#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ia8 s VAL 3 N 0.00 4.26 0.00 0.00 1.01 -1.26 -4.99 120.40 119.42 1ia8 s VAL 3 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.48 1ia8 s VAL 3 Cb 0.00 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1ia8 s VAL 3 CO 0.00 -0.24 0.20 -2.65 0.00 0.00 0.00 175.10 172.41 1ia8 n PRO 4 N 6.80 0.00 -0.71 2.72 -0.02 -1.26 -3.53 135.00 139.00 1ia8 n PRO 4 Ca 0.14 0.20 -0.11 0.00 -2.02 0.00 0.00 63.50 61.70 1ia8 n PRO 4 Cb 0.45 -0.59 0.04 0.00 -0.02 0.00 0.00 33.50 33.38 1ia8 n PRO 4 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ia8 n PHE 5 N -0.44 1.13 0.80 6.00 3.01 -1.26 -4.43 117.46 122.26 1ia8 n PHE 5 Ca 0.00 -1.55 0.13 0.00 1.01 0.00 0.00 57.45 57.05 1ia8 n PHE 5 Cb 0.00 -0.76 0.51 0.00 -0.01 0.00 0.00 39.48 39.22 1ia8 n PHE 5 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1ia8 n VAL 6 N 0.48 0.32 1.22 -4.37 0.31 -1.23 -3.08 118.33 111.98 1ia8 n VAL 6 Ca 0.22 -0.14 0.13 0.00 -0.01 0.00 0.00 64.34 64.54 1ia8 n VAL 6 Cb 0.64 -0.56 0.35 0.00 -0.91 0.00 0.00 33.84 33.36 1ia8 n VAL 6 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ia8 n GLU 7 N -1.89 1.94 -3.33 5.55 -0.58 -1.26 -4.86 120.64 116.21 1ia8 n GLU 7 Ca 0.06 -1.38 -0.38 0.00 -0.42 0.00 0.00 57.16 55.05 1ia8 n GLU 7 Cb 0.38 -1.46 -0.06 0.00 -0.57 0.00 0.00 31.44 29.73 1ia8 n GLU 7 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ia8 s ASP 8 N -1.90 6.73 -0.04 1.62 1.01 -1.18 -5.04 116.67 117.87 1ia8 s ASP 8 Ca 0.34 0.87 0.04 0.00 0.71 0.00 0.00 52.55 54.51 1ia8 s ASP 8 Cb 0.20 -2.29 -0.00 0.00 1.01 0.00 0.00 42.92 41.84 1ia8 s ASP 8 CO 0.31 0.06 -0.16 0.26 0.21 0.00 0.00 175.17 175.85 1ia8 s TRP 9 N 0.31 1.63 -0.19 4.23 0.51 -1.26 -0.63 118.94 123.53 1ia8 s TRP 9 Ca 0.26 -0.46 -0.10 0.00 -2.12 0.00 0.00 56.10 53.68 1ia8 s TRP 9 Cb -0.16 -1.10 -0.05 0.00 -0.81 0.00 0.00 33.47 31.35 1ia8 s TRP 9 CO 0.11 -0.16 0.14 -0.51 -0.51 0.00 0.00 176.95 176.02 1ia8 s ASP 10 N 0.06 6.24 -0.70 2.95 -0.00 0.39 -4.87 116.67 120.74 1ia8 s ASP 10 Ca -0.04 0.27 -0.21 0.00 -0.00 0.00 0.00 52.55 52.57 1ia8 s ASP 10 Cb -0.11 -2.09 0.09 0.00 -0.00 0.00 0.00 42.92 40.80 1ia8 s ASP 10 CO 0.02 0.20 0.96 -0.76 -0.00 0.00 0.00 175.17 175.59 1ia8 s LEU 11 N 0.20 4.63 0.07 1.23 1.02 -1.26 -0.64 118.68 123.92 1ia8 s LEU 11 Ca 0.09 -1.23 -0.10 0.00 0.02 0.00 0.00 54.13 52.91 1ia8 s LEU 11 Cb -0.11 -2.40 -0.27 0.00 0.02 0.00 0.00 46.19 43.42 1ia8 s LEU 11 CO -0.01 -1.33 1.12 0.58 0.02 0.00 0.00 176.35 176.73 1ia8 h VAL 12 N 5.95 1.38 -2.51 -1.59 2.07 -1.52 -3.49 116.25 116.54 1ia8 h VAL 12 Ca -0.21 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 64.58 1ia8 h VAL 12 Cb 1.06 2.83 -0.15 0.00 -1.52 0.00 0.00 31.29 33.51 1ia8 h VAL 12 CO 1.16 0.81 0.29 0.00 0.02 0.00 0.00 177.57 179.85 1ia8 s GLN 13 N -2.82 1.08 -0.10 1.57 -2.07 -1.24 -4.99 119.66 111.09 1ia8 s GLN 13 Ca -0.07 -0.22 -0.24 0.00 -1.82 0.00 0.00 55.36 53.02 1ia8 s GLN 13 Cb 0.06 0.50 -0.03 0.00 -1.09 0.00 0.00 33.01 32.46 1ia8 s GLN 13 CO 0.91 -0.44 0.74 -0.08 -1.32 0.00 0.00 175.29 175.11 1ia8 s THR 14 N -2.82 4.99 -0.03 3.63 -1.32 -1.26 0.39 115.64 119.22 1ia8 s THR 14 Ca -0.01 1.50 0.09 0.00 -1.21 0.00 0.00 61.69 62.06 1ia8 s THR 14 Cb -0.01 -4.07 -0.23 0.00 -1.51 0.00 0.00 72.50 66.68 1ia8 s THR 14 CO -0.06 0.17 0.70 -0.07 -2.21 0.00 0.00 174.62 173.16 1ia8 h LEU 15 N 7.32 0.06 0.00 9.08 -0.00 -0.87 -3.47 115.31 127.42 1ia8 h LEU 15 Ca -0.37 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1ia8 h LEU 15 Cb 1.18 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.82 1ia8 h LEU 15 CO 0.78 1.10 0.00 0.61 -0.00 0.00 0.00 178.44 180.93 1ia8 n GLY 16 N 1.58 1.45 3.25 0.83 0.00 -1.20 -5.00 105.19 106.10 1ia8 n GLY 16 Ca -0.17 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1ia8 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ia8 s GLU 17 N -0.64 2.84 1.05 1.61 2.02 -1.26 -0.72 118.70 123.60 1ia8 s GLU 17 Ca 0.00 -1.95 -0.15 0.00 0.02 0.00 0.00 54.97 52.89 1ia8 s GLU 17 Cb 0.00 -4.11 0.21 0.00 0.10 0.00 0.00 34.13 30.33 1ia8 s GLU 17 CO 0.00 -1.25 1.12 0.20 0.02 0.00 0.00 175.26 175.35 1ia8 s GLY 18 N 2.66 1.58 0.00 -1.39 0.00 -0.96 -4.89 107.32 104.32 1ia8 s GLY 18 Ca 0.08 -0.62 0.19 0.00 0.00 0.00 0.00 44.72 44.37 1ia8 s GLY 18 CO -0.01 0.08 1.55 0.00 0.00 0.00 0.00 173.10 174.71 1ia8 n ALA 19 N -4.27 2.26 -2.84 3.20 0.00 -1.26 -3.32 120.51 114.27 1ia8 n ALA 19 Ca 0.08 -0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.28 1ia8 n ALA 19 Cb 0.58 -1.31 0.01 0.00 0.00 0.00 0.00 19.45 18.73 1ia8 n ALA 19 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1ia8 n TYR 20 N -0.96 0.73 0.00 0.00 0.18 -1.26 -5.11 117.16 110.73 1ia8 n TYR 20 Ca 0.14 -3.12 0.00 0.00 1.88 0.00 0.00 57.90 56.80 1ia8 n TYR 20 Cb 0.07 -0.35 0.00 0.00 -0.38 0.00 0.00 39.34 38.68 1ia8 n TYR 20 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1ia8 n GLY 21 N 0.05 0.35 3.44 -7.48 0.00 -1.21 -4.72 105.19 95.62 1ia8 n GLY 21 Ca 0.14 -2.10 -0.11 0.00 0.00 0.00 0.00 46.02 43.96 1ia8 n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ia8 s GLU 22 N -0.08 1.27 -0.13 1.61 -1.05 -0.71 -2.27 118.70 117.33 1ia8 s GLU 22 Ca 0.00 -0.67 0.03 0.00 -0.15 0.00 0.00 54.97 54.17 1ia8 s GLU 22 Cb 0.00 0.54 0.01 0.00 -0.44 0.00 0.00 34.13 34.23 1ia8 s GLU 22 CO 0.00 -0.54 -0.22 0.08 0.95 0.00 0.00 175.26 175.54 1ia8 s VAL 23 N -3.81 2.03 0.04 1.83 1.01 0.10 -0.36 120.40 121.24 1ia8 s VAL 23 Ca 0.04 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.13 1ia8 s VAL 23 Cb -0.00 -1.79 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1ia8 s VAL 23 CO -0.09 0.55 -0.17 -1.10 0.00 0.00 0.00 175.10 174.28 1ia8 s GLN 24 N 0.77 2.08 -0.28 2.72 -1.52 0.00 -0.13 119.66 123.29 1ia8 s GLN 24 Ca -0.08 -0.98 -0.24 0.00 -1.95 0.00 0.00 55.36 52.10 1ia8 s GLN 24 Cb -0.16 -2.20 -0.00 0.00 -0.22 0.00 0.00 33.01 30.43 1ia8 s GLN 24 CO -0.01 0.54 0.82 -1.17 -0.25 0.00 0.00 175.29 175.23 1ia8 s LEU 25 N -1.48 4.07 -0.14 2.90 1.98 0.16 -0.32 118.68 125.85 1ia8 s LEU 25 Ca 0.15 0.83 -0.04 0.00 -2.89 0.00 0.00 54.13 52.19 1ia8 s LEU 25 Cb -0.11 -3.15 -0.03 0.00 0.66 0.00 0.00 46.19 43.56 1ia8 s LEU 25 CO 0.06 -0.59 -0.01 0.00 -1.89 0.00 0.00 176.35 173.91 1ia8 s ALA 26 N 2.96 3.14 -0.12 5.97 0.00 0.75 -1.15 121.76 133.30 1ia8 s ALA 26 Ca 0.34 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1ia8 s ALA 26 Cb -0.14 -1.57 -0.00 0.00 0.00 0.00 0.00 23.12 21.40 1ia8 s ALA 26 CO 0.11 0.33 -0.19 0.08 0.00 0.00 0.00 175.76 176.08 1ia8 s VAL 27 N -0.02 2.41 0.17 0.00 1.01 0.19 -0.86 120.40 123.30 1ia8 s VAL 27 Ca 0.02 -0.88 -0.31 0.00 0.00 0.00 0.00 61.98 60.81 1ia8 s VAL 27 Cb -0.13 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 1ia8 s VAL 27 CO 0.02 0.54 1.44 0.21 0.00 0.00 0.00 175.10 177.32 1ia8 s ASN 28 N 0.50 6.72 0.40 3.32 3.84 0.02 -0.46 114.94 129.27 1ia8 s ASN 28 Ca -0.13 2.50 0.10 0.00 0.21 0.00 0.00 52.86 55.54 1ia8 s ASN 28 Cb -0.17 -2.60 0.90 0.00 -0.55 0.00 0.00 41.25 38.83 1ia8 s ASN 28 CO 0.05 -0.70 1.97 -0.09 -2.79 0.00 0.00 177.10 175.54 1ia8 h ARG 29 N 6.22 0.55 0.00 0.43 2.43 -1.13 -0.19 114.38 122.69 1ia8 h ARG 29 Ca -0.43 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 58.45 1ia8 h ARG 29 Cb 1.21 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.60 1ia8 h ARG 29 CO 0.85 0.36 -1.69 0.28 -1.51 0.00 0.00 179.97 178.26 1ia8 n VAL 30 N -4.48 1.51 0.15 0.20 0.31 -1.26 -4.66 118.33 110.09 1ia8 n VAL 30 Ca 0.10 -0.12 0.10 0.00 -0.01 0.00 0.00 64.34 64.42 1ia8 n VAL 30 Cb 0.31 -2.09 0.06 0.00 -0.91 0.00 0.00 33.84 31.21 1ia8 n VAL 30 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1ia8 h THR 31 N -1.00 0.12 -0.24 2.52 1.35 -1.93 -3.47 112.91 110.26 1ia8 h THR 31 Ca -0.38 -1.20 -0.10 0.00 -0.55 0.00 0.00 66.41 64.18 1ia8 h THR 31 Cb 1.28 1.83 -0.04 0.00 -1.73 0.00 0.00 68.15 69.48 1ia8 h THR 31 CO -0.23 0.07 -0.09 -0.62 -0.25 0.00 0.00 175.52 174.40 1ia8 n GLU 32 N -2.91 -0.80 -1.95 4.72 1.02 -0.08 -4.95 120.64 115.68 1ia8 n GLU 32 Ca 0.01 0.55 -0.41 0.00 -0.02 0.00 0.00 57.16 57.29 1ia8 n GLU 32 Cb 0.58 -4.35 -0.01 0.00 -0.02 0.00 0.00 31.44 27.64 1ia8 n GLU 32 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ia8 s GLU 33 N -1.91 4.23 -0.14 3.49 2.12 -1.26 -4.50 118.70 120.73 1ia8 s GLU 33 Ca 0.00 2.40 -0.04 0.00 0.36 0.00 0.00 54.97 57.69 1ia8 s GLU 33 Cb 0.00 -3.02 -0.03 0.00 0.26 0.00 0.00 34.13 31.34 1ia8 s GLU 33 CO 0.00 -0.37 -0.00 0.00 -0.54 0.00 0.00 175.26 174.34 1ia8 s ALA 34 N -1.06 3.18 0.12 6.30 0.00 -1.26 -0.80 121.76 128.24 1ia8 s ALA 34 Ca 0.51 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.65 1ia8 s ALA 34 Cb -0.43 -1.63 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 1ia8 s ALA 34 CO 0.57 0.30 0.08 0.14 0.00 0.00 0.00 175.76 176.86 1ia8 s VAL 35 N 0.04 0.12 -0.17 0.00 -7.23 -0.04 -4.44 120.40 108.69 1ia8 s VAL 35 Ca 0.02 -1.75 -0.08 0.00 -1.81 0.00 0.00 61.98 58.36 1ia8 s VAL 35 Cb -0.13 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.92 1ia8 s VAL 35 CO 0.02 -0.57 0.11 0.00 -0.31 0.00 0.00 175.10 174.35 1ia8 s ALA 36 N -3.99 3.64 -0.23 1.32 0.00 0.54 -0.17 121.76 122.86 1ia8 s ALA 36 Ca 0.18 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.43 1ia8 s ALA 36 Cb 0.07 -2.01 0.03 0.00 0.00 0.00 0.00 