#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1otx n THR 2 N 0.00 0.00 0.19 0.00 -2.24 0.50 -4.94 114.28 107.78 1otx n THR 2 Ca 0.00 -1.73 0.06 0.00 -2.27 0.00 0.00 64.05 60.12 1otx n THR 2 Cb 0.00 -0.18 0.56 0.00 -2.10 0.00 0.00 70.33 68.61 1otx n THR 2 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1otx h PRO 3 N 0.00 0.14 -0.06 -0.78 0.11 -2.01 -3.17 132.00 126.24 1otx h PRO 3 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1otx h PRO 3 Cb 1.02 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1otx h PRO 3 CO 0.42 0.13 0.00 0.72 -0.21 0.00 0.00 178.00 179.06 1otx n HIS 4 N -4.49 0.07 -3.63 0.65 8.25 -1.26 -4.96 115.22 109.86 1otx n HIS 4 Ca -0.01 -0.40 -0.20 0.00 -0.26 0.00 0.00 57.72 56.84 1otx n HIS 4 Cb 0.11 -0.04 -0.16 0.00 1.12 0.00 0.00 29.99 31.02 1otx n HIS 4 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1otx s ILE 5 N -0.84 -0.19 -0.98 1.59 1.01 -1.20 -4.72 121.20 115.86 1otx s ILE 5 Ca 0.04 0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.75 1otx s ILE 5 Cb 0.02 -0.36 0.19 0.00 0.01 0.00 0.00 42.46 42.32 1otx s ILE 5 CO 0.03 0.02 1.07 0.21 0.00 0.00 0.00 174.94 176.27 1otx s ASN 6 N 2.23 6.88 0.36 3.58 3.04 -1.26 -0.37 114.94 129.39 1otx s ASN 6 Ca 0.04 -2.69 -0.03 0.00 0.04 0.00 0.00 52.86 50.22 1otx s ASN 6 Cb -0.13 -2.31 0.01 0.00 -1.54 0.00 0.00 41.25 37.28 1otx s ASN 6 CO -0.07 -0.72 0.51 0.00 -3.04 0.00 0.00 177.10 173.78 1otx s ALA 7 N 1.01 0.72 0.06 1.71 0.00 -1.26 -4.54 121.76 119.46 1otx s ALA 7 Ca 0.30 -1.50 0.04 0.00 0.00 0.00 0.00 51.96 50.80 1otx s ALA 7 Cb -0.07 1.12 -0.03 0.00 0.00 0.00 0.00 23.12 24.14 1otx s ALA 7 CO -0.07 -0.81 -0.11 -2.00 0.00 0.00 0.00 175.76 172.77 1otx s GLU 8 N -2.91 0.71 -0.13 0.00 2.56 -1.26 0.11 118.70 117.78 1otx s GLU 8 Ca 0.30 -0.91 -0.38 0.00 0.00 0.00 0.00 54.97 53.97 1otx s GLU 8 Cb -0.01 -0.56 -0.16 0.00 2.00 0.00 0.00 34.13 35.41 1otx s GLU 8 CO 0.21 0.11 1.62 -0.12 -0.56 0.00 0.00 175.26 176.51 1otx n MET 9 N 1.22 1.28 0.00 4.30 0.00 -1.26 -0.99 117.12 121.66 1otx n MET 9 Ca -0.21 0.47 0.00 0.00 -0.00 0.00 0.00 57.70 57.96 1otx n MET 9 Cb 0.55 -2.15 0.00 0.00 0.00 0.00 0.00 33.22 31.62 1otx n MET 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1otx n GLY 10 N 3.63 0.87 0.27 -5.12 0.00 -1.26 -4.94 105.19 98.64 1otx n GLY 10 Ca 0.23 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.39 1otx n GLY 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1otx h ASP 11 N 1.61 0.00 -3.40 1.61 3.32 -1.44 -3.43 116.42 114.70 1otx h ASP 11 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 1otx h ASP 11 Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 1otx h ASP 11 CO 0.00 0.10 -0.66 -0.36 -1.72 0.00 0.00 179.24 176.60 1otx s PHE 12 N -4.05 3.01 0.99 4.55 0.40 -1.26 -4.68 117.98 116.94 1otx s PHE 12 Ca -0.02 0.02 -0.15 0.00 -0.60 0.00 0.00 56.93 56.18 1otx s PHE 12 Cb 0.12 -1.61 0.19 0.00 0.51 0.00 0.00 43.02 42.23 1otx s PHE 12 CO 0.56 0.45 1.17 0.00 0.70 0.00 0.00 175.22 178.11 1otx s ALA 13 N -1.15 1.57 -1.14 5.36 0.00 -1.26 -4.94 121.76 120.20 1otx s ALA 13 Ca 0.21 -0.77 0.25 0.00 0.00 0.00 0.00 51.96 51.65 1otx s ALA 13 Cb -0.11 -2.94 1.12 0.00 0.00 0.00 0.00 23.12 21.18 1otx s ALA 13 CO 0.12 -2.64 1.80 -0.40 0.00 0.00 0.00 175.76 174.64 1otx n ASP 14 N -4.01 0.00 -4.11 0.00 5.68 -1.26 -4.61 116.55 108.24 1otx n ASP 14 Ca 0.10 0.31 -0.22 0.00 -0.50 0.00 0.00 54.79 54.47 1otx n ASP 14 Cb 0.59 -0.43 -0.15 0.00 -1.14 0.00 0.00 41.12 39.99 1otx n ASP 14 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1otx s VAL 15 N -2.86 1.10 -0.04 2.12 -7.23 -1.26 -0.04 120.40 112.20 1otx s VAL 15 Ca 0.16 -0.60 0.02 0.00 -1.81 0.00 0.00 61.98 59.75 1otx s VAL 15 Cb 0.16 -0.92 0.01 0.00 0.56 0.00 0.00 36.38 36.19 1otx s VAL 15 CO 0.42 0.31 -0.08 -0.69 -0.31 0.00 0.00 175.10 174.75 1otx s VAL 16 N -0.34 0.75 -0.05 1.32 1.01 -0.02 -2.70 120.40 120.38 1otx s VAL 16 Ca 0.05 -0.30 -0.19 0.00 0.00 0.00 0.00 61.98 61.54 1otx s VAL 16 Cb -0.05 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 1otx s VAL 16 CO -0.01 0.25 0.54 -0.76 0.00 0.00 0.00 175.10 175.12 1otx s LEU 17 N 0.46 4.37 -0.22 3.92 1.02 0.38 -0.96 118.68 127.65 1otx s LEU 17 Ca -0.07 1.02 -0.02 0.00 0.02 0.00 0.00 54.13 55.08 1otx s LEU 17 Cb -0.11 -2.81 0.07 0.00 0.02 0.00 0.00 46.19 43.35 1otx s LEU 17 CO 0.01 0.08 0.02 -0.04 0.02 0.00 0.00 176.35 176.44 1otx s MET 18 N 0.06 0.91 0.51 1.70 -1.94 0.14 -1.64 119.30 119.04 1otx s MET 18 Ca 0.29 -0.68 -0.00 0.00 -1.71 0.00 0.00 55.69 53.59 1otx s MET 18 Cb -0.17 -2.21 0.01 0.00 2.01 0.00 0.00 34.83 34.47 1otx s MET 18 CO 0.14 -0.69 0.74 -1.25 -0.01 0.00 0.00 175.02 173.96 1otx s PRO 19 N 1.70 2.84 0.12 2.03 0.04 -1.25 -1.64 135.00 138.84 1otx s PRO 19 Ca -0.00 -0.53 -0.07 0.00 0.04 0.00 0.00 61.00 60.44 1otx s PRO 19 Cb -0.18 -2.49 -0.13 0.00 0.04 0.00 0.00 34.50 31.75 1otx s PRO 19 CO -0.10 -0.50 1.28 0.78 0.04 0.00 0.00 177.00 178.49 1otx h GLY 20 N 0.19 0.56 -5.81 0.56 0.00 -1.85 -1.02 103.07 95.70 1otx h GLY 20 Ca -0.45 -0.97 -0.59 0.00 0.00 0.00 0.00 47.33 45.33 1otx h GLY 20 CO 0.56 0.86 0.66 -0.35 0.00 0.00 0.00 176.54 178.26 1otx s ASP 21 N -7.13 6.85 0.41 0.19 2.15 -1.26 -1.92 116.67 115.96 1otx s ASP 21 Ca -0.07 0.96 0.14 0.00 0.43 0.00 0.00 52.55 54.00 1otx s ASP 21 Cb 0.08 -2.49 0.98 0.00 -0.30 0.00 0.00 42.92 41.20 1otx s ASP 21 CO 0.88 -0.73 1.91 -0.65 -0.17 0.00 0.00 175.17 176.41 1otx h PRO 22 N 7.98 0.48 0.00 4.34 0.11 -1.89 0.17 132.00 143.19 1otx h PRO 22 Ca -0.22 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.83 1otx h PRO 22 Cb 1.07 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1otx h PRO 22 CO 0.96 0.32 -0.17 -0.07 -0.21 0.00 0.00 178.00 178.83 1otx h LEU 23 N 0.50 0.00 -0.09 2.35 3.38 -1.91 -2.37 115.31 117.17 1otx h LEU 23 Ca 0.38 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.11 1otx h LEU 23 Cb 0.78 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.53 1otx h LEU 23 CO -0.14 0.17 -1.02 0.03 0.09 0.00 0.00 178.44 177.58 1otx h ARG 24 N 0.00 0.46 -0.48 1.13 2.47 -1.08 -1.70 114.38 115.19 1otx h ARG 24 Ca -0.00 -0.53 0.06 0.00 -1.26 0.00 0.00 59.98 58.24 1otx h ARG 24 Cb 0.56 0.16 -0.05 0.00 -1.65 0.00 0.00 29.97 28.99 1otx h ARG 24 CO 0.02 1.18 0.20 0.00 0.56 0.00 0.00 179.97 181.93 1otx h ALA 25 N 0.63 0.60 -0.16 0.04 0.00 -1.10 0.11 119.26 119.37 1otx h ALA 25 Ca -0.10 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1otx h ALA 25 Cb 1.67 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1otx h ALA 25 CO 0.18 -0.18 0.10 -0.22 0.00 0.00 0.00 179.25 179.13 1otx h LYS 26 N 0.40 0.22 -0.91 0.00 3.64 -1.41 -1.03 116.57 117.48 1otx h LYS 26 Ca 0.22 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1otx h LYS 26 Cb 0.19 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 1otx h LYS 26 CO -0.20 0.19 0.60 -0.92 -2.27 0.00 0.00 179.45 176.85 1otx h TYR 27 N 0.19 1.16 -0.38 1.91 5.03 -0.73 -1.27 116.97 122.87 1otx h TYR 27 Ca 0.06 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.36 1otx h TYR 27 Cb 0.03 -0.39 -0.02 0.00 1.55 0.00 0.00 36.73 37.90 1otx h TYR 27 CO -0.05 0.74 0.11 0.82 -1.32 0.00 0.00 178.16 178.45 1otx h ILE 28 N 1.24 1.22 -0.37 1.81 2.04 -0.50 -0.02 117.51 122.94 1otx h ILE 28 Ca 0.33 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1otx h ILE 28 Cb -0.13 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1otx h ILE 28 CO -0.07 0.25 0.04 0.00 0.00 0.00 0.00 178.15 178.37 1otx h ALA 29 N 0.95 1.38 0.13 1.87 0.00 -0.80 0.12 119.26 122.93 1otx h ALA 29 Ca 0.12 -0.19 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 1otx h ALA 29 Cb 0.28 -0.16 0.03 0.00 0.00 0.00 0.00 17.79 17.94 1otx h ALA 29 CO -0.00 0.43 -1.27 0.93 0.00 0.00 0.00 179.25 179.35 1otx h GLU 30 N 0.54 0.59 0.12 0.00 5.08 -0.99 -2.83 114.58 117.08 1otx h GLU 30 Ca 0.12 -0.81 -0.31 0.00 -1.00 0.00 0.00 59.36 57.36 1otx h GLU 30 Cb 0.29 0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1otx h GLU 30 CO 0.01 1.37 -1.53 1.15 -1.00 0.00 0.00 179.01 179.00 1otx h THR 31 