s GLU 31 Ca 0.08 -0.87 -0.20 0.00 0.00 0.00 0.00 54.97 53.97 3hjo s GLU 31 Cb -0.17 -3.74 -0.04 0.00 2.00 0.00 0.00 34.13 32.18 3hjo s GLU 31 CO 0.11 -0.57 0.57 0.08 -0.56 0.00 0.00 175.26 174.88 3hjo s VAL 32 N 1.63 5.13 -0.24 3.70 1.01 -1.26 -2.16 120.40 128.21 3hjo s VAL 32 Ca 0.04 1.15 -0.06 0.00 0.00 0.00 0.00 61.98 63.11 3hjo s VAL 32 Cb -0.18 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 3hjo s VAL 32 CO 0.08 0.29 0.02 -0.69 0.00 0.00 0.00 175.10 174.79 3hjo s VAL 33 N 0.77 3.87 0.68 2.92 1.01 -0.38 -4.95 120.40 124.32 3hjo s VAL 33 Ca 0.30 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 3hjo s VAL 33 Cb -0.16 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 3hjo s VAL 33 CO 0.13 0.38 1.08 0.42 0.00 0.00 0.00 175.10 177.11 3hjo s THR 34 N 1.55 3.81 0.24 3.92 -4.23 -1.26 -4.07 115.64 115.61 3hjo s THR 34 Ca 0.06 0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 61.10 3hjo s THR 34 Cb -0.15 -3.58 0.22 0.00 1.34 0.00 0.00 72.50 70.34 3hjo s THR 34 CO 0.00 -0.76 1.86 0.58 -0.54 0.00 0.00 174.62 175.76 3hjo h VAL 35 N -0.56 1.07 -0.30 2.29 2.07 -1.99 -1.38 116.25 117.45 3hjo h VAL 35 Ca -0.45 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 3hjo h VAL 35 Cb 1.24 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 3hjo h VAL 35 CO 0.63 0.19 0.15 -0.08 0.02 0.00 0.00 177.57 178.48 3hjo h GLU 36 N 1.03 0.42 -0.57 1.57 4.81 -1.99 -0.45 114.58 119.41 3hjo h GLU 36 Ca 0.38 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.51 3hjo h GLU 36 Cb 0.14 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3hjo h GLU 36 CO -0.16 0.39 0.21 1.15 -0.73 0.00 0.00 179.01 179.86 3hjo h THR 37 N 0.35 1.23 0.05 0.32 2.02 -1.88 -2.90 112.91 112.11 3hjo h THR 37 Ca 0.10 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.53 3hjo h THR 37 Cb 0.10 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 3hjo h THR 37 CO -0.01 0.29 -0.04 -0.25 0.37 0.00 0.00 175.52 175.87 3hjo h TRP 38 N 0.79 -0.10 -0.06 3.16 2.91 -1.11 -2.58 115.95 118.96 3hjo h TRP 38 Ca 0.19 -0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.23 3hjo h TRP 38 Cb 0.24 0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 28.93 3hjo h TRP 38 CO 0.01 -0.07 0.20 1.96 -1.03 0.00 0.00 178.44 179.51 3hjo h GLN 39 N -0.10 0.00 0.00 2.65 4.20 -1.02 -1.36 115.11 119.48 3hjo h GLN 39 Ca -0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3hjo h GLN 39 Cb 0.09 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3hjo h GLN 39 CO -0.00 0.00 -0.32 1.49 -0.67 0.00 0.00 178.83 179.32 3hjo h GLU 40 N 0.00 0.00 0.00 1.46 4.22 -1.25 -3.48 114.58 115.54 3hjo h GLU 40 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.47 3hjo h GLU 40 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3hjo h GLU 40 CO -0.00 0.32 0.00 0.41 -2.18 0.00 0.00 179.01 177.56 3hjo n GLY 41 N -0.16 3.11 0.09 1.92 0.00 -0.52 -4.95 105.19 104.69 3hjo n GLY 41 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 3hjo n GLY 41 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3hjo h SER 42 N 0.04 -0.11 -0.21 1.61 0.02 -1.84 -1.76 113.55 111.31 3hjo h SER 42 Ca 0.00 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 3hjo h SER 42 Cb 0.00 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3hjo h SER 42 CO 0.00 0.03 0.09 0.25 -1.14 0.00 0.00 176.83 176.06 3hjo h LEU 43 N -0.25 0.28 -0.57 5.07 5.85 -1.89 -2.67 115.31 121.13 3hjo h LEU 43 Ca -0.01 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.62 3hjo h LEU 43 Cb 0.21 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 3hjo h LEU 43 CO 0.02 0.35 0.26 0.50 -0.34 0.00 0.00 178.44 179.23 3hjo h LYS 44 N 0.19 0.48 0.00 1.25 3.64 -1.83 0.11 116.57 120.40 3hjo h LYS 44 Ca 0.07 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3hjo h LYS 44 Cb 0.15 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 3hjo h LYS 44 CO -0.01 0.31 -0.06 0.00 -2.27 0.00 0.00 179.45 177.43 3hjo h ALA 45 N 1.34 1.38 0.00 5.00 0.00 -1.26 -1.76 119.26 123.96 3hjo h ALA 45 Ca 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hjo h ALA 45 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hjo h ALA 45 CO -0.22 0.07 -0.36 -1.13 0.00 0.00 0.00 179.25 177.62 3hjo n SER 46 N -3.71 0.62 -4.74 0.00 3.41 -0.03 -4.87 113.62 104.30 3hjo n SER 46 Ca -0.02 0.24 -0.41 0.00 -0.26 0.00 0.00 58.87 58.42 3hjo n SER 46 Cb 0.16 -0.18 -0.05 0.00 -0.26 0.00 0.00 64.21 63.89 3hjo n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hjo h LEU 48 N 5.58 -0.54 -3.19 0.00 5.85 -1.88 -1.46 115.31 119.66 3hjo h LEU 48 Ca -0.43 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.47 3hjo h LEU 48 Cb 1.21 0.37 0.00 0.00 0.37 0.00 0.00 40.66 42.61 3hjo h LEU 48 CO 0.71 -0.19 0.00 -1.22 -0.34 0.00 0.00 178.44 177.40 3hjo n TYR 49 N -5.41 1.05 -1.21 1.25 4.01 -1.26 -4.95 117.16 110.64 3hjo n TYR 49 Ca 0.07 -0.73 -0.07 0.00 -0.16 0.00 0.00 57.90 57.01 3hjo n TYR 49 Cb 0.32 -0.26 -0.03 0.00 -0.31 0.00 0.00 39.34 39.06 3hjo n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hjo n GLY 50 N 0.10 0.92 3.13 2.72 0.00 -0.55 -4.99 105.19 106.52 3hjo n GLY 50 Ca 0.21 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 3hjo n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hjo s GLN 51 N -2.52 0.79 0.22 1.61 -0.21 -1.26 -4.91 119.66 113.39 3hjo s GLN 51 Ca 0.00 -1.34 0.08 0.00 0.02 0.00 0.00 55.36 54.12 3hjo s GLN 51 Cb 0.00 0.16 -0.04 0.00 1.00 0.00 0.00 33.01 34.12 3hjo s GLN 51 CO 0.00 -0.17 0.03 -0.51 -2.12 0.00 0.00 175.29 172.53 3hjo s LEU 52 N -3.00 3.36 0.64 2.90 1.43 -1.26 -4.58 118.68 118.17 3hjo s LEU 52 Ca 0.16 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 52.64 3hjo s LEU 52 Cb 0.07 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 3hjo s LEU 52 CO -0.04 0.03 1.10 -2.16 0.23 0.00 0.00 176.35 175.51 3hjo s PRO 53 N -3.39 2.94 -0.01 1.29 0.04 -1.26 -4.98 135.00 129.64 3hjo s PRO 53 Ca 0.30 1.34 0.06 0.00 0.04 0.00 0.00 61.00 62.74 3hjo s PRO 53 Cb -0.08 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 3hjo s PRO 53 CO 0.20 -1.13 -0.20 0.21 0.04 0.00 0.00 177.00 176.12 3hjo s LYS 54 N -4.09 2.20 -0.04 4.56 2.20 -0.58 -3.83 119.74 120.17 3hjo s LYS 54 Ca 0.66 -0.88 0.02 0.00 -0.36 0.00 0.00 55.97 55.41 3hjo s LYS 54 Cb -0.19 -2.18 0.01 0.00 -1.51 0.00 0.00 37.83 33.96 3hjo s LYS 54 CO 0.40 0.57 -0.07 0.12 -0.36 0.00 0.00 175.35 176.01 3hjo s PHE 55 N -0.75 0.90 -0.16 4.03 5.36 0.25 -0.86 117.98 126.75 3hjo s PHE 55 Ca 0.12 -0.26 -0.05 0.00 -0.96 0.00 0.00 56.93 55.78 3hjo s PHE 55 Cb -0.10 -0.71 -0.03 0.00 -0.34 0.00 0.00 43.02 41.84 3hjo s PHE 55 CO 0.01 -0.17 -0.01 -0.65 -1.46 0.00 0.00 175.22 172.95 3hjo s GLN 56 N 0.60 3.74 -0.49 10.12 -1.52 -0.55 0.11 119.66 131.67 3hjo s GLN 56 Ca -0.09 -0.46 0.03 0.00 -1.95 0.00 0.00 55.36 52.89 3hjo s GLN 56 Cb -0.12 -3.00 0.13 0.00 -0.22 0.00 0.00 33.01 29.79 3hjo s GLN 56 CO 0.01 0.27 0.24 0.34 -0.25 0.00 0.00 175.29 175.91 3hjo s ASP 57 N 0.31 4.14 1.77 5.90 -1.08 0.12 -1.19 116.67 126.63 3hjo s ASP 57 Ca -0.01 -2.86 0.00 0.00 -0.52 0.00 0.00 52.55 49.15 3hjo s ASP 57 Cb -0.13 -1.46 0.00 0.00 -1.46 0.00 0.00 42.92 39.86 3hjo s ASP 57 CO 0.02 -0.25 0.00 0.61 0.52 0.00 0.00 175.17 176.07 3hjo n GLY 58 N 3.28 3.40 1.31 2.66 0.00 -0.50 -1.32 105.19 114.02 3hjo n GLY 58 Ca 0.06 0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.24 3hjo n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hjo n ASP 59 N 9.52 3.81 -4.61 1.61 3.85 -1.26 -4.87 116.55 124.60 3hjo n ASP 59 Ca 0.00 -2.14 -0.38 0.00 -0.71 0.00 0.00 54.79 51.56 3hjo n ASP 59 Cb 0.00 -0.48 -0.10 0.00 -1.35 0.00 0.00 41.12 39.19 3hjo n ASP 59 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 3hjo s LEU 60 N -1.25 4.04 -0.23 -2.12 2.96 -0.44 -5.06 118.68 116.59 3hjo s LEU 60 Ca 0.45 0.16 -0.10 0.00 -0.22 0.00 0.00 54.13 54.42 3hjo s LEU 60 Cb 0.25 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 3hjo s LEU 60 CO 0.27 -0.10 0.14 -0.89 -1.32 0.00 0.00 176.35 174.45 3hjo s THR 61 N 1.82 5.19 0.13 3.68 2.01 -1.26 -0.71 115.64 126.50 3hjo s THR 61 Ca 0.11 0.12 0.10 0.00 0.31 0.00 0.00 61.69 62.33 3hjo s THR 61 Cb -0.16 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 3hjo s THR 61 CO 0.10 0.36 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.41 3hjo s LEU 62 N 1.02 2.55 0.25 4.42 1.43 0.12 -4.98 118.68 123.48 3hjo s LEU 62 Ca 0.07 -0.66 0.08 0.00 -1.03 0.00 0.00 54.13 52.59 3hjo s LEU 62 Cb -0.14 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.64 3hjo s LEU 62 CO 0.04 0.17 -0.12 -0.31 0.23 0.00 0.00 176.35 176.36 3hjo s TYR 63 N -1.19 1.94 0.00 0.29 2.02 -1.26 -0.58 117.35 118.56 3hjo s TYR 63 Ca 0.17 -0.58 0.00 0.00 -0.37 0.00 0.00 57.07 56.29 3hjo s TYR 63 Cb -0.10 -0.98 0.00 0.00 -0.40 0.00 0.00 41.96 40.48 3hjo s TYR 63 CO 0.09 0.40 0.00 1.04 -1.57 0.00 0.00 175.55 175.51 3hjo n GLN 64 N -0.52 0.00 -0.29 -0.62 1.13 -1.25 -4.64 117.38 111.19 3hjo n GLN 64 Ca -0.06 0.26 0.03 0.00 -1.94 0.00 0.00 57.00 55.29 3hjo n GLN 64 Cb 0.62 -0.18 0.17 0.00 0.11 0.00 0.00 30.24 30.95 3hjo n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3hjo h SER 65 N 0.00 0.66 0.85 1.08 4.64 -1.88 -0.58 113.55 118.32 3hjo h SER 65 Ca 0.00 0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.24 3hjo h SER 65 Cb 0.00 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 3hjo h SER 65 CO 0.00 0.37 -0.62 0.78 -0.87 0.00 0.00 176.83 176.49 3hjo h ASN 66 N 0.78 0.00 -0.46 4.97 -0.26 -1.92 -1.52 115.58 117.17 3hjo h ASN 66 Ca 0.40 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 56.14 3hjo h ASN 66 Cb 0.38 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.62 3hjo h ASN 66 CO -0.26 0.62 0.27 0.74 -1.06 0.00 0.00 177.43 177.75 3hjo h THR 67 N 0.00 1.15 -0.30 2.81 2.02 -1.50 -0.78 112.91 116.31 3hjo h THR 67 Ca -0.01 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 3hjo h THR 67 Cb 1.21 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 3hjo h THR 67 CO 0.08 0.15 0.16 0.40 0.37 0.00 0.00 175.52 176.68 3hjo h ILE 68 N 0.61 1.13 -0.27 3.11 2.04 -0.88 0.22 117.51 123.48 3hjo h ILE 68 Ca 0.16 -0.35 0.04 0.00 1.00 0.00 0.00 64.86 65.72 3hjo h ILE 68 Cb 0.01 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 3hjo h ILE 68 CO -0.03 0.13 0.02 -0.07 0.00 0.00 0.00 178.15 178.21 3hjo h LEU 69 N 0.36 -0.05 -1.09 1.44 3.38 -1.21 0.03 115.31 118.18 3hjo h LEU 69 Ca 0.10 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 3hjo h LEU 69 Cb 0.07 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3hjo h LEU 69 CO -0.02 0.01 -0.09 0.03 0.09 0.00 0.00 178.44 178.46 3hjo h ARG 70 N 0.11 0.54 0.03 1.13 3.08 -0.97 0.25 114.38 118.55 3hjo h ARG 70 Ca 0.13 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3hjo h ARG 70 Cb 0.15 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hjo h ARG 70 CO -0.19 0.63 -0.02 1.25 -1.07 0.00 0.00 179.97 180.57 3hjo h HIS 71 N 0.50 -0.04 -0.67 3.04 2.76 -0.63 0.17 115.15 120.29 3hjo h HIS 71 Ca 0.10 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.20 3hjo h HIS 71 Cb 0.47 0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.41 3hjo h HIS 71 CO 0.02 0.21 0.16 -0.07 -1.30 0.00 0.00 177.93 176.95 3hjo h LEU 72 N -0.29 1.00 -0.45 0.26 3.38 -0.86 0.72 115.31 119.07 3hjo h LEU 72 Ca -0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3hjo h LEU 72 Cb 0.27 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3hjo h LEU 72 CO 0.01 0.96 0.30 1.23 0.09 0.00 0.00 178.44 181.02 3hjo h GLY 73 N 1.07 0.63 0.73 0.83 0.00 -0.32 -0.02 103.07 105.99 3hjo h GLY 73 Ca 0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 3hjo h GLY 73 CO 0.00 0.23 -0.02 -0.09 0.00 0.00 0.00 176.54 176.66 3hjo h ARG 74 N 0.61 -0.06 0.00 4.80 2.43 -0.43 0.63 114.38 122.36 3hjo h ARG 74 Ca 0.17 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.20 3hjo h ARG 74 Cb -0.07 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 3hjo h ARG 74 CO -0.04 0.21 -0.65 1.79 -1.51 0.00 0.00 179.97 179.78 3hjo h THR 75 N -0.33 1.29 -0.08 0.20 1.35 -0.76 -3.23 112.91 111.36 3hjo h THR 75 Ca -0.01 -2.35 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 3hjo h THR 75 Cb 0.30 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 3hjo h THR 75 CO 0.01 0.63 0.00 0.18 -0.25 0.00 0.00 175.52 176.09 3hjo n LEU 76 N -3.53 3.03 -1.92 3.87 4.77 -0.03 -5.00 117.00 118.20 3hjo n LEU 76 Ca -0.00 -1.07 -0.06 0.00 -0.03 0.00 0.00 56.01 54.85 3hjo n LEU 76 Cb 0.70 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.79 3hjo n LEU 76 CO 0.42 0.53 0.04 0.61 -1.33 0.00 0.00 177.39 177.66 3hjo n GLY 77 N 1.35 0.14 2.44 -0.72 0.00 -0.69 -4.99 105.19 102.71 3hjo n GLY 77 Ca 0.14 -0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 3hjo n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hjo n LEU 78 N -2.19 4.73 -1.40 0.99 4.77 0.21 -4.77 117.00 119.33 3hjo n LEU 78 Ca -0.11 -5.17 0.04 0.00 -0.03 0.00 0.00 56.01 50.74 3hjo n LEU 78 Cb 0.56 -0.45 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 3hjo n LEU 78 CO 0.23 2.23 0.08 0.00 -1.33 0.00 0.00 177.39 178.60 3hjo n TYR 79 N -0.50 0.00 0.00 -1.77 4.19 -1.25 -1.43 117.16 116.40 3hjo n TYR 79 Ca 0.39 -0.51 0.00 0.00 3.31 0.00 0.00 57.90 61.09 3hjo n TYR 79 Cb 0.69 -0.15 0.00 0.00 0.49 0.00 0.00 39.34 40.37 3hjo n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3hjo n GLY 80 N 0.40 -1.54 0.11 2.98 0.00 -1.26 -3.69 105.19 102.19 3hjo n GLY 80 Ca 0.06 -1.53 0.09 0.00 0.00 0.00 0.00 46.02 44.64 3hjo n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3hjo n LYS 81 N -1.65 0.61 -2.60 1.61 2.85 -1.26 -4.86 118.16 112.86 3hjo n LYS 81 Ca 0.00 0.13 -0.06 0.00 -1.05 0.00 0.00 58.31 57.33 3hjo n LYS 81 Cb 0.00 -1.81 -0.00 0.00 -0.65 0.00 0.00 35.03 32.57 3hjo n LYS 81 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 3hjo n ASP 82 N -2.70 -0.91 -0.26 -5.58 5.68 -1.26 -5.04 116.55 106.47 3hjo n ASP 82 Ca -0.02 -1.89 -0.04 0.00 -0.50 0.00 0.00 54.79 52.34 3hjo n ASP 82 Cb 0.61 1.59 0.11 0.00 -1.14 0.00 0.00 41.12 42.29 3hjo n ASP 82 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 3hjo h GLN 83 N 0.00 1.13 -0.52 0.11 4.20 -1.94 0.09 115.11 118.18 3hjo h GLN 83 Ca -0.15 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.31 3hjo h GLN 83 Cb 0.61 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 3hjo h GLN 83 CO 0.20 0.90 0.09 0.37 -0.67 0.00 0.00 178.83 179.72 3hjo h GLN 84 N 1.11 0.86 -0.56 1.46 4.15 -1.98 -1.91 115.11 118.24 3hjo h GLN 84 Ca 0.26 -0.23 -0.10 0.00 0.77 0.00 0.00 58.65 59.34 3hjo h GLN 84 Cb 0.18 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 3hjo h GLN 84 CO -0.02 0.84 -0.06 0.93 -1.93 0.00 0.00 178.83 178.59 3hjo h GLU 85 N 0.74 1.02 -0.60 1.69 5.08 -1.85 -2.34 114.58 118.33 3hjo h GLU 85 Ca 0.16 -0.35 0.10 0.00 -1.00 0.00 0.00 59.36 58.26 3hjo h GLU 85 Cb 0.40 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 3hjo h GLU 85 CO 0.01 1.04 0.21 0.00 -1.00 0.00 0.00 179.01 179.26 3hjo h ALA 86 N 1.00 0.76 -0.79 3.43 0.00 -0.80 0.10 119.26 122.96 3hjo h ALA 86 Ca 0.15 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.22 3hjo h ALA 86 Cb 0.62 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 3hjo h ALA 86 CO 0.04 -0.22 0.47 0.00 0.00 0.00 0.00 179.25 179.55 3hjo h ALA 87 N 1.42 1.08 -0.51 0.00 0.00 -1.12 -1.18 119.26 118.96 3hjo h ALA 87 Ca 0.30 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 3hjo h ALA 87 Cb 0.39 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3hjo h ALA 87 CO -0.32 0.18 -0.07 -0.07 0.00 0.00 0.00 179.25 178.97 3hjo h LEU 88 N 0.85 0.95 -0.32 0.00 3.38 -0.70 -0.57 115.31 118.90 3hjo h LEU 88 Ca 0.35 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3hjo h LEU 88 Cb 0.20 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 3hjo h LEU 88 CO -0.18 1.07 0.15 0.58 0.09 0.00 0.00 178.44 180.14 3hjo h VAL 89 N 0.82 0.97 -0.72 1.22 2.07 -0.55 -1.22 116.25 118.84 3hjo h VAL 89 Ca 0.14 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.56 3hjo h VAL 89 Cb 0.62 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 3hjo h VAL 89 CO 0.04 0.06 0.47 0.44 0.02 0.00 0.00 177.57 178.60 3hjo h ASP 90 N 0.32 0.81 -0.62 0.57 3.32 -1.02 -0.69 116.42 119.12 3hjo h ASP 90 Ca 0.14 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3hjo h ASP 90 Cb 0.06 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 3hjo h ASP 90 CO -0.10 0.59 0.40 -0.03 -1.72 0.00 0.00 179.24 178.38 3hjo h MET 91 N 0.96 0.82 0.32 3.56 4.05 -0.72 0.22 114.93 124.13 3hjo h MET 91 Ca 0.26 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.62 3hjo h MET 91 Cb -0.10 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 30.52 3hjo h MET 91 CO -0.06 0.55 -0.15 0.28 0.23 0.00 0.00 176.91 177.76 3hjo h VAL 92 N 0.84 0.69 -0.99 -5.77 2.07 -1.00 -2.37 116.25 109.71 3hjo h VAL 92 Ca 0.23 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.75 3hjo h VAL 92 Cb -0.09 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 3hjo h VAL 92 CO -0.05 0.01 0.65 -1.13 0.02 0.00 0.00 177.57 177.07 3hjo h ASN 93 N -0.44 1.10 -0.58 0.57 -1.24 -0.74 -0.53 115.58 113.72 3hjo h ASN 93 Ca -0.04 -0.02 -0.08 0.00 0.71 0.00 0.00 56.30 56.87 3hjo h ASN 93 Cb 0.34 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.10 3hjo h ASN 93 CO 0.07 0.76 0.07 0.44 -1.29 0.00 0.00 177.43 177.48 3hjo h ASP 94 N 1.28 0.97 -0.65 1.15 3.32 -0.58 -0.28 116.42 121.62 3hjo h ASP 94 Ca 0.39 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 3hjo h ASP 94 Cb -0.04 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 3hjo h ASP 94 CO -0.11 0.98 0.38 1.23 -1.72 0.00 0.00 179.24 180.00 3hjo h GLY 95 N 1.02 0.95 0.97 2.75 0.00 -0.83 -1.92 103.07 106.00 3hjo h GLY 95 Ca 0.18 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 3hjo h GLY 95 CO 0.02 0.39 0.20 -2.08 0.00 0.00 0.00 176.54 175.07 3hjo h VAL 96 N 0.88 1.14 -0.86 4.60 2.07 -0.78 -2.66 116.25 120.65 3hjo h VAL 96 Ca 0.23 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.41 3hjo h VAL 96 Cb -0.01 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 3hjo h VAL 96 CO -0.04 0.15 0.56 -0.08 0.02 0.00 0.00 177.57 178.17 3hjo h GLU 97 N 0.46 1.08 -0.28 1.57 4.57 -0.89 0.38 114.58 121.48 3hjo h GLU 97 Ca 0.13 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 3hjo h GLU 97 Cb 0.05 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.39 3hjo h GLU 97 CO -0.02 0.72 0.18 -0.44 -1.18 0.00 0.00 179.01 178.27 3hjo h ASP 98 N 1.11 0.32 -0.50 1.04 3.32 -1.15 -0.52 116.42 120.05 3hjo h ASP 98 Ca 0.33 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 3hjo h