#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 -0.21 -5.13 3.72 -1.26 -3.82 117.46 110.76 3i9v n PHE 4 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3i9v n PHE 4 Cb 0.00 -0.18 0.11 0.00 -0.94 0.00 0.00 39.48 38.47 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 0.42 0.29 -0.27 4.37 3.04 -2.05 -2.70 116.42 119.52 3i9v h ASP 5 Ca 0.00 0.07 0.06 0.00 -3.24 0.00 0.00 57.03 53.93 3i9v h ASP 5 Cb 0.51 0.03 -0.08 0.00 -1.04 0.00 0.00 39.33 38.76 3i9v h ASP 5 CO 0.00 0.17 -0.29 -0.78 -2.04 0.00 0.00 179.24 176.31 3i9v h ASP 6 N 0.46 -0.93 -2.60 4.15 1.82 -2.10 -3.37 116.42 113.84 3i9v h ASP 6 Ca 0.31 0.16 -0.65 0.00 -0.39 0.00 0.00 57.03 56.46 3i9v h ASP 6 Cb 0.36 0.43 -0.39 0.00 0.68 0.00 0.00 39.33 40.41 3i9v h ASP 6 CO -0.29 -0.31 -0.30 2.29 -1.61 0.00 0.00 179.24 179.02 3i9v n LYS 7 N -5.40 2.75 -0.14 0.28 0.00 -1.02 -4.86 118.16 109.78 3i9v n LYS 7 Ca -0.01 -4.60 0.09 0.00 -0.00 0.00 0.00 58.31 53.79 3i9v n LYS 7 Cb 0.32 -2.33 0.29 0.00 -0.00 0.00 0.00 35.03 33.31 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 1.29 1.91 0.07 -1.58 6.02 -1.24 -2.72 117.38 121.13 3i9v n GLN 8 Ca 0.27 -1.39 -0.07 0.00 -0.01 0.00 0.00 57.00 55.80 3i9v n GLN 8 Cb 0.38 -1.39 -0.08 0.00 1.02 0.00 0.00 30.24 30.17 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 2.59 0.02 0.21 1.08 2.03 -1.92 -2.96 116.42 117.48 3i9v h ASP 9 Ca 0.00 -0.02 -0.19 0.00 -0.73 0.00 0.00 57.03 56.09 3i9v h ASP 9 Cb 0.58 -0.01 -0.00 0.00 -0.83 0.00 0.00 39.33 39.07 3i9v h ASP 9 CO 0.00 0.97 -0.72 0.15 -1.03 0.00 0.00 179.24 178.60 3i9v h PHE 10 N 0.01 0.60 0.03 4.15 3.04 -1.92 -3.10 116.94 119.74 3i9v h PHE 10 Ca -0.02 -0.26 -0.00 0.00 3.98 0.00 0.00 57.97 61.67 3i9v h PHE 10 Cb 1.69 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 40.11 3i9v h PHE 10 CO 0.00 1.02 -0.02 -0.07 -2.02 0.00 0.00 178.31 177.23 3i9v h LEU 11 N 0.31 -0.04 -0.09 0.59 3.38 -1.62 -1.97 115.31 115.87 3i9v h LEU 11 Ca -0.03 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.60 3i9v h LEU 11 Cb 1.30 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 42.00 3i9v h LEU 11 CO 0.13 0.37 -0.33 -0.33 0.09 0.00 0.00 178.44 178.36 3i9v h GLU 12 N -0.45 -0.42 -0.38 1.13 5.08 -1.60 -1.14 114.58 116.79 3i9v h GLU 12 Ca -0.00 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.46 3i9v h GLU 12 Cb 0.42 0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.70 3i9v h GLU 12 CO 0.01 -0.28 -0.06 1.49 -1.00 0.00 0.00 179.01 179.17 3i9v h GLU 13 N -0.43 0.03 0.00 2.33 4.81 -1.59 -2.13 114.58 117.60 3i9v h GLU 13 Ca 0.08 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 3i9v h GLU 13 Cb 0.56 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3i9v h GLU 13 CO -0.33 0.02 -0.44 1.79 -0.73 0.00 0.00 179.01 179.32 3i9v h THR 14 N 0.03 0.22 0.00 0.32 1.35 -1.07 -2.96 112.91 110.79 3i9v h THR 14 Ca 0.19 -1.33 -0.08 0.00 -0.55 0.00 0.00 66.41 64.64 3i9v h THR 14 Cb 0.28 1.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 3i9v h THR 14 CO -0.37 0.12 -0.38 -0.26 -0.25 0.00 0.00 175.52 174.38 3i9v h PHE 15 N 0.00 0.00 0.00 4.73 0.04 -0.99 -3.24 116.94 117.48 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 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 3i9v h PHE 15 CO 0.00 0.38 0.00 0.00 -0.60 0.00 0.00 178.31 178.09 3i9v n ALA 16 N -2.27 1.68 0.78 2.45 0.00 -0.82 -2.19 120.51 120.14 3i9v n ALA 16 Ca 0.00 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.64 3i9v n ALA 16 Cb 0.55 -1.37 0.45 0.00 0.00 0.00 0.00 19.45 19.07 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 -2.13 0.16 -4.28 0.00 5.02 -1.22 -4.87 118.16 110.83 3i9v n LYS 17 Ca 0.02 0.11 -0.18 0.00 -2.02 0.00 0.00 58.31 56.24 3i9v n LYS 17 Cb 0.23 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.46 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 -3.07 1.53 0.97 2.13 2.02 -0.93 -5.14 117.35 114.86 3i9v s TYR 18 Ca 0.11 -0.56 -0.13 0.00 -0.37 0.00 0.00 57.07 56.12 3i9v s TYR 18 Cb 0.15 -0.77 0.08 0.00 -0.40 0.00 0.00 41.96 41.03 3i9v s TYR 18 CO 0.59 0.21 0.58 -2.30 -1.57 0.00 0.00 175.55 173.06 3i9v n PRO 19 N 0.24 -0.57 -0.24 -1.71 -0.02 -1.26 -4.86 135.00 126.57 3i9v n PRO 19 Ca -0.13 -0.12 0.05 0.00 -2.02 0.00 0.00 63.50 61.27 3i9v n PRO 19 Cb 0.58 -1.98 0.17 0.00 -0.02 0.00 0.00 33.50 32.25 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 -1.75 0.33 -0.62 0.52 0.13 -2.00 -1.72 132.00 126.89 3i9v h PRO 20 Ca -0.45 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3i9v h PRO 20 Cb 1.29 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3i9v h PRO 20 CO 0.37 0.22 0.00 -0.85 -0.23 0.00 0.00 178.00 177.51 3i9v n GLU 21 N -5.09 3.09 -2.78 0.86 0.00 -1.26 -4.37 120.64 111.09 3i9v n GLU 21 Ca 0.13 -2.21 -0.23 0.00 0.00 0.00 0.00 57.16 54.85 3i9v n GLU 21 Cb 0.42 -1.74 -0.02 0.00 0.00 0.00 0.00 31.44 30.11 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 0.98 4.94 0.13 -1.84 0.00 -0.65 -4.89 105.19 103.86 3i9v n GLY 22 Ca 0.20 -2.43 -0.20 0.00 0.00 0.00 0.00 46.02 43.59 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 2.85 0.25 -0.93 1.61 3.08 -1.76 -3.28 114.38 116.19 3i9v h ARG 23 Ca 0.15 -0.43 0.27 0.00 0.07 0.00 0.00 59.98 60.05 3i9v h ARG 23 Cb 0.80 0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.97 3i9v h ARG 23 CO 0.74 1.15 0.71 0.00 -1.07 0.00 0.00 179.97 181.50 3i9v h ARG 24 N 0.07 0.00 -1.33 0.04 3.08 -1.90 0.11 114.38 114.45 3i9v h ARG 24 Ca -0.40 0.00 0.38 0.00 0.07 0.00 0.00 59.98 60.04 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 0.10 0.00 0.95 0.00 -1.07 0.00 0.00 179.97 179.95 3i9v h ALA 25 N 1.45 3.25 0.00 