#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pox h VAL 3 N 0.00 0.00 -3.48 0.44 -1.51 -1.98 -3.42 116.25 106.31 2pox h VAL 3 Ca 0.00 -0.53 -0.60 0.00 -1.23 0.00 0.00 66.70 64.34 2pox h VAL 3 Cb 0.00 1.46 -0.11 0.00 -2.13 0.00 0.00 31.29 30.52 2pox h VAL 3 CO 0.00 0.00 0.01 -0.63 -1.23 0.00 0.00 177.57 175.72 2pox s ILE 4 N -3.24 5.08 0.26 7.19 -1.09 -1.26 -5.00 121.20 123.14 2pox s ILE 4 Ca 0.07 0.99 0.07 0.00 -2.23 0.00 0.00 60.65 59.55 2pox s ILE 4 Cb 0.10 -3.86 -0.03 0.00 -1.58 0.00 0.00 42.46 37.08 2pox s ILE 4 CO 0.56 0.14 0.24 -0.54 -1.23 0.00 0.00 174.94 174.10 2pox s LYS 5 N 1.86 2.96 0.51 2.79 1.02 -1.26 -5.02 119.74 122.59 2pox s LYS 5 Ca 0.24 -1.05 0.19 0.00 0.02 0.00 0.00 55.97 55.37 2pox s LYS 5 Cb -0.16 -2.59 1.27 0.00 -0.52 0.00 0.00 37.83 35.83 2pox s LYS 5 CO 0.10 0.35 2.07 -1.35 -0.92 0.00 0.00 175.35 175.60 2pox h PRO 6 N 1.40 0.07 -4.34 -1.68 0.11 -1.98 -3.40 132.00 122.19 2pox h PRO 6 Ca -0.48 -0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.06 2pox h PRO 6 Cb 1.24 -0.02 -0.37 0.00 0.11 0.00 0.00 31.00 31.96 2pox h PRO 6 CO 0.60 0.05 -0.81 -0.51 -0.21 0.00 0.00 178.00 177.12 2pox s ASP 7 N -6.67 2.63 0.40 -2.05 1.11 -1.26 -3.98 116.67 106.85 2pox s ASP 7 Ca -0.05 -0.52 0.07 0.00 0.18 0.00 0.00 52.55 52.23 2pox s ASP 7 Cb 0.18 -0.98 -0.08 0.00 1.07 0.00 0.00 42.92 43.12 2pox s ASP 7 CO 0.70 -0.13 0.01 -0.04 1.18 0.00 0.00 175.17 176.90 2pox s MET 8 N 1.60 1.97 0.37 8.23 -1.94 -0.64 -5.00 119.30 123.89 2pox s MET 8 Ca 0.03 -2.06 0.08 0.00 -1.71 0.00 0.00 55.69 52.03 2pox s MET 8 Cb -0.14 -1.68 -0.06 0.00 2.01 0.00 0.00 34.83 34.96 2pox s MET 8 CO -0.09 -0.03 0.03 0.15 -0.01 0.00 0.00 175.02 175.08 2pox s LYS 9 N -3.72 2.06 -0.02 2.03 1.02 -0.29 -2.05 119.74 118.77 2pox s LYS 9 Ca 0.35 -1.85 0.01 0.00 0.02 0.00 0.00 55.97 54.50 2pox s LYS 9 Cb 0.08 -1.86 0.01 0.00 -0.52 0.00 0.00 37.83 35.54 2pox s LYS 9 CO 0.18 0.05 -0.03 0.42 -0.92 0.00 0.00 175.35 175.06 2pox s ILE 10 N -2.58 0.30 0.00 2.17 1.01 0.18 -0.73 121.20 121.56 2pox s ILE 10 Ca 0.36 -0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.98 2pox s ILE 10 Cb 0.03 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.16 2pox s ILE 10 CO 0.19 0.14 -0.13 -0.54 0.00 0.00 0.00 174.94 174.60 2pox s LYS 11 N 0.50 1.02 0.01 2.79 1.02 -0.21 -0.69 119.74 124.19 2pox s LYS 11 Ca -0.05 -0.53 -0.14 0.00 0.02 0.00 0.00 55.97 55.27 2pox s LYS 11 Cb -0.09 -1.00 0.02 0.00 -0.52 0.00 0.00 37.83 36.25 2pox s LYS 11 CO -0.01 0.27 0.29 -0.48 -0.92 0.00 0.00 175.35 174.50 2pox s LEU 12 N -0.50 0.95 -0.04 3.17 0.05 -0.37 -1.07 118.68 120.87 2pox s LEU 12 Ca 0.04 -0.07 0.01 0.00 0.05 0.00 0.00 54.13 54.16 2pox s LEU 12 Cb -0.06 