N 0.25 1.16 0.00 1.13 2.02 -0.88 -3.41 112.91 113.18 1otx h THR 31 Ca -0.19 -2.79 0.00 0.00 0.77 0.00 0.00 66.41 64.20 1otx h THR 31 Cb 1.94 2.77 0.00 0.00 -1.74 0.00 0.00 68.15 71.12 1otx h THR 31 CO 0.24 0.82 -1.20 0.49 0.37 0.00 0.00 175.52 176.24 1otx n PHE 32 N -3.47 0.00 -4.10 3.16 3.01 0.42 -5.03 117.46 111.44 1otx n PHE 32 Ca -0.16 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 57.94 1otx n PHE 32 Cb 1.05 -0.14 -0.07 0.00 -0.01 0.00 0.00 39.48 40.30 1otx n PHE 32 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1otx s LEU 33 N -3.35 3.99 0.04 4.37 1.43 -1.07 -4.72 118.68 119.37 1otx s LEU 33 Ca -0.02 0.27 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 1otx s LEU 33 Cb 0.05 -2.07 -0.05 0.00 0.03 0.00 0.00 46.19 44.15 1otx s LEU 33 CO 0.30 0.36 0.27 -1.61 0.23 0.00 0.00 176.35 175.89 1otx s GLU 34 N -1.21 3.55 -1.52 1.70 2.02 0.00 -4.27 118.70 118.98 1otx s GLU 34 Ca 0.17 -0.15 -0.01 0.00 0.02 0.00 0.00 54.97 55.00 1otx s GLU 34 Cb -0.12 -3.03 0.00 0.00 0.10 0.00 0.00 34.13 31.08 1otx s GLU 34 CO 0.07 0.61 0.08 -0.25 0.02 0.00 0.00 175.26 175.79 1otx n ASP 35 N 0.79 -5.24 -4.64 -0.19 9.92 -1.26 -1.12 116.55 114.80 1otx n ASP 35 Ca -0.09 0.01 -0.46 0.00 -0.53 0.00 0.00 54.79 53.72 1otx n ASP 35 Cb 0.52 -4.36 -0.04 0.00 -0.64 0.00 0.00 41.12 36.60 1otx n ASP 35 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1otx n ALA 36 N -2.30 0.61 -3.47 2.24 0.00 -1.26 -4.57 120.51 111.76 1otx n ALA 36 Ca -0.19 0.44 -0.21 0.00 0.00 0.00 0.00 53.44 53.48 1otx n ALA 36 Cb 0.65 -2.22 -0.16 0.00 0.00 0.00 0.00 19.45 17.72 1otx n ALA 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1otx s ARG 37 N -0.04 1.01 -0.00 0.00 3.52 -0.54 -4.94 118.95 117.95 1otx s ARG 37 Ca 0.73 -0.20 -0.30 0.00 -0.13 0.00 0.00 55.73 55.82 1otx s ARG 37 Cb -0.72 -0.94 -0.04 0.00 -1.56 0.00 0.00 34.95 31.68 1otx s ARG 37 CO 0.47 -0.02 1.23 -2.00 -0.81 0.00 0.00 175.30 174.18 1otx s GLU 38 N 0.69 4.37 0.00 5.12 2.12 -1.26 -1.20 118.70 128.55 1otx s GLU 38 Ca -0.11 1.76 0.03 0.00 0.36 0.00 0.00 54.97 57.01 1otx s GLU 38 Cb -0.13 -3.48 0.04 0.00 0.26 0.00 0.00 34.13 30.81 1otx s GLU 38 CO 0.01 -0.40 0.71 1.33 -0.54 0.00 0.00 175.26 176.37 1otx n VAL 39 N 4.37 0.24 -3.64 3.70 0.24 0.20 -4.96 118.33 118.48 1otx n VAL 39 Ca 0.11 -0.62 -0.09 0.00 -2.04 0.00 0.00 64.34 61.70 1otx n VAL 39 Cb 0.46 0.93 -0.07 0.00 -1.47 0.00 0.00 33.84 33.69 1otx n VAL 39 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1otx s ASN 40 N -0.43 -0.53 0.00 -1.34 2.47 -1.23 -4.33 114.94 109.55 1otx s ASN 40 Ca 0.04 0.97 0.00 0.00 0.42 0.00 0.00 52.86 54.30 1otx s ASN 40 Cb 0.03 1.04 0.00 0.00 -1.45 0.00 0.00 41.25 40.86 1otx s ASN 40 CO 0.04 -0.16 0.44 -0.46 -3.72 0.00 0.00 177.10 173.23 1otx n ASN 41 N 2.63 0.00 -4.73 -4.21 6.94 -1.26 -1.34 115.26 113.28 1otx n ASN 41 Ca -0.14 -1.00 -0.42 0.00 -0.02 0.00 0.00 54.58 53.00 1otx n ASN 41 Cb 0.56 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.97 1otx n ASN 41 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1otx n VAL 42 N 0.00 1.26 -1.59 3.53 0.31 -1.26 -0.37 118.33 120.20 1otx n VAL 42 Ca 0.00 -0.31 -0.14 0.00 -0.01 0.00 0.00 64.34 63.88 1otx n VAL 42 Cb 0.50 -1.85 -0.05 0.00 -0.91 0.00 0.00 33.84 31.52 1otx n VAL 42 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1otx n ARG 43 N 1.71 -1.45 -1.06 5.55 1.74 -1.26 -1.13 116.66 120.77 1otx n ARG 43 Ca 0.07 0.80 -0.02 0.00 -0.77 0.00 0.00 57.85 57.94 1otx n ARG 43 Cb 0.36 -5.13 -0.01 0.00 -1.02 0.00 0.00 32.46 26.67 1otx n ARG 43 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1otx n GLY 44 N -0.37 0.31 2.76 -0.13 0.00 0.50 -4.89 105.19 103.38 1otx n GLY 44 Ca -0.15 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1otx n GLY 44 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1otx n MET 45 N -0.28 3.15 -1.51 1.61 0.00 -0.28 -4.87 117.12 114.94 1otx n MET 45 Ca -0.02 -2.91 -0.55 0.00 0.00 0.00 0.00 57.70 54.21 1otx n MET 45 Cb 0.40 -3.15 -0.06 0.00 0.00 0.00 0.00 33.22 30.41 1otx n MET 45 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1otx n LEU 46 N 5.23 0.25 -4.16 -0.89 4.77 -1.25 -4.53 117.00 116.42 1otx n LEU 46 Ca 0.49 1.15 -0.20 0.00 -0.03 0.00 0.00 56.01 57.41 1otx n LEU 46 Cb 0.38 -1.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.33 1otx n LEU 46 CO 0.87 -1.86 -0.47 -0.83 -1.33 0.00 0.00 177.39 173.77 1otx s GLY 47 N -0.07 0.83 0.03 -0.72 0.00 -0.45 -2.67 107.32 104.26 1otx s GLY 47 Ca 0.84 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 44.67 1otx s GLY 47 CO 0.55 -0.84 0.02 -1.36 0.00 0.00 0.00 173.10 171.48 1otx s PHE 48 N -0.88 0.25 -0.07 1.90 0.08 0.21 -0.63 117.98 118.85 1otx s PHE 48 Ca 0.02 -0.54 -0.00 0.00 0.12 0.00 0.00 56.93 56.52 1otx s PHE 48 Cb -0.08 -0.19 0.03 0.00 -0.57 0.00 0.00 43.02 42.21 1otx s PHE 48 CO 0.01 -0.27 -0.02 0.99 -0.10 0.00 0.00 175.22 175.83 1otx s THR 49 N -2.08 0.48 0.00 0.64 2.01 -0.34 0.28 115.64 116.63 1otx s THR 49 Ca -0.10 0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.91 1otx s THR 49 Cb -0.05 -0.58 0.00 0.00 0.01 0.00 0.00 72.50 71.88 1otx s THR 49 CO -0.03 0.26 0.00 0.61 -0.69 0.00 0.00 174.62 174.77 1otx n GLY 50 N 4.75 5.37 2.89 4.40 0.00 0.38 -1.47 105.19 121.51 1otx n GLY 50 Ca -0.14 -1.05 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 1otx n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1otx s THR 51 N 1.09 0.14 -0.23 2.61 2.01 -0.28 -1.89 115.64 119.10 1otx s THR 51 Ca 0.00 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.95 1otx s THR 51 Cb 0.00 -0.15 0.06 0.00 0.01 0.00 0.00 72.50 72.42 1otx s THR 51 CO 0.00 0.06 -0.05 -0.47 -0.69 0.00 0.00 174.62 173.46 1otx s TYR 52 N 0.11 2.28 -1.59 4.92 6.14 0.11 -0.82 117.35 128.51 1otx s TYR 52 Ca -0.01 -1.66 -0.15 0.00 0.64 0.00 0.00 57.07 55.89 1otx s TYR 52 Cb -0.03 -1.54 0.11 0.00 0.42 0.00 0.00 41.96 40.93 1otx s TYR 52 CO -0.00 -0.76 0.91 1.63 0.64 0.00 0.00 175.55 177.97 1otx n LYS 53 N 4.70 -4.66 0.00 4.97 5.02 -1.26 -0.61 118.16 126.32 1otx n LYS 53 Ca -0.12 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 1otx n LYS 53 Cb 0.44 -5.34 0.00 0.00 -0.02 0.00 0.00 35.03 30.12 1otx n LYS 53 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1otx n GLY 54 N -1.59 2.30 3.76 0.72 0.00 -1.26 -5.04 105.19 104.08 1otx n GLY 54 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1otx n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1otx s ARG 55 N -0.54 4.31 -0.15 1.61 0.52 0.22 -5.01 118.95 119.91 1otx s ARG 55 Ca 0.00 0.72 -0.29 0.00 -0.52 0.00 0.00 55.73 55.64 1otx s ARG 55 Cb 0.00 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 32.10 1otx s ARG 55 CO 0.00 0.36 1.43 0.21 0.02 0.00 0.00 175.30 177.31 1otx s LYS 56 N -0.14 4.13 0.14 3.54 2.20 -1.26 0.09 119.74 128.43 1otx s LYS 56 Ca 0.31 1.78 0.07 0.00 -0.36 0.00 0.00 55.97 57.76 1otx s LYS 56 Cb -0.18 -3.88 -0.04 0.00 -1.51 0.00 0.00 37.83 32.23 1otx s LYS 56 CO 0.17 -0.86 -0.15 0.42 -0.36 0.00 0.00 175.35 174.56 1otx s ILE 57 N 3.96 1.47 0.07 5.43 -1.09 -0.79 -4.62 121.20 125.64 1otx s ILE 57 Ca 0.62 -1.81 0.05 0.00 -2.23 0.00 0.00 60.65 57.28 1otx s ILE 57 Cb -0.25 -1.65 -0.03 0.00 -1.58 0.00 0.00 42.46 38.95 1otx s ILE 57 CO 0.22 -0.41 -0.13 -0.44 -1.23 0.00 0.00 174.94 172.94 1otx s SER 58 N -2.58 1.60 -0.05 3.58 0.01 -1.10 -0.47 113.70 114.69 1otx s SER 58 Ca 0.12 -0.62 -0.02 0.00 1.31 0.00 0.00 55.95 56.74 1otx s SER 58 Cb -0.05 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.18 1otx s SER 58 CO 0.04 -0.10 0.10 0.54 0.41 0.00 0.00 173.24 174.23 1otx s VAL 59 N -1.33 -0.06 -0.18 3.43 0.11 0.14 -0.47 120.40 122.04 1otx s VAL 59 Ca -0.02 0.20 -0.16 0.00 -2.93 0.00 0.00 61.98 59.07 1otx s VAL 59 Cb -0.10 -0.18 0.05 0.00 -1.53 0.00 0.00 36.38 34.63 1otx s VAL 59 CO 0.02 0.08 0.48 -0.32 -3.33 0.00 0.00 175.10 172.03 1otx s MET 60 N 1.15 0.55 0.77 1.54 0.00 -0.65 0.64 119.30 123.31 1otx s MET 60 Ca -0.09 0.70 -0.11 0.00 0.00 0.00 0.00 55.69 56.19 1otx s MET 60 Cb -0.12 0.24 0.06 0.00 0.00 0.00 0.00 34.83 35.01 1otx