23.12 21.20 1ia8 s ALA 36 CO -0.02 0.31 -0.09 0.08 0.00 0.00 0.00 175.76 176.04 1ia8 s VAL 37 N -0.08 2.68 -0.28 0.00 1.01 0.57 0.41 120.40 124.70 1ia8 s VAL 37 Ca 0.09 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 1ia8 s VAL 37 Cb -0.12 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1ia8 s VAL 37 CO 0.00 0.26 0.61 -0.75 0.00 0.00 0.00 175.10 175.23 1ia8 s LYS 38 N 1.31 4.01 -0.25 2.72 2.20 0.03 -0.82 119.74 128.94 1ia8 s LYS 38 Ca 0.01 0.40 -0.07 0.00 -0.36 0.00 0.00 55.97 55.94 1ia8 s LYS 38 Cb -0.16 -3.69 -0.03 0.00 -1.51 0.00 0.00 37.83 32.45 1ia8 s LYS 38 CO -0.06 -0.47 0.07 0.42 -0.36 0.00 0.00 175.35 174.95 1ia8 s ILE 39 N 2.52 4.29 -0.10 5.43 1.01 0.51 -1.58 121.20 133.27 1ia8 s ILE 39 Ca 0.25 -0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.71 1ia8 s ILE 39 Cb -0.15 -3.02 0.02 0.00 0.01 0.00 0.00 42.46 39.32 1ia8 s ILE 39 CO 0.10 0.33 -0.11 0.68 0.00 0.00 0.00 174.94 175.94 1ia8 s VAL 40 N 1.61 1.20 -0.70 2.92 -7.23 -1.01 -1.73 120.40 115.46 1ia8 s VAL 40 Ca 0.06 -0.45 -0.25 0.00 -1.81 0.00 0.00 61.98 59.53 1ia8 s VAL 40 Cb -0.15 -1.14 0.05 0.00 0.56 0.00 0.00 36.38 35.69 1ia8 s VAL 40 CO 0.04 0.39 1.14 -0.62 -0.31 0.00 0.00 175.10 175.73 1ia8 s ASP 41 N 1.23 6.18 0.60 4.85 -1.08 -1.26 -2.00 116.67 125.17 1ia8 s ASP 41 Ca -0.03 -0.65 0.26 0.00 -0.52 0.00 0.00 52.55 51.60 1ia8 s ASP 41 Cb -0.14 -2.50 1.42 0.00 -1.46 0.00 0.00 42.92 40.24 1ia8 s ASP 41 CO -0.04 -1.66 1.78 0.24 0.52 0.00 0.00 175.17 176.01 1ia8 h MET 42 N 9.82 0.00 0.00 4.34 2.86 -1.75 0.35 114.93 130.55 1ia8 h MET 42 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1ia8 h MET 42 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 1ia8 h MET 42 CO 1.23 0.00 -1.17 1.63 1.06 0.00 0.00 176.91 179.67 1ia8 n LYS 43 N -2.71 0.56 0.09 1.72 4.01 -1.26 -3.65 118.16 116.91 1ia8 n LYS 43 Ca -0.02 0.05 -0.08 0.00 -0.51 0.00 0.00 58.31 57.75 1ia8 n LYS 43 Cb 0.37 -1.73 -0.04 0.00 -0.51 0.00 0.00 35.03 33.12 1ia8 n LYS 43 CO 0.00 0.00 0.00 0.07 -1.11 0.00 0.00 177.40 176.36 1ia8 h ARG 44 N 0.00 0.13 -3.41 1.97 -0.00 -0.68 -3.53 114.38 108.85 1ia8 h ARG 44 Ca 0.00 -0.16 -0.34 0.00 -0.00 0.00 0.00 59.98 59.49 1ia8 h ARG 44 Cb 0.95 0.05 -0.37 0.00 -0.00 0.00 0.00 29.97 30.60 1ia8 h ARG 44 CO 0.00 0.96 -0.74 0.00 -0.00 0.00 0.00 179.97 180.19 1ia8 h PRO 49 N 7.89 0.33 0.24 0.00 0.11 -1.97 -2.11 132.00 136.51 1ia8 h PRO 49 Ca -0.28 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 1ia8 h PRO 49 Cb 1.12 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1ia8 h PRO 49 CO 0.31 0.22 -0.12 1.49 -0.21 0.00 0.00 178.00 179.69 1ia8 h GLU 50 N 0.34 -0.31 -0.45 1.05 4.81 -1.98 -2.23 114.58 115.80 1ia8 h GLU 50 Ca 0.14 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.48 1ia8 h GLU 50 Cb 0.06 0.07 -0.10 0.00 0.63 0.00 0.00 28.75 29.41 1ia8 h GLU 50 CO -0.10 0.05 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.03 1ia8 h ASN 51 N -0.84 -0.99 -0.72 1.04 4.21 -1.98 0.13 115.58 116.42 1ia8 h ASN 51 Ca -0.03 0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.64 1ia8 h ASN 51 Cb 0.51 0.49 -0.03 0.00 -1.12 0.00 0.00 38.32 38.17 1ia8 h ASN 51 CO 0.05 -0.30 0.35 -0.29 -1.29 0.00 0.00 177.43 175.96 1ia8 h ILE 52 N -0.20 1.23 -0.59 2.81 -0.00 -1.48 -1.85 117.51 117.44 1ia8 h ILE 52 Ca 0.20 -0.67 -0.02 0.00 -0.00 0.00 0.00 64.86 64.37 1ia8 h ILE 52 Cb 0.52 0.30 -0.03 0.00 -0.00 0.00 0.00 36.82 37.61 1ia8 h ILE 52 CO -0.57 0.28 0.26 0.11 -0.00 0.00 0.00 178.15 178.24 1ia8 h LYS 53 N 1.05 0.84 -0.18 2.19 6.56 -0.27 -1.21 116.57 125.55 1ia8 h LYS 53 Ca 0.25 -0.11 -0.19 0.00 -1.06 0.00 0.00 60.65 59.54 1ia8 h LYS 53 Cb 0.11 -0.16 0.00 0.00 -0.57 0.00 0.00 32.23 31.62 1ia8 h LYS 53 CO -0.03 0.66 -0.66 -0.22 -2.06 0.00 0.00 179.45 177.14 1ia8 h LYS 54 N 0.83 0.68 -0.85 3.15 3.64 -0.35 -1.75 116.57 121.93 1ia8 h LYS 54 Ca 0.20 -0.49 -0.03 0.00 -1.27 0.00 0.00 60.65 59.06 1ia8 h LYS 54 Cb 0.12 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.98 1ia8 h LYS 54 CO -0.02 1.11 0.42 1.49 -2.27 0.00 0.00 179.45 180.18 1ia8 h GLU 55 N 0.50 1.20 -0.28 1.90 4.81 -0.85 0.19 114.58 122.05 1ia8 h GLU 55 Ca -0.02 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 58.97 1ia8 h GLU 55 Cb 1.25 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1ia8 h GLU 55 CO 0.13 0.91 -0.12 0.82 -0.73 0.00 0.00 179.01 180.03 1ia8 h ILE 56 N 1.20 1.29 0.06 2.32 2.04 -1.16 -1.04 117.51 122.22 1ia8 h ILE 56 Ca 0.29 -1.19 0.02 0.00 1.00 0.00 0.00 64.86 64.98 1ia8 h ILE 56 Cb 0.09 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1ia8 h ILE 56 CO -0.04 0.38 -0.19 0.00 0.00 0.00 0.00 178.15 178.30 1ia8 h ILE 58 N -0.34 1.18 -0.55 0.00 2.04 -0.95 -2.30 117.51 116.59 1ia8 h ILE 58 Ca 0.04 -0.35 0.03 0.00 1.00 0.00 0.00 64.86 65.58 1ia8 h ILE 58 Cb 0.38 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1ia8 h ILE 58 CO -0.13 0.18 0.37 0.78 0.00 0.00 0.00 178.15 179.35 1ia8 h ASN 59 N 1.01 0.57 0.47 1.72 2.35 -0.62 -1.18 115.58 119.90 1ia8 h ASN 59 Ca 0.28 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1ia8 h ASN 59 Cb -0.10 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.13 1ia8 h ASN 59 CO -0.07 0.40 0.00 0.11 -1.65 0.00 0.00 177.43 176.22 1ia8 h LYS 60 N 0.67 0.00 0.00 0.81 1.57 -0.58 -1.91 116.57 117.13 1ia8 h LYS 60 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1ia8 h LYS 60 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ia8 h LYS 60 CO -0.06 0.00 -0.81 -1.33 -0.57 0.00 0.00 179.45 176.68 1ia8 n MET 61 N -2.38 0.38 -2.89 3.15 2.81 -0.45 -4.94 117.12 112.80 1ia8 n MET 61 Ca 0.00 0.08 -0.41 0.00 -1.81 0.00 0.00 57.70 55.56 1ia8 n MET 61 Cb 0.16 -1.71 -0.04 0.00 -0.71 0.00 0.00 33.22 30.93 1ia8 n MET 61 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1ia8 s LEU 62 N -4.48 4.31 -0.45 4.03 1.43 -0.72 -5.00 118.68 117.79 1ia8 s LEU 62 Ca 0.04 1.36 0.07 0.00 -1.03 0.00 0.00 54.13 54.57 1ia8 s LEU 62 Cb 0.12 -3.29 0.18 0.00 0.03 0.00 0.00 46.19 43.23 1ia8 s LEU 62 CO 0.76 -0.22 0.63 0.21 0.23 0.00 0.00 176.35 177.95 1ia8 s ASN 63 N 0.94 -1.05 -0.09 2.29 2.47 -1.26 -4.68 114.94 113.56 1ia8 s ASN 63 Ca 0.43 -1.36 -0.17 0.00 0.42 0.00 0.00 52.86 52.18 1ia8 s ASN 63 Cb -0.19 1.66 0.04 0.00 -1.45 0.00 0.00 41.25 41.31 1ia8 s ASN 63 CO 0.20 -0.13 0.41 -2.28 -3.72 0.00 0.00 177.10 171.58 1ia8 s HIS 64 N 1.33 -0.38 0.09 0.43 2.46 -1.26 -5.05 115.29 112.91 1ia8 s HIS 64 Ca 0.22 0.78 0.31 0.00 0.47 0.00 0.00 55.06 56.85 1ia8 s HIS 64 Cb -0.03 0.17 1.60 0.00 -0.13 0.00 0.00 32.58 34.18 1ia8 s HIS 64 CO -0.06 -0.34 1.94 1.05 -2.47 0.00 0.00 174.74 174.86 1ia8 h GLU 65 N 4.50 0.00 -0.33 2.88 9.09 -1.98 -2.18 114.58 126.55 1ia8 h GLU 65 Ca -0.28 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.01 1ia8 h GLU 65 Cb 1.17 0.00 -0.07 0.00 -1.65 0.00 0.00 28.75 28.20 1ia8 h GLU 65 CO 0.32 0.00 -0.01 0.09 0.05 0.00 0.00 179.01 179.46 1ia8 n ASN 66 N -2.62 3.08 -3.88 3.06 4.13 -1.26 -4.81 115.26 112.96 1ia8 n ASN 66 Ca -0.01 -3.45 -0.20 0.00 1.68 0.00 0.00 54.58 52.60 1ia8 n ASN 66 Cb 0.10 -0.60 -0.16 0.00 -1.54 0.00 0.00 39.78 37.57 1ia8 n ASN 66 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1ia8 s VAL 67 N -3.08 0.47 -0.07 2.41 1.01 -0.82 -0.69 120.40 119.63 1ia8 s VAL 67 Ca 0.44 -0.08 -0.37 0.00 0.00 0.00 0.00 61.98 61.97 1ia8 s VAL 67 Cb 0.38 -0.51 -0.15 0.00 0.00 0.00 0.00 36.38 36.10 1ia8 s VAL 67 CO 0.04 0.21 1.66 0.52 0.00 0.00 0.00 175.10 177.53 1ia8 n VAL 68 N 4.09 0.25 -2.27 2.92 0.31 -0.38 -4.58 118.33 118.68 1ia8 n VAL 68 Ca -0.25 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 63.65 1ia8 n VAL 68 Cb 0.51 -1.36 -0.02 0.00 -0.91 0.00 0.00 33.84 32.06 1ia8 n VAL 68 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ia8 s LYS 69 N 2.51 4.05 -0.25 5.55 3.01 -1.26 -4.83 119.74 128.52 1ia8 s LYS 69 Ca 0.90 1.88 -0.06 0.00 -1.01 0.00 0.00 55.97 57.68 1ia8 s LYS 69 Cb -0.87 -2.69 -0.01 0.00 -1.01 0.00 0.00 37.83 33.24 1ia8 s LYS 69 CO 0.53 -0.33 0.03 0.12 0.51 0.00 0.00 175.35 176.20 1ia8 s PHE 70 N -1.39 3.05 -0.15 3.18 5.36 -1.26 -0.82 117.98 125.95 1ia8 s PHE 70 Ca 0.57 -0.73 0.20 0.00 -0.96 0.00 0.00 56.93 56.01 1ia8 s PHE 70 Cb -0.32 -2.19 -0.14 0.00 -0.34 0.00 0.00 43.02 40.03 1ia8 s PHE 70 CO 0.40 -0.47 0.77 0.66 -1.46 0.00 0.00 175.22 175.11 1ia8 n TYR 71 N 4.87 0.68 -0.18 10.12 4.01 0.12 -5.00 117.16 131.78 1ia8 n TYR 71 Ca -0.17 0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1ia8 n TYR 71 Cb 0.50 -0.90 0.00 0.00 -0.31 0.00 0.00 39.34 38.63 1ia8 n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ia8 n GLY 72 N 1.31 0.12 3.14 2.72 0.00 -1.21 -4.97 105.19 106.31 1ia8 n GLY 72 Ca -0.07 -1.79 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 1ia8 n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ia8 s HIS 73 N -1.43 0.25 -0.09 1.61 -3.43 -1.26 -0.56 115.29 110.38 1ia8 s HIS 73 Ca 0.00 -0.64 0.03 0.00 -0.80 0.00 0.00 55.06 53.64 1ia8 s HIS 73 Cb 0.00 -0.17 0.01 0.00 -1.43 0.00 0.00 32.58 30.99 1ia8 s HIS 73 CO 0.00 -0.43 -0.18 1.03 -2.00 0.00 0.00 174.74 173.16 1ia8 s ARG 74 N -3.30 2.36 0.00 -0.38 0.52 -0.20 -4.97 118.95 112.99 1ia8 s ARG 74 Ca 0.01 -0.63 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 1ia8 s ARG 74 Cb 0.03 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.62 1ia8 s