#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ik6 s ALA 2 N 0.00 3.26 0.00 1.55 0.00 -1.26 -4.90 121.76 120.41 1ik6 s ALA 2 Ca 0.00 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1ik6 s ALA 2 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1ik6 s ALA 2 CO 0.00 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.82 1ik6 n GLY 3 N 0.79 -0.32 3.75 0.00 0.00 -1.26 -4.56 105.19 103.59 1ik6 n GLY 3 Ca 0.02 -2.23 -0.38 0.00 0.00 0.00 0.00 46.02 43.43 1ik6 n GLY 3 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ik6 s VAL 4 N 0.00 2.25 0.16 1.61 1.01 -1.26 -4.86 120.40 119.31 1ik6 s VAL 4 Ca 0.00 0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.24 1ik6 s VAL 4 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1ik6 s VAL 4 CO 0.00 -0.00 -0.16 0.68 0.00 0.00 0.00 175.10 175.62 1ik6 s VAL 5 N -1.34 1.67 0.05 2.92 -7.23 -1.26 -1.00 120.40 114.21 1ik6 s VAL 5 Ca 0.70 -1.92 0.06 0.00 -1.81 0.00 0.00 61.98 59.00 1ik6 s VAL 5 Cb -0.39 -1.80 -0.04 0.00 0.56 0.00 0.00 36.38 34.72 1ik6 s VAL 5 CO 0.46 -0.40 -0.11 -0.04 -0.31 0.00 0.00 175.10 174.70 1ik6 s MET 6 N -2.93 2.26 -0.66 4.82 -1.94 -0.24 -4.89 119.30 115.71 1ik6 s MET 6 Ca 0.15 -0.91 -0.18 0.00 -1.71 0.00 0.00 55.69 53.04 1ik6 s MET 6 Cb -0.04 -2.34 0.12 0.00 2.01 0.00 0.00 34.83 34.57 1ik6 s MET 6 CO 0.06 0.55 0.76 1.41 -0.01 0.00 0.00 175.02 177.78 1ik6 s MET 7 N -1.73 3.17 0.11 2.03 1.75 -1.26 -0.24 119.30 123.12 1ik6 s MET 7 Ca 0.18 -1.51 0.09 0.00 -1.25 0.00 0.00 55.69 53.21 1ik6 s MET 7 Cb -0.11 -4.36 -0.04 0.00 2.84 0.00 0.00 34.83 33.17 1ik6 s MET 7 CO 0.09 -1.54 -0.23 0.00 -0.65 0.00 0.00 175.02 172.69 1ik6 s ALA 8 N 2.39 2.01 0.76 4.11 0.00 0.21 -4.78 121.76 126.45 1ik6 s ALA 8 Ca 0.14 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.78 1ik6 s ALA 8 Cb -0.20 -0.30 0.15 0.00 0.00 0.00 0.00 23.12 22.76 1ik6 s ALA 8 CO 0.03 0.43 1.05 0.54 0.00 0.00 0.00 175.76 177.80 1ik6 s ASN 9 N -1.90 4.11 0.27 0.00 2.20 -1.26 -1.14 114.94 117.22 1ik6 s ASN 9 Ca 0.09 -0.42 -0.03 0.00 -0.94 0.00 0.00 52.86 51.56 1ik6 s ASN 9 Cb -0.10 0.15 0.37 0.00 -2.00 0.00 0.00 41.25 39.66 1ik6 s ASN 9 CO 0.05 -2.04 1.91 -0.03 -2.94 0.00 0.00 177.10 174.06 1ik6 h MET 10 N -0.68 1.20 -0.53 3.55 1.85 -1.56 -1.76 114.93 117.00 1ik6 h MET 10 Ca -0.36 -0.07 -0.02 0.00 -0.61 0.00 0.00 59.70 58.64 1ik6 h MET 10 Cb 1.26 -0.27 -0.02 0.00 0.43 0.00 0.00 31.60 32.99 1ik6 h MET 10 CO 0.37 0.79 0.25 0.00 -0.40 0.00 0.00 176.91 177.93 1ik6 h ALA 11 N 1.43 0.68 -0.77 0.39 0.00 -1.62 -1.13 119.26 118.24 1ik6 h ALA 11 Ca 0.39 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 1ik6 h ALA 11 Cb 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1ik6 h ALA 11 CO -0.12 0.24 0.28 -0.22 0.00 0.00 0.00 179.25 179.43 1ik6 h LYS 12 N 0.70 1.17 -0.56 0.00 1.63 -1.73 -0.41 116.57 117.37 1ik6 h LYS 12 Ca 0.18 -0.23 -0.06 0.00 -0.85 0.00 0.00 60.65 59.69 1ik6 h LYS 12 Cb 0.12 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 1ik6 h LYS 12 CO -0.02 0.97 0.12 0.00 -3.45 0.00 0.00 179.45 177.06 1ik6 h ALA 13 N 1.16 1.15 -0.32 5.00 0.00 -0.84 0.22 119.26 125.63 1ik6 h ALA 13 Ca 0.25 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 1ik6 h ALA 13 Cb 0.26 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ik6 h ALA 13 CO -0.01 0.57 -0.43 0.82 0.00 0.00 0.00 179.25 180.20 1ik6 h ILE 14 N 0.84 1.28 -0.90 0.00 2.04 -0.95 -1.16 117.51 118.66 1ik6 h ILE 14 Ca 0.18 -1.61 0.03 0.00 1.00 0.00 0.00 64.86 64.46 1ik6 h ILE 14 Cb 0.33 1.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.90 1ik6 h ILE 14 CO 0.00 0.53 0.58 -1.13 0.00 0.00 0.00 178.15 178.13 1ik6 h ASN 15 N 0.65 0.98 -0.21 1.72 -0.73 -0.49 -1.00 115.58 116.49 1ik6 h ASN 15 Ca 0.04 -0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.18 1ik6 h ASN 15 Cb 1.03 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.38 1ik6 h ASN 15 CO 0.10 0.67 0.07 0.24 -0.37 0.00 0.00 177.43 178.15 1ik6 h MET 16 N 1.14 0.33 -0.63 6.67 2.86 -0.29 -1.37 114.93 123.64 1ik6 h MET 16 Ca 0.35 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.95 1ik6 h MET 16 Cb -0.01 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.56 1ik6 h MET 16 CO -0.11 0.42 0.39 0.00 1.06 0.00 0.00 176.91 178.66 1ik6 h ALA 17 N 0.90 0.81 -0.07 6.32 0.00 -0.60 0.13 119.26 126.75 1ik6 h ALA 17 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ik6 h ALA 17 Cb 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ik6 h ALA 17 CO -0.00 0.14 0.02 -0.07 0.00 0.00 0.00 179.25 179.34 1ik6 h LEU 18 N 0.77 0.11 -0.38 0.00 3.38 -1.12 0.21 115.31 118.27 1ik6 h LEU 18 Ca 0.25 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1ik6 h LEU 18 Cb 0.01 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1ik6 h LEU 18 CO -0.10 0.27 0.13 0.45 0.09 0.00 0.00 178.44 179.29 1ik6 h HIS 19 N -0.07 0.23 -0.24 1.13 3.86 -0.95 -1.27 115.15 117.84 1ik6 h HIS 19 Ca 0.02 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1ik6 h HIS 19 Cb 0.21 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1ik6 h HIS 19 CO -0.01 0.09 0.08 0.93 0.86 0.00 0.00 177.93 179.88 1ik6 h GLU 20 N 0.28 0.37 -0.16 2.45 5.08 -0.48 -0.87 114.58 121.25 1ik6 h GLU 20 Ca 0.17 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1ik6 h GLU 20 Cb 0.15 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1ik6 h GLU 20 CO -0.18 0.45 -0.22 0.93 -1.00 0.00 0.00 179.01 178.99 1ik6 h GLU 21 N 0.22 0.28 -0.15 2.33 4.39 -0.46 0.11 114.58 121.29 1ik6 h GLU 21 Ca 0.08 -0.09 -0.19 0.00 0.34 0.00 0.00 59.36 59.50 1ik6 h GLU 21 Cb 0.23 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1ik6 h GLU 21 CO -0.00 0.49 -0.66 0.52 -1.16 0.00 0.00 179.01 178.20 1ik6 h MET 22 N 0.26 0.72 -0.72 2.33 2.86 -1.08 -0.55 114.93 118.75 1ik6 h MET 22 Ca 0.04 -0.57 -0.06 0.00 -2.06 0.00 0.00 59.70 57.06 1ik6 h MET 22 Cb 0.54 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.28 1ik6 h MET 22 CO 0.04 1.18 0.23 1.49 1.06 0.00 0.00 176.91 180.91 1ik6 h GLU 23 N 0.42 1.10 -0.40 1.72 4.81 -0.99 -3.16 114.58 118.09 1ik6 h GLU 23 Ca -0.04 -0.23 -0.13 0.00 -0.13 0.00 0.00 59.36 58.84 1ik6 h GLU 23 Cb 1.29 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1ik6 h GLU 23 CO 0.14 0.94 -0.26 -0.09 -0.73 0.00 0.00 179.01 179.00 1ik6 h ARG 24 N 1.06 0.83 -3.20 1.92 2.43 -0.85 -3.43 114.38 113.14 1ik6 h ARG 24 Ca 0.23 -0.36 -0.45 0.00 -0.81 0.00 0.00 59.98 58.59 1ik6 h ARG 24 Cb 0.29 -0.02 -0.40 0.00 -0.42 0.00 0.00 29.97 29.41 1ik6 h ARG 24 CO -0.01 1.00 -0.75 0.34 -1.51 0.00 0.00 179.97 179.04 1ik6 s ASP 25 N -6.77 2.11 0.63 -3.80 -1.08 -0.23 -4.99 116.67 102.54 1ik6 s ASP 25 Ca -0.10 -0.46 0.30 0.00 -0.52 0.00 0.00 52.55 51.77 1ik6 s ASP 25 Cb 0.12 -0.27 1.59 0.00 -1.46 0.00 0.00 42.92 42.90 1ik6 s ASP 25 CO 0.85 -0.31 1.94 1.05 0.52 0.00 0.00 175.17 179.21 1ik6 h GLU 26 N 8.40 0.00 0.00 4.34 -0.00 -1.84 -0.18 114.58 125.30 1ik6 h GLU 26 Ca -0.15 0.00 -0.05 0.00 -0.00 0.00 0.00 59.36 59.16 1ik6 h GLU 26 Cb 1.14 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.88 1ik6 h GLU 26 CO 0.26 0.00 -0.24 0.00 -0.00 0.00 0.00 179.01 179.03 1ik6 h ARG 27 N 0.00 0.00 -6.36 1.06 3.08 -1.91 -3.44 114.38 106.80 1ik6 h ARG 27 Ca 0.08 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.59 1ik6 h ARG 27 Cb 0.81 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.85 1ik6 h ARG 27 CO -0.00 0.24 0.83 0.08 -1.07 0.00 0.00 179.97 180.05 1ik6 s VAL 28 N -3.61 3.77 0.14 2.04 1.01 -0.08 -0.90 120.40 122.77 1ik6 s VAL 28 Ca 0.01 1.14 0.07 0.00 0.00 0.00 0.00 61.98 63.20 1ik6 s VAL 28 Cb 0.10 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1ik6 s VAL 28 CO 0.65 -0.01 -0.16 0.68 0.00 0.00 0.00 175.10 176.26 1ik6 s VAL 29 N 2.42 1.52 -0.04 2.92 -7.23 -0.28 -4.82 120.40 114.89 1ik6 s VAL 29 Ca 0.63 -1.80 0.06 0.00 -1.81 0.00 0.00 61.98 59.06 1ik6 s VAL 29 Cb -0.31 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 34.95 1ik6 s VAL 29 CO 0.26 -0.38 -0.23 -0.69 -0.31 0.00 0.00 175.10 173.75 1ik6 s VAL 30 N -2.13 2.27 0.17 1.32 1.01 -0.11 -0.60 120.40 122.33 1ik6 s VAL 30 Ca 0.12 -1.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1ik6 s VAL 30 Cb -0.05 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1ik6 s VAL 30 CO 0.04 0.58 0.28 -1.48 0.00 0.00 0.00 175.10 174.53 1ik6 s LEU 31 N -0.46 0.95 0.00 3.92 2.34 -0.44 -0.66 118.68 124.32 1ik6 s LEU 31 Ca 0.05 -0.90 0.00 0.00 0.06 0.00 0.00 54.13 53.35 1ik6 s LEU 31 Cb -0.11 1.18 0.00 0.00 -0.56 0.00 0.00 46.19 46.69 1ik6 s LEU 31 CO 0.01 -0.90 0.00 0.61 -1.06 0.00 0.00 176.35 175.01 1ik6 n GLY 32 N -0.22 -0.55 0.15 -3.48 0.00 -0.86 -1.90 105.19 98.32 1ik6 n GLY 32 Ca -0.07 -1.70 -0.11 0.00 0.00 0.00 0.00 46.02 44.14 1ik6 n GLY 32 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ik6 h GLU 33 N 3.63 0.34 0.00 1.61 4.81 -1.83 0.10 114.58 123.24 1ik6 h GLU 33 Ca 0.00 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1ik6 h GLU 33 Cb 0.00 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1ik6 h GLU 33 CO 0.00 1.03 0.00 -0.11 -0.73 0.00 0.00 179.01 179.20 1ik6 n LEU 43 N -3.74 0.00 0.29 1.64 7.94 -1.26 -4.84 117.00 117.03 1ik6 n LEU 43 Ca -0.05 0.00 0.18 0.00 -1.11 0.00 0.00 56.01 55.03 1ik6 n LEU 43 Cb 0.80 0.00 0.80 0.00 0.53 0.00 0.00 43.42 45.55 1ik6 n LEU 43 CO 0.49 0.00 1.03 0.58 -1.11 0.00 0.00 177.39 178.39 1ik6 h VAL 44 N 0.55 0.01 -0.51 1.96 2.07 -2.00 -2.64 116.25 115.70 1ik6 h VAL 44 Ca 0.00 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1ik6 h VAL 44 Cb 0.00 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1ik6 h VAL 44 CO 0.00 0.00 0.00 0.35 0.02 0.00 0.00 177.57 177.94 1ik6 n THR 45 N -3.10 2.08 -1.72 2.57 -2.24 -1.26 -3.78 114.28 106.83 1ik6 n THR 45 Ca -0.00 -1.39 -0.43 0.00 -2.27 0.00 0.00 64.05 59.96 1ik6 n THR 45 Cb 0.26 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 1ik6 n THR 45 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1ik6 n GLU 46 N 0.57 2.38 0.00 -0.78 2.13 -1.00 -2.63 120.64 121.31 1ik6 n GLU 46 Ca 0.24 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.90 1ik6 n GLU 46 Cb 0.92 -2.54 0.00 0.00 0.27 0.00 0.00 31.44 30.09 1ik6 n GLU 46 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ik6 n GLY 47 N 1.67 2.31 0.12 8.31 0.00 -1.26 -4.87 105.19 111.46 1ik6 n GLY 47 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 1ik6 n GLY 47 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ik6 h LEU 48 N 0.00 0.26 0.37 0.99 3.38 -1.91 -2.24 115.31 116.16 1ik6 h LEU 48 Ca 0.00 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 1ik6 h LEU 48 Cb 0.00 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1ik6 h LEU 48 CO 0.00 0.32 -0.35 0.22 0.09 0.00 0.00 178.44 178.72 1ik6 h TYR 49 N 0.19 -0.94 0.00 1.13 5.03 -1.90 0.49 116.97 120.97 1ik6 h TYR 49 Ca 0.07 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.38 1ik6 h TYR 49 Cb 0.13 0.36 0.00 0.00 1.55 0.00 0.00 36.73 38.77 1ik6 h TYR 49 CO -0.02 -0.49 0.00 -0.85 -1.32 0.00 0.00 178.16 175.47 1ik6 n GLU 50 N -5.46 0.01 -0.07 1.82 0.00 -1.22 -0.53 120.64 115.19 1ik6 n GLU 50 Ca -0.10 0.35 -0.07 0.00 0.00 0.00 0.00 57.16 57.34 1ik6 n GLU 50 Cb 0.36 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.18 1ik6 n GLU 50 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1ik6 n ARG 51 N -1.49 1.55 -0.00 3.44 0.63 -0.47 -4.73 116.66 115.59 1ik6 n ARG 51 Ca 0.02 -0.01 0.03 0.00 -0.92 0.00 0.00 57.85 56.97 1ik6 n ARG 51 Cb 0.09 -1.38 -0.04 0.00 0.45 0.00 0.00 32.46 31.58 1ik6 n ARG 51 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1ik6 n PHE 52 N -2.56 0.00 0.00 -0.14 3.01 0.16 -5.08 117.46 112.85 1ik6 n PHE 52 Ca -0.24 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.22 1ik6 n PHE 52 Cb 0.98 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 40.36 1ik6 n PHE 52 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ik6 n GLY 53 N 1.86 -1.06 0.45 1.37 0.00 0.31 -4.37 105.19 103.75 1ik6 n GLY 53 Ca -0.00 -1.63 0.26 0.00 0.00 0.00 0.00 46.02 44.65 1ik6 n GLY 53 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ik6 h PRO 54 N 0.00 0.00 -0.01 1.61 0.11 -1.82 0.12 132.00 132.01 1ik6 h PRO 54 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ik6 h PRO 54 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ik6 h PRO 54 CO 0.00 0.00 -0.39 0.39 -0.21 0.00 0.00 178.00 177.79 1ik6 n GLU 55 N -3.93 0.88 -0.02 1.05 1.02 -1.26 -4.17 120.64 114.20 1ik6 n GLU 55 Ca 0.15 -0.62 -0.02 0.00 -0.02 0.00 0.00 57.16 56.65 1ik6 n GLU 55 Cb 0.91 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.80 1ik6 n GLU 55 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1ik6 n ARG 56 N -0.52 2.79 -4.01 3.49 5.12 -0.63 -4.84 116.66 118.05 1ik6 n ARG 56 Ca 0.10 -0.01 -0.31 0.00 -1.93 0.00 0.00 57.85 55.71 1ik6 n ARG 56 Cb 0.39 -1.14 -0.15 0.00 -1.16 0.00 0.00 32.46 30.40 1ik6 n ARG 56 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ik6 s VAL 57 N -2.16 2.31 -0.27 1.55 1.01 0.33 -0.93 120.40 122.24 1ik6 s VAL 57 Ca -0.03 -2.46 -0.06 0.00 0.00 0.00 0.00 61.98 59.44 1ik6 s VAL 57 Cb 0.02 -2.70 -0.00 0.00 0.00 0.00 0.00 36.38 33.69 1ik6 s VAL 57 CO 0.22 -0.62 0.04 -0.63 0.00 0.00 0.00 175.10 174.11 1ik6 s ILE 58 N 0.77 3.86 -0.30 2.22 1.01 0.16 -4.28 121.20 124.65 1ik6 s ILE 58 Ca 0.12 -0.54 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 1ik6 s ILE 58 Cb -0.20 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.38 1ik6 s ILE 58 CO -0.07 0.22 1.28 -0.62 0.00 0.00 0.00 174.94 175.74 1ik6 s ASP 59 N 1.51 6.71 -0.49 3.58 2.15 -1.26 -2.03 116.67 126.85 1ik6 s ASP 59 Ca 0.04 1.21 -0.12 0.00 0.43 0.00 0.00 52.55 54.11 1ik6 s ASP 59 Cb -0.16 -2.54 0.11 0.00 -0.30 0.00 0.00 42.92 40.03 1ik6 s ASP 59 CO 0.01 -1.05 0.39 0.42 -0.17 0.00 0.00 175.17 174.77 1ik6 s THR 60 N 4.26 4.63 -0.38 1.71 -4.23 0.02 -4.90 115.64 116.76 1ik6 s THR 60 Ca 0.55 -1.57 -0.07 0.00 -1.18 0.00 0.00 61.69 59.43 1ik6 s THR 60 Cb -0.16 -3.96 -0.22 0.00 1.34 0.00 0.00 72.50 69.49 1ik6 s THR 60 CO 0.22 -0.75 3.41 -0.81 -0.54 0.00 0.00 174.62 176.15 1ik6 n PRO 61 N 5.05 2.35 -4.64 3.99 -0.04 -1.26 -4.08 135.00 136.37 1ik6 n PRO 61 Ca -0.11 -1.26 -0.29 0.00 -0.04 0.00 0.00 63.50 61.81 1ik6 n PRO 61 Cb 0.41 -2.18 -0.10 0.00 -0.04 0.00 0.00 33.50 31.60 1ik6 n PRO 61 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ik6 s LEU 62 N 0.04 2.53 0.76 1.53 1.43 -1.26 -5.10 118.68 118.62 1ik6 s LEU 62 Ca 0.66 -1.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.18 1ik6 s LEU 62 Cb 0.28 -0.73 0.09 0.00 0.03 0.00 0.00 46.19 45.86 1ik6 s LEU 62 CO -0.01 -0.64 1.09 0.54 0.23 0.00 0.00 176.35 177.56 1ik6 s ASN 63 N -3.74 4.49 0.25 2.29 4.22 -1.26 -4.71 114.94 116.48 1ik6 s ASN 63 Ca 0.24 0.46 -0.03 0.00 -2.14 0.00 0.00 52.86 51.39 1ik6 s ASN 63 Cb 0.06 -0.97 0.51 0.00 1.28 0.00 0.00 41.25 42.14 1ik6 s ASN 63 CO 0.12 -1.84 1.72 -0.33 -2.04 0.00 0.00 177.10 174.73 1ik6 h GLU 64 N -0.84 0.40 -0.50 3.55 5.08 -1.99 0.61 114.58 120.89 1ik6 h GLU 64 Ca -0.44 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.85 1ik6 h GLU 64 Cb 1.31 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1ik6 h GLU 64 CO 0.57 0.26 0.15 0.78 -1.00 0.00 0.00 179.01 179.78 1ik6 h GLY 65 N 0.41 0.85 0.79 -3.84 0.00 -1.93 0.42 103.07 99.77 1ik6 h GLY 65 Ca 0.44 -0.51 0.03 0.00 0.00 0.00 0.00 47.33 47.30 1ik6 h GLY 65 CO -0.44 0.47 0.21 -1.33 0.00 0.00 0.00 176.54 175.45 1ik6 h GLY 66 N 0.69 0.57 0.93 4.60 0.00 -1.34 0.40 103.07 108.92 1ik6 h GLY 66 Ca 0.16 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.36 1ik6 h GLY 66 CO -0.00 0.10 0.20 -2.22 0.00 0.00 0.00 176.54 174.62 1ik6 h ILE 67 N 0.42 1.04 -0.36 2.60 2.04 -0.60 0.88 117.51 123.54 1ik6 h ILE 67 Ca 0.18 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.93 1ik6 h ILE 67 Cb 0.08 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 1ik6 h ILE 67 CO -0.12 0.07 0.16 -0.07 0.00 0.00 0.00 178.15 178.19 1ik6 h LEU 68 N 0.40 0.21 -0.59 1.44 3.38 -0.36 0.57 115.31 120.37 1ik6 h LEU 68 Ca 0.13 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ik6 h LEU 68 Cb -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1ik6 h LEU 68 CO -0.06 0.16 0.34 1.23 0.09 0.00 0.00 178.44 180.20 1ik6 h GLY 69 N 0.33 0.87 0.78 0.83 0.00 0.44 0.28 103.07 106.59 1ik6 h GLY 69 Ca 0.15 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 47.12 1ik6 h GLY 69 CO -0.13 0.37 -0.03 -2.75 0.00 0.00 0.00 176.54 174.00 1ik6 h PHE 70 N 0.80 -0.08 -0.70 5.60 3.57 0.18 0.33 116.94 126.64 1ik6 h PHE 70 Ca 0.21 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.75 1ik6 h PHE 70 Cb 0.02 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1ik6 h PHE 70 CO -0.01 -0.06 0.44 0.00 -2.23 0.00 0.00 178.31 176.45 1ik6 h ALA 71 N 1.09 0.91 -0.82 2.41 0.00 0.48 0.45 119.26 123.77 1ik6 h ALA 71 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ik6 h ALA 71 Cb 0.09 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1ik6 h ALA 71 CO -0.11 0.23 0.47 0.52 0.00 0.00 0.00 179.25 180.35 1ik6 h MET 72 N 0.88 1.14 -0.57 0.00 2.86 -0.22 -0.37 114.93 118.65 1ik6 h MET 72 Ca 0.28 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1ik6 h MET 72 Cb -0.00 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.41 1ik6 h MET 72 CO -0.10 0.82 0.03 0.78 1.06 0.00 0.00 176.91 179.51 1ik6 h GLY 73 N 1.17 1.06 1.14 8.32 0.00 0.57 -0.08 103.07 115.24 1ik6 h GLY 73 Ca 0.29 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 1ik6 h GLY 73 CO -0.05 0.69 0.22 -0.33 0.00 0.00 0.00 176.54 177.07 1ik6 h MET 74 N 0.87 1.08 -0.34 4.80 2.86 -0.29 -1.75 114.93 122.16 1ik6 h MET 74 Ca 0.16 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1ik6 h MET 74 Cb 0.50 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1ik6 h MET 74 CO 0.02 0.93 0.12 0.00 1.06 0.00 0.00 176.91 179.04 1ik6 h ALA 75 N 1.19 0.44 0.00 6.32 0.00 -0.63 -1.58 119.26 125.00 1ik6 h ALA 75 Ca 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ik6 h ALA 75 Cb 0.30 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ik6 h ALA 75 CO -0.01 0.06 -0.04 0.00 0.00 0.00 0.00 179.25 179.27 1ik6 h MET 76 N 0.40 0.00 -0.00 0.00 3.00 -0.82 0.14 114.93 117.64 1ik6 h MET 76 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.81 1ik6 h MET 76 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.82 1ik6 h MET 76 CO -0.01 0.04 0.00 0.00 0.00 0.00 0.00 176.91 176.94 1ik6 n ALA 77 N -2.36 2.67 -0.10 -3.00 0.00 -0.67 -4.88 120.51 112.16 1ik6 n ALA 77 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ik6 n ALA 77 Cb 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1ik6 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ik6 n GLY 78 N 1.00 0.95 3.87 0.00 0.00 0.48 -5.07 105.19 106.42 1ik6 n GLY 78 Ca 0.22 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 1ik6 n GLY 78 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ik6 s LEU 79 N 0.00 3.41 -0.55 0.99 1.43 -0.74 -4.93 118.68 118.28 1ik6 s LEU 79 Ca 0.00 -0.72 0.03 0.00 -1.03 0.00 0.00 54.13 52.41 1ik6 s LEU 79 Cb 0.00 -2.07 0.14 0.00 0.03 0.00 0.00 46.19 44.29 1ik6 s LEU 79 CO 0.00 -0.62 0.31 -0.54 0.23 0.00 0.00 176.35 175.72 1ik6 s LYS 80 N -4.12 2.11 0.35 1.70 1.02 -0.08 -4.01 119.74 116.70 1ik6 s LYS 80 Ca 0.47 -2.70 -0.23 0.00 0.02 0.00 0.00 55.97 53.53 1ik6 s LYS 80 Cb -0.03 -3.38 -0.10 0.00 -0.52 0.00 0.00 37.83 33.80 1ik6 s LYS 80 CO 0.28 -1.14 0.91 -1.25 -0.92 0.00 0.00 175.35 173.23 1ik6 s PRO 81 N -0.41 4.39 -0.24 -1.68 0.04 -1.26 -1.12 135.00 134.71 1ik6 s PRO 81 Ca 0.18 1.16 -0.00 0.00 0.04 0.00 0.00 61.00 62.38 1ik6 s PRO 81 Cb -0.23 -2.58 0.07 0.00 0.04 0.00 0.00 34.50 31.80 1ik6 s PRO 81 CO -0.02 0.18 -0.00 0.08 0.04 0.00 0.00 177.00 177.28 1ik6 s VAL 82 N -1.82 1.24 -0.05 -0.36 1.01 0.23 -1.52 120.40 119.14 1ik6 s VAL 82 Ca 0.53 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1ik6 s VAL 82 Cb -0.15 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 1ik6 s VAL 82 CO 