ASP 98 Cb -0.06 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3hjo h ASP 98 CO -0.09 0.23 -0.16 0.25 -1.72 0.00 0.00 179.24 177.75 3hjo h LEU 99 N 0.38 1.00 -0.78 1.55 5.85 -1.22 -2.41 115.31 119.68 3hjo h LEU 99 Ca 0.10 -0.38 0.09 0.00 0.84 0.00 0.00 57.88 58.53 3hjo h LEU 99 Cb -0.04 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.64 3hjo h LEU 99 CO -0.02 1.15 0.44 -0.09 -0.34 0.00 0.00 178.44 179.58 3hjo h ARG 100 N 0.85 0.73 -0.63 1.25 2.43 -0.75 0.49 114.38 118.76 3hjo h ARG 100 Ca 0.12 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3hjo h ARG 100 Cb 0.74 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 3hjo h ARG 100 CO 0.06 0.49 0.33 0.00 -1.51 0.00 0.00 179.97 179.34 3hjo h LYS 102 N 0.87 0.68 0.00 0.00 1.57 -0.92 -0.66 116.57 118.11 3hjo h LYS 102 Ca 0.22 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3hjo h LYS 102 Cb 0.07 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3hjo h LYS 102 CO -0.03 0.54 -0.03 -0.92 -0.57 0.00 0.00 179.45 178.43 3hjo h TYR 103 N 0.65 -0.08 -0.59 -1.35 3.20 -0.67 -1.66 116.97 116.46 3hjo h TYR 103 Ca 0.17 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.05 3hjo h TYR 103 Cb 0.05 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.33 3hjo h TYR 103 CO -0.02 -0.05 0.39 0.82 -1.64 0.00 0.00 178.16 177.66 3hjo h ILE 104 N -0.06 1.16 0.00 1.81 2.04 -0.74 -0.85 117.51 120.87 3hjo h ILE 104 Ca 0.01 -0.30 0.03 0.00 1.00 0.00 0.00 64.86 65.60 3hjo h ILE 104 Cb 0.08 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 3hjo h ILE 104 CO -0.03 0.15 -0.17 -1.28 0.00 0.00 0.00 178.15 176.82 3hjo h SER 105 N 0.80 -0.49 -0.33 1.72 0.87 -1.04 0.12 113.55 115.22 3hjo h SER 105 Ca 0.22 0.07 0.04 0.00 -1.23 0.00 0.00 61.79 60.89 3hjo h SER 105 Cb -0.08 0.20 -0.08 0.00 -0.44 0.00 0.00 62.40 62.01 3hjo h SER 105 CO -0.05 -0.23 -0.55 0.25 -0.53 0.00 0.00 176.83 175.72 3hjo h LEU 106 N -0.28 -1.82 -0.42 2.23 5.85 -1.05 0.10 115.31 119.94 3hjo h LEU 106 Ca 0.05 0.23 0.05 0.00 0.84 0.00 0.00 57.88 59.06 3hjo h LEU 106 Cb 0.34 0.73 -0.05 0.00 0.37 0.00 0.00 40.66 42.06 3hjo h LEU 106 CO -0.16 -0.43 0.14 0.40 -0.34 0.00 0.00 178.44 178.05 3hjo h ILE 107 N -0.45 0.86 0.17 4.05 1.08 -0.85 -0.16 117.51 122.21 3hjo h ILE 107 Ca 0.06 -0.10 -0.35 0.00 -0.39 0.00 0.00 64.86 64.08 3hjo h ILE 107 Cb 0.62 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 3hjo h ILE 107 CO -0.55 0.05 -1.77 0.58 -0.69 0.00 0.00 178.15 175.78 3hjo h VAL 108 N 0.30 0.91 0.00 1.67 2.07 -0.66 -3.41 116.25 117.13 3hjo h VAL 108 Ca 0.19 -2.52 0.00 0.00 0.82 0.00 0.00 66.70 65.19 3hjo h VAL 108 Cb 0.19 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 3hjo h VAL 108 CO -0.20 0.86 -1.33 0.35 0.02 0.00 0.00 177.57 177.26 3hjo n THR 109 N -3.56 0.00 -2.47 2.57 -2.24 0.35 -4.87 114.28 104.06 3hjo n THR 109 Ca -0.25 -0.22 -0.03 0.00 -2.27 0.00 0.00 64.05 61.28 3hjo n THR 109 Cb 1.07 0.36 0.06 0.00 -2.10 0.00 0.00 70.33 69.71 3hjo n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3hjo n ASN 110 N -1.76 -0.97 0.27 3.42 5.15 -0.64 -5.01 115.26 115.72 3hjo n ASN 110 Ca -0.01 -2.13 -0.16 0.00 -0.60 0.00 0.00 54.58 51.68 3hjo n ASN 110 Cb 0.23 0.43 -0.08 0.00 -0.53 0.00 0.00 39.78 39.83 3hjo n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 3hjo h TYR 111 N 0.82 -0.80 0.09 1.20 3.20 -1.29 0.56 116.97 120.75 3hjo h TYR 111 Ca -0.45 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.41 3hjo h TYR 111 Cb 1.36 0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.92 3hjo h TYR 111 CO -0.05 -0.46 -0.04 0.93 -1.64 0.00 0.00 178.16 176.90 3hjo h GLU 112 N -0.74 -0.11 0.00 1.82 3.07 -1.95 -1.96 114.58 114.71 3hjo h GLU 112 Ca -0.05 0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 58.71 3hjo h GLU 112 Cb 0.61 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.53 3hjo h GLU 112 CO 0.04 0.09 -0.52 0.00 -1.40 0.00 0.00 179.01 177.21 3hjo h ALA 113 N 0.60 0.72 0.00 3.43 0.00 -1.98 -3.36 119.26 118.67 3hjo h ALA 113 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hjo h ALA 113 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3hjo h ALA 113 CO 0.02 0.66 -1.29 0.41 0.00 0.00 0.00 179.25 179.05 3hjo n GLY 114 N 0.96 -1.27 0.18 0.00 0.00 0.19 -4.57 105.19 100.68 3hjo n GLY 114 Ca 0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 3hjo n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3hjo h LYS 115 N 0.00 0.55 0.09 1.61 3.64 -1.51 -0.44 116.57 120.51 3hjo h LYS 115 Ca 0.00 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3hjo h LYS 115 Cb 0.93 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.60 3hjo h LYS 115 CO 0.00 0.42 -0.30 0.22 -2.27 0.00 0.00 179.45 177.52 3hjo h ASP 116 N 0.53 -0.88 -0.37 4.20 3.58 -1.85 0.16 116.42 121.79 3hjo h ASP 116 Ca 0.14 0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.74 3hjo h ASP 116 Cb 0.02 0.34 -0.04 0.00 1.72 0.00 0.00 39.33 41.37 3hjo h ASP 116 CO -0.03 -0.39 0.13 0.44 -2.88 0.00 0.00 179.24 176.52 3hjo h ASP 117 N -0.51 0.15 -0.19 2.28 3.32 -1.80 -1.46 116.42 118.21 3hjo h ASP 117 Ca 0.04 0.04 0.05 0.00 0.02 0.00 0.00 57.03 57.18 3hjo h ASP 117 Cb 0.55 0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.07 3hjo h ASP 117 CO -0.20 0.12 -0.15 0.22 -1.72 0.00 0.00 179.24 177.52 3hjo h TYR 118 N 0.29 -0.37 -0.55 4.55 5.03 -0.71 -1.56 116.97 123.65 3hjo h TYR 118 Ca 0.17 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.44 3hjo h TYR 118 Cb 0.14 0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.59 3hjo h TYR 118 CO -0.14 -0.22 0.10 0.28 -1.32 0.00 0.00 178.16 176.86 3hjo h VAL 119 N -0.16 1.23 -0.70 1.81 2.07 -0.45 -1.22 116.25 118.85 3hjo h VAL 119 Ca 0.11 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 3hjo h VAL 119 Cb 0.32 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3hjo h VAL 119 CO -0.28 0.33 0.43 0.11 0.02 0.00 0.00 177.57 178.17 3hjo h LYS 120 N 0.82 0.94 0.00 1.57 1.57 -0.96 -2.50 116.57 118.01 3hjo h LYS 120 Ca 0.17 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3hjo h LYS 120 Cb 0.35 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3hjo h LYS 120 CO 0.00 0.65 -0.09 0.00 -0.57 0.00 0.00 179.45 179.45 