s MET 60 CO -0.05 -0.08 1.10 0.20 0.00 0.00 0.00 175.02 176.20 1otx s GLY 61 N 0.40 1.76 0.00 2.11 0.00 -1.09 -3.81 107.32 106.68 1otx s GLY 61 Ca -0.01 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.06 1otx s GLY 61 CO -0.01 0.71 0.22 -2.39 0.00 0.00 0.00 173.10 171.63 1otx n HIS 62 N -3.44 0.00 -0.05 1.90 1.44 -0.39 -4.89 115.22 109.79 1otx n HIS 62 Ca 0.10 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.81 1otx n HIS 62 Cb 0.53 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.63 1otx n HIS 62 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1otx n GLY 63 N 0.36 -1.43 3.50 -1.39 0.00 -0.81 -2.92 105.19 102.52 1otx n GLY 63 Ca 0.00 -1.52 -0.38 0.00 0.00 0.00 0.00 46.02 44.12 1otx n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1otx s VAL 64 N -1.24 4.85 0.00 1.61 1.01 -1.26 -4.48 120.40 120.89 1otx s VAL 64 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1otx s VAL 64 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1otx s VAL 64 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1otx n GLY 65 N 5.01 1.21 0.09 4.51 0.00 -1.20 -4.30 105.19 110.51 1otx n GLY 65 Ca -0.14 -1.73 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 1otx n GLY 65 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1otx h ILE 66 N 0.00 1.05 -0.85 -0.61 2.04 -1.77 -2.36 117.51 115.00 1otx h ILE 66 Ca 0.00 -0.10 0.12 0.00 1.00 0.00 0.00 64.86 65.89 1otx h ILE 66 Cb 0.00 0.84 -0.08 0.00 -0.74 0.00 0.00 36.82 36.84 1otx h ILE 66 CO 0.00 0.04 0.47 -0.65 0.00 0.00 0.00 178.15 178.02 1otx h PRO 67 N 0.20 0.71 0.45 2.37 0.11 -1.91 0.23 132.00 134.16 1otx h PRO 67 Ca 0.05 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 1otx h PRO 67 Cb -0.01 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 30.94 1otx h PRO 67 CO -0.01 0.47 -0.22 1.03 -0.21 0.00 0.00 178.00 179.06 1otx h SER 68 N 0.73 -0.51 0.75 -2.05 0.87 -1.69 -2.89 113.55 108.76 1otx h SER 68 Ca 0.44 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 1otx h SER 68 Cb 0.52 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 1otx h SER 68 CO -0.30 -0.16 0.00 0.00 -0.53 0.00 0.00 176.83 175.84 1otx h SER 70 N 0.00 0.66 0.54 0.00 0.02 -0.88 -1.10 113.55 112.79 1otx h SER 70 Ca 0.00 -0.54 -0.02 0.00 -0.84 0.00 0.00 61.79 60.39 1otx h SER 70 Cb 0.38 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 1otx h SER 70 CO 0.00 1.07 -0.30 0.40 -1.14 0.00 0.00 176.83 176.86 1otx h ILE 71 N 0.27 0.39 -0.59 3.27 2.04 -1.23 -1.61 117.51 120.05 1otx h ILE 71 Ca 0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 1otx h ILE 71 Cb 0.94 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1otx h ILE 71 CO 0.08 0.00 0.20 1.88 0.00 0.00 0.00 178.15 180.31 1otx h TYR 72 N -0.78 0.93 -0.62 1.37 0.05 -1.57 -1.35 116.97 114.99 1otx h TYR 72 Ca -0.07 -0.09 -0.08 0.00 0.05 0.00 0.00 58.73 58.55 1otx h TYR 72 Cb 0.62 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 38.06 1otx h TYR 72 CO -0.07 0.77 0.08 1.79 -1.05 0.00 0.00 178.16 179.68 1otx h THR 73 N 0.83 1.26 0.46 -2.88 1.35 -1.22 -1.97 112.91 110.73 1otx h THR 73 Ca 0.19 -1.04 -0.02 0.00 -0.55 0.00 0.00 66.41 64.99 1otx h THR 73 Cb 0.26 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 1otx h THR 73 CO -0.01 0.38 -0.22 0.50 -0.25 0.00 0.00 175.52 175.92 1otx h LYS 74 N 0.96 -0.59 -0.97 4.72 3.11 -1.09 -1.55 116.57 121.17 1otx h LYS 74 Ca 0.19 0.04 0.10 0.00 -2.81 0.00 0.00 60.65 58.17 1otx h LYS 74 Cb 0.45 0.13 -0.08 0.00 -1.00 0.00 0.00 32.23 31.73 1otx h LYS 74 CO 0.02 -0.35 0.60 0.93 -2.81 0.00 0.00 179.45 177.84 1otx h GLU 75 N -0.71 0.96 -0.26 1.90 5.08 -1.20 -0.34 114.58 120.00 1otx h GLU 75 Ca -0.06 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1otx h GLU 75 Cb 0.52 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1otx h GLU 75 CO 0.10 0.63 0.07 -0.07 -1.00 0.00 0.00 179.01 178.74 1otx h LEU 76 N 0.98 0.39 -0.77 1.33 3.38 -1.24 -1.07 115.31 118.32 1otx h LEU 76 Ca 0.46 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 1otx h LEU 76 Cb 0.40 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1otx h LEU 76 CO -0.25 0.51 -0.01 0.40 0.09 0.00 0.00 178.44 179.18 1otx h ILE 77 N 0.25 1.26 0.00 1.22 2.04 -0.67 -2.12 117.51 119.49 1otx h ILE 77 Ca 0.08 -1.10 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 1otx h ILE 77 Cb 0.27 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1otx h ILE 77 CO 0.00 0.39 -1.36 0.35 0.00 0.00 0.00 178.15 177.54 1otx n THR 78 N -4.19 0.48 -0.02 -0.27 -2.24 -0.19 -4.24 114.28 103.61 1otx n THR 78 Ca 0.03 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1otx n THR 78 Cb 0.33 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1otx n THR 78 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1otx n ASP 79 N -2.57 0.26 -0.24 3.42 9.92 -0.41 -4.77 116.55 122.17 1otx n ASP 79 Ca -0.02 -0.62 0.05 0.00 -0.53 0.00 0.00 54.79 53.67 1otx n ASP 79 Cb 0.59 0.68 0.07 0.00 -0.64 0.00 0.00 41.12 41.82 1otx n ASP 79 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1otx n PHE 80 N -0.68 0.00 -2.09 1.24 3.01 -0.82 -4.25 117.46 113.87 1otx n PHE 80 Ca 0.00 -0.53 -0.15 0.00 1.01 0.00 0.00 57.45 57.78 1otx n PHE 80 Cb 0.00 -0.10 -0.03 0.00 -0.01 0.00 0.00 39.48 39.35 1otx n PHE 80 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1otx n GLY 81 N -0.75 0.16 3.66 1.37 0.00 -1.19 -4.64 105.19 103.81 1otx n GLY 81 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1otx n GLY 81 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1otx s VAL 82 N -2.60 4.21 -0.06 1.61 1.01 -1.09 -4.69 120.40 118.80 1otx s VAL 82 Ca 0.00 1.47 0.09 0.00 0.00 0.00 0.00 61.98 63.55 1otx s VAL 82 Cb 0.00 -3.95 -0.24 0.00 0.00 0.00 0.00 36.38 32.19 1otx s VAL 82 CO 0.00 -0.12 0.61 0.29 0.00 0.00 0.00 175.10 175.88 1otx n LYS 83 N 6.54 0.65 -4.37 2.72 4.76 0.94 -4.45 118.16 124.95 1otx n LYS 83 Ca 0.14 0.29 -0.20 0.00 -2.87 0.00 0.00 58.31 55.67 1otx n LYS 83 Cb 0.45 -1.78 -0.16 0.00 -1.84 0.00 0.00 35.03 31.70 1otx n LYS 83 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1otx s LYS 84 N -2.59 0.98 -0.15 1.97 1.02 -0.29 -1.63 119.74 119.05 1otx s LYS 84 Ca -0.08 -0.29 0.02 0.00 0.02 0.00 0.00 55.97 55.65 1otx s LYS 84 Cb 0.08 -0.91 0.01 0.00 -0.52 0.00 0.00 37.83 36.49 1otx s LYS 84 CO 0.82 0.09 -0.22 0.42 -0.92 0.00 0.00 175.35 175.54 1otx s ILE 85 N 0.29 2.06 -0.29 2.17 -1.09 -0.16 -0.84 121.20 123.33 1otx s ILE 85 Ca -0.05 -0.97 0.01 0.00 -2.23 0.00 0.00 60.65 57.41 1otx s ILE 85 Cb -0.09 -1.82 0.06 0.00 -1.58 0.00 0.00 42.46 39.02 1otx s ILE 85 CO 0.01 0.55 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.61 1otx s ILE 86 N 0.88 2.61 -0.13 2.92 1.01 -0.13 -1.20 121.20 127.16 1otx s ILE 86 Ca -0.05 -1.61 -0.27 0.00 0.00 0.00 0.00 60.65 58.72 1otx s ILE 86 Cb -0.15 -2.57 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 1otx s ILE 86 CO -0.03 -0.15 0.88 -0.60 0.00 0.00 0.00 174.94 175.03 1otx s ARG 87 N 1.15 4.37 -0.46 2.79 3.52 0.54 0.24 118.95 131.11 1otx s ARG 87 Ca -0.05 1.15 0.02 0.00 -0.13 0.00 0.00 55.73 56.72 1otx s ARG 87 Cb -0.20 -3.54 0.12 0.00 -1.56 0.00 0.00 34.95 29.77 1otx s ARG 87 CO -0.03 -0.26 0.21 0.14 -0.81 0.00 0.00 175.30 174.55 1otx s VAL 88 N 1.87 2.73 0.00 7.11 -7.23 -0.65 -0.09 120.40 124.13 1otx s VAL 88 Ca 0.42 -2.80 0.00 0.00 -1.81 0.00 0.00 61.98 57.79 1otx s VAL 88 Cb -0.18 -2.91 0.00 0.00 0.56 0.00 0.00 36.38 33.86 1otx s VAL 88 CO 0.16 -0.73 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 1otx n GLY 89 N 3.71 5.08 3.56 2.32 0.00 -0.44 -3.96 105.19 115.46 1otx n GLY 89 Ca 0.04 -1.89 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 1otx n GLY 89 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1otx s SER 90 N -0.25 4.25 0.31 1.61 1.04 -1.26 -0.67 113.70 118.72 1otx s SER 90 Ca 0.00 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 55.97 1otx s SER 90 Cb 0.00 -0.74 -0.02 0.00 0.10 0.00 0.00 66.02 65.36 1otx s SER 90 CO 0.00 0.16 0.33 0.00 0.98 0.00 0.00 173.24 174.71 1otx s GLY 92 N -3.26 1.58 0.36 0.00 0.00 -0.05 -1.13 107.32 104.81 1otx s GLY 92 Ca 0.36 -0.93 -0.10 0.00 0.00 0.00 0.00 44.72 44.05 1otx s GLY 92 CO 0.21 -0.57 0.71 0.00 0.00 0.00 0.00 173.10 173.45 1otx s ALA 93 N -0.42 3.42 0.00 3.20 0.00 0.26 0.69 121.76 128.90 1otx s ALA 93 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1otx s ALA 93 Cb -0.12 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1otx s ALA 93 CO 0.02 0.11 0.00 1.55 0.00 0.00 0.00 175.76 177.44 1otx n VAL 94 N -1.05 0.00 -3.15 0.00 3.14 -1.26 -0.97 118.33 115.04 1otx n VAL 94 Ca 0.02 -0.01 -0.39 0.00 -2.96 0.00 0.00 64.34 61.00 1otx n VAL 94 Cb 0.54 0.23 -0.06 0.00 -1.06 0.00 0.00 33.84 33.49 1otx n VAL 94 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1otx s LEU 95 N -1.15 4.55 0.18 6.55 1.43 -1.26 -4.86 118.68 124.12 1otx s LEU 95 Ca 0.00 1.42 -0.13 0.00 -1.03 0.00 0.00 54.13 54.39 1otx s LEU 95 Cb 0.00 -3.09 0.12 0.00 0.03 0.00 0.00 46.19 43.24 1otx s LEU 95 CO 0.00 0.24 1.82 -0.65 0.23 0.00 0.00 176.35 177.99 1otx h PRO 96 N 4.38 0.64 -0.97 1.29 0.11 -1.99 -2.59 132.00 132.87 1otx h PRO 96 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1otx h PRO 96 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1otx h PRO 96 CO 0.65 0.42 0.00 -2.39 -0.21 0.00 0.00 178.00 176.47 1otx n HIS 97 N -4.77 0.00 -3.91 0.65 1.44 -1.26 -4.59 115.22 102.77 1otx n HIS 97 Ca 0.04 -0.17 -0.28 0.00 -2.01 0.00 0.00 57.72 55.31 1otx n HIS 97 Cb 0.08 -0.14 -0.16 0.00 0.12 0.00 0.00 29.99 29.88 1otx n HIS 97 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1otx s VAL 98 N -0.55 1.18 0.31 0.61 1.01 -0.98 -5.14 120.40 116.84 1otx s VAL 98 Ca 0.00 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1otx s VAL 98 Cb 0.00 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.03 1otx s VAL 98 CO 0.00 0.19 0.02 -1.59 0.00 0.00 0.00 175.10 173.72 1otx s LYS 99 N 1.61 2.20 0.45 2.72 0.00 -1.26 -4.80 119.74 120.66 1otx s LYS 99 Ca 0.01 -1.57 -0.22 0.00 0.00 0.00 0.00 55.97 54.19 1otx s LYS 99 Cb -0.15 -2.06 -0.11 0.00 0.00 0.00 0.00 37.83 35.50 1otx s LYS 99 CO -0.08 0.24 0.63 1.28 0.00 0.00 0.00 175.35 177.41 1otx n LEU 100 N -0.95 0.60 0.00 2.77 4.32 -1.26 -1.89 117.00 120.59 1otx n LEU 100 Ca -0.05 0.90 0.00 0.00 -0.02 0.00 0.00 56.01 56.84 1otx n LEU 100 Cb 0.61 -1.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.24 1otx n LEU 100 CO 0.42 -2.67 0.00 0.54 -1.22 0.00 0.00 177.39 174.46 1otx n ARG 101 N 0.38 0.00 -1.94 3.23 1.74 0.38 -4.96 116.66 115.49 1otx n ARG 101 Ca 0.11 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.81 1otx n ARG 101 Cb 0.41 -1.75 0.02 0.00 -1.02 0.00 0.00 32.46 30.12 1otx n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1otx s ASP 102 N -3.50 5.58 -0.23 0.55 1.11 -0.79 -4.64 116.67 114.75 1otx s ASP 102 Ca 0.00 2.62 -0.06 0.00 0.18 0.00 0.00 52.55 55.29 1otx s ASP 102 Cb 0.00 -2.63 -0.02 0.00 1.07 0.00 0.00 42.92 41.34 1otx s ASP 102 CO 0.00 -1.34 0.03 -0.69 1.18 0.00 0.00 175.17 174.34 1otx s VAL 103 N -1.38 4.01 0.03 -1.27 1.01 -1.26 -0.75 120.40 120.79 1otx s VAL 103 Ca 0.69 -0.28 0.06 0.00 0.00 0.00 0.00 61.98 62.45 1otx s VAL 103 Cb -0.37 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1otx s VAL 103 CO 0.44 0.38 -0.15 0.68 0.00 0.00 0.00 175.10 176.45 1otx s VAL 104 N 1.47 3.03 -0.21 2.92 -7.23 0.59 -1.71 120.40 119.26 1otx s VAL 104 Ca 0.05 -1.07 -0.04 0.00 -1.81 0.00 0.00 61.98 59.11 1otx s VAL 104 Cb -0.15 -2.29 -0.02 0.00 0.56 0.00 0.00 36.38 34.49 1otx s VAL 104 CO 0.01 0.35 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.50 1otx s ILE 105 N -0.95 3.61 -0.95 -0.62 -1.09 0.11 -0.85 121.20 120.45 1otx s ILE 105 Ca 0.15 -0.42 -0.20 0.00 -2.23 0.00 0.00 60.65 57.96 1otx s ILE 105 Cb -0.11 -2.64 0.11 0.00 -1.58 0.00 0.00 42.46 38.25 1otx s ILE 105 CO 0.06 0.42 1.20 -0.83 -1.23 0.00 0.00 174.94 174.56 1otx s GLY 106 N 1.28 1.79 0.39 6.18 0.00 -0.34 -1.59 107.32 115.03 1otx s GLY 106 Ca 0.03 -2.66 0.10 0.00 0.00 0.00 0.00 44.72 42.19 1otx s GLY 106 CO -0.01 2.16 1.92 1.98 0.00 0.00 0.00 173.10 179.15 1otx h MET 107 N 9.03 0.20 -4.34 2.90 4.05 -1.30 -3.39 114.93 122.09 1otx h MET 107 Ca 0.17 -0.05 -0.19 0.00 -0.28 0.00 0.00 59.70 59.36 1otx h MET 107 Cb 1.02 -0.03 -0.14 0.00 -0.80 0.00 0.00 31.60 31.65 1otx h MET 107 CO 1.18 0.36 -0.52 0.20 0.23 0.00 0.00 176.91 178.35 1otx s GLY 108 N -4.07 1.10 -0.16 1.39 0.00 -1.15 -1.21 107.32 103.22 1otx s GLY 108 Ca -0.05 -1.44 -0.04 0.00 0.00 0.00 0.00 44.72 43.18 1otx s GLY 108 CO 0.73 -1.22 0.27 0.00 0.00 0.00 0.00 173.10 172.88 1otx s ALA 109 N -4.09 -0.54 0.70 3.20 0.00 0.45 -1.60 121.76 119.88 1otx s ALA 109 Ca 0.31 0.75 -0.10 0.00 0.00 0.00 0.00 51.96 52.92 1otx s ALA 109 Cb 0.06 -1.18 0.03 0.00 0.00 0.00 0.00 23.12 22.02 1otx s ALA 109 CO 0.08 -0.87 1.07 0.00 0.00 0.00 0.00 175.76 176.04 1otx s THR 111 N -3.32 0.00 -0.87 0.00 -1.32 -1.26 0.74 115.64 109.60 1otx s THR 111 Ca 0.58 -0.06 0.09 0.00 -1.21 0.00 0.00 61.69 61.09 1otx s THR 111 Cb -0.11 -1.09 0.21 0.00 -1.51 0.00 0.00 72.50 70.00 1otx s THR 111 CO 0.50 0.00 1.11 -0.90 -2.21 0.00 0.00 174.62 173.12 1otx n ASP 112 N -0.26 2.53 -4.82 8.08 3.85 -1.17 -4.96 116.55 119.80 1otx n ASP 112 Ca -0.08 -1.85 -0.30 0.00 -0.71 0.00 0.00 54.79 51.85 1otx n ASP 112 Cb 0.62 -0.15 0.09 0.00 -1.35 0.00 0.00 41.12 40.33 1otx n ASP 112 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 1otx s SER 113 N -0.95 4.45 0.00 -1.12 0.15 -1.26 -4.90 113.70 110.07 1otx s SER 113 Ca 0.17 1.15 0.15 0.00 0.70 0.00 0.00 55.95 58.12 1otx s SER 113 Cb 0.10 -1.83 -0.08 0.00 -1.71 0.00 0.00 66.02 62.50 1otx s SER 113 CO 0.13 -1.98 0.71 0.29 1.20 0.00 0.00 173.24 173.59 1otx n LYS 114 N -3.42 2.03 -0.20 5.44 5.02 -1.26 -4.72 118.16 121.04 1otx n LYS 114 Ca 0.07 -0.39 -0.06 0.00 -2.02 0.00 0.00 58.31 55.91 1otx n LYS 114 Cb 0.58 -1.21 -0.00 0.00 -0.02 0.00 0.00 35.03 34.38 1otx n LYS 114 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1otx h VAL 115 N 0.85 0.15 -0.28 -0.18 -1.51 -1.99 -0.40 116.25 112.89 1otx h VAL 115 Ca 0.00 0.00 -0.09 0.00 -1.23 0.00 0.00 66.70 65.38 1otx h VAL 115 Cb 0.42 0.15 -0.01 0.00 -2.13 0.00 0.00 31.29 29.72 1otx h VAL 115 CO 0.00 0.00 -0.21 0.78 -1.23 0.00 0.00 177.57 176.91 1otx h ASN 116 N -0.18 0.52 -0.38 4.19 -0.26 -1.93 -0.95 115.58 116.59 1otx h ASN 116 Ca 0.22 -0.16 -0.04 0.00 -0.56 0.00 0.00 56.30 55.76 1otx h ASN 116 Cb 0.55 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.65 1otx h ASN 116 CO -0.68 0.73 0.10 0.03 -1.06 0.00 0.00 177.43 176.56 1otx h ARG 117 N 0.46 0.68 -0.34 0.81 3.08 -1.57 0.82 114.38 118.33 1otx h ARG 117 Ca 0.07 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1otx h ARG 117 Cb 0.63 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1otx h ARG 117 CO 0.04 0.63 0.06 0.82 -1.07 0.00 0.00 179.97 180.45 1otx h ILE 118 N 0.66 1.23 0.00 2.04 2.04 -0.45 0.37 117.51 123.41 1otx h ILE 118 Ca 0.15 -0.80 -0.09 0.00 1.00 0.00 0.00 64.86 65.12 1otx h ILE 118 Cb 0.26 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1otx h ILE 118 CO -0.00 0.27 -0.44 0.03 0.00 0.00 0.00 178.15 178.01 1otx h ARG 119 N 0.39 0.00 -1.13 2.37 3.08 -0.02 -3.33 114.38 115.75 1otx h ARG 119 Ca 0.10 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.52 1otx h ARG 119 Cb 0.33 0.00 -0.35 0.00 0.08 0.00 0.00 29.97 30.03 1otx h ARG 119 CO 0.00 0.44 0.12 0.34 -1.07 0.00 0.00 179.97 179.80 1otx n PHE 120 N -3.83 3.06 -3.95 3.04 7.35 0.28 -4.93 117.46 118.47 1otx n PHE 120 Ca -0.01 -2.67 -0.32 0.00 -0.76 0.00 0.00 57.45 53.70 1otx n PHE 120 Cb 0.49 -0.86 -0.04 0.00 0.35 0.00 0.00 39.48 39.42 1otx n PHE 120 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1otx n LYS 121 N -0.74 -2.20 -1.26 -4.13 5.02 -1.14 0.13 118.16 113.83 1otx n LYS 121 Ca 0.52 0.25 -0.09 0.00 -2.02 0.00 0.00 58.31 56.97 1otx n LYS 121 Cb 0.70 -4.89 -0.04 0.00 -0.02 0.00 0.00 35.03 30.79 1otx n LYS 121 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1otx n ASP 122 N -2.35 -4.62 -2.11 4.39 4.64 0.13 -5.02 116.55 111.62 1otx n ASP 122 Ca 0.07 0.22 -0.01 0.00 -1.38 