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 175.10 175.02 1ik6 s ALA 83 N 1.50 3.20 -0.23 5.51 0.00 0.17 -1.33 121.76 130.59 1ik6 s ALA 83 Ca -0.01 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.94 1ik6 s ALA 83 Cb -0.18 -1.36 -0.05 0.00 0.00 0.00 0.00 23.12 21.54 1ik6 s ALA 83 CO -0.10 0.61 0.24 -2.00 0.00 0.00 0.00 175.76 174.51 1ik6 s GLU 84 N -1.13 4.09 -0.10 0.00 2.12 -0.80 0.22 118.70 123.10 1ik6 s GLU 84 Ca 0.15 -0.12 -0.04 0.00 0.36 0.00 0.00 54.97 55.32 1ik6 s GLU 84 Cb -0.11 -3.55 0.05 0.00 0.26 0.00 0.00 34.13 30.78 1ik6 s GLU 84 CO 0.05 -0.00 0.20 0.42 -0.54 0.00 0.00 175.26 175.38 1ik6 s ILE 85 N 1.24 -0.29 -0.14 -3.70 1.01 -0.07 -4.65 121.20 114.59 1ik6 s ILE 85 Ca 0.11 0.31 0.17 0.00 0.00 0.00 0.00 60.65 61.24 1ik6 s ILE 85 Cb -0.14 -0.34 0.11 0.00 0.01 0.00 0.00 42.46 42.09 1ik6 s ILE 85 CO 0.06 0.13 1.51 1.56 0.00 0.00 0.00 174.94 178.21 1ik6 h GLN 86 N 8.23 0.00 -4.06 2.79 4.20 -1.92 -3.37 115.11 120.98 1ik6 h GLN 86 Ca -0.16 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.34 1ik6 h GLN 86 Cb 1.12 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.99 1ik6 h GLN 86 CO 0.16 0.42 -0.44 1.19 -0.67 0.00 0.00 178.83 179.50 1ik6 n PHE 87 N -3.24 -1.46 -0.85 2.96 3.01 -1.26 -4.87 117.46 111.74 1ik6 n PHE 87 Ca 0.02 0.58 -0.21 0.00 1.01 0.00 0.00 57.45 58.84 1ik6 n PHE 87 Cb 0.67 -3.67 0.09 0.00 -0.01 0.00 0.00 39.48 36.56 1ik6 n PHE 87 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1ik6 n VAL 88 N -3.30 2.88 0.00 -4.37 0.24 -1.26 -4.92 118.33 107.61 1ik6 n VAL 88 Ca -0.10 -1.82 0.00 0.00 -2.04 0.00 0.00 64.34 60.38 1ik6 n VAL 88 Cb 0.58 -0.99 0.00 0.00 -1.47 0.00 0.00 33.84 31.96 1ik6 n VAL 88 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 1ik6 n LEU 93 N -0.38 0.00 0.00 1.34 -0.00 -1.26 -5.17 117.00 111.53 1ik6 n LEU 93 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.44 1ik6 n LEU 93 Cb 0.92 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.34 1ik6 n LEU 93 CO 0.50 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.50 1ik6 n GLY 94 N 0.00 0.13 0.37 -3.96 0.00 -1.26 -4.28 105.19 96.19 1ik6 n GLY 94 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1ik6 n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ik6 h ALA 95 N 0.00 1.37 -0.13 4.61 0.00 -1.98 -1.09 119.26 122.04 1ik6 h ALA 95 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1ik6 h ALA 95 Cb 0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.39 1ik6 h ALA 95 CO 0.00 0.51 -0.31 -0.44 0.00 0.00 0.00 179.25 179.01 1ik6 h ASP 96 N 1.23 -0.97 -0.30 0.00 3.32 -1.99 0.35 116.42 118.06 1ik6 h ASP 96 Ca 0.41 0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.60 1ik6 h ASP 96 Cb 0.07 0.41 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1ik6 h ASP 96 CO -0.14 -0.35 0.14 -0.33 -1.72 0.00 0.00 179.24 176.84 1ik6 h GLU 97 N -0.38 0.43 -0.08 3.56 5.08 -1.80 -2.59 114.58 118.81 1ik6 h GLU 97 Ca 0.10 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1ik6 h GLU 97 Cb 0.54 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1ik6 h GLU 97 CO -0.35 0.41 0.05 1.25 -1.00 0.00 0.00 179.01 179.37 1ik6 h LEU 98 N 0.35 0.09 -0.96 1.33 6.46 -0.71 -2.25 115.31 119.62 1ik6 h LEU 98 Ca 0.10 -0.06 0.05 0.00 -0.12 0.00 0.00 57.88 57.86 1ik6 h LEU 98 Cb 0.12 -0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 39.96 1ik6 h LEU 98 CO -0.01 0.12 0.62 -0.07 -0.62 0.00 0.00 178.44 178.48 1ik6 h LEU 99 N 0.06 1.02 -0.34 2.25 4.07 -0.32 -0.87 115.31 121.18 1ik6 h LEU 99 Ca 0.03 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.96 1ik6 h LEU 99 Cb 0.05 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.55 1ik6 h LEU 99 CO -0.00 0.68 0.11 -1.13 -1.08 0.00 0.00 178.44 177.01 1ik6 h ASN 100 N 1.17 0.49 -0.50 -0.43 -0.73 -1.30 0.15 115.58 114.44 1ik6 h ASN 100 Ca 0.40 -0.20 0.01 0.00 1.87 0.00 0.00 56.30 58.38 1ik6 h ASN 100 Cb 0.08 -0.13 -0.03 0.00 0.27 0.00 0.00 38.32 38.51 1ik6 h ASN 100 CO -0.15 0.56 0.32 0.45 -0.37 0.00 0.00 177.43 178.25 1ik6 h HIS 101 N 0.40 0.61 -0.49 0.67 -0.00 -0.82 0.31 115.15 115.82 1ik6 h HIS 101 Ca 0.11 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.49 1ik6 h HIS 101 Cb 0.24 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.43 1ik6 h HIS 101 CO 0.01 0.37 0.27 -0.84 -0.00 0.00 0.00 177.93 177.73 1ik6 h ILE 102 N 0.65 1.17 -0.19 2.45 -2.65 -0.93 -0.01 117.51 117.99 1ik6 h ILE 102 Ca 0.19 -0.44 0.00 0.00 1.03 0.00 0.00 64.86 65.65 1ik6 h ILE 102 Cb -0.04 0.56 -0.01 0.00 -2.05 0.00 0.00 36.82 35.28 1ik6 h ILE 102 CO -0.06 0.18 0.12 0.00 0.03 0.00 0.00 178.15 178.42 1ik6 h ALA 103 N 1.11 0.25 -0.18 0.16 0.00 -0.53 0.21 119.26 120.28 1ik6 h ALA 103 Ca 0.17 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1ik6 h ALA 103 Cb 0.05 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1ik6 h ALA 103 CO -0.03 -0.26 -0.10 0.87 0.00 0.00 0.00 179.25 179.73 1ik6 h LYS 104 N 0.24 -0.09 -0.19 0.00 1.57 -0.57 0.82 116.57 118.36 1ik6 h LYS 104 Ca 0.07 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1ik6 h LYS 104 Cb 0.00 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1ik6 h LYS 104 CO -0.01 -0.06 0.02 1.25 -0.57 0.00 0.00 179.45 180.07 1ik6 h LEU 105 N -0.09 -0.03 0.49 2.94 6.46 -0.70 -2.87 115.31 121.51 1ik6 h LEU 105 Ca 0.10 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1ik6 h LEU 105 Cb 0.24 0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.21 1ik6 h LEU 105 CO -0.24 0.01 -0.49 -0.09 -0.62 0.00 0.00 178.44 177.01 1ik6 h ARG 106 N 0.08 -0.95 -0.92 1.25 1.12 0.21 -3.50 114.38 111.68 1ik6 h ARG 106 Ca 0.09 0.06 0.20 0.00 -1.11 0.00 0.00 59.98 59.22 1ik6 h ARG 106 Cb 0.10 0.21 -0.07 0.00 -0.01 0.00 0.00 29.97 30.20 1ik6 h ARG 106 CO -0.13 -0.63 0.60 1.88 -3.11 0.00 0.00 179.97 178.58 1ik6 h TYR 107 N -0.98 0.62 -3.29 2.20 0.05 0.88 -3.49 116.97 112.96 1ik6 h TYR 107 Ca -0.06 0.02 -0.61 0.00 0.05 0.00 0.00 58.73 58.13 1ik6 h TYR 107 Cb 0.86 -0.19 -0.15 0.00 1.01 0.00 0.00 36.73 38.26 1ik6 h TYR 107 CO -0.25 0.16 -0.54 0.15 -1.05 0.00 0.00 178.16 176.63 1ik6 s LYS 114 N -5.49 4.05 -0.46 4.88 1.02 -1.26 -4.96 119.74 117.51 1ik6 s LYS 114 Ca -0.09 -0.30 0.06 0.00 0.02 0.00 0.00 55.97 55.67 1ik6 s LYS 114 Cb 0.23 -3.29 0.30 0.00 -0.52 0.00 0.00 37.83 34.54 1ik6 s LYS 114 CO 0.79 0.28 1.02 0.00 -0.92 0.00 0.00 175.35 176.51 1ik6 n ALA 115 N 3.54 -0.78 -1.75 5.17 0.00 -1.26 -4.93 120.51 120.50 1ik6 n ALA 115 Ca -0.16 -1.58 -0.41 0.00 0.00 0.00 0.00 53.44 51.29 1ik6 n ALA 115 Cb 0.52 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 1ik6 n ALA 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ik6 n PRO 116 N 0.77 2.33 -4.29 0.00 -0.05 -1.22 -2.60 135.00 129.94 1ik6 n PRO 116 Ca 0.08 -2.47 -0.18 0.00 -0.05 0.00 0.00 63.50 60.88 1ik6 n PRO 116 Cb 0.67 -3.27 -0.11 0.00 -0.05 0.00 0.00 33.50 30.75 1ik6 n PRO 116 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 175.50 174.97 1ik6 s LEU 117 N 3.40 2.49 -0.09 1.53 2.34 -1.26 -4.17 118.68 122.92 1ik6 s LEU 117 Ca 0.54 -0.93 0.02 0.00 0.06 0.00 0.00 54.13 53.83 1ik6 s LEU 117 Cb 0.10 -0.58 0.01 0.00 -0.56 0.00 0.00 46.19 45.16 1ik6 s LEU 117 CO 0.04 -0.18 -0.15 -0.69 -1.06 0.00 0.00 176.35 174.30 1ik6 s VAL 118 N -2.66 1.43 -0.22 1.48 1.01 -0.57 -1.15 120.40 119.72 1ik6 s VAL 118 Ca 0.16 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 1ik6 s VAL 118 Cb -0.02 -1.29 0.01 0.00 0.00 0.00 0.00 36.38 35.08 1ik6 s VAL 118 CO 0.04 0.42 -0.07 -0.69 0.00 0.00 0.00 175.10 174.80 1ik6 s VAL 119 N 0.76 2.99 -0.10 2.92 1.01 -0.13 0.46 120.40 128.31 1ik6 s VAL 119 Ca -0.12 -0.75 -0.17 0.00 0.00 0.00 0.00 61.98 60.94 1ik6 s VAL 119 Cb -0.16 -2.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 1ik6 s VAL 119 CO 0.02 0.36 0.45 -0.13 0.00 0.00 0.00 175.10 175.80 1ik6 s ARG 120 N 1.40 4.26 -0.12 2.72 0.52 0.13 -0.14 118.95 127.72 1ik6 s ARG 120 Ca 0.04 0.41 -0.04 0.00 -0.52 0.00 0.00 55.73 55.62 1ik6 s ARG 120 Cb -0.15 -3.39 0.05 0.00 0.52 0.00 0.00 34.95 31.98 1ik6 s ARG 120 CO -0.05 0.27 0.11 0.95 0.02 0.00 0.00 175.30 176.59 1ik6 s THR 121 N 0.28 -0.15 0.32 0.02 -4.23 -0.34 -0.89 115.64 110.64 1ik6 s THR 121 Ca 0.25 0.11 -0.29 0.00 -1.18 0.00 0.00 61.69 60.58 1ik6 s THR 121 Cb -0.15 -0.41 -0.11 0.00 1.34 0.00 0.00 72.50 73.17 1ik6 s THR 121 CO 0.10 -0.06 1.45 -2.84 -0.54 0.00 0.00 174.62 172.74 1ik6 s PRO 122 N 2.20 4.21 -0.01 3.99 0.02 -1.26 -1.64 135.00 142.50 1ik6 s PRO 122 Ca 0.04 2.43 0.04 0.00 0.02 0.00 0.00 61.00 63.52 1ik6 s PRO 122 Cb -0.14 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.33 1ik6 s PRO 122 CO -0.07 -0.45 -0.13 0.14 -0.33 0.00 0.00 177.00 176.17 1ik6 s VAL 123 N -0.64 1.02 -0.24 3.83 -7.23 0.59 -4.81 120.40 112.92 1ik6 s VAL 123 Ca 0.55 -0.55 -0.02 0.00 -1.81 0.00 0.00 61.98 60.15 1ik6 s VAL 123 Cb -0.44 -0.85 -0.18 0.00 0.56 0.00 0.00 36.38 35.47 1ik6 s VAL 123 CO 0.53 0.29 -0.13 0.61 -0.31 0.00 0.00 175.10 176.09 1ik6 n GLY 124 N 2.78 -0.42 3.25 2.32 0.00 -1.26 -0.53 105.19 111.33 1ik6 n GLY 124 Ca -0.14 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 1ik6 n GLY 124 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ik6 s SER 136 N -6.74 -0.34 0.50 1.61 0.15 -1.26 -4.98 113.70 102.65 1ik6 s SER 136 Ca -0.33 0.91 0.21 0.00 0.70 0.00 0.00 55.95 57.44 1ik6 s SER 136 Cb 0.09 1.01 1.32 0.00 -1.71 0.00 0.00 66.02 66.73 1ik6 s SER 136 CO 0.62 -0.21 2.09 -0.65 1.20 0.00 0.00 173.24 176.28 1ik6 h PRO 137 N 7.67 0.00 0.81 5.44 0.11 -1.91 -2.69 132.00 141.43 1ik6 h PRO 137 Ca -0.26 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 1ik6 h PRO 137 Cb 1.15 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.26 1ik6 h PRO 137 CO 0.21 0.11 -0.39 1.49 -0.21 0.00 0.00 178.00 179.21 1ik6 h GLU 138 N 0.00 -1.05 -0.75 1.05 4.81 -1.99 -2.65 114.58 114.00 1ik6 h GLU 138 Ca -0.00 0.07 0.17 0.00 -0.13 0.00 0.00 59.36 59.47 1ik6 h GLU 138 Cb 0.22 0.24 -0.13 0.00 0.63 0.00 0.00 28.75 29.71 1ik6 h GLU 138 CO 0.01 -0.69 