ARG 74 CO -0.08 0.07 0.47 0.54 0.02 0.00 0.00 175.30 176.32 1ia8 n ARG 75 N 3.78 0.00 -3.19 3.54 5.12 -1.26 -2.14 116.66 122.51 1ia8 n ARG 75 Ca -0.21 0.13 -0.15 0.00 -1.93 0.00 0.00 57.85 55.70 1ia8 n ARG 75 Cb 0.52 -0.97 0.07 0.00 -1.16 0.00 0.00 32.46 30.92 1ia8 n ARG 75 CO 0.00 0.00 0.00 -1.91 -1.93 0.00 0.00 177.63 173.79 1ia8 n GLU 76 N -0.60 -3.63 0.00 5.56 4.07 -1.26 -3.95 120.64 120.83 1ia8 n GLU 76 Ca 0.00 0.79 0.00 0.00 -0.06 0.00 0.00 57.16 57.89 1ia8 n GLU 76 Cb 0.00 -5.54 0.00 0.00 -0.06 0.00 0.00 31.44 25.84 1ia8 n GLU 76 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ia8 n GLY 77 N -1.20 1.43 0.12 8.31 0.00 -1.26 -2.44 105.19 110.14 1ia8 n GLY 77 Ca -0.14 0.12 0.05 0.00 0.00 0.00 0.00 46.02 46.05 1ia8 n GLY 77 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ia8 n ASN 78 N 10.55 0.87 -4.48 1.61 4.13 -1.26 -4.92 115.26 121.76 1ia8 n ASN 78 Ca 0.00 -0.94 -0.43 0.00 1.68 0.00 0.00 54.58 54.90 1ia8 n ASN 78 Cb 0.00 0.77 -0.09 0.00 -1.54 0.00 0.00 39.78 38.92 1ia8 n ASN 78 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ia8 s ILE 79 N -1.81 5.13 0.11 2.41 -1.09 -1.02 -1.97 121.20 122.96 1ia8 s ILE 79 Ca 0.07 -0.40 -0.27 0.00 -2.23 0.00 0.00 60.65 57.82 1ia8 s ILE 79 Cb 0.09 -4.00 -0.07 0.00 -1.58 0.00 0.00 42.46 36.90 1ia8 s ILE 79 CO 0.39 -0.38 0.83 -1.10 -1.23 0.00 0.00 174.94 173.45 1ia8 s GLN 80 N 2.02 4.59 -0.29 2.79 -1.52 -0.85 -4.25 119.66 122.15 1ia8 s GLN 80 Ca 0.10 1.22 0.03 0.00 -1.95 0.00 0.00 55.36 54.76 1ia8 s GLN 80 Cb -0.17 -3.33 0.07 0.00 -0.22 0.00 0.00 33.01 29.36 1ia8 s GLN 80 CO 0.13 0.36 -0.04 0.71 -0.25 0.00 0.00 175.29 176.20 1ia8 s TYR 81 N -0.43 3.45 -0.29 0.91 2.02 -0.91 -2.39 117.35 119.70 1ia8 s TYR 81 Ca 0.40 -2.54 -0.12 0.00 -0.37 0.00 0.00 57.07 54.44 1ia8 s TYR 81 Cb -0.22 -2.32 -0.04 0.00 -0.40 0.00 0.00 41.96 38.98 1ia8 s TYR 81 CO 0.26 -0.90 0.22 -0.51 -1.57 0.00 0.00 175.55 173.05 1ia8 s LEU 82 N 1.04 4.13 -0.43 -1.29 1.43 -0.62 -1.03 118.68 121.91 1ia8 s LEU 82 Ca -0.01 -0.07 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 1ia8 s LEU 82 Cb -0.20 -2.15 0.02 0.00 0.03 0.00 0.00 46.19 43.89 1ia8 s LEU 82 CO -0.06 -0.10 0.68 -0.36 0.23 0.00 0.00 176.35 176.74 1ia8 s PHE 83 N 1.78 3.06 0.30 0.29 0.40 0.28 -0.79 117.98 123.30 1ia8 s PHE 83 Ca 0.08 0.06 0.11 0.00 -0.60 0.00 0.00 56.93 56.57 1ia8 s PHE 83 Cb -0.16 -3.41 -0.05 0.00 0.51 0.00 0.00 43.02 39.90 1ia8 s PHE 83 CO 0.11 -0.87 -0.14 -0.51 0.70 0.00 0.00 175.22 174.50 1ia8 s LEU 84 N 2.94 2.70 0.23 -0.37 1.43 0.16 0.16 118.68 125.93 1ia8 s LEU 84 Ca 0.25 -1.05 -0.31 0.00 -1.03 0.00 0.00 54.13 51.99 1ia8 s LEU 84 Cb -0.14 -1.13 -0.11 0.00 0.03 0.00 0.00 46.19 44.84 1ia8 s LEU 84 CO 0.19 -0.05 1.64 -0.70 0.23 0.00 0.00 176.35 177.67 1ia8 s GLU 85 N -3.56 4.14 -0.09 1.70 2.12 -0.00 -0.34 118.70 122.67 1ia8 s GLU 85 Ca 0.31 2.55 -0.24 0.00 0.36 0.00 0.00 54.97 57.96 1ia8 s GLU 85 Cb -0.03 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.26 1ia8 s GLU 85 CO 0.16 -0.68 0.72 -0.47 -0.54 0.00 0.00 175.26 174.46 1ia8 s TYR 86 N 0.71 3.53 -0.55 5.30 5.04 -1.26 -4.47 117.35 125.66 1ia8 s TYR 86 Ca 0.69 1.23 -0.02 0.00 -2.44 0.00 0.00 57.07 56.54 1ia8 s TYR 86 Cb -0.48 -2.85 0.14 0.00 0.35 0.00 0.00 41.96 39.12 1ia8 s TYR 86 CO 0.38 0.00 0.34 0.00 -1.34 0.00 0.00 175.55 174.94 1ia8 n SER 88 N 3.72 0.30 -0.01 0.00 3.41 -1.22 -2.11 113.62 117.72 1ia8 n SER 88 Ca 0.05 0.62 0.14 0.00 -0.26 0.00 0.00 58.87 59.42 1ia8 n SER 88 Cb 0.38 -0.67 0.56 0.00 -0.26 0.00 0.00 64.21 64.23 1ia8 n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ia8 n GLY 89 N -0.98 -1.41 6.44 5.00 0.00 0.17 -4.90 105.19 109.50 1ia8 n GLY 89 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1ia8 n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ia8 n GLY 90 N 1.47 -0.94 3.88 -0.02 0.00 -0.90 -4.67 105.19 104.02 1ia8 n GLY 90 Ca 0.08 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 1ia8 n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ia8 s GLU 91 N 0.00 3.75 0.40 1.61 2.02 -1.26 -0.25 118.70 124.97 1ia8 s GLU 91 Ca 0.00 0.17 0.12 0.00 0.02 0.00 0.00 54.97 55.28 1ia8 s GLU 91 Cb 0.00 -2.70 0.85 0.00 0.10 0.00 0.00 34.13 32.38 1ia8 s GLU 91 CO 0.00 0.35 1.92 1.25 0.02 0.00 0.00 175.26 178.80 1ia8 h LEU 92 N 2.59 0.09 -0.99 1.80 5.85 -0.60 -2.19 115.31 121.86 1ia8 h LEU 92 Ca -0.47 -0.02 0.15 0.00 0.84 0.00 0.00 57.88 58.39 1ia8 h LEU 92 Cb 1.17 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.08 1ia8 h LEU 92 CO 0.70 0.31 0.60 0.15 -0.34 0.00 0.00 178.44 179.86 1ia8 h PHE 93 N 0.09 1.07 0.00 1.25 3.04 -1.74 0.69 116.94 121.33 1ia8 h PHE 93 Ca 0.02 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.00 1ia8 h PHE 93 Cb 0.43 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 38.61 1ia8 h PHE 93 CO 0.00 0.33 0.00 -0.25 -2.02 0.00 0.00 178.31 176.37 1ia8 n ASP 94 N -4.71 0.00 -0.70 0.41 10.43 -0.82 -2.44 116.55 118.71 1ia8 n ASP 94 Ca 0.21 -0.73 0.11 0.00 2.57 0.00 0.00 54.79 56.94 1ia8 n ASP 94 Cb 0.46 -0.04 0.05 0.00 1.84 0.00 0.00 41.12 43.43 1ia8 n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1ia8 n ARG 95 N -1.04 1.75 -3.52 -1.24 5.12 0.23 -4.87 116.66 113.09 1ia8 n ARG 95 Ca 0.19 -1.45 -0.39 0.00 -1.93 0.00 0.00 57.85 54.27 1ia8 n ARG 95 Cb 0.11 -1.42 -0.10 0.00 -1.16 0.00 0.00 32.46 29.89 1ia8 n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1ia8 s ILE 96 N -2.01 5.27 -0.17 0.55 1.01 -1.02 -4.71 121.20 120.12 1ia8 s ILE 96 Ca 0.22 0.02 -0.26 0.00 0.00 0.00 0.00 60.65 60.63 1ia8 s ILE 96 Cb 0.17 -3.66 -0.01 0.00 0.01 0.00 0.00 42.46 38.97 1ia8 s ILE 96 CO 0.37 0.08 0.88 -1.61 0.00 0.00 0.00 174.94 174.67 1ia8 s GLU 97 N 1.81 4.31 0.08 2.79 8.01 -0.22 -4.89 118.70 130.59 1ia8 s GLU 97 Ca 0.08 1.11 -0.37 0.00 0.01 0.00 0.00 54.97 55.80 1ia8 s GLU 97 Cb -0.17 -3.58 -0.17 0.00 -4.31 0.00 0.00 34.13 25.90 1ia8 s GLU 97 CO 0.11 -0.37 1.29 -2.30 0.01 0.00 0.00 175.26 174.01 1ia8 n PRO 98 N 5.34 1.02 -0.72 0.39 -0.02 -1.26 -0.63 135.00 139.12 1ia8 n PRO 98 Ca 0.06 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1ia8 n PRO 98 Cb 0.48 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1ia8 n PRO 98 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1ia8 n ASP 99 N 2.37 -0.20 0.00 2.55 9.92 0.81 -4.68 116.55 127.31 1ia8 n ASP 99 Ca 0.18 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.44 1ia8 n ASP 99 Cb 0.18 -1.51 0.00 0.00 -0.64 0.00 0.00 41.12 39.16 1ia8 n ASP 99 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 1ia8 n ILE 100 N -2.02 0.00 0.00 0.53 -5.35 -0.37 -4.71 119.36 107.44 1ia8 n ILE 100 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1ia8 n ILE 100 Cb 0.01 -0.30 0.00 0.00 -1.74 0.00 0.00 39.64 37.62 1ia8 n ILE 100 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ia8 n GLY 101 N 2.66 0.97 3.66 3.28 0.00 0.19 -4.04 105.19 111.90 1ia8 n GLY 101 Ca 0.00 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.67 1ia8 n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ia8 s MET 102 N 0.00 1.56 0.24 1.61 0.23 -0.25 -1.06 119.30 121.63 1ia8 s MET 102 Ca 0.00 -0.87 -0.31 0.00 -1.03 0.00 0.00 55.69 53.48 1ia8 s MET 102 Cb 0.00 0.57 -0.13 0.00 -1.53 0.00 0.00 34.83 33.74 1ia8 s MET 102 CO 0.00 -0.69 1.42 -2.30 -2.03 0.00 0.00 175.02 171.42 1ia8 n PRO 103 N -0.41 2.07 -0.34 3.16 -0.02 -1.26 -4.76 135.00 133.44 1ia8 n PRO 103 Ca -0.08 0.74 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 1ia8 n PRO 103 Cb 0.61 -2.40 0.30 0.00 -0.02 0.00 0.00 33.50 31.99 1ia8 n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ia8 h GLU 104 N 4.21 0.69 -0.88 -0.52 4.81 -1.97 -0.90 114.58 120.03 1ia8 h GLU 104 Ca -0.45 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 1ia8 h GLU 104 Cb 1.27 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.46 1ia8 h GLU 104 CO 0.76 0.46 0.51 -1.35 -0.73 0.00 0.00 179.01 178.66 1ia8 h PRO 105 N 0.71 1.20 -0.44 0.92 0.11 -1.89 -0.10 132.00 132.51 1ia8 h PRO 105 Ca 0.55 -0.11 -0.05 0.00 0.11 0.00 0.00 66.00 66.50 1ia8 h PRO 105 Cb 0.86 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.70 1ia8 h PRO 105 CO -0.39 0.85 0.09 -0.44 -0.21 0.00 0.00 178.00 177.89 1ia8 h ASP 106 N 1.21 0.69 -0.81 -2.05 5.19 -1.55 -1.86 116.42 117.24 1ia8 h ASP 106 Ca 0.31 -0.25 -0.04 0.00 -0.62 0.00 0.00 57.03 56.43 1ia8 h ASP 106 Cb -0.03 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 39.26 1ia8 h ASP 106 CO -0.06 0.76 0.34 0.00 -3.12 0.00 0.00 179.24 177.17 1ia8 h ALA 107 N 0.95 1.07 -0.45 3.45 0.00 -0.84 -1.44 119.26 122.00 1ia8 h ALA 107 Ca 0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ia8 h ALA 107 Cb 0.35 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ia8 h ALA 107 CO 0.01 0.67 0.13 0.37 0.00 0.00 0.00 179.25 180.43 1ia8 h GLN 108 N 1.18 0.70 -0.39 0.00 4.15 -0.82 0.30 115.11 120.23 1ia8 h GLN 108 Ca 0.27 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.52 1ia8 h GLN 108 Cb 0.19 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 1ia8 h GLN 108 CO -0.03 0.68 0.18 -0.09 -1.93 0.00 0.00 178.83 177.64 1ia8 h ARG 109 N 0.58 0.57 -0.59 1.69 2.43 -1.12 0.02 114.38 117.98 1ia8 h ARG 109 Ca 0.14 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1ia8 h ARG 109 Cb 0.28 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1ia8 