1.24 0.02 0.00 -2.05 0.00 0.00 46.19 45.34 2pox s LEU 12 CO -0.00 -0.51 -0.03 -0.60 -0.55 0.00 0.00 176.35 174.66 2pox s ARG 13 N -1.87 0.62 -0.15 1.48 3.52 -0.92 -1.53 118.95 120.10 2pox s ARG 13 Ca -0.10 -0.04 -0.01 0.00 -0.13 0.00 0.00 55.73 55.45 2pox s ARG 13 Cb -0.03 -0.68 -0.02 0.00 -1.56 0.00 0.00 34.95 32.66 2pox s ARG 13 CO 0.01 -0.09 -0.10 1.41 -0.81 0.00 0.00 175.30 175.72 2pox s MET 14 N 0.91 3.43 -0.03 5.12 -2.45 0.81 -1.40 119.30 125.68 2pox s MET 14 Ca -0.11 -0.64 0.05 0.00 -1.25 0.00 0.00 55.69 53.73 2pox s MET 14 Cb -0.14 -2.75 -0.03 0.00 1.25 0.00 0.00 34.83 33.16 2pox s MET 14 CO -0.00 0.14 -0.17 -1.21 1.05 0.00 0.00 175.02 174.83 2pox s GLU 15 N 0.57 2.37 0.23 4.11 2.02 -0.47 -1.05 118.70 126.48 2pox s GLU 15 Ca -0.06 -0.78 -0.18 0.00 0.02 0.00 0.00 54.97 53.97 2pox s GLU 15 Cb -0.15 -2.30 0.07 0.00 0.10 0.00 0.00 34.13 31.85 2pox s GLU 15 CO 0.03 0.60 0.89 0.41 0.02 0.00 0.00 175.26 177.21 2pox n GLY 16 N 2.21 0.78 3.27 -1.39 0.00 -0.72 -1.30 105.19 108.04 2pox n GLY 16 Ca -0.17 -1.17 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 2pox n GLY 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pox s ALA 17 N -1.97 -0.92 -0.08 4.61 0.00 -0.05 -0.85 121.76 122.50 2pox s ALA 17 Ca 0.19 0.61 0.02 0.00 0.00 0.00 0.00 51.96 52.77 2pox s ALA 17 Cb -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.00 2pox s ALA 17 CO 0.07 -0.25 -0.12 0.08 0.00 0.00 0.00 175.76 175.54 2pox s VAL 18 N -0.94 1.20 -1.27 0.00 1.01 -0.84 -0.84 120.40 118.72 2pox s VAL 18 Ca -0.10 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.32 2pox s VAL 18 Cb -0.04 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.27 2pox s VAL 18 CO 0.04 0.38 0.42 0.59 0.00 0.00 0.00 175.10 176.53 2pox n ASN 19 N 4.07 -4.04 0.00 3.32 4.13 0.72 -1.09 115.26 122.37 2pox n ASN 19 Ca -0.20 -0.27 0.00 0.00 1.68 0.00 0.00 54.58 55.78 2pox n ASN 19 Cb 0.51 -3.34 0.00 0.00 -1.54 0.00 0.00 39.78 35.41 2pox n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2pox n GLY 20 N -1.15 0.85 3.47 7.41 0.00 -1.26 -5.02 105.19 109.48 2pox n GLY 20 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2pox n GLY 20 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2pox s HIS 21 N -3.33 3.20 0.57 1.61 3.76 -0.25 -5.05 115.29 115.80 2pox s HIS 21 Ca 0.00 -0.46 -0.16 0.00 -0.15 0.00 0.00 55.06 54.29 2pox s HIS 21 Cb 0.00 -2.41 -0.05 0.00 1.11 0.00 0.00 32.58 31.22 2pox s HIS 21 CO 0.00 -0.44 1.02 -1.25 -0.85 0.00 0.00 174.74 173.23 2pox s PRO 22 N 1.65 3.60 0.26 8.40 0.04 -1.26 -1.98 135.00 145.71 2pox s PRO 22 Ca 0.05 1.05 -0.17 0.00 0.04 0.00 0.00 61.00 61.97 2pox s PRO 22 Cb -0.17 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.30 