#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9v n PHE 4 N 0.00 0.00 -0.17 -5.13 3.72 -1.26 -3.79 117.46 110.83 3i9v n PHE 4 Ca 0.00 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.37 3i9v n PHE 4 Cb 0.00 -0.19 0.06 0.00 -0.94 0.00 0.00 39.48 38.41 3i9v n PHE 4 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 3i9v h ASP 5 N 0.66 0.26 -0.34 4.37 3.04 -2.05 -2.80 116.42 119.56 3i9v h ASP 5 Ca 0.00 0.05 0.07 0.00 -3.24 0.00 0.00 57.03 53.91 3i9v h ASP 5 Cb 0.49 0.01 -0.08 0.00 -1.04 0.00 0.00 39.33 38.71 3i9v h ASP 5 CO 0.00 0.18 -0.23 -0.78 -2.04 0.00 0.00 179.24 176.37 3i9v h ASP 6 N 0.42 -0.75 -2.67 4.15 1.82 -2.10 -3.37 116.42 113.92 3i9v h ASP 6 Ca 0.24 0.15 -0.65 0.00 -0.39 0.00 0.00 57.03 56.38 3i9v h ASP 6 Cb 0.22 0.38 -0.39 0.00 0.68 0.00 0.00 39.33 40.22 3i9v h ASP 6 CO -0.22 -0.26 -0.33 2.29 -1.61 0.00 0.00 179.24 179.12 3i9v n LYS 7 N -5.38 2.65 -0.19 0.28 0.00 -1.06 -4.86 118.16 109.61 3i9v n LYS 7 Ca 0.01 -4.59 0.09 0.00 -0.00 0.00 0.00 58.31 53.82 3i9v n LYS 7 Cb 0.29 -2.32 0.26 0.00 -0.00 0.00 0.00 35.03 33.26 3i9v n LYS 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3i9v n GLN 8 N 1.39 2.10 0.07 -1.58 6.02 -1.24 -2.90 117.38 121.24 3i9v n GLN 8 Ca 0.26 -1.69 -0.07 0.00 -0.01 0.00 0.00 57.00 55.49 3i9v n GLN 8 Cb 0.38 -1.41 -0.08 0.00 1.02 0.00 0.00 30.24 30.14 3i9v n GLN 8 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 3i9v h ASP 9 N 3.02 0.03 0.28 1.08 2.03 -1.92 -3.01 116.42 117.94 3i9v h ASP 9 Ca 0.00 -0.03 -0.16 0.00 -0.73 0.00 0.00 57.03 56.10 3i9v h ASP 9 Cb 0.68 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 39.16 3i9v h ASP 9 CO 0.00 0.98 -0.65 0.15 -1.03 0.00 0.00 179.24 178.68 3i9v h PHE 10 N 0.01 0.45 0.07 4.15 3.04 -1.94 -3.10 116.94 119.62 3i9v h PHE 10 Ca -0.02 -0.19 -0.00 0.00 3.98 0.00 0.00 57.97 61.74 3i9v h PHE 10 Cb 1.69 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 40.13 3i9v h PHE 10 CO 0.00 0.90 -0.04 -0.07 -2.02 0.00 0.00 178.31 177.09 3i9v h LEU 11 N 0.25 -0.08 -0.13 0.59 3.38 -1.63 -1.89 115.31 115.81 3i9v h LEU 11 Ca -0.01 -0.41 0.05 0.00 0.09 0.00 0.00 57.88 57.59 3i9v h LEU 11 Cb 1.20 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.91 3i9v h LEU 11 CO 0.11 0.39 -0.33 -0.33 0.09 0.00 0.00 178.44 178.37 3i9v h GLU 12 N -0.58 -0.39 -0.33 1.13 5.08 -1.61 -1.26 114.58 116.62 3i9v h GLU 12 Ca -0.01 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 3i9v h GLU 12 Cb 0.49 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.76 3i9v h GLU 12 CO 0.02 -0.26 -0.12 1.49 -1.00 0.00 0.00 179.01 179.14 3i9v h GLU 13 N -0.40 -0.05 0.00 2.33 4.81 -1.59 -2.15 114.58 117.53 3i9v h GLU 13 Ca 0.09 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 3i9v h GLU 13 Cb 0.55 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.94 3i9v h GLU 13 CO -0.35 -0.04 -0.28 1.79 -0.73 0.00 0.00 179.01 179.40 3i9v h THR 14 N -0.05 0.12 0.00 0.32 1.35 -1.07 -2.87 112.91 110.70 3i9v h THR 14 Ca 0.16 -1.17 -0.09 0.00 -0.55 0.00 0.00 66.41 64.76 3i9v h THR 14 Cb 0.30 1.96 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 3i9v h THR 14 CO -0.37 0.07 -0.42 -0.26 -0.25 0.00 0.00 175.52 174.29 3i9v h PHE 15 N 0.00 0.00 0.00 4.73 0.04 -1.01 -3.27 116.94 117.43 3i9v h PHE 15 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3i9v h PHE 15 Cb 1.06 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.21 3i9v h PHE 15 CO 0.00 0.42 0.00 0.00 -0.60 0.00 0.00 178.31 178.13 3i9v n ALA 16 N -2.28 1.79 0.81 2.45 0.00 -0.83 -2.15 120.51 120.30 3i9v n ALA 16 Ca 0.00 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.61 3i9v n ALA 16 Cb 0.57 -1.38 0.48 0.00 0.00 0.00 0.00 19.45 19.12 3i9v n ALA 16 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3i9v n LYS 17 N -2.09 0.14 -4.27 0.00 5.02 -1.23 -4.87 118.16 110.86 3i9v n LYS 17 Ca 0.03 0.10 -0.18 0.00 -2.02 0.00 0.00 58.31 56.25 3i9v n LYS 17 Cb 0.26 -1.65 -0.11 0.00 -0.02 0.00 0.00 35.03 33.51 3i9v n LYS 17 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3i9v s TYR 18 N -3.06 1.47 0.98 2.13 2.02 -0.91 -5.14 117.35 114.84 3i9v s TYR 18 Ca 0.12 -0.59 -0.12 0.00 -0.37 0.00 0.00 57.07 56.11 3i9v s TYR 18 Cb 0.16 -0.74 0.11 0.00 -0.40 0.00 0.00 41.96 41.08 3i9v s TYR 18 CO 0.58 0.19 0.69 -2.30 -1.57 0.00 0.00 175.55 173.14 3i9v n PRO 19 N 0.22 -0.71 -0.23 -1.71 -0.02 -1.26 -4.86 135.00 126.43 3i9v n PRO 19 Ca -0.13 -0.16 0.03 0.00 -2.02 0.00 0.00 63.50 61.22 3i9v n PRO 19 Cb 0.58 -2.06 0.15 0.00 -0.02 0.00 0.00 33.50 32.15 3i9v n PRO 19 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3i9v h PRO 20 N -1.85 0.29 -0.63 0.52 0.13 -2.00 -1.39 132.00 127.07 3i9v h PRO 20 Ca -0.46 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3i9v h PRO 20 Cb 1.29 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3i9v h PRO 20 CO 0.39 0.19 0.00 -0.85 -0.23 0.00 0.00 178.00 177.50 3i9v n GLU 21 N -5.11 3.13 -2.75 0.86 0.00 -1.26 -4.35 120.64 111.16 3i9v n GLU 21 Ca 0.12 -2.09 -0.22 0.00 0.00 0.00 0.00 57.16 54.96 3i9v n GLU 21 Cb 0.38 -1.78 -0.01 0.00 0.00 0.00 0.00 31.44 30.03 3i9v n GLU 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3i9v n GLY 22 N 0.81 4.58 0.13 -1.84 0.00 -0.52 -4.88 105.19 103.46 3i9v n GLY 22 Ca 0.19 -2.30 -0.19 0.00 0.00 0.00 0.00 46.02 43.73 3i9v n GLY 22 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i9v h ARG 23 N 2.84 0.24 -0.45 1.61 3.08 -1.76 -3.27 114.38 116.67 3i9v h ARG 23 Ca 0.14 -0.42 0.13 0.00 0.07 0.00 0.00 59.98 59.90 3i9v h ARG 23 Cb 0.87 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.06 3i9v h ARG 23 CO 0.71 1.10 0.49 0.00 -1.07 0.00 0.00 179.97 181.20 3i9v h ARG 24 N 0.07 0.00 -1.22 0.04 3.08 -1.90 0.19 114.38 114.63 3i9v h ARG 24 Ca -0.35 0.00 0.35 0.00 0.07 0.00 0.00 59.98 60.05 3i9v h ARG 24 Cb 2.04 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 32.04 3i9v h ARG 24 CO 0.12 0.00 0.87 0.00 -1.07 0.00 0.00 179.97 179.89 3i9v h ALA 25 N 1.44 3.11 