0.00 0.00 54.79 53.69 1otx n ASP 122 Cb 0.48 -2.91 0.00 0.00 -1.04 0.00 0.00 41.12 37.66 1otx n ASP 122 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 1otx n HIS 123 N -2.56 -3.09 -3.38 -0.67 8.25 0.12 -5.00 115.22 108.88 1otx n HIS 123 Ca -0.09 -0.08 -0.41 0.00 -0.26 0.00 0.00 57.72 56.89 1otx n HIS 123 Cb 0.38 -0.02 -0.09 0.00 1.12 0.00 0.00 29.99 31.38 1otx n HIS 123 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1otx s ASP 124 N -1.14 6.19 -0.21 0.41 -0.00 -1.26 -4.61 116.67 116.04 1otx s ASP 124 Ca 0.02 -0.22 -0.10 0.00 -0.00 0.00 0.00 52.55 52.26 1otx s ASP 124 Cb -0.00 -2.20 -0.05 0.00 -0.00 0.00 0.00 42.92 40.67 1otx s ASP 124 CO 0.02 -0.36 0.13 0.12 -0.00 0.00 0.00 175.17 175.07 1otx s PHE 125 N 2.06 3.33 -0.67 4.23 5.36 -1.26 -5.03 117.98 126.00 1otx s PHE 125 Ca 0.12 0.22 -0.24 0.00 -0.96 0.00 0.00 56.93 56.07 1otx s PHE 125 Cb -0.16 -2.19 0.06 0.00 -0.34 0.00 0.00 43.02 40.39 1otx s PHE 125 CO 0.12 0.16 1.05 0.00 -1.46 0.00 0.00 175.22 175.09 1otx s ALA 126 N 0.66 3.02 -0.48 11.12 0.00 -1.26 -4.95 121.76 129.86 1otx s ALA 126 Ca 0.07 -1.64 -0.27 0.00 0.00 0.00 0.00 51.96 50.12 1otx s ALA 126 Cb -0.12 -3.96 -0.04 0.00 0.00 0.00 0.00 23.12 19.00 1otx s ALA 126 CO 0.01 -2.88 2.03 0.00 0.00 0.00 0.00 175.76 174.92 1otx s ALA 127 N 4.53 2.22 0.09 0.00 0.00 -1.26 -4.94 121.76 122.39 1otx s ALA 127 Ca 0.27 -0.15 0.08 0.00 0.00 0.00 0.00 51.96 52.16 1otx s ALA 127 Cb -0.14 -4.23 -0.03 0.00 0.00 0.00 0.00 23.12 18.72 1otx s ALA 127 CO 0.13 -3.68 -0.20 0.96 0.00 0.00 0.00 175.76 172.96 1otx s ILE 128 N 9.39 1.63 0.96 0.00 -4.36 -1.26 -0.41 121.20 127.15 1otx s ILE 128 Ca 0.81 -1.44 -0.15 0.00 -0.26 0.00 0.00 60.65 59.61 1otx s ILE 128 Cb -0.18 -1.48 0.18 0.00 1.25 0.00 0.00 42.46 42.24 1otx s ILE 128 CO 0.26 -0.02 1.24 0.00 0.24 0.00 0.00 174.94 176.66 1otx s ALA 129 N -1.09 2.01 -0.23 2.27 0.00 -0.35 -4.88 121.76 119.49 1otx s ALA 129 Ca 0.06 -0.97 -0.26 0.00 0.00 0.00 0.00 51.96 50.79 1otx s ALA 129 Cb -0.10 -2.86 -0.00 0.00 0.00 0.00 0.00 23.12 20.16 1otx s ALA 129 CO 0.04 -2.44 0.91 0.34 0.00 0.00 0.00 175.76 174.60 1otx s ASP 130 N -4.56 6.95 0.23 0.00 -1.08 -0.97 -4.96 116.67 112.28 1otx s ASP 130 Ca 0.70 1.19 -0.12 0.00 -0.52 0.00 0.00 52.55 53.79 1otx s ASP 130 Cb -0.08 -2.48 0.30 0.00 -1.46 0.00 0.00 42.92 39.21 1otx s ASP 130 CO 0.53 -0.56 1.60 0.15 0.52 0.00 0.00 175.17 177.41 1otx h PHE 131 N 7.55 -0.45 -0.30 -5.34 3.57 -1.94 -0.34 116.94 119.68 1otx h PHE 131 Ca -0.22 0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.31 1otx h PHE 131 Cb 1.09 0.32 -0.02 0.00 2.79 0.00 0.00 35.95 40.13 1otx h PHE 131 CO 0.75 -0.33 0.02 -0.44 -2.23 0.00 0.00 178.31 176.07 1otx h ASP 132 N -0.01 0.41 -0.20 0.41 3.32 -1.98 0.43 116.42 118.80 1otx h ASP 132 Ca 0.36 -0.06 -0.16 0.00 0.02 0.00 0.00 57.03 57.19 1otx h ASP 132 Cb 0.56 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1otx h ASP 132 CO -0.78 0.46 -0.44 0.24 -1.72 0.00 0.00 179.24 177.00 1otx h MET 133 N 0.43 0.76 -0.46 3.56 2.86 -1.50 0.32 114.93 120.90 1otx h MET 133 Ca 0.10 -0.42 -0.10 0.00 -2.06 0.00 0.00 59.70 57.23 1otx h MET 133 Cb 0.26 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1otx h MET 133 CO 0.01 1.04 -0.09 0.28 1.06 0.00 0.00 176.91 179.21 1otx h VAL 134 N 0.61 1.27 -0.45 -2.22 2.07 -0.69 -1.20 116.25 115.64 1otx h VAL 134 Ca 0.04 -1.20 -0.08 0.00 0.82 0.00 0.00 66.70 66.28 1otx h VAL 134 Cb 1.00 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1otx h VAL 134 CO 0.09 0.41 -0.03 -0.09 0.02 0.00 0.00 177.57 177.97 1otx h ARG 135 N 0.71 0.82 -0.39 1.57 2.43 -0.74 -1.09 114.38 117.70 1otx h ARG 135 Ca 0.12 -0.28 0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1otx h ARG 135 Cb 0.63 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 1otx h ARG 135 CO 0.04 0.90 0.23 -0.91 -1.51 0.00 0.00 179.97 178.72 1otx h ASN 136 N 0.66 0.38 -0.84 -3.80 2.35 -0.24 -0.63 115.58 113.45 1otx h ASN 136 Ca 0.12 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1otx h ASN 136 Cb 0.55 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 1otx h ASN 136 CO 0.03 0.27 0.47 0.00 -1.65 0.00 0.00 177.43 176.55 1otx h ALA 137 N 1.17 1.08 -0.42 -0.83 0.00 -1.04 0.30 119.26 119.51 1otx h ALA 137 Ca 0.15 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1otx h ALA 137 Cb 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1otx h ALA 137 CO -0.07 0.59 -0.17 0.28 0.00 0.00 0.00 179.25 179.88 1otx h VAL 138 N 1.17 1.27 -0.20 0.00 2.07 -0.85 -1.40 116.25 118.30 1otx h VAL 138 Ca 0.30 -1.27 -0.20 0.00 0.82 0.00 0.00 66.70 66.35 1otx h VAL 138 Cb 0.02 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1otx h VAL 138 CO -0.05 0.43 -0.67 0.44 0.02 0.00 0.00 177.57 177.74 1otx h ASP 139 N 0.72 0.89 -0.32 0.57 3.45 -0.61 -2.66 116.42 118.45 1otx h ASP 139 Ca 0.11 -0.53 -0.04 0.00 0.43 0.00 0.00 57.03 56.99 1otx h ASP 139 Cb 0.68 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.17 1otx h ASP 139 CO 0.05 1.32 0.07 0.00 -1.57 0.00 0.00 179.24 179.11 1otx h ALA 140 N 0.68 1.36 -0.23 3.45 0.00 -0.28 -2.23 119.26 122.00 1otx h ALA 140 Ca -0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1otx h ALA 140 Cb 1.28 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1otx h ALA 140 CO 0.14 0.45 0.02 0.00 0.00 0.00 0.00 179.25 179.86 1otx h ALA 141 N 1.48 0.30 -0.62 0.00 0.00 -1.12 -2.49 119.26 116.82 1otx h ALA 141 Ca 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1otx h ALA 141 Cb 0.28 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1otx h ALA 141 CO 0.00 0.01 0.23 0.87 0.00 0.00 0.00 179.25 180.36 1otx h LYS 142 N 0.17 0.91 0.00 0.00 1.79 -1.27 -0.00 116.57 118.17 1otx h LYS 142 Ca 0.07 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1otx h LYS 142 Cb 0.37 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1otx h LYS 142 CO 0.01 0.76 0.00 0.00 -1.08 0.00 0.00 179.45 179.14 1otx h ALA 143 N 1.36 1.00 -0.01 3.86 0.00 -1.27 -2.01 119.26 122.19 1otx h ALA 143 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1otx h ALA 143 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1otx h ALA 143 CO -0.02 0.00 -0.77 1.28 0.00 0.00 0.00 179.25 179.75 1otx n LEU 144 N -2.82 1.28 0.00 0.00 4.77 -0.37 -4.96 117.00 114.91 1otx n LEU 144 Ca 0.01 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 1otx n LEU 144 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1otx n LEU 144 CO 0.24 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1otx n GLY 145 N 1.43 0.61 3.80 -0.72 0.00 -0.16 -5.02 105.19 105.14 1otx n GLY 145 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1otx n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1otx s ILE 146 N -2.52 4.56 0.26 -0.61 1.01 -0.47 -4.98 121.20 118.45 1otx s ILE 146 Ca 0.00 1.41 -0.20 0.00 0.00 0.00 0.00 60.65 61.87 1otx s ILE 146 Cb 0.00 -3.98 -0.09 0.00 0.01 0.00 0.00 42.46 38.40 1otx s ILE 146 CO 0.00 0.47 0.76 -1.81 0.00 0.00 0.00 174.94 174.35 1otx s ASP 147 N -1.25 7.03 -0.19 3.58 1.01 -1.26 -4.24 116.67 121.35 1otx s ASP 147 Ca 0.35 1.45 -0.07 0.00 0.71 0.00 0.00 52.55 54.98 1otx s ASP 147 Cb -0.20 -2.43 0.08 0.00 1.01 0.00 0.00 42.92 41.38 1otx s ASP 147 CO 0.22 -0.03 0.42 0.00 0.21 0.00 0.00 175.17 175.99 1otx s ALA 148 N -1.63 -1.14 0.07 5.23 0.00 -1.26 -4.25 121.76 118.77 1otx s ALA 148 Ca 0.46 1.52 -0.21 0.00 0.00 0.00 0.00 51.96 53.73 1otx s ALA 148 Cb -0.15 -1.25 -0.07 0.00 0.00 0.00 0.00 23.12 21.65 1otx s ALA 148 CO 0.20 -0.65 0.62 1.03 0.00 0.00 0.00 175.76 176.96 1otx s ARG 149 N 2.36 4.31 -0.11 0.00 0.52 -0.69 -4.90 118.95 120.43 1otx s ARG 149 Ca -0.03 0.83 -0.01 0.00 -0.52 0.00 0.00 55.73 56.00 1otx s ARG 149 Cb -0.11 -3.27 -0.03 0.00 0.52 0.00 0.00 34.95 32.06 1otx s ARG 149 CO -0.13 0.55 -0.08 0.08 0.02 0.00 0.00 175.30 175.74 1otx s VAL 150 N -0.85 3.59 -3.47 3.52 1.01 -1.26 0.04 120.40 122.98 1otx s VAL 150 Ca 0.31 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.80 1otx s VAL 150 Cb -0.20 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.66 1otx s VAL 