0.05 0.00 -0.73 0.00 0.00 179.01 177.65 1ik6 h ALA 139 N -1.07 0.82 0.00 2.92 0.00 -1.93 0.20 119.26 120.21 1ik6 h ALA 139 Ca -0.11 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ik6 h ALA 139 Cb 0.85 0.37 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ik6 h ALA 139 CO 0.18 -0.41 -0.07 -0.84 0.00 0.00 0.00 179.25 178.11 1ik6 h ILE 140 N 0.13 0.22 0.00 0.00 3.07 -1.39 -3.34 117.51 116.21 1ik6 h ILE 140 Ca 0.41 -0.55 -0.08 0.00 1.55 0.00 0.00 64.86 66.20 1ik6 h ILE 140 Cb 0.73 1.45 -0.01 0.00 -0.27 0.00 0.00 36.82 38.71 1ik6 h ILE 140 CO -0.63 0.06 -1.38 0.49 -1.05 0.00 0.00 178.15 175.65 1ik6 n PHE 141 N -3.26 0.00 0.02 0.16 0.99 -0.24 -4.73 117.46 110.41 1ik6 n PHE 141 Ca -0.01 0.00 0.21 0.00 -0.00 0.00 0.00 57.45 57.65 1ik6 n PHE 141 Cb 0.28 -0.25 0.72 0.00 -1.00 0.00 0.00 39.48 39.22 1ik6 n PHE 141 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.76 176.52 1ik6 h VAL 142 N 0.00 0.63 -0.53 -4.37 3.04 -0.81 -1.37 116.25 112.84 1ik6 h VAL 142 Ca -0.11 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 1ik6 h VAL 142 Cb 1.04 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.03 1ik6 h VAL 142 CO 0.01 0.00 0.00 1.41 -1.01 0.00 0.00 177.57 177.98 1ik6 n HIS 143 N -4.19 0.70 -2.59 3.17 8.25 -1.26 -4.63 115.22 114.67 1ik6 n HIS 143 Ca 0.09 -0.40 -0.42 0.00 -0.26 0.00 0.00 57.72 56.73 1ik6 n HIS 143 Cb 0.61 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 1ik6 n HIS 143 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1ik6 s THR 144 N -1.15 4.56 0.30 1.59 2.01 -0.52 -5.01 115.64 117.42 1ik6 s THR 144 Ca 0.40 1.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.96 1ik6 s THR 144 Cb 0.22 -4.19 -0.10 0.00 0.01 0.00 0.00 72.50 68.43 1ik6 s THR 144 CO 0.29 -0.02 1.34 -2.84 -0.69 0.00 0.00 174.62 172.70 1ik6 s PRO 145 N 2.24 4.33 0.00 4.92 0.02 -1.26 -2.83 135.00 142.43 1ik6 s PRO 145 Ca 0.51 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1ik6 s PRO 145 Cb -0.20 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.22 1ik6 s PRO 145 CO 0.18 -0.25 0.00 0.41 -0.33 0.00 0.00 177.00 177.01 1ik6 n GLY 146 N 1.28 1.27 3.55 0.52 0.00 -1.26 -3.78 105.19 106.77 1ik6 n GLY 146 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1ik6 n GLY 146 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ik6 s LEU 147 N 0.00 3.32 -0.11 0.99 0.20 -1.13 -4.69 118.68 117.27 1ik6 s LEU 147 Ca 0.00 -0.06 -0.15 0.00 0.69 0.00 0.00 54.13 54.61 1ik6 s LEU 147 Cb 0.00 -1.79 -0.05 0.00 -0.43 0.00 0.00 46.19 43.93 1ik6 s LEU 147 CO 0.00 0.23 0.37 -0.69 -0.29 0.00 0.00 176.35 175.96 1ik6 s VAL 148 N 0.01 5.22 -0.12 1.68 1.01 -0.39 -4.58 120.40 123.23 1ik6 s VAL 148 Ca 0.01 0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1ik6 s VAL 148 Cb -0.13 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1ik6 s VAL 148 CO 0.02 0.42 -0.12 -0.69 0.00 0.00 0.00 175.10 174.73 1ik6 s VAL 149 N 0.13 1.35 0.13 2.92 1.01 0.40 -0.50 120.40 125.84 1ik6 s VAL 149 Ca 0.21 -0.51 0.06 0.00 0.00 0.00 0.00 61.98 61.74 1ik6 s VAL 149 Cb -0.14 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1ik6 s VAL 149 CO 0.08 0.42 -0.15 0.68 0.00 0.00 0.00 175.10 176.13 1ik6 s VAL 150 N 1.41 1.44 -0.17 2.92 -7.23 -0.62 0.35 120.40 118.50 1ik6 s VAL 150 Ca 0.01 -1.75 -0.04 0.00 -1.81 0.00 0.00 61.98 58.39 1ik6 s VAL 150 Cb -0.13 -1.59 0.08 0.00 0.56 0.00 0.00 36.38 35.29 1ik6 s VAL 150 CO -0.07 -0.38 0.19 -0.32 -0.31 0.00 0.00 175.10 174.20 1ik6 s MET 151 N -2.67 0.13 0.82 4.82 1.75 -0.10 -1.41 119.30 122.65 1ik6 s MET 151 Ca 0.10 0.25 -0.11 0.00 -1.25 0.00 0.00 55.69 54.68 1ik6 s MET 151 Cb -0.05 -1.07 0.08 0.00 2.84 0.00 0.00 34.83 36.62 1ik6 s MET 151 CO 0.04 -0.57 1.10 -1.25 -0.65 0.00 0.00 175.02 173.68 1ik6 s PRO 152 N 2.29 1.92 0.00 4.11 0.04 -1.25 -4.24 135.00 137.87 1ik6 s PRO 152 Ca 0.05 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.79 1ik6 s PRO 152 Cb -0.15 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1ik6 s PRO 152 CO -0.10 -1.75 0.00 -1.13 0.04 0.00 0.00 177.00 174.06 1ik6 n SER 153 N -3.53 1.22 -4.21 6.66 3.41 -1.26 -4.02 113.62 111.89 1ik6 n SER 153 Ca 0.07 -0.11 -0.12 0.00 -0.26 0.00 0.00 58.87 58.45 1ik6 n SER 153 Cb 0.56 0.46 -0.10 0.00 -0.26 0.00 0.00 64.21 64.87 1ik6 n SER 153 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ik6 s THR 154 N -0.71 0.53 0.29 6.66 -4.23 -1.26 -4.85 115.64 112.08 1ik6 s THR 154 Ca 0.00 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1ik6 s THR 154 Cb 0.00 -2.05 0.14 0.00 1.34 0.00 0.00 72.50 71.93 1ik6 s THR 154 CO 0.00 -0.52 1.81 -0.65 -0.54 0.00 0.00 174.62 174.72 1ik6 h PRO 155 N 2.77 0.73 0.22 3.99 0.11 -1.87 0.40 132.00 138.35 1ik6 h PRO 155 Ca -0.36 -0.17 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1ik6 h PRO 155 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1ik6 h PRO 155 CO 0.62 0.71 -0.11 -0.92 -0.21 0.00 0.00 178.00 178.10 1ik6 h TYR 156 N 0.70 -0.28 0.00 0.65 3.20 -1.91 -2.03 116.97 117.29 1ik6 h TYR 156 Ca 0.15 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1ik6 h TYR 156 Cb 0.36 0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1ik6 h TYR 156 CO 0.02 -0.15 -0.00 0.27 -1.64 0.00 0.00 178.16 176.65 1ik6 n ASN 157 N -5.21 0.79 0.03 -2.11 0.23 -1.14 -1.78 115.26 106.07 1ik6 n ASN 157 Ca -0.09 0.57 -0.13 0.00 -0.53 0.00 0.00 54.58 54.40 1ik6 n ASN 157 Cb 0.15 -0.78 -0.08 0.00 -2.08 0.00 0.00 39.78 36.99 1ik6 n ASN 157 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ik6 h ALA 158 N 2.54 -0.03 0.15 -2.53 0.00 -0.66 0.18 119.26 118.91 1ik6 h ALA 158 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ik6 h ALA 158 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1ik6 h ALA 158 CO 0.00 -0.42 -0.07 -0.22 0.00 0.00 0.00 179.25 178.54 1ik6 h LYS 159 N -0.23 -0.20 -0.44 0.00 3.64 -1.32 -2.45 116.57 115.57 1ik6 h LYS 159 Ca -0.00 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 1ik6 h LYS 159 Cb 0.22 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 1ik6 h LYS 159 CO 0.01 0.01 0.18 0.78 -2.27 0.00 0.00 179.45 178.16 1ik6 h GLY 160 N -0.39 0.59 1.16 5.01 0.00 -1.29 -1.80 103.07 106.34 1ik6 h GLY 160 Ca -0.02 -0.11 -0.12 0.00 0.00 0.00 0.00 47.33 47.07 1ik6 h GLY 160 CO 0.03 0.05 -0.18 1.41 0.00 0.00 0.00 176.54 177.86 1ik6 h LEU 161 N 0.37 0.98 -0.57 3.11 3.38 -0.67 -1.28 115.31 120.62 1ik6 h LEU 161 Ca 0.20 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1ik6 h LEU 161 Cb 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1ik6 h LEU 161 CO -0.18 1.13 0.11 0.25 0.09 0.00 0.00 178.44 179.85 1ik6 h LEU 162 N 0.85 0.89 -0.50 1.67 5.85 -1.27 0.24 115.31 123.03 1ik6 h LEU 162 Ca 0.12 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1ik6 h LEU 162 Cb 0.74 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 1ik6 h LEU 162 CO 0.06 0.91 0.26 0.11 -0.34 0.00 0.00 178.44 179.44 1ik6 h LYS 163 N 0.84 0.71 -0.67 1.25 1.57 -1.25 -0.11 116.57 118.91 1ik6 h LYS 163 Ca 0.18 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1ik6 h LYS 163 Cb 0.39 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1ik6 h LYS 163 CO 0.01 0.57 0.36 0.00 -0.57 0.00 0.00 179.45 179.83 1ik6 h ALA 164 N 1.10 0.86 -0.31 3.86 0.00 -0.82 -1.48 119.26 122.47 1ik6 h ALA 164 Ca 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ik6 h ALA 164 Cb 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ik6 h ALA 164 CO -0.03 0.39 0.16 0.00 0.00 0.00 0.00 179.25 179.77 1ik6 h ALA 165 N 1.18 0.40 -0.60 0.00 0.00 -0.21 -1.30 119.26 118.73 1ik6 h ALA 165 Ca 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1ik6 h ALA 165 Cb 0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1ik6 h ALA 165 CO -0.04 -0.05 0.32 0.82 0.00 0.00 0.00 179.25 180.30 1ik6 h ILE 166 N 0.38 1.20 0.00 0.00 2.04 -0.84 -2.88 117.51 117.40 1ik6 h ILE 166 Ca 0.11 -0.52 -0.10 0.00 1.00 0.00 0.00 64.86 65.35 1ik6 h ILE 166 Cb 0.09 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1ik6 h ILE 166 CO -0.02 0.22 -0.46 0.03 0.00 0.00 0.00 178.15 177.93 1ik6 h ARG 167 N 0.82 0.00 -7.35 2.37 3.08 -1.08 -3.45 114.38 108.76 1ik6 h ARG 167 Ca 0.21 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.79 1ik6 h ARG 167 Cb 0.06 0.00 0.15 0.00 0.08 0.00 0.00 29.97 30.26 1ik6 h ARG 167 CO -0.03 0.46 0.23 0.20 -1.07 0.00 0.00 179.97 179.76 1ik6 s GLY 168 N -4.39 1.60 0.00 0.04 0.00 -0.51 -4.97 107.32 99.10 1ik6 s GLY 168 Ca -0.01 -0.19 0.21 0.00 0.00 0.00 0.00 44.72 44.73 1ik6 s GLY 168 CO 0.72 0.35 1.15 2.09 0.00 0.00 0.00 173.10 177.40 1ik6 n ASP 169 N -3.98 2.69 -4.84 1.64 5.75 -1.26 -4.87 116.55 111.68 1ik6 n ASP 169 Ca 0.06 -1.84 -0.35 0.00 -0.01 0.00 0.00 54.79 52.65 1ik6 n ASP 169 Cb 0.56 0.02 -0.06 0.00 -1.03 0.00 0.00 41.12 40.61 1ik6 n ASP 169 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1ik6 s ASP 170 N -1.75 6.85 0.23 -1.12 1.01 -1.26 -3.41 116.67 117.22 1ik6 s ASP 170 Ca 0.24 1.14 -0.30 0.00 0.71 0.00 0.00 52.55 54.34 1ik6 s ASP 170 Cb 0.17 -2.31 -0.09 0.00 1.01 0.00 0.00 42.92 41.70 1ik6 s ASP 170 CO 0.27 0.05 1.33 -2.16 0.21 0.00 0.00 175.17 174.87 1ik6 s PRO 171 N -2.13 4.37 -0.02 8.23 0.04 -1.07 -4.29 135.00 140.12 1ik6 s PRO 171 Ca 0.41 2.12 0.02 0.00 0.04 0.00 0.00 61.00 63.60 1ik6 s PRO 171 Cb -0.15 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1ik6 s PRO 171 CO 0.20 -0.26 -0.08 0.08 0.04 0.00 0.00 177.00 176.97 1ik6 s VAL 172 N -0.14 0.71 -0.22 -0.36 1.01 -0.30 -1.26 120.40 119.83 1ik6 s VAL 172 Ca 0.56 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 62.14 1ik6 s VAL 172 Cb -0.38 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 1ik6 s VAL 172 CO 0.42 0.23 0.09 -0.69 0.00 0.00 0.00 175.10 175.14 1ik6 s VAL 173 N 0.21 4.70 -0.48 2.92 1.01 0.35 -0.96 120.40 128.16 1ik6 s VAL 173 Ca -0.03 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 61.84 1ik6 s VAL 173 Cb -0.08 -3.17 0.12 0.00 0.00 0.00 0.00 36.38 33.26 1ik6 s VAL 173 CO 0.00 0.38 0.32 0.12 0.00 0.00 0.00 175.10 