0.04 0.00 -1.96 0.49 119.26 122.53 3i9v h ALA 25 Ca 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3i9v h ALA 25 Cb 1.86 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.75 3i9v h ALA 25 CO -0.00 -1.63 0.00 0.00 0.00 0.00 0.00 179.25 177.61 3i9v h ALA 26 N 1.34 1.00 -0.58 0.00 0.00 -1.02 -3.29 119.26 116.71 3i9v h ALA 26 Ca 0.63 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.64 3i9v h ALA 26 Cb 2.53 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 20.24 3i9v h ALA 26 CO -0.01 0.00 0.14 0.82 0.00 0.00 0.00 179.25 180.20 3i9v h ILE 27 N 0.00 0.69 0.82 0.00 2.04 -0.20 -1.34 117.51 119.52 3i9v h ILE 27 Ca 0.00 -0.10 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 3i9v h ILE 27 Cb 0.47 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 3i9v h ILE 27 CO 0.00 0.05 -0.48 0.24 0.00 0.00 0.00 178.15 177.96 3i9v h MET 28 N 0.29 -1.17 -0.60 2.37 2.86 -1.78 -1.44 114.93 115.46 3i9v h MET 28 Ca 0.30 0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 58.01 3i9v h MET 28 Cb 0.41 0.26 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 3i9v h MET 28 CO -0.36 -0.78 0.35 -1.00 1.06 0.00 0.00 176.91 176.18 3i9v h PRO 29 N -1.21 0.81 0.50 -0.22 0.13 -1.70 0.00 132.00 130.30 3i9v h PRO 29 Ca -0.11 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 3i9v h PRO 29 Cb 0.96 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3i9v h PRO 29 CO 0.13 0.57 -0.24 -0.07 -0.23 0.00 0.00 178.00 178.17 3i9v h LEU 30 N 0.82 -0.56 -0.86 1.56 3.38 -1.21 -2.22 115.31 116.22 3i9v h LEU 30 Ca 0.22 -0.06 0.19 0.00 0.09 0.00 0.00 57.88 58.32 3i9v h LEU 30 Cb -0.02 0.15 -0.16 0.00 0.09 0.00 0.00 40.66 40.72 3i9v h LEU 30 CO -0.04 -0.26 -0.10 -0.07 0.09 0.00 0.00 178.44 178.05 3i9v h LEU 31 N -0.87 -0.61 -0.62 1.67 -0.00 -1.07 -0.31 115.31 113.50 3i9v h LEU 31 Ca -0.07 0.25 0.09 0.00 -0.00 0.00 0.00 57.88 58.15 3i9v h LEU 31 Cb 0.59 0.47 -0.07 0.00 -0.00 0.00 0.00 40.66 41.65 3i9v h LEU 31 CO 0.11 -0.27 0.25 -0.09 -0.00 0.00 0.00 178.44 178.45 3i9v h ARG 32 N 0.03 0.44 0.84 1.13 2.43 -0.79 -2.71 114.38 115.76 3i9v h ARG 32 Ca 0.45 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.56 3i9v h ARG 32 Cb 0.78 -0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.24 3i9v h ARG 32 CO -0.83 0.29 -0.41 0.00 -1.51 0.00 0.00 179.97 177.51 3i9v h ARG 33 N 0.45 -1.09 -0.81 0.20 3.08 -0.43 -2.45 114.38 113.33 3i9v h ARG 33 Ca 0.31 0.07 0.18 0.00 0.07 0.00 0.00 59.98 60.62 3i9v h ARG 33 Cb 0.35 0.25 -0.15 0.00 0.08 0.00 0.00 29.97 30.50 3i9v h ARG 33 CO -0.28 -0.73 -0.13 0.28 -1.07 0.00 0.00 179.97 178.04 3i9v n VAL 34 N -5.09 -0.34 0.42 2.04 0.31 -1.03 -1.38 118.33 113.26 3i9v n VAL 34 Ca -0.14 1.84 -0.19 0.00 -0.01 0.00 0.00 64.34 65.83 3i9v n VAL 34 Cb 0.45 -2.59 -0.10 0.00 -0.91 0.00 0.00 33.84 30.69 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 -1.11 0.00 5.55 1.08 -1.23 0.33 115.11 119.73 3i9v h GLN 35 Ca 0.43 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.70 3i9v h GLN 35 Cb 0.74 0.25 0.00 0.00 -0.05 0.00 0.00 27.48 28.42 3i9v h GLN 35 CO -0.81 -0.74 0.00 0.00 -0.95 0.00 0.00 178.83 176.33 3i9v n GLN 36 N -5.60 0.14 -0.09 1.46 10.64 -0.48 0.09 117.38 123.54 3i9v n GLN 36 Ca -0.14 0.20 -0.12 0.00 -1.83 0.00 0.00 57.00 55.10 3i9v n GLN 36 Cb 0.48 -1.50 -0.04 0.00 -0.86 0.00 0.00 30.24 28.32 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 -1.32 0.49 0.00 2.61 -0.58 -0.57 -4.76 120.64 116.52 3i9v n GLU 37 Ca 0.05 0.20 0.11 0.00 -0.42 0.00 0.00 57.16 57.10 3i9v n GLU 37 Cb 0.10 -1.35 0.08 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 -4.32 0.03 0.00 3.49 1.02 0.11 -4.98 120.64 116.00 3i9v n GLU 38 Ca -0.20 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 56.91 3i9v n GLU 38 Cb 0.55 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 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 1.50 3.02 3.77 0.62 0.00 0.11 -4.94 105.19 109.27 3i9v n GLY 39 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.73 -0.21 -0.25 1.61 1.48 -1.26 -4.50 118.94 114.08 3i9v s TRP 40 Ca 0.00 -0.16 -0.07 0.00 -1.06 0.00 0.00 56.10 54.80 3i9v s TRP 40 Cb 0.00 0.67 -0.03 0.00 -1.16 0.00 0.00 33.47 32.95 3i9v s TRP 40 CO 0.00 -1.05 0.07 0.42 -4.06 0.00 0.00 176.95 172.33 3i9v s ILE 41 N -3.68 4.34 0.25 0.66 1.01 -0.15 -4.63 121.20 118.99 3i9v s ILE 41 Ca 0.10 -0.17 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 3i9v s ILE 41 Cb -0.04 -3.03 -0.06 0.00 0.01 0.00 0.00 42.46 39.34 3i9v s ILE 41 CO 0.03 0.33 0.52 -0.13 0.00 0.00 0.00 174.94 175.69 3i9v s ARG 42 N 1.62 3.67 0.27 2.79 0.52 -1.26 -4.63 118.95 121.92 3i9v s ARG 42 Ca 0.06 0.04 0.19 0.00 -0.52 0.00 0.00 55.73 55.51 3i9v s ARG 42 Cb -0.15 -2.69 1.00 0.00 0.52 0.00 0.00 34.95 33.64 3i9v s ARG 42 CO 0.04 0.29 1.59 -0.35 0.02 0.00 0.00 175.30 176.88 3i9v n PRO 43 N -0.58 0.13 0.08 3.54 -0.04 -1.26 -0.60 135.00 136.27 3i9v n PRO 43 Ca -0.01 0.59 -0.06 0.00 -0.04 0.00 0.00 63.50 63.97 3i9v n PRO 43 Cb 0.53 -1.89 0.09 0.00 -0.04 0.00 0.00 33.50 32.19 3i9v n PRO 43 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3i9v h GLU 44 N 0.00 0.24 -0.39 0.54 3.07 -2.00 -2.82 114.58 113.22 3i9v h GLU 44 Ca 0.00 -0.19 -0.10 0.00 -0.50 0.00 0.00 59.36 58.58 3i9v h GLU 44 Cb 0.06 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 3i9v h GLU 44 CO 0.00 0.82 -0.15 0.00 -1.40 0.00 0.00 179.01 178.28 3i9v h ARG 45 N 0.17 0.73 -0.19 2.33 2.47 -1.24 -1.71 114.38 116.94 3i9v h ARG 45 Ca -0.02 -0.25 -0.13 0.00 -1.26 0.00 0.00 59.98 58.32 3i9v h ARG 45 Cb 1.20 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.46 3i9v h ARG 45 CO 0.10 0.84 -0.44 0.82 0.56 0.00 0.00 179.97 181.86 3i9v h ILE 46 N 0.65 1.31 -0.15 2.04 2.04 -1.52 -1.13 117.51 120.75 3i9v h ILE 46 Ca 0.11 -1.61 -0.10 0.00 1.00 0.00 0.00 64.86 64.25 3i9v h ILE 46 Cb 0.62 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 3i9v h ILE 46 CO 0.04 0.50 -0.29 -0.33 0.00 0.00 0.00 178.15 178.07 3i9v h GLU 47 N 0.38 0.46 0.00 2.37 5.08 -1.36 -2.49 114.58 119.02 3i9v h GLU 47 Ca 0.03 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3i9v h GLU 47 Cb 0.92 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3i9v h GLU 47 CO 0.08 0.90 0.00 -1.91 -1.00 0.00 0.00 179.01 177.08 3i9v n GLU 48 N -4.40 0.00 -0.51 2.33 2.13 -0.66 -2.24 120.64 117.30 3i9v n GLU 48 Ca -0.07 0.55 0.41 0.00 0.66 0.00 0.00 57.16 58.72 3i9v n GLU 48 Cb 0.47 -1.33 0.71 0.00 0.27 0.00 0.00 31.44 31.55 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 0.11 -0.16 6.31 2.04 -1.30 0.98 117.51 125.49 3i9v h ILE 49 Ca 0.00 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 3i9v h ILE 49 Cb 0.00 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 3i9v h ILE 49 CO 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 178.15 178.13 3i9v h ALA 50 N 1.42 0.21 -0.40 1.87 0.00 -1.17 -0.40 119.26 120.79 3i9v h ALA 50 Ca 0.84 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.43 3i9v h ALA 50 Cb 2.89 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 20.61 3i9v h ALA 50 CO -0.28 -0.04 -0.10 0.00 0.00 0.00 0.00 179.25 178.83 3i9v h ARG 51 N 0.01 0.71 -0.14 0.00 3.08 0.14 0.33 114.38 118.50 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 0.44 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3i9v h ARG 51 CO 0.01 0.79 0.04 -0.07 -1.07 0.00 0.00 179.97 179.68 3i9v h LEU 52 N 0.64 0.20 0.00 3.04 3.38 -0.87 -3.17 115.31 118.53 3i9v h LEU 52 Ca 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3i9v h LEU 52 Cb 0.55 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3i9v h LEU 52 CO 0.03 0.35 -0.33 1.62 0.09 0.00 0.00 178.44 180.20 3i9v h VAL 53 N 0.04 0.00 0.00 1.22 3.04 -0.93 -3.48 116.25 116.14 3i9v h VAL 53 Ca 0.04 -0.69 0.00 0.00 -1.01 0.00 0.00 66.70 65.04 3i9v h VAL 53 Cb 0.22 1.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.99 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 1.24 1.45 0.00 3.17 0.00 0.90 -4.36 105.19 107.60 3i9v n GLY 54 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.83 0.00 -1.97 2.61 5.66 0.23 -5.00 114.28 113.98 3i9v n THR 55 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 3i9v n THR 55 Cb 0.10 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.88 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 -1.15 4.55 0.31 1.09 -4.23 -1.26 -4.20 115.64 110.76 3i9v s THR 56 Ca 0.00 0.93 0.00 0.00 -1.18 0.00 0.00 61.69 61.45 3i9v s THR 56 Cb 0.00 -3.76 0.21 0.00 1.34 0.00 0.00 72.50 70.29 3i9v s THR 56 CO 0.00 -0.98 1.92 -0.65 -0.54 0.00 0.00 174.62 174.36 3i9v h PRO 57 N -0.04 0.84 0.63 3.99 0.11 -1.90 -3.15 132.00 132.47 3i9v h PRO 57 Ca -0.45 -0.11 -0.03 0.00 0.11 0.00 0.00 66.00 65.53 3i9v h PRO 57 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3i9v h PRO 57 CO 0.61 0.66 -0.33 1.15 -0.21 0.00 0.00 178.00 179.88 3i9v h THR 58 N 0.83 0.33 -0.96 -1.15 2.02 -1.94 -0.56 112.91 111.48 3i9v h THR 58 Ca 0.21 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.52 3i9v h THR 58 Cb 0.10 0.33 -0.09 0.00 -1.74 0.00 0.00 68.15 66.75 3i9v h THR 58 CO -0.03 0.00 0.58 -0.33 0.37 0.00 0.00 175.52 176.11 3i9v h GLU 59 N -0.88 0.84 -0.16 6.66 4.39 -1.95 -1.97 114.58 121.51 3i9v h GLU 59 Ca -0.08 -0.05 -0.18 0.00 0.34 0.00 0.00 59.36 59.39 3i9v h GLU 59 Cb 0.69 -0.19 0.01 0.00 -0.10 0.00 0.00 28.75 29.16 3i9v h GLU 59 CO 0.12 0.56 -0.59 0.28 -1.16 0.00 0.00 179.01 178.21 3i9v h VAL 60 N 0.87 1.32 -0.34 3.13 2.07 -1.48 -2.83 116.25 118.99 3i9v h VAL 60 Ca 0.50 -1.83 0.05 0.00 0.82 0.00 0.00 66.70 66.23 3i9v h VAL 60 Cb 0.58 2.00 -0.08 0.00 -1.52 0.00 0.00 31.29 32.26 3i9v h VAL 60 CO -0.30 0.57 -0.54 -0.03 0.02 0.00 0.00 177.57 177.29 3i9v h MET 61 N 0.37 -0.43 -0.32 1.57 1.85 -0.37 -1.14 114.93 116.46 3i9v h MET 61 Ca -0.03 0.03 0.07 0.00 -0.61 0.00 0.00 59.70 59.16 3i9v h MET 61 Cb 1.22 0.10 -0.08 0.00 0.43 0.00 0.00 31.60 33.27 3i9v h MET 61 CO 0.12 -0.28 -0.21 0.78 -0.40 0.00 0.00 176.91 176.92 3i9v h GLY 62 N -0.44 -0.03 0.38 1.39 0.00 -1.46 -1.77 103.07 101.14 3i9v h GLY 62 Ca 0.07 0.27 0.11 0.00 0.00 0.00 0.00 47.33 47.78 3i9v h GLY 62 CO -0.55 -0.19 0.37 -2.08 0.00 0.00 0.00 176.54 174.08 3i9v h VAL 63 N -0.18 0.80 -0.13 4.60 2.07 -1.16 -2.38 116.25 119.87 3i9v h VAL 63 Ca 0.16 -0.20 -0.15 0.00 0.82 0.00 0.00 66.70 67.33 3i9v h VAL 63 Cb 0.43 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3i9v h VAL 63 CO -0.43 0.11 -0.57 0.00 0.02 0.00 0.00 177.57 176.70 3i9v h ALA 64 N 1.47 0.78 0.00 1.67 0.00 -0.79 -3.03 119.26 119.36 3i9v h ALA 64 Ca 0.38 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3i9v h ALA 64 Cb 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3i9v h ALA 64 CO -0.30 0.70 0.00 -1.13 0.00 0.00 0.00 179.25 178.52 3i9v n SER 65 N -3.92 0.00 -0.03 0.00 3.41 -0.71 -3.46 113.62 108.92 3i9v n SER 65 Ca -0.03 -1.61 -0.06 0.00 -0.26 0.00 0.00 58.87 56.92 3i9v n SER 65 Cb 0.61 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.42 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 -0.67 0.68 -3.37 7.33 -0.00 -1.14 -4.98 117.46 115.31 3i9v n PHE 66 Ca 0.08 0.24 -0.21 0.00 -0.00 0.00 0.00 57.45 57.55 3i9v n PHE 66 Cb 0.04 -1.08 -0.00 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 -2.70 3.27 -0.15 -5.13 1.51 -1.22 -5.04 