0.00 0.04 0.00 -1.96 0.57 119.26 122.46 3i9v h ALA 25 Ca 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3i9v h ALA 25 Cb 1.20 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3i9v h ALA 25 CO -0.00 -1.47 0.00 0.00 0.00 0.00 0.00 179.25 177.78 3i9v h ALA 26 N 1.40 1.00 -0.49 0.00 0.00 -1.20 -3.30 119.26 116.67 3i9v h ALA 26 Ca 0.59 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.60 3i9v h ALA 26 Cb 2.31 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 20.01 3i9v h ALA 26 CO -0.03 0.00 -0.05 0.82 0.00 0.00 0.00 179.25 179.99 3i9v h ILE 27 N 0.00 0.57 0.59 0.00 2.04 -0.04 -1.42 117.51 119.25 3i9v h ILE 27 Ca 0.00 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 3i9v h ILE 27 Cb 0.51 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 3i9v h ILE 27 CO 0.00 0.01 -0.39 0.24 0.00 0.00 0.00 178.15 178.01 3i9v h MET 28 N 0.07 -0.90 -0.53 2.37 2.86 -1.77 -0.89 114.93 116.13 3i9v h MET 28 Ca 0.25 0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.92 3i9v h MET 28 Cb 0.38 0.21 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 3i9v h MET 28 CO -0.45 -0.60 0.21 -1.00 1.06 0.00 0.00 176.91 176.13 3i9v h PRO 29 N -0.94 0.76 0.47 -0.22 0.13 -1.73 -0.60 132.00 129.87 3i9v h PRO 29 Ca -0.07 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 3i9v h PRO 29 Cb 0.77 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.77 3i9v h PRO 29 CO 0.06 0.63 -0.23 -0.07 -0.23 0.00 0.00 178.00 178.15 3i9v h LEU 30 N 0.75 -0.54 -0.76 1.56 3.38 -1.21 -2.24 115.31 116.26 3i9v h LEU 30 Ca 0.18 -0.06 0.17 0.00 0.09 0.00 0.00 57.88 58.26 3i9v h LEU 30 Cb 0.15 0.14 -0.14 0.00 0.09 0.00 0.00 40.66 40.91 3i9v h LEU 30 CO -0.02 -0.26 -0.04 -0.07 0.09 0.00 0.00 178.44 178.14 3i9v h LEU 31 N -0.80 -0.44 -0.53 1.67 -0.00 -1.07 -1.26 115.31 112.87 3i9v h LEU 31 Ca -0.06 0.21 0.07 0.00 -0.00 0.00 0.00 57.88 58.09 3i9v h LEU 31 Cb 0.56 0.38 -0.06 0.00 -0.00 0.00 0.00 40.66 41.54 3i9v h LEU 31 CO 0.11 -0.20 0.21 -0.09 -0.00 0.00 0.00 178.44 178.46 3i9v h ARG 32 N 0.07 0.39 0.33 1.13 2.43 -0.97 -2.73 114.38 115.04 3i9v h ARG 32 Ca 0.41 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.54 3i9v h ARG 32 Cb 0.70 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 3i9v h ARG 32 CO -0.70 0.26 -0.27 0.00 -1.51 0.00 0.00 179.97 177.75 3i9v h ARG 33 N 0.41 -0.56 -0.69 0.20 3.08 -0.61 -2.50 114.38 113.71 3i9v h ARG 33 Ca 0.25 0.04 0.13 0.00 0.07 0.00 0.00 59.98 60.48 3i9v h ARG 33 Cb 0.26 0.13 -0.13 0.00 0.08 0.00 0.00 29.97 30.30 3i9v h ARG 33 CO -0.24 -0.37 -0.18 0.28 -1.07 0.00 0.00 179.97 178.39 3i9v n VAL 34 N -3.97 -0.29 0.36 2.04 0.31 -1.05 -1.03 118.33 114.69 3i9v n VAL 34 Ca -0.07 1.57 -0.18 0.00 -0.01 0.00 0.00 64.34 65.65 3i9v n VAL 34 Cb 0.25 -2.17 -0.09 0.00 -0.91 0.00 0.00 33.84 30.92 3i9v n VAL 34 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 3i9v h GLN 35 N 0.00 -0.96 0.00 5.55 1.08 -1.23 0.42 115.11 119.98 3i9v h GLN 35 Ca 0.32 0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.59 3i9v h GLN 35 Cb 0.49 0.22 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3i9v h GLN 35 CO -0.70 -0.64 0.00 0.00 -0.95 0.00 0.00 178.83 176.54 3i9v n GLN 36 N -5.54 0.18 -0.09 1.46 10.64 -0.20 0.12 117.38 123.95 3i9v n GLN 36 Ca -0.13 0.17 -0.14 0.00 -1.83 0.00 0.00 57.00 55.07 3i9v n GLN 36 Cb 0.43 -1.50 -0.05 0.00 -0.86 0.00 0.00 30.24 28.26 3i9v n GLN 36 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 3i9v n GLU 37 N -1.30 0.49 0.00 2.61 -0.58 -0.54 -4.77 120.64 116.54 3i9v n GLU 37 Ca 0.06 0.20 0.11 0.00 -0.42 0.00 0.00 57.16 57.11 3i9v n GLU 37 Cb 0.11 -1.34 0.05 0.00 -0.57 0.00 0.00 31.44 29.70 3i9v n GLU 37 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3i9v n GLU 38 N -4.27 0.34 0.00 3.49 1.02 0.15 -4.98 120.64 116.38 3i9v n GLU 38 Ca -0.24 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.65 3i9v n GLU 38 Cb 0.58 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 3i9v n GLU 38 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i9v n GLY 39 N 1.47 2.98 3.71 0.62 0.00 0.12 -4.93 105.19 109.15 3i9v n GLY 39 Ca 0.06 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 3i9v n GLY 39 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3i9v s TRP 40 N -1.67 -0.23 -0.27 1.61 1.48 -1.26 -4.51 118.94 114.10 3i9v s TRP 40 Ca 0.00 -0.08 -0.08 0.00 -1.06 0.00 0.00 56.10 54.88 3i9v s TRP 40 Cb 0.00 0.64 -0.02 0.00 -1.16 0.00 0.00 33.47 32.92 3i9v s TRP 40 CO 0.00 -0.92 0.09 0.42 -4.06 0.00 0.00 176.95 172.48 3i9v s ILE 41 N -3.53 4.38 0.24 0.66 1.01 -0.27 -4.67 121.20 119.03 3i9v s ILE 41 Ca 0.09 -0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.46 3i9v s ILE 41 Cb -0.03 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 3i9v s ILE 41 CO 0.00 0.26 0.48 -0.13 0.00 0.00 0.00 174.94 175.56 3i9v s ARG 42 N 1.61 3.61 0.35 2.79 0.52 -1.26 -4.65 118.95 121.92 3i9v s ARG 42 Ca 0.06 -0.08 0.24 0.00 -0.52 0.00 0.00 55.73 55.42 3i9v s ARG 42 Cb -0.16 -2.73 1.26 0.00 0.52 0.00 0.00 34.95 33.84 3i9v s ARG 42 CO 0.04 0.31 1.74 -1.00 0.02 0.00 0.00 175.30 176.41 3i9v h PRO 43 N 2.00 0.00 -0.07 3.54 0.13 -1.98 0.89 132.00 136.51 3i9v h PRO 43 Ca -0.47 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 3i9v h PRO 43 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 3i9v h PRO 43 CO 0.68 0.00 -0.63 0.93 -0.23 0.00 0.00 178.00 178.75 3i9v h GLU 44 N 0.00 0.27 -0.42 0.86 3.07 -2.00 -2.63 114.58 113.72 3i9v h GLU 44 Ca 0.00 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.58 3i9v h GLU 44 Cb 0.07 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 3i9v h GLU 44 CO 0.00 0.81 -0.12 0.00 -1.40 0.00 0.00 179.01 178.30 3i9v h ARG 45 N 0.20 0.76 -0.16 2.33 2.47 -1.20 -1.66 114.38 117.12 3i9v h ARG 45 Ca -0.01 -0.25 -0.15 0.00 -1.26 0.00 0.00 59.98 58.31 3i9v h ARG 45 Cb 1.15 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 3i9v h ARG 45 CO 0.10 0.85 -0.53 0.82 0.56 0.00 0.00 179.97 181.77 3i9v