h ARG 109 CO -0.00 0.52 0.14 0.74 -1.51 0.00 0.00 179.97 179.85 1ia8 h PHE 110 N 0.50 0.95 -0.43 2.20 0.04 -1.12 -1.93 116.94 117.14 1ia8 h PHE 110 Ca 0.13 -0.10 -0.10 0.00 2.80 0.00 0.00 57.97 60.71 1ia8 h PHE 110 Cb 0.14 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 1ia8 h PHE 110 CO -0.01 0.79 -0.13 0.35 -0.60 0.00 0.00 178.31 178.71 1ia8 h PHE 111 N 0.87 0.88 -0.40 -0.55 3.57 -0.56 0.27 116.94 121.03 1ia8 h PHE 111 Ca 0.19 -0.17 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1ia8 h PHE 111 Cb 0.32 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 1ia8 h PHE 111 CO 0.02 0.88 0.24 0.45 -2.23 0.00 0.00 178.31 177.67 1ia8 h HIS 112 N 0.72 0.52 -0.19 0.41 3.86 -0.56 -0.54 115.15 119.37 1ia8 h HIS 112 Ca 0.12 -0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.21 1ia8 h HIS 112 Cb 0.62 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 1ia8 h HIS 112 CO 0.03 0.37 -0.37 1.96 0.86 0.00 0.00 177.93 180.78 1ia8 h GLN 113 N 0.52 0.42 -0.30 2.45 4.20 -1.09 -1.49 115.11 119.83 1ia8 h GLN 113 Ca 0.14 -0.20 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 1ia8 h GLN 113 Cb 0.00 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1ia8 h GLN 113 CO -0.03 0.74 0.09 1.25 -0.67 0.00 0.00 178.83 180.21 1ia8 h LEU 114 N 0.36 0.44 -0.87 1.46 5.85 -0.59 -1.52 115.31 120.43 1ia8 h LEU 114 Ca 0.04 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1ia8 h LEU 114 Cb 0.82 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 1ia8 h LEU 114 CO 0.07 0.54 0.55 0.24 -0.34 0.00 0.00 178.44 179.50 1ia8 h MET 115 N 0.32 1.16 -0.70 1.25 2.86 -0.89 0.29 114.93 119.21 1ia8 h MET 115 Ca 0.10 -0.08 0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1ia8 h MET 115 Cb 0.26 -0.25 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1ia8 h MET 115 CO -0.00 0.78 0.46 0.00 1.06 0.00 0.00 176.91 179.22 1ia8 h ALA 116 N 1.30 0.89 -0.35 6.32 0.00 -0.97 0.16 119.26 126.62 1ia8 h ALA 116 Ca 0.31 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 1ia8 h ALA 116 Cb -0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1ia8 h ALA 116 CO -0.06 0.30 -0.09 0.78 0.00 0.00 0.00 179.25 180.17 1ia8 h GLY 117 N 0.94 0.73 1.24 0.00 0.00 -0.67 -2.40 103.07 102.92 1ia8 h GLY 117 Ca 0.26 -0.61 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 1ia8 h GLY 117 CO -0.06 0.56 -0.28 -2.08 0.00 0.00 0.00 176.54 174.68 1ia8 h VAL 118 N 0.46 1.27 -0.92 4.60 2.07 -0.66 -1.86 116.25 121.22 1ia8 h VAL 118 Ca 0.09 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.20 1ia8 h VAL 118 Cb 0.60 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 1ia8 h VAL 118 CO 0.04 0.48 0.60 0.58 0.02 0.00 0.00 177.57 179.29 1ia8 h VAL 119 N 0.73 1.20 0.22 2.57 2.07 -0.65 -0.11 116.25 122.28 1ia8 h VAL 119 Ca 0.09 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1ia8 h VAL 119 Cb 0.83 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1ia8 h VAL 119 CO 0.07 0.22 -0.11 0.22 0.02 0.00 0.00 177.57 177.99 1ia8 h TYR 120 N 1.20 -0.27 -0.19 1.57 3.20 -1.20 -0.28 116.97 120.99 1ia8 h TYR 120 Ca 0.35 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.24 1ia8 h TYR 120 Cb -0.08 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1ia8 h TYR 120 CO -0.01 -0.07 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.36 1ia8 h LEU 121 N -0.42 -0.09 -1.51 2.82 3.38 -1.03 -1.88 115.31 116.57 1ia8 h LEU 121 Ca -0.03 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1ia8 h LEU 121 Cb 0.32 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1ia8 h LEU 121 CO 0.05 -0.02 0.11 0.45 0.09 0.00 0.00 178.44 179.12 1ia8 h HIS 122 N 0.05 0.42 0.00 1.13 3.86 -0.96 -0.87 115.15 118.78 1ia8 h HIS 122 Ca 0.09 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1ia8 h HIS 122 Cb 0.11 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 1ia8 h HIS 122 CO -0.18 0.35 -0.22 0.78 0.86 0.00 0.00 177.93 179.53 1ia8 h GLY 123 N 0.60 0.00 -2.08 2.45 0.00 -0.24 -1.29 103.07 102.50 1ia8 h GLY 123 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1ia8 h GLY 123 CO -0.01 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.04 1ia8 n ILE 124 N -4.15 0.64 -0.99 2.60 0.13 -0.68 -4.95 119.36 111.97 1ia8 n ILE 124 Ca -0.02 -0.73 0.00 0.00 -1.10 0.00 0.00 62.75 60.90 1ia8 n ILE 124 Cb 0.28 0.58 0.00 0.00 -0.84 0.00 0.00 39.64 39.67 1ia8 n ILE 124 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ia8 n GLY 125 N 1.44 0.40 3.47 4.50 0.00 -0.49 -4.91 105.19 109.60 1ia8 n GLY 125 Ca 0.20 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 1ia8 n GLY 125 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ia8 s ILE 126 N -2.00 3.00 -0.07 -0.61 -4.36 -0.42 -0.05 121.20 116.69 1ia8 s ILE 126 Ca 0.00 -0.85 0.03 0.00 -0.26 0.00 0.00 60.65 59.57 1ia8 s ILE 126 Cb 0.00 -2.20 -0.02 0.00 1.25 0.00 0.00 42.46 41.49 1ia8 s ILE 126 CO 0.00 0.52 -0.16 0.28 0.24 0.00 0.00 174.94 175.82 1ia8 s THR 127 N -0.79 2.88 0.06 8.37 -1.32 -0.28 -3.37 115.64 121.19 1ia8 s THR 127 Ca 0.13 -0.77 -0.16 0.00 -1.21 0.00 0.00 61.69 59.68 1ia8 s THR 127 Cb -0.11 -2.14 -0.21 0.00 -1.51 0.00 0.00 72.50 68.53 1ia8 s THR 127 CO 0.02 0.57 1.19 -0.74 -2.21 0.00 0.00 174.62 173.45 1ia8 h HIS 128 N 5.83 0.92 0.00 9.09 2.76 -1.91 -1.94 115.15 129.91 1ia8 h HIS 128 Ca -0.38 -0.47 0.00 0.00 -2.20 0.00 0.00 60.37 57.31 1ia8 h HIS 128 Cb 1.17 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 30.02 1ia8 h HIS 128 CO 0.49 1.30 0.00 0.54 -1.30 0.00 0.00 177.93 178.96 1ia8 n ARG 129 N -3.99 -0.27 -2.71 5.26 1.74 -1.26 -3.05 116.66 112.37 1ia8 n ARG 129 Ca -0.10 0.07 -0.05 0.00 -0.77 0.00 0.00 57.85 57.00 1ia8 n ARG 129 Cb 0.78 -3.72 0.08 0.00 -1.02 0.00 0.00 32.46 28.59 1ia8 n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ia8 n ASP 130 N -0.13 -0.13 -4.70 0.55 4.64 -1.26 -3.83 116.55 111.69 1ia8 n ASP 130 Ca 0.00 -2.37 -0.42 0.00 -1.38 0.00 0.00 54.79 50.62 1ia8 n ASP 130 Cb 0.07 0.19 -0.03 0.00 -1.04 0.00 0.00 41.12 40.31 1ia8 n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1ia8 s ILE 131 N -1.61 3.79 0.03 5.18 1.01 -1.26 -4.81 121.20 123.53 1ia8 s ILE 131 Ca 0.21 1.22 -0.28 0.00 0.00 0.00 0.00 60.65 61.80 1ia8 s ILE 131 Cb 0.41 -3.78 0.09 0.00 0.01 0.00 0.00 42.46 39.19 1ia8 s ILE 131 CO -0.05 0.03 0.91 -1.59 0.00 0.00 0.00 174.94 174.24 1ia8 s LYS 132 N 1.90 0.89 0.49 2.79 -2.85 -1.26 -4.78 119.74 116.92 1ia8 s LYS 132 Ca 0.62 -0.38 0.25 0.00 -1.00 0.00 0.00 55.97 55.46 1ia8 s LYS 132 Cb -0.31 0.38 1.30 0.00 -2.06 0.00 0.00 37.83 37.14 1ia8 s LYS 132 CO 0.27 -0.40 1.89 -1.35 0.10 0.00 0.00 175.35 175.86 1ia8 h PRO 133 N 2.00 0.17 0.00 1.78 0.11 -1.93 0.21 132.00 134.33 1ia8 h PRO 133 Ca -0.23 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.83 1ia8 h PRO 133 Cb 1.24 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1ia8 h PRO 133 CO 0.30 0.11 -0.21 0.93 -0.21 0.00 0.00 178.00 178.91 1ia8 h GLU 134 N 0.17 0.00 -0.52 1.05 3.07 -1.96 -2.79 114.58 113.60 1ia8 h GLU 134 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 1ia8 h GLU 134 Cb 1.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.30 1ia8 h GLU 134 CO -0.08 0.21 0.00 0.09 -1.40 0.00 0.00 179.01 177.84 1ia8 n ASN 135 N -3.53 4.64 -3.99 1.42 3.02 0.05 -4.79 115.26 112.08 1ia8 n ASN 135 Ca -0.01 -2.64 -0.31 0.00 -0.03 0.00 0.00 54.58 51.59 1ia8 n ASN 135 Cb 0.37 -0.56 -0.15 0.00 -0.61 0.00 0.00 39.78 38.83 1ia8 n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ia8 s LEU 136 N -2.19 3.73 0.38 3.41 1.43 -1.08 -0.35 118.68 124.01 1ia8 s LEU 136 Ca 0.47 -1.70 0.03 0.00 -1.03 0.00 0.00 54.13 51.90 1ia8 s LEU 136 Cb 0.33 -1.45 -0.01 0.00 0.03 0.00 0.00 46.19 45.09 1ia8 s LEU 136 CO 0.18 -0.30 0.56 -0.76 0.23 0.00 0.00 176.35 176.27 1ia8 s LEU 137 N 1.12 3.85 -0.03 1.79 1.43 -0.24 -0.41 118.68 126.19 1ia8 s LEU 137 Ca 0.02 0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1ia8 s LEU 137 Cb -0.19 -3.00 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 1ia8 s LEU 137 CO -0.08 -0.52 -0.18 -0.76 0.23 0.00 0.00 176.35 175.03 1ia8 s LEU 138 N -4.35 1.98 0.00 1.79 2.01 0.65 -0.29 118.68 120.46 1ia8 s LEU 138 Ca 0.45 -0.36 0.00 0.00 0.01 0.00 0.00 54.13 54.23 1ia8 s LEU 138 Cb -0.10 -1.00 0.00 0.00 0.01 0.00 0.00 46.19 45.10 1ia8 s LEU 138 CO 0.35 0.19 0.00 -0.90 1.01 0.00 0.00 176.35 177.00 1ia8 n ASP 139 N 2.90 0.00 0.26 2.29 3.85 -0.75 0.42 116.55 125.52 1ia8 n ASP 139 Ca -0.17 -0.92 0.10 0.00 -0.71 0.00 0.00 54.79 53.09 1ia8 n ASP 139 Cb 0.53 0.00 0.69 0.00 -1.35 0.00 0.00 41.12 40.99 1ia8 n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 1ia8 h GLU 140 N 0.00 0.00 -0.55 0.11 9.09 -1.91 -2.00 114.58 119.32 1ia8 h GLU 140 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ia8 h GLU 140 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1ia8 h GLU 140 CO 0.00 0.09 0.00 0.54 0.05 0.00 0.00 179.01 179.69 1ia8 n ARG 141 N -4.08 4.52 -2.36 1.06 1.74 -1.26 -4.93 116.66 111.36 1ia8 n ARG 141 Ca -0.03 -3.09 -0.18 0.00 -0.77 0.00 0.00 57.85 53.79 1ia8 n ARG 141 Cb 0.17 -2.17 -0.01 0.00 -1.02 0.00 0.00 32.46 29.44 1ia8 n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1ia8 n ASP 142 N 0.57 -5.18 -4.74 0.55 8.00 -0.75 -4.99 116.55 110.01 1ia8 n ASP 142 Ca 0.27 -0.03 -0.40 0.00 0.71 0.00 0.00 54.79 55.34 1ia8 n ASP 142 Cb 