3hjo h ALA 121 N 1.51 0.94 -0.21 3.86 0.00 -0.69 -3.40 119.26 121.28 3hjo h ALA 121 Ca 0.25 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.18 3hjo h ALA 121 Cb -0.05 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3hjo h ALA 121 CO -0.05 0.00 0.09 1.25 0.00 0.00 0.00 179.25 180.54 3hjo h LEU 122 N 0.00 0.12 -0.87 0.00 5.85 -0.77 -2.79 115.31 116.86 3hjo h LEU 122 Ca 0.00 0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.87 3hjo h LEU 122 Cb 0.75 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.69 3hjo h LEU 122 CO 0.00 0.10 0.47 -0.65 -0.34 0.00 0.00 178.44 178.02 3hjo h PRO 123 N 0.20 0.67 -0.12 5.25 0.11 -1.77 0.03 132.00 136.37 3hjo h PRO 123 Ca 0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 3hjo h PRO 123 Cb 0.04 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3hjo h PRO 123 CO -0.08 0.44 -0.10 0.78 -0.21 0.00 0.00 178.00 178.84 3hjo h GLY 124 N 0.69 0.20 2.00 -0.55 0.00 -1.80 0.97 103.07 104.57 3hjo h GLY 124 Ca 0.46 -0.11 -0.17 0.00 0.00 0.00 0.00 47.33 47.51 3hjo h GLY 124 CO -0.33 0.10 -0.81 1.46 0.00 0.00 0.00 176.54 176.96 3hjo h GLN 125 N 0.18 0.00 0.12 4.80 1.08 -0.86 -3.34 115.11 117.10 3hjo h GLN 125 Ca 0.04 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.93 3hjo h GLN 125 Cb 0.29 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3hjo h GLN 125 CO 0.02 0.81 -1.53 -0.07 -0.95 0.00 0.00 178.83 177.10 3hjo h LEU 126 N 0.00 0.41 -0.93 1.46 3.38 -0.67 -3.39 115.31 115.57 3hjo h LEU 126 Ca -0.01 -0.56 0.26 0.00 0.09 0.00 0.00 57.88 57.65 3hjo h LEU 126 Cb 1.57 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 42.05 3hjo h LEU 126 CO 0.11 1.47 0.40 0.50 0.09 0.00 0.00 178.44 181.00 3hjo h LYS 127 N 0.07 0.32 -0.89 1.13 3.64 -0.94 -2.20 116.57 117.70 3hjo h LYS 127 Ca -0.24 -0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.23 3hjo h LYS 127 Cb 2.02 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 33.70 3hjo h LYS 127 CO 0.17 0.21 0.57 -1.35 -2.27 0.00 0.00 179.45 176.78 3hjo h PRO 128 N 0.33 0.78 -0.07 1.90 0.11 -1.77 -0.53 132.00 132.74 3hjo h PRO 128 Ca 0.61 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.52 3hjo h PRO 128 Cb 1.26 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3hjo h PRO 128 CO -0.59 0.51 -0.64 0.74 -0.21 0.00 0.00 178.00 177.81 3hjo h PHE 129 N 0.80 0.35 -0.20 0.65 0.04 -1.69 -0.46 116.94 116.43 3hjo h PHE 129 Ca 0.43 -0.14 -0.02 0.00 2.80 0.00 0.00 57.97 61.05 3hjo h PHE 129 Cb 0.55 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.63 3hjo h PHE 129 CO -0.00 0.83 0.06 1.49 -0.60 0.00 0.00 178.31 180.09 3hjo h GLU 130 N 0.19 0.31 -0.55 1.51 4.57 -1.34 -1.68 114.58 117.60 3hjo h GLU 130 Ca -0.01 -0.07 0.06 0.00 -1.18 0.00 0.00 59.36 58.16 3hjo h GLU 130 Cb 1.17 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.66 3hjo h GLU 130 CO 0.10 0.41 0.26 1.15 -1.18 0.00 0.00 179.01 179.75 3hjo h THR 131 N 0.15 0.92 -0.11 0.32 2.02 -0.92 0.85 112.91 116.14 3hjo h THR 131 Ca 0.07 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 67.08 3hjo h THR 131 Cb 0.23 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3hjo h THR 131 CO -0.00 0.09 0.03 -0.07 0.37 0.00 0.00 175.52 175.94 3hjo h LEU 132 N 0.50 0.03 -0.55 2.58 3.38 -0.99 -1.63 115.31 118.64 3hjo h LEU 132 Ca 0.25 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.32 3hjo h LEU 132 Cb 0.19 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 3hjo h LEU 132 CO -0.19 0.04 0.16 -0.07 0.09 0.00 0.00 178.44 178.47 3hjo h LEU 133 N 0.08 0.12 -2.10 1.67 3.38 -0.96 -2.13 115.31 115.37 3hjo h LEU 133 Ca 0.05 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.13 3hjo h LEU 133 Cb 0.03 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3hjo h LEU 133 CO -0.05 0.08 0.10 0.77 0.09 0.00 0.00 178.44 179.43 3hjo h SER 134 N 0.32 0.00 0.15 -0.43 4.64 -0.34 -0.24 113.55 117.65 3hjo h SER 134 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3hjo h SER 134 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3hjo h SER 134 CO -0.31 0.00 -0.18 0.00 -0.87 0.00 0.00 176.83 175.47 3hjo n GLN 135 N -4.30 1.14 -3.97 4.77 6.02 -0.66 -4.30 117.38 116.07 3hjo n GLN 135 Ca 0.00 -0.69 -0.31 0.00 -0.01 0.00 0.00 57.00 56.00 3hjo n GLN 135 Cb 0.22 -1.49 -0.15 0.00 1.02 0.00 0.00 30.24 29.85 3hjo n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 3hjo s ASN 136 N -2.34 4.59 -1.44 1.08 2.47 -0.62 -4.85 114.94 113.83 3hjo s ASN 136 Ca 0.28 -2.27 -0.01 0.00 0.42 0.00 0.00 52.86 51.29 3hjo s ASN 136 Cb 0.20 -1.54 0.00 0.00 -1.45 0.00 0.00 41.25 38.46 3hjo s ASN 136 CO 0.46 -0.36 0.35 0.00 -3.72 0.00 0.00 177.10 173.84 3hjo n GLN 137 N 4.10 -2.87 -1.80 0.43 6.02 -1.26 -1.45 117.38 120.55 3hjo n GLN 137 Ca 0.04 0.35 -0.14 0.00 -0.01 0.00 0.00 57.00 57.24 3hjo n GLN 137 Cb 0.40 -4.37 -0.04 0.00 1.02 0.00 0.00 30.24 27.25 3hjo n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hjo n GLY 138 N -2.08 0.62 1.76 1.08 0.00 -1.26 -2.14 105.19 103.18 3hjo n GLY 138 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3hjo n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hjo n GLY 139 N -0.48 0.55 0.04 -0.02 0.00 -0.20 -4.83 105.19 100.24 3hjo n GLY 139 Ca -0.15 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 45.86 3hjo n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hjo n LYS 140 N -2.88 0.12 0.00 1.61 5.02 -0.91 -4.79 118.16 116.33 3hjo n LYS 140 Ca 0.00 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 3hjo n LYS 140 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3hjo n LYS 140 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3hjo n THR 141 N -1.36 0.00 -4.46 -0.18 -2.24 -1.26 -5.12 114.28 99.66 3hjo n THR 141 Ca 0.05 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.60 3hjo n THR 141 Cb 0.34 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.49 3hjo n THR 141 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3hjo s PHE 142 N 1.00 1.77 0.30 4.78 0.08 -1.25 -5.03 117.98 119.63 3hjo s PHE 142 Ca 0.00 -1.28 0.05 0.00 0.12 0.00 0.00 56.93 55.82 3hjo s PHE 142 Cb 0.00 -1.09 0.48 0.00 -0.57 0.00 0.00 43.02 41.84 3hjo s PHE 142 CO 0.00 -0.33 1.74 0.97 -0.10 0.00 0.00 175.22 177.50 