#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ik9 s GLU 3 N 0.00 2.20 0.43 0.00 2.56 -1.26 -5.08 118.70 117.56 3ik9 s GLU 3 Ca 0.00 -0.39 -0.25 0.00 0.00 0.00 0.00 54.97 54.33 3ik9 s GLU 3 Cb 0.00 -2.23 -0.08 0.00 2.00 0.00 0.00 34.13 33.82 3ik9 s GLU 3 CO 0.00 -1.18 1.33 0.15 -0.56 0.00 0.00 175.26 175.00 3ik9 s LYS 4 N -5.17 3.82 0.19 4.30 1.02 -1.26 -4.84 119.74 117.80 3ik9 s LYS 4 Ca 0.60 2.20 -0.33 0.00 0.02 0.00 0.00 55.97 58.46 3ik9 s LYS 4 Cb -0.10 -2.67 -0.13 0.00 -0.52 0.00 0.00 37.83 34.41 3ik9 s LYS 4 CO 0.44 -0.63 1.67 -2.30 -0.92 0.00 0.00 175.35 173.60 3ik9 n PRO 5 N -0.09 2.55 -3.93 -1.68 -0.02 -1.26 -4.77 135.00 125.79 3ik9 n PRO 5 Ca 0.05 0.92 -0.35 0.00 -2.02 0.00 0.00 63.50 62.09 3ik9 n PRO 5 Cb 0.44 -2.73 -0.13 0.00 -0.02 0.00 0.00 33.50 31.05 3ik9 n PRO 5 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3ik9 s LYS 6 N 1.04 3.47 -0.33 -0.52 2.20 0.04 -1.38 119.74 124.27 3ik9 s LYS 6 Ca 0.76 -0.58 -0.17 0.00 -0.36 0.00 0.00 55.97 55.62 3ik9 s LYS 6 Cb -0.57 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 32.67 3ik9 s LYS 6 CO 0.35 -0.15 0.45 -0.51 -0.36 0.00 0.00 175.35 175.12 3ik9 s LEU 7 N 1.39 4.30 -0.34 5.43 1.02 0.02 -1.19 118.68 129.31 3ik9 s LEU 7 Ca 0.05 0.01 -0.15 0.00 0.02 0.00 0.00 54.13 54.06 3ik9 s LEU 7 Cb -0.14 -2.49 -0.01 0.00 0.02 0.00 0.00 46.19 43.56 3ik9 s LEU 7 CO -0.01 -0.37 0.36 -1.00 0.02 0.00 0.00 176.35 175.35 3ik9 s HIS 8 N 2.22 3.21 0.17 0.29 3.76 0.63 -1.48 115.29 124.09 3ik9 s HIS 8 Ca 0.16 -0.02 -0.24 0.00 -0.15 0.00 0.00 55.06 54.81 3ik9 s HIS 8 Cb -0.16 -2.67 0.06 0.00 1.11 0.00 0.00 32.58 30.92 3ik9 s HIS 8 CO 0.12 -0.43 0.94 -0.47 -0.85 0.00 0.00 174.74 174.05 3ik9 s TYR 9 N 2.02 -0.11 0.87 1.40 5.04 -1.23 -2.72 117.35 122.62 3ik9 s TYR 9 Ca 0.12 -0.22 -0.10 0.00 -2.44 0.00 0.00 57.07 54.42 3ik9 s TYR 9 Cb -0.17 0.66 0.12 0.00 0.35 0.00 0.00 41.96 42.92 3ik9 s TYR 9 CO 0.12 -0.89 1.13 -0.06 -1.34 0.00 0.00 175.55 174.50 3ik9 s PHE 10 N -3.24 1.91 -1.13 4.97 0.40 -1.26 -0.01 117.98 119.61 3ik9 s PHE 10 Ca 0.13 1.72 -0.21 0.00 -0.60 0.00 0.00 56.93 57.97 3ik9 s PHE 10 Cb -0.02 -3.25 0.06 0.00 0.51 0.00 0.00 43.02 40.32 3ik9 s PHE 10 CO 0.03 -2.50 1.56 1.21 0.70 0.00 0.00 175.22 176.22 3ik9 s ASN 11 N -2.89 6.64 0.00 1.36 3.84 -1.26 -4.79 114.94 117.83 3ik9 s ASN 11 Ca 0.65 -1.86 0.00 0.00 0.21 0.00 0.00 52.86 51.86 3ik9 s ASN 11 Cb -0.21 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 37.92 3ik9 s ASN 11 CO 0.57 -1.37 0.00 0.61 -2.79 0.00 0.00 177.10 174.13 3ik9 n GLY 12 N 6.27 -1.59 0.00 1.21 0.00 -1.26 -5.00 105.19 104.82 3ik9 n GLY 12 Ca 0.39 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.34 3ik9 n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ik9 n ARG 13 N -0.24 0.00 0.00 1.61 1.74 -1.26 -4.71 116.66 113.80 3ik9 n ARG 13 Ca 0.00 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 3ik9 n ARG 13 Cb 0.00 -0.66 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 3ik9 n ARG 13 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ik9 n GLY 14 N 1.70 0.79 0.24 -0.13 0.00 -1.26 -2.13 105.19 104.41 3ik9 n GLY 14 Ca 0.00 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.24 3ik9 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ik9 n ARG 15 N 4.97 0.97 0.02 1.61 1.74 -1.26 -3.55 116.66 121.16 3ik9 n ARG 15 Ca 0.00 -0.48 0.11 0.00 -0.77 0.00 0.00 57.85 56.71 3ik9 n ARG 15 Cb 0.00 -1.49 -0.07 0.00 -1.02 0.00 0.00 32.46 29.88 3ik9 n ARG 15 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 3ik9 n MET 16 N -0.60 0.44 -0.21 5.56 1.56 -0.90 -4.59 117.12 118.38 3ik9 n MET 16 Ca 0.15 -0.05 -0.07 0.00 -0.27 0.00 0.00 57.70 57.46 3ik9 n MET 16 Cb 0.31 -1.60 0.03 0.00 2.15 0.00 0.00 33.22 34.12 3ik9 n MET 16 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 3ik9 h GLU 17 N 0.00 0.88 -0.60 2.12 4.57 -1.51 -2.17 114.58 117.87 3ik9 h GLU 17 Ca 0.00 -0.14 0.05 0.00 -1.18 0.00 0.00 59.36 58.08 3ik9 h GLU 17 Cb 0.85 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 3ik9 h GLU 17 CO 0.00 0.73 0.40 0.66 -1.18 0.00 0.00 179.01 179.61 3ik9 h SER 18 N 0.82 0.56 -0.05 1.04 4.64 -1.82 -0.04 113.55 118.70 3ik9 h SER 18 Ca 0.20 -0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.37 3ik9 h SER 18 Cb 0.15 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3ik9 h SER 18 CO -0.02 0.38 -0.48 0.74 -0.87 0.00 0.00 176.83 176.58 3ik9 h THR 19 N 0.64 1.31 0.03 2.95 2.02 -1.70 -1.81 112.91 116.35 3ik9 h THR 19 Ca 0.25 -1.68 -0.00 0.00 0.77 0.00 0.00 66.41 65.75 3ik9 h THR 19 Cb 0.18 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 3ik9 h THR 19 CO -0.07 0.53 -0.02 0.03 0.37 0.00 0.00 175.52 176.36 3ik9 h ARG 20 N 0.48 -0.04 -0.56 6.66 3.08 -0.62 -0.21 114.38 123.18 3ik9 h ARG 20 Ca 0.03 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.19 3ik9 h ARG 20 Cb 1.01 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.97 3ik9 h ARG 20 CO 0.09 0.12 -0.06 -1.49 -1.07 0.00 0.00 179.97 177.56 3ik9 h TRP 21 N -0.20 -0.16 -0.22 3.04 4.06 -1.33 0.29 115.95 121.44 3ik9 h TRP 21 Ca -0.00 0.05 -0.09 0.00 2.06 0.00 0.00 58.89 60.90 3ik9 h TRP 21 Cb 0.18 0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 28.49 3ik9 h TRP 21 CO -0.02 -0.19 -0.23 1.25 -3.56 0.00 0.00 178.44 175.69 3ik9 h LEU 22 N 0.06 0.59 -0.09 -4.49 5.85 -1.11 0.43 115.31 116.54 3ik9 h LEU 22 Ca 0.28 -0.48 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 3ik9 h LEU 22 Cb 0.44 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3ik9 h LEU 22 CO -0.52 0.95 0.05 -0.07 -0.34 0.00 0.00 178.44 178.51 3ik9 h LEU 23 N 0.24 0.12 -1.26 2.25 3.38 -0.89 -0.54 115.31 118.60 3ik9 h LEU 23 Ca 0.03 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3ik9 h LEU 23 Cb 0.79 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3ik9 h LEU 23 CO 0.06 0.17 0.19 0.00 0.09 0.00 0.00 178.44 178.95 3ik9 h ALA 24 N 0.95 1.42 -0.03 1.53 0.00 -0.90 -0.91 119.26 121.32 3ik9 h ALA 24 Ca 0.03 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3ik9 h ALA 24 Cb 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3ik9 h ALA 24 CO -0.01 0.44 -0.35 0.00 0.00 0.00 0.00 179.25 179.34 3ik9 h ALA 25 N 1.52 1.36 -0.01 0.00 0.00 0.06 -1.57 119.26 120.61 3ik9 h ALA 25 Ca 0.17 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3ik9 h ALA 25 Cb 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3ik9 h ALA 25 CO -0.02 0.47 -0.02 0.00 0.00 0.00 0.00 179.25 179.68 3ik9 n ALA 26 N -2.47 2.65 -2.75 0.00 0.00 -0.23 -4.75 120.51 112.96 3ik9 n ALA 26 Ca -0.02 -0.37 -0.08 0.00 0.00 0.00 0.00 53.44 52.97 3ik9 n ALA 26 Cb 0.40 -1.26 0.02 0.00 0.00 0.00 0.00 19.45 18.61 3ik9 n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ik9 n GLY 27 N 1.15 0.38 3.33 0.00 0.00 -0.54 -5.03 105.19 104.48 3ik9 n GLY 27 Ca 0.19 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 3ik9 n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ik9 s VAL 28 N -2.98 3.54 0.20 1.61 1.01 -0.46 -5.02 120.40 118.30 3ik9 s VAL 28 Ca 0.17 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 3ik9 s VAL 28 Cb -0.07 -2.65 -0.08 0.00 0.00 0.00 0.00 36.38 33.58 3ik9 s VAL 28 CO 0.21 0.36 1.19 -1.61 0.00 0.00 0.00 175.10 175.25 3ik9 s GLU 29 N 1.49 4.50 0.20 2.72 2.02 -1.26 -4.33 118.70 124.04 3ik9 s GLU 29 Ca 0.05 1.88 0.00 0.00 0.02 0.00 0.00 54.97 56.92 3ik9 s GLU 29 Cb -0.15 -3.23 -0.04 0.00 0.10 0.00 0.00 34.13 30.81 3ik9 s GLU 29 CO -0.02 -0.07 0.08 -0.59 0.02 0.00 0.00 175.26 174.68 3ik9 s PHE 30 N -0.16 1.24 0.24 1.61 -0.12 -1.26 -4.30 117.98 115.23 3ik9 s PHE 30 Ca 0.52 -1.22 0.11 0.00 -0.05 0.00 0.00 56.93 56.29 3ik9 s PHE 30 Cb -0.33 -0.68 -0.05 0.00 -0.63 0.00 0.00 43.02 41.33 3ik9 s PHE 30 CO 0.37 -0.44 -0.21 -1.83 -0.05 0.00 0.00 175.22 173.07 3ik9 s GLU 31 N -4.05 1.57 -0.04 1.99 -1.05 -0.48 -4.99 118.70 111.65 3ik9 s GLU 31 Ca 0.33 -1.64 0.05 0.00 -0.15 0.00 0.00 54.97 53.56 3ik9 s GLU 31 Cb 0.07 -1.72 -0.01 0.00 -0.44 0.00 0.00 34.13 32.04 3ik9 s GLU 31 CO 0.09 0.34 -0.18 -1.21 0.95 0.00 0.00 175.26 175.25 3ik9 s GLU 32 N -3.17 1.79 -0.33 -4.83 2.02 -1.26 -0.80 118.70 112.12 3ik9 s GLU 32 Ca 0.25 -0.65 -0.05 0.00 0.02 0.00 0.00 54.97 54.55 3ik9 s GLU 32 Cb -0.06 -1.59 0.05 0.00 0.10 0.00 0.00 34.13 32.63 3ik9 s GLU 32 CO 0.12 0.29 0.07 0.21 0.02 0.00 0.00 175.26 175.97 3ik9 s LYS 33 N -0.09 2.53 0.06 1.61 2.20 -0.55 -4.91 119.74 120.58 3ik9 s LYS 33 Ca -0.01 -1.24 -0.28 0.00 -0.36 0.00 0.00 55.97 54.08 3ik9 s LYS 33 Cb -0.11 -3.36 -0.05 0.00 -1.51 0.00 0.00 37.83 32.80 3ik9 s LYS 33 CO 0.02 -0.67 0.90 -0.06 -0.36 0.00 0.00 175.35 175.18 3ik9 s PHE 34 N 1.34 3.74 -0.51 4.03 0.08 -1.26 -3.55 117.98 121.85 3ik9 s PHE 34 Ca -0.03 1.66 -0.25 0.00 0.12 0.00 0.00 56.93 58.43 3ik9 s PHE 34 Cb -0.20 -2.99 0.03 0.00 -0.57 0.00 0.00 43.02 39.29 3ik9 s PHE 34 CO 0.01 0.17 0.96 0.42 -0.10 0.00 0.00 175.22 176.68 3ik9 s ILE 35 N 0.26 4.39 -0.41 0.64 1.01 0.98 -4.89 121.20 123.18 3ik9 s ILE 35 Ca 0.45 0.56 0.17 0.00 0.00 0.00 0.00 60.65 61.83 3ik9 s ILE 35 Cb -0.22 -4.51 -0.23 0.00 0.01 0.00 0.00 42.46 37.51 3ik9 s ILE 35 CO 0.27 -1.01 0.55 0.29 0.00 0.00 0.00 174.94 175.05 3ik9 n LYS 36 N 7.42 0.93 -3.96 2.79 4.76 -1.26 -4.22 118.16 124.62 3ik9 n LYS 36 Ca 0.04 -0.08 -0.09 0.00 -2.87 0.00 0.00 58.31 55.31 3ik9 n LYS 36 Cb 0.48 -1.37 -0.06 0.00 -1.84 0.00 0.00 35.03 32.25 3ik9 n LYS 36 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3ik9 s SER 37 N -3.34 -0.07 0.43 4.39 1.04 -1.26 -5.02 113.70 109.87 3ik9 s SER 37 Ca -0.00 -0.86 0.19 0.00 0.48 0.00 0.00 55.95 55.75 3ik9 s SER 37 Cb 0.12 0.54 1.12 0.00 0.10 0.00 0.00 66.02 67.90 3ik9 s SER 37 CO 0.72 -1.05 1.86 0.00 0.98 0.00 0.00 173.24 175.76 3ik9 h ALA 38 N 2.34 2.26 -0.29 5.32 0.00 -1.92 -2.33 119.26 124.63 3ik9 h ALA 38 Ca -0.28 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 3ik9 h ALA 38 Cb 1.25 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3ik9 h ALA 38 CO 0.40 -0.53 -0.43 0.93 0.00 0.00 0.00 179.25 179.62 3ik9 h GLU 39 N 0.37 0.72 -0.53 0.00 3.07 -1.95 0.18 114.58 116.44 3ik9 h GLU 39 Ca 0.46 -0.39 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 3ik9 h GLU 39 Cb 1.19 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.09 3ik9 h GLU 39 CO -0.16 1.00 0.29 -0.44 -1.40 0.00 0.00 179.01 178.31 3ik9 h ASP 40 N 0.58 0.66 0.11 1.42 3.32 -1.82 -1.31 116.42 119.37 3ik9 h ASP 40 Ca 0.04 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 3ik9 h ASP 40 Cb 0.97 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.36 3ik9 h ASP 40 CO 0.09 0.56 -0.05 0.25 -1.72 0.00 0.00 179.24 178.37 3ik9 h LEU 41 N 0.71 -0.12 -1.68 1.55 5.85 -1.20 -2.59 115.31 117.83 3ik9 h LEU 41 Ca 0.19 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 3ik9 h LEU 41 Cb 0.04 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3ik9 h LEU 41 CO -0.03 -0.00 -0.19 0.44 -0.34 0.00 0.00 178.44 178.32 3ik9 h ASP 42 N -0.24 0.00 -0.37 1.25 3.32 -0.52 0.43 116.42 120.31 3ik9 h ASP 42 Ca -0.01 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 3ik9 h ASP 42 Cb 0.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3ik9 h ASP 42 CO 0.02 0.19 -0.01 0.50 -1.72 0.00 0.00 179.24 178.22 3ik9 h LYS 43 N 0.00 0.66 -0.06 3.56 1.63 -1.10 0.32 116.57 121.58 3ik9 h LYS 43 Ca -0.00 -0.22 -0.00 0.00 -0.85 0.00 0.00 60.65 59.58 3ik9 h LYS 43 Cb 0.39 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 3ik9 h LYS 43 CO 0.02 0.77 0.03 -0.07 -3.45 0.00 0.00 179.45 176.76 3ik9 h LEU 44 N 0.47 0.07 -0.00 5.20 3.38 -0.99 0.25 115.31 123.69 3ik9 h LEU 44 Ca 0.10 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.04 3ik9 h LEU 44 Cb 0.48 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 3ik9 h LEU 44 CO 0.02 0.11 -0.29 0.03 0.09 0.00 0.00 178.44 178.40 3ik9 h ARG 45 N 0.02 -0.42 0.00 1.13 3.08 -0.87 -2.08 114.38 115.23 3ik9 h ARG 45 Ca 0.02 0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 3ik9 h ARG 45 Cb 0.06 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 3ik9 h ARG 45 CO -0.00 -0.28 -0.11 -0.97 -1.07 0.00 0.00 179.97 177.53 3ik9 h ASN 46 N -0.44 0.00 0.40 7.04 -1.24 -0.83 -0.62 115.58 119.89 3ik9 h ASN 46 Ca 0.06 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.07 3ik9 h ASN 46 Cb 0.53 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.58 3ik9 h ASN 46 CO -0.25 0.11 0.00 0.47 -1.29 0.00 0.00 177.43 176.47 3ik9 n ASP 47 N -3.17 0.00 -0.11 1.15 9.92 0.87 -4.92 116.55 120.30 3ik9 n ASP 47 Ca 0.02 -0.27 -0.01 0.00 -0.53 0.00 0.00 54.79 54.00 3ik9 n ASP 47 Cb 0.48 -0.22 -0.00 0.00 -0.64 0.00 0.00 41.12 40.73 3ik9 n ASP 47 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ik9 n GLY 48 N 0.95 0.38 0.19 0.44 0.00 -0.24 -4.95 105.19 101.95 3ik9 n GLY 48 Ca 0.15 -0.92 0.10 0.00 0.00 0.00 0.00 46.02 45.35 3ik9 n GLY 48 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3ik9 h TYR 49 N 0.00 0.00 -3.57 1.61 -1.99 -1.55 -3.44 116.97 108.04 3ik9 h TYR 49 Ca -0.03 0.00 -0.66 0.00 2.00 0.00 0.00 58.73 60.04 3ik9 h TYR 49 Cb 0.66 0.00 -0.39 0.00 2.00 0.00 0.00 36.73 39.00 3ik9 h TYR 49 CO 0.03 0.10 -0.65 -0.51 -0.00 0.00 0.00 178.16 177.14 3ik9 s LEU 50 N -6.09 4.76 0.29 3.88 1.43 -1.25 -4.85 118.68 116.84 3ik9 s LEU 50 Ca 0.05 -2.42 0.04 0.00 -1.03 0.00 0.00 54.13 50.77 3ik9 s LEU 50 Cb 0.06 -1.68 0.73 0.00 0.03 0.00 0.00 46.19 45.33 3ik9 s LEU 50 CO 0.71 -0.36 1.70 -0.03 0.23 0.00 0.00 176.35 178.60 3ik9 h MET 51 N 7.34 0.42 -0.28 1.70 1.85 -1.87 -0.11 114.93 123.98 3ik9 h MET 51 Ca -0.06 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 59.00 3ik9 h MET 51 Cb 0.99 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 32.92 3ik9 h MET 51 CO 0.60 0.28 0.00 1.19 -0.40 0.00 0.00 176.91 178.58 3ik9 n PHE 52 N -5.02 0.89 -1.72 1.39 3.72 -1.26 -4.96 117.46 110.50 3ik9 n PHE 52 Ca 0.22 -0.81 -0.13 0.00 -0.05 0.00 0.00 57.45 56.69 3ik9 n PHE 52 Cb 0.64 -0.27 -0.03 0.00 -0.94 0.00 0.00 39.48 38.88 3ik9 n PHE 52 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3ik9 n GLN 53 N -0.30 -0.93 -4.24 -1.08 1.13 -0.05 -5.01 117.38 106.90 3ik9 n GLN 53 Ca 0.20 0.81 -0.15 0.00 -1.94 0.00 0.00 57.00 55.92 3ik9 n GLN 53 Cb 0.82 -4.91 -0.10 0.00 0.11 0.00 0.00 30.24 26.16 3ik9 n GLN 53 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3ik9 s GLN 54 N -3.70 1.03 0.29 -1.09 -0.21 -1.26 -4.97 119.66 109.74 3ik9 s GLN 54 Ca 0.00 -1.39 0.10 0.00 0.02 0.00 0.00 55.36 54.09 3ik9 s GLN 54 Cb 0.00 -0.64 -0.05 0.00 1.00 0.00 0.00 33.01 33.32 3ik9 s GLN 54 CO 0.00 0.09 -0.05 0.14 -2.12 0.00 0.00 175.29 173.35 3ik9 s VAL 55 N -3.07 3.01 0.66 1.09 -7.23 -1.26 -4.65 120.40 108.94 3ik9 s VAL 55 Ca 0.14 -2.05 -0.17 0.00 -1.81 0.00 0.00 61.98 58.09 3ik9 s VAL 55 Cb 0.01 -2.70 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 3ik9 s VAL 55 CO 0.01 -0.34 1.22 -0.81 -0.31 0.00 0.00 175.10 174.87 3ik9 n PRO 56 N -0.85 0.96 -3.97 4.82 -0.04 -1.26 -4.97 135.00 129.69 3ik9 n PRO 56 Ca -0.05 0.38 -0.13 0.00 -0.04 0.00 0.00 63.50 63.66 3ik9 n PRO 56 Cb 0.60 -2.45 -0.14 0.00 -0.04 0.00 0.00 33.50 31.47 3ik9 n PRO 56 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 3ik9 s MET 57 N -3.35 0.15 -0.09 0.54 1.75 -1.10 -3.82 119.30 113.38 3ik9 s MET 57 Ca 0.81 -0.09 0.00 0.00 -1.25 0.00 0.00 55.69 55.16 3ik9 s MET 57 Cb -0.38 -0.13 0.02 0.00 2.84 0.00 0.00 34.83 37.19 3ik9 s MET 57 CO 0.43 0.03 -0.07 0.08 -0.65 0.00 0.00 175.02 174.84 3ik9 s VAL 58 N -0.10 0.92 -0.22 10.11 1.01 -0.35 -0.27 120.40 131.50 3ik9 s VAL 58 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.49 3ik9 s VAL 58 Cb -0.01 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 3ik9 s VAL 58 CO -0.00 0.34 0.77 -1.61 0.00 0.00 0.00 175.10 174.60 3ik9 s GLU 59 N 1.49 4.21 -0.23 2.72 2.02 -0.33 -1.40 118.70 127.17 3ik9 s GLU 59 Ca 0.00 0.85 -0.11 0.00 0.02 0.00 0.00 54.97 55.73 3ik9 s GLU 59 Cb -0.13 -3.62 0.09 0.00 0.10 0.00 0.00 34.13 30.57 3ik9 s GLU 59 CO -0.05 -0.41 0.54 -1.50 0.02 0.00 0.00 175.26 173.86 3ik9 s ILE 60 N 2.47 -0.34 -1.39 -1.63 2.07 -0.91 -0.78 121.20 120.69 3ik9 s ILE 60 Ca 0.33 0.07 -0.01 0.00 -1.41 0.00 0.00 60.65 59.63 3ik9 s ILE 60 Cb -0.16 -0.80 0.00 0.00 0.13 0.00 0.00 42.46 41.63 3ik9 s ILE 60 CO 0.09 0.03 0.43 0.47 -1.91 0.00 0.00 174.94 174.05 3ik9 n ASP 61 N 4.76 -0.52 0.00 4.50 8.00 -1.26 -2.02 116.55 130.01 3ik9 n ASP 61 Ca -0.17 -1.01 0.00 0.00 0.71 0.00 0.00 54.79 54.32 3ik9 n ASP 61 Cb 0.54 -3.06 0.00 0.00 -0.02 0.00 0.00 41.12 38.58 3ik9 n ASP 61 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ik9 n GLY 62 N -1.97 0.45 3.62 0.44 0.00 -1.26 -4.98 105.19 101.48 3ik9 n GLY 62 Ca -0.30 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 3ik9 n GLY 62 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ik9 s MET 63 N -0.59 2.29 -0.51 1.61 -1.94 -0.86 -5.09 119.30 114.22 3ik9 s MET 63 Ca 0.00 -0.95 -0.13 0.00 -1.71 0.00 0.00 55.69 52.91 3ik9 s MET 63 Cb 0.00 -2.39 0.12 0.00 2.01 0.00 0.00 34.83 34.57 3ik9 s MET 63 CO 0.00 0.52 0.43 0.15 -0.01 0.00 0.00 175.02 176.11 3ik9 s LYS 64 N -2.20 2.75 -0.26 2.03 1.02 -1.26 -2.15 119.74 119.67 3ik9 s LYS 64 Ca 0.23 -1.72 -0.11 0.00 0.02 0.00 0.00 55.97 54.38 3ik9 s LYS 64 Cb -0.11 -4.12 -0.05 0.00 -0.52 0.00 0.00 37.83 33.02 3ik9 s LYS 64 CO 0.15 -1.26 0.18 -0.51 -0.92 0.00 0.00 175.35 172.99 3ik9 s LEU 65 N 1.49 4.06 0.47 3.17 1.43 -0.49 -4.91 118.68 123.90 3ik9 s LEU 65 Ca 0.04 0.04 0.06 0.00 -1.03 0.00 0.00 54.13 53.24 3ik9 s LEU 65 Cb -0.28 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.81 3ik9 s LEU 65 CO 0.01 -0.00 0.22 0.68 0.23 0.00 0.00 176.35 177.49 3ik9 s VAL 66 N 1.47 1.93 0.08 -1.59 -7.23 -1.26 -1.21 120.40 112.59 3ik9 s VAL 66 Ca 0.07 -1.68 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 3ik9 s VAL 66 Cb -0.15 -2.61 0.00 0.00 0.56 0.00 0.00 36.38 34.18 3ik9 s VAL 66 CO 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.87 3ik9 n GLN 67 N -1.41 -2.94 -0.18 4.82 1.13 -1.25 -4.44 117.38 113.10 3ik9 n GLN 67 Ca -0.04 2.33 -0.00 0.00 -1.94 0.00 0.00 57.00 57.35 3ik9 n GLN 67 Cb 0.65 -2.48 0.09 0.00 0.11 0.00 0.00 30.24 28.60 3ik9 n GLN 67 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 3ik9 h THR 68 N 2.32 0.57 -0.62 5.09 2.02 -1.90 -0.72 112.91 119.67 3ik9 h THR 68 Ca 0.00 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.09 3ik9 h THR 68 Cb 0.00 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 3ik9 h THR 68 CO 0.00 0.03 0.23 0.03 0.37 0.00 0.00 175.52 176.17 3ik9 h ARG 69 N 0.15 0.92 -0.32 6.66 3.08 -1.97 0.19 114.38 123.09 3ik9 h ARG 69 Ca 0.29 -0.16 -0.17 0.00 0.07 0.00 0.00 59.98 60.02 3ik9 h ARG 69 Cb 0.46 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 3ik9 h ARG 69 CO -0.46 0.77 -0.45 0.00 -1.07 0.00 0.00 179.97 178.77 3ik9 h ALA 70 N 1.35 0.48 0.53 0.04 0.00 -1.47 0.14 119.26 120.33 3ik9 h ALA 70 Ca 0.21 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3ik9 h ALA 70 Cb 0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3ik9 h ALA 70 CO -0.01 0.63 -0.44 0.82 0.00 0.00 0.00 179.25 180.24 3ik9 h ILE 71 N 0.65 0.11 -0.62 0.00 2.04 -0.73 -1.20 117.51 117.77 3ik9 h ILE 71 Ca 0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.91 3ik9 h ILE 71 Cb 1.05 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 3ik9 h ILE 71 CO 0.10 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 178.58 3ik9 h LEU 72 N -0.96 0.66 -0.59 1.44 3.38 -0.59 -2.04 115.31 116.61 3ik9 h LEU 72 Ca -0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3ik9 h LEU 72 Cb 0.82 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3ik9 h LEU 72 CO -0.01 0.47 0.34 0.78 0.09 0.00 0.00 178.44 180.11 3ik9 h ASN 73 N 0.79 0.72 -0.18 -0.43 2.35 -0.61 0.34 115.58 118.56 3ik9 h ASN 73 Ca 0.24 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3ik9 h ASN 73 Cb -0.03 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 3ik9 h ASN 73 CO -0.08 0.58 0.12 0.22 -1.65 0.00 0.00 177.43 176.62 3ik9 h TYR 74 N 0.80 0.23 0.22 1.19 3.20 -0.97 -1.17 116.97 120.46 3ik9 h TYR 74 Ca 0.21 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 3ik9 h TYR 74 Cb 0.00 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.20 3ik9 h TYR 74 CO -0.02 0.14 -0.10 0.82 -1.64 0.00 0.00 178.16 177.36 3ik9 h ILE 75 N 0.25 0.86 -0.71 1.81 2.04 -1.03 0.15 117.51 120.87 3ik9 h ILE 75 Ca 0.07 -0.46 0.15 0.00 1.00 0.00 0.00 64.86 65.62 3ik9 h ILE 75 Cb -0.03 1.13 -0.13 0.00 -0.74 0.00 0.00 36.82 37.05 3ik9 h ILE 75 CO -0.02 0.10 -0.09 0.00 0.00 0.00 0.00 178.15 178.15 3ik9 h ALA 76 N 0.21 0.60 -0.13 1.87 0.00 -0.32 -1.77 119.26 119.72 3ik9 h ALA 76 Ca -0.03 0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.90 3ik9 h ALA 76 Cb 0.39 0.47 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3ik9 h ALA 76 CO 0.05 -0.42 -0.81 1.03 0.00 0.00 0.00 179.25 179.10 3ik9 h SER 77 N 0.05 0.92 -0.78 0.00 0.87 -0.93 0.18 113.55 113.86 3ik9 h SER 77 Ca 0.37 -0.62 0.04 0.00 -1.23 0.00 0.00 61.79 60.35 3ik9 h SER 77 Cb 0.60 -0.27 -0.05 0.00 -0.44 0.00 0.00 62.40 62.24 3ik9 h SER 77 CO -0.68 1.42 0.48 0.50 -0.53 0.00 0.00 176.83 178.02 3ik9 h LYS 78 N 0.51 0.89 -0.55 2.24 3.64 -0.16 -2.98 116.57 120.17 3ik9 h LYS 78 Ca -0.06 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.13 3ik9 h LYS 78 Cb 1.44 -0.20 -0.08 0.00 -0.41 0.00 0.00 32.23 32.98 3ik9 h LYS 78 CO 0.16 0.59 0.13 0.66 -2.27 0.00 0.00 179.45 178.72 3ik9 n TYR 79 N -4.64 1.86 -3.26 1.91 4.01 -0.72 -4.95 117.16 111.36 3ik9 n TYR 79 Ca 0.10 -1.12 -0.24 0.00 -0.16 0.00 0.00 57.90 56.48 3ik9 n TYR 79 Cb 0.12 -0.55 0.03 0.00 -0.31 0.00 0.00 39.34 38.63 3ik9 n TYR 79 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3ik9 n ASN 80 N -0.28 -5.49 -1.27 7.72 3.02 -0.94 -4.88 115.26 113.14 3ik9 n ASN 80 Ca 0.34 -0.39 0.08 0.00 -0.03 0.00 0.00 54.58 54.57 3ik9 n ASN 80 Cb 1.20 -4.43 0.30 0.00 -0.61 0.00 0.00 39.78 36.24 3ik9 n ASN 80 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3ik9 n LEU 81 N -4.16 4.39 -1.82 3.41 4.77 0.59 -4.51 117.00 119.67 3ik9 n LEU 81 Ca -0.06 -2.66 -0.20 0.00 -0.03 0.00 0.00 56.01 53.06 3ik9 n LEU 81 Cb 0.59 -0.53 0.09 0.00 -2.33 0.00 0.00 43.42 41.23 3ik9 n LEU 81 CO 0.53 0.72 0.62 0.00 -1.33 0.00 0.00 177.39 177.94 3ik9 n TYR 82 N 0.40 2.33 -1.72 -1.77 4.19 -1.10 -0.91 117.16 118.59 3ik9 n TYR 82 Ca 0.23 -2.22 0.11 0.00 3.31 0.00 0.00 57.90 59.32 3ik9 n TYR 82 Cb 0.88 -0.64 -0.03 0.00 0.49 0.00 0.00 39.34 40.04 3ik9 n TYR 82 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3ik9 n GLY 83 N -0.89 -1.87 0.00 2.98 0.00 -1.26 -4.53 105.19 99.62 3ik9 n GLY 83 Ca 0.45 -1.24 0.03 0.00 0.00 0.00 0.00 46.02 45.26 3ik9 n GLY 83 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3ik9 n LYS 84 N -2.92 3.76 -3.97 1.61 2.85 -1.26 -4.98 118.16 113.26 3ik9 n LYS 84 Ca 0.01 -0.01 -0.09 0.00 -1.05 0.00 0.00 58.31 57.16 3ik9 n LYS 84 Cb 0.37 -0.90 -0.05 0.00 -0.65 0.00 0.00 35.03 33.80 3ik9 n LYS 84 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 3ik9 s ASP 85 N -1.91 -0.10 0.43 -5.58 1.47 -1.26 -5.04 116.67 104.68 3ik9 s ASP 85 Ca 0.02 -0.88 0.12 0.00 1.18 0.00 0.00 52.55 52.98 3ik9 s ASP 85 Cb 0.05 0.58 0.98 0.00 -0.34 0.00 0.00 42.92 44.19 3ik9 s ASP 85 CO 