1.12 -4.25 -0.05 0.00 -0.02 0.00 0.00 41.12 37.92 1ia8 n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ia8 s ASN 143 N -2.23 7.27 0.21 -2.24 0.02 -1.26 -4.76 114.94 111.95 1ia8 s ASN 143 Ca 0.01 1.52 -0.30 0.00 -1.02 0.00 0.00 52.86 53.08 1ia8 s ASN 143 Cb -0.00 -2.49 -0.08 0.00 0.02 0.00 0.00 41.25 38.69 1ia8 s ASN 143 CO 0.01 -0.01 1.01 -0.22 0.02 0.00 0.00 177.10 177.92 1ia8 s LEU 144 N -0.03 4.57 -0.09 0.60 0.20 -1.26 -1.80 118.68 120.87 1ia8 s LEU 144 Ca 0.40 2.01 -0.01 0.00 0.69 0.00 0.00 54.13 57.23 1ia8 s LEU 144 Cb -0.21 -3.61 0.03 0.00 -0.43 0.00 0.00 46.19 41.97 1ia8 s LEU 144 CO 0.24 -0.02 -0.04 -0.54 -0.29 0.00 0.00 176.35 175.71 1ia8 s LYS 145 N -0.84 1.03 0.09 1.98 -0.14 0.60 -4.33 119.74 118.13 1ia8 s LYS 145 Ca 0.45 -0.06 -0.31 0.00 -1.36 0.00 0.00 55.97 54.68 1ia8 s LYS 145 Cb -0.27 -1.25 -0.07 0.00 -1.68 0.00 0.00 37.83 34.56 1ia8 s LYS 145 CO 0.34 -0.28 1.33 0.42 -0.76 0.00 0.00 175.35 176.40 1ia8 s ILE 146 N 1.82 3.57 0.16 2.17 1.01 0.13 -1.08 121.20 128.99 1ia8 s ILE 146 Ca 0.04 1.12 0.09 0.00 0.00 0.00 0.00 60.65 61.90 1ia8 s ILE 146 Cb -0.12 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 1ia8 s ILE 146 CO -0.06 0.08 -0.20 -0.55 0.00 0.00 0.00 174.94 174.21 1ia8 s SER 147 N 1.16 2.79 -0.13 3.58 0.15 0.52 -1.24 113.70 120.54 1ia8 s SER 147 Ca 0.63 -0.84 -0.05 0.00 0.70 0.00 0.00 55.95 56.39 1ia8 s SER 147 Cb -0.34 -0.17 0.02 0.00 -1.71 0.00 0.00 66.02 63.82 1ia8 s SER 147 CO 0.29 0.00 0.10 -0.67 1.20 0.00 0.00 173.24 174.17 1ia8 n ASP 148 N 0.39 -2.31 -1.95 5.45 4.64 -1.26 -4.80 116.55 116.71 1ia8 n ASP 148 Ca -0.14 0.77 -0.12 0.00 -1.38 0.00 0.00 54.79 53.92 1ia8 n ASP 148 Cb 0.56 -3.40 0.25 0.00 -1.04 0.00 0.00 41.12 37.50 1ia8 n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1ia8 n PHE 149 N 0.79 2.47 0.29 -0.67 3.01 -1.26 -4.52 117.46 117.56 1ia8 n PHE 149 Ca -0.17 -1.46 0.16 0.00 1.01 0.00 0.00 57.45 56.99 1ia8 n PHE 149 Cb 0.26 -0.75 0.84 0.00 -0.01 0.00 0.00 39.48 39.82 1ia8 n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1ia8 h GLY 150 N 1.86 0.00 -0.70 1.37 0.00 -1.92 -2.71 103.07 100.97 1ia8 h GLY 150 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1ia8 h GLY 150 CO 0.81 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.39 1ia8 n LEU 151 N -3.36 1.75 -4.77 3.11 4.77 -1.26 -4.90 117.00 112.34 1ia8 n LEU 151 Ca -0.01 -1.04 -0.33 0.00 -0.03 0.00 0.00 56.01 54.60 1ia8 n LEU 151 Cb 0.22 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1ia8 n LEU 151 CO 0.27 0.35 0.74 0.00 -1.33 0.00 0.00 177.39 177.42 1ia8 s ALA 152 N -0.73 2.45 0.15 -1.18 0.00 -1.02 -4.67 121.76 116.77 1ia8 s ALA 152 Ca 0.10 0.56 -0.14 0.00 0.00 0.00 0.00 51.96 52.48 1ia8 s ALA 152 Cb 0.07 -3.32 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1ia8 s ALA 152 CO 0.11 -1.31 0.40 -0.08 0.00 0.00 0.00 175.76 174.88 1ia8 s THR 153 N -2.33 0.06 -0.15 0.00 -1.32 -0.73 -4.97 115.64 106.20 1ia8 s THR 153 Ca 0.67 -0.86 -0.21 0.00 -1.21 0.00 0.00 61.69 60.08 1ia8 s THR 153 Cb -0.21 -1.46 -0.03 0.00 -1.51 0.00 0.00 72.50 69.29 1ia8 s THR 153 CO 0.42 -0.27 0.62 -0.69 -2.21 0.00 0.00 174.62 172.49 1ia8 s VAL 154 N -3.87 5.06 -0.72 5.08 1.01 -1.26 -1.12 120.40 124.58 1ia8 s VAL 154 Ca 0.08 1.21 0.10 0.00 0.00 0.00 0.00 61.98 63.37 1ia8 s VAL 154 Cb 0.01 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1ia8 s VAL 154 CO -0.06 0.19 0.54 2.22 0.00 0.00 0.00 175.10 177.98 1ia8 n PHE 155 N 4.47 0.00 -3.75 5.22 -1.74 0.93 -4.93 117.46 117.66 1ia8 n PHE 155 Ca -0.02 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.68 1ia8 n PHE 155 Cb 0.50 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.33 1ia8 n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 1ia8 s ARG 156 N -1.53 0.10 -0.01 3.97 3.52 -1.16 -0.13 118.95 123.70 1ia8 s ARG 156 Ca 0.06 0.25 -0.00 0.00 -0.13 0.00 0.00 55.73 55.91 1ia8 s ARG 156 Cb 0.08 -0.52 0.02 0.00 -1.56 0.00 0.00 34.95 32.96 1ia8 s ARG 156 CO 0.29 -0.26 0.02 -0.47 -0.81 0.00 0.00 175.30 174.08 1ia8 s TYR 157 N 1.71 0.01 -1.48 5.12 5.04 -0.81 -4.60 117.35 122.33 1ia8 s TYR 157 Ca -0.01 0.08 -0.12 0.00 -2.44 0.00 0.00 57.07 54.59 1ia8 s TYR 157 Cb -0.13 -0.12 0.07 0.00 0.35 0.00 0.00 41.96 42.14 1ia8 s TYR 157 CO -0.03 -0.05 0.84 0.09 -1.34 0.00 0.00 175.55 175.06 1ia8 n ASN 158 N 3.65 -4.82 -0.92 4.32 5.03 -1.26 -1.17 115.26 120.09 1ia8 n ASN 158 Ca -0.20 -0.63 -0.12 0.00 0.87 0.00 0.00 54.58 54.50 1ia8 n ASN 158 Cb 0.55 -3.87 -0.05 0.00 -1.02 0.00 0.00 39.78 35.38 1ia8 n ASN 158 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1ia8 n ASN 159 N -2.68 -5.02 -4.27 6.41 5.15 -1.26 -4.98 115.26 108.60 1ia8 n ASN 159 Ca 0.01 0.30 -0.33 0.00 -0.60 0.00 0.00 54.58 53.96 1ia8 n ASN 159 Cb 0.54 -3.58 -0.15 0.00 -0.53 0.00 0.00 39.78 36.06 1ia8 n ASN 159 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1ia8 s ARG 160 N -2.90 3.23 0.18 1.20 1.81 -0.32 -5.11 118.95 117.05 1ia8 s ARG 160 Ca 0.00 -0.73 -0.27 0.00 -1.72 0.00 0.00 55.73 53.01 1ia8 s ARG 160 Cb 0.00 -2.67 -0.08 0.00 -0.45 0.00 0.00 34.95 31.75 1ia8 s ARG 160 CO 0.00 -0.00 0.83 -2.00 -0.68 0.00 0.00 175.30 173.45 1ia8 s GLU 161 N 0.88 4.66 -0.16 3.54 2.12 -1.26 -1.93 118.70 126.54 1ia8 s GLU 161 Ca -0.04 1.27 -0.03 0.00 0.36 0.00 0.00 54.97 56.53 1ia8 s GLU 161 Cb -0.15 -3.28 -0.02 0.00 0.26 0.00 0.00 34.13 30.94 1ia8 s GLU 161 CO -0.01 0.52 -0.05 0.50 -0.54 0.00 0.00 175.26 175.68 1ia8 s ARG 162 N -1.02 3.58 0.37 4.30 3.52 0.82 -4.99 118.95 125.53 1ia8 s ARG 162 Ca 0.38 -0.56 -0.25 0.00 -0.13 0.00 0.00 55.73 55.17 1ia8 s ARG 162 Cb -0.24 -2.89 -0.09 0.00 -1.56 0.00 0.00 34.95 30.17 1ia8 s ARG 162 CO 0.28 0.17 1.01 -0.51 -0.81 0.00 0.00 175.30 175.44 1ia8 s LEU 163 N 0.53 4.20 0.24 -0.88 1.43 -1.26 -4.73 118.68 118.21 1ia8 s LEU 163 Ca -0.04 1.96 0.05 0.00 -1.03 0.00 0.00 54.13 55.07 1ia8 s LEU 163 Cb -0.15 -4.14 -0.03 0.00 0.03 0.00 0.00 46.19 41.91 1ia8 s LEU 163 CO 0.03 -0.34 0.35 -0.76 0.23 0.00 0.00 176.35 175.87 1ia8 s LEU 164 N -2.45 4.31 0.00 1.79 1.43 -0.42 -4.88 118.68 118.46 1ia8 s LEU 164 Ca 0.55 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1ia8 s LEU 164 Cb -0.20 -2.85 0.00 0.00 0.03 0.00 0.00 46.19 43.17 1ia8 s LEU 164 CO 0.26 -0.06 0.00 -0.46 0.23 0.00 0.00 176.35 176.31 1ia8 n ASN 165 N -1.36 0.00 -4.69 2.29 6.94 -1.26 -1.26 115.26 115.93 1ia8 n ASN 165 Ca -0.09 -0.04 -0.42 0.00 -0.02 0.00 0.00 54.58 54.01 1ia8 n ASN 165 Cb 0.57 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.96 1ia8 n ASN 165 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1ia8 s LYS 166 N 0.00 4.26 -0.35 -3.83 2.20 -1.26 -4.93 119.74 115.83 1ia8 s LYS 166 Ca 0.00 2.03 -0.26 0.00 -0.36 0.00 0.00 55.97 57.39 1ia8 s LYS 166 Cb 0.00 -3.62 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 1ia8 s LYS 166 CO 0.00 -0.63 0.91 -1.64 -0.36 0.00 0.00 175.35 173.63 1ia8 s MET 167 N 2.61 3.88 0.26 4.03 -1.94 -1.26 -4.98 119.30 121.90 1ia8 s MET 167 Ca 0.66 0.62 -0.18 0.00 -1.71 0.00 0.00 55.69 55.08 1ia8 s MET 167 Cb -0.33 -3.78 0.01 0.00 2.01 0.00 0.00 34.83 32.75 1ia8 s MET 167 CO 0.27 -0.89 0.63 0.00 -0.01 0.00 0.00 175.02 175.02 1ia8 n GLY 169 N -0.43 0.23 2.77 0.00 0.00 -1.25 -4.95 105.19 101.56 1ia8 n GLY 169 Ca -0.04 -2.03 -0.23 0.00 0.00 0.00 0.00 46.02 43.72 1ia8 n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ia8 s THR 170 N 0.00 0.38 0.17 2.61 2.01 -1.26 -5.02 115.64 114.53 1ia8 s THR 170 Ca 0.00 0.06 -0.15 0.00 0.31 0.00 0.00 61.69 61.91 1ia8 s THR 170 Cb 0.00 -0.58 0.15 0.00 0.01 0.00 0.00 72.50 72.08 1ia8 s THR 170 CO 0.00 0.21 1.19 0.18 -0.69 0.00 0.00 174.62 175.51 1ia8 n LEU 171 N 5.14 -0.54 0.31 4.42 4.32 -1.26 -0.45 117.00 128.94 1ia8 n LEU 171 Ca -0.07 1.34 0.19 0.00 -0.02 0.00 0.00 56.01 57.45 1ia8 n LEU 171 Cb 0.50 -0.29 1.02 0.00 -1.62 0.00 0.00 43.42 43.03 1ia8 n LEU 171 CO 0.11 -1.19 1.13 -0.65 -1.22 0.00 0.00 177.39 175.56 1ia8 h PRO 172 N 0.00 0.00 -0.00 3.23 0.11 -1.75 -2.65 132.00 130.93 1ia8 h PRO 172 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1ia8 h PRO 172 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1ia8 h PRO 172 CO -0.76 0.02 -0.80 0.66 -0.21 0.00 0.00 178.00 176.91 1ia8 n TYR 173 N -3.40 0.00 -2.69 0.65 4.01 0.40 -4.84 117.16 111.28 1ia8 n TYR 173 Ca -0.03 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.34 1ia8 n TYR 173 Cb 0.11 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.09 1ia8 n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1ia8 s VAL 174 N -2.64 4.00 0.45 -0.72 0.11 -0.61 -3.75 120.40 117.24 1ia8 s VAL 174 Ca 0.07 1.68 -0.23 0.00 -2.93 0.00 0.00 61.98 60.58 1ia8 s VAL 174 Cb 0.14 -3.95 -0.08 0.00 -1.53 0.00 0.00 36.38 30.96 1ia8 s VAL 174 CO 0.71 0.16 1.16 0.00 -3.33 0.00 0.00 175.10 173.80 1ia8 s ALA 175 N -1.55 3.01 0.48 1.54 0.00 -1.26 -4.58 121.76 119.40 1ia8 s ALA 175 Ca 0.51 0.93 0.16 0.00 0.00 0.00 0.00 51.96 53.55 1ia8 s ALA 175 Cb -0.21 -3.38 1.17 0.00 0.00 0.00 0.00 23.12 20.71 1ia8 s ALA 175 CO 0.27 -0.61 2.06 -1.00 0.00 0.00 0.00 175.76 176.48 1ia8 h PRO 176 N 2.16 0.18 0.00 0.00 0.13 -1.88 -2.25 132.00 130.35 1ia8 h PRO 176 Ca -0.49 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 1ia8 h PRO 176 Cb 1.24 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1ia8 h PRO 176 CO 0.61 0.12 -0.19 1.05 -0.23 0.00 0.00 178.00 179.36 1ia8 h GLU 177 N 0.19 0.00 0.00 0.86 9.09 -1.92 -1.34 114.58 121.46 1ia8 h GLU 177 Ca 0.15 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.53 1ia8 h GLU 177 Cb 0.35 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.44 1ia8 h GLU 177 CO -0.02 0.19 -0.15 1.25 0.05 0.00 0.00 179.01 180.32 1ia8 h LEU 178 N 0.00 0.00 -0.38 3.06 7.12 -1.69 0.15 115.31 123.57 1ia8 h LEU 178 Ca -0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1ia8 h LEU 178 Cb 0.40 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.53 1ia8 h LEU 178 CO 0.02 0.15 -0.64 0.18 -0.13 0.00 0.00 178.44 178.03 1ia8 n LEU 179 N -3.58 1.23 0.00 2.25 4.77 -0.54 -4.55 117.00 116.58 1ia8 n LEU 179 Ca -0.01 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 1ia8 n LEU 179 Cb 0.29 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1ia8 n LEU 179 CO 0.31 0.26 -0.15 2.29 -1.33 0.00 0.00 177.39 178.77 1ia8 n LYS 180 N -0.91 3.47 -4.61 3.23 2.85 -0.96 -5.07 118.16 116.16 1ia8 n LYS 180 Ca 0.07 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.04 1ia8 n LYS 180 Cb 0.38 -0.56 -0.14 0.00 -0.65 0.00 0.00 35.03 34.06 1ia8 n LYS 180 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1ia8 s ARG 181 N -0.97 1.54 0.12 -1.58 1.81 0.00 -5.04 118.95 114.83 1ia8 s ARG 181 Ca 0.00 -1.21 -0.14 0.00 -1.72 0.00 0.00 55.73 52.66 1ia8 s ARG 181 Cb 0.00 -1.86 -0.04 0.00 -0.45 0.00 0.00 34.95 32.60 1ia8 s ARG 181 CO 0.00 0.46 1.51 -0.09 -0.68 0.00 0.00 175.30 176.50 1ia8 h ARG 182 N 4.33 0.77 -6.13 3.54 2.43 -1.93 -3.44 114.38 113.94 1ia8 h ARG 182 Ca -0.48 -0.32 -0.57 0.00 -0.81 0.00 0.00 59.98 57.80 1ia8 h ARG 182 Cb 1.16 -0.03 -0.17 0.00 -0.42 0.00 0.00 29.97 30.51 1ia8 h ARG 182 CO 0.41 0.93 -0.78 -1.21 -1.51 0.00 0.00 179.97 177.81 1ia8 s GLU 183 N -4.68 1.44 -0.02 0.20 2.02 -1.26 -4.36 118.70 112.04 1ia8 s GLU 183 Ca -0.12 -1.54 -0.29 0.00 0.02 0.00 0.00 54.97 53.04 1ia8 s GLU 183 Cb 0.10 -1.54 0.09 0.00 0.10 0.00 0.00 34.13 32.88 1ia8 s GLU 183 CO 0.82 0.31 0.76 -0.59 0.02 0.00 0.00 175.26 176.58 1ia8 s PHE 184 N -2.16 -0.53 0.30 1.61 -0.12 -0.39 -4.97 117.98 111.72 1ia8 s PHE 184 Ca 0.21 0.72 -0.29 0.00 -0.05 0.00 0.00 56.93 57.52 1ia8 s PHE 184 Cb -0.06 0.47 -0.10 0.00 -0.63 0.00 0.00 43.02 42.71 1ia8 s PHE 184 CO 0.09 -0.60 1.17 -1.01 -0.05 0.00 0.00 175.22 174.83 1ia8 s HIS 185 N -2.01 3.40 0.07 3.49 3.76 -1.26 -1.30 115.29 121.44 1ia8 s HIS 185 Ca -0.04 1.60 -0.18 0.00 -0.15 0.00 0.00 55.06 56.29 1ia8 s HIS 185 Cb -0.00 -3.42 -0.10 0.00 1.11 0.00 0.00 32.58 30.17 1ia8 s HIS 185 CO 0.00 -0.99 1.45 0.00 -0.85 0.00 0.00 174.74 174.35 1ia8 h ALA 186 N 3.66 0.32 -0.33 -1.40 0.00 -1.95 -3.36 119.26 116.20 1ia8 h ALA 186 Ca -0.47 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.19 1ia8 h ALA 186 Cb 1.22 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1ia8 h ALA 186 CO 0.66 0.15 0.10 0.93 0.00 0.00 0.00 179.25 181.09 1ia8 h GLU 187 N 0.19 0.23 0.00 0.00 5.08 -1.98 -2.40 114.58 115.70 1ia8 h GLU 187 Ca 0.06 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1ia8 h GLU 187 Cb 0.57 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1ia8 h GLU 187 CO 0.03 0.15 -0.04 -1.35 -1.00 0.00 0.00 179.01 176.80 1ia8 h PRO 188 N 0.23 0.00 -0.28 2.33 0.11 -1.91 -1.71 132.00 130.77 1ia8 h PRO 188 Ca 0.15 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.15 1ia8 h PRO 188 Cb 0.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 1ia8 h PRO 188 CO -0.16 0.04 -0.27 0.28 -0.21 0.00 0.00 178.00 177.67 1ia8 h VAL 189 N 0.00 1.31 -0.14 3.15 2.07 -1.57 -1.56 116.25 119.50 1ia8 h VAL 189 Ca -0.00 -1.44 -0.12 0.00 0.82 0.00 0.00 66.70 65.96 1ia8 h VAL 189 Cb 0.16 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1ia8 h VAL 189 CO 0.00 0.46 -0.43 0.44 0.02 0.00 0.00 177.57 178.06 1ia8 h ASP 190 N 0.41 0.36 -0.57 0.57 3.32 -1.37 -2.37 116.42 116.77 1ia8 h ASP 190 Ca 0.04 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 1ia8 h ASP 190 Cb 0.84 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 1ia8 h ASP 190 CO 0.07 0.75 0.20 0.58 -1.72 0.00 0.00 179.24 179.11 1ia8 h VAL 191 N 0.28 1.23 -0.05 -1.35 2.07 -1.15 -1.87 116.25 115.42 1ia8 h VAL 191 Ca 0.02 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 1ia8 h VAL 191 Cb 0.87 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1ia8 h VAL 191 CO 0.07 0.29 0.03 -0.25 0.02 0.00 0.00 177.57 177.73 1ia8 h TRP 192 N 0.79 0.06 -0.43 1.57 2.91 -1.05 -1.97 115.95 117.84 1ia8 h TRP 192 Ca 0.19 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.19 1ia8 h TRP 192 Cb 0.26 -0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 28.86 1ia8 h TRP 192 CO 0.01 0.07 0.21 0.66 -1.03 0.00 0.00 178.44 178.37 1ia8 h SER 193 N 0.03 0.53 0.03 2.65 4.64 -1.32 0.39 113.55 120.49 1ia8 h SER 193 Ca 0.02 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1ia8 h SER 193 Cb 0.03 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1ia8 h SER 193 CO -0.00 0.45 -0.12 0.00 -0.87 0.00 0.00 176.83 176.29 1ia8 h GLY 195 N 0.67 0.83 1.49 0.00 0.00 -0.21 -1.26 103.07 104.58 1ia8 h GLY 195 Ca 0.04 -0.80 -0.13 0.00 0.00 0.00 0.00 47.33 46.43 1ia8 h GLY 195 CO 0.02 0.73 -0.41 1.19 0.00 0.00 0.00 176.54 178.07 1ia8 h ILE 196 N 0.63 1.30 -0.77 2.60 6.09 -0.83 -1.06 117.51 125.48 1ia8 h ILE 196 Ca 0.06 -1.58 -0.05 0.00 -1.37 0.00 0.00 64.86 61.93 1ia8 h ILE 196 Cb 0.89 1.56 -0.03 0.00 0.47 0.00 0.00 36.82 39.71 1ia8 h ILE 196 CO 0.08 0.50 0.29 0.58 -3.07 0.00 0.00 178.15 176.52 1ia8 h VAL 197 N 0.46 1.26 -0.51 2.19 2.07 -0.98 -0.45 116.25 120.29 1ia8 h VAL 197 Ca 0.04 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1ia8 h VAL 197 Cb 0.91 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1ia8 h VAL 197 CO 0.08 0.34 0.11 0.25 0.02 0.00 0.00 177.57 178.37 1ia8 h LEU 198 N 1.12 0.79 -0.50 2.57 6.46 -0.88 -0.75 115.31 124.12 1ia8 h LEU 198 Ca 0.25 -0.24 0.01 0.00 -0.12 0.00 0.00 57.88 57.78 1ia8 h LEU 198 Cb 0.24 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 39.93 1ia8 h LEU 198 CO -0.02 0.83 0.32 0.74 -0.62 0.00 0.00 178.44 179.69 1ia8 h THR 199 N 0.71 1.09 -0.46 1.05 2.02 -0.76 -1.50 112.91 115.06 1ia8 h THR 199 Ca 0.16 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1ia8 h THR 199 Cb 0.36 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1ia8 h THR 199 CO 0.00 0.12 0.27 0.00 0.37 0.00 0.00 175.52 176.29 1ia8 h ALA 200 N 1.20 0.59 -0.29 6.16 0.00 -0.74 -0.36 119.26 125.83 1ia8 h ALA 200 Ca 0.19 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1ia8 h ALA 200 Cb -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ia8 h ALA 200 CO -0.06 0.09 0.03 0.52 0.00 0.00 0.00 179.25 179.82 1ia8 h MET 201 N 0.61 0.43 0.00 0.00 2.07 -0.80 0.18 114.93 117.42 1ia8 h MET 201 Ca 0.17 -0.07 0.00 0.00 -2.07 0.00 0.00 59.70 57.72 1ia8 h MET 201 Cb 0.01 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 29.67 1ia8 h MET 201 CO -0.03 0.44 -0.86 1.28 1.07 0.00 0.00 176.91 178.81 1ia8 n LEU 202 N -4.33 0.70 0.00 1.22 4.77 -0.60 -1.10 117.00 117.67 1ia8 n LEU 202 Ca 0.01 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1ia8 n LEU 202 Cb 0.20 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1ia8 n LEU 202 CO 0.38 -0.06 0.00 0.00 -1.33 0.00 0.00 177.39 176.37 1ia8 n ALA 203 N -1.93 1.05 -1.80 -1.18 0.00 -0.18 -4.65 120.51 111.82 1ia8 n ALA 203 Ca 0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 1ia8 n ALA 203 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.89 1ia8 n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ia8 n GLY 204 N 0.52 0.67 3.47 0.00 0.00 0.61 -2.69 105.19 107.76 1ia8 n GLY 204 Ca 0.00 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.51 1ia8 n GLY 204 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ia8 s GLU 205 N -3.87 1.05 0.04 1.61 -1.05 -1.26 -0.13 118.70 115.09 1ia8 s GLU 205 Ca 0.00 0.06 -0.21 0.00 -0.15 0.00 0.00 54.97 54.68 1ia8 s GLU 205 Cb 0.00 0.49 -0.06 0.00 -0.44 0.00 0.00 34.13 34.12 1ia8 s GLU 205 CO 0.00 -0.35 0.60 -0.51 0.95 0.00 0.00 175.26 175.95 1ia8 s LEU 206 N -1.51 4.47 0.38 1.83 1.02 -1.26 -4.14 118.68 119.48 1ia8 s LEU 206 Ca -0.09 1.25 0.10 0.00 0.02 0.00 0.00 54.13 55.41 1ia8 s LEU 206 Cb -0.01 -2.95 0.76 0.00 0.02 0.00 0.00 46.19 44.01 1ia8 s LEU 206 CO 0.05 0.17 1.89 1.55 0.02 0.00 0.00 176.35 180.03 1ia8 h PRO 207 N 5.13 0.19 -2.98 1.29 0.13 -1.93 -3.47 132.00 130.36 1ia8 h PRO 207 Ca -0.47 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.57 1ia8 h PRO 207 Cb 1.21 -0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 1ia8 h PRO 207 CO 0.67 0.39 0.10 1.67 -0.23 0.00 0.00 178.00 180.60 1ia8 s TRP 208 N -4.59 -0.44 0.28 1.56 -2.14 -1.26 -4.68 118.94 107.67 1ia8 s TRP 208 Ca -0.05 0.30 0.00 0.00 2.66 0.00 0.00 56.10 59.02 1ia8 s TRP 208 Cb 0.15 0.43 0.40 0.00 -3.10 0.00 0.00 33.47 31.35 1ia8 s TRP 208 CO 0.73 -0.75 1.77 -0.44 -2.66 0.00 0.00 176.95 175.60 1ia8 h ASP 209 N 2.33 0.63 -4.40 -2.66 3.32 -1.92 -3.41 116.42 110.31 1ia8 h ASP 209 Ca -0.33 -0.16 0.08 0.00 0.02 0.00 0.00 57.03 56.64 1ia8 h ASP 209 Cb 1.26 -0.17 -0.20 0.00 0.22 0.00 0.00 39.33 40.45 1ia8 h ASP 209 CO 0.41 0.75 0.50 0.00 -1.72 0.00 0.00 179.24 179.18 1ia8 s GLN 210 N -4.84 0.72 -1.49 3.56 -2.07 -1.26 -2.71 119.66 111.57 1ia8 s GLN 210 Ca -0.08 -0.02 -0.11 0.00 -1.82 0.00 0.00 55.36 53.33 1ia8 s GLN 210 Cb 0.14 0.34 0.01 0.00 -1.09 0.00 0.00 33.01 32.41 1ia8 s GLN 210 CO 0.80 -0.26 2.50 -0.35 -1.32 0.00 0.00 175.29 176.65 1ia8 n PRO 211 N 0.37 3.46 -4.39 9.60 -0.04 -1.26 -4.73 135.00 138.01 1ia8 n PRO 211 Ca -0.10 -2.64 -0.27 0.00 -0.04 0.00 0.00 63.50 60.45 1ia8 n PRO 211 Cb 0.59 -2.99 -0.12 0.00 -0.04 0.00 0.00 33.50 30.94 1ia8 n PRO 211 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1ia8 s SER 212 N 2.23 3.24 0.55 3.54 0.01 -1.26 -4.58 113.70 117.43 1ia8 s SER 212 Ca 0.56 -0.81 0.23 0.00 1.31 0.00 0.00 55.95 57.25 1ia8 s SER 212 Cb 0.16 -0.22 1.52 0.00 0.21 0.00 0.00 66.02 67.69 1ia8 s SER 212 CO -0.07 0.12 2.18 0.44 0.41 0.00 0.00 173.24 176.32 1ia8 h ASP 213 N 3.53 0.00 1.16 2.44 3.45 -1.97 -0.03 116.42 125.00 1ia8 h ASP 213 Ca -0.48 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.98 1ia8 h ASP 213 Cb 1.