117.35 107.88 3i9v s TYR 67 Ca -0.06 0.05 0.19 0.00 -1.01 0.00 0.00 57.07 56.25 3i9v s TYR 67 Cb 0.08 -2.02 -0.12 0.00 -0.11 0.00 0.00 41.96 39.79 3i9v s TYR 67 CO 0.83 -0.03 0.81 0.43 -1.11 0.00 0.00 175.55 176.47 3i9v n SER 68 N -1.77 0.71 0.07 2.29 7.64 -1.26 -4.40 113.62 116.89 3i9v n SER 68 Ca -0.02 0.30 -0.12 0.00 1.01 0.00 0.00 58.87 60.04 3i9v n SER 68 Cb 0.57 0.50 -0.13 0.00 -1.01 0.00 0.00 64.21 64.15 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 0.24 -2.86 1.43 3.20 -1.96 -3.44 116.97 113.58 3i9v h TYR 69 Ca -0.12 -0.17 -0.56 0.00 3.14 0.00 0.00 58.73 61.01 3i9v h TYR 69 Cb 1.38 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.60 3i9v h TYR 69 CO 0.00 1.16 1.06 0.71 -1.64 0.00 0.00 178.16 179.45 3i9v s TYR 70 N -2.67 2.31 0.08 -3.82 2.02 -1.26 -5.01 117.35 109.00 3i9v s TYR 70 Ca -0.03 0.64 -0.16 0.00 -0.37 0.00 0.00 57.07 57.15 3i9v s TYR 70 Cb 0.08 -3.91 -0.06 0.00 -0.40 0.00 0.00 41.96 37.66 3i9v s TYR 70 CO 0.85 -2.59 0.51 -0.65 -1.57 0.00 0.00 175.55 172.10 3i9v s GLN 71 N 4.39 4.03 0.00 -0.62 -1.52 -1.26 -4.98 119.66 119.69 3i9v s GLN 71 Ca 0.66 0.54 0.02 0.00 -1.95 0.00 0.00 55.36 54.63 3i9v s GLN 71 Cb -0.23 -3.12 0.05 0.00 -0.22 0.00 0.00 33.01 29.49 3i9v s GLN 71 CO 0.26 0.60 0.91 1.19 -0.25 0.00 0.00 175.29 178.00 3i9v n PHE 72 N 1.40 0.07 -4.19 0.91 3.01 -1.26 -0.98 117.46 116.42 3i9v n PHE 72 Ca -0.10 -0.35 -0.15 0.00 1.01 0.00 0.00 57.45 57.86 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 -0.76 1.04 0.63 -4.37 -7.23 -1.26 -4.77 120.40 103.67 3i9v s VAL 73 Ca 0.04 -1.67 -0.17 0.00 -1.81 0.00 0.00 61.98 58.37 3i9v s VAL 73 Cb 0.02 -1.41 -0.10 0.00 0.56 0.00 0.00 36.38 35.45 3i9v s VAL 73 CO 0.03 -0.53 0.21 -2.65 -0.31 0.00 0.00 175.10 171.85 3i9v n PRO 74 N 0.53 0.25 -3.86 4.82 -0.02 -1.26 -4.77 135.00 130.69 3i9v n PRO 74 Ca -0.16 0.10 -0.14 0.00 -2.02 0.00 0.00 63.50 61.29 3i9v n PRO 74 Cb 0.58 -1.46 -0.15 0.00 -0.02 0.00 0.00 33.50 32.45 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 -1.89 0.02 1.10 3.45 -1.32 -1.26 -4.94 115.64 110.80 3i9v s THR 75 Ca 0.62 0.07 -0.19 0.00 -1.21 0.00 0.00 61.69 60.97 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 0.61 0.05 -0.14 0.61 -2.21 0.00 0.00 174.62 173.54 3i9v n GLY 76 N 3.51 -2.55 0.29 6.08 0.00 -1.26 -4.88 105.19 106.39 3i9v n GLY 76 Ca -0.18 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.95 0.76 -4.01 1.61 3.64 -1.62 -3.33 116.57 111.67 3i9v h LYS 77 Ca -0.52 -0.05 -0.68 0.00 -1.27 0.00 0.00 60.65 58.13 3i9v h LYS 77 Cb 1.36 -0.17 -0.37 0.00 -0.41 0.00 0.00 32.23 32.65 3i9v h LYS 77 CO 0.37 0.50 -0.52 0.71 -2.27 0.00 0.00 179.45 178.24 3i9v s TYR 78 N -6.06 3.48 -0.68 1.91 2.02 -0.40 -4.99 117.35 112.64 3i9v s TYR 78 Ca -0.13 -2.73 -0.27 0.00 -0.37 0.00 0.00 57.07 53.57 3i9v s TYR 78 Cb 0.18 -3.11 0.03 0.00 -0.40 0.00 0.00 41.96 38.66 3i9v s TYR 78 CO 0.78 -0.88 1.23 -1.58 -1.57 0.00 0.00 175.55 173.52 3i9v s HIS 79 N 0.43 2.42 -0.52 2.71 5.65 -1.25 -3.09 115.29 121.65 3i9v s HIS 79 Ca 0.13 0.09 -0.28 0.00 0.25 0.00 0.00 55.06 55.25 3i9v s HIS 79 Cb -0.22 -4.56 0.03 0.00 -1.18 0.00 0.00 32.58 26.65 3i9v s HIS 79 CO -0.04 -1.87 1.11 -0.51 -0.65 0.00 0.00 174.74 172.78 3i9v s LEU 80 N 5.35 3.65 -0.31 8.88 1.43 0.28 -4.16 118.68 133.80 3i9v s LEU 80 Ca 0.37 0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.58 3i9v s LEU 80 Cb -0.08 -3.31 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 3i9v s LEU 80 CO 0.18 -1.31 0.21 -1.10 0.23 0.00 0.00 176.35 174.57 3i9v s GLN 81 N 4.50 3.67 -0.20 1.70 -0.21 -0.81 -1.08 119.66 127.23 3i9v s GLN 81 Ca 0.43 -0.52 -0.08 0.00 0.02 0.00 0.00 55.36 55.21 3i9v s GLN 81 Cb -0.08 -3.73 -0.04 0.00 1.00 0.00 0.00 33.01 30.16 3i9v s GLN 81 CO 0.28 -0.33 0.09 0.08 -2.12 0.00 0.00 175.29 173.29 3i9v s VAL 82 N 1.73 4.90 -0.06 1.09 1.01 0.21 -1.15 120.40 128.13 3i9v s VAL 82 Ca 0.06 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.76 3i9v s VAL 82 Cb -0.17 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 3i9v s VAL 82 CO 0.10 0.42 1.23 0.00 0.00 0.00 0.00 175.10 176.85 3i9v n ALA 84 N 5.35 2.57 -1.71 0.00 0.00 -0.72 -4.74 120.51 121.27 3i9v n ALA 84 Ca 0.11 -0.32 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 3i9v n ALA 84 Cb 0.46 -0.45 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.91 1.36 0.00 0.00 -1.04 -1.26 -4.16 114.28 107.26 3i9v n THR 85 Ca -0.02 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 3i9v n THR 85 Cb 0.33 -1.67 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 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 1.62 0.00 -0.29 -4.42 7.94 -1.26 -0.20 117.00 120.39 3i9v n LEU 86 Ca 0.08 0.00 0.10 0.00 -1.11 0.00 0.00 56.01 55.08 3i9v n LEU 86 Cb 0.35 0.00 0.26 0.00 0.53 0.00 0.00 43.42 44.55 3i9v n LEU 86 CO 0.63 0.00 1.04 -1.28 -1.11 0.00 0.00 177.39 176.67 3i9v h SER 87 N 0.00 0.33 0.83 1.96 0.87 -1.97 0.84 113.55 116.41 3i9v h SER 87 Ca 0.00 0.13 -0.17 0.00 -1.23 0.00 0.00 61.79 60.53 3i9v h SER 87 Cb 0.00 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 3i9v h SER 87 CO 0.00 0.06 -0.80 0.00 -0.53 0.00 0.00 176.83 175.56 3i9v h LYS 89 N 0.00 0.40 0.00 0.00 3.64 0.12 -0.43 116.57 120.29 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 1.43 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 3i9v h LYS 89 CO 0.10 0.26 0.00 1.28 -2.27 0.00 0.00 179.45 178.83 3i9v n LEU 90 N -4.97 0.00 -0.01 5.20 4.32 0.25 -1.96 117.00 119.84 3i9v n LEU 90 Ca 0.06 0.07 0.06 0.00 -0.02 0.00 0.00 56.01 56.18 3i9v n LEU 90 Cb 0.21 -0.07 -0.10 0.00 -1.62 0.00 0.00 43.42 41.85 3i9v n LEU 90 CO 0.25 -0.03 -0.62 0.00 -1.22 0.00 0.00 177.39 175.77 3i9v n ALA 91 N -1.07 2.52 0.00 -1.18 0.00 -0.74 -4.99 120.51 115.05 3i9v n ALA 91 Ca 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3i9v n ALA 91 Cb 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.11 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 1.76 0.02 0.40 0.00 0.00 -0.80 -4.55 105.19 102.02 3i9v n GLY 92 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.29 -0.36 4.61 0.00 -1.19 -1.47 119.26 120.56 3i9v h ALA 93 Ca 0.00 0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.12 3i9v h ALA 93 Cb 0.00 1.