0.29 -1.12 2.01 -0.29 0.68 0.00 0.00 175.17 176.75 3ik9 h ILE 86 N 2.26 0.97 0.00 2.11 2.10 -1.96 -1.30 117.51 121.70 3ik9 h ILE 86 Ca -0.26 -0.15 -0.21 0.00 1.08 0.00 0.00 64.86 65.32 3ik9 h ILE 86 Cb 1.25 0.49 -0.01 0.00 -1.09 0.00 0.00 36.82 37.46 3ik9 h ILE 86 CO 0.36 0.08 -0.90 0.11 -1.08 0.00 0.00 178.15 176.72 3ik9 h LYS 87 N 0.44 0.27 -0.55 2.19 1.57 -1.99 -2.45 116.57 116.05 3ik9 h LYS 87 Ca 0.22 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 3ik9 h LYS 87 Cb 0.31 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 3ik9 h LYS 87 CO -0.06 1.01 0.00 0.93 -0.57 0.00 0.00 179.45 180.76 3ik9 h GLU 88 N 0.15 0.94 -0.19 3.15 5.08 -1.68 -2.23 114.58 119.81 3ik9 h GLU 88 Ca -0.06 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 3ik9 h GLU 88 Cb 1.53 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.67 3ik9 h GLU 88 CO 0.14 0.93 -0.17 0.00 -1.00 0.00 0.00 179.01 178.92 3ik9 h ARG 89 N 0.87 0.32 -0.10 2.33 3.08 -1.25 0.27 114.38 119.89 3ik9 h ARG 89 Ca 0.16 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 3ik9 h ARG 89 Cb 0.51 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 3ik9 h ARG 89 CO 0.03 0.49 0.04 0.00 -1.07 0.00 0.00 179.97 179.45 3ik9 h ALA 90 N 1.54 0.13 -0.34 0.04 0.00 -1.16 0.51 119.26 119.97 3ik9 h ALA 90 Ca 0.05 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3ik9 h ALA 90 Cb 0.48 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 3ik9 h ALA 90 CO 0.03 -0.27 0.22 -0.07 0.00 0.00 0.00 179.25 179.15 3ik9 h LEU 91 N -0.00 0.36 -0.44 0.00 3.38 -1.09 -0.88 115.31 116.64 3ik9 h LEU 91 Ca 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3ik9 h LEU 91 Cb 0.18 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3ik9 h LEU 91 CO -0.00 0.26 0.15 0.40 0.09 0.00 0.00 178.44 179.34 3ik9 h ILE 92 N 0.44 1.22 -0.55 1.22 2.04 -0.21 -1.16 117.51 120.51 3ik9 h ILE 92 Ca 0.13 -0.71 -0.08 0.00 1.00 0.00 0.00 64.86 65.20 3ik9 h ILE 92 Cb -0.03 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3ik9 h ILE 92 CO -0.04 0.26 0.01 0.44 0.00 0.00 0.00 178.15 178.82 3ik9 h ASP 93 N 0.57 0.94 -0.79 1.72 3.32 0.22 0.87 116.42 123.26 3ik9 h ASP 93 Ca 0.14 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3ik9 h ASP 93 Cb 0.25 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3ik9 h ASP 93 CO -0.01 1.01 0.47 -0.03 -1.72 0.00 0.00 179.24 178.96 3ik9 h MET 94 N 0.84 1.08 0.20 3.56 4.05 -0.99 -0.75 114.93 122.92 3ik9 h MET 94 Ca 0.16 -0.10 -0.01 0.00 -0.28 0.00 0.00 59.70 59.47 3ik9 h MET 94 Cb 0.52 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 3ik9 h MET 94 CO 0.03 0.76 -0.10 1.88 0.23 0.00 0.00 176.91 179.71 3ik9 h TYR 95 N 1.08 -0.25 0.00 1.39 0.05 -0.59 -2.66 116.97 116.00 3ik9 h TYR 95 Ca 0.28 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 59.05 3ik9 h TYR 95 Cb -0.03 0.08 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 3ik9 h TYR 95 CO -0.01 0.11 -0.04 -0.84 -1.05 0.00 0.00 178.16 176.33 3ik9 h ILE 96 N -0.65 0.12 0.01 -2.88 3.07 -0.80 -1.12 117.51 115.25 3ik9 h ILE 96 Ca -0.03 -0.63 -0.24 0.00 1.55 0.00 0.00 64.86 65.51 3ik9 h ILE 96 Cb 0.47 1.56 0.01 0.00 -0.27 0.00 0.00 36.82 38.59 3ik9 h ILE 96 CO 0.04 0.04 -0.99 -0.33 -1.05 0.00 0.00 178.15 175.87 3ik9 h GLU 97 N 0.00 0.52 -0.83 0.16 4.39 -1.14 0.79 114.58 118.46 3ik9 h GLU 97 Ca -0.00 -0.57 0.02 0.00 0.34 0.00 0.00 59.36 59.16 3ik9 h GLU 97 Cb 0.56 0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.32 3ik9 h GLU 97 CO 0.01 1.20 0.54 0.78 -1.16 0.00 0.00 179.01 180.37 3ik9 h GLY 98 N 0.92 1.19 0.85 -3.84 0.00 -1.04 -1.16 103.07 99.99 3ik9 h GLY 98 Ca -0.10 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 46.77 3ik9 h GLY 98 CO 0.18 0.38 -0.02 -2.22 0.00 0.00 0.00 176.54 174.86 3ik9 h ILE 99 N 1.07 1.27 -0.39 2.60 2.04 -1.02 -2.67 117.51 120.41 3ik9 h ILE 99 Ca 0.32 -0.96 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 3ik9 h ILE 99 Cb -0.04 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3ik9 h ILE 99 CO -0.10 0.30 0.05 0.00 0.00 0.00 0.00 178.15 178.41 3ik9 h ALA 100 N 0.80 1.36 0.28 1.87 0.00 -0.77 0.76 119.26 123.56 3ik9 h ALA 100 Ca 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3ik9 h ALA 100 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ik9 h ALA 100 CO 0.02 0.45 -0.23 -0.44 0.00 0.00 0.00 179.25 179.04 3ik9 h ASP 101 N 0.57 -0.60 0.15 0.00 3.32 -1.08 0.23 116.42 119.01 3ik9 h ASP 101 Ca 0.13 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3ik9 h ASP 101 Cb 0.29 0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 3ik9 h ASP 101 CO 0.00 -0.35 -0.15 0.25 -1.72 0.00 0.00 179.24 177.27 3ik9 h LEU 102 N -0.53 -0.40 -1.67 1.55 5.85 -1.07 -2.95 115.31 116.09 3ik9 h LEU 102 Ca -0.02 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.79 3ik9 h LEU 102 Cb 0.47 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 3ik9 h LEU 102 CO -0.02 -0.23 0.31 1.23 -0.34 0.00 0.00 178.44 179.39 3ik9 h GLY 103 N -0.33 0.50 1.07 3.75 0.00 0.63 0.18 103.07 108.87 3ik9 h GLY 103 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.20 3ik9 h GLY 103 CO -0.04 0.13 0.56 -2.09 0.00 0.00 0.00 176.54 175.11 3ik9 h GLU 104 N 0.42 1.06 -0.35 4.80 4.57 -0.37 -1.18 114.58 123.53 3ik9 h GLU 104 Ca 0.20 -0.06 -0.13 0.00 -1.18 0.00 0.00 59.36 58.19 3ik9 h GLU 104 Cb 0.26 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 3ik9 h GLU 104 CO -0.05 0.70 -0.30 0.52 -1.18 0.00 0.00 179.01 178.70 3ik9 h MET 105 N 1.09 0.74 -0.21 1.92 2.86 -0.54 -2.03 114.93 118.77 3ik9 h MET 105 Ca 0.33 -0.34 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 3ik9 h MET 105 Cb -0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 3ik9 h MET 105 CO -0.09 0.95 -0.42 0.82 1.06 0.00 0.00 176.91 179.23 3ik9 h ILE 106 N 0.63 1.31 -0.48 -1.22 2.04 -1.16 -1.76 117.51 116.87 3ik9 h ILE 106 Ca 0.07 -1.59 -0.09 0.00 1.00 0.00 0.00 64.86 64.25 3ik9 h ILE 106 Cb 0.82 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 3ik9 h ILE 106 CO 0.07 0.50 -0.07 0.40 0.00 0.00 0.00 178.15 179.05 3ik9 h ILE 107 N 0.41 1.26 0.00 -0.67 2.04 -1.04 -3.19 117.51 116.32 3ik9 h ILE 107 Ca 0.03 -1.14 -0.07 0.00 1.00 0.00 0.00 64.86 64.68 3ik9 h ILE 107 Cb 0.91 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.94 3ik9 h ILE 107 CO 0.08 0.40 -0.50 0.24 0.00 0.00 0.00 178.15 178.36 3ik9 h MET 108 N 0.78 0.00 -0.89 2.37 2.86 -1.14 -3.37 114.93 115.53 3ik9 h MET 108 Ca 0.14 0.00 0.24 0.00 -2.06 0.00 0.00 59.70 58.02 3ik9 h MET 108 Cb 0.56 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.08 3ik9 h MET 108 CO 0.03 0.29 0.27 1.25 1.06 0.00 0.00 176.91 179.81 3ik9 h LEU 109 N 0.00 0.06 0.00 1.22 5.85 -1.31 0.22 115.31 121.35 3ik9 h LEU 109 Ca -0.02 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3ik9 h LEU 109 Cb 1.26 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.54 3ik9 h LEU 109 CO 0.04 -0.15 0.00 -2.65 -0.34 0.00 0.00 178.44 175.34 3ik9 n PRO 110 N -5.20 0.75 -0.00 5.25 -0.02 -1.26 -3.25 135.00 131.27 3ik9 n PRO 110 Ca 0.22 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.76 3ik9 n PRO 110 Cb 0.71 -1.42 -0.08 0.00 -0.02 0.00 0.00 33.50 32.69 3ik9 n PRO 110 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ik9 n PHE 111 N -0.92 0.00 -1.38 6.00 3.72 0.76 -5.01 117.46 120.63 3ik9 n PHE 111 Ca 0.15 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.24 3ik9 n PHE 111 Cb 0.07 -0.17 0.08 0.00 -0.94 0.00 0.00 39.48 38.52 3ik9 n PHE 111 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ik9 n PRO 113 N -3.38 2.11 -0.27 0.00 -0.02 -1.26 -4.83 135.00 127.35 3ik9 n PRO 113 Ca 0.08 0.76 0.08 0.00 -2.02 0.00 0.00 63.50 62.40 3ik9 n PRO 113 Cb 0.53 -2.59 0.21 0.00 -0.02 0.00 0.00 33.50 31.63 