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.96 1ia8 h ASP 213 CO 0.44 0.03 0.00 0.77 -1.57 0.00 0.00 179.24 178.91 1ia8 h SER 214 N 0.00 0.00 -3.62 6.45 4.64 -1.95 -3.42 113.55 115.65 1ia8 h SER 214 Ca -0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 1ia8 h SER 214 Cb 0.06 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.04 1ia8 h SER 214 CO 0.00 0.00 0.52 0.00 -0.87 0.00 0.00 176.83 176.48 1ia8 h GLN 216 N 8.92 0.79 -0.72 0.00 5.75 -1.84 -1.17 115.11 126.84 1ia8 h GLN 216 Ca -0.24 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.20 1ia8 h GLN 216 Cb 1.08 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 29.42 1ia8 h GLN 216 CO 1.00 0.53 0.42 0.93 -2.65 0.00 0.00 178.83 179.05 1ia8 h GLU 217 N 0.82 0.99 -0.26 1.69 3.07 -1.92 -0.43 114.58 118.54 1ia8 h GLU 217 Ca 0.43 -0.10 -0.20 0.00 -0.50 0.00 0.00 59.36 59.00 1ia8 h GLU 217 Cb 0.43 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1ia8 h GLU 217 CO -0.27 0.71 -0.60 -0.92 -1.40 0.00 0.00 179.01 176.53 1ia8 h TYR 218 N 1.00 1.09 -0.64 4.33 3.20 -1.54 -2.79 116.97 121.64 1ia8 h TYR 218 Ca 0.26 -0.41 -0.02 0.00 3.14 0.00 0.00 58.73 61.70 1ia8 h TYR 218 Cb -0.01 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.03 1ia8 h TYR 218 CO 0.01 1.24 0.31 0.77 -1.64 0.00 0.00 178.16 178.85 1ia8 h SER 219 N 0.64 0.83 -0.95 -2.11 0.02 -0.79 -2.19 113.55 108.99 1ia8 h SER 219 Ca -0.00 -0.13 0.07 0.00 -0.84 0.00 0.00 61.79 60.89 1ia8 h SER 219 Cb 1.22 -0.21 -0.07 0.00 0.14 0.00 0.00 62.40 63.48 1ia8 h SER 219 CO 0.13 0.72 0.61 0.44 -1.14 0.00 0.00 176.83 177.59 1ia8 h ASP 220 N 0.87 0.96 -0.36 3.07 3.45 -1.06 -0.97 116.42 122.39 1ia8 h ASP 220 Ca 0.22 0.01 -0.04 0.00 0.43 0.00 0.00 57.03 57.66 1ia8 h ASP 220 Cb 0.11 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.68 1ia8 h ASP 220 CO -0.03 0.61 0.09 -0.25 -1.57 0.00 0.00 179.24 178.08 1ia8 h TRP 221 N 1.09 0.60 0.00 4.55 2.91 -1.16 -1.24 115.95 122.70 1ia8 h TRP 221 Ca 0.42 -0.07 -0.01 0.00 1.13 0.00 0.00 58.89 60.35 1ia8 h TRP 221 Cb 0.19 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 28.67 1ia8 h TRP 221 CO -0.01 0.60 -0.07 0.87 -1.03 0.00 0.00 178.44 178.80 1ia8 h LYS 222 N 0.43 0.00 -0.12 2.65 1.57 -0.80 0.11 116.57 120.41 1ia8 h LYS 222 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1ia8 h LYS 222 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1ia8 h LYS 222 CO 0.00 0.07 0.00 0.39 -0.57 0.00 0.00 179.45 179.34 1ia8 n GLU 223 N -3.36 1.62 -2.38 3.15 1.02 -0.43 -4.93 120.64 115.34 1ia8 n GLU 223 Ca -0.01 -0.93 -0.16 0.00 -0.02 0.00 0.00 57.16 56.04 1ia8 n GLU 223 Cb 0.23 -1.40 -0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1ia8 n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ia8 n LYS 224 N 0.14 -1.61 -1.70 3.49 4.01 0.03 -4.91 118.16 117.61 1ia8 n LYS 224 Ca 0.17 0.73 -0.40 0.00 -0.51 0.00 0.00 58.31 58.30 1ia8 n LYS 224 Cb 0.30 -5.09 -0.01 0.00 -0.51 0.00 0.00 35.03 29.72 1ia8 n LYS 224 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1ia8 n LYS 225 N -2.59 3.78 0.00 1.97 5.02 -0.53 -4.68 118.16 121.15 1ia8 n LYS 225 Ca -0.17 -2.78 0.10 0.00 -2.02 0.00 0.00 58.31 53.44 1ia8 n LYS 225 Cb 0.63 -2.86 0.58 0.00 -0.02 0.00 0.00 35.03 33.36 1ia8 n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ia8 n THR 226 N 3.32 0.03 1.71 -0.18 -2.24 -1.26 -2.25 114.28 113.40 1ia8 n THR 226 Ca 0.65 0.01 0.15 0.00 -2.27 0.00 0.00 64.05 62.58 1ia8 n THR 226 Cb 0.28 -0.70 0.78 0.00 -2.10 0.00 0.00 70.33 68.59 1ia8 n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ia8 n TYR 227 N -1.02 0.00 -3.08 4.78 0.18 -1.26 -2.38 117.16 114.38 1ia8 n TYR 227 Ca 0.14 0.00 -0.32 0.00 1.88 0.00 0.00 57.90 59.60 1ia8 n TYR 227 Cb 0.07 -0.08 -0.06 0.00 -0.38 0.00 0.00 39.34 38.89 1ia8 n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1ia8 s LEU 228 N -2.18 4.03 0.00 -3.48 1.43 -0.96 -4.68 118.68 112.85 1ia8 s LEU 228 Ca 0.39 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.82 1ia8 s LEU 228 Cb 0.21 -4.14 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1ia8 s LEU 228 CO 0.40 -0.24 0.00 -3.20 0.23 0.00 0.00 176.35 173.54 1ia8 n ASN 229 N -0.47 0.00 0.48 2.29 5.15 -1.26 -2.04 115.26 119.41 1ia8 n ASN 229 Ca 0.04 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 53.82 1ia8 n ASN 229 Cb 0.53 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.69 1ia8 n ASN 229 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1ia8 h PRO 230 N 0.00 -1.20 -0.32 1.20 0.13 -1.94 -3.26 132.00 126.61 1ia8 h PRO 230 Ca 0.00 0.08 0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1ia8 h PRO 230 Cb 0.00 0.27 -0.02 0.00 0.13 0.00 0.00 31.00 31.39 1ia8 h PRO 230 CO 0.00 -0.80 0.21 -1.49 -0.23 0.00 0.00 178.00 175.70 1ia8 h TRP 231 N -1.24 0.39 0.00 1.56 4.06 -1.68 -2.52 115.95 116.52 1ia8 h TRP 231 Ca -0.12 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.84 1ia8 h TRP 231 Cb 0.96 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.99 1ia8 h TRP 231 CO -0.03 0.24 0.00 0.36 -3.56 0.00 0.00 178.44 175.46 1ia8 n LYS 232 N -4.49 0.01 0.00 0.49 2.85 -0.87 -2.36 118.16 113.80 1ia8 n LYS 232 Ca 0.02 0.27 0.12 0.00 -1.05 0.00 0.00 58.31 57.67 1ia8 n LYS 232 Cb 0.08 -1.50 0.12 0.00 -0.65 0.00 0.00 35.03 33.08 1ia8 n LYS 232 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1ia8 n LYS 233 N -1.48 1.98 0.00 -1.58 5.02 -0.95 -4.86 118.16 116.29 1ia8 n LYS 233 Ca 0.03 -1.60 0.00 0.00 -2.02 0.00 0.00 58.31 54.72 1ia8 n LYS 233 Cb 0.14 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1ia8 n LYS 233 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1ia8 n ILE 234 N 0.89 0.00 0.00 -0.18 5.41 -1.00 -4.86 119.36 119.62 1ia8 n ILE 234 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1ia8 n ILE 234 Cb 0.54 -0.36 0.00 0.00 -0.71 0.00 0.00 39.64 39.11 1ia8 n ILE 234 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1ia8 n ASP 235 N -0.77 0.00 -0.02 4.38 -0.08 -1.26 -4.92 116.55 113.88 1ia8 n ASP 235 Ca 0.00 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.07 1ia8 n ASP 235 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 1ia8 n ASP 235 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ia8 n SER 236 N 0.00 2.08 0.47 1.67 3.41 -1.26 -2.54 113.62 117.45 1ia8 n SER 236 Ca 0.00 0.14 -0.19 0.00 -0.26 0.00 0.00 58.87 58.56 1ia8 n SER 236 Cb 0.00 -0.76 -0.09 0.00 -0.26 0.00 0.00 64.21 63.10 1ia8 n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ia8 h ALA 237 N 0.07 -1.20 0.00 7.33 0.00 -2.00 -0.28 119.26 123.18 1ia8 h ALA 237 Ca -0.46 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 1ia8 h ALA 237 Cb 2.01 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 20.25 1ia8 h ALA 237 CO 0.05 -1.13 -0.30 -1.00 0.00 0.00 0.00 179.25 176.87 1ia8 h PRO 238 N -1.28 0.00 -0.76 0.00 0.13 -1.91 -2.44 132.00 125.73 1ia8 h PRO 238 Ca -0.12 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.97 1ia8 h PRO 238 Cb 0.92 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.02 1ia8 h PRO 238 CO 0.20 0.30 0.34 1.25 -0.23 0.00 0.00 178.00 179.86 1ia8 h LEU 239 N 0.00 1.01 -1.35 1.56 6.46 -1.37 -0.91 115.31 120.72 1ia8 h LEU 239 Ca -0.00 -0.13 -0.02 0.00 -0.12 0.00 0.00 57.88 57.61 1ia8 h LEU 239 Cb 0.54 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 1ia8 h LEU 239 CO 0.04 0.87 0.19 0.00 -0.62 0.00 0.00 178.44 178.92 1ia8 h ALA 240 N 1.28 1.49 -0.20 1.25 0.00 -0.55 -0.06 119.26 122.47 1ia8 h ALA 240 Ca 0.26 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1ia8 h ALA 240 Cb 0.15 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ia8 h ALA 240 CO -0.03 0.40 -0.24 1.25 0.00 0.00 0.00 179.25 180.63 1ia8 h LEU 241 N 0.64 0.55 -1.63 0.00 5.85 -1.19 -2.89 115.31 116.64 1ia8 h LEU 241 Ca 0.16 -0.50 0.04 0.00 0.84 0.00 0.00 57.88 58.42 1ia8 h LEU 241 Cb 0.11 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 1ia8 h LEU 241 CO -0.02 0.94 0.31 -0.07 -0.34 0.00 0.00 178.44 179.26 1ia8 h LEU 242 N 0.18 0.42 -1.78 2.25 4.07 -0.59 0.12 115.31 119.98 1ia8 h LEU 242 Ca 0.03 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.95 1ia8 h LEU 242 Cb 0.80 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 42.44 1ia8 h LEU 242 CO 0.06 0.29 -0.15 0.45 -1.08 0.00 0.00 178.44 178.01 1ia8 h HIS 243 N 0.49 0.00 0.00 1.13 3.86 -0.82 0.21 115.15 120.01 1ia8 h HIS 243 Ca 0.19 