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 3i9v h ALA 93 CO 0.00 -0.82 -0.00 0.93 0.00 0.00 0.00 179.25 179.35 3i9v h GLU 94 N -0.14 0.10 -0.17 0.00 4.39 -1.84 -0.21 114.58 116.72 3i9v h GLU 94 Ca 0.21 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.95 3i9v h GLU 94 Cb 0.54 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.10 3i9v h GLU 94 CO -0.80 0.06 -0.27 0.93 -1.16 0.00 0.00 179.01 177.77 3i9v h GLU 95 N 0.10 -0.31 -0.98 2.33 5.08 -1.67 -0.06 114.58 119.06 3i9v h GLU 95 Ca 0.18 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.68 3i9v h GLU 95 Cb 0.25 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 3i9v h GLU 95 CO -0.30 -0.21 0.62 1.25 -1.00 0.00 0.00 179.01 179.37 3i9v h LEU 96 N -0.32 0.88 -0.53 1.33 5.85 -0.66 -0.01 115.31 121.85 3i9v h LEU 96 Ca 0.11 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 3i9v h LEU 96 Cb 0.49 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3i9v h LEU 96 CO -0.35 0.47 0.01 -0.25 -0.34 0.00 0.00 178.44 177.98 3i9v h TRP 97 N 0.95 1.02 -0.59 1.25 2.91 -0.31 -1.00 115.95 120.16 3i9v h TRP 97 Ca 0.48 -0.17 -0.02 0.00 1.13 0.00 0.00 58.89 60.31 3i9v h TRP 97 Cb 0.51 -0.27 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 3i9v h TRP 97 CO -0.00 0.93 0.29 -0.44 -1.03 0.00 0.00 178.44 178.19 3i9v h ASP 98 N 0.81 0.77 0.75 2.65 3.32 0.63 -2.14 116.42 123.21 3i9v h ASP 98 Ca 0.15 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3i9v h ASP 98 Cb 0.52 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.88 3i9v h ASP 98 CO 0.03 0.67 -0.36 0.22 -1.72 0.00 0.00 179.24 178.08 3i9v h TYR 99 N 0.81 -0.93 -0.58 4.55 3.20 -0.96 -2.10 116.97 120.96 3i9v h TYR 99 Ca 0.21 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.15 3i9v h TYR 99 Cb 0.10 0.31 -0.11 0.00 1.54 0.00 0.00 36.73 38.57 3i9v h TYR 99 CO -0.00 -0.58 -0.36 1.25 -1.64 0.00 0.00 178.16 176.83 3i9v h LEU 100 N -1.26 -1.24 -0.92 2.82 5.85 -1.20 0.26 115.31 119.61 3i9v h LEU 100 Ca -0.10 0.23 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 3i9v h LEU 100 Cb 0.77 0.60 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 3i9v h LEU 100 CO 0.17 -0.31 -0.04 0.74 -0.34 0.00 0.00 178.44 178.65 3i9v h THR 101 N -0.19 1.24 -0.00 1.05 2.02 -1.48 -1.46 112.91 114.09 3i9v h THR 101 Ca 0.22 -1.04 -0.17 0.00 0.77 0.00 0.00 66.41 66.18 3i9v h THR 101 Cb 0.56 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3i9v h THR 101 CO -0.67 0.36 -0.80 -0.08 0.37 0.00 0.00 175.52 174.70 3i9v h GLU 102 N 0.69 0.10 0.06 6.66 4.81 -0.60 0.23 114.58 126.53 3i9v h GLU 102 Ca 0.13 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3i9v h GLU 102 Cb 0.49 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.89 3i9v h GLU 102 CO 0.02 0.84 -0.03 1.15 -0.73 0.00 0.00 179.01 180.27 3i9v h THR 103 N 0.06 1.28 0.00 0.32 2.02 -0.33 -3.33 112.91 112.93 3i9v h THR 103 Ca -0.02 -1.33 -0.11 0.00 0.77 0.00 0.00 66.41 65.72 3i9v h THR 103 Cb 1.39 2.13 -0.02 0.00 -1.74 0.00 0.00 68.15 69.91 3i9v h THR 103 CO 0.11 0.32 -0.52 -0.07 0.37 0.00 0.00 175.52 175.73 3i9v h LEU 104 N -0.69 0.00 1.00 2.58 3.38 -1.33 -3.48 115.31 116.77 3i9v h LEU 104 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 3i9v h LEU 104 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 3i9v h LEU 104 CO 0.01 0.52 -0.20 0.61 0.09 0.00 0.00 178.44 179.47 3i9v n GLY 105 N 1.08 0.07 3.39 0.83 0.00 0.81 -4.92 105.19 106.45 3i9v n GLY 105 Ca 0.01 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 2.37 0.40 -0.61 1.01 -1.15 -5.03 121.20 115.75 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 -1.98 0.07 0.00 0.01 0.00 0.00 42.46 40.55 3i9v s ILE 106 CO 0.01 0.28 0.55 0.61 0.00 0.00 0.00 174.94 176.39 3i9v n GLY 107 N 1.47 1.63 0.09 6.18 0.00 -1.26 -4.78 105.19 108.52 3i9v n GLY 107 Ca -0.17 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.58 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 -0.10 0.00 1.61 0.13 -2.02 -3.10 132.00 128.52 3i9v h PRO 108 Ca -0.18 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 3i9v h PRO 108 Cb 0.80 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3i9v h PRO 108 CO 0.24 -0.07 0.00 0.41 -0.23 0.00 0.00 178.00 178.35 3i9v n GLY 109 N -1.15 -1.09 4.02 1.56 0.00 -1.26 -4.46 105.19 102.81 3i9v n GLY 109 Ca -0.07 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.79 2.19 -0.01 1.61 2.02 -1.17 -5.02 118.70 115.52 3i9v s GLU 110 Ca 0.15 -1.43 -0.01 0.00 0.02 0.00 0.00 54.97 53.69 3i9v s GLU 110 Cb 0.14 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.80 3i9v s GLU 110 CO 0.34 -0.96 0.04 0.54 0.02 0.00 0.00 175.26 175.24 3i9v s VAL 111 N -2.77 0.01 0.73 2.63 0.11 -1.26 -4.56 120.40 115.28 3i9v s VAL 111 Ca 0.62 -0.05 -0.16 0.00 -2.93 0.00 0.00 61.98 59.47 3i9v s VAL 111 Cb -0.06 -0.08 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 3i9v s VAL 111 CO 0.40 -0.03 0.69 1.07 -3.33 0.00 0.00 175.10 173.91 3i9v n THR 112 N 2.97 2.07 -0.28 5.04 5.66 -0.83 -4.82 114.28 124.09 3i9v n THR 112 Ca -0.13 -0.38 0.06 