h ILE 46 N 0.69 1.33 -0.20 2.04 2.04 -1.50 -1.33 117.51 120.59 3i9v h ILE 46 Ca 0.12 -1.78 -0.12 0.00 1.00 0.00 0.00 64.86 64.07 3i9v h ILE 46 Cb 0.59 1.79 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 3i9v h ILE 46 CO 0.04 0.55 -0.34 -0.33 0.00 0.00 0.00 178.15 178.06 3i9v h GLU 47 N 0.35 0.58 0.00 2.37 5.08 -1.29 -2.29 114.58 119.38 3i9v h GLU 47 Ca 0.01 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3i9v h GLU 47 Cb 1.04 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3i9v h GLU 47 CO 0.09 0.97 0.00 -1.91 -1.00 0.00 0.00 179.01 177.16 3i9v n GLU 48 N -4.30 0.00 -0.56 2.33 2.13 -0.64 -2.09 120.64 117.50 3i9v n GLU 48 Ca -0.06 0.50 0.45 0.00 0.66 0.00 0.00 57.16 58.72 3i9v n GLU 48 Cb 0.50 -1.31 0.74 0.00 0.27 0.00 0.00 31.44 31.63 3i9v n GLU 48 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3i9v h ILE 49 N 0.00 0.00 -0.16 6.31 2.04 -1.33 0.88 117.51 125.26 3i9v h ILE 49 Ca 0.00 -0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 3i9v h ILE 49 Cb 0.00 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.08 3i9v h ILE 49 CO 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 178.15 178.11 3i9v h ALA 50 N 1.39 0.22 -0.48 1.87 0.00 -1.08 -0.91 119.26 120.27 3i9v h ALA 50 Ca 0.91 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.51 3i9v h ALA 50 Cb 3.20 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 20.91 3i9v h ALA 50 CO -0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 179.25 178.92 3i9v h ARG 51 N 0.01 0.81 -0.11 0.00 3.08 0.13 0.19 114.38 118.48 3i9v h ARG 51 Ca 0.04 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 3i9v h ARG 51 Cb 0.47 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 3i9v h ARG 51 CO 0.02 0.81 0.02 -0.07 -1.07 0.00 0.00 179.97 179.68 3i9v h LEU 52 N 0.75 0.17 0.00 3.04 3.38 -1.08 -3.16 115.31 118.41 3i9v h LEU 52 Ca 0.15 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3i9v h LEU 52 Cb 0.46 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3i9v h LEU 52 CO 0.02 0.37 -0.20 1.62 0.09 0.00 0.00 178.44 180.34 3i9v h VAL 53 N -0.03 0.00 0.00 1.22 3.04 -1.05 -3.48 116.25 115.95 3i9v h VAL 53 Ca 0.03 -0.70 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 3i9v h VAL 53 Cb 0.27 1.59 0.00 0.00 -2.01 0.00 0.00 31.29 31.13 3i9v h VAL 53 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.17 3i9v n GLY 54 N 1.23 1.38 0.13 3.17 0.00 0.43 -4.40 105.19 107.13 3i9v n GLY 54 Ca 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 3i9v n GLY 54 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3i9v n THR 55 N -1.88 0.00 -1.78 2.61 5.66 0.12 -5.00 114.28 114.01 3i9v n THR 55 Ca 0.00 -0.09 -0.31 0.00 -3.05 0.00 0.00 64.05 60.60 3i9v n THR 55 Cb 0.08 0.03 0.03 0.00 -1.55 0.00 0.00 70.33 68.92 3i9v n THR 55 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3i9v s THR 56 N -1.44 4.30 0.31 1.09 -4.23 -1.26 -4.18 115.64 110.24 3i9v s THR 56 Ca 0.01 0.80 0.02 0.00 -1.18 0.00 0.00 61.69 61.33 3i9v s THR 56 Cb 0.00 -3.60 0.16 0.00 1.34 0.00 0.00 72.50 70.40 3i9v s THR 56 CO 0.00 -0.93 1.86 -0.65 -0.54 0.00 0.00 174.62 174.37 3i9v h PRO 57 N -0.36 0.66 0.58 3.99 0.11 -1.90 -3.16 132.00 131.92 3i9v h PRO 57 Ca -0.44 -0.13 -0.02 0.00 0.11 0.00 0.00 66.00 65.51 3i9v h PRO 57 Cb 1.20 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3i9v h PRO 57 CO 0.59 0.63 -0.33 1.15 -0.21 0.00 0.00 178.00 179.84 3i9v h THR 58 N 0.64 0.33 -0.99 -1.15 2.02 -1.94 -0.81 112.91 111.00 3i9v h THR 58 Ca 0.14 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.44 3i9v h THR 58 Cb 0.30 0.33 -0.08 0.00 -1.74 0.00 0.00 68.15 66.96 3i9v h THR 58 CO 0.00 0.00 0.62 -0.33 0.37 0.00 0.00 175.52 176.18 3i9v h GLU 59 N -0.84 0.95 -0.13 6.66 4.39 -1.95 -2.16 114.58 121.50 3i9v h GLU 59 Ca -0.07 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.45 3i9v h GLU 59 Cb 0.67 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 3i9v h GLU 59 CO 0.09 0.63 -0.40 0.28 -1.16 0.00 0.00 179.01 178.45 3i9v h VAL 60 N 0.98 1.36 -0.49 3.13 2.07 -1.50 -2.96 116.25 118.84 3i9v h VAL 60 Ca 0.49 -1.70 0.06 0.00 0.82 0.00 0.00 66.70 66.37 3i9v h VAL 60 Cb 0.48 2.09 -0.09 0.00 -1.52 0.00 0.00 31.29 32.25 3i9v h VAL 60 CO -0.27 0.51 -0.54 -0.03 0.02 0.00 0.00 177.57 177.27 3i9v h MET 61 N 0.11 -0.32 -0.26 1.57 1.85 -0.54 -1.44 114.93 115.91 3i9v h MET 61 Ca -0.01 0.02 0.06 0.00 -0.61 0.00 0.00 59.70 59.16 3i9v h MET 61 Cb 1.02 0.07 -0.07 0.00 0.43 0.00 0.00 31.60 33.05 3i9v h MET 61 CO 0.09 -0.22 -0.29 0.78 -0.40 0.00 0.00 176.91 176.86 3i9v h GLY 62 N -0.34 -0.28 0.17 1.39 0.00 -1.48 -1.91 103.07 100.62 3i9v h GLY 62 Ca 0.10 0.37 0.16 0.00 0.00 0.00 0.00 47.33 47.96 3i9v h GLY 62 CO -0.64 -0.21 0.45 -2.08 0.00 0.00 0.00 176.54 174.06 3i9v h VAL 63 N -0.30 0.70 0.00 4.60 2.07 -1.24 -2.17 116.25 119.91 3i9v h VAL 63 Ca 0.14 -0.21 -0.18 0.00 0.82 0.00 0.00 66.70 67.26 3i9v h VAL 63 Cb 0.51 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3i9v h VAL 63 CO -0.42 0.11 -0.87 0.00 0.02 0.00 0.00 177.57 176.41 3i9v h ALA 64 N 1.59 0.57 0.00 1.67 0.00 -0.91 -3.09 119.26 119.09 3i9v h ALA 64 Ca 0.49 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3i9v h ALA 64 Cb 0.73 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3i9v h ALA 64 CO -0.38 1.