3ik9 n PRO 113 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3ik9 h PRO 114 N 2.11 0.17 0.00 0.52 0.11 -1.97 0.83 132.00 133.77 3ik9 h PRO 114 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ik9 h PRO 114 Cb 1.28 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3ik9 h PRO 114 CO 0.60 0.11 0.00 1.05 -0.21 0.00 0.00 178.00 179.55 3ik9 h GLU 115 N 0.17 0.00 -0.01 1.05 9.09 -2.04 -1.73 114.58 121.11 3ik9 h GLU 115 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 3ik9 h GLU 115 Cb 0.86 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.96 3ik9 h GLU 115 CO -0.64 0.00 -0.46 0.39 0.05 0.00 0.00 179.01 178.35 3ik9 n GLU 116 N -2.94 0.92 -0.17 1.06 1.02 0.28 -4.64 120.64 116.18 3ik9 n GLU 116 Ca -0.02 -0.70 -0.11 0.00 -0.02 0.00 0.00 57.16 56.31 3ik9 n GLU 116 Cb 0.10 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 3ik9 n GLU 116 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3ik9 h LYS 117 N 1.71 0.97 -0.26 3.49 3.64 -1.23 -2.20 116.57 122.69 3ik9 h LYS 117 Ca 0.00 -0.37 -0.19 0.00 -1.27 0.00 0.00 60.65 58.83 3ik9 h LYS 117 Cb 0.64 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 3ik9 h LYS 117 CO 0.00 1.04 -0.57 -0.44 -2.27 0.00 0.00 179.45 177.21 3ik9 h ASP 118 N 0.83 0.92 0.23 4.20 5.19 -1.82 -0.78 116.42 125.18 3ik9 h ASP 118 Ca 0.13 -0.50 0.01 0.00 -0.62 0.00 0.00 57.03 56.05 3ik9 h ASP 118 Cb 0.67 -0.26 -0.04 0.00 0.18 0.00 0.00 39.33 39.88 3ik9 h ASP 118 CO 0.05 1.29 -0.40 0.00 -3.12 0.00 0.00 179.24 177.06 3ik9 h ALA 119 N 0.72 -0.77 -0.75 3.45 0.00 -1.82 -0.19 119.26 119.90 3ik9 h ALA 119 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ik9 h ALA 119 Cb 1.17 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 19.56 3ik9 h ALA 119 CO 0.12 -0.99 0.48 0.87 0.00 0.00 0.00 179.25 179.73 3ik9 h LYS 120 N -0.71 0.99 -0.28 0.00 1.57 -1.29 -0.35 116.57 116.50 3ik9 h LYS 120 Ca 0.00 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3ik9 h LYS 120 Cb 0.69 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3ik9 h LYS 120 CO -0.17 0.67 0.05 1.25 -0.57 0.00 0.00 179.45 180.69 3ik9 h LEU 121 N 1.02 0.44 -1.48 2.94 5.85 -0.86 0.21 115.31 123.43 3ik9 h LEU 121 Ca 0.27 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3ik9 h LEU 121 Cb -0.09 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 3ik9 h LEU 121 CO -0.06 0.57 0.07 0.00 -0.34 0.00 0.00 178.44 178.69 3ik9 h ALA 122 N 0.88 1.59 0.20 1.25 0.00 -0.72 0.11 119.26 122.57 3ik9 h ALA 122 Ca 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3ik9 h ALA 122 Cb 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3ik9 h ALA 122 CO 0.00 0.31 -0.09 1.25 0.00 0.00 0.00 179.25 180.72 3ik9 h LEU 123 N 0.41 -0.22 0.03 0.00 5.85 -0.49 -1.85 115.31 119.04 3ik9 h LEU 123 Ca 0.10 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.63 3ik9 h LEU 123 Cb 0.16 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 3ik9 h LEU 123 CO -0.00 0.11 -0.42 0.40 -0.34 0.00 0.00 178.44 178.19 3ik9 h ILE 124 N -0.58 0.15 -0.75 4.05 2.04 -0.28 -0.16 117.51 121.97 3ik9 h ILE 124 Ca -0.03 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.00 3ik9 h ILE 124 Cb 0.43 0.15 -0.12 0.00 -0.74 0.00 0.00 36.82 36.54 3ik9 h ILE 124 CO 0.04 0.00 0.09 0.11 0.00 0.00 0.00 178.15 178.40 3ik9 h LYS 125 N -0.60 0.17 -0.68 2.37 1.57 -0.83 0.31 116.57 118.88 3ik9 h LYS 125 Ca 0.04 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 3ik9 h LYS 125 Cb 0.66 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.90 3ik9 h LYS 125 CO -0.30 0.11 0.19 1.49 -0.57 0.00 0.00 179.45 180.38 3ik9 h GLU 126 N 0.17 1.05 -0.57 3.15 4.57 -0.44 -0.59 114.58 121.94 3ik9 h GLU 126 Ca 0.42 -0.23 -0.10 0.00 -1.18 0.00 0.00 59.36 58.27 3ik9 h GLU 126 Cb 0.75 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 3ik9 h GLU 126 CO -0.60 0.91 -0.05 0.87 -1.18 0.00 0.00 179.01 178.97 3ik9 h LYS 127 N 1.01 1.02 0.18 1.92 1.57 0.11 0.29 116.57 122.66 3ik9 h LYS 127 Ca 0.22 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 3ik9 h LYS 127 Cb 0.31 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 3ik9 h LYS 127 CO -0.00 1.03 -0.29 0.82 -0.57 0.00 0.00 179.45 180.44 3ik9 h ILE 128 N 0.92 0.39 -0.34 1.86 2.04 -0.05 0.12 117.51 122.44 3ik9 h ILE 128 Ca 0.16 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.88 3ik9 h ILE 128 Cb 0.60 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3ik9 h ILE 128 CO 0.04 0.00 -0.33 0.50 0.00 0.00 0.00 178.15 178.36 3ik9 h LYS 129 N -0.54 0.76 0.00 2.37 1.63 -0.90 -1.12 116.57 118.78 3ik9 h LYS 129 Ca 0.02 -0.36 -0.04 0.00 -0.85 0.00 0.00 60.65 59.41 3ik9 h LYS 129 Cb 0.54 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 3ik9 h LYS 129 CO -0.13 0.98 -1.98 0.09 -3.45 0.00 0.00 179.45 174.96 3ik9 n ASN 130 N -4.07 0.29 0.01 4.20 3.02 0.07 -4.36 115.26 114.42 3ik9 n ASN 130 Ca -0.01 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.54 3ik9 n ASN 130 Cb 0.49 1.83 -0.00 0.00 -0.61 0.00 0.00 39.78 41.49 3ik9 n ASN 130 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3ik9 n ARG 131 N -2.27 0.01 -0.04 3.52 0.63 0.22 -4.79 116.66 113.94 3ik9 n ARG 131 Ca -0.07 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.73 3ik9 n ARG 131 Cb 0.61 -0.13 -0.11 0.00 0.45 0.00 0.00 32.46 33.27 3ik9 n ARG 131 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 3ik9 h TYR 132 N -0.01 0.01 -0.35 -0.14 0.05 -1.04 -1.84 116.97 113.65 3ik9 h TYR 132 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3ik9 h TYR 132 Cb 0.01 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 3ik9 h TYR 132 CO -0.01 0.71 0.22 0.74 -1.05 0.00 0.00 178.16 178.78 3ik9 h PHE 133 N -0.70 0.45 -0.64 4.88 -1.00 -1.41 -0.98 116.94 117.53 3ik9 h PHE 133 Ca -0.00 0.01 0.12 0.00 2.81 0.00 0.00 57.97 60.90 3ik9 h PHE 133 Cb 0.72 -0.15 -0.09 0.00 3.61 0.00 0.00 35.95 40.04 3ik9 h PHE 133 CO 0.17 0.30 0.19 -1.35 -1.61 0.00 0.00 178.31 176.01 3ik9 h PRO 134 N 0.46 0.32 -0.24 1.51 0.11 -1.73 0.19 132.00 132.63 3ik9 h PRO 134 Ca 0.13 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 3ik9 h PRO 134 Cb -0.03 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 3ik9 h PRO 134 CO -0.03 0.21 0.14 0.00 -0.21 0.00 0.00 178.00 178.12 3ik9 h ALA 135 N 1.49 0.31 -0.06 -0.75 0.00 -0.89 0.20 119.26 119.56 3ik9 h ALA 135 Ca 0.34 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 55.01 3ik9 h ALA 135 Cb 0.50 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3ik9 h ALA 135 CO -0.39 -0.18 -0.78 0.74 0.00 0.00 0.00 179.25 178.64 3ik9 h PHE 136 N 0.29 0.54 0.09 0.00 0.04 -0.62 -2.14 116.94 115.14 3ik9 h PHE 136 Ca 0.09 -0.25 0.00 0.00 2.80 0.00 0.00 57.97 60.60 3ik9 h PHE 136 Cb 0.03 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 3ik9 h PHE 136 CO -0.04 1.02 -0.07 1.49 -0.60 0.00 0.00 178.31 180.11 3ik9 h GLU 137 N 0.25 -0.16 -0.85 1.51 4.57 -0.53 -2.27 114.58 117.10 3ik9 h GLU 137 Ca -0.04 0.01 0.21 0.00 -1.18 0.00 0.00 59.36 58.36 3ik9 h GLU 137 Cb 1.37 0.04 -0.13 0.00 -0.16 0.00 0.00 28.75 29.87 3ik9 h GLU 137 CO 0.13 -0.11 0.29 -0.22 -1.18 0.00 0.00 179.01 177.93 3ik9 h LYS 138 N -0.17 0.30 -0.49 1.92 3.64 -0.40 0.37 116.57 121.74 3ik9 h LYS 138 Ca -0.00 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3ik9 h LYS 138 Cb 0.15 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 3ik9 h LYS 138 CO -0.01 0.20 0.21 0.28 -2.27 0.00 0.00 179.45 177.87 3ik9 h VAL 139 N 0.31 1.20 -0.05 2.00 2.07 -0.94 -0.53 116.25 120.32 3ik9 h VAL 139 Ca 0.52 -0.60 -0.19 0.00 0.82 0.00 0.00 66.70 67.25 3ik9 h VAL 139 Cb 0.98 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3ik9 h VAL 139 CO -0.56 0.23 -0.77 -0.07 0.02 0.00 0.00 177.57 176.42 3ik9 h LEU 140 N 0.65 0.42 -0.14 2.57 3.38 -0.63 -3.18 115.31 118.38 3ik9 h LEU 140 Ca 0.17 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 3ik9 h LEU 140 Cb 0.16 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 3ik9 h LEU 140 CO -0.02 1.04 -0.01 0.50 0.09 0.00 0.00 178.44 180.05 3ik9 h LYS 141 N 0.23 0.26 0.21 1.13 1.63 -0.18 -0.82 116.57 119.03 3ik9 h LYS 141 Ca -0.04 -0.09 0.01 0.00 -0.85 0.00 0.00 60.65 59.69 3ik9 h LYS 141 Cb 1.36 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.93 3ik9 h LYS 141 CO 0.13 0.51 -0.35 0.77 -3.45 0.00 0.00 179.45 177.05 3ik9 h SER 142 N -0.01 -1.01 0.53 4.20 0.02 -1.14 -3.13 113.55 113.00 3ik9 h SER 142 Ca 0.04 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 3ik9 h SER 142 Cb 0.40 0.37 0.00 0.00 0.14 0.00 0.00 62.40 63.30 3ik9 h SER 142 CO 0.01 -0.46 -0.41 0.00 -1.14 0.00 0.00 176.83 174.83 3ik9 n HIS 143 N -5.45 0.00 -0.40 3.45 1.44 -1.20 -4.96 115.22 108.10 3ik9 n HIS 143 Ca -0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.63 3ik9 n HIS 143 Cb 0.35 -0.26 0.00 0.00 0.12 0.00 0.00 29.99 30.20 3ik9 n HIS 143 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3ik9 n GLY 144 N 1.48 0.56 3.88 -1.39 0.00 -0.31 -4.98 105.19 104.43 3ik9 n GLY 144 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3ik9 n GLY 144 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ik9 s GLN 145 N -0.42 3.29 0.28 1.61 -0.21 -1.26 -4.98 119.66 117.99 3ik9 s GLN 145 Ca 0.00 0.51 0.25 0.00 0.02 0.00 0.00 55.36 56.14 3ik9 s GLN 145 Cb 0.00 -2.12 0.93 0.00 1.00 0.00 0.00 33.01 32.82 3ik9 s GLN 145 CO 0.00 -0.68 1.76 -0.44 -2.12 0.00 0.00 175.29 173.81 3ik9 h ASP 146 N -0.33 0.00 -2.48 5.90 3.32 -1.93 -3.45 116.42 117.44 3ik9 h ASP 146 Ca -0.45 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.04 3ik9 h ASP 146 Cb 1.22 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.63 3ik9 h ASP 146 CO 0.62 0.00 -0.73 -0.31 -1.72 0.00 0.00 179.24 177.10 3ik9 s TYR 147 N -3.28 2.13 0.12 4.55 2.02 -1.26 -4.92 117.35 116.71 3ik9 s TYR 147 Ca 0.06 -0.46 -0.14 0.00 -0.37 0.00 0.00 57.07 56.16 3ik9 s TYR 147 Cb 0.10 -1.02 -0.03 0.00 -0.40 0.00 0.00 41.96 40.61 3ik9 s TYR 147 CO 0.49 0.56 1.53 -0.07 -1.57 0.00 0.00 175.55 176.50 3ik9 h LEU 148 N 2.30 0.74 -7.76 -1.29 3.38 -1.87 -3.42 115.31 107.40 3ik9 h LEU 148 Ca -0.40 -0.36 -0.30 0.00 0.09 0.00 0.00 57.88 56.92 3ik9 h LEU 148 Cb 1.25 -0.20 -0.30 0.00 0.09 0.00 0.00 40.66 41.49 3ik9 h LEU 148 CO 0.63 0.92 -0.74 -0.69 0.09 0.00 0.00 178.44 178.65 3ik9 s VAL 149 N -4.82 0.20 -1.13 1.22 1.01 -1.26 -4.85 120.40 110.77 3ik9 s VAL 149 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.80 3ik9 s VAL 149 Cb 0.10 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.27 3ik9 s VAL 149 CO 0.81 0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.60 3ik9 n GLY 150 N 3.35 1.16 2.23 4.51 0.00 -1.26 -3.50 105.19 111.67 3ik9 n GLY 150 Ca -0.17 -0.30 -0.11 0.00 0.00 0.00 0.00 46.02 45.44 3ik9 n GLY 150 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3ik9 n ASN 151 N -0.30 -3.35 -3.68 1.61 5.15 -1.26 -4.92 115.26 108.51 3ik9 n ASN 151 Ca -0.11 0.24 -0.13 0.00 -0.60 0.00 0.00 54.58 53.98 3ik9 n ASN 151 Cb 0.42 -2.98 -0.06 0.00 -0.53 0.00 0.00 39.78 36.63 3ik9 n ASN 151 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 3ik9 s LYS 152 N -4.26 1.62 0.15 1.20 -2.85 -1.23 -4.83 119.74 109.54 3ik9 s LYS 152 Ca 0.00 -1.64 -0.31 0.00 -1.00 0.00 0.00 55.97 53.02 3ik9 s LYS 152 Cb 0.00 0.39 -0.09 0.00 -2.06 0.00 0.00 37.83 36.08 3ik9 s LYS 152 CO 0.00 -0.64 1.40 -1.17 0.10 0.00 0.00 175.35 175.04 3ik9 s LEU 153 N -3.18 4.38 0.30 2.77 2.96 -1.26 -4.53 118.68 120.11 3ik9 s LEU 153 Ca 0.32 2.40 0.03 0.00 -0.22 0.00 0.00 54.13 56.66 3ik9 s LEU 153 Cb 0.02 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 3ik9 s LEU 153 CO 0.16 -0.65 0.15 -0.94 -1.32 0.00 0.00 176.35 173.75 3ik9 s SER 154 N 0.89 1.48 0.66 3.68 1.04 -1.26 -4.82 113.70 115.37 3ik9 s SER 154 Ca 0.63 -1.54 0.37 0.00 0.48 0.00 0.00 55.95 55.89 3ik9 s SER 154 Cb -0.38 0.36 2.00 0.00 0.10 0.00 0.00 66.02 68.11 3ik9 s SER 154 CO 0.33 -0.87 2.14 0.08 0.98 0.00 0.00 173.24 175.91 3ik9 h ARG 155 N 2.24 0.00 -0.06 4.02 0.11 -1.41 -2.02 114.38 117.26 3ik9 h ARG 155 Ca -0.34 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.52 3ik9 h ARG 155 Cb 1.25 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.34 3ik9 h ARG 155 CO 0.53 0.00 -0.86 0.00 0.10 0.00 0.00 179.97 179.73 3ik9 h ALA 156 N 1.68 0.36 -0.35 0.08 0.00 -1.92 0.19 119.26 119.30 3ik9 h ALA 156 Ca 0.01 -0.65 -0.06 0.00 0.00 0.00 0.00 54.91 54.20 3ik9 h ALA 156 Cb 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3ik9 h ALA 156 CO -0.00 0.74 -0.03 -0.44 0.00 0.00 0.00 179.25 179.52 3ik9 h ASP 157 N 0.36 0.62 0.24 0.00 3.32 -1.78 0.52 116.42 119.70 3ik9 h ASP 157 Ca -0.07 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.66 3ik9 h ASP 157 Cb 1.49 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 3ik9 h ASP 157 CO 0.16 0.80 -0.25 0.40 -1.72 0.00 0.00 179.24 178.64 3ik9 h ILE 158 N 0.43 0.47 -0.12 0.35 1.08 -1.38 -0.84 117.51 117.49 3ik9 h ILE 158 Ca 0.09 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.45 3ik9 h ILE 158 Cb 0.50 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.71 3ik9 h ILE 158 CO 0.02 0.00 -0.43 0.45 -0.69 0.00 0.00 178.15 177.50 3ik9 h HIS 159 N -0.52 0.32 0.14 1.37 3.86 -0.56 -2.17 115.15 117.59 3ik9 h HIS 159 Ca -0.00 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.11 3ik9 h HIS 159 Cb 0.49 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 28.89 3ik9 h HIS 159 CO -0.17 0.66 -0.07 1.25 0.86 0.00 0.00 177.93 180.47 3ik9 h LEU 160 N 0.23 -0.16 -0.41 2.43 5.85 -0.73 -2.78 115.31 119.73 3ik9 h LEU 160 Ca 0.02 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 3ik9 h LEU 160 Cb 0.86 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 3ik9 h LEU 160 CO 0.07 0.04 0.02 0.58 -0.34 0.00 0.00 178.44 178.81 3ik9 h VAL 161 N -0.35 1.25 -0.99 1.05 2.07 -0.98 0.30 116.25 118.60 3ik9 h VAL 161 Ca -0.02 -0.97 0.20 0.00 0.82 0.00 0.00 66.70 66.73 3ik9 h VAL 161 Cb 0.28 1.08 -0.19 0.00 -1.52 0.00 0.00 31.29 30.94 3ik9 h VAL 161 CO 0.03 0.33 -0.26 -0.08 0.02 0.00 0.00 177.57 177.61 3ik9 h GLU 162 N 0.55 -0.00 -0.15 1.57 4.81 -1.42 0.22 114.58 120.16 3ik9 h GLU 162 Ca 0.12 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 3ik9 h GLU 162 Cb 0.44 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 3ik9 h GLU 162 CO 0.02 -0.00 -0.43 1.25 -0.73 0.00 0.00 179.01 179.12 3ik9 h LEU 163 N -0.00 0.36 -0.80 1.64 5.85 -0.79 -2.77 115.31 118.80 3ik9 h LEU 163 Ca 0.47 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 3ik9 h LEU 163 Cb 0.71 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 3ik9 h LEU 163 CO -1.02 0.75 0.41 -0.07 -0.34 0.00 0.00 178.44 178.16 3ik9 h LEU 164 N 0.28 1.02 -0.27 2.25 3.38 0.13 -0.47 115.31 121.62 3ik9 h LEU 164 Ca 0.02 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 57.93 3ik9 h LEU 164 Cb 0.87 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 3ik9 h LEU 164 CO 0.07 0.85 -0.02 1.88 0.09 0.00 0.00 178.44 181.31 3ik9 h TYR 165 N 1.11 -0.05 -0.22 1.13 0.05 -0.97 0.17 116.97 118.18 3ik9 h TYR 165 Ca 0.28 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 59.03 3ik9 h TYR 165 Cb 0.08 0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 3ik9 h TYR 165 CO 0.01 -0.07 -0.06 1.88 -1.05 0.00 0.00 178.16 178.87 3ik9 h TYR 166 N 0.06 0.36 -0.13 4.88 0.05 -1.11 -1.59 116.97 119.49 3ik9 h TYR 166 Ca 0.13 -0.03 -0.22 0.00 0.05 0.00 0.00 58.73 58.66 3ik9 h TYR 166 Cb 0.18 -0.10 0.01 0.00 1.01 0.00 0.00 36.73 37.83 3ik9 h TYR 166 CO -0.23 0.42 -0.78 0.28 -1.05 0.00 0.00 178.16 