150 CO 0.20 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.45 1otx n GLY 151 N 3.03 -0.56 3.80 4.51 0.00 -0.62 -4.94 105.19 110.41 1otx n GLY 151 Ca -0.18 -0.74 -0.38 0.00 0.00 0.00 0.00 46.02 44.72 1otx n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1otx s ASN 152 N -4.00 7.21 0.35 1.61 0.01 -1.26 -0.82 114.94 118.04 1otx s ASN 152 Ca 0.00 1.48 0.08 0.00 -0.71 0.00 0.00 52.86 53.71 1otx s ASN 152 Cb 0.00 -2.44 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 1otx s ASN 152 CO 0.00 0.17 0.11 -0.76 -1.51 0.00 0.00 177.10 175.11 1otx s LEU 153 N -1.40 3.17 -0.15 0.60 1.43 -0.63 -0.91 118.68 120.79 1otx s LEU 153 Ca 0.36 -0.86 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 1otx s LEU 153 Cb -0.20 -1.60 0.03 0.00 0.03 0.00 0.00 46.19 44.45 1otx s LEU 153 CO 0.23 -0.30 -0.11 0.12 0.23 0.00 0.00 176.35 176.52 1otx s PHE 154 N -2.47 1.98 -0.36 0.29 5.36 -0.47 0.74 117.98 123.04 1otx s PHE 154 Ca 0.37 -1.14 -0.18 0.00 -0.96 0.00 0.00 56.93 55.02 1otx s PHE 154 Cb -0.01 -1.48 0.00 0.00 -0.34 0.00 0.00 43.02 41.19 1otx s PHE 154 CO 0.22 -0.64 0.51 -1.12 -1.46 0.00 0.00 175.22 172.73 1otx s SER 155 N 1.55 6.30 -0.07 6.13 0.01 0.23 -0.55 113.70 127.30 1otx s SER 155 Ca 0.03 -0.12 -0.05 0.00 1.31 0.00 0.00 55.95 57.12 1otx s SER 155 Cb -0.14 -2.27 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1otx s SER 155 CO -0.09 -0.51 0.16 0.00 0.41 0.00 0.00 173.24 173.21 1otx s ALA 156 N 2.40 3.92 -0.10 1.44 0.00 0.18 -3.02 121.76 126.57 1otx s ALA 156 Ca 0.18 -0.69 0.15 0.00 0.00 0.00 0.00 51.96 51.60 1otx s ALA 156 Cb -0.15 -1.93 -0.08 0.00 0.00 0.00 0.00 23.12 20.95 1otx s ALA 156 CO 0.14 0.68 1.08 -0.44 0.00 0.00 0.00 175.76 177.22 1otx h ASP 157 N 4.44 0.00 -3.70 0.00 3.45 -1.90 -3.40 116.42 115.29 1otx h ASP 157 Ca -0.52 0.00 -0.66 0.00 0.43 0.00 0.00 57.03 56.27 1otx h ASP 157 Cb 1.21 0.00 -0.39 0.00 -0.56 0.00 0.00 39.33 39.59 1otx h ASP 157 CO 0.63 0.63 -0.72 -0.76 -1.57 0.00 0.00 179.24 177.45 1otx s LEU 158 N -6.14 4.58 0.42 1.55 1.43 -1.26 -4.93 118.68 114.33 1otx s LEU 158 Ca -0.00 -2.01 0.15 0.00 -1.03 0.00 0.00 54.13 51.24 1otx s LEU 158 Cb 0.08 -1.63 1.03 0.00 0.03 0.00 0.00 46.19 45.70 1otx s LEU 158 CO 0.79 -0.36 1.93 0.15 0.23 0.00 0.00 176.35 179.09 1otx h PHE 159 N 7.68 0.50 -2.76 0.29 3.04 -1.97 -2.01 116.94 121.71 1otx h PHE 159 Ca -0.07 0.01 -0.71 0.00 3.98 0.00 0.00 57.97 61.18 1otx h PHE 159 Cb 1.03 -0.16 -0.35 0.00 2.56 0.00 0.00 35.95 39.03 1otx h PHE 159 CO 0.50 0.20 0.09 0.66 -2.02 0.00 0.00 178.31 177.74 1otx n TYR 160 N -4.48 3.28 -2.24 0.41 4.01 -1.26 -5.05 117.16 111.82 1otx n TYR 160 Ca 0.14 -3.53 -0.42 0.00 -0.16 0.00 0.00 57.90 53.93 1otx n TYR 160 Cb 0.49 -0.99 -0.03 0.00 -0.31 0.00 0.00 39.34 38.50 1otx n TYR 160 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1otx s SER 161 N -1.59 6.91 0.00 7.72 0.15 -0.76 -4.90 113.70 121.23 1otx s SER 161 Ca 0.33 2.32 0.27 0.00 0.70 0.00 0.00 55.95 59.58 1otx s SER 161 Cb 0.05 -2.60 1.41 0.00 -1.71 0.00 0.00 66.02 63.18 1otx s SER 161 CO 0.01 -0.55 1.94 -0.81 1.20 0.00 0.00 173.24 175.03 1otx n PRO 162 N 3.18 0.45 -3.64 5.44 -0.04 -1.26 -4.42 135.00 134.71 1otx n PRO 162 Ca 0.08 0.03 -0.38 0.00 -0.04 0.00 0.00 63.50 63.18 1otx n PRO 162 Cb 0.43 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.31 1otx n PRO 162 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1otx s ASP 163 N -2.49 5.55 0.39 3.54 3.68 -1.26 -4.92 116.67 121.16 1otx s ASP 163 Ca 0.28 -2.88 0.20 0.00 2.13 0.00 0.00 52.55 52.27 1otx s ASP 163 Cb 0.18 -1.92 0.77 0.00 -1.45 0.00 0.00 42.92 40.50 1otx s ASP 163 CO 0.40 -0.39 1.78 1.23 0.13 0.00 0.00 175.17 178.31 1otx h GLY 164 N 7.10 0.00 2.00 2.66 0.00 -2.02 -3.04 103.07 109.77 1otx h GLY 164 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1otx h GLY 164 CO 0.72 0.00 -0.11 0.83 0.00 0.00 0.00 176.54 177.99 1otx h GLU 165 N 0.00 0.00 -0.11 4.80 5.08 -1.97 -2.37 114.58 120.01 1otx h GLU 165 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1otx h GLU 165 Cb 0.82 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 1otx h GLU 165 CO 0.04 0.11 0.07 1.98 -1.00 0.00 0.00 179.01 180.21 1otx h MET 166 N 0.00 0.14 0.00 2.33 4.05 -1.96 -1.00 114.93 118.49 1otx h MET 166 Ca -0.00 -0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.36 1otx h MET 166 Cb 0.23 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 1otx h MET 166 CO 0.01 0.10 -0.21 0.74 0.23 0.00 0.00 176.91 177.78 1otx h PHE 167 N 0.15 0.00 -0.35 1.39 0.05 -1.62 -0.37 116.94 116.19 1otx h PHE 167 Ca 0.04 0.00 -0.15 0.00 3.82 0.00 0.00 57.97 61.68 1otx h PHE 167 Cb -0.01 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.93 1otx h PHE 167 CO 0.00 0.21 -0.38 -0.44 -0.18 0.00 0.00 178.31 177.52 1otx h ASP 168 N 0.00 0.89 -0.46 2.17 3.45 -1.33 -0.89 116.42 120.25 1otx h ASP 168 Ca -0.00 -0.40 -0.08 0.00 0.43 0.00 0.00 57.03 56.98 1otx h ASP 168 Cb 0.39 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.90 1otx h ASP 168 CO 0.03 1.16 -0.01 0.58 -1.57 0.00 0.00 179.24 179.43 1otx h VAL 169 N 0.69 1.26 -0.45 -1.35 2.07 -1.20 -0.67 116.25 116.61 1otx h VAL 169 Ca 0.06 -1.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 1otx h VAL 169 Cb 0.95 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1otx h VAL 169 CO 0.09 0.37 0.28 0.24 0.02 0.00 0.00 177.57 178.57 1otx h MET 170 N 0.68 0.60 0.05 1.57 2.86 -0.92 -2.06 114.93 117.70 1otx h MET 170 Ca 0.13 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1otx h MET 170 Cb 0.52 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 1otx h MET 170 CO 0.03 0.43 -0.09 1.49 1.06 0.00 0.00 176.91 179.83 1otx h GLU 171 N 0.60 -0.16 -0.38 1.72 4.81 -0.92 -0.75 114.58 119.49 1otx h GLU 171 Ca 0.16 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.51 1otx h GLU 171 Cb -0.02 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1otx h GLU 171 CO -0.03 -0.11 0.28 -0.22 -0.73 0.00 0.00 179.01 178.20 1otx h LYS 172 N -0.17 0.00 -0.62 1.92 3.64 -0.86 0.16 116.57 120.64 1otx h LYS 172 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1otx h LYS 172 Cb 0.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1otx h LYS 172 CO -0.05 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.79 1otx n TYR 173 N -4.40 1.83 -2.43 1.91 4.01 -0.80 -4.96 117.16 112.34 1otx n TYR 173 Ca 0.06 -0.67 -0.18 0.00 -0.16 0.00 0.00 57.90 56.95 1otx n TYR 173 Cb 0.47 -0.39 -0.00 0.00 -0.31 0.00 0.00 39.34 39.10 1otx n TYR 173 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1otx n GLY 174 N 0.87 -0.35 3.70 2.72 0.00 0.04 -4.95 105.19 107.23 1otx n GLY 174 Ca 0.27 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1otx n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1otx s ILE 175 N -2.91 2.52 0.03 -0.61 -1.09 -0.35 -4.61 121.20 114.18 1otx s ILE 175 Ca 0.04 0.22 0.10 0.00 -2.23 0.00 0.00 60.65 58.78 1otx s ILE 175 Cb -0.02 -3.14 -0.15 0.00 -1.58 0.00 0.00 42.46 37.57 1otx s ILE 175 CO 0.05 0.01 1.24 -0.07 -1.23 0.00 0.00 174.94 174.94 1otx h LEU 176 N 7.69 0.00 -7.00 2.97 3.38 -1.37 -3.41 115.31 117.57 1otx h LEU 176 Ca -0.44 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 1otx h LEU 176 Cb 1.21 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.74 1otx h LEU 176 CO 0.94 0.87 0.21 -0.83 0.09 0.00 0.00 178.44 179.72 1otx s GLY 177 N -4.69 -0.49 -0.33 0.83 0.00 -1.26 -4.51 107.32 96.87 1otx s GLY 177 Ca 0.01 1.93 -0.11 0.00 0.00 0.00 0.00 44.72 46.55 1otx s GLY 177 CO 0.80 1.52 0.19 0.14 0.00 0.00 0.00 173.10 175.76 1otx s VAL 178 N -0.11 4.89 0.00 1.40 1.01 0.22 -1.37 120.40 126.43 1otx s VAL 178 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.59 1otx s VAL 178 Cb -0.04 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1otx s VAL 178 CO 0.02 0.02 0.00 -1.84 0.00 0.00 0.00 175.10 173.30 1otx n GLU 179 N 5.03 1.65 -0.97 2.72 -0.00 0.29 -0.87 120.64 128.49 1otx n GLU 179 Ca -0.13 0.00 0.02 0.00 -0.00 0.00 0.00 57.16 57.05 1otx n GLU 179 Cb 0.49 0.00 0.02 0.00 -0.00 0.00 0.00 31.44 31.95 1otx n GLU 