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.81 3i9v n SER 65 N -3.51 0.00 -0.04 0.00 3.41 -0.75 -3.63 113.62 109.10 3i9v n SER 65 Ca -0.00 -1.65 -0.06 0.00 -0.26 0.00 0.00 58.87 56.89 3i9v n SER 65 Cb 0.82 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.64 3i9v n SER 65 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3i9v n PHE 66 N -0.66 0.62 -3.51 7.33 -0.00 -1.16 -4.97 117.46 115.11 3i9v n PHE 66 Ca 0.07 0.22 -0.22 0.00 -0.00 0.00 0.00 57.45 57.52 3i9v n PHE 66 Cb 0.03 -1.07 -0.01 0.00 -0.00 0.00 0.00 39.48 38.44 3i9v n PHE 66 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.76 177.47 3i9v s TYR 67 N -2.68 3.35 -0.17 -5.13 1.51 -1.24 -5.04 117.35 107.95 3i9v s TYR 67 Ca -0.06 0.09 0.19 0.00 -1.01 0.00 0.00 57.07 56.28 3i9v s TYR 67 Cb 0.08 -1.89 -0.08 0.00 -0.11 0.00 0.00 41.96 39.96 3i9v s TYR 67 CO 0.83 0.11 0.91 0.43 -1.11 0.00 0.00 175.55 176.71 3i9v n SER 68 N -1.69 0.84 0.06 2.29 7.64 -1.26 -4.37 113.62 117.13 3i9v n SER 68 Ca -0.04 0.35 -0.10 0.00 1.01 0.00 0.00 58.87 60.09 3i9v n SER 68 Cb 0.57 0.31 -0.13 0.00 -1.01 0.00 0.00 64.21 63.95 3i9v n SER 68 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3i9v h TYR 69 N 0.00 0.16 -3.01 1.43 3.20 -1.96 -3.44 116.97 113.36 3i9v h TYR 69 Ca -0.09 -0.12 -0.57 0.00 3.14 0.00 0.00 58.73 61.09 3i9v h TYR 69 Cb 1.33 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.56 3i9v h TYR 69 CO 0.00 1.10 0.97 0.71 -1.64 0.00 0.00 178.16 179.31 3i9v s TYR 70 N -2.68 2.64 0.06 -3.82 2.02 -1.26 -5.01 117.35 109.30 3i9v s TYR 70 Ca -0.02 0.85 -0.16 0.00 -0.37 0.00 0.00 57.07 57.37 3i9v s TYR 70 Cb 0.09 -3.80 -0.06 0.00 -0.40 0.00 0.00 41.96 37.79 3i9v s TYR 70 CO 0.84 -1.93 0.49 -0.65 -1.57 0.00 0.00 175.55 172.73 3i9v s GLN 71 N 4.03 4.03 0.00 -0.62 -1.52 -1.26 -4.99 119.66 119.33 3i9v s GLN 71 Ca 0.58 0.54 0.03 0.00 -1.95 0.00 0.00 55.36 54.56 3i9v s GLN 71 Cb -0.20 -3.17 0.07 0.00 -0.22 0.00 0.00 33.01 29.49 3i9v s GLN 71 CO 0.21 0.63 0.93 1.19 -0.25 0.00 0.00 175.29 178.01 3i9v n PHE 72 N 1.56 0.09 -4.19 0.91 3.01 -1.26 -1.11 117.46 116.47 3i9v n PHE 72 Ca -0.11 -0.35 -0.15 0.00 1.01 0.00 0.00 57.45 57.85 3i9v n PHE 72 Cb 0.52 -0.03 -0.11 0.00 -0.01 0.00 0.00 39.48 39.85 3i9v n PHE 72 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 3i9v s VAL 73 N -0.78 1.02 0.63 -4.37 -7.23 -1.26 -4.76 120.40 103.64 3i9v s VAL 73 Ca 0.06 -1.64 -0.17 0.00 -1.81 0.00 0.00 61.98 58.41 3i9v s VAL 73 Cb 0.03 -1.38 -0.10 0.00 0.56 0.00 0.00 36.38 35.49 3i9v s VAL 73 CO 0.04 -0.52 0.16 -2.65 -0.31 0.00 0.00 175.10 171.83 3i9v n PRO 74 N 0.58 0.22 -3.83 4.82 -0.02 -1.26 -4.78 135.00 130.73 3i9v n PRO 74 Ca -0.16 0.09 -0.14 0.00 -2.02 0.00 0.00 63.50 61.27 3i9v n PRO 74 Cb 0.57 -1.41 -0.15 0.00 -0.02 0.00 0.00 33.50 32.49 3i9v n PRO 74 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 3i9v s THR 75 N -1.90 -0.01 1.10 3.45 -1.32 -1.26 -4.95 115.64 110.76 3i9v s THR 75 Ca 0.61 0.10 -0.20 0.00 -1.21 0.00 0.00 61.69 60.99 3i9v s THR 75 Cb -0.41 -0.07 0.07 0.00 -1.51 0.00 0.00 72.50 70.58 3i9v s THR 75 CO 0.62 0.05 -0.21 0.61 -2.21 0.00 0.00 174.62 173.49 3i9v n GLY 76 N 3.67 -2.58 0.29 6.08 0.00 -1.26 -4.87 105.19 106.52 3i9v n GLY 76 Ca -0.21 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.10 3i9v n GLY 76 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3i9v h LYS 77 N -1.97 0.86 -3.88 1.61 3.64 -1.59 -3.34 116.57 111.90 3i9v h LYS 77 Ca -0.50 -0.05 -0.68 0.00 -1.27 0.00 0.00 60.65 58.14 3i9v h LYS 77 Cb 1.34 -0.19 -0.37 0.00 -0.41 0.00 0.00 32.23 32.59 3i9v h LYS 77 CO 0.35 0.57 -0.51 0.71 -2.27 0.00 0.00 179.45 178.30 3i9v s TYR 78 N -6.09 3.44 -0.71 1.91 2.02 -0.13 -4.99 117.35 112.80 3i9v s TYR 78 Ca -0.13 -2.78 -0.27 0.00 -0.37 0.00 0.00 57.07 53.53 3i9v s TYR 78 Cb 0.17 -3.09 0.03 0.00 -0.40 0.00 0.00 41.96 38.67 3i9v s TYR 78 CO 0.78 -0.86 1.23 -1.58 -1.57 0.00 0.00 175.55 173.55 3i9v s HIS 79 N 0.28 2.36 -0.53 2.71 5.65 -1.25 -3.02 115.29 121.49 3i9v s HIS 79 Ca 0.14 -0.05 -0.29 0.00 0.25 0.00 0.00 55.06 55.11 3i9v s HIS 79 Cb -0.22 -4.57 0.03 0.00 -1.18 0.00 0.00 32.58 26.63 3i9v s HIS 79 CO -0.03 -1.97 1.20 -0.51 -0.65 0.00 0.00 174.74 172.78 3i9v s LEU 80 N 5.46 3.52 -0.30 8.88 1.43 0.25 -4.19 118.68 133.73 3i9v s LEU 80 Ca 0.34 0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 53.62 3i9v s LEU 80 Cb -0.09 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 42.77 3i9v s LEU 80 CO 0.16 -1.41 0.23 -1.10 0.23 0.00 0.00 176.35 174.45 3i9v s GLN 81 N 4.81 3.79 -0.21 1.70 -0.21 -0.82 -1.25 119.66 127.47 3i9v s GLN 81 Ca 0.47 -0.41 -0.08 0.00 0.02 0.00 0.00 55.36 55.36 3i9v s GLN 81 Cb -0.08 -3.71 -0.04 0.00 1.00 0.00 0.00 33.01 30.18 3i9v s GLN 81 CO 0.28 -0.29 0.08 0.08 -2.12 0.00 0.00 175.29 173.33 3i9v s VAL 82 N 1.78 4.78 -0.04 1.09 1.01 0.17 -1.28 120.40 127.91 3i9v s VAL 82 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 3i9v s VAL 82 Cb -0.16 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 3i9v s VAL 82 CO 0.11 0.40 1.30 0.00 0.00 0.00 0.00 175.10 176.91 3i9v n ALA 84 N 5.46 2.56 -1.73 0.00 0.00 -0.74 -4.74 120.51 121.33 3i9v n ALA 84 Ca 0.12 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 3i9v n ALA 84 Cb 0.45 -0.42 -0.01 0.00 0.00 0.00 0.00 19.45 19.47 3i9v n ALA 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3i9v n THR 85 N -1.86 1.66 0.00 0.00 -1.04 -1.26 -4.16 114.28 107.62 3i9v n THR 85 Ca -0.02 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.58 3i9v n THR 85 Cb 0.30 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 3i9v n THR 85 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3i9v n LEU 86 N 1.13 0.00 -0.29 -4.42 7.94 -1.26 -0.54 117.00 119.55 3i9v n LEU 86 Ca 0.05 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 55.02 3i9v n LEU 86 Cb 0.37 0.00 0.22 0.00 0.53 0.00 0.00 43.42 44.53 3i9v n LEU 86 CO 0.63 0.00 1.10 -1.28 -1.11 0.00 0.00 177.39 176.73 3i9v h SER 87 N 0.00 0.53 0.55 1.96 0.87 -1.96 0.57 113.55 116.07 3i9v h SER 87 Ca 0.00 0.09 -0.15 0.00 -1.23 0.00 0.00 61.79 60.50 3i9v h SER 87 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 3i9v h SER 87 CO 0.00 0.23 -0.67 0.00 -0.53 0.00 0.00 176.83 175.86 3i9v h LYS 89 N 0.07 0.29 0.00 0.00 3.64 0.50 -0.42 116.57 120.65 3i9v h LYS 89 Ca -0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3i9v h LYS 89 Cb 1.19 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3i9v h LYS 89 CO 0.10 0.19 0.00 1.28 -2.27 0.00 0.00 179.45 178.75 3i9v n LEU 90 N -5.08 0.00 -0.01 5.20 4.32 0.17 -1.82 117.00 119.79 3i9v n LEU 90 Ca 0.07 0.10 0.06 0.00 -0.02 0.00 0.00 56.01 56.22 3i9v n LEU 90 Cb 0.27 -0.10 -0.10 0.00 -1.62 0.00 0.00 43.42 41.87 3i9v n LEU 90 CO 0.20 -0.03 -0.66 0.00 -1.22 0.00 0.00 177.39 175.67 3i9v n ALA 91 N -1.10 2.48 0.00 -1.18 0.00 -0.75 -4.99 120.51 114.96 3i9v n ALA 91 Ca 0.13 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.24 3i9v n ALA 91 Cb 0.10 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.10 3i9v n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i9v n GLY 92 N 1.75 -0.13 0.39 0.00 0.00 -0.73 -4.55 105.19 101.92 3i9v n GLY 92 Ca -0.03 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 3i9v n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i9v h ALA 93 N 0.00 -0.12 -0.35 4.61 0.00 -1.19 -0.80 119.26 121.42 3i9v h ALA 93 Ca 0.00 0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.17 3i9v h ALA 93 Cb 0.00 1.