2pox s PRO 22 CO 0.08 -0.57 0.59 -0.59 0.04 0.00 0.00 177.00 176.55 2pox s PHE 23 N -2.61 0.08 -0.08 0.56 -0.12 -0.03 -4.29 117.98 111.49 2pox s PHE 23 Ca 0.61 -0.48 -0.11 0.00 -0.05 0.00 0.00 56.93 56.89 2pox s PHE 23 Cb -0.13 0.43 0.02 0.00 -0.63 0.00 0.00 43.02 42.72 2pox s PHE 23 CO 0.36 -1.09 0.28 0.00 -0.05 0.00 0.00 175.22 174.72 2pox s ALA 24 N -3.96 -0.70 -0.01 1.99 0.00 -0.57 -1.75 121.76 116.75 2pox s ALA 24 Ca 0.16 0.64 0.01 0.00 0.00 0.00 0.00 51.96 52.77 2pox s ALA 24 Cb -0.03 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2pox s ALA 24 CO 0.07 -0.17 -0.02 0.42 0.00 0.00 0.00 175.76 176.06 2pox s ILE 25 N -0.28 0.22 0.10 0.00 1.01 -0.22 -0.25 121.20 121.79 2pox s ILE 25 Ca -0.04 -0.06 0.08 0.00 0.00 0.00 0.00 60.65 60.63 2pox s ILE 25 Cb -0.03 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.17 2pox s ILE 25 CO 0.01 0.09 -0.17 -1.61 0.00 0.00 0.00 174.94 173.26 2pox s GLU 26 N 0.29 1.86 0.04 2.79 2.02 -0.53 -0.14 118.70 125.04 2pox s GLU 26 Ca -0.03 -1.13 0.02 0.00 0.02 0.00 0.00 54.97 53.85 2pox s GLU 26 Cb -0.05 -2.14 -0.02 0.00 0.10 0.00 0.00 34.13 32.01 2pox s GLU 26 CO -0.01 0.49 -0.08 0.20 0.02 0.00 0.00 175.26 175.89 2pox s GLY 27 N -2.03 0.51 -0.02 -1.39 0.00 -0.58 -0.57 107.32 103.25 2pox s GLY 27 Ca 0.18 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.16 2pox s GLY 27 CO 0.10 -0.82 -0.08 -1.34 0.00 0.00 0.00 173.10 170.96 2pox s VAL 28 N -1.37 0.71 0.18 1.40 -7.23 -0.76 -1.24 120.40 112.09 2pox s VAL 28 Ca -0.10 -0.33 -0.03 0.00 -1.81 0.00 0.00 61.98 59.71 2pox s VAL 28 Cb -0.10 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.22 2pox s VAL 28 CO 0.00 0.22 0.30 0.61 -0.31 0.00 0.00 175.10 175.93 2pox n GLY 29 N 3.25 2.17 3.14 2.32 0.00 0.13 -0.72 105.19 115.48 2pox n GLY 29 Ca -0.18 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.40 2pox n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pox s LEU 30 N 0.00 1.53 0.19 0.99 2.01 -0.35 -0.64 118.68 122.39 2pox s LEU 30 Ca 0.11 -0.34 -0.15 0.00 0.01 0.00 0.00 54.13 53.77 2pox s LEU 30 Cb -0.01 0.78 0.02 0.00 0.01 0.00 0.00 46.19 46.98 2pox s LEU 30 CO 0.08 -0.47 0.45 -0.83 1.01 0.00 0.00 176.35 176.59 2pox s GLY 31 N -1.82 0.09 -0.42 -3.19 0.00 -0.87 -1.25 107.32 99.86 2pox s GLY 31 Ca -0.09 -0.43 0.03 0.00 0.00 0.00 0.00 44.72 44.23 2pox s GLY 31 CO -0.02 -0.44 0.15 0.54 0.00 0.00 0.00 173.10 173.33 2pox s LYS 32 N -3.90 1.73 0.41 2.90 1.02 0.73 -1.62 119.74 121.02 2pox s LYS 32 Ca 0.12 -2.18 0.10 0.00 0.02 0.00 0.00 55.97 54.03 2pox s LYS 32 Cb 0.00 -3.29 0.88 0.00 -0.52 0.00 0.00 37.83 34.90 2pox s LYS 32 CO -0.02 -1.02 1.98 -1.35 -0.92 0.00 0.00 175.35 174.02 2pox h PRO 33 N 7.20 0.26 