179 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1otx n MET 180 N 0.00 0.09 0.00 3.44 2.81 -1.26 0.51 117.12 122.70 1otx n MET 180 Ca 0.00 -1.60 0.00 0.00 -1.81 0.00 0.00 57.70 54.29 1otx n MET 180 Cb 0.00 -0.32 0.00 0.00 -0.71 0.00 0.00 33.22 32.19 1otx n MET 180 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1otx n GLU 181 N 0.16 0.00 -0.06 0.03 4.71 -1.26 -2.27 120.64 121.95 1otx n GLU 181 Ca 0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.17 1otx n GLU 181 Cb 0.91 -0.37 -0.01 0.00 -1.01 0.00 0.00 31.44 30.96 1otx n GLU 181 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1otx n ALA 182 N -1.78 -0.09 -0.26 0.62 0.00 -1.26 0.63 120.51 118.38 1otx n ALA 182 Ca 0.00 0.12 0.22 0.00 0.00 0.00 0.00 53.44 53.78 1otx n ALA 182 Cb 0.01 0.16 0.55 0.00 0.00 0.00 0.00 19.45 20.16 1otx n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1otx h ALA 183 N -0.29 2.34 0.03 0.00 0.00 -1.83 0.15 119.26 119.65 1otx h ALA 183 Ca 0.02 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1otx h ALA 183 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1otx h ALA 183 CO -0.13 -0.65 -0.01 0.78 0.00 0.00 0.00 179.25 179.24 1otx h GLY 184 N 0.33 -0.04 0.66 0.00 0.00 -0.17 -0.98 103.07 102.88 1otx h GLY 184 Ca 0.50 0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.87 1otx h GLY 184 CO -0.18 -0.01 -0.09 -2.22 0.00 0.00 0.00 176.54 174.03 1otx h ILE 185 N -0.51 0.74 -0.27 2.60 1.08 -0.27 0.20 117.51 121.07 1otx h ILE 185 Ca -0.00 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.50 1otx h ILE 185 Cb 0.48 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 34.96 1otx h ILE 185 CO 0.01 0.00 0.18 1.88 -0.69 0.00 0.00 178.15 179.53 1otx h TYR 186 N -0.12 0.22 -0.21 1.37 0.99 -1.10 0.14 116.97 118.26 1otx h TYR 186 Ca 0.06 0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.72 1otx h TYR 186 Cb 0.21 -0.07 -0.00 0.00 1.00 0.00 0.00 36.73 37.86 1otx h TYR 186 CO -0.20 0.13 -0.16 0.78 -0.00 0.00 0.00 178.16 178.72 1otx h GLY 187 N 0.23 0.52 0.83 3.88 0.00 0.41 -2.89 103.07 106.04 1otx h GLY 187 Ca 0.11 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 1otx h GLY 187 CO -0.02 0.46 -0.01 -2.08 0.00 0.00 0.00 176.54 174.89 1otx h VAL 188 N 0.17 1.26 -0.63 4.60 2.07 0.36 -2.49 116.25 121.59 1otx h VAL 188 Ca 0.04 -0.91 0.09 0.00 0.82 0.00 0.00 66.70 66.75 1otx h VAL 188 Cb 0.68 1.43 -0.07 0.00 -1.52 0.00 0.00 31.29 31.81 1otx h VAL 188 CO 0.04 0.28 0.26 0.00 0.02 0.00 0.00 177.57 178.17 1otx h ALA 189 N 0.79 0.83 -0.43 1.67 0.00 -0.82 0.20 119.26 121.49 1otx h ALA 189 Ca 0.06 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1otx h ALA 189 Cb 0.42 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1otx h ALA 189 CO 0.01 -0.15 0.10 0.00 0.00 0.00 0.00 179.25 179.21 1otx h ALA 190 N 1.42 0.57 -0.44 0.00 0.00 -1.49 0.11 119.26 119.42 1otx h ALA 190 Ca 0.32 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1otx h ALA 190 Cb 0.37 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1otx h ALA 190 CO -0.29 0.26 -0.27 1.49 0.00 0.00 0.00 179.25 180.44 1otx h GLU 191 N 0.56 0.95 -0.45 0.00 4.81 -0.91 -3.25 114.58 116.30 1otx h GLU 191 Ca 0.13 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1otx h GLU 191 Cb 0.33 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1otx h GLU 191 CO 0.00 1.09 0.00 1.19 -0.73 0.00 0.00 179.01 180.57 1otx n PHE 192 N -4.09 0.58 -2.47 0.92 3.01 0.64 -5.01 117.46 111.03 1otx n PHE 192 Ca -0.01 -0.29 -0.06 0.00 1.01 0.00 0.00 57.45 58.11 1otx n PHE 192 Cb 0.48 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.98 1otx n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1otx n GLY 193 N 1.54 -0.47 1.11 1.37 0.00 0.18 -4.95 105.19 103.97 1otx n GLY 193 Ca 0.20 0.21 -0.06 0.00 0.00 0.00 0.00 46.02 46.38 1otx n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1otx n ALA 194 N -2.14 0.02 -2.55 4.61 0.00 -0.08 -5.04 120.51 115.33 1otx n ALA 194 Ca -0.03 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.60 1otx n ALA 194 Cb 0.55 0.47 -0.14 0.00 0.00 0.00 0.00 19.45 20.33 1otx n ALA 194 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1otx s LYS 195 N -2.34 1.22 0.05 0.00 1.02 -0.64 -4.48 119.74 114.57 1otx s LYS 195 Ca 0.11 -0.83 -0.06 0.00 0.02 0.00 0.00 55.97 55.21 1otx s LYS 195 Cb 0.00 -1.27 -0.01 0.00 -0.52 0.00 0.00 37.83 36.03 1otx s LYS 195 CO 0.08 0.33 0.11 0.00 -0.92 0.00 0.00 175.35 174.95 1otx s ALA 196 N -0.76 -0.05 -0.11 5.17 0.00 -1.26 -0.99 121.76 123.76 1otx s ALA 196 Ca 0.05 -0.64 -0.13 0.00 0.00 0.00 0.00 51.96 51.24 1otx s ALA 196 Cb -0.08 0.32 0.03 0.00 0.00 0.00 0.00 23.12 23.40 1otx s ALA 196 CO 0.01 -0.39 0.35 -1.17 0.00 0.00 0.00 175.76 174.56 1otx s LEU 197 N -2.46 0.68 -0.14 0.00 2.96 -0.34 -2.29 118.68 117.09 1otx s LEU 197 Ca -0.00 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.52 1otx s LEU 197 Cb 0.02 1.22 -0.00 0.00 0.50 0.00 0.00 46.19 47.93 1otx s LEU 197 CO -0.07 -0.18 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.73 1otx s THR 198 N -0.07 2.62 -0.09 3.68 2.01 -1.26 -0.34 115.64 122.20 1otx s THR 198 Ca -0.02 -0.80 0.04 0.00 0.31 0.00 0.00 61.69 61.22 1otx s THR 198 Cb -0.03 -2.09 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 1otx s THR 198 CO 0.01 0.53 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.61 1otx s ILE 199 N 0.63 2.22 0.06 1.82 1.01 0.87 -1.20 121.20 126.61 1otx s ILE 199 Ca -0.09 -0.98 0.05 0.00 0.00 0.00 0.00 60.65 59.64 1otx s ILE 199 Cb -0.16 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1otx s ILE 199 CO 0.03 0.56 -0.14 0.00 0.00 0.00 0.00 174.94 175.38 1otx s THR 201 N -1.10 4.05 -0.41 0.00 2.01 0.15 -0.30 115.64 120.03 1otx s THR 201 Ca -0.00 -0.28 -0.27 0.00 0.31 0.00 0.00 61.69 61.45 1otx s THR 201 Cb -0.09 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.54 1otx s THR 201 CO 0.02 0.42 2.07 -0.69 -0.69 0.00 0.00 174.62 175.75 1otx s VAL 202 N 1.05 3.22 -0.73 3.82 1.01 0.07 -1.85 120.40 126.98 1otx s VAL 202 Ca 0.02 0.19 0.24 0.00 0.00 0.00 0.00 61.98 62.43 1otx s VAL 202 Cb -0.14 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1otx s VAL 202 CO 0.02 -0.32 1.22 -1.54 0.00 0.00 0.00 175.10 174.47 1otx n SER 203 N 12.67 0.63 -3.48 3.32 3.41 -0.28 -0.47 113.62 129.41 1otx n SER 203 Ca 0.28 -0.13 -0.09 0.00 -0.26 0.00 0.00 58.87 58.66 1otx n SER 203 Cb 0.50 0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.88 1otx n SER 203 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1otx s ASP 204 N -3.77 -0.42 -0.21 4.04 -4.77 -1.19 -2.12 116.67 108.23 1otx s ASP 204 Ca 0.06 -0.00 -0.05 0.00 -3.30 0.00 0.00 52.55 49.26 1otx s ASP 204 Cb 0.15 0.44 -0.02 0.00 -1.09 0.00 0.00 42.92 42.40 1otx s ASP 204 CO 0.75 -0.71 0.00 -2.28 0.70 0.00 0.00 175.17 173.63 1otx s HIS 205 N -3.28 3.03 0.44 2.11 2.46 -1.13 -0.58 115.29 118.34 1otx s HIS 205 Ca 0.04 -0.52 0.16 0.00 0.47 0.00 0.00 55.06 55.20 1otx s HIS 205 Cb -0.01 -2.11 1.03 0.00 -0.13 0.00 0.00 32.58 31.36 1otx s HIS 205 CO -0.10 -0.30 1.99 0.82 -2.47 0.00 0.00 174.74 174.68 1otx h ILE 206 N 5.45 1.08 0.00 0.89 2.04 -1.37 0.02 117.51 125.62 1otx h ILE 206 Ca -0.37 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 64.76 1otx h ILE 206 Cb 1.18 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.61 1otx h ILE 206 CO 0.60 0.19 -0.46 0.03 0.00 0.00 0.00 178.15 178.51 1otx h ARG 207 N 0.00 0.00 0.00 2.37 2.47 -1.90 -3.40 114.38 113.92 1otx h ARG 207 Ca -0.00 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.58 1otx h ARG 207 Cb 0.35 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1otx h ARG 207 CO 0.02 0.54 -0.68 1.79 0.56 0.00 0.00 179.97 182.21 1otx h THR 208 N -1.00 1.20 -3.58 2.04 1.35 -1.93 -3.49 112.91 107.50 1otx h THR 208 Ca -0.10 -2.59 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 1otx h THR 208 Cb 0.74 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.69 1otx h THR 208 CO -0.06 0.66 -0.05 1.41 -0.25 0.00 0.00 175.52 177.23 1otx n HIS 209 N -3.32 -0.79 -3.67 4.73 8.25 -0.01 -5.03 115.22 115.38 