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3i9v h ALA 93 CO 0.00 -0.75 -0.01 0.93 0.00 0.00 0.00 179.25 179.42 3i9v h GLU 94 N -0.07 0.08 -0.26 0.00 4.39 -1.84 -0.34 114.58 116.53 3i9v h GLU 94 Ca 0.26 -0.00 0.06 0.00 0.34 0.00 0.00 59.36 60.02 3i9v h GLU 94 Cb 0.55 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 29.11 3i9v h GLU 94 CO -0.87 0.05 -0.18 0.93 -1.16 0.00 0.00 179.01 177.78 3i9v h GLU 95 N 0.08 -0.16 -0.98 2.33 5.08 -1.54 -0.53 114.58 118.86 3i9v h GLU 95 Ca 0.17 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.62 3i9v h GLU 95 Cb 0.24 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 3i9v h GLU 95 CO -0.30 -0.11 0.63 1.25 -1.00 0.00 0.00 179.01 179.49 3i9v h LEU 96 N -0.17 0.98 -0.55 1.33 5.85 -0.64 0.12 115.31 122.23 3i9v h LEU 96 Ca 0.14 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 3i9v h LEU 96 Cb 0.38 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3i9v h LEU 96 CO -0.36 0.61 0.10 -0.25 -0.34 0.00 0.00 178.44 178.19 3i9v h TRP 97 N 1.10 0.97 -0.61 1.25 2.91 -0.42 -0.79 115.95 120.37 3i9v h TRP 97 Ca 0.43 -0.13 -0.04 0.00 1.13 0.00 0.00 58.89 60.28 3i9v h TRP 97 Cb 0.23 -0.27 -0.03 0.00 -0.51 0.00 0.00 29.16 28.59 3i9v h TRP 97 CO -0.00 0.86 0.23 -0.44 -1.03 0.00 0.00 178.44 178.06 3i9v h ASP 98 N 0.81 0.86 0.60 2.65 3.32 0.46 -1.81 116.42 123.30 3i9v h ASP 98 Ca 0.17 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 3i9v h ASP 98 Cb 0.40 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.74 3i9v h ASP 98 CO 0.01 0.81 -0.29 0.22 -1.72 0.00 0.00 179.24 178.27 3i9v h TYR 99 N 0.86 -0.75 -0.46 4.55 3.20 -0.92 -2.24 116.97 121.21 3i9v h TYR 99 Ca 0.20 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.14 3i9v h TYR 99 Cb 0.23 0.25 -0.10 0.00 1.54 0.00 0.00 36.73 38.64 3i9v h TYR 99 CO 0.01 -0.42 -0.35 1.25 -1.64 0.00 0.00 178.16 177.01 3i9v h LEU 100 N -1.11 -1.19 -0.96 2.82 5.85 -1.15 0.26 115.31 119.84 3i9v h LEU 100 Ca -0.08 0.21 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 3i9v h LEU 100 Cb 0.67 0.56 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 3i9v h LEU 100 CO 0.14 -0.33 -0.08 0.74 -0.34 0.00 0.00 178.44 178.57 3i9v h THR 101 N -0.24 1.24 0.00 1.05 2.02 -1.42 -1.62 112.91 113.94 3i9v h THR 101 Ca 0.18 -1.05 -0.16 0.00 0.77 0.00 0.00 66.41 66.15 3i9v h THR 101 Cb 0.55 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3i9v h THR 101 CO -0.59 0.36 -0.78 -0.08 0.37 0.00 0.00 175.52 174.79 3i9v h GLU 102 N 0.62 0.00 0.00 6.66 4.81 -0.73 0.17 114.58 126.12 3i9v h GLU 102 Ca 0.12 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3i9v h GLU 102 Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 3i9v h GLU 102 CO 0.03 0.78 -0.00 1.15 -0.73 0.00 0.00 179.01 180.24 3i9v h THR 103 N 0.00 1.55 0.00 0.32 2.02 -0.25 -3.34 112.91 113.22 3i9v h THR 103 Ca -0.01 -1.64 -0.12 0.00 0.77 0.00 0.00 66.41 65.41 3i9v h THR 103 Cb 1.40 2.67 -0.02 0.00 -1.74 0.00 0.00 68.15 70.46 3i9v h THR 103 CO 0.10 0.43 -0.58 -0.07 0.37 0.00 0.00 175.52 175.77 3i9v h LEU 104 N -0.70 0.00 0.99 2.58 3.38 -1.37 -3.48 115.31 116.70 3i9v h LEU 104 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 3i9v h LEU 104 Cb 0.70 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 3i9v h LEU 104 CO 0.00 0.58 -0.20 0.61 0.09 0.00 0.00 178.44 179.52 3i9v n GLY 105 N 1.09 0.07 3.37 0.83 0.00 0.60 -4.92 105.19 106.22 3i9v n GLY 105 Ca 0.01 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.18 3i9v n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i9v s ILE 106 N -2.43 2.26 0.46 -0.61 1.01 -1.16 -5.02 121.20 115.71 3i9v s ILE 106 Ca 0.01 -1.43 0.05 0.00 0.00 0.00 0.00 60.65 59.28 3i9v s ILE 106 Cb -0.01 -1.91 0.08 0.00 0.01 0.00 0.00 42.46 40.63 3i9v s ILE 106 CO 0.02 0.31 0.64 0.61 0.00 0.00 0.00 174.94 176.51 3i9v n GLY 107 N 1.57 1.57 0.09 6.18 0.00 -1.26 -4.77 105.19 108.57 3i9v n GLY 107 Ca -0.17 -2.14 -0.10 0.00 0.00 0.00 0.00 46.02 43.60 3i9v n GLY 107 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i9v h PRO 108 N 0.00 -0.04 0.00 1.61 0.13 -2.02 -3.10 132.00 128.58 3i9v h PRO 108 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3i9v h PRO 108 Cb 0.92 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3i9v h PRO 108 CO 0.28 -0.02 0.00 0.41 -0.23 0.00 0.00 178.00 178.44 3i9v n GLY 109 N -1.16 -1.19 4.02 1.56 0.00 -1.26 -4.44 105.19 102.72 3i9v n GLY 109 Ca -0.05 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 3i9v n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3i9v s GLU 110 N -2.88 2.00 -0.02 1.61 2.02 -1.17 -5.01 118.70 115.24 3i9v s GLU 110 Ca 0.14 -1.51 -0.03 0.00 0.02 0.00 0.00 54.97 53.59 3i9v s GLU 110 Cb 0.15 -2.52 0.01 0.00 0.10 0.00 0.00 34.13 31.86 3i9v s GLU 110 CO 0.38 -1.15 0.08 0.54 0.02 0.00 0.00 175.26 175.13 3i9v s VAL 111 N -2.87 0.01 0.76 2.63 0.11 -1.26 -4.58 120.40 115.19 3i9v s VAL 111 Ca 0.64 -0.11 -0.15 0.00 -2.93 0.00 0.00 61.98 59.43 3i9v s VAL 111 Cb -0.05 -0.15 -0.00 0.00 -1.53 0.00 0.00 36.38 34.65 3i9v s VAL 111 CO 0.42 -0.06 0.71 1.07 -3.33 0.00 0.00 175.10 173.91 3i9v n THR 112 N 2.83 1.90 -0.36 5.04 5.66 -0.92 -4.82 