175.92 1ik6 s PHE 174 N 1.06 3.50 -0.23 5.22 5.36 0.80 -1.59 117.98 132.11 1ik6 s PHE 174 Ca 0.05 -2.21 -0.28 0.00 -0.96 0.00 0.00 56.93 53.52 1ik6 s PHE 174 Cb -0.14 -3.36 0.01 0.00 -0.34 0.00 0.00 43.02 39.19 1ik6 s PHE 174 CO 0.03 -0.97 1.00 -0.51 -1.46 0.00 0.00 175.22 173.31 1ik6 s LEU 175 N 1.04 4.10 -0.34 6.12 1.43 -0.50 -1.20 118.68 129.33 1ik6 s LEU 175 Ca 0.09 1.32 -0.06 0.00 -1.03 0.00 0.00 54.13 54.44 1ik6 s LEU 175 Cb -0.23 -3.47 0.04 0.00 0.03 0.00 0.00 46.19 42.56 1ik6 s LEU 175 CO -0.03 -0.63 0.10 -1.61 0.23 0.00 0.00 176.35 174.41 1ik6 s GLU 176 N 3.09 2.60 -0.45 1.70 2.02 -0.65 -3.82 118.70 123.18 1ik6 s GLU 176 Ca 0.42 -1.20 -0.27 0.00 0.02 0.00 0.00 54.97 53.95 1ik6 s GLU 176 Cb -0.15 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.59 1ik6 s GLU 176 CO 0.07 -0.67 2.08 -2.14 0.02 0.00 0.00 175.26 174.61 1ik6 s PRO 177 N 1.39 2.68 0.41 0.39 0.02 -1.26 -0.30 135.00 138.34 1ik6 s PRO 177 Ca -0.02 1.25 0.20 0.00 0.02 0.00 0.00 61.00 62.45 1ik6 s PRO 177 Cb -0.20 -4.41 1.14 0.00 0.02 0.00 0.00 34.50 31.05 1ik6 s PRO 177 CO 0.02 -2.63 1.78 0.87 -0.33 0.00 0.00 177.00 176.72 1ik6 h LYS 178 N 16.02 0.35 0.00 5.54 6.56 -1.18 0.11 116.57 143.98 1ik6 h LYS 178 Ca -0.29 -0.02 -0.00 0.00 -1.06 0.00 0.00 60.65 59.28 1ik6 h LYS 178 Cb 1.21 -0.08 -0.00 0.00 -0.57 0.00 0.00 32.23 32.79 1ik6 h LYS 178 CO 1.12 0.23 -0.00 0.97 -2.06 0.00 0.00 179.45 179.71 1ik6 h ILE 179 N 0.36 0.01 -0.02 1.86 2.10 -1.88 -2.31 117.51 117.64 1ik6 h ILE 179 Ca 0.58 -0.15 0.00 0.00 1.08 0.00 0.00 64.86 66.37 1ik6 h ILE 179 Cb 1.52 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 38.40 1ik6 h ILE 179 CO -0.26 0.00 -0.19 0.18 -1.08 0.00 0.00 178.15 176.80 1ik6 n LEU 180 N -3.09 2.12 -0.21 2.19 4.77 0.39 -4.56 117.00 118.60 1ik6 n LEU 180 Ca -0.02 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 1ik6 n LEU 180 Cb 0.14 -0.02 0.11 0.00 -2.33 0.00 0.00 43.42 41.32 1ik6 n LEU 180 CO 0.22 0.37 1.01 1.88 -1.33 0.00 0.00 177.39 179.54 1ik6 h TYR 181 N 3.02 0.46 0.03 -1.77 0.99 -1.46 -3.22 116.97 115.03 1ik6 h TYR 181 Ca 0.00 0.03 -0.30 0.00 2.00 0.00 0.00 58.73 60.46 1ik6 h TYR 181 Cb 0.76 -0.11 -0.04 0.00 1.00 0.00 0.00 36.73 38.33 1ik6 h TYR 181 CO 0.00 0.14 -1.66 0.00 -0.00 0.00 0.00 178.16 176.63 1ik6 h ARG 182 N 0.46 0.06 -3.39 4.88 -0.00 -1.81 -2.15 114.38 112.44 1ik6 h ARG 182 Ca 0.31 -0.10 -0.05 0.00 -0.50 0.00 0.00 59.98 59.64 1ik6 h ARG 182 Cb 0.36 0.04 -0.13 0.00 0.00 0.00 0.00 29.97 30.24 1ik6 h ARG 182 CO -0.29 0.69 -0.07 0.00 0.00 0.00 0.00 179.97 180.31 1ik6 s ALA 183 N -2.60 -0.93 0.75 0.04 0.00 -1.22 -4.69 121.76 113.10 1ik6 s ALA 183 Ca -0.07 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.73 1ik6 s ALA 183 Cb 0.08 0.71 0.05 0.00 0.00 0.00 0.00 23.12 23.96 1ik6 s ALA 183 CO 0.82 -0.65 1.11 -2.14 0.00 0.00 0.00 175.76 174.90 1ik6 s PRO 184 N -3.81 2.35 -0.10 0.00 0.02 -1.26 -4.38 135.00 127.83 1ik6 s PRO 184 Ca 0.03 0.18 -0.04 0.00 0.02 0.00 0.00 61.00 61.20 1ik6 s PRO 184 Cb 0.02 -2.02 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 1ik6 s PRO 184 CO -0.12 -1.31 0.05 1.03 -0.33 0.00 0.00 177.00 176.33 1ik6 s ARG 185 N -5.43 3.14 0.20 5.54 0.52 -1.26 -4.22 118.95 117.44 1ik6 s ARG 185 Ca 0.60 -0.31 -0.09 0.00 -0.52 0.00 0.00 55.73 55.41 1ik6 s ARG 185 Cb -0.11 -2.93 -0.01 0.00 0.52 0.00 0.00 34.95 32.41 1ik6 s ARG 185 CO 0.49 0.73 0.31 -1.83 0.02 0.00 0.00 175.30 175.03 1ik6 s GLU 186 N -0.93 1.29 0.03 3.54 -1.05 -0.29 -4.86 118.70 116.43 1ik6 s GLU 186 Ca 0.14 -1.29 -0.30 0.00 -0.15 0.00 0.00 54.97 53.37 1ik6 s GLU 186 Cb -0.12 0.39 -0.08 0.00 -0.44 0.00 0.00 34.13 33.88 1ik6 s GLU 186 CO 0.03 -0.48 1.70 -1.21 0.95 0.00 0.00 175.26 176.25 1ik6 s GLU 187 N -4.02 4.18 -0.19 -4.83 2.02 -1.26 -0.62 118.70 113.98 1ik6 s GLU 187 Ca 0.23 2.34 -0.01 0.00 0.02 0.00 0.00 54.97 57.55 1ik6 s GLU 187 Cb 0.03 -3.79 0.05 0.00 0.10 0.00 0.00 34.13 30.52 1ik6 s GLU 187 CO 0.05 -0.80 -0.03 0.08 0.02 0.00 0.00 175.26 174.58 1ik6 s VAL 188 N 3.30 1.11 0.32 2.63 1.01 0.67 -4.75 120.40 124.69 1ik6 s VAL 188 Ca 0.76 -0.78 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 1ik6 s VAL 188 Cb -0.39 -1.38 -0.12 0.00 0.00 0.00 0.00 36.38 34.50 1ik6 s VAL 188 CO 0.33 -0.01 1.41 -2.65 0.00 0.00 0.00 175.10 174.18 1ik6 n PRO 189 N 4.85 2.35 0.00 2.72 -0.02 -1.26 -1.08 135.00 142.55 1ik6 n PRO 189 Ca -0.11 0.83 0.13 0.00 -2.02 0.00 0.00 63.50 62.33 1ik6 n PRO 189 Cb 0.46 -2.49 0.49 0.00 -0.02 0.00 0.00 33.50 31.94 1ik6 n PRO 189 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1ik6 n GLU 190 N 1.07 0.09 -1.08 -0.52 0.28 -0.17 -4.87 120.64 115.43 1ik6 n GLU 190 Ca 0.06 -0.03 -0.30 0.00 -0.16 0.00 0.00 57.16 56.73 1ik6 n GLU 190 Cb 0.36 -1.50 0.25 0.00 1.43 0.00 0.00 31.44 31.98 1ik6 n GLU 190 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1ik6 s GLY 191 N -2.93 1.59 -0.59 -1.84 0.00 -1.26 -4.96 107.32 97.33 1ik6 s GLY 191 Ca 0.15 -1.07 -0.28 0.00 0.00 0.00 0.00 44.72 43.52 1ik6 s GLY 191 CO 0.58 -0.13 1.26 -0.35 0.00 0.00 0.00 173.10 174.47 1ik6 s ASP 192 N -4.00 6.33 0.04 1.64 2.15 -1.26 -4.68 116.67 116.89 1ik6 s ASP 192 Ca 0.72 0.11 -0.17 0.00 0.43 0.00 0.00 52.55 53.64 1ik6 s ASP 192 Cb -0.08 -2.55 0.03 0.00 -0.30 0.00 0.00 42.92 40.02 1ik6 s ASP 192 CO 0.56 -1.58 0.39 -0.72 -0.17 0.00 0.00 175.17 173.65 1ik6 s TYR 193 N 5.34 -0.24 0.18 -5.34 -0.85 -1.26 -4.50 117.35 110.69 1ik6 s TYR 193 Ca 0.45 0.20 0.03 0.00 -0.52 0.00 0.00 57.07 57.23 1ik6 s TYR 193 Cb -0.08 0.19 -0.05 0.00 0.38 0.00 0.00 41.96 42.40 1ik6 s TYR 193 CO 0.24 -0.54 -0.01 0.14 -1.52 0.00 0.00 175.55 173.86 1ik6 s VAL 194 N -2.35 0.82 -0.19 -3.49 -7.23 -1.26 -4.61 120.40 102.09 1ik6 s VAL 194 Ca -0.06 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.10 1ik6 s VAL 194 Cb -0.01 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.79 1ik6 s VAL 194 CO -0.02 -0.47 -0.12 -0.69 -0.31 0.00 0.00 175.10 173.49 1ik6 s VAL 195 N -3.56 2.76 0.21 1.32 1.01 -0.57 -4.91 120.40 116.65 1ik6 s VAL 195 Ca 0.24 -0.71 -0.32 0.00 0.00 0.00 0.00 61.98 61.19 1ik6 s VAL 195 Cb 0.06 -2.21 -0.12 0.00 0.00 0.00 0.00 36.38 34.11 1ik6 s VAL 195 CO 0.05 0.49 1.71 1.21 0.00 0.00 0.00 175.10 178.55 1ik6 n GLU 196 N 4.54 2.71 -2.16 2.72 2.13 -1.26 -4.18 120.64 125.14 1ik6 n GLU 196 Ca -0.19 0.98 -0.40 0.00 0.66 0.00 0.00 57.16 58.20 1ik6 n GLU 196 Cb 0.51 -2.81 -0.02 0.00 0.27 0.00 0.00 31.44 29.38 1ik6 n GLU 196 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ik6 s ILE 197 N 1.11 2.82 0.00 6.31 -1.09 -1.26 -3.13 121.20 125.96 1ik6 s ILE 197 Ca 0.75 0.80 0.00 0.00 -2.23 0.00 0.00 60.65 59.98 1ik6 s ILE 197 Cb -0.52 -3.50 0.00 0.00 -1.58 0.00 0.00 42.46 36.85 1ik6 s ILE 197 CO 0.33 0.18 0.00 0.61 -1.23 0.00 0.00 174.94 174.83 1ik6 n GLY 198 N 0.81 0.66 3.13 6.18 0.00 -1.26 -5.05 105.19 109.67 1ik6 n GLY 198 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1ik6 n GLY 198 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ik6 s LYS 199 N -0.29 2.80 0.59 1.61 2.20 -1.18 -4.31 119.74 121.16 1ik6 s LYS 199 Ca 0.00 -0.77 -0.07 0.00 -0.36 0.00 0.00 55.97 54.77 1ik6 s LYS 199 Cb 0.00 -2.30 -0.00 0.00 -1.51 0.00 0.00 37.83 34.01 1ik6 s LYS 199 CO 0.00 -0.05 0.91 0.00 -0.36 0.00 0.00 175.35 175.86 1ik6 s ALA 200 N 0.91 3.25 0.05 3.13 0.00 -1.23 -4.43 121.76 123.44 1ik6 s ALA 200 Ca -0.06 -0.56 0.04 0.00 0.00 0.00 0.00 51.96 51.38 1ik6 s ALA 200 Cb -0.15 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.25 1ik6 s ALA 200 CO -0.03 -0.74 -0.12 -0.98 0.00 0.00 0.00 175.76 173.89 1ik6 s ARG 201 N -5.00 0.73 -0.59 0.00 1.70 -0.06 -4.99 118.95 110.75 1ik6 s ARG 201 Ca 0.53 -0.80 -0.23 0.00 -0.47 0.00 0.00 55.73 54.76 1ik6 s ARG 201 Cb -0.11 -0.67 0.05 0.00 -0.57 0.00 0.00 34.95 33.66 1ik6 s ARG 201 CO 0.47 0.15 0.93 0.08 -1.08 0.00 0.00 175.30 175.84 1ik6 s VAL 202 N -1.14 4.40 -0.47 4.99 1.01 -1.26 -0.04 120.40 127.89 1ik6 s VAL 202 Ca -0.03 -0.02 0.26 0.00 0.00 0.00 0.00 61.98 62.18 1ik6 s VAL 202 Cb -0.09 -4.58 0.29 0.00 0.00 0.00 0.00 36.38 32.00 1ik6 s VAL 202 CO 0.01 -1.22 1.76 0.00 0.00 0.00 0.00 175.10 175.65 1ik6 h ALA 203 N 9.39 1.00 -1.64 5.51 0.00 -0.55 -3.43 119.26 129.54 1ik6 h ALA 203 Ca -0.27 0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.75 1ik6 h ALA 203 Cb 1.07 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.65 1ik6 h ALA 203 CO 1.11 0.00 0.02 0.50 0.00 0.00 0.00 179.25 180.88 1ik6 s ARG 204 N -3.29 0.48 0.39 0.00 3.52 -1.13 -4.92 118.95 113.99 1ik6 s ARG 204 Ca 0.06 1.17 -0.26 0.00 -0.13 0.00 0.00 55.73 56.57 1ik6 s ARG 204 Cb 0.10 0.66 -0.09 0.00 -1.56 0.00 0.00 34.95 34.06 1ik6 s ARG 204 CO 0.50 -0.16 1.15 -1.83 -0.81 0.00 0.00 175.30 174.16 1ik6 s GLU 205 N 2.62 4.14 -0.00 5.12 4.04 -1.26 -0.86 118.70 132.49 1ik6 s GLU 205 Ca -0.05 1.81 -0.28 0.00 0.04 0.00 0.00 54.97 56.49 1ik6 s GLU 205 Cb -0.09 -2.73 0.10 0.00 0.02 0.00 0.00 34.13 31.43 1ik6 s GLU 205 CO -0.18 -0.24 0.85 0.20 -1.84 0.00 0.00 175.26 174.04 1ik6 s GLY 206 N -1.13 -0.47 0.00 -3.83 0.00 -1.26 -4.56 107.32 96.07 1ik6 s GLY 206 Ca 0.56 1.06 0.00 0.00 0.00 0.00 0.00 44.72 46.34 1ik6 s GLY 206 CO 0.38 0.42 0.61 2.09 0.00 0.00 0.00 173.10 176.60 1ik6 n ASP 207 N -0.10 1.03 -0.10 1.64 3.85 -1.13 -4.30 116.55 117.45 1ik6 n ASP 207 Ca -0.11 -1.37 -0.13 0.00 -0.71 0.00 0.00 54.79 52.47 1ik6 n ASP 207 Cb 0.62 0.00 -0.12 0.00 -1.35 0.00 0.00 41.12 40.26 1ik6 n ASP 207 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1ik6 n ASP 208 N -0.19 1.50 -3.80 -1.12 10.43 0.47 -4.26 116.55 119.58 1ik6 n ASP 208 Ca 0.00 -0.07 -0.13 0.00 2.57 0.00 0.00 54.79 57.16 1ik6 n ASP 208 Cb 0.23 0.23 -0.14 0.00 1.84 0.00 0.00 41.12 43.27 1ik6 n ASP 208 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1ik6 s VAL 209 N -2.44 -0.03 -0.21 2.53 1.01 -1.00 -4.33 120.40 115.93 1ik6 s VAL 209 Ca -0.21 0.