0.00 -1.68 0.11 -1.78 -0.42 132.00 135.68 2pox h PRO 33 Ca -0.06 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2pox h PRO 33 Cb 0.97 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.04 2pox h PRO 33 CO 0.60 0.31 -0.22 1.19 -0.21 0.00 0.00 178.00 179.67 2pox n PHE 34 N -4.36 0.61 0.70 0.65 3.01 -1.26 -3.09 117.46 113.73 2pox n PHE 34 Ca -0.00 0.18 0.10 0.00 1.01 0.00 0.00 57.45 58.74 2pox n PHE 34 Cb 0.20 -0.74 -0.13 0.00 -0.01 0.00 0.00 39.48 38.80 2pox n PHE 34 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2pox n GLU 35 N -2.05 0.28 -3.09 -1.08 1.02 -0.86 -4.73 120.64 110.13 2pox n GLU 35 Ca 0.05 -0.05 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 2pox n GLU 35 Cb 0.41 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.40 2pox n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pox n GLY 36 N 1.43 -0.01 3.07 0.62 0.00 -0.22 -4.61 105.19 105.46 2pox n GLY 36 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 2pox n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pox s LYS 37 N -5.51 0.54 0.12 1.61 -2.85 -1.03 -0.98 119.74 111.64 2pox s LYS 37 Ca 0.25 -1.04 -0.24 0.00 -1.00 0.00 0.00 55.97 53.93 2pox s LYS 37 Cb -0.11 0.13 0.07 0.00 -2.06 0.00 0.00 37.83 35.86 2pox s LYS 37 CO 0.46 -0.08 0.61 1.14 0.10 0.00 0.00 175.35 177.58 2pox s GLN 38 N -3.15 1.23 0.06 1.78 -2.07 -0.41 -0.19 119.66 116.91 2pox s GLN 38 Ca 0.00 -0.33 -0.11 0.00 -1.82 0.00 0.00 55.36 53.11 2pox s GLN 38 Cb 0.02 0.57 0.01 0.00 -1.09 0.00 0.00 33.01 32.52 2pox s GLN 38 CO -0.07 -0.51 0.24 -1.54 -1.32 0.00 0.00 175.29 172.09 2pox s SER 39 N -2.44 -0.01 0.05 12.60 1.04 -0.38 -1.37 113.70 123.20 2pox s SER 39 Ca -0.01 -0.39 -0.20 0.00 0.48 0.00 0.00 55.95 55.83 2pox s SER 39 Cb -0.01 0.34 0.05 0.00 0.10 0.00 0.00 66.02 66.50 2pox s SER 39 CO -0.08 -0.64 0.48 0.00 0.98 0.00 0.00 173.24 173.97 2pox s MET 40 N -3.00 1.00 -0.18 4.02 0.23 -0.07 -1.21 119.30 120.09 2pox s MET 40 Ca -0.02 -0.32 -0.04 0.00 -1.03 0.00 0.00 55.69 54.28 2pox s MET 40 Cb 0.01 0.45 -0.03 0.00 -1.53 0.00 0.00 34.83 33.74 2pox s MET 40 CO -0.06 -0.36 -0.02 -0.51 -2.03 0.00 0.00 175.02 172.04 2pox s ASP 41 N -2.06 4.82 -0.04 -1.18 1.01 0.11 -0.86 116.67 118.47 2pox s ASP 41 Ca -0.04 -0.16 0.05 0.00 0.71 0.00 0.00 52.55 53.11 2pox s ASP 41 Cb -0.01 -1.80 -0.03 0.00 1.01 0.00 0.00 42.92 42.10 2pox s ASP 41 CO -0.03 0.12 -0.17 -0.76 0.21 0.00 0.00 175.17 174.54 2pox s LEU 42 N 0.64 2.57 -0.06 1.23 1.43 0.71 -1.82 118.68 123.37 2pox s LEU 42 Ca -0.01 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2pox s LEU 42 Cb -0.14 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.59 2pox s LEU 42 CO 0.02 0.33 -0.07 -0.54 0.23 0.00 