3hjo h ILE 143 N 1.92 1.27 -3.44 0.64 6.09 -1.96 -3.42 117.51 118.62 3hjo h ILE 143 Ca -0.35 -1.30 -0.38 0.00 -1.37 0.00 0.00 64.86 61.46 3hjo h ILE 143 Cb 1.26 1.47 -0.35 0.00 0.47 0.00 0.00 36.82 39.67 3hjo h ILE 143 CO 0.56 0.40 -0.76 -0.69 -3.07 0.00 0.00 178.15 174.60 3hjo s VAL 144 N -4.38 0.29 0.00 2.19 1.01 -1.26 -4.69 120.40 113.56 3hjo s VAL 144 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.97 3hjo s VAL 144 Cb 0.14 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 36.13 3hjo s VAL 144 CO 0.77 0.19 0.00 0.61 0.00 0.00 0.00 175.10 176.67 3hjo n GLY 145 N 4.32 0.09 0.57 4.51 0.00 -1.26 -4.27 105.19 109.14 3hjo n GLY 145 Ca -0.22 -0.97 0.05 0.00 0.00 0.00 0.00 46.02 44.88 3hjo n GLY 145 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hjo n ASP 146 N -1.74 2.72 -4.20 1.61 10.43 -1.26 -3.97 116.55 120.14 3hjo n ASP 146 Ca 0.00 -1.92 -0.19 0.00 2.57 0.00 0.00 54.79 55.25 3hjo n ASP 146 Cb 0.00 -0.18 -0.12 0.00 1.84 0.00 0.00 41.12 42.66 3hjo n ASP 146 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3hjo s GLN 147 N -0.98 0.90 0.42 -1.24 -0.21 -1.26 -4.90 119.66 112.39 3hjo s GLN 147 Ca 0.20 -1.05 -0.26 0.00 0.02 0.00 0.00 55.36 54.27 3hjo s GLN 147 Cb 0.11 -0.90 -0.09 0.00 1.00 0.00 0.00 33.01 33.13 3hjo s GLN 147 CO 0.14 0.19 1.39 -1.50 -2.12 0.00 0.00 175.29 173.39 3hjo s ILE 148 N -1.51 2.29 0.30 1.08 2.07 -1.26 -4.77 121.20 119.41 3hjo s ILE 148 Ca 0.02 0.27 0.04 0.00 -1.41 0.00 0.00 60.65 59.56 3hjo s ILE 148 Cb -0.09 -3.16 -0.06 0.00 0.13 0.00 0.00 42.46 39.28 3hjo s ILE 148 CO 0.03 0.04 0.05 -0.94 -1.91 0.00 0.00 174.94 172.21 3hjo s SER 149 N -0.54 2.16 0.43 4.50 1.04 -1.26 -4.57 113.70 115.46 3hjo s SER 149 Ca 0.58 -1.35 0.10 0.00 0.48 0.00 0.00 55.95 55.76 3hjo s SER 149 Cb -0.42 -0.04 0.96 0.00 0.10 0.00 0.00 66.02 66.61 3hjo s SER 149 CO 0.54 -0.60 2.06 2.19 0.98 0.00 0.00 173.24 178.41 3hjo h PHE 150 N 2.21 0.42 0.00 5.02 -5.15 -1.57 -1.48 116.94 116.39 3hjo h PHE 150 Ca -0.40 0.01 -0.05 0.00 -0.20 0.00 0.00 57.97 57.33 3hjo h PHE 150 Cb 1.24 -0.14 -0.01 0.00 0.22 0.00 0.00 35.95 37.26 3hjo h PHE 150 CO 0.57 0.25 -0.23 0.00 -2.00 0.00 0.00 178.31 176.90 3hjo h ALA 151 N 1.77 1.60 -0.33 12.09 0.00 -1.86 -2.49 119.26 130.04 3hjo h ALA 151 Ca 0.16 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hjo h ALA 151 Cb 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3hjo h ALA 151 CO -0.04 0.28 0.20 -0.44 0.00 0.00 0.00 179.25 179.26 3hjo h ASP 152 N 0.00 0.34 -0.46 0.00 3.32 -1.66 0.15 116.42 118.11 3hjo h ASP 152 Ca -0.00 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3hjo h ASP 152 Cb 0.41 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3hjo h ASP 152 CO 0.03 0.24 0.13 1.88 -1.72 0.00 0.00 179.24 179.81 3hjo h TYR 153 N 0.42 0.75 -0.38 4.55 0.05 -1.49 0.12 116.97 120.99 3hjo h TYR 153 Ca 0.13 -0.08 -0.02 0.00 0.05 0.00 0.00 58.73 58.81 3hjo h TYR 153 Cb -0.02 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 3hjo h TYR 153 CO -0.07 0.68 0.16 -0.97 -1.05 0.00 0.00 178.16 176.91 3hjo h ASN 154 N 0.61 0.52 -0.29 3.88 -1.24 -1.32 -1.33 115.58 116.40 3hjo h ASN 154 Ca 0.15 -0.16 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 3hjo h ASN 154 Cb 0.29 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 3hjo h ASN 154 CO -0.00 0.53 0.15 0.25 -1.29 0.00 0.00 177.43 177.07 3hjo h LEU 155 N 0.47 0.37 -0.40 0.34 5.85 -0.54 -1.77 115.31 119.64 3hjo h LEU 155 Ca 0.13 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.80 3hjo h LEU 155 Cb 0.17 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 3hjo h LEU 155 CO -0.01 0.37 0.12 0.25 -0.34 0.00 0.00 178.44 178.83 3hjo h LEU 156 N 0.35 0.11 -0.51 2.25 5.85 -0.66 -0.69 115.31 122.00 3hjo h LEU 156 Ca 0.10 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.92 3hjo h LEU 156 Cb 0.09 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 3hjo h LEU 156 CO -0.01 0.10 0.25 -0.78 -0.34 0.00 0.00 178.44 177.65 3hjo h ASP 157 N 0.27 0.35 -0.92 1.25 3.58 -1.09 -0.34 116.42 119.52 3hjo h ASP 157 Ca 0.18 0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.71 3hjo h ASP 157 Cb 0.18 -0.03 -0.06 0.00 1.72 0.00 0.00 39.33 41.14 3hjo h ASP 157 CO -0.20 0.24 0.59 0.25 -2.88 0.00 0.00 179.24 177.24 3hjo h LEU 158 N 0.49 0.97 -0.30 2.28 5.85 -0.63 -1.43 115.31 122.54 3hjo h LEU 158 Ca 0.23 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 3hjo h LEU 158 Cb 0.15 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3hjo h LEU 158 CO -0.17 0.64 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.25 3hjo h LEU 159 N 1.12 0.74 -0.27 2.25 3.38 -0.68 -2.54 115.31 119.31 3hjo h LEU 159 Ca 0.38 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.94 3hjo h LEU 159 Cb 0.08 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 3hjo h LEU 159 CO -0.14 1.04 0.04 -0.07 0.09 0.00 0.00 178.44 179.39 3hjo h LEU 160 N 0.45 -0.03 -1.02 1.67 3.38 -0.57 -1.32 115.31 117.88 3hjo h LEU 160 Ca 0.05 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3hjo h LEU 160 Cb 0.81 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3hjo h LEU 160 CO 0.07 0.02 -0.33 0.16 0.09 0.00 0.00 178.44 178.44 3hjo h ILE 161 N 0.13 0.82 -0.01 1.22 3.07 -1.29 -2.82 117.51 118.62 3hjo h ILE 161 Ca 0.13 -1.39 -0.19 0.00 1.55 0.00 0.00 64.86 64.95 3hjo h ILE 161 Cb 0.14 1.86 -0.01 0.00 -0.27 0.00 0.00 36.82 38.55 3hjo h ILE 161 CO -0.18 0.33 -0.84 0.45 -1.05 0.00 0.00 178.15 176.85 3hjo h HIS 162 N 0.00 0.35 0.00 0.16 3.86 -1.10 -1.32 115.15 117.10 3hjo h HIS 162 Ca -0.00 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 58.99 3hjo h HIS 162 Cb 0.84 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.26 3hjo h HIS 162 CO 0.00 0.98 -0.14 0.93 0.86 0.00 0.00 177.93 180.55 3hjo h GLU 163 N 0.14 0.00 0.08 2.45 4.39 -1.04 0.63 114.58 121.22 3hjo h GLU 163 Ca -0.04 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.40 3hjo h GLU 163 Cb 1.46 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 30.13 3hjo h GLU 163 CO 0.13 0.14 -1.04 0.28 -1.16 0.00 0.00 179.01 177.37 3hjo h VAL 164 N 0.00 1.33 -0.33 3.13 2.07 -1.26 -2.65 116.25 118.55 3hjo h VAL 164 Ca -0.00 -2.35 -0.06 0.00 0.82 0.00 