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.73 1ik6 s VAL 209 Cb 0.07 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.26 1ik6 s VAL 209 CO 0.62 0.04 0.28 -0.89 0.00 0.00 0.00 175.10 175.14 1ik6 s THR 210 N 0.55 5.29 -0.31 3.92 2.01 0.76 0.03 115.64 127.89 1ik6 s THR 210 Ca -0.04 0.46 0.03 0.00 0.31 0.00 0.00 61.69 62.45 1ik6 s THR 210 Cb -0.06 -3.61 0.09 0.00 0.01 0.00 0.00 72.50 68.92 1ik6 s THR 210 CO -0.02 0.32 0.00 -0.22 -0.69 0.00 0.00 174.62 174.01 1ik6 s LEU 211 N 1.03 4.33 -0.21 4.42 0.20 0.32 -1.05 118.68 127.73 1ik6 s LEU 211 Ca 0.14 -1.89 -0.21 0.00 0.69 0.00 0.00 54.13 52.86 1ik6 s LEU 211 Cb -0.14 -1.61 -0.02 0.00 -0.43 0.00 0.00 46.19 43.99 1ik6 s LEU 211 CO 0.05 -0.32 0.62 -0.69 -0.29 0.00 0.00 176.35 175.73 1ik6 s VAL 212 N 0.98 5.02 0.16 1.68 1.01 0.64 -0.81 120.40 129.08 1ik6 s VAL 212 Ca 0.04 1.16 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 1ik6 s VAL 212 Cb -0.19 -3.94 0.01 0.00 0.00 0.00 0.00 36.38 32.26 1ik6 s VAL 212 CO -0.07 0.10 0.27 1.07 0.00 0.00 0.00 175.10 176.47 1ik6 n THR 213 N 4.79 0.00 -3.70 3.92 5.66 0.38 -0.06 114.28 125.27 1ik6 n THR 213 Ca -0.01 -0.61 -0.02 0.00 -3.05 0.00 0.00 64.05 60.36 1ik6 n THR 213 Cb 0.50 0.45 -0.01 0.00 -1.55 0.00 0.00 70.33 69.72 1ik6 n THR 213 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1ik6 s TYR 214 N -5.01 -0.10 0.00 1.09 -0.85 -1.25 -1.06 117.35 110.17 1ik6 s TYR 214 Ca 0.10 -0.12 0.00 0.00 -0.52 0.00 0.00 57.07 56.53 1ik6 s TYR 214 Cb -0.01 0.60 0.00 0.00 0.38 0.00 0.00 41.96 42.93 1ik6 s TYR 214 CO 0.07 -0.60 0.00 0.41 -1.52 0.00 0.00 175.55 173.91 1ik6 n GLY 215 N -0.47 2.45 0.27 5.49 0.00 -1.26 -2.72 105.19 108.96 1ik6 n GLY 215 Ca -0.07 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.62 1ik6 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ik6 h ALA 216 N -0.92 1.99 0.00 4.61 0.00 -1.89 -2.40 119.26 120.65 1ik6 h ALA 216 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ik6 h ALA 216 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ik6 h ALA 216 CO 0.00 -0.00 0.00 0.28 0.00 0.00 0.00 179.25 179.53 1ik6 h VAL 217 N 0.06 0.00 -0.58 0.00 2.07 -1.86 -3.02 116.25 112.91 1ik6 h VAL 217 Ca 0.03 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.25 1ik6 h VAL 217 Cb 0.04 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 1ik6 h VAL 217 CO -0.00 0.00 0.24 0.58 0.02 0.00 0.00 177.57 178.40 1ik6 h VAL 218 N 0.00 0.83 -0.37 2.57 2.07 -1.49 0.49 116.25 120.35 1ik6 h VAL 218 Ca 0.00 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1ik6 h VAL 218 Cb 0.40 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1ik6 h VAL 218 CO 0.00 0.08 0.08 0.45 0.02 0.00 0.00 177.57 178.20 1ik6 h HIS 219 N 0.44 0.55 -0.28 1.57 3.86 -1.74 -0.20 115.15 119.34 1ik6 h HIS 219 Ca 0.28 -0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 59.29 1ik6 h HIS 219 Cb 0.30 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 1ik6 h HIS 219 CO -0.15 0.48 -0.49 0.87 0.86 0.00 0.00 177.93 179.51 1ik6 h LYS 220 N 0.53 0.83 -0.81 2.45 1.57 -1.45 -1.73 116.57 117.96 1ik6 h LYS 220 Ca 0.12 -0.52 -0.01 0.00 -1.87 0.00 0.00 60.65 58.38 1ik6 h LYS 220 Cb 0.21 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1ik6 h LYS 220 CO -0.00 1.15 0.47 0.00 -0.57 0.00 0.00 179.45 180.50 1ik6 h ALA 221 N 0.67 1.04 -0.40 3.86 0.00 -0.27 -1.45 119.26 122.70 1ik6 h ALA 221 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1ik6 h ALA 221 Cb 1.10 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1ik6 h ALA 221 CO 0.11 0.52 -0.06 -0.07 0.00 0.00 0.00 179.25 179.75 1ik6 h LEU 222 N 1.12 0.66 -0.09 0.00 3.38 -0.89 -0.16 115.31 119.34 1ik6 h LEU 222 Ca 0.29 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1ik6 h LEU 222 Cb -0.01 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1ik6 h LEU 222 CO -0.05 0.77 0.01 -0.33 0.09 0.00 0.00 178.44 178.93 1ik6 h GLU 223 N 0.63 0.15 -0.89 1.13 5.08 -0.82 -2.71 114.58 117.15 1ik6 h GLU 223 Ca 0.12 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1ik6 h GLU 223 Cb 0.49 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 1ik6 h GLU 223 CO 0.03 0.38 0.57 0.00 -1.00 0.00 0.00 179.01 178.98 1ik6 h ALA 224 N 0.76 1.22 -0.67 3.43 0.00 -1.10 -0.65 119.26 122.25 1ik6 h ALA 224 Ca 0.03 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1ik6 h ALA 224 Cb 0.30 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1ik6 h ALA 224 CO 0.00 0.35 0.45 0.00 0.00 0.00 0.00 179.25 180.06 1ik6 h ALA 225 N 1.40 2.03 0.00 0.00 0.00 -0.85 -0.45 119.26 121.39 1ik6 h ALA 225 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1ik6 h ALA 225 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ik6 h ALA 225 CO -0.16 -0.19 -0.13 0.93 0.00 0.00 0.00 179.25 179.71 1ik6 h GLU 226 N 0.44 0.00 -0.42 0.00 4.39 -0.81 -3.35 114.58 114.84 1ik6 h GLU 226 Ca 0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.02 1ik6 h GLU 226 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 1ik6 h GLU 226 CO -0.10 0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.29 1ik6 n ARG 227 N -2.80 3.57 -4.42 2.33 1.74 -0.19 -4.98 116.66 111.91 1ik6 n ARG 227 Ca 0.04 -2.85 -0.21 0.00 -0.77 0.00 0.00 57.85 54.06 1ik6 n ARG 227 Cb 0.50 -1.90 -0.10 0.00 -1.02 0.00 0.00 32.46 29.94 1ik6 n ARG 227 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ik6 s VAL 228 N -2.44 1.74 0.02 1.55 -7.23 -1.16 -5.06 120.40 107.83 1ik6 s VAL 228 Ca 0.45 -2.16 -0.19 0.00 -1.81 0.00 0.00 61.98 58.27 1ik6 s VAL 228 Cb 0.33 -2.38 -0.22 0.00 0.56 0.00 0.00 36.38 34.68 1ik6 s VAL 228 CO 0.14 -0.35 1.14 0.07 -0.31 0.00 0.00 175.10 175.79 1ik6 h LYS 229 N 2.31 0.45 -7.09 4.82 -0.00 -1.93 -3.46 116.57 111.67 1ik6 h LYS 229 Ca -0.40 -0.44 -0.55 0.00 -0.00 0.00 0.00 60.65 59.26 1ik6 h LYS 229 Cb 1.23 0.12 0.17 0.00 -0.00 0.00 0.00 32.23 33.75 1ik6 h LYS 229 CO 0.66 1.09 0.34 0.00 -0.00 0.00 0.00 179.45 181.55 1ik6 n ALA 230 N -2.58 0.39 -2.64 0.07 0.00 -1.26 -4.96 120.51 109.54 1ik6 n ALA 230 Ca -0.10 -0.16 -0.43 0.00 0.00 0.00 0.00 53.44 52.76 1ik6 n ALA 230 Cb 0.66 -2.24 -0.04 0.00 0.00 0.00 0.00 19.45 17.82 1ik6 n ALA 230 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ik6 s SER 231 N -1.69 6.36 -0.24 0.00 0.15 -1.26 -5.00 113.70 112.02 1ik6 s SER 231 Ca 0.77 -0.31 -0.09 0.00 0.70 0.00 0.00 55.95 57.02 1ik6 s SER 231 Cb -0.34 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 61.50 1ik6 s SER 231 CO 0.46 -1.14 0.12 -0.69 1.20 0.00 0.00 173.24 173.19 1ik6 s VAL 232 N 3.75 4.98 -0.37 4.45 1.01 -1.26 -0.39 120.40 132.56 1ik6 s VAL 232 Ca 0.30 0.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.15 1ik6 s VAL 232 Cb -0.13 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 32.94 1ik6 s VAL 232 CO 0.20 0.35 0.49 -0.70 0.00 0.00 0.00 175.10 175.44 1ik6 s GLU 233 N 1.18 3.50 -0.26 2.72 2.12 0.10 -4.09 118.70 123.98 1ik6 s GLU 233 Ca 0.06 -0.31 -0.16 0.00 0.36 0.00 0.00 54.97 54.93 1ik6 s GLU 233 Cb -0.14 -3.84 -0.03 0.00 0.26 0.00 0.00 34.13 30.37 1ik6 s GLU 233 CO 0.05 -0.69 0.42 0.08 -0.54 0.00 0.00 175.26 174.58 1ik6 s VAL 234 N 2.34 5.14 -0.26 3.70 1.01 -0.04 -0.52 120.40 131.78 1ik6 s VAL 234 Ca 0.17 0.68 -0.06 0.00 0.00 0.00 0.00 61.98 62.76 1ik6 s VAL 234 Cb -0.16 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1ik6 s VAL 234 CO 0.14 0.14 0.05 -0.69 0.00 0.00 0.00 175.10 174.73 1ik6 s VAL 235 N 2.09 3.99 -0.46 2.92 1.01 0.01 0.26 120.40 130.22 1ik6 s VAL 235 Ca 0.17 -0.39 -0.17 0.00 0.00 0.00 0.00 61.98 61.58 1ik6 s VAL 235 Cb -0.16 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.36 1ik6 s VAL 235 CO 0.10 0.29 0.48 -0.62 0.00 0.00 0.00 175.10 175.35 1ik6 s ASP 236 N 1.55 6.19 0.27 3.32 3.68 0.95 -0.47 116.67 132.16 1ik6 s ASP 236 Ca 0.05 -0.90 -0.01 0.00 2.13 0.00 0.00 52.55 53.83 1ik6 s ASP 236 Cb -0.15 -2.23 0.50 0.00 -1.45 0.00 0.00 42.92 39.58 1ik6 s ASP 236 CO 0.02 -0.69 1.83 -0.07 0.13 0.00 0.00 175.17 176.38 1ik6 h LEU 237 N 9.18 0.85 0.00 -1.34 3.38 -1.36 -0.12 115.31 125.90 1ik6 h LEU 237 Ca -0.27 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1ik6 h LEU 237 Cb 1.11 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1ik6 h LEU 237 CO 0.87 0.46 0.00 0.00 0.09 0.00 0.00 178.44 179.86 1ik6 n GLN 238 N -4.66 0.00 -3.70 1.13 6.02 -1.26 -3.47 117.38 111.44 1ik6 n GLN 238 Ca 0.17 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.79 1ik6 n GLN 238 Cb 0.33 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.48 1ik6 n GLN 238 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1ik6 s THR 239 N 0.00 5.07 -0.09 5.09 2.01 -1.26 -0.92 115.64 125.54 1ik6 s THR 239 Ca 0.00 0.08 0.15 0.00 0.31 0.00 0.00 61.69 62.23 1ik6 s THR 239 Cb 0.00 -3.38 -0.14 0.00 0.01 0.00 0.00 72.50 69.00 1ik6 s THR 239 CO 0.00 0.33 0.90 -0.07 -0.69 0.00 0.00 174.62 175.09 1ik6 h LEU 240 N 7.85 0.00 -7.00 4.42 3.38 -0.39 -3.41 115.31 120.16 1ik6 h LEU 240 Ca -0.37 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.51 1ik6 h LEU 240 Cb 1.18 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.65 1ik6 h LEU 240 CO 0.61 0.70 -0.37 0.21 0.09 0.00 0.00 178.44 179.68 1ik6 s ASN 241 N -6.02 -0.24 0.05 -0.43 2.47 -0.62 -3.62 114.94 106.53 1ik6 s ASN 241 Ca -0.02 0.90 -0.30 0.00 0.42 0.00 0.00 52.86 53.86 1ik6 s ASN 241 Cb 0.08 1.37 -0.04 0.00 -1.45 0.00 0.00 41.25 41.21 1ik6 s ASN 241 CO 0.81 -0.24 1.01 -2.16 -3.72 0.00 0.00 177.10 172.80 1ik6 s PRO 242 N 2.62 4.58 0.31 0.43 0.04 -1.26 -0.45 135.00 141.27 1ik6 s PRO 242 Ca 0.01 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 1ik6 s PRO 242 Cb -0.13 -3.41 -0.11 0.00 0.04 0.00 0.00 34.50 30.89 1ik6 s PRO 242 CO -0.14 0.00 1.54 -1.17 0.04 0.00 0.00 177.00 177.27 1ik6 s LEU 243 N 0.66 4.35 -1.21 -3.56 2.96 -1.24 -4.57 118.68 116.07 1ik6 s LEU 243 Ca 0.51 2.92 -0.17 0.00 -0.22 0.00 0.00 54.13 57.18 1ik6 s LEU 243 Cb -0.23 -3.64 0.12 0.00 0.50 0.00 0.00 46.19 42.94 1ik6 s LEU 243 CO 0.29 -0.86 1.53 -0.62 -1.32 0.00 0.00 176.35 175.37 1ik6 s ASP 244 N 0.30 6.90 0.36 3.68 3.68 -1.26 -4.80 116.67 125.53 1ik6 s ASP 244 Ca 0.60 -2.59 