0.00 176.35 176.32 2pox s LYS 43 N -0.77 1.22 -0.07 1.70 1.02 0.27 -1.49 119.74 121.61 2pox s LYS 43 Ca 0.11 -0.22 -0.30 0.00 0.02 0.00 0.00 55.97 55.59 2pox s LYS 43 Cb -0.10 -1.15 -0.03 0.00 -0.52 0.00 0.00 37.83 36.02 2pox s LYS 43 CO 0.01 -0.08 1.31 0.08 -0.92 0.00 0.00 175.35 175.75 2pox s VAL 44 N 1.00 4.06 -0.20 3.17 1.01 -0.42 -1.45 120.40 127.57 2pox s VAL 44 Ca -0.09 1.36 0.15 0.00 0.00 0.00 0.00 61.98 63.40 2pox s VAL 44 Cb -0.14 -3.88 -0.23 0.00 0.00 0.00 0.00 36.38 32.13 2pox s VAL 44 CO -0.00 -0.05 0.02 0.29 0.00 0.00 0.00 175.10 175.36 2pox n LYS 45 N 5.85 0.81 -3.89 2.72 4.76 0.66 -4.96 118.16 124.11 2pox n LYS 45 Ca 0.13 0.01 -0.11 0.00 -2.87 0.00 0.00 58.31 55.47 2pox n LYS 45 Cb 0.45 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.03 2pox n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2pox s GLU 46 N -2.47 0.37 0.00 1.97 2.02 -0.90 -4.90 118.70 114.79 2pox s GLU 46 Ca -0.13 -0.32 0.00 0.00 0.02 0.00 0.00 54.97 54.54 2pox s GLU 46 Cb 0.06 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.44 2pox s GLU 46 CO 0.76 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 176.37 2pox n GLY 47 N 1.83 0.66 3.88 -1.39 0.00 -1.26 -1.51 105.19 107.40 2pox n GLY 47 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 2pox n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pox s GLY 48 N -1.97 1.89 0.21 -0.02 0.00 -1.26 -3.81 107.32 102.36 2pox s GLY 48 Ca 0.00 -0.20 -0.30 0.00 0.00 0.00 0.00 44.72 44.22 2pox s GLY 48 CO 0.00 -0.00 1.20 2.56 0.00 0.00 0.00 173.10 176.86 2pox s PRO 49 N -4.02 4.49 0.14 2.90 0.04 -1.26 -5.07 135.00 132.23 2pox s PRO 49 Ca 0.52 1.90 -0.33 0.00 0.04 0.00 0.00 61.00 63.13 2pox s PRO 49 Cb -0.10 -3.22 -0.12 0.00 0.04 0.00 0.00 34.50 31.09 2pox s PRO 49 CO 0.34 -0.07 1.73 1.28 0.04 0.00 0.00 177.00 180.32 2pox n LEU 50 N 2.26 3.69 -0.45 -3.56 4.77 -1.25 -4.87 117.00 117.59 2pox n LEU 50 Ca 0.04 1.04 0.03 0.00 -0.03 0.00 0.00 56.01 57.08 2pox n LEU 50 Cb 0.44 -1.50 0.09 0.00 -2.33 0.00 0.00 43.42 40.12 2pox n LEU 50 CO 0.56 0.02 0.55 -0.81 -1.33 0.00 0.00 177.39 176.38 2pox n PRO 51 N 4.56 1.56 -4.24 3.23 -0.04 -1.26 -4.91 135.00 133.89 2pox n PRO 51 Ca 0.17 -0.75 -0.14 0.00 -0.04 0.00 0.00 63.50 62.75 2pox n PRO 51 Cb 0.33 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 2pox n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2pox s PHE 52 N -1.69 1.23 0.07 0.54 -0.12 -1.26 -4.69 117.98 112.06 2pox s PHE 52 Ca 0.14 -1.07 -0.30 0.00 -0.05 0.00 0.00 56.93 55.64 2pox s PHE 52 Cb 0.08 -0.70 -0.09 0.00 -0.63 0.00 0.00 43.02 41.67 2pox s PHE 52 CO 0.08 -0.26 1.84 0.00 -0.05 0.00 0.00 175.22 176.82 2pox s ALA 53 N -3.71 3.67 0.50 1.99 0.00 0.59 -4.88 121.76 119.91 2pox s ALA 53 Ca 0.26 1.32 0.20 0.00 0.00 0.00 0.00 51.96 53.74 2pox s ALA 53 Cb 0.06 -3.78 1.32 0.00 0.00 0.00 0.00 23.12 20.73 2pox s ALA 53 CO 0.05 -1.35 2.11 -0.92 0.00 0.00 0.00 175.76 175.65 2pox h TYR 54 N 9.38 0.00 -0.54 0.00 3.20 -1.96 -2.74 116.97 124.32 2pox h TYR 54 Ca -0.46 0.00 0.16 0.00 3.14 0.00 0.00 58.73 61.56 2pox h TYR 54 Cb 1.22 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.47 2pox h TYR 54 CO 0.86 0.08 0.43 -0.44 -1.64 0.00 0.00 178.16 177.45 2pox h ASP 55 N 0.00 0.00 0.41 -2.11 3.32 -1.96 0.26 116.42 116.34 2pox h ASP 55 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pox h ASP 55 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2pox h ASP 55 CO 0.01 0.00 0.00 0.16 -1.72 0.00 0.00 179.24 177.69 2pox h ILE 56 N 0.00 0.00 0.00 0.35 3.07 -1.88 -3.01 117.51 116.03 2pox h ILE 56 Ca 0.26 -0.20 -0.16 0.00 1.55 0.00 0.00 64.86 66.31 2pox h ILE 56 Cb 1.12 1.15 -0.03 0.00 -0.27 0.00 0.00 36.82 38.79 2pox h ILE 56 CO -0.00 0.00 -1.62 0.18 -1.05 0.00 0.00 178.15 175.66 2pox n LEU 57 N -2.99 0.60 -0.09 0.16 4.77 0.08 -4.65 117.00 114.89 2pox n LEU 57 Ca -0.01 0.26 -0.05 0.00 -0.03 0.00 0.00 56.01 56.18 2pox n LEU 57 Cb 0.16 0.12 0.15 0.00 -2.33 0.00 0.00 43.42 41.52 2pox n LEU 57 CO 0.22 0.15 0.82 0.71 -1.33 0.00 0.00 177.39 177.96 2pox h THR 58 N 0.00 1.25 0.00 -5.08 1.35 -1.54 -0.50 112.91 108.38 2pox h THR 58 Ca -0.18 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 2pox h THR 58 Cb 1.55 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 2pox h THR 58 CO 0.03 0.38 0.00 0.35 -0.25 0.00 0.00 175.52 176.03 2pox n THR 59 N -4.18 0.49 0.10 6.82 -2.24 -1.26 -2.44 114.28 111.57 2pox n THR 59 Ca 0.02 0.12 -0.21 0.00 -2.27 0.00 0.00 64.05 61.71 2pox n THR 59 Cb 0.34 -0.75 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 2pox n THR 59 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2pox h VAL 60 N 0.00 1.17 0.00 2.28 2.07 -1.38 -3.45 116.25 116.93 2pox h VAL 60 Ca 0.00 -2.72 -0.22 0.00 0.82 0.00 0.00 66.70 64.58 2pox h VAL 60 Cb 0.35 2.86 0.01 0.00 -1.52 0.00 0.00 31.29 32.99 2pox h VAL 60 CO 0.00 0.84 1.74 0.49 0.02 0.00 0.00 177.57 180.66 2pox n PHE 61 N -3.58 0.74 0.00 1.57 0.99 -1.02 -5.01 117.46 111.15 2pox n PHE 61 Ca -0.18 -1.30 0.00 0.00 -0.00 0.00 0.00 57.45 55.97 2pox n PHE 61 Cb 1.07 -1.22 0.00 0.00 -1.00 0.00 0.00 39.48 38.33 2pox n PHE 61 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2pox n ASN 65 N 4.21 0.00 0.00 4.37 5.15 -1.26 -5.13 115.26 122.60 2pox n ASN 65 Ca 0.27 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.28 2pox n ASN 65 Cb 0.12 0.00 0.21 0.00 -0.53 0.00 0.00 39.78 39.58 2pox n ASN 65 