0.00 -3.05 0.00 0.00 64.05 60.55 3i9v n THR 112 Cb 0.59 -0.87 0.28 0.00 -1.55 0.00 0.00 70.33 68.79 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 -0.38 0.89 0.00 1.09 0.13 -1.93 -0.66 132.00 131.14 3i9v h PRO 113 Ca -0.46 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3i9v h PRO 113 Cb 1.34 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3i9v h PRO 113 CO 0.44 0.59 0.00 -0.40 -0.23 0.00 0.00 178.00 178.40 3i9v n ASP 114 N -4.50 0.00 -2.22 1.44 5.75 -1.26 -4.92 116.55 110.84 3i9v n ASP 114 Ca 0.14 -0.60 -0.14 0.00 -0.01 0.00 0.00 54.79 54.18 3i9v n ASP 114 Cb 0.25 -0.08 0.04 0.00 -1.03 0.00 0.00 41.12 40.30 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 0.70 0.04 0.11 6.12 0.00 -0.25 -4.92 105.19 107.00 3i9v n GLY 115 Ca 0.17 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.00 0.00 -3.52 0.99 -0.00 -1.26 -3.16 117.00 107.06 3i9v n LEU 116 Ca -0.01 -0.27 -0.23 0.00 -0.00 0.00 0.00 56.01 55.49 3i9v n LEU 116 Cb 0.54 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.83 3i9v n LEU 116 CO 0.36 0.12 -0.27 -0.36 -0.00 0.00 0.00 177.39 177.24 3i9v s PHE 117 N 0.00 -0.01 0.11 1.47 0.08 -1.26 -1.27 117.98 117.10 3i9v s PHE 117 Ca 0.00 -0.35 0.06 0.00 0.12 0.00 0.00 56.93 56.76 3i9v s PHE 117 Cb 0.00 -0.64 -0.04 0.00 -0.57 0.00 0.00 43.02 41.77 3i9v s PHE 117 CO 0.00 -0.72 -0.02 -1.12 -0.10 0.00 0.00 175.22 173.25 3i9v s SER 118 N 2.21 4.83 0.11 1.36 0.01 -1.18 -1.97 113.70 119.08 3i9v s SER 118 Ca 0.07 -0.27 0.07 0.00 1.31 0.00 0.00 55.95 57.13 3i9v s SER 118 Cb -0.16 -1.08 -0.03 0.00 0.21 0.00 0.00 66.02 64.96 3i9v s SER 118 CO -0.24 0.16 -0.18 0.68 0.41 0.00 0.00 173.24 174.07 3i9v s VAL 119 N -1.38 1.52 -0.23 3.43 -7.23 -1.26 0.99 120.40 116.25 3i9v s VAL 119 Ca 0.25 -1.57 -0.17 0.00 -1.81 0.00 0.00 61.98 58.68 3i9v s VAL 119 Cb -0.11 -1.48 0.07 0.00 0.56 0.00 0.00 36.38 35.42 3i9v s VAL 119 CO 0.17 -0.20 0.59 -1.58 -0.31 0.00 0.00 175.10 173.77 3i9v s GLN 120 N -2.13 0.63 0.11 4.82 0.74 -0.24 -4.33 119.66 119.26 3i9v s GLN 120 Ca 0.06 0.95 -0.25 0.00 0.05 0.00 0.00 55.36 56.17 3i9v s GLN 120 Cb -0.08 0.20 -0.07 0.00 1.10 0.00 0.00 33.01 34.15 3i9v s GLN 120 CO 0.04 -0.12 0.76 0.15 -0.55 0.00 0.00 175.29 175.57 3i9v s LYS 121 N 0.97 4.52 0.40 1.67 1.02 -1.26 0.65 119.74 127.70 3i9v s LYS 121 Ca -0.05 1.10 0.04 0.00 0.02 0.00 0.00 55.97 57.07 3i9v s LYS 121 Cb -0.05 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.93 3i9v s LYS 121 CO -0.09 0.47 0.11 0.08 -0.92 0.00 0.00 175.35 175.00 3i9v s VAL 122 N -0.73 0.73 0.33 3.17 1.01 0.16 -4.84 120.40 120.23 3i9v s VAL 122 Ca 0.36 -2.00 -0.02 0.00 0.00 0.00 0.00 61.98 60.33 3i9v s VAL 122 Cb -0.22 -2.42 0.07 0.00 0.00 0.00 0.00 36.38 33.81 3i9v s VAL 122 CO 0.25 0.00 0.45 -0.62 0.00 0.00 0.00 175.10 175.17 3i9v n GLU 123 N -0.88 0.12 -1.69 2.72 -0.58 -1.26 -1.75 120.64 117.31 3i9v n GLU 123 Ca -0.06 -1.07 -0.56 0.00 -0.42 0.00 0.00 57.16 55.05 3i9v n GLU 123 Cb 0.65 -0.34 -0.07 0.00 -0.57 0.00 0.00 31.44 31.11 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 5.04 0.22 -0.93 0.00 4.77 -1.26 -4.92 117.00 119.91 3i9v n LEU 125 Ca 0.25 0.26 -0.03 0.00 -0.03 0.00 0.00 56.01 56.46 3i9v n LEU 125 Cb 0.15 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 40.89 3i9v n LEU 125 CO 0.78 0.05 0.03 0.61 -1.33 0.00 0.00 177.39 177.52 3i9v n GLY 126 N 1.45 0.72 2.36 -0.72 0.00 -1.26 -4.98 105.19 102.76 3i9v n GLY 126 Ca 0.08 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 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 0.64 -0.34 0.15 1.61 3.41 -1.26 -4.99 113.62 112.84 3i9v n SER 127 Ca -0.00 -3.15 0.01 0.00 -0.26 0.00 0.00 58.87 55.46 3i9v n SER 127 Cb 0.51 0.19 0.17 0.00 -0.26 0.00 0.00 64.21 64.82 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 -3.56 0.00 -2.42 0.00 1.44 -1.26 -2.75 115.22 106.67 3i9v n HIS 129 Ca -0.00 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.48 3i9v n HIS 129 Cb 0.64 -0.43 0.01 0.00 0.12 0.00 0.00 29.99 30.32 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 -1.43 2.17 -2.75 0.61 -2.24 -1.05 -4.75 114.28 104.84 3i9v n THR 130 Ca 0.05 -4.42 -0.31 0.00 -2.27 0.00 0.00 64.05 57.11 3i9v n THR 130 Cb 0.18 -0.85 -0.03 0.00 -2.10 0.00 0.00 70.33 67.53 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 -3.51 3.27 0.42 6.98 0.00 -1.11 -1.25 121.76 126.56 3i9v s ALA 131 Ca 0.45 -0.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.11 3i9v s ALA 131 Cb 0.41 -2.82 -0.11 0.00 0.00 0.00 0.00 23.12 20.60 3i9v s ALA 131 CO -0.10 -0.05 0.95 -1.25 0.00 0.00 0.00 175.76 175.32 3i9v s PRO 132 N -3.85 4.26 0.14 0.00 0.04 -1.26 -4.59 135.00 129.74 3i9v s PRO 132 Ca 0.53 1.16 0.09 0.00 0.04 0.00 0.00 61.00 62.82 3i9v s PRO 132 Cb -0.10 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 3i9v s PRO 132 CO 0.30 -0.00 -0.14 0.08 0.04 0.00 0.00 177.00 177.28 3i9v s VAL 133 N -2.09 3.02 -0.08 -0.36 1.01 -1.26 -1.15 120.40 119.49 3i9v s VAL 133 Ca 0.61 -1.