176.80 3ik9 h VAL 167 N 0.33 1.30 -1.00 -2.88 2.07 -0.53 -1.90 116.25 113.64 3ik9 h VAL 167 Ca 0.07 -2.04 0.14 0.00 0.82 0.00 0.00 66.70 65.70 3ik9 h VAL 167 Cb 0.33 2.04 -0.09 0.00 -1.52 0.00 0.00 31.29 32.05 3ik9 h VAL 167 CO 0.01 0.64 0.62 -0.08 0.02 0.00 0.00 177.57 178.78 3ik9 h GLU 168 N 0.46 0.89 -0.57 1.57 4.81 0.08 0.36 114.58 122.19 3ik9 h GLU 168 Ca -0.05 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 3ik9 h GLU 168 Cb 1.40 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 3ik9 h GLU 168 CO 0.15 0.59 -0.02 0.93 -0.73 0.00 0.00 179.01 179.93 3ik9 h GLU 169 N 0.92 1.03 0.34 1.92 5.08 -0.87 -3.23 114.58 119.78 3ik9 h GLU 169 Ca 0.52 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 3ik9 h GLU 169 Cb 0.61 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3ik9 h GLU 169 CO -0.30 1.03 -0.16 -0.07 -1.00 0.00 0.00 179.01 178.50 3ik9 h LEU 170 N 0.92 -0.39 -6.79 1.33 4.07 -0.88 -3.46 115.31 110.11 3ik9 h LEU 170 Ca 0.16 -0.13 0.12 0.00 0.08 0.00 0.00 57.88 58.11 3ik9 h LEU 170 Cb 0.58 0.10 -0.23 0.00 1.08 0.00 0.00 40.66 42.19 3ik9 h LEU 170 CO 0.03 -0.08 0.15 -0.62 -1.08 0.00 0.00 178.44 176.85 3ik9 s ASP 171 N -4.97 -0.74 0.00 -0.43 2.15 0.07 -5.06 116.67 107.69 3ik9 s ASP 171 Ca -0.15 1.06 0.27 0.00 0.43 0.00 0.00 52.55 54.17 3ik9 s ASP 171 Cb 0.03 1.69 0.94 0.00 -0.30 0.00 0.00 42.92 45.28 3ik9 s ASP 171 CO 0.57 -0.15 1.69 -1.54 -0.17 0.00 0.00 175.17 175.56 3ik9 n SER 172 N 4.74 0.55 -0.34 -0.34 3.41 -1.22 -3.17 113.62 117.25 3ik9 n SER 172 Ca -0.13 -0.44 0.14 0.00 -0.26 0.00 0.00 58.87 58.18 3ik9 n SER 172 Cb 0.53 0.00 0.62 0.00 -0.26 0.00 0.00 64.21 65.11 3ik9 n SER 172 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3ik9 n SER 173 N -1.08 1.04 -0.03 4.04 3.41 -1.26 -4.29 113.62 115.45 3ik9 n SER 173 Ca 0.11 -1.39 -0.15 0.00 -0.26 0.00 0.00 58.87 57.17 3ik9 n SER 173 Cb 0.32 -0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.16 3ik9 n SER 173 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ik9 h LEU 174 N 1.58 0.46 0.00 1.04 3.38 -1.89 -3.10 115.31 116.78 3ik9 h LEU 174 Ca 0.00 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.31 3ik9 h LEU 174 Cb 0.34 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3ik9 h LEU 174 CO 0.00 1.04 0.00 0.00 0.09 0.00 0.00 178.44 179.57 3ik9 n ILE 175 N -4.36 0.12 -0.13 1.22 3.06 -1.26 -4.29 119.36 113.72 3ik9 n ILE 175 Ca -0.08 0.03 -0.10 0.00 -2.50 0.00 0.00 62.75 60.10 3ik9 n ILE 175 Cb 0.54 -0.72 -0.01 0.00 0.54 0.00 0.00 39.64 39.98 3ik9 n ILE 175 CO 0.00 0.00 0.00 0.77 -2.50 0.00 0.00 176.55 174.82 3ik9 h SER 176 N 0.00 0.58 0.00 9.51 4.64 -1.78 -0.20 113.55 126.30 3ik9 h SER 176 Ca 0.00 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 3ik9 h SER 176 Cb 0.05 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 3ik9 h SER 176 CO 0.00 0.67 0.00 -1.20 -0.87 0.00 0.00 176.83 175.43 3ik9 n SER 177 N -4.58 0.29 -3.62 4.97 7.64 -1.26 -4.38 113.62 112.69 3ik9 n SER 177 Ca -0.01 -1.93 -0.27 0.00 1.01 0.00 0.00 58.87 57.67 3ik9 n SER 177 Cb 0.21 -0.15 -0.10 0.00 -1.01 0.00 0.00 64.21 63.16 3ik9 n SER 177 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3ik9 n PHE 178 N -0.34 2.67 -0.21 1.43 3.72 -0.09 -4.96 117.46 119.68 3ik9 n PHE 178 Ca 0.00 -4.09 -0.02 0.00 -0.05 0.00 0.00 57.45 53.28 3ik9 n PHE 178 Cb 0.07 -0.49 0.04 0.00 -0.94 0.00 0.00 39.48 38.17 3ik9 n PHE 178 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3ik9 h PRO 179 N 4.86 -0.08 -0.04 -1.08 0.11 -1.76 -2.24 132.00 131.76 3ik9 h PRO 179 Ca 0.17 0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.17 3ik9 h PRO 179 Cb 0.75 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 3ik9 h PRO 179 CO 0.70 -0.05 -0.52 -0.07 -0.21 0.00 0.00 178.00 177.85 3ik9 h LEU 180 N -0.08 0.13 -0.47 2.35 3.38 -1.93 0.16 115.31 118.85 3ik9 h LEU 180 Ca 0.28 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 3ik9 h LEU 180 Cb 0.52 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3ik9 h LEU 180 CO -0.67 0.63 0.18 -0.07 0.09 0.00 0.00 178.44 178.60 3ik9 h LEU 181 N 0.10 0.66 -0.05 1.67 3.38 -1.79 0.03 115.31 119.31 3ik9 h LEU 181 Ca 0.00 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.81 3ik9 h LEU 181 Cb 0.96 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 3ik9 h LEU 181 CO 0.07 0.66 -0.09 0.11 0.09 0.00 0.00 178.44 179.29 3ik9 h LYS 182 N 0.62 -0.13 -0.24 1.13 1.57 -0.87 -1.36 116.57 117.30 3ik9 h LYS 182 Ca 0.16 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 3ik9 h LYS 182 Cb 0.21 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3ik9 h LYS 182 CO -0.01 -0.09 0.15 0.00 -0.57 0.00 0.00 179.45 178.93 3ik9 h ALA 183 N 0.89 0.30 -0.67 3.86 0.00 -0.75 -2.15 119.26 120.74 3ik9 h ALA 183 Ca 0.05 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.06 3ik9 h ALA 183 Cb 0.20 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 3ik9 h ALA 183 CO -0.13 -0.24 0.26 1.25 0.00 0.00 0.00 179.25 180.40 3ik9 h LEU 184 N 0.30 0.26 -1.09 0.00 5.85 -0.81 -1.52 115.31 118.31 3ik9 h LEU 184 Ca 0.09 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.93 3ik9 h LEU 184 Cb -0.02 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 3ik9 h LEU 184 CO -0.04 0.14 0.61 0.50 -0.34 0.00 0.00 178.44 179.32 3ik9 h LYS 185 N 0.44 1.17 0.23 1.25 3.64 -0.62 -1.35 116.57 121.33 3ik9 h LYS 185 Ca 0.35 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.65 3ik9 h LYS 185 Cb 0.47 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3ik9 h LYS 185 CO -0.34 0.78 -0.11 1.15 -2.27 0.00 0.00 179.45 178.66 3ik9 h THR 186 N 1.21 0.77 -0.24 1.00 2.02 -0.82 -1.32 112.91 115.54 3ik9 h THR 186 Ca 0.36 -0.89 0.05 0.00 0.77 0.00 0.00 66.41 66.70 3ik9 h THR 186 Cb -0.05 1.22 -0.05 0.00 -1.74 0.00 0.00 68.15 67.53 3ik9 h THR 186 CO -0.10 0.17 -0.07 0.03 0.37 0.00 0.00 175.52 175.93 3ik9 h ARG 187 N -0.81 -0.01 -0.43 6.66 3.08 -1.21 -0.18 114.38 121.47 3ik9 h ARG 187 Ca -0.03 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 3ik9 h ARG 187 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3ik9 h ARG 187 CO 0.05 -0.01 -0.12 0.82 -1.07 0.00 0.00 179.97 179.64 3ik9 h ILE 188 N -0.01 1.27 -0.24 2.04 1.08 -1.34 -1.72 117.51 118.59 3ik9 h ILE 188 Ca 0.12 -1.24 0.07 0.00 -0.39 0.00 0.00 64.86 63.42 3ik9 h ILE 188 Cb 0.19 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 3ik9 h ILE 188 CO -0.25 0.42 0.28 0.28 -0.69 0.00 0.00 178.15 178.19 3ik9 h SER 189 N 0.68 0.00 0.79 1.72 0.02 -0.88 -2.02 113.55 113.87 3ik9 h SER 189 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3ik9 h SER 189 Cb 0.67 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.21 3ik9 h SER 189 CO 0.05 0.00 -0.16 0.59 -1.14 0.00 0.00 176.83 176.16 3ik9 n ASN 190 N -3.74 0.18 -4.75 3.07 3.02 -0.11 -2.94 115.26 109.99 3ik9 n ASN 190 Ca 0.03 0.19 -0.41 0.00 -0.03 0.00 0.00 54.58 54.35 3ik9 n ASN 190 Cb 0.41 -0.23 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 3ik9 n ASN 190 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ik9 s LEU 191 N -2.96 4.39 0.21 3.41 1.43 -0.76 -4.76 118.68 119.64 3ik9 s LEU 191 Ca 0.14 2.68 -0.17 0.00 -1.03 0.00 0.00 54.13 55.75 3ik9 s LEU 191 Cb 0.19 -3.63 0.21 0.00 0.03 0.00 0.00 46.19 42.99 3ik9 s LEU 191 CO 0.58 -0.68 1.59 -0.65 0.23 0.00 0.00 176.35 177.41 3ik9 h PRO 192 N 4.79 -0.08 -0.51 1.29 0.10 -1.89 0.37 132.00 136.06 3ik9 h PRO 192 Ca -0.46 0.01 0.03 0.00 0.10 0.00 0.00 66.00 65.67 3ik9 h PRO 192 Cb 1.22 0.02 -0.04 0.00 0.10 0.00 0.00 31.00 32.30 3ik9 h PRO 192 CO 0.76 -0.05 0.29 1.79 0.10 0.00 0.00 178.00 180.89 3ik9 h THR 193 N -0.08 1.03 0.04 -1.15 1.35 -1.87 -1.37 112.91 110.85 3ik9 h THR 193 Ca 0.30 -0.20 -0.19 0.00 -0.55 0.00 0.00 66.41 