114.28 123.62 3i9v n THR 112 Ca -0.14 -0.35 0.04 0.00 -3.05 0.00 0.00 64.05 60.55 3i9v n THR 112 Cb 0.59 -0.88 0.20 0.00 -1.55 0.00 0.00 70.33 68.69 3i9v n THR 112 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 3i9v h PRO 113 N -0.52 1.09 0.00 1.09 0.13 -1.93 -0.88 132.00 130.98 3i9v h PRO 113 Ca -0.46 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3i9v h PRO 113 Cb 1.33 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3i9v h PRO 113 CO 0.43 0.72 0.00 -0.40 -0.23 0.00 0.00 178.00 178.52 3i9v n ASP 114 N -4.51 0.00 -2.09 1.44 5.75 -1.26 -4.92 116.55 110.96 3i9v n ASP 114 Ca 0.16 -0.62 -0.13 0.00 -0.01 0.00 0.00 54.79 54.18 3i9v n ASP 114 Cb 0.21 -0.07 0.04 0.00 -1.03 0.00 0.00 41.12 40.27 3i9v n ASP 114 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i9v n GLY 115 N 0.63 0.06 0.00 6.12 0.00 -0.33 -4.91 105.19 106.75 3i9v n GLY 115 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3i9v n GLY 115 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3i9v n LEU 116 N -2.82 0.00 -3.57 0.99 -0.00 -1.26 -3.15 117.00 107.19 3i9v n LEU 116 Ca -0.02 -0.03 -0.28 0.00 -0.00 0.00 0.00 56.01 55.68 3i9v n LEU 116 Cb 0.55 0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.81 3i9v n LEU 116 CO 0.33 0.03 -0.33 -0.36 -0.00 0.00 0.00 177.39 177.07 3i9v s PHE 117 N 0.00 0.25 0.11 1.47 0.08 -1.26 -0.95 117.98 117.68 3i9v s PHE 117 Ca 0.00 -0.62 0.06 0.00 0.12 0.00 0.00 56.93 56.49 3i9v s PHE 117 Cb 0.00 -0.80 -0.04 0.00 -0.57 0.00 0.00 43.02 41.61 3i9v s PHE 117 CO 0.00 -0.69 -0.01 -1.12 -0.10 0.00 0.00 175.22 173.30 3i9v s SER 118 N 2.12 4.88 0.08 1.36 0.01 -1.17 -2.16 113.70 118.84 3i9v s SER 118 Ca 0.06 -0.26 0.07 0.00 1.31 0.00 0.00 55.95 57.13 3i9v s SER 118 Cb -0.16 -1.11 -0.03 0.00 0.21 0.00 0.00 66.02 64.93 3i9v s SER 118 CO -0.25 0.15 -0.18 0.68 0.41 0.00 0.00 173.24 174.06 3i9v s VAL 119 N -1.40 1.46 -0.23 3.43 -7.23 -1.26 0.86 120.40 116.03 3i9v s VAL 119 Ca 0.26 -1.41 -0.15 0.00 -1.81 0.00 0.00 61.98 58.86 3i9v s VAL 119 Cb -0.11 -1.35 0.07 0.00 0.56 0.00 0.00 36.38 35.55 3i9v s VAL 119 CO 0.18 -0.10 0.57 -1.58 -0.31 0.00 0.00 175.10 173.85 3i9v s GLN 120 N -1.77 0.60 0.12 4.82 0.74 -0.38 -4.29 119.66 119.50 3i9v s GLN 120 Ca 0.03 0.95 -0.27 0.00 0.05 0.00 0.00 55.36 56.13 3i9v s GLN 120 Cb -0.10 0.15 -0.07 0.00 1.10 0.00 0.00 33.01 34.10 3i9v s GLN 120 CO 0.03 -0.13 0.84 0.15 -0.55 0.00 0.00 175.29 175.63 3i9v s LYS 121 N 1.12 4.61 0.42 1.67 1.02 -1.26 0.43 119.74 127.74 3i9v s LYS 121 Ca -0.07 1.24 0.03 0.00 0.02 0.00 0.00 55.97 57.20 3i9v s LYS 121 Cb -0.06 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 3i9v s LYS 121 CO -0.11 0.38 0.10 0.08 -0.92 0.00 0.00 175.35 174.88 3i9v s VAL 122 N -0.51 0.79 0.44 3.17 1.01 0.11 -4.85 120.40 120.56 3i9v s VAL 122 Ca 0.40 -2.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.37 3i9v s VAL 122 Cb -0.23 -2.38 0.09 0.00 0.00 0.00 0.00 36.38 33.86 3i9v s VAL 122 CO 0.27 0.00 0.60 -0.62 0.00 0.00 0.00 175.10 175.35 3i9v n GLU 123 N -0.95 0.14 -1.71 2.72 -0.58 -1.26 -1.78 120.64 117.22 3i9v n GLU 123 Ca -0.08 -1.60 -0.59 0.00 -0.42 0.00 0.00 57.16 54.48 3i9v n GLU 123 Cb 0.66 -0.41 -0.08 0.00 -0.57 0.00 0.00 31.44 31.04 3i9v n GLU 123 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3i9v n LEU 125 N 5.09 0.12 -0.69 0.00 4.77 -1.26 -4.92 117.00 120.10 3i9v n LEU 125 Ca 0.27 0.40 -0.01 0.00 -0.03 0.00 0.00 56.01 56.64 3i9v n LEU 125 Cb 0.10 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 3i9v n LEU 125 CO 0.82 0.02 0.01 0.61 -1.33 0.00 0.00 177.39 177.52 3i9v n GLY 126 N 1.50 0.82 2.33 -0.72 0.00 -1.26 -4.99 105.19 102.87 3i9v n GLY 126 Ca 0.07 -0.61 -0.17 0.00 0.00 0.00 0.00 46.02 45.31 3i9v n GLY 126 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i9v n SER 127 N 0.94 -0.16 0.17 1.61 3.41 -1.26 -4.99 113.62 113.33 3i9v n SER 127 Ca -0.00 -3.11 0.04 0.00 -0.26 0.00 0.00 58.87 55.53 3i9v n SER 127 Cb 0.50 0.04 0.23 0.00 -0.26 0.00 0.00 64.21 64.73 3i9v n SER 127 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i9v n HIS 129 N -3.47 0.00 -2.48 0.00 1.44 -1.26 -3.03 115.22 106.42 3i9v n HIS 129 Ca 0.00 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.48 3i9v n HIS 129 Cb 0.59 -0.46 0.01 0.00 0.12 0.00 0.00 29.99 30.25 3i9v n HIS 129 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 3i9v n THR 130 N -1.46 2.10 -2.80 0.61 -2.24 -0.99 -4.74 114.28 104.77 3i9v n THR 130 Ca 0.05 -4.47 -0.29 0.00 -2.27 0.00 0.00 64.05 57.07 3i9v n THR 130 Cb 0.20 -0.84 -0.02 0.00 -2.10 0.00 0.00 70.33 67.57 3i9v n THR 130 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i9v s ALA 131 N -3.48 3.37 0.40 6.98 0.00 -1.17 -1.39 121.76 126.47 3i9v s ALA 131 Ca 0.44 -0.29 -0.23 0.00 0.00 0.00 0.00 51.96 51.88 3i9v s ALA 131 Cb 0.41 -2.67 -0.10 0.00 0.00 0.00 0.00 23.12 20.76 3i9v s ALA 131 CO -0.12 -0.10 0.99 -1.25 0.00 0.00 0.00 175.76 175.28 3i9v s PRO 132 N -4.09 4.23 0.10 0.00 0.04 -1.26 -4.57 135.00 129.44 3i9v s PRO 132 Ca 0.50 1.32 0.07 0.00 0.04 0.00 0.00 61.00 62.93 3i9v s PRO 132 Cb -0.10 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 3i9v s PRO 132 CO 0.35 -0.05 -0.12 0.08 0.04 0.00 0.00 177.00 177.30 3i9v s VAL 133 N -1.87 3.23 -0.03 -0.36 1.01 -1.26 -1.11 120.40 120.01 3i9v s VAL 133 Ca 0.59 -1.