0.00 66.70 65.10 3hjo h VAL 164 Cb 0.29 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 3hjo h VAL 164 CO 0.02 0.71 -0.05 0.25 0.02 0.00 0.00 177.57 178.51 3hjo h LEU 165 N 0.16 0.61 -6.50 2.57 5.85 -0.77 -3.38 115.31 113.84 3hjo h LEU 165 Ca -0.15 -0.35 -0.60 0.00 0.84 0.00 0.00 57.88 57.63 3hjo h LEU 165 Cb 1.73 -0.17 -0.39 0.00 0.37 0.00 0.00 40.66 42.21 3hjo h LEU 165 CO 0.20 0.81 -0.90 0.00 -0.34 0.00 0.00 178.44 178.21 3hjo s ALA 166 N -4.85 1.82 0.14 1.25 0.00 0.22 -5.09 121.76 115.25 3hjo s ALA 166 Ca -0.13 -2.68 -0.34 0.00 0.00 0.00 0.00 51.96 48.80 3hjo s ALA 166 Cb 0.09 -1.70 -0.14 0.00 0.00 0.00 0.00 23.12 21.37 3hjo s ALA 166 CO 0.78 -2.00 1.54 -2.30 0.00 0.00 0.00 175.76 173.79 3hjo n PRO 167 N 2.72 1.97 -0.54 0.00 -0.02 -1.00 -1.30 135.00 136.83 3hjo n PRO 167 Ca 0.28 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 3hjo n PRO 167 Cb 0.45 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3hjo n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hjo n GLY 168 N 3.28 0.76 0.30 -1.23 0.00 -1.26 -4.94 105.19 102.10 3hjo n GLY 168 Ca 0.17 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.38 3hjo n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjo n LEU 170 N -3.24 1.20 -0.13 0.00 4.77 -1.26 -4.39 117.00 113.95 3hjo n LEU 170 Ca -0.02 -0.36 0.08 0.00 -0.03 0.00 0.00 56.01 55.69 3hjo n LEU 170 Cb 0.18 -0.10 0.42 0.00 -2.33 0.00 0.00 43.42 41.59 3hjo n LEU 170 CO 0.25 0.23 1.20 -0.78 -1.33 0.00 0.00 177.39 176.96 3hjo h ASP 171 N 1.31 0.53 0.46 -1.43 3.58 -1.78 -0.35 116.42 118.74 3hjo h ASP 171 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 3hjo h ASP 171 Cb 0.56 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.50 3hjo h ASP 171 CO 0.00 0.34 0.00 0.00 -2.88 0.00 0.00 179.24 176.70 3hjo n ALA 172 N -2.48 2.26 -3.85 -0.78 0.00 -1.26 -4.55 120.51 109.85 3hjo n ALA 172 Ca 0.10 -0.12 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 3hjo n ALA 172 Cb 0.27 -1.40 -0.13 0.00 0.00 0.00 0.00 19.45 18.19 3hjo n ALA 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3hjo s PHE 173 N -2.56 2.93 0.32 0.00 0.08 -0.14 -4.99 117.98 113.62 3hjo s PHE 173 Ca 0.24 -3.02 0.01 0.00 0.12 0.00 0.00 56.93 54.28 3hjo s PHE 173 Cb 0.17 -2.49 0.53 0.00 -0.57 0.00 0.00 43.02 40.67 3hjo s PHE 173 CO 0.38 -0.70 1.91 -1.00 -0.10 0.00 0.00 175.22 175.71 3hjo h PRO 174 N 6.17 0.77 -0.17 0.24 0.13 -1.80 0.08 132.00 137.41 3hjo h PRO 174 Ca 0.02 -0.11 -0.06 0.00 -0.87 0.00 0.00 66.00 64.98 3hjo h PRO 174 Cb 0.86 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 3hjo h PRO 174 CO 0.64 0.63 -0.12 -0.07 -0.23 0.00 0.00 178.00 178.85 3hjo h LEU 175 N 0.76 0.40 -0.36 1.56 3.38 -1.93 -0.59 115.31 118.54 3hjo h LEU 175 Ca 0.18 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.72 3hjo h LEU 175 Cb 0.15 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3hjo h LEU 175 CO -0.02 0.76 0.23 -0.07 0.09 0.00 0.00 178.44 179.43 3hjo h LEU 176 N 0.05 0.40 -0.14 1.67 3.38 -1.85 0.16 115.31 118.97 3hjo h LEU 176 Ca 0.03 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.01 3hjo h LEU 176 Cb 0.62 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 3hjo h LEU 176 CO 0.03 0.29 0.05 -1.28 0.09 0.00 0.00 178.44 177.61 3hjo h SER 177 N 0.47 0.05 -0.74 -0.43 0.87 -0.93 -1.31 113.55 111.52 3hjo h SER 177 Ca 0.13 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.67 3hjo h SER 177 Cb -0.04 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 3hjo h SER 177 CO -0.04 0.05 0.32 0.00 -0.53 0.00 0.00 176.83 176.63 3hjo h ALA 178 N 1.09 0.96 -0.73 6.23 0.00 -0.97 -2.86 119.26 122.98 3hjo h ALA 178 Ca 0.06 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3hjo h ALA 178 Cb 0.04 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.48 3hjo h ALA 178 CO -0.07 0.57 0.43 -0.92 0.00 0.00 0.00 179.25 179.26 3hjo h TYR 179 N 1.06 0.78 -0.10 0.00 3.20 -0.42 0.00 116.97 121.50 3hjo h TYR 179 Ca 0.25 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.14 3hjo h TYR 179 Cb 0.18 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.20 3hjo h TYR 179 CO 0.01 0.38 0.05 0.28 -1.64 0.00 0.00 178.16 177.25 3hjo h VAL 180 N 0.78 1.10 -0.56 1.81 2.07 -1.16 -1.12 116.25 119.17 3hjo h VAL 180 Ca 0.32 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.57 3hjo h VAL 180 Cb 0.18 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3hjo h VAL 180 CO -0.18 0.09 0.36 1.23 0.02 0.00 0.00 177.57 179.09 3hjo h GLY 181 N 0.05 0.78 0.75 2.17 0.00 -1.25 -2.10 103.07 103.47 3hjo h GLY 181 Ca 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 3hjo h GLY 181 CO -0.01 0.27 -0.02 -0.09 0.00 0.00 0.00 176.54 176.70 3hjo h ARG 182 N 0.74 0.23 -0.50 4.80 2.43 -0.87 -2.06 114.38 119.15 3hjo h ARG 182 Ca 0.21 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 3hjo h ARG 182 Cb -0.07 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3hjo h ARG 182 CO -0.05 0.51 -0.07 -0.07 -1.51 0.00 0.00 179.97 178.78 3hjo h LEU 183 N -0.07 0.88 -1.79 3.80 4.07 -1.25 -2.94 115.31 118.03 3hjo h LEU 183 Ca 0.03 -0.26 -0.03 0.00 0.08 0.00 0.00 57.88 57.70 3hjo h LEU 183 Cb 0.42 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 3hjo h LEU 183 CO 0.01 0.98 -0.16 0.28 -1.08 0.00 0.00 178.44 178.48 3hjo h SER 184 N 0.82 0.00 1.14 -0.43 0.02 -1.28 -2.31 113.55 111.51 3hjo h SER 184 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3hjo h SER 184 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 3hjo h SER 184 CO 0.04 0.16 -0.20 0.00 -1.14 0.00 0.00 176.83 175.68 3hjo n ALA 185 N -2.36 2.57 -1.65 3.77 0.00 -0.79 -3.07 120.51 118.98 3hjo n ALA 185 Ca -0.02 -0.12 -0.52 0.00 0.00 0.00 0.00 53.44 52.78 3hjo n ALA 185 Cb 0.25 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.28 3hjo n ALA 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hjo n ARG 186 N -2.00 1.50 -0.05 0.00 1.74 -0.87 -4.68 116.66 112.30 3hjo n ARG 186 Ca 0.05 0.55 -0.08 0.00 -0.77 0.00 0.00 57.85 57.60 3hjo n ARG 186 Cb 0.41 -2.25 -0.01 0.00 -1.02 0.00 0.00 32.46 29.58 3hjo n ARG 186 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3hjo h PRO 187 N 6.14 -0.15 -0.46 5.56 0.11 -1.90 0.69 132.00 141.99 