1otx n HIS 209 Ca 0.01 0.31 -0.22 0.00 -0.26 0.00 0.00 57.72 57.56 1otx n HIS 209 Cb 0.79 -2.14 -0.18 0.00 1.12 0.00 0.00 29.99 29.57 1otx n HIS 209 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1otx s GLU 210 N -2.30 0.09 0.70 -0.41 2.02 -1.25 -4.93 118.70 112.61 1otx s GLU 210 Ca 0.03 0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.22 1otx s GLU 210 Cb -0.01 -0.99 0.13 0.00 0.10 0.00 0.00 34.13 33.36 1otx s GLU 210 CO 0.19 -0.43 0.96 -0.65 0.02 0.00 0.00 175.26 175.35 1otx s GLN 211 N 2.12 1.76 0.10 1.61 1.11 -1.26 -2.85 119.66 122.25 1otx s GLN 211 Ca 0.04 -1.29 -0.32 0.00 0.01 0.00 0.00 55.36 53.80 1otx s GLN 211 Cb -0.13 -2.40 -0.11 0.00 -1.01 0.00 0.00 33.01 29.35 1otx s GLN 211 CO -0.05 -1.36 1.80 0.25 0.01 0.00 0.00 175.29 175.94 1otx n THR 212 N -2.72 0.33 -4.23 -0.19 -2.24 -0.90 -4.88 114.28 99.45 1otx n THR 212 Ca 0.16 -0.06 -0.14 0.00 -2.27 0.00 0.00 64.05 61.74 1otx n THR 212 Cb 0.61 -1.99 -0.10 0.00 -2.10 0.00 0.00 70.33 66.75 1otx n THR 212 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1otx s THR 213 N 2.61 0.09 0.00 4.28 -1.32 -1.26 -5.05 115.64 114.99 1otx s THR 213 Ca 0.83 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.31 1otx s THR 213 Cb -0.54 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 67.93 1otx s THR 213 CO 0.39 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.80 1otx n ALA 214 N -0.34 0.00 1.37 11.08 0.00 -1.26 -3.54 120.51 127.82 1otx n ALA 214 Ca 0.02 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.60 1otx n ALA 214 Cb 0.66 0.00 0.49 0.00 0.00 0.00 0.00 19.45 20.60 1otx n ALA 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1otx n ALA 215 N 0.56 2.87 -0.09 0.00 0.00 -1.26 -4.10 120.51 118.49 1otx n ALA 215 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 53.44 52.98 1otx n ALA 215 Cb 0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 1otx n ALA 215 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1otx h GLU 216 N 1.25 0.40 -0.87 0.00 5.08 -2.03 -2.83 114.58 115.58 1otx h GLU 216 Ca 0.00 -0.03 0.23 0.00 -1.00 0.00 0.00 59.36 58.56 1otx h GLU 216 Cb 0.45 -0.09 -0.15 0.00 0.50 0.00 0.00 28.75 29.46 1otx h GLU 216 CO 0.00 0.28 0.13 0.07 -1.00 0.00 0.00 179.01 178.49 1otx h ARG 217 N 0.39 0.13 0.00 2.33 0.11 -1.71 -2.08 114.38 113.55 1otx h ARG 217 Ca 0.11 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.18 1otx h ARG 217 Cb -0.02 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.03 1otx h ARG 217 CO -0.02 0.08 0.00 0.94 0.10 0.00 0.00 179.97 181.07 1otx n GLN 218 N -5.32 0.00 -0.34 0.08 7.27 -1.07 0.44 117.38 118.45 1otx n GLN 218 Ca 0.20 0.49 0.15 0.00 0.07 0.00 0.00 57.00 57.90 1otx n GLN 218 Cb 0.64 -1.35 0.36 0.00 2.41 0.00 0.00 30.24 32.31 1otx n GLN 218 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 1otx h THR 219 N 0.00 0.69 -0.06 1.69 2.02 -1.59 1.20 112.91 116.86 1otx h THR 219 Ca 0.00 -0.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.84 1otx h THR 219 Cb 0.00 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.34 1otx h THR 219 CO 0.00 0.13 -0.46 0.74 0.37 0.00 0.00 175.52 176.29 1otx h THR 220 N 0.69 1.33 -0.31 3.16 2.02 -1.32 1.29 112.91 119.77 1otx h THR 220 Ca 0.57 -1.63 -0.12 0.00 0.77 0.00 0.00 66.41 66.00 1otx h THR 220 Cb 0.98 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 1otx h THR 220 CO -0.35 0.48 -0.27 0.15 0.37 0.00 0.00 175.52 175.90 1otx h PHE 221 N 0.11 0.87 0.00 3.16 -0.00 0.46 -2.37 116.94 119.17 1otx h PHE 221 Ca 0.01 -0.25 -0.07 0.00 -0.00 0.00 0.00 57.97 57.65 1otx h PHE 221 Cb 0.87 -0.19 -0.01 0.00 -0.00 0.00 0.00 35.95 36.62 1otx h PHE 221 CO 0.01 1.00 -0.33 -0.91 -0.00 0.00 0.00 178.31 178.07 1otx h ASN 222 N 0.49 0.00 0.01 0.41 2.35 0.22 -2.56 115.58 116.50 1otx h ASN 222 Ca 0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1otx h ASN 222 Cb 0.84 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.21 1otx h ASN 222 CO 0.07 0.33 -0.01 0.44 -1.65 0.00 0.00 177.43 176.62 1otx h ASP 223 N 0.00 -0.01 -0.47 5.81 3.32 0.20 0.29 116.42 125.57 1otx h ASP 223 Ca -0.00 -0.21 0.07 0.00 0.02 0.00 0.00 57.03 56.91 1otx h ASP 223 Cb 0.81 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.30 1otx h ASP 223 CO 0.04 0.20 0.12 -0.03 -1.72 0.00 0.00 179.24 177.86 1otx h MET 224 N -0.23 0.26 -0.40 3.56 4.05 -1.31 0.04 114.93 120.90 1otx h MET 224 Ca -0.00 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 1otx h MET 224 Cb 0.22 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.94 1otx h MET 224 CO 0.00 0.17 0.22 0.82 0.23 0.00 0.00 176.91 178.35 1otx h ILE 225 N 0.27 1.15 -0.43 1.77 1.08 -1.14 -0.76 117.51 119.45 1otx h ILE 225 Ca 0.23 -0.40 0.02 0.00 -0.39 0.00 0.00 64.86 64.31 1otx h ILE 225 Cb 0.27 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.69 1otx h ILE 225 CO -0.27 0.16 0.26 0.50 -0.69 0.00 0.00 178.15 178.11 1otx h LYS 226 N 0.51 0.51 -0.14 2.37 1.63 0.16 0.03 116.57 121.65 1otx h LYS 226 Ca 0.14 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1otx h LYS 226 Cb 0.07 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1otx h LYS 226 CO -0.02 0.34 0.09 0.82 -3.45 0.00 0.00 179.45 177.22 1otx h ILE 227 N 0.53 1.07 -0.45 2.00 2.04 -0.73 -0.04 117.51 121.93 1otx h ILE 227 Ca 0.17 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.87 1otx h ILE 227 Cb -0.00 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1otx h ILE 227 CO -0.07 0.07 0.26 0.00 0.00 0.00 0.00 178.15 178.40 1otx h ALA 228 N 1.01 0.58 -0.15 1.87 0.00 -0.88 -0.21 119.26 121.48 1otx h ALA 228 Ca 0.05 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1otx h ALA 228 Cb 0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1otx h ALA 228 CO -0.01 -0.07 0.02 -0.07 0.00 0.00 0.00 179.25 179.12 1otx h LEU 229 N 0.52 0.24 -0.42 0.00 3.38 -0.76 -2.91 115.31 115.35 1otx h LEU 229 Ca 0.19 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1otx h LEU 229 Cb 0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1otx h LEU 229 CO -0.10 0.44 0.19 -0.33 0.09 0.00 0.00 178.44 178.73 1otx h GLU 230 N 0.03 0.61 -0.41 1.13 4.39 -0.87 -2.20 114.58 117.25 1otx h GLU 230 Ca 0.05 -0.10 0.12 0.00 0.34 0.00 0.00 59.36 59.76 1otx h GLU 230 Cb 0.31 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1otx h GLU 230 CO 0.00 0.55 0.35 0.66 -1.16 0.00 0.00 179.01 179.41 1otx h SER 231 N 0.53 0.00 -0.27 1.42 4.64 -1.01 0.46 113.55 119.32 1otx h SER 231 Ca 0.14 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.31 1otx h SER 231 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1otx h SER 231 CO -0.02 0.00 -0.41 0.58 -0.87 0.00 0.00 176.83 176.12 1otx h VAL 232 N 0.00 1.28 -0.31 0.95 2.07 -1.19 -1.77 116.25 117.29 1otx h VAL 232 Ca 0.20 -1.58 -0.11 0.00 0.82 0.00 0.00 66.70 66.02 1otx h VAL 232 Cb 0.89 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1otx h VAL 232 CO -0.00 0.52 -0.22 -0.07 0.02 0.00 0.00 177.57 177.81 1otx h LEU 233 N 0.67 0.73 -1.39 2.57 3.38 -0.06 -2.38 115.31 118.83 1otx h LEU 233 Ca 0.05 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.59 1otx h LEU 233 Cb 0.98 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1otx h LEU 233 CO 0.09 1.01 0.42 -0.07 0.09 0.00 0.00 178.44 179.99 1otx h LEU 234 N 0.44 0.71 -1.03 1.67 4.07 -1.06 -1.41 115.31 118.72 1otx h LEU 234 Ca 0.06 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 1otx h LEU 234 Cb 0.78 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.33 1otx h LEU 234 CO 0.06 0.51 -0.28 1.23 -1.08 0.00 0.00 178.44 178.88 1otx h GLY 235 N 0.84 0.39 1.14 0.83 0.00 -1.09 -2.94 103.07 102.23 1otx h GLY 235 Ca 0.24 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 1otx h GLY 235 CO -0.06 0.29 0.04 -0.55 0.00 0.00 0.00 176.54 176.26 1otx h ASP 236 N 0.32 1.01 0.00 0.19 3.32 -0.74 -3.51 116.42 117.00 1otx h ASP 236 Ca 0.05 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.83 1otx h ASP 236 Cb 0.66 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1otx h ASP 236 CO 0.05 1.04 0.00 0.29 -1.72 0.00 0.00 179.24 178.90