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 3i9v s VAL 133 Cb -0.16 -2.49 0.03 0.00 0.00 0.00 0.00 36.38 33.76 3i9v s VAL 133 CO 0.21 0.14 0.05 -0.63 0.00 0.00 0.00 175.10 174.86 3i9v s ILE 134 N -1.17 -0.08 -0.22 2.22 1.01 -1.08 -2.49 121.20 119.40 3i9v s ILE 134 Ca 0.20 0.28 -0.05 0.00 0.00 0.00 0.00 60.65 61.08 3i9v s ILE 134 Cb -0.11 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.23 3i9v s ILE 134 CO 0.12 0.12 0.00 -1.58 0.00 0.00 0.00 174.94 173.60 3i9v s GLN 135 N 1.43 3.55 0.00 2.79 0.74 -0.40 0.72 119.66 128.49 3i9v s GLN 135 Ca -0.05 -0.54 0.00 0.00 0.05 0.00 0.00 55.36 54.82 3i9v s GLN 135 Cb -0.13 -3.10 0.00 0.00 1.10 0.00 0.00 33.01 30.88 3i9v s GLN 135 CO -0.03 -0.09 0.00 0.28 -0.55 0.00 0.00 175.29 174.90 3i9v n VAL 136 N 4.54 0.00 -0.03 1.34 0.31 -1.26 -1.94 118.33 121.29 3i9v n VAL 136 Ca -0.17 0.08 -0.03 0.00 -0.01 0.00 0.00 64.34 64.20 3i9v n VAL 136 Cb 0.51 -0.70 -0.01 0.00 -0.91 0.00 0.00 33.84 32.73 3i9v n VAL 136 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3i9v n ASN 137 N 0.00 0.71 -0.70 4.52 3.02 -1.26 -4.18 115.26 117.36 3i9v n ASN 137 Ca 0.00 0.12 -0.01 0.00 -0.03 0.00 0.00 54.58 54.66 3i9v n ASN 137 Cb 0.00 -0.54 -0.01 0.00 -0.61 0.00 0.00 39.78 38.62 3i9v n ASN 137 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3i9v n ASP 138 N -3.21 -0.05 -4.20 6.41 5.75 -1.26 -5.02 116.55 114.97 3i9v n ASP 138 Ca -0.05 -1.58 -0.19 0.00 -0.01 0.00 0.00 54.79 52.96 3i9v n ASP 138 Cb 0.18 -0.04 -0.12 0.00 -1.03 0.00 0.00 41.12 40.10 3i9v n ASP 138 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 3i9v s GLU 139 N 0.00 0.89 0.00 0.11 -1.05 -1.26 -5.08 118.70 112.30 3i9v s GLU 139 Ca 0.04 -1.01 0.00 0.00 -0.15 0.00 0.00 54.97 53.85 3i9v s GLU 139 Cb 0.05 -0.93 0.00 0.00 -0.44 0.00 0.00 34.13 32.80 3i9v s GLU 139 CO -0.02 0.21 0.00 -2.30 0.95 0.00 0.00 175.26 174.10 3i9v n PRO 140 N 1.20 0.00 -1.10 -4.83 -0.02 -1.26 -4.17 135.00 124.82 3i9v n PRO 140 Ca -0.21 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.93 3i9v n PRO 140 Cb 0.54 0.00 0.10 0.00 -0.02 0.00 0.00 33.50 34.12 3i9v n PRO 140 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3i9v n TYR 141 N 0.00 -0.17 -3.37 6.00 4.01 -1.26 -4.65 117.16 117.72 3i9v n TYR 141 Ca 0.00 0.34 -0.46 0.00 -0.16 0.00 0.00 57.90 57.62 3i9v n TYR 141 Cb 0.00 -1.96 -0.03 0.00 -0.31 0.00 0.00 39.34 37.04 3i9v n TYR 141 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3i9v s VAL 142 N -2.10 5.41 0.47 -0.72 1.01 0.22 -4.99 120.40 119.71 3i9v s VAL 142 Ca 0.66 -2.46 -0.17 0.00 0.00 0.00 0.00 61.98 60.01 3i9v s VAL 142 Cb -0.30 -4.36 -0.08 0.00 0.00 0.00 0.00 36.38 31.64 3i9v s VAL 142 CO 0.57 -1.00 0.94 -1.61 0.00 0.00 0.00 175.10 174.00 3i9v s GLU 143 N 0.22 4.00 -0.93 2.72 2.02 -1.26 -2.63 118.70 122.83 3i9v s GLU 143 Ca 0.17 0.92 -0.00 0.00 0.02 0.00 0.00 54.97 56.08 3i9v s GLU 143 Cb -0.12 -2.19 -0.00 0.00 0.10 0.00 0.00 34.13 31.91 3i9v s GLU 143 CO -0.08 -0.16 0.78 0.00 0.02 0.00 0.00 175.26 175.82 3i9v s VAL 145 N -3.28 3.78 0.91 0.00 1.01 -0.27 -4.86 120.40 117.68 3i9v s VAL 145 Ca 0.03 -0.79 -0.12 0.00 0.00 0.00 0.00 61.98 61.10 3i9v s VAL 145 Cb -0.00 -4.73 0.14 0.00 0.00 0.00 0.00 36.38 31.79 3i9v s VAL 145 CO 0.57 -1.59 1.14 0.42 0.00 0.00 0.00 175.10 175.65 3i9v s THR 146 N 6.84 2.00 0.49 3.92 -4.23 -1.26 -4.55 115.64 118.85 3i9v s THR 146 Ca 0.56 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 61.22 3i9v s THR 146 Cb -0.02 -2.76 0.29 0.00 1.34 0.00 0.00 72.50 71.36 3i9v s THR 146 CO -0.04 0.00 2.10 -0.09 -0.54 0.00 0.00 174.62 176.06 3i9v h ARG 147 N -1.49 0.14 0.05 3.99 2.43 -1.99 0.19 114.38 117.70 3i9v h ARG 147 Ca -0.50 -0.01 -0.22 0.00 -0.81 0.00 0.00 59.98 58.43 3i9v h ARG 147 Cb 1.33 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 3i9v h ARG 147 CO 0.62 0.09 -1.19 0.00 -1.51 0.00 0.00 179.97 177.98 3i9v h ALA 148 N 1.90 0.21 -1.00 2.80 0.00 -1.97 -3.18 119.26 118.02 3i9v h ALA 148 Ca 0.08 -1.09 0.19 0.00 0.00 0.00 0.00 54.91 54.09 3i9v h ALA 148 Cb 0.14 0.55 -0.11 0.00 0.00 0.00 0.00 17.79 18.37 3i9v h ALA 148 CO -0.01 0.70 0.60 -0.09 0.00 0.00 0.00 179.25 180.45 3i9v h ARG 149 N -0.68 0.74 0.97 0.00 2.43 -1.83 -2.83 114.38 113.19 3i9v h ARG 149 Ca -0.29 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 58.79 3i9v h ARG 149 Cb 1.47 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 30.87 3i9v h ARG 149 CO -0.07 0.49 -0.47 1.25 -1.51 0.00 0.00 179.97 179.66 3i9v h LEU 150 N 0.76 -1.11 -1.71 3.80 7.12 -0.71 -2.48 115.31 120.98 3i9v h LEU 150 Ca 0.57 0.04 0.19 0.00 0.13 0.00 0.00 57.88 58.81 3i9v h LEU 150 Cb 0.88 0.29 -0.05 0.00 -0.53 0.00 0.00 40.66 41.25 3i9v h LEU 150 CO -0.38 -0.77 0.54 -0.33 -0.13 0.00 0.00 178.44 177.37 3i9v h GLU 151 N -1.34 0.25 -0.18 1.25 5.08 -1.48 0.18 114.58 118.34 3i9v h GLU 151 Ca -0.13 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.13 3i9v h GLU 151 Cb 1.00 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 3i9v h GLU 151 CO 0.22 0.17 -0.21 0.00 -1.00 0.00 0.00 179.01 178.18 3i9v h ALA 152 N 1.63 0.27 -0.51 3.43 0.00 -1.49 -1.45 119.26 121.14 3i9v h ALA 152 Ca 0.40 -0.36 0.10 0.00 0.00 0.00 0.00 54.91 55.04 3i9v h ALA 152 Cb 1.16 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 3i9v h ALA 152 CO -0.10 0.21 0.02 1.25 0.00 0.00 0.00 179.25 180.63 3i9v h LEU 153 N 0.11 -0.17 0.10 0.00 7.12 -0.26 0.16 115.31 122.36 3i9v h LEU 153 Ca 0.02 0.12 0.01 0.00 0.13 0.00 0.00 57.88 58.16 3i9v h LEU 153 Cb 0.77 0.20 -0.02 0.00 -0.53 0.00 0.00 40.66 41.07 3i9v h LEU 153 CO 0.05 -0.06 -0.17 -0.07 -0.13 0.00 0.00 178.44 178.06 3i9v h LEU 154 N 0.14 -0.48 -0.71 2.25 3.38 -0.84 -2.38 115.31 116.67 3i9v h LEU 154 Ca 0.26 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 58.17 3i9v h LEU 154 Cb 0.38 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3i9v h LEU 154 CO -0.41 -0.25 -0.52 0.00 0.09 0.00 0.00 178.44 177.36 3i9v h ALA 155 N 0.50 0.90 0.40 1.53 0.00 -1.08 -0.17 119.26 121.34 3i9v h ALA 155 Ca 0.02 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 3i9v h ALA 155 Cb 0.35 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3i9v h ALA 155 CO -0.10 0.65 -0.41 0.78 0.00 0.00 0.00 179.25 180.17 3i9v h GLY 156 N 2.21 -0.98 1.36 0.00 0.00 -0.44 -1.67 103.07 103.55 3i9v h GLY 156 Ca -0.01 0.48 -0.08 0.00 0.00 0.00 0.00 47.33 47.72 3i9v h GLY 156 CO 0.07 -0.33 -0.03 1.41 0.00 0.00 0.00 176.54 177.66 3i9v h LEU 157 N -0.83 0.75 -2.40 3.11 3.38 -1.37 -2.25 115.31 115.70 3i9v h LEU 157 Ca -0.03 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 3i9v h LEU 157 Cb 0.74 