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.19 1ia8 h HIS 243 Cb 0.15 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.58 1ia8 h HIS 243 CO -0.00 0.15 -1.45 0.87 0.86 0.00 0.00 177.93 178.35 1ia8 h LYS 244 N 0.00 0.00 0.06 2.45 1.57 -0.67 -3.40 116.57 116.58 1ia8 h LYS 244 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 1ia8 h LYS 244 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1ia8 h LYS 244 CO 0.02 0.41 -0.83 0.82 -0.57 0.00 0.00 179.45 179.30 1ia8 h ILE 245 N 0.00 1.33 -0.57 1.86 2.04 -0.82 -2.47 117.51 118.88 1ia8 h ILE 245 Ca -0.19 -2.36 -0.56 0.00 1.00 0.00 0.00 64.86 62.75 1ia8 h ILE 245 Cb 1.74 2.90 -0.08 0.00 -0.74 0.00 0.00 36.82 40.64 1ia8 h ILE 245 CO 0.06 0.59 1.85 0.18 0.00 0.00 0.00 178.15 180.83 1ia8 n LEU 246 N -4.29 7.37 -4.71 1.44 4.77 0.03 -4.73 117.00 116.89 1ia8 n LEU 246 Ca -0.20 -4.23 -0.36 0.00 -0.03 0.00 0.00 56.01 51.19 1ia8 n LEU 246 Cb 0.71 -1.40 -0.08 0.00 -2.33 0.00 0.00 43.42 40.31 1ia8 n LEU 246 CO 0.35 1.93 -0.10 -0.69 -1.33 0.00 0.00 177.39 177.54 1ia8 s VAL 247 N 0.01 5.35 0.18 4.08 1.01 -1.26 -4.95 120.40 124.81 1ia8 s VAL 247 Ca 0.62 0.34 -0.14 0.00 0.00 0.00 0.00 61.98 62.81 1ia8 s VAL 247 Cb 0.25 -3.55 0.07 0.00 0.00 0.00 0.00 36.38 33.15 1ia8 s VAL 247 CO -0.09 0.38 1.79 -0.08 0.00 0.00 0.00 175.10 177.10 1ia8 h GLU 248 N 6.95 0.49 -6.57 2.72 4.81 -1.97 -3.39 114.58 117.62 1ia8 h GLU 248 Ca -0.40 -0.03 -0.57 0.00 -0.13 0.00 0.00 59.36 58.24 1ia8 h GLU 248 Cb 1.16 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.37 1ia8 h GLU 248 CO 0.73 0.32 1.04 1.21 -0.73 0.00 0.00 179.01 181.58 1ia8 s ASN 249 N -5.50 6.41 0.60 1.04 3.84 -1.26 -4.63 114.94 115.44 1ia8 s ASN 249 Ca -0.13 0.76 0.31 0.00 0.21 0.00 0.00 52.86 54.01 1ia8 s ASN 249 Cb 0.13 -2.54 1.87 0.00 -0.55 0.00 0.00 41.25 40.16 1ia8 s ASN 249 CO 0.73 -1.39 2.25 1.55 -2.79 0.00 0.00 177.10 177.46 1ia8 h PRO 250 N 10.35 0.00 0.00 0.43 0.13 -1.96 -1.07 132.00 139.88 1ia8 h PRO 250 Ca -0.27 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.77 1ia8 h PRO 250 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1ia8 h PRO 250 CO 1.09 0.00 -0.43 0.77 -0.23 0.00 0.00 178.00 179.21 1ia8 h SER 251 N 0.00 0.00 0.33 1.44 0.02 -1.94 -3.14 113.55 110.26 1ia8 h SER 251 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1ia8 h SER 251 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1ia8 h SER 251 CO -0.00 0.43 -1.08 0.00 -1.14 0.00 0.00 176.83 175.04 1ia8 n ALA 252 N -2.27 3.58 -1.76 3.77 0.00 -0.51 -4.96 120.51 118.37 1ia8 n ALA 252 Ca 0.00 -0.44 -0.39 0.00 0.00 0.00 0.00 53.44 52.61 1ia8 n ALA 252 Cb 0.58 -0.93 0.03 0.00 0.00 0.00 0.00 19.45 19.14 1ia8 n ALA 252 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ia8 s ARG 253 N -3.18 3.39 0.48 0.00 3.52 -0.60 -4.94 118.95 117.63 1ia8 s ARG 253 Ca 0.04 2.28 -0.24 0.00 -0.13 0.00 0.00 55.73 57.69 1ia8 s ARG 253 Cb 0.15 -2.43 -0.07 0.00 -1.56 0.00 0.00 34.95 31.04 1ia8 s ARG 253 CO 0.82 -1.01 1.34 -1.50 -0.81 0.00 0.00 175.30 174.14 1ia8 s ILE 254 N -1.27 2.30 0.47 4.11 2.07 -0.93 -5.02 121.20 122.92 1ia8 s ILE 254 Ca 0.67 0.24 0.05 0.00 -1.41 0.00 0.00 60.65 60.20 1ia8 s ILE 254 Cb -0.41 -3.13 0.02 0.00 0.13 0.00 0.00 42.46 39.06 1ia8 s ILE 254 CO 0.50 0.02 0.65 0.42 -1.91 0.00 0.00 174.94 174.62 1ia8 s THR 255 N -1.30 3.01 0.18 4.00 -4.23 -1.26 -4.92 115.64 111.12 1ia8 s THR 255 Ca 0.65 -0.84 -0.10 0.00 -1.18 0.00 0.00 61.69 60.22 1ia8 s THR 255 Cb -0.39 -3.06 0.07 0.00 1.34 0.00 0.00 72.50 70.45 1ia8 s THR 255 CO 0.49 -0.03 1.65 0.40 -0.54 0.00 0.00 174.62 176.58 1ia8 h ILE 256 N 0.42 1.26 -0.72 2.99 2.04 -1.97 -0.84 117.51 120.69 1ia8 h ILE 256 Ca -0.42 -1.09 0.12 0.00 1.00 0.00 0.00 64.86 64.48 1ia8 h ILE 256 Cb 1.28 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 38.09 1ia8 h ILE 256 CO 0.49 0.40 0.48 -0.65 0.00 0.00 0.00 178.15 178.87 1ia8 h PRO 257 N 0.94 0.48 0.00 2.37 0.11 -2.00 -0.52 132.00 133.38 1ia8 h PRO 257 Ca 0.18 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.07 1ia8 h PRO 257 Cb 0.50 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.48 1ia8 h PRO 257 CO 0.02 0.32 -0.89 -0.44 -0.21 0.00 0.00 178.00 176.79 1ia8 h ASP 258 N 0.49 0.00 -0.79 -2.05 3.45 -1.84 -3.10 116.42 112.58 1ia8 h ASP 258 Ca 0.34 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.76 1ia8 h ASP 258 Cb 0.66 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.40 1ia8 h ASP 258 CO -0.11 0.89 0.34 0.40 -1.57 0.00 0.00 179.24 179.19 1ia8 h ILE 259 N 0.00 1.26 0.00 0.35 2.04 0.29 -1.13 117.51 120.32 1ia8 h ILE 259 Ca -0.01 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1ia8 h ILE 259 Cb 1.64 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1ia8 h ILE 259 CO 0.12 0.32 0.00 2.29 0.00 0.00 0.00 178.15 180.88 1ia8 n LYS 260 N -4.29 0.14 0.00 2.37 2.85 -0.43 -1.23 118.16 117.56 1ia8 n LYS 260 Ca 0.07 0.54 0.10 0.00 -1.05 0.00 0.00 58.31 57.98 1ia8 n LYS 260 Cb 0.17 -1.88 -0.02 0.00 -0.65 0.00 0.00 35.03 32.64 1ia8 n LYS 260 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1ia8 n LYS 261 N -2.17 1.13 -1.80 -1.58 5.02 -0.46 -4.79 118.16 113.50 1ia8 n LYS 261 Ca 0.00 -0.80 -0.39 0.00 -2.02 0.00 0.00 58.31 55.10 1ia8 n LYS 261 Cb 0.10 -1.45 0.03 0.00 -0.02 0.00 0.00 35.03 33.69 1ia8 n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ia8 s ASP 262 N -2.47 5.59 0.10 4.39 -1.08 -0.37 -4.91 116.67 117.92 1ia8 s ASP 262 Ca 0.16 2.84 -0.23 0.00 -0.52 0.00 0.00 52.55 54.80 1ia8 s ASP 262 Cb 0.17 -2.64 -0.12 0.00 -1.46 0.00 0.00 42.92 38.87 1ia8 s ASP 262 CO 0.59 -1.36 1.72 -0.09 0.52 0.00 0.00 175.17 176.56 1ia8 h ARG 263 N 1.91 -0.04 -0.63 4.34 2.43 -1.93 -2.42 114.38 118.03 1ia8 h ARG 263 Ca -0.51 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.61 1ia8 h ARG 263 Cb 1.28 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.82 1ia8 h ARG 263 CO 0.59 -0.03 0.18 2.35 -1.51 0.00 0.00 179.97 181.55 1ia8 h TRP 264 N -0.04 1.03 -0.87 2.20 7.01 -1.92 -2.17 115.95 121.18 1ia8 h TRP 264 Ca 0.02 -0.11 0.15 0.00 2.11 0.00 0.00 58.89 61.07 1ia8 h TRP 264 Cb 0.08 -0.29 -0.07 0.00 -2.10 0.00 0.00 29.16 26.78 1ia8 h TRP 264 CO -0.12 0.85 0.57 -0.92 -2.79 0.00 0.00 178.44 176.02 1ia8 h TYR 265 N 0.91 0.73 -0.29 2.65 5.03 -1.81 -1.72 116.97 122.47 1ia8 h TYR 265 Ca 0.20 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.53 1ia8 h TYR 265 Cb 0.32 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.37 1ia8 h TYR 265 CO 0.02 0.26 0.00 0.09 -1.32 0.00 0.00 178.16 177.21 1ia8 n ASN 266 N -4.55 2.94 -4.70 -2.11 3.02 -0.93 -4.96 115.26 103.97 1ia8 n ASN 266 Ca 0.17 -1.92 -0.42 0.00 -0.03 0.00 0.00 54.58 52.38 1ia8 n ASN 266 Cb 0.51 -0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.47 1ia8 n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ia8 s LYS 267 N -1.63 4.42 0.02 3.52 1.02 -0.65 -4.97 119.74 121.46 1ia8 s LYS 267 Ca 0.36 1.69 -0.30 0.00 0.02 0.00 0.00 55.97 57.74 1ia8 s LYS 267 Cb 0.21 -3.43 -0.06 0.00 -0.52 0.00 0.00 37.83 34.02 1ia8 s LYS 267 CO 0.30 -0.29 1.51 -2.14 -0.92 0.00 0.00 175.35 173.81 1ia8 s PRO 268 N 1.44 4.24 0.00 -1.68 0.02 -1.26 -4.78 135.00 132.99 1ia8 s PRO 268 Ca 0.57 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.70 1ia8 s PRO 268 Cb -0.27 -3.62 0.00 0.00 0.02 0.00 0.00 34.50 30.63 1ia8 s PRO 268 CO 0.27 -0.66 0.00 1.28 -0.33 0.00 0.00 177.00 177.56 1ia8 n LEU 269 N 5.62 0.30 -4.42 -5.54 4.77 -1.26 -5.11 117.00 111.35 1ia8 n LEU 269 Ca 0.14 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.80 1ia8 n LEU 269 Cb 0.42 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.37 1ia8 n LEU 269 CO 0.60 0.05 -0.48 -0.75 -1.33 0.00 0.00 177.39 175.48 1ia8 s LYS 270 N -1.11 2.54 0.64 3.23 2.20 -1.26 -4.83 119.74 121.15 1ia8 s LYS 270 Ca 0.00 -0.75 -0.11 0.00 -0.36 0.00 0.00 55.97 54.75 1ia8 s LYS 270 Cb 0.00 -2.34 -0.03 0.00 -1.51 0.00 0.00 37.83 33.95 1ia8 s LYS 270 CO 0.00 0.55 1.04 0.15 -0.36 0.00 0.00 175.35 176.73 1ia8 s LYS 271 N -0.55 3.43 1.15 4.03 -0.14 -1.26 -5.05 119.74 121.35 1ia8 s LYS 271 Ca 0.08 0.81 -0.17 0.00 -1.36 0.00 0.00 55.97 55.32 1ia8 s LYS 271 Cb -0.11 -2.06 0.26 0.00 -1.68 0.00 0.00 37.83 34.24 1ia8 s LYS 271 CO 0.01 -0.70 1.10 0.20 -0.76 0.00 0.00 175.35 175.20 1ia8 s GLY 272 N -4.05 1.58 0.55 -3.33 0.00 -1.26 -4.94 107.32 95.86 1ia8 s GLY 272 Ca 0.56 -0.79 -0.19 0.00 0.00 0.00 0.00 44.72 44.30 1ia8 s GLY 272 CO 0.54 0.03 0.59 0.00 0.00 0.00 0.00 173.10 174.25 1ia8 n ALA 273 N -4.61 -1.00 -1.68 3.20 0.00 -1.26 -4.81 120.51 110.36 1ia8 n ALA 273 Ca 0.11 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 1ia8 n ALA 273 Cb 0.59 -1.86 -0.03 0.00 0.00 0.00 0.00 19.45 18.15 1ia8 n ALA 273 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ia8 s LYS 274 N -2.08 3.89 -0.51 0.00 -0.14 -1.26 -3.56 119.74 116.08 1ia8 s LYS 274 Ca 0.68 2.43 -0.15 0.00 -1.36 0.00 0.00 55.97 57.58 1ia8 s LYS 274 Cb -0.47 -4.21 0.02 0.00 -1.68 0.00 0.00 37.83 31.50 1ia8 s LYS 274 CO 0.54 -1.24 0.63 0.54 -0.76 0.00 0.00 175.35 175.06 1ia8 n ARG 275 N 7.83 -2.10 0.00 1.68 5.12 -1.26 -5.31 116.66 122.61 1ia8 n ARG 275 Ca 0.22 1.89 0.00 0.00 -1.93 0.00 0.00 57.85 58.03 1ia8 n ARG 275 Cb 0.42 -5.23 0.00 0.00 -1.16 0.00 0.00 32.46 26.49 1ia8 n ARG 275 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35