0.11 0.00 2.13 0.00 0.00 52.55 52.80 1ik6 s ASP 244 Cb -0.46 -2.48 0.67 0.00 -1.45 0.00 0.00 42.92 39.19 1ik6 s ASP 244 CO 0.51 -1.00 1.81 0.15 0.13 0.00 0.00 175.17 176.77 1ik6 h PHE 245 N 7.65 0.11 -0.56 -5.34 3.57 -1.91 -3.13 116.94 117.31 1ik6 h PHE 245 Ca 0.35 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.87 1ik6 h PHE 245 Cb 0.89 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.56 1ik6 h PHE 245 CO 1.25 0.43 0.31 -0.44 -2.23 0.00 0.00 178.31 177.63 1ik6 h ASP 246 N 0.08 0.47 -0.63 0.41 3.32 -1.99 0.22 116.42 118.31 1ik6 h ASP 246 Ca 0.01 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1ik6 h ASP 246 Cb 0.65 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.10 1ik6 h ASP 246 CO 0.05 0.32 0.12 0.74 -1.72 0.00 0.00 179.24 178.75 1ik6 h THR 247 N 0.60 1.26 -0.40 0.35 2.02 -1.95 0.93 112.91 115.73 1ik6 h THR 247 Ca 0.24 -0.99 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 1ik6 h THR 247 Cb 0.11 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1ik6 h THR 247 CO -0.14 0.37 0.09 0.58 0.37 0.00 0.00 175.52 176.79 1ik6 h VAL 248 N 0.94 1.23 -0.69 3.16 2.07 -1.39 -1.62 116.25 119.95 1ik6 h VAL 248 Ca 0.19 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 1ik6 h VAL 248 Cb 0.41 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1ik6 h VAL 248 CO 0.01 0.28 0.17 0.25 0.02 0.00 0.00 177.57 178.29 1ik6 h LEU 249 N 0.50 1.04 -0.63 2.57 5.85 -0.28 -0.97 115.31 123.39 1ik6 h LEU 249 Ca 0.12 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1ik6 h LEU 249 Cb 0.32 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1ik6 h LEU 249 CO 0.00 1.00 0.31 0.50 -0.34 0.00 0.00 178.44 179.92 1ik6 h LYS 250 N 1.05 0.90 -0.31 1.25 3.64 -0.61 0.10 116.57 122.59 1ik6 h LYS 250 Ca 0.22 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1ik6 h LYS 250 Cb 0.37 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1ik6 h LYS 250 CO 0.00 0.71 -0.03 1.03 -2.27 0.00 0.00 179.45 178.89 1ik6 h SER 251 N 0.86 0.57 0.29 4.20 0.87 -0.91 -2.91 113.55 116.52 1ik6 h SER 251 Ca 0.22 -0.33 -0.09 0.00 -1.23 0.00 0.00 61.79 60.35 1ik6 h SER 251 Cb 0.10 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1ik6 h SER 251 CO -0.03 0.77 -0.39 0.58 -0.53 0.00 0.00 176.83 177.23 1ik6 h VAL 252 N 0.36 1.29 -0.27 2.23 2.07 -1.01 -0.96 116.25 119.97 1ik6 h VAL 252 Ca 0.08 -1.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.13 1ik6 h VAL 252 Cb 0.50 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1ik6 h VAL 252 CO 0.02 0.42 -0.08 0.28 0.02 0.00 0.00 177.57 178.23 1ik6 h SER 253 N 0.12 0.40 0.01 0.57 0.02 -0.88 0.14 113.55 113.93 1ik6 h SER 253 Ca 0.01 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1ik6 h SER 253 Cb 0.74 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1ik6 h SER 253 CO 0.06 0.53 -0.00 0.50 -1.14 0.00 0.00 176.83 176.77 1ik6 h LYS 254 N 0.40 -0.01 0.20 3.45 3.64 -1.25 -3.39 116.57 119.62 1ik6 h LYS 254 Ca 0.08 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.14 1ik6 h LYS 254 Cb 0.39 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.23 1ik6 h LYS 254 CO 0.02 0.81 -1.45 1.79 -2.27 0.00 0.00 179.45 178.35 1ik6 h THR 255 N -0.85 1.30 0.00 1.00 1.35 -1.15 -3.47 112.91 111.09 1ik6 h THR 255 Ca -0.00 -2.80 0.00 0.00 -0.55 0.00 0.00 66.41 63.06 1ik6 h THR 255 Cb 0.82 2.97 0.00 0.00 -1.73 0.00 0.00 68.15 70.21 1ik6 h THR 255 CO 0.00 0.84 0.00 0.61 -0.25 0.00 0.00 175.52 176.72 1ik6 n GLY 256 N 1.68 0.71 2.91 5.82 0.00 0.47 -4.70 105.19 112.08 1ik6 n GLY 256 Ca -0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 1ik6 n GLY 256 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ik6 s ARG 257 N -0.24 0.67 -0.06 1.61 0.52 -1.26 -0.50 118.95 119.68 1ik6 s ARG 257 Ca 0.00 -0.13 0.02 0.00 -0.52 0.00 0.00 55.73 55.10 1ik6 s ARG 257 Cb 0.00 -0.68 0.02 0.00 0.52 0.00 0.00 34.95 34.80 1ik6 s ARG 257 CO 0.00 -0.01 -0.11 -1.17 0.02 0.00 0.00 175.30 174.03 1ik6 s LEU 258 N 0.56 1.58 -0.06 2.53 2.96 -1.26 -0.17 118.68 124.82 1ik6 s LEU 258 Ca -0.07 -0.26 0.04 0.00 -0.22 0.00 0.00 54.13 53.62 1ik6 s LEU 258 Cb -0.11 -0.74 0.00 0.00 0.50 0.00 0.00 46.19 45.84 1ik6 s LEU 258 CO -0.00 0.01 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.24 1ik6 s ILE 259 N 0.72 1.46 -0.16 6.68 1.01 -0.21 -1.21 121.20 129.49 1ik6 s ILE 259 Ca -0.14 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.82 1ik6 s ILE 259 Cb -0.15 -1.27 0.01 0.00 0.01 0.00 0.00 42.46 41.05 1ik6 s ILE 259 CO 0.03 0.42 -0.20 -0.63 0.00 0.00 0.00 174.94 174.56 1ik6 s ILE 260 N 0.23 2.13 -0.06 2.92 1.01 0.13 -0.26 121.20 127.31 1ik6 s ILE 260 Ca -0.09 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.64 1ik6 s ILE 260 Cb -0.14 -1.87 0.02 0.00 0.01 0.00 0.00 42.46 40.48 1ik6 s ILE 260 CO 0.04 0.54 -0.07 0.00 0.00 0.00 0.00 174.94 175.44 1ik6 s ALA 261 N 1.01 0.91 0.03 9.38 0.00 0.91 -0.84 121.76 133.16 1ik6 s ALA 261 Ca -0.02 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.64 1ik6 s ALA 261 Cb -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.48 1ik6 s ALA 261 CO -0.06 0.00 0.20 -3.38 0.00 0.00 0.00 175.76 172.52 1ik6 s HIS 262 N 0.89 0.04 -0.66 0.00 -3.43 -0.78 -3.95 115.29 107.39 1ik6 s HIS 262 Ca -0.11 -0.23 0.24 0.00 -0.80 0.00 0.00 55.06 54.16 1ik6 s HIS 262 Cb -0.15 -0.02 0.41 0.00 -1.43 0.00 0.00 32.58 31.39 1ik6 s HIS 262 CO 0.01 -0.42 1.38 -0.40 -2.00 0.00 0.00 174.74 173.31 1ik6 n ASP 263 N 0.77 0.71 -4.69 7.38 3.85 -1.26 -2.83 116.55 120.47 1ik6 n ASP 263 Ca -0.19 0.17 -0.30 0.00 -0.71 0.00 0.00 54.79 53.77 1ik6 n ASP 263 Cb 0.58 0.04 0.15 0.00 -1.35 0.00 0.00 41.12 40.55 1ik6 n ASP 263 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1ik6 s SER 264 N -4.24 3.13 0.03 -1.12 1.04 -1.26 -3.42 113.70 107.86 1ik6 s SER 264 Ca 0.07 1.50 -0.38 0.00 0.48 0.00 0.00 55.95 57.61 1ik6 s SER 264 Cb 0.13 -2.17 -0.18 0.00 0.10 0.00 0.00 66.02 63.90 1ik6 s SER 264 CO 0.70 -2.86 1.23 -2.65 0.98 0.00 0.00 173.24 170.65 1ik6 n PRO 265 N -4.03 0.61 -0.04 4.02 -0.02 -1.26 -1.23 135.00 133.05 1ik6 n PRO 265 Ca 0.07 0.22 -0.13 0.00 -2.02 0.00 0.00 63.50 61.63 1ik6 n PRO 265 Cb 0.55 -1.80 -0.08 0.00 -0.02 0.00 0.00 33.50 32.15 1ik6 n PRO 265 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ik6 h LYS 266 N 3.90 0.25 -6.30 -0.52 3.64 -1.49 -3.34 116.57 112.72 1ik6 h LYS 266 Ca -0.49 -0.15 -0.54 0.00 -1.27 0.00 0.00 60.65 58.20 1ik6 h LYS 266 Cb 1.38 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 1ik6 h LYS 266 CO 0.73 0.70 1.16 0.99 -2.27 0.00 0.00 179.45 180.76 1ik6 s THR 267 N -4.17 3.32 0.00 1.00 2.01 -1.26 -1.10 115.64 115.43 1ik6 s THR 267 Ca -0.15 0.38 0.00 0.00 0.31 0.00 0.00 61.69 62.24 1ik6 s THR 267 Cb 0.04 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1ik6 s THR 267 CO 0.73 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 1ik6 n GLY 268 N 4.35 0.63 2.39 4.40 0.00 -1.26 -5.00 105.19 110.69 1ik6 n GLY 268 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1ik6 n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ik6 n GLY 269 N -1.99 -2.53 0.37 -0.02 0.00 -0.26 -4.86 105.19 95.91 1ik6 n GLY 269 Ca 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 46.02 44.50 1ik6 n GLY 269 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ik6 h LEU 270 N 0.00 1.12 -1.56 0.99 6.46 -1.86 -2.29 115.31 118.17 1ik6 h LEU 270 Ca -0.28 -0.04 0.16 0.00 -0.12 0.00 0.00 57.88 57.61 1ik6 h LEU 270 Cb 0.84 -0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 40.44 1ik6 h LEU 270 CO 0.18 0.82 0.53 1.23 -0.62 0.00 0.00 178.44 180.58 1ik6 h GLY 271 N 1.31 0.75 0.94 3.75 0.00 -1.92 -1.02 103.07 106.88 1ik6 h GLY 271 Ca 0.35 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 1ik6 h GLY 271 CO -0.07 0.05 0.00 0.00 0.00 0.00 0.00 176.54 176.52 1ik6 h ALA 272 N 1.63 0.51 -0.36 3.60 0.00 -1.65 -1.67 119.26 121.32 1ik6 h ALA 272 Ca 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1ik6 h ALA 272 Cb 0.93 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1ik6 h ALA 272 CO -0.13 0.28 0.14 0.93 0.00 0.00 0.00 179.25 180.47 1ik6 h GLU 273 N 0.49 0.55 -0.10 0.00 4.39 -1.23 -0.81 114.58 117.87 1ik6 h GLU 273 Ca 0.11 -0.10 0.02 0.00 0.34 0.00 0.00 59.36 59.72 1ik6 h GLU 273 Cb 0.46 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1ik6 h GLU 273 CO 0.02 0.54 -0.01 0.28 -1.16 0.00 0.00 179.01 178.67 1ik6 h VAL 274 N 0.44 0.91 -0.72 3.13 2.07 -1.25 0.65 116.25 121.48 1ik6 h VAL 274 Ca 0.12 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.66 1ik6 h VAL 274 Cb 0.20 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 1ik6 h VAL 274 CO -0.01 0.00 0.46 0.03 0.02 0.00 0.00 177.57 178.07 1ik6 h ARG 275 N 0.01 0.88 -0.53 1.57 -0.00 -1.21 -0.14 114.38 114.97 1ik6 h ARG 275 Ca 0.05 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.98 59.43 1ik6 h ARG 275 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 29.97 29.81 1ik6 h ARG 275 CO -0.09 0.58 0.17 0.00 0.00 0.00 0.00 179.97 180.63 1ik6 h ALA 276 N 1.30 0.69 -0.76 0.04 0.00 -0.72 0.10 119.26 119.91 1ik6 h ALA 276 Ca 0.28 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ik6 h ALA 276 Cb -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1ik6 h ALA 276 CO -0.10 0.35 0.29 -0.07 0.00 0.00 0.00 179.25 179.73 1ik6 h LEU 277 N 0.73 1.06 -0.48 0.00 3.38 -0.58 -2.26 115.31 117.16 1ik6 h LEU 277 Ca 0.17 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1ik6 h LEU 277 Cb 0.27 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1ik6 h LEU 277 CO -0.01 0.95 -0.40 0.58 0.09 0.00 0.00 178.44 179.66 1ik6 h VAL 278 N 1.11 1.28 0.00 1.22 2.07 -0.67 -0.17 116.25 121.09 1ik6 h VAL 278 Ca 0.25 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.18 1ik6 h VAL 278 Cb 0.23 1.