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 3i9v h LEU 157 CO -0.07 0.84 -0.02 -0.09 0.09 0.00 0.00 178.44 179.19 3i9v h ARG 158 N 0.72 0.00 -0.33 1.13 2.43 -0.84 -0.90 114.38 116.59 3i9v h ARG 158 Ca 0.14 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3i9v h ARG 158 Cb 0.49 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3i9v h ARG 158 CO 0.02 0.02 0.00 0.00 -1.51 0.00 0.00 179.97 178.51 3i9v n ALA 159 N -2.14 3.20 -1.21 2.80 0.00 -0.64 -4.97 120.51 117.56 3i9v n ALA 159 Ca -0.02 -2.24 -0.07 0.00 0.00 0.00 0.00 53.44 51.11 3i9v n ALA 159 Cb 0.16 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 3i9v n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i9v n GLY 160 N -0.27 0.93 3.68 0.00 0.00 -0.34 -4.99 105.19 104.20 3i9v n GLY 160 Ca 0.23 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 3i9v n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i9v s LYS 161 N -2.57 4.32 0.21 1.61 1.02 -0.88 -4.97 119.74 118.49 3i9v s LYS 161 Ca 0.00 1.74 -0.32 0.00 0.02 0.00 0.00 55.97 57.41 3i9v s LYS 161 Cb 0.00 -3.59 -0.12 0.00 -0.52 0.00 0.00 37.83 33.60 3i9v s LYS 161 CO 0.00 -0.51 1.72 2.89 -0.92 0.00 0.00 175.35 178.54 3i9v n ARG 162 N 5.40 2.79 -0.27 1.68 1.85 -1.26 -4.43 116.66 122.42 3i9v n ARG 162 Ca 0.12 1.01 0.06 0.00 -1.00 0.00 0.00 57.85 58.03 3i9v n ARG 162 Cb 0.45 -2.85 0.20 0.00 -1.05 0.00 0.00 32.46 29.21 3i9v n ARG 162 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 3i9v h LEU 163 N 6.68 0.43 0.00 2.89 6.46 -1.95 -2.19 115.31 127.63 3i9v h LEU 163 Ca -0.43 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.42 3i9v h LEU 163 Cb 1.20 0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.16 3i9v h LEU 163 CO 0.95 0.19 0.18 -1.84 -0.62 0.00 0.00 178.44 177.30 3i9v n GLU 164 N -4.92 0.00 -2.77 1.25 0.28 -1.26 -1.98 120.64 111.24 3i9v n GLU 164 Ca 0.15 0.26 -0.10 0.00 -0.16 0.00 0.00 57.16 57.31 3i9v n GLU 164 Cb 0.40 -1.68 0.04 0.00 1.43 0.00 0.00 31.44 31.63 3i9v n GLU 164 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 3i9v n GLU 165 N -1.23 1.11 -3.92 3.44 0.28 -0.82 -5.08 120.64 114.41 3i9v n GLU 165 Ca 0.00 -2.84 -0.31 0.00 -0.16 0.00 0.00 57.16 53.85 3i9v n GLU 165 Cb 0.18 -1.04 -0.04 0.00 1.43 0.00 0.00 31.44 31.97 3i9v n GLU 165 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3i9v s ILE 166 N -1.95 5.37 -0.26 3.84 1.01 -0.84 -4.83 121.20 123.54 3i9v s ILE 166 Ca 0.28 -0.37 -0.13 0.00 0.00 0.00 0.00 60.65 60.43 3i9v s ILE 166 Cb 0.41 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 3i9v s ILE 166 CO -0.02 0.17 0.29 -1.83 0.00 0.00 0.00 174.94 173.55 3i9v s GLU 167 N -2.41 4.01 -0.25 2.79 -1.05 -1.26 -5.06 118.70 115.47 3i9v s GLU 167 Ca 0.34 -0.10 -0.07 0.00 -0.15 0.00 0.00 54.97 54.98 3i9v s GLU 167 Cb -0.13 -3.63 -0.03 0.00 -0.44 0.00 0.00 34.13 29.90 3i9v s GLU 167 CO 0.26 -0.18 0.07 -0.51 0.95 0.00 0.00 175.26 175.84 3i9v s LEU 168 N 1.78 3.44 0.67 1.83 1.43 -1.26 -4.88 118.68 121.69 3i9v s LEU 168 Ca 0.12 -0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 52.80 3i9v s LEU 168 Cb -0.16 -1.91 -0.06 0.00 0.03 0.00 0.00 46.19 44.10 3i9v s LEU 168 CO 0.09 -0.04 0.52 -0.81 0.23 0.00 0.00 176.35 176.34 3i9v n PRO 169 N 4.92 0.39 -0.67 1.29 -0.04 -1.26 -4.75 135.00 134.88 3i9v n PRO 169 Ca -0.16 0.17 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 3i9v n PRO 169 Cb 0.51 -1.78 -0.03 0.00 -0.04 0.00 0.00 33.50 32.17 3i9v n PRO 169 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3i9v n GLY 170 N 1.71 -1.78 3.25 0.55 0.00 -1.26 -4.83 105.19 102.83 3i9v n GLY 170 Ca 0.11 -1.35 -0.24 0.00 0.00 0.00 0.00 46.02 44.53 3i9v n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i9v s LYS 171 N -1.89 1.27 -0.09 1.61 -2.85 -1.26 -5.14 119.74 111.39 3i9v s LYS 171 Ca 0.00 -0.98 -0.02 0.00 -1.00 0.00 0.00 55.97 53.97 3i9v s LYS 171 Cb 0.00 -1.41 0.04 0.00 -2.06 0.00 0.00 37.83 34.40 3i9v s LYS 171 CO 0.00 0.35 0.03 0.00 0.10 0.00 0.00 175.35 175.83 3i9v n GLY 173 N 5.20 -3.62 0.00 0.00 0.00 -1.26 -5.08 105.19 100.43 3i9v n GLY 173 Ca -0.06 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.61 3i9v n GLY 173 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3i9v n HIS 174 N -5.55 0.00 1.12 1.61 -0.00 -1.26 -4.82 115.22 106.32 3i9v n HIS 174 Ca 0.14 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.45 3i9v n HIS 174 Cb 0.60 0.00 0.28 0.00 -0.12 0.00 0.00 29.99 30.75 3i9v n HIS 174 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 3i9v n HIS 175 N 0.00 0.00 -4.16 1.57 1.44 -1.26 -4.80 115.22 108.02 3i9v n HIS 175 Ca 0.00 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.55 3i9v n HIS 175 Cb 0.00 -0.16 -0.12 0.00 0.12 0.00 0.00 29.99 29.83 3i9v n HIS 175 CO 0.00 0.00 0.00 0.14 -2.81 0.00 0.00 176.34 173.67 3i9v s VAL 176 N -2.72 0.85 -0.06 0.61 -7.23 -1.26 -5.07 120.40 105.53 3i9v s VAL 176 Ca 0.18 -1.11 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 3i9v s VAL 176 Cb 0.18 -0.84 0.04 0.00 0.56 0.00 0.00 36.38 36.32 3i9v s VAL 176 CO 0.61 -0.23 0.12 -2.28 -0.31 0.00 0.00 175.10 173.01 3i9v s HIS 177 N -1.17 -0.11 -0.25 2.82 2.46 -1.26 -4.42 115.29 113.35 3i9v s HIS 177 Ca -0.04 0.42 -0.13 0.00 0.47 0.00 0.00 55.06 55.78 3i9v s HIS 177 Cb -0.09 -0.18 -0.04 0.00 -0.13 0.00 0.00 32.58 32.14 3i9v s HIS 177 CO 0.01 -0.17 0.28 -2.00 -2.47 0.00 0.00 174.74 170.39 3i9v s GLU 178 N 1.43 4.05 0.20 2.88 2.56 -1.26 -5.03 118.70 123.54 3i9v s GLU 178 Ca -0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 54.97 54.77 3i9v s GLU 178 Cb -0.12 -3.60 -0.05 0.00 2.00 0.00 0.00 34.13 32.36 3i9v s GLU 178 CO -0.05 -0.11 0.45 0.08 -0.56 0.00 0.00 175.26 175.07 3i9v s VAL 179 N 1.56 5.11 0.00 3.70 1.01 -1.26 -4.96 120.40 125.55 3i9v s VAL 179 Ca 0.12 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.11 3i9v s VAL 179 Cb -0.15 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.56 3i9v s VAL 179 CO 0.08 -0.12 0.00 -0.62 0.00 0.00 0.00 175.10 174.45