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 3i9v s VAL 133 Cb -0.11 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.88 3i9v s VAL 133 CO 0.15 0.02 0.17 -0.63 0.00 0.00 0.00 175.10 174.80 3i9v s ILE 134 N -1.38 -0.10 -0.19 2.22 1.01 -1.08 -2.57 121.20 119.11 3i9v s ILE 134 Ca 0.21 0.21 -0.03 0.00 0.00 0.00 0.00 60.65 61.04 3i9v s ILE 134 Cb -0.10 -0.28 -0.01 0.00 0.01 0.00 0.00 42.46 42.08 3i9v s ILE 134 CO 0.12 0.09 -0.06 -1.58 0.00 0.00 0.00 174.94 173.51 3i9v s GLN 135 N 1.44 3.45 0.00 2.79 0.74 -0.30 0.77 119.66 128.54 3i9v s GLN 135 Ca -0.07 -0.61 0.00 0.00 0.05 0.00 0.00 55.36 54.73 3i9v s GLN 135 Cb -0.12 -2.91 0.00 0.00 1.10 0.00 0.00 33.01 31.08 3i9v s GLN 135 CO -0.06 -0.01 0.00 0.28 -0.55 0.00 0.00 175.29 174.95 3i9v n VAL 136 N 4.24 0.00 -0.03 1.34 0.31 -1.26 -1.93 118.33 121.01 3i9v n VAL 136 Ca -0.18 0.08 -0.03 0.00 -0.01 0.00 0.00 64.34 64.20 3i9v n VAL 136 Cb 0.52 -0.57 -0.01 0.00 -0.91 0.00 0.00 33.84 32.87 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 0.61 -0.68 4.52 3.02 -1.26 -4.18 115.26 117.28 3i9v n ASN 137 Ca 0.00 0.10 -0.01 0.00 -0.03 0.00 0.00 54.58 54.64 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 -3.11 -0.05 -4.23 6.41 5.75 -1.26 -5.01 116.55 115.05 3i9v n ASP 138 Ca -0.04 -1.55 -0.20 0.00 -0.01 0.00 0.00 54.79 52.98 3i9v n ASP 138 Cb 0.15 -0.04 -0.12 0.00 -1.03 0.00 0.00 41.12 40.08 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 0.96 0.00 0.11 -1.05 -1.26 -5.08 118.70 112.38 3i9v s GLU 139 Ca 0.04 -1.08 0.00 0.00 -0.15 0.00 0.00 54.97 53.78 3i9v s GLU 139 Cb 0.04 -1.05 0.00 0.00 -0.44 0.00 0.00 34.13 32.68 3i9v s GLU 139 CO -0.02 0.23 0.00 -2.30 0.95 0.00 0.00 175.26 174.12 3i9v n PRO 140 N 1.08 0.00 -1.22 -4.83 -0.02 -1.26 -4.14 135.00 124.61 3i9v n PRO 140 Ca -0.20 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.93 3i9v n PRO 140 Cb 0.54 0.00 0.08 0.00 -0.02 0.00 0.00 33.50 34.10 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 -0.63 -3.40 6.00 4.01 -1.26 -4.66 117.16 117.22 3i9v n TYR 141 Ca 0.00 0.35 -0.45 0.00 -0.16 0.00 0.00 57.90 57.64 3i9v n TYR 141 Cb 0.00 -1.93 -0.03 0.00 -0.31 0.00 0.00 39.34 37.07 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 -1.95 5.26 0.46 -0.72 1.01 0.23 -4.99 120.40 119.70 3i9v s VAL 142 Ca 0.66 -2.58 -0.16 0.00 0.00 0.00 0.00 61.98 59.89 3i9v s VAL 142 Cb -0.33 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 31.69 3i9v s VAL 142 CO 0.58 -1.00 0.92 -1.61 0.00 0.00 0.00 175.10 173.98 3i9v s GLU 143 N 0.10 3.99 -0.97 2.72 2.02 -1.26 -2.63 118.70 122.66 3i9v s GLU 143 Ca 0.18 0.88 -0.01 0.00 0.02 0.00 0.00 54.97 56.04 3i9v s GLU 143 Cb -0.12 -2.22 0.00 0.00 0.10 0.00 0.00 34.13 31.89 3i9v s GLU 143 CO -0.08 -0.14 0.81 0.00 0.02 0.00 0.00 175.26 175.88 3i9v s VAL 145 N -3.28 3.61 0.93 0.00 1.01 -0.30 -4.85 120.40 117.51 3i9v s VAL 145 Ca 0.05 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.25 3i9v s VAL 145 Cb -0.02 -4.40 0.15 0.00 0.00 0.00 0.00 36.38 32.10 3i9v s VAL 145 CO 0.58 -1.23 1.15 0.42 0.00 0.00 0.00 175.10 176.03 3i9v s THR 146 N 8.82 1.97 0.47 3.92 -4.23 -1.26 -4.56 115.64 120.78 3i9v s THR 146 Ca 0.64 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 61.29 3i9v s THR 146 Cb -0.04 -2.77 0.30 0.00 1.34 0.00 0.00 72.50 71.33 3i9v s THR 146 CO 0.00 0.00 2.07 -0.09 -0.54 0.00 0.00 174.62 176.06 3i9v h ARG 147 N -1.55 0.24 0.02 3.99 2.43 -2.00 0.78 114.38 118.29 3i9v h ARG 147 Ca -0.49 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 58.50 3i9v h ARG 147 Cb 1.32 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 3i9v h ARG 147 CO 0.58 0.16 -0.84 0.00 -1.51 0.00 0.00 179.97 178.36 3i9v h ALA 148 N 1.83 0.15 -0.96 2.80 0.00 -1.98 -3.16 119.26 117.95 3i9v h ALA 148 Ca 0.13 -0.94 0.22 0.00 0.00 0.00 0.00 54.91 54.32 3i9v h ALA 148 Cb 0.22 0.43 -0.12 0.00 0.00 0.00 0.00 17.79 18.32 3i9v h ALA 148 CO -0.03 0.48 0.53 -0.09 0.00 0.00 0.00 179.25 180.14 3i9v h ARG 149 N -0.87 0.56 0.89 0.00 2.43 -1.84 -2.67 114.38 112.87 3i9v h ARG 149 Ca -0.22 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 58.88 3i9v h ARG 149 Cb 1.28 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.72 3i9v h ARG 149 CO -0.09 0.37 -0.43 1.25 -1.51 0.00 0.00 179.97 179.56 3i9v h LEU 150 N 0.57 -1.01 -1.68 3.80 7.12 -0.92 -2.34 115.31 120.85 3i9v h LEU 150 Ca 0.59 0.03 0.16 0.00 0.13 0.00 0.00 57.88 58.80 3i9v h LEU 150 Cb 1.07 0.26 -0.05 0.00 -0.53 0.00 0.00 40.66 41.42 3i9v h LEU 150 CO -0.46 -0.70 0.50 -0.33 -0.13 0.00 0.00 178.44 177.32 3i9v h GLU 151 N -1.24 0.30 -0.23 1.25 5.08 -1.44 0.15 114.58 118.46 3i9v h GLU 151 Ca -0.12 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.13 3i9v h GLU 151 Cb 0.92 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 3i9v h GLU 151 CO 0.20 0.20 -0.20 0.00 -1.00 0.00 0.00 179.01 178.21 3i9v h ALA 152 N 1.65 0.33 -0.42 3.43 0.00 -1.46 -1.56 119.26 121.22 3i9v h ALA 152 Ca 0.36 -0.35 0.08 0.00 0.00 0.00 0.00 54.91 55.00 3i9v h ALA 152 Cb 0.97 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 3i9v h ALA 152 CO -0.10 0.27 -0.01 1.25 0.00 0.00 0.00 179.25 180.66 3i9v h LEU 153 N 0.24 -0.21 0.09 0.00 7.12 -0.22 0.12 115.31 122.44 3i9v h LEU 153 Ca 0.04 0.10 0.02 0.00 0.13 0.00 0.00 57.88 58.17 3i9v h LEU 153 Cb 0.74 0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 41.03 3i9v h LEU 153 CO 0.05 -0.06 -0.20 -0.07 -0.13 0.00 0.00 178.44 178.03 3i9v h LEU 154 N 0.09 -0.56 -0.82 2.25 3.38 -0.87 -2.31 115.31 116.47 3i9v h LEU 154 Ca 0.21 0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 3i9v h LEU 154 Cb 0.31 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3i9v h LEU 154 CO -0.36 -0.28 -0.50 0.00 0.09 0.00 0.00 178.44 177.39 3i9v h ALA 155 N 0.46 0.97 0.57 1.53 0.00 -1.13 0.30 119.26 121.96 3i9v h ALA 155 Ca 0.03 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 3i9v h ALA 155 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3i9v h ALA 155 CO -0.13 0.62 -0.41 0.78 0.00 0.00 0.00 179.25 180.11 3i9v h GLY 156 N 2.01 -1.06 1.34 0.00 0.00 -0.51 -1.24 103.07 103.62 3i9v h GLY 156 Ca -0.00 0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.74 3i9v h GLY 156 CO 0.06 -0.36 0.15 1.41 0.00 0.00 0.00 176.54 177.80 3i9v h LEU 157 N -0.94 0.77 -2.15 