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1ik6 h VAL 278 CO -0.02 0.52 -0.08 0.00 0.02 0.00 0.00 177.57 178.00 1ik6 h ALA 279 N 0.88 1.22 0.01 1.67 0.00 -0.51 0.40 119.26 122.92 1ik6 h ALA 279 Ca 0.05 -0.08 -0.40 0.00 0.00 0.00 0.00 54.91 54.49 1ik6 h ALA 279 Cb 0.96 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1ik6 h ALA 279 CO 0.09 0.10 -2.24 -1.91 0.00 0.00 0.00 179.25 175.29 1ik6 n GLU 280 N -3.51 0.60 0.14 0.00 2.13 -0.88 -4.31 120.64 114.82 1ik6 n GLU 280 Ca -0.02 0.31 0.12 0.00 0.66 0.00 0.00 57.16 58.23 1ik6 n GLU 280 Cb 0.22 -1.56 0.06 0.00 0.27 0.00 0.00 31.44 30.42 1ik6 n GLU 280 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1ik6 h LYS 281 N -0.80 0.00 0.00 5.31 1.57 -1.06 -3.40 116.57 118.19 1ik6 h LYS 281 Ca -0.60 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.08 1ik6 h LYS 281 Cb 1.62 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.70 1ik6 h LYS 281 CO -0.31 0.00 -0.80 0.00 -0.57 0.00 0.00 179.45 177.77 1ik6 n ALA 282 N -2.15 2.23 0.26 3.86 0.00 0.09 -4.85 120.51 119.94 1ik6 n ALA 282 Ca 0.01 -1.81 0.10 0.00 0.00 0.00 0.00 53.44 51.74 1ik6 n ALA 282 Cb 0.54 -0.63 0.68 0.00 0.00 0.00 0.00 19.45 20.04 1ik6 n ALA 282 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ik6 h LEU 283 N 0.58 0.00 -1.78 0.00 6.46 -1.63 -1.37 115.31 117.57 1ik6 h LEU 283 Ca -0.13 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.63 1ik6 h LEU 283 Cb 1.67 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.60 1ik6 h LEU 283 CO 0.06 0.06 0.00 -2.24 -0.62 0.00 0.00 178.44 175.70 1ik6 h ASP 284 N 0.00 0.00 0.19 1.25 2.03 -1.89 -2.55 116.42 115.45 1ik6 h ASP 284 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1ik6 h ASP 284 Cb 0.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 1ik6 h ASP 284 CO 0.01 0.00 -0.66 0.54 -1.03 0.00 0.00 179.24 178.09 1ik6 n ARG 285 N -2.77 0.29 -3.06 4.15 1.74 -0.52 -4.94 116.66 111.55 1ik6 n ARG 285 Ca -0.01 -0.22 -0.39 0.00 -0.77 0.00 0.00 57.85 56.46 1ik6 n ARG 285 Cb 0.17 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.06 1ik6 n ARG 285 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ik6 s LEU 286 N -2.86 4.52 0.00 0.55 1.02 -0.96 -4.01 118.68 116.95 1ik6 s LEU 286 Ca 0.13 1.47 0.06 0.00 0.02 0.00 0.00 54.13 55.80 1ik6 s LEU 286 Cb 0.17 -3.16 0.00 0.00 0.02 0.00 0.00 46.19 43.22 1ik6 s LEU 286 CO 0.72 0.16 0.51 0.35 0.02 0.00 0.00 176.35 178.11 1ik6 n THR 287 N 2.07 0.00 -4.16 5.49 -2.24 0.34 -5.03 114.28 110.75 1ik6 n THR 287 Ca -0.06 -0.45 -0.10 0.00 -2.27 0.00 0.00 64.05 61.17 1ik6 n THR 287 Cb 0.50 1.08 -0.10 0.00 -2.10 0.00 0.00 70.33 69.70 1ik6 n THR 287 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ik6 s ALA 288 N -0.93 0.91 0.48 6.98 0.00 -1.20 -4.75 121.76 123.25 1ik6 s ALA 288 Ca 0.05 -1.40 -0.24 0.00 0.00 0.00 0.00 51.96 50.38 1ik6 s ALA 288 Cb 0.05 0.46 -0.07 0.00 0.00 0.00 0.00 23.12 23.55 1ik6 s ALA 288 CO 0.14 -0.35 1.31 -2.14 0.00 0.00 0.00 175.76 174.72 1ik6 s PRO 289 N -3.93 3.58 -0.24 0.00 0.02 -1.26 -4.77 135.00 128.40 1ik6 s PRO 289 Ca 0.16 2.15 -0.28 0.00 0.02 0.00 0.00 61.00 63.05 1ik6 s PRO 289 Cb 0.07 -2.48 0.01 0.00 0.02 0.00 0.00 34.50 32.11 1ik6 s PRO 289 CO -0.03 -0.81 1.00 0.08 -0.33 0.00 0.00 177.00 176.91 1ik6 s VAL 290 N -1.33 4.70 -0.17 3.83 1.01 -1.26 -4.57 120.40 122.61 1ik6 s VAL 290 Ca 0.64 1.90 -0.08 0.00 0.00 0.00 0.00 61.98 64.44 1ik6 s VAL 290 Cb -0.38 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 1ik6 s VAL 290 CO 0.47 -0.19 0.11 -0.63 0.00 0.00 0.00 175.10 174.86 1ik6 s ILE 291 N 3.17 5.22 -0.15 2.22 -1.09 -0.35 -5.01 121.20 125.20 1ik6 s ILE 291 Ca 0.42 0.11 -0.02 0.00 -2.23 0.00 0.00 60.65 58.94 1ik6 s ILE 291 Cb -0.15 -3.33 -0.02 0.00 -1.58 0.00 0.00 42.46 37.38 1ik6 s ILE 291 CO 0.07 0.51 -0.09 -0.13 -1.23 0.00 0.00 174.94 174.07 1ik6 s ARG 292 N -0.11 3.46 -0.25 2.79 0.52 -1.26 0.17 118.95 124.28 1ik6 s ARG 292 Ca 0.09 -0.63 0.02 0.00 -0.52 0.00 0.00 55.73 54.70 1ik6 s ARG 292 Cb -0.12 -2.78 0.06 0.00 0.52 0.00 0.00 34.95 32.63 1ik6 s ARG 292 CO 0.00 0.15 -0.09 -0.51 0.02 0.00 0.00 175.30 174.87 1ik6 s LEU 293 N 0.56 3.13 0.00 2.53 1.43 -0.02 -4.96 118.68 121.35 1ik6 s LEU 293 Ca -0.06 -1.31 0.02 0.00 -1.03 0.00 0.00 54.13 51.75 1ik6 s LEU 293 Cb -0.15 -1.43 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 1ik6 s LEU 293 CO 0.03 -0.20 0.17 0.00 0.23 0.00 0.00 176.35 176.58 1ik6 n ALA 294 N 4.51 0.12 -1.60 4.21 0.00 -1.26 -1.87 120.51 124.62 1ik6 n ALA 294 Ca -0.14 -0.82 -0.30 0.00 0.00 0.00 0.00 53.44 52.18 1ik6 n ALA 294 Cb 0.43 0.66 0.07 0.00 0.00 0.00 0.00 19.45 20.61 1ik6 n ALA 294 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ik6 s GLY 295 N -2.02 1.64 0.55 0.00 0.00 -0.36 -4.27 107.32 102.86 1ik6 s GLY 295 Ca 0.16 -0.11 -0.21 0.00 0.00 0.00 0.00 44.72 44.56 1ik6 s GLY 295 CO 0.11 0.26 1.28 -4.14 0.00 0.00 0.00 173.10 170.61 1ik6 s PRO 296 N -5.14 3.16 0.00 2.90 0.02 -1.26 -1.45 135.00 133.23 1ik6 s PRO 296 Ca 0.59 2.03 0.17 0.00 0.02 0.00 0.00 61.00 63.81 1ik6 s PRO 296 Cb -0.14 -2.17 0.79 0.00 0.02 0.00 0.00 34.50 33.00 1ik6 s PRO 296 CO 0.54 -1.11 1.54 -0.25 -0.33 0.00 0.00 177.00 177.39 1ik6 n ASP 297 N -1.14 0.00 -0.79 2.53 8.00 -1.26 -4.29 116.55 119.59 1ik6 n ASP 297 Ca 0.11 0.32 -0.03 0.00 0.71 0.00 0.00 54.79 55.90 1ik6 n ASP 297 Cb 0.47 -0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 1ik6 n ASP 297 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1ik6 n VAL 298 N -1.42 0.00 -5.13 2.53 0.24 -1.26 -4.95 118.33 108.34 1ik6 n VAL 298 Ca 0.06 -0.06 -0.31 0.00 -2.04 0.00 0.00 64.34 61.99 1ik6 n VAL 298 Cb 0.18 0.32 -0.17 0.00 -1.47 0.00 0.00 33.84 32.70 1ik6 n VAL 298 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1ik6 s PRO 311 N 0.00 2.75 0.46 7.34 0.05 -1.26 -5.20 135.00 139.13 1ik6 s PRO 311 Ca 0.02 -0.82 0.04 0.00 0.05 0.00 0.00 61.00 60.29 1ik6 s PRO 311 Cb 0.02 -2.13 0.01 0.00 0.05 0.00 0.00 34.50 32.45 1ik6 s PRO 311 CO -0.01 0.20 0.65 0.95 0.05 0.00 0.00 177.00 178.83 1ik6 s THR 312 N 0.28 3.32 0.22 1.26 -4.23 -1.26 -4.97 115.64 110.26 1ik6 s THR 312 Ca -0.15 -0.76 -0.09 0.00 -1.18 0.00 0.00 61.69 59.51 1ik6 s THR 312 Cb -0.17 -3.19 0.17 0.00 1.34 0.00 0.00 72.50 70.65 1ik6 s THR 312 CO 0.07 -0.11 1.87 0.58 -0.54 0.00 0.00 174.62 176.49 1ik6 h VAL 313 N 0.43 1.14 -0.52 2.29 2.07 -2.00 -1.92 116.25 117.74 1ik6 h VAL 313 Ca -0.43 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 1ik6 h VAL 313 Cb 1.27 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1ik6 h VAL 313 CO 0.52 0.18 0.05 -0.33 0.02 0.00 0.00 177.57 178.00 1ik6 h GLU 314 N 0.98 0.85 -0.22 1.57 3.07 -1.95 0.05 114.58 118.93 1ik6 h GLU 314 Ca 0.30 -0.21 -0.11 0.00 -0.50 0.00 0.00 59.36 58.84 1ik6 h GLU 314 Cb -0.02 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 27.77 1ik6 h GLU 314 CO -0.10 0.82 -0.34 -0.09 -1.40 0.00 0.00 179.01 177.89 1ik6 h ARG 315 N 0.80 0.47 -0.29 2.33 9.65 -1.83 -0.56 114.38 124.94 1ik6 h ARG 315 Ca 0.16 -0.21 -0.18 0.00 -1.10 0.00 0.00 59.98 58.65 1ik6 h ARG 315 Cb 0.41 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.98 1ik6 h ARG 315 CO 0.01 0.76 -0.51 0.82 2.80 0.00 0.00 179.97 183.85 1ik6 h ILE 316 N 0.40 1.28 -0.30 1.20 2.04 -1.01 -1.57 117.51 119.55 1ik6 h ILE 316 Ca 0.05 -1.69 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 1ik6 h ILE 316 Cb 0.80 1.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1ik6 h ILE 316 CO 0.06 0.55 0.15 0.40 0.00 0.00 0.00 178.15 179.32 1ik6 h ILE 317 N 0.63 1.14 -0.64 -0.67 2.04 -0.67 -0.69 117.51 118.66 1ik6 h ILE 317 Ca 0.02 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.49 1ik6 h ILE 317 Cb 1.11 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 1ik6 h ILE 317 CO 0.11 0.15 0.42 0.11 0.00 0.00 0.00 178.15 178.94 1ik6 h LYS 318 N 0.36 0.84 -0.47 2.37 1.57 -1.01 -0.63 116.57 119.59 1ik6 h LYS 318 Ca 0.11 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 1ik6 h LYS 318 Cb 0.09 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1ik6 h LYS 318 CO -0.01 0.55 -0.23 0.00 -0.57 0.00 0.00 179.45 179.19 1ik6 h ALA 319 N 1.60 0.66 -0.13 3.86 0.00 -0.69 -0.08 119.26 124.48 1ik6 h ALA 319 Ca 0.23 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ik6 h ALA 319 Cb -0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1ik6 h ALA 319 CO -0.05 0.66 0.07 0.82 0.00 0.00 0.00 179.25 180.75 1ik6 h ILE 320 N 0.84 1.12 -1.00 0.00 2.04 -0.49 -1.61 117.51 118.42 1ik6 h ILE 320 Ca 0.10 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.66 1ik6 h ILE 320 Cb 0.81 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.94 1ik6 h ILE 320 CO 0.07 0.11 0.65 -0.33 0.00 0.00 0.00 178.15 178.65 1ik6 h GLU 321 N 0.09 1.19 0.04 2.37 5.08 -0.99 -0.56 114.58 121.81 1ik6 h GLU 321 Ca 0.05 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1ik6 h GLU 321 Cb 0.12 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1ik6 h GLU 321 CO -0.01 0.79 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.85 1ik6 h TYR 322 N 1.23 -0.05 0.00 4.33 3.20 -0.56 -2.94 116.97 122.17 1ik6 h TYR 322 Ca 0.41 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.21 1ik6 h TYR 322 Cb 0.06 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1ik6 h TYR 322 CO -0.00 0.10 -0.33 -0.39 -1.64 0.00 0.00 178.16 175.90 1ik6 h VAL 323 N -0.20 0.99 0.00 1.81 -1.51 -1.01 -1.64 116.25 114.68 1ik6 h VAL 323 Ca -0.01 -1.25 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1ik6 h VAL 323 Cb 0.18 1.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1ik6 h VAL 323 CO 0.01 0.32 0.00 0.23 -1.23 0.00 0.00 177.57 176.90 1ik6 n MET 324 N -3.78 0.15 0.23 5.19 2.81 -0.24 -1.11 117.12 120.36 1ik6 n MET 324 Ca -0.01 0.50 0.10 0.00 -1.81 0.00 0.00 57.70 56.48 1ik6 n MET 324 Cb 0.42 -1.85 0.49 0.00 -0.71 0.00 0.00 33.22 31.56 1ik6 n MET 324 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ik6 h ARG 325 N 0.00 0.00 -0.03 0.03 3.08 -1.23 -3.51 114.38 112.72 1ik6 h ARG 325 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ik6 h ARG 325 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1ik6 h ARG 325 CO 0.00 0.22 0.00 0.66 -1.07 0.00 0.00 179.97 179.78