3hjo h PRO 187 Ca -0.47 0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 3hjo h PRO 187 Cb 1.31 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.43 3hjo h PRO 187 CO 0.87 -0.10 -0.08 0.87 -0.21 0.00 0.00 178.00 179.35 3hjo h LYS 188 N -0.15 0.81 -0.34 1.05 1.57 -1.88 -1.56 116.57 116.06 3hjo h LYS 188 Ca 0.13 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.54 3hjo h LYS 188 Cb 0.35 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3hjo h LYS 188 CO -0.33 0.87 -0.22 1.25 -0.57 0.00 0.00 179.45 180.45 3hjo h LEU 189 N 0.74 0.79 -0.27 2.94 5.85 -1.64 -2.42 115.31 121.29 3hjo h LEU 189 Ca 0.13 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 58.48 3hjo h LEU 189 Cb 0.57 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.31 3hjo h LEU 189 CO 0.03 1.05 -0.18 0.50 -0.34 0.00 0.00 178.44 179.50 3hjo h LYS 190 N 0.54 -0.16 -0.43 1.25 3.64 0.58 0.48 116.57 122.46 3hjo h LYS 190 Ca 0.07 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3hjo h LYS 190 Cb 0.77 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 3hjo h LYS 190 CO 0.06 -0.11 0.24 0.00 -2.27 0.00 0.00 179.45 177.38 3hjo h ALA 191 N 0.99 0.55 -0.55 5.00 0.00 -1.29 -2.21 119.26 121.75 3hjo h ALA 191 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3hjo h ALA 191 Cb 0.38 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3hjo h ALA 191 CO -0.36 0.07 0.35 0.35 0.00 0.00 0.00 179.25 179.66 3hjo h PHE 192 N 0.56 0.71 0.00 0.00 3.57 -1.04 -1.97 116.94 118.79 3hjo h PHE 192 Ca 0.15 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3hjo h PHE 192 Cb 0.05 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 3hjo h PHE 192 CO -0.02 0.47 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.29 3hjo h LEU 193 N 0.75 0.00 -0.28 0.59 3.38 -0.68 -1.95 115.31 117.12 3hjo h LEU 193 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3hjo h LEU 193 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hjo h LEU 193 CO -0.04 0.17 -0.27 0.00 0.09 0.00 0.00 178.44 178.39 3hjo n ALA 194 N -2.36 3.08 -1.91 1.53 0.00 -0.85 -4.50 120.51 115.50 3hjo n ALA 194 Ca -0.02 -0.34 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 3hjo n ALA 194 Cb 0.27 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 3hjo n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hjo s SER 195 N -2.65 6.73 0.40 0.00 1.04 -0.73 -4.84 113.70 113.65 3hjo s SER 195 Ca 0.21 1.53 0.15 0.00 0.48 0.00 0.00 55.95 58.32 3hjo s SER 195 Cb 0.19 -2.48 1.01 0.00 0.10 0.00 0.00 66.02 64.84 3hjo s SER 195 CO 0.55 -0.45 1.87 -0.65 0.98 0.00 0.00 173.24 175.55 3hjo h PRO 196 N 1.42 0.46 -0.83 4.02 0.11 -1.92 0.60 132.00 135.86 3hjo h PRO 196 Ca -0.48 -0.03 0.19 0.00 0.11 0.00 0.00 66.00 65.79 3hjo h PRO 196 Cb 1.18 -0.10 -0.12 0.00 0.11 0.00 0.00 31.00 32.07 3hjo h PRO 196 CO 0.62 0.31 0.32 1.49 -0.21 0.00 0.00 178.00 180.52 3hjo h GLU 197 N 0.48 0.37 0.00 1.05 4.81 -1.93 -0.25 114.58 119.11 3hjo h GLU 197 Ca 0.44 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.58 3hjo h GLU 197 Cb 0.99 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 3hjo h GLU 197 CO -0.17 0.24 -0.70 -0.92 -0.73 0.00 0.00 179.01 176.73 3hjo h TYR 198 N 0.38 0.00 -0.44 0.92 3.20 -1.64 -3.41 116.97 115.97 3hjo h TYR 198 Ca 0.49 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.36 3hjo h TYR 198 Cb 0.88 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 3hjo h TYR 198 CO -0.18 0.51 0.25 0.28 -1.64 0.00 0.00 178.16 177.37 3hjo h VAL 199 N -1.00 1.14 -0.30 1.81 2.07 -0.84 -2.71 116.25 116.42 3hjo h VAL 199 Ca -0.11 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.07 3hjo h VAL 199 Cb 0.74 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 3hjo h VAL 199 CO -0.07 0.15 0.00 0.59 0.02 0.00 0.00 177.57 178.26 3hjo n ASN 200 N -4.43 1.96 -4.85 0.57 3.02 -0.11 -4.81 115.26 106.62 3hjo n ASN 200 Ca 0.03 -1.89 -0.33 0.00 -0.03 0.00 0.00 54.58 52.37 3hjo n ASN 200 Cb 0.09 -0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 39.01 3hjo n ASN 200 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3hjo s LEU 201 N -1.24 4.14 0.70 3.41 1.43 -1.02 -5.06 118.68 121.04 3hjo s LEU 201 Ca 0.29 0.23 -0.11 0.00 -1.03 0.00 0.00 54.13 53.51 3hjo s LEU 201 Cb 0.15 -2.49 0.01 0.00 0.03 0.00 0.00 46.19 43.90 3hjo s LEU 201 CO 0.21 0.25 1.07 -2.16 0.23 0.00 0.00 176.35 175.95 3hjo s PRO 202 N -1.93 2.82 0.01 1.29 0.04 -1.26 -4.79 135.00 131.18 3hjo s PRO 202 Ca 0.26 1.02 -0.24 0.00 0.04 0.00 0.00 61.00 62.07 3hjo s PRO 202 Cb -0.12 -1.97 -0.18 0.00 0.04 0.00 0.00 34.50 32.26 3hjo s PRO 202 CO 0.18 -1.19 1.39 0.82 0.04 0.00 0.00 177.00 178.24 3hjo h ILE 203 N -0.73 1.29 -4.87 0.56 2.04 -1.95 0.27 117.51 114.13 3hjo h ILE 203 Ca -0.44 -0.89 -0.55 0.00 1.00 0.00 0.00 64.86 63.98 3hjo h ILE 203 Cb 1.22 1.84 -0.11 0.00 -0.74 0.00 0.00 36.82 39.03 3hjo h ILE 203 CO 0.56 0.24 -0.41 0.59 0.00 0.00 0.00 178.15 179.13 3hjo n ASN 204 N -4.87 2.97 -0.21 1.72 4.13 -1.26 -0.38 115.26 117.35 3hjo n ASN 204 Ca -0.08 -2.89 0.12 0.00 1.68 0.00 0.00 54.58 53.41 3hjo n ASN 204 Cb 0.21 0.37 0.13 0.00 -1.54 0.00 0.00 39.78 38.95 3hjo n ASN 204 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hjo n GLY 205 N -0.18 -0.64 0.71 7.41 0.00 -1.26 -4.40 105.19 106.84 3hjo n GLY 205 Ca -0.16 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.41 3hjo n GLY 205 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hjo n ASN 206 N -0.83 3.23 0.00 1.61 6.94 -1.26 -4.95 115.26 119.99 3hjo n ASN 206 Ca 0.08 -2.33 0.00 0.00 -0.02 0.00 0.00 54.58 52.32 3hjo n ASN 206 Cb 0.38 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 3hjo n ASN 206 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3hjo n GLY 207 N 0.17 0.71 3.75 4.83 0.00 -1.26 -5.02 105.19 108.38 3hjo n GLY 207 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 3hjo n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hjo s LYS 208 N -0.10 2.75 0.00 1.61 1.02 -1.26 -5.10 119.74 118.67 3hjo s LYS 208 Ca 0.00 -0.88 0.00 0.00 0.02 0.00 0.00 55.97 55.11 3hjo s LYS 208 Cb 0.00 -2.59 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 3hjo s LYS 208 CO 0.00 0.50 0.00 0.00 -0.92 0.00 0.00 175.35 174.93