3.11 3.38 -1.32 -2.34 115.31 115.80 3i9v h LEU 157 Ca -0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3i9v h LEU 157 Cb 0.79 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 3i9v h LEU 157 CO 0.03 0.74 -0.03 -0.09 0.09 0.00 0.00 178.44 179.18 3i9v h ARG 158 N 0.80 0.00 -0.40 1.13 2.43 -0.69 -0.73 114.38 116.93 3i9v h ARG 158 Ca 0.18 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 3i9v h ARG 158 Cb 0.26 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 3i9v h ARG 158 CO -0.01 0.03 0.03 0.00 -1.51 0.00 0.00 179.97 178.52 3i9v n ALA 159 N -2.14 3.50 -1.20 2.80 0.00 -0.49 -4.97 120.51 118.02 3i9v n ALA 159 Ca -0.01 -2.30 -0.07 0.00 0.00 0.00 0.00 53.44 51.06 3i9v n ALA 159 Cb 0.20 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.26 0.89 3.68 0.00 0.00 -0.28 -4.99 105.19 104.23 3i9v n GLY 160 Ca 0.26 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.34 4.29 0.21 1.61 1.02 -0.92 -4.97 119.74 118.64 3i9v s LYS 161 Ca 0.00 1.83 -0.32 0.00 0.02 0.00 0.00 55.97 57.50 3i9v s LYS 161 Cb 0.00 -3.64 -0.12 0.00 -0.52 0.00 0.00 37.83 33.54 3i9v s LYS 161 CO 0.00 -0.58 1.68 2.89 -0.92 0.00 0.00 175.35 178.41 3i9v n ARG 162 N 5.72 2.64 -0.31 1.68 1.85 -1.26 -4.43 116.66 122.55 3i9v n ARG 162 Ca 0.13 0.95 0.06 0.00 -1.00 0.00 0.00 57.85 57.99 3i9v n ARG 162 Cb 0.45 -2.77 0.21 0.00 -1.05 0.00 0.00 32.46 29.29 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 6.32 0.66 0.00 2.89 6.46 -1.96 -2.20 115.31 127.48 3i9v h LEU 163 Ca -0.44 0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 3i9v h LEU 163 Cb 1.22 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 41.09 3i9v h LEU 163 CO 0.92 0.33 0.15 -1.84 -0.62 0.00 0.00 178.44 177.38 3i9v n GLU 164 N -4.77 0.00 -2.75 1.25 0.28 -1.26 -2.06 120.64 111.32 3i9v n GLU 164 Ca 0.16 0.27 -0.10 0.00 -0.16 0.00 0.00 57.16 57.33 3i9v n GLU 164 Cb 0.37 -1.65 0.05 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 -1.24 1.12 -3.92 3.44 0.28 -0.83 -5.08 120.64 114.42 3i9v n GLU 165 Ca 0.00 -2.82 -0.31 0.00 -0.16 0.00 0.00 57.16 53.86 3i9v n GLU 165 Cb 0.15 -1.00 -0.04 0.00 1.43 0.00 0.00 31.44 31.98 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 -1.96 5.39 -0.27 3.84 1.01 -0.88 -4.84 121.20 123.50 3i9v s ILE 166 Ca 0.27 -0.36 -0.14 0.00 0.00 0.00 0.00 60.65 60.43 3i9v s ILE 166 Cb 0.42 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.23 3i9v s ILE 166 CO -0.02 0.16 0.31 -1.83 0.00 0.00 0.00 174.94 173.57 3i9v s GLU 167 N -2.44 4.01 -0.24 2.79 -1.05 -1.26 -5.06 118.70 115.45 3i9v s GLU 167 Ca 0.34 -0.07 -0.07 0.00 -0.15 0.00 0.00 54.97 55.02 3i9v s GLU 167 Cb -0.13 -3.64 -0.03 0.00 -0.44 0.00 0.00 34.13 29.89 3i9v s GLU 167 CO 0.27 -0.21 0.06 -0.51 0.95 0.00 0.00 175.26 175.82 3i9v s LEU 168 N 1.86 3.41 0.69 1.83 1.43 -1.26 -4.87 118.68 121.76 3i9v s LEU 168 Ca 0.13 -0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 52.85 3i9v s LEU 168 Cb -0.16 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 3i9v s LEU 168 CO 0.10 -0.02 0.56 -0.81 0.23 0.00 0.00 176.35 176.40 3i9v n PRO 169 N 4.86 0.38 -0.72 1.29 -0.04 -1.26 -4.75 135.00 134.75 3i9v n PRO 169 Ca -0.16 0.17 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 3i9v n PRO 169 Cb 0.51 -1.83 -0.03 0.00 -0.04 0.00 0.00 33.50 32.12 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 1.65 -1.77 3.27 0.55 0.00 -1.26 -4.82 105.19 102.81 3i9v n GLY 170 Ca 0.11 -1.34 -0.25 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.88 1.33 -0.09 1.61 -2.85 -1.26 -5.14 119.74 111.46 3i9v s LYS 171 Ca 0.00 -1.04 -0.02 0.00 -1.00 0.00 0.00 55.97 53.91 3i9v s LYS 171 Cb 0.00 -1.51 0.04 0.00 -2.06 0.00 0.00 37.83 34.29 3i9v s LYS 171 CO 0.00 0.38 0.04 0.00 0.10 0.00 0.00 175.35 175.87 3i9v s GLY 173 N 2.06 1.45 0.00 0.00 0.00 -1.26 -5.08 107.32 104.50 3i9v s GLY 173 Ca 0.04 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.82 3i9v s GLY 173 CO -0.05 0.08 0.00 1.57 0.00 0.00 0.00 173.10 174.69 3i9v n HIS 174 N -5.48 0.00 1.09 1.90 -0.00 -1.26 -4.82 115.22 106.65 3i9v n HIS 174 Ca 0.14 0.00 0.12 0.00 0.46 0.00 0.00 57.72 58.44 3i9v n HIS 174 Cb 0.60 0.00 0.17 0.00 -0.12 0.00 0.00 29.99 30.64 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 -4.10 1.57 1.44 -1.26 -4.81 115.22 108.05 3i9v n HIS 175 Ca 0.00 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.56 3i9v n HIS 175 Cb 0.00 -0.10 -0.12 0.00 0.12 0.00 0.00 29.99 29.89 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 -2.69 0.68 -0.08 0.61 -7.23 -1.26 -5.07 120.40 105.37 3i9v s VAL 176 Ca 0.17 -1.08 -0.03 0.00 -1.81 0.00 0.00 61.98 59.23 3i9v s VAL 176 Cb 0.18 -0.71 0.04 0.00 0.56 0.00 0.00 36.38 36.45 3i9v s VAL 176 CO 0.63 -0.30 0.17 -2.28 -0.31 0.00 0.00 175.10 173.01 3i9v s HIS 177 N -1.27 -0.20 -0.25 2.82 2.46 -1.26 -4.42 115.29 113.17 3i9v s HIS 177 Ca -0.07 0.57 -0.12 0.00 0.47 0.00 0.00 55.06 55.91 3i9v s HIS 177 Cb -0.09 -0.10 -0.05 0.00 -0.13 0.00 0.00 32.58 32.21 3i9v s HIS 177 CO 0.01 -0.20 0.22 -2.00 -2.47 0.00 0.00 174.74 170.29 3i9v s GLU 178 N 1.45 4.04 0.20 2.88 2.56 -1.26 -5.03 118.70 123.54 3i9v s GLU 178 Ca -0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 54.97 54.68 3i9v s GLU 178 Cb -0.12 -3.59 -0.05 0.00 2.00 0.00 0.00 34.13 32.38 3i9v s GLU 178 CO -0.06 -0.06 0.42 0.08 -0.56 0.00 0.00 175.26 175.08 3i9v s VAL 179 N 1.40 5.15 0.00 3.70 1.01 -1.26 -4.96 120.40 125.43 3i9v s VAL 179 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.95 3i9v s VAL 179 Cb -0.15 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.54 3i9v s VAL 179 CO 0.07 -0.12 0.00 -0.62 0.00 0.00 0.00 175.10 174.43