65.77 3ik9 h THR 193 Cb 0.56 0.39 0.02 0.00 -1.73 0.00 0.00 68.15 67.40 3ik9 h THR 193 CO -0.77 0.11 -0.77 0.58 -0.25 0.00 0.00 175.52 174.42 3ik9 h VAL 194 N 0.58 1.41 -0.76 6.82 2.07 -1.58 -2.19 116.25 122.60 3ik9 h VAL 194 Ca 0.21 -2.23 0.17 0.00 0.82 0.00 0.00 66.70 65.67 3ik9 h VAL 194 Cb 0.05 2.71 -0.13 0.00 -1.52 0.00 0.00 31.29 32.40 3ik9 h VAL 194 CO -0.11 0.65 0.03 0.50 0.02 0.00 0.00 177.57 178.66 3ik9 h LYS 195 N -0.06 0.11 -0.34 1.57 3.64 -0.17 0.47 116.57 121.79 3ik9 h LYS 195 Ca -0.11 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.28 3ik9 h LYS 195 Cb 1.49 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.26 3ik9 h LYS 195 CO 0.15 0.08 0.19 -0.22 -2.27 0.00 0.00 179.45 177.37 3ik9 h LYS 196 N 0.12 0.37 0.00 1.90 3.64 -1.15 -2.60 116.57 118.85 3ik9 h LYS 196 Ca 0.42 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.71 3ik9 h LYS 196 Cb 0.74 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 3ik9 h LYS 196 CO -0.65 0.25 -0.32 0.35 -2.27 0.00 0.00 179.45 176.80 3ik9 h PHE 197 N 0.38 0.00 -0.00 1.91 3.57 -0.48 -2.80 116.94 119.52 3ik9 h PHE 197 Ca 0.13 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3ik9 h PHE 197 Cb 0.02 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.76 3ik9 h PHE 197 CO -0.08 0.32 -0.05 1.28 -2.23 0.00 0.00 178.31 177.55 3ik9 n LEU 198 N -3.63 0.06 -4.88 0.59 4.77 0.15 -4.62 117.00 109.43 3ik9 n LEU 198 Ca -0.01 0.42 -0.30 0.00 -0.03 0.00 0.00 56.01 56.10 3ik9 n LEU 198 Cb 0.44 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3ik9 n LEU 198 CO 0.36 0.01 0.60 -1.10 -1.33 0.00 0.00 177.39 175.94 3ik9 s GLN 199 N -2.95 3.61 0.49 3.23 -0.21 -1.06 -5.01 119.66 117.75 3ik9 s GLN 199 Ca 0.15 0.55 -0.22 0.00 0.02 0.00 0.00 55.36 55.86 3ik9 s GLN 199 Cb 0.19 -2.21 -0.09 0.00 1.00 0.00 0.00 33.01 31.91 3ik9 s GLN 199 CO 0.54 -0.39 0.96 -2.30 -2.12 0.00 0.00 175.29 171.98 3ik9 n PRO 200 N -2.42 1.17 -0.69 2.91 -0.02 -1.26 -3.12 135.00 131.57 3ik9 n PRO 200 Ca 0.04 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3ik9 n PRO 200 Cb 0.54 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3ik9 n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ik9 n GLY 201 N 1.25 0.96 3.76 -1.23 0.00 -1.26 -5.06 105.19 103.62 3ik9 n GLY 201 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 3ik9 n GLY 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ik9 s SER 202 N -3.03 3.07 0.00 1.61 1.04 -1.18 -4.93 113.70 110.28 3ik9 s SER 202 Ca 0.00 0.90 0.15 0.00 0.48 0.00 0.00 55.95 57.48 3ik9 s SER 202 Cb 0.00 -1.41 0.91 0.00 0.10 0.00 0.00 66.02 65.62 3ik9 s SER 202 CO 0.00 -2.82 1.37 -2.65 0.98 0.00 0.00 173.24 170.12 3ik9 n PRO 203 N -3.93 0.66 -1.84 4.02 -0.02 -1.26 -4.84 135.00 127.79 3ik9 n PRO 203 Ca 0.08 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.18 3ik9 n PRO 203 Cb 0.59 -1.36 0.04 0.00 -0.02 0.00 0.00 33.50 32.75 3ik9 n PRO 203 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3ik9 s ARG 204 N -2.00 3.15 0.16 -0.52 3.52 -1.26 -5.02 118.95 116.98 3ik9 s ARG 204 Ca 0.23 2.15 0.09 0.00 -0.13 0.00 0.00 55.73 58.07 3ik9 s ARG 204 Cb 0.10 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 31.23 3ik9 s ARG 204 CO 0.18 -1.15 -0.15 0.15 -0.81 0.00 0.00 175.30 173.52 3ik9 s LYS 205 N -2.94 1.89 0.86 5.12 -0.14 -1.26 -5.02 119.74 118.24 3ik9 s LYS 205 Ca 0.72 -1.28 -0.13 0.00 -1.36 0.00 0.00 55.97 53.91 3ik9 s LYS 205 Cb -0.38 -2.09 0.12 0.00 -1.68 0.00 0.00 37.83 33.79 3ik9 s LYS 205 CO 0.45 0.44 1.22 -1.25 -0.76 0.00 0.00 175.35 175.45 3ik9 s PRO 206 N -2.59 1.52 0.94 -1.68 0.04 -1.26 -4.86 135.00 127.11 3ik9 s PRO 206 Ca 0.22 -0.04 -0.11 0.00 0.04 0.00 0.00 61.00 61.10 3ik9 s PRO 206 Cb -0.09 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.64 3ik9 s PRO 206 CO 0.13 -1.87 0.81 -2.30 0.04 0.00 0.00 177.00 173.81 3ik9 n PRO 207 N -3.47 -0.43 -2.12 0.56 -0.02 -1.26 -4.40 135.00 123.86 3ik9 n PRO 207 Ca 0.10 -0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 61.10 3ik9 n PRO 207 Cb 0.60 -2.14 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 3ik9 n PRO 207 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3ik9 s PRO 208 N -4.19 4.33 0.46 0.52 0.04 -1.26 -4.95 135.00 129.94 3ik9 s PRO 208 Ca 0.62 2.17 0.03 0.00 0.04 0.00 0.00 61.00 63.86 3ik9 s PRO 208 Cb -0.22 -3.16 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 3ik9 s PRO 208 CO 0.62 -0.35 0.04 0.16 0.04 0.00 0.00 177.00 177.51 3ik9 s ASP 209 N 0.43 3.64 0.36 6.66 -4.77 -1.26 -4.98 116.67 116.74 3ik9 s ASP 209 Ca 0.59 -1.60 0.13 0.00 -3.30 0.00 0.00 52.55 48.37 3ik9 s ASP 209 Cb -0.39 0.33 0.95 0.00 -1.09 0.00 0.00 42.92 42.72 3ik9 s ASP 209 CO 0.39 -0.79 1.79 -0.33 0.70 0.00 0.00 175.17 176.93 3ik9 h GLU 210 N 1.58 0.53 0.50 2.11 5.08 -2.00 -1.57 114.58 120.81 3ik9 h GLU 210 Ca -0.42 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 3ik9 h GLU 210 Cb 1.29 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3ik9 h GLU 210 CO 0.71 0.35 -0.24 0.82 -1.00 0.00 0.00 179.01 179.65 3ik9 h ILE 211 N 0.55 0.41 -0.43 3.13 2.04 -2.00 -3.09 117.51 118.11 3ik9 h ILE 211 Ca 0.56 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 66.04 3ik9 h ILE 211 Cb 1.18 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3ik9 h ILE 211 CO -0.31 0.05 0.27 0.22 0.00 0.00 0.00 178.15 178.39 3ik9 h TYR 212 N -0.93 0.54 0.21 1.37 5.03 -1.83 -0.68 116.97 120.68 3ik9 h TYR 212 Ca -0.07 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.24 3ik9 h TYR 212 Cb 0.60 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.70 3ik9 h TYR 212 CO 0.00 0.35 -0.10 0.28 -1.32 0.00 0.00 178.16 177.38 3ik9 h VAL 213 N 0.58 0.88 0.00 1.81 2.07 -1.33 -1.41 116.25 118.85 3ik9 h VAL 213 Ca 0.16 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 67.01 3ik9 h VAL 213 Cb -0.05 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3ik9 h VAL 213 CO -0.03 0.13 -0.35 0.03 0.02 0.00 0.00 177.57 177.37 3ik9 h ARG 214 N -0.59 0.00 0.01 1.57 3.08 -1.45 -2.10 114.38 114.91 3ik9 h ARG 214 Ca -0.03 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.05 3ik9 h ARG 214 Cb 0.43 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 3ik9 h ARG 214 CO 0.05 0.35 -0.25 1.15 -1.07 0.00 0.00 179.97 180.20 3ik9 h THR 215 N 0.00 0.43 -0.75 2.04 2.02 -1.04 0.41 112.91 116.03 3ik9 h THR 215 Ca -0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 3ik9 h THR 215 Cb 1.02 0.43 -0.06 0.00 -1.74 0.00 0.00 68.15 67.79 3ik9 h THR 215 CO 0.05 0.00 0.44 0.58 0.37 0.00 0.00 175.52 176.95 3ik9 h VAL 216 N -0.40 1.00 0.04 3.16 2.07 -0.87 -1.89 116.25 119.36 3ik9 h VAL 216 Ca 0.06 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3ik9 h VAL 216 Cb 0.47 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 3ik9 h VAL 216 CO -0.21 0.15 -0.02 1.88 0.02 0.00 0.00 177.57 179.39 3ik9 h TYR 217 N 0.81 -0.05 0.00 1.57 0.05 -1.07 -2.92 116.97 115.36 3ik9 h TYR 217 Ca 0.33 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.11 3ik9 h TYR 217 Cb 0.17 0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.93 3ik9 h TYR 217 CO -0.06 0.02 0.00 0.09 -1.05 0.00 0.00 178.16 177.16 3ik9 n ASN 218 N -5.09 0.16 0.00 3.88 3.02 0.14 0.03 115.26 117.40 3ik9 n ASN 218 Ca -0.07 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 3ik9 n ASN 218 Cb 0.07 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 3ik9 n ASN 218 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3ik9 n ILE 219 N 1.59 0.00 0.27 2.41 5.41 -1.11 -4.02 119.36 123.92 3ik9 n ILE 219 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.78 3ik9 n ILE 219 Cb 0.02 -0.37 0.03 0.00 -0.71 0.00 0.00 39.64 38.61 3ik9 n ILE 219 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04