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2pox n ARG 66 N 0.00 0.29 0.28 1.20 5.12 -1.26 -2.19 116.66 120.09 2pox n ARG 66 Ca 0.00 0.00 0.18 0.00 -1.93 0.00 0.00 57.85 56.10 2pox n ARG 66 Cb 0.00 -1.38 0.78 0.00 -1.16 0.00 0.00 32.46 30.70 2pox n ARG 66 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2pox h VAL 67 N 0.00 0.00 -0.81 1.55 2.07 -1.96 -2.70 116.25 114.40 2pox h VAL 67 Ca 0.00 -0.39 -0.49 0.00 0.82 0.00 0.00 66.70 66.64 2pox h VAL 67 Cb 0.00 1.37 -0.24 0.00 -1.52 0.00 0.00 31.29 30.89 2pox h VAL 67 CO 0.00 0.00 0.62 0.49 0.02 0.00 0.00 177.57 178.70 2pox n PHE 68 N -3.03 2.57 -4.63 1.57 3.01 -0.93 -4.62 117.46 111.41 2pox n PHE 68 Ca -0.00 -2.10 -0.33 0.00 1.01 0.00 0.00 57.45 56.02 2pox n PHE 68 Cb 0.25 -1.04 -0.12 0.00 -0.01 0.00 0.00 39.48 38.56 2pox n PHE 68 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2pox s ALA 69 N -2.89 2.88 -0.28 4.37 0.00 -1.02 -3.80 121.76 121.02 2pox s ALA 69 Ca 0.50 -0.88 -0.29 0.00 0.00 0.00 0.00 51.96 51.28 2pox s ALA 69 Cb 0.40 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 22.25 2pox s ALA 69 CO 0.04 0.42 1.12 0.21 0.00 0.00 0.00 175.76 177.55 2pox s LYS 70 N -0.27 4.09 -0.15 0.00 2.20 -0.38 -4.63 119.74 120.59 2pox s LYS 70 Ca 0.03 1.21 -0.07 0.00 -0.36 0.00 0.00 55.97 56.79 2pox s LYS 70 Cb -0.13 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 2pox s LYS 70 CO 0.03 -0.87 0.08 0.71 -0.36 0.00 0.00 175.35 174.94 2pox s TYR 71 N 3.67 3.34 0.90 4.03 2.02 -1.26 -0.71 117.35 129.34 2pox s TYR 71 Ca 0.48 0.23 -0.12 0.00 -0.37 0.00 0.00 57.07 57.29 2pox s TYR 71 Cb -0.14 -2.01 0.13 0.00 -0.40 0.00 0.00 41.96 39.54 2pox s TYR 71 CO 0.15 0.36 1.12 -1.25 -1.57 0.00 0.00 175.55 174.36 2pox s PRO 72 N -0.15 1.20 0.49 -1.71 0.04 -1.26 -4.94 135.00 128.67 2pox s PRO 72 Ca 0.08 0.39 0.28 0.00 0.04 0.00 0.00 61.00 61.79 2pox s PRO 72 Cb -0.12 -1.84 1.18 0.00 0.04 0.00 0.00 34.50 33.77 2pox s PRO 72 CO 0.01 -2.18 1.93 1.49 0.04 0.00 0.00 177.00 178.29 2pox h GLU 73 N -1.49 0.00 -0.31 4.56 4.81 -1.99 -2.85 114.58 117.31 2pox h GLU 73 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2pox h GLU 73 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 2pox h GLU 73 CO 0.61 0.14 0.00 0.27 -0.73 0.00 0.00 179.01 179.30 2pox n ASN 74 N -3.34 2.17 -4.16 1.04 6.94 -1.26 -4.79 115.26 111.86 2pox n ASN 74 Ca -0.00 -1.87 -0.31 0.00 -0.02 0.00 0.00 54.58 52.37 2pox n ASN 74 Cb 0.35 -0.20 -0.17 0.00 -2.36 0.00 0.00 39.78 37.40 2pox n ASN 74 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2pox s ILE 75 N -1.59 1.91 0.15 1.53 1.01 -1.08 -5.08 121.20 118.05 2pox s ILE 75 Ca 0.32 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 59.75 2pox s ILE 75 Cb 0.17 -1.69 -0.10 0.00 0.01 0.00 0.00 42.46 40.85 2pox s ILE 75 CO 0.24 0.52 1.64 -0.69 0.00 0.00 0.00 174.94 176.65 2pox s VAL 76 N 0.71 2.59 -0.71 2.92 1.01 -1.26 -4.70 120.40 120.96 2pox s VAL 76 Ca -0.11 0.34 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 2pox s VAL 76 Cb -0.16 -3.22 0.18 0.00 0.00 0.00 0.00 36.38 33.18 2pox s VAL 76 CO 0.01 0.02 0.65 -0.62 0.00 0.00 0.00 175.10 175.16 2pox s ASP 77 N 1.56 6.50 0.32 3.32 -1.08 -1.26 -4.65 116.67 121.39 2pox s ASP 77 Ca 0.73 -2.34 0.05 0.00 -0.52 0.00 0.00 52.55 50.47 2pox s ASP 77 Cb -0.44 -2.20 0.67 0.00 -1.46 0.00 0.00 42.92 39.49 2pox s ASP 77 CO 0.32 -0.68 1.88 0.22 0.52 0.00 0.00 175.17 177.43 2pox h TYR 78 N 8.20 0.96 0.01 -5.34 3.20 -1.93 -2.52 116.97 119.55 2pox h TYR 78 Ca -0.06 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 2pox h TYR 78 Cb 1.06 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.03 2pox h TYR 78 CO 0.91 0.41 -0.07 0.74 -1.64 0.00 0.00 178.16 178.51 2pox h PHE 79 N 0.86 0.06 -0.22 -3.82 -1.00 -1.91 -3.04 116.94 107.87 2pox h PHE 79 Ca 0.43 -0.04 -0.06 0.00 2.81 0.00 0.00 57.97 61.12 2pox h PHE 79 Cb 0.49 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.03 2pox h PHE 79 CO -0.00 0.95 -0.13 0.87 -1.61 0.00 0.00 178.31 178.39 2pox h LYS 80 N -0.85 0.37 0.00 1.51 1.57 -1.89 -2.19 116.57 115.08 2pox h LYS 80 Ca -0.01 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 2pox h LYS 80 Cb 0.98 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.24 2pox h LYS 80 CO 0.01 0.50 -0.09 1.96 -0.57 0.00 0.00 179.45 181.26 2pox h GLN 81 N 0.34 0.00 0.00 3.15 4.20 -1.50 -3.12 115.11 118.18 2pox h GLN 81 Ca 0.07 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2pox h GLN 81 Cb 0.44 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 2pox h GLN 81 CO 0.03 0.09 -0.11 0.66 -0.67 0.00 0.00 178.83 178.83 2pox h SER 82 N 0.00 0.00 -3.90 1.46 4.64 -1.27 -3.45 113.55 111.04 2pox h SER 82 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2pox h SER 82 Cb 0.19 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2pox h SER 82 CO 0.01 0.11 0.22 -0.36 -0.87 0.00 0.00 176.83 175.94 2pox s PHE 83 N -3.54 3.46 0.14 4.77 0.40 -1.18 -0.23 117.98 121.80 2pox s PHE 83 Ca 0.02 1.22 0.34 0.00 -0.60 0.00 0.00 56.93 57.91 2pox s PHE 83 Cb 0.09 -2.59 1.41 0.00 0.51 0.00 0.00 43.02 42.44 2pox s PHE 83 CO 0.61 -0.21 2.00 -1.00 0.70 0.00 0.00 175.22 177.32 2pox h PRO 84 N 1.15 0.00 -0.70 0.24 0.13 -1.90 -3.45 132.00 127.47 2pox h PRO 84 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2pox h PRO 84 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2pox h PRO 84 CO 0.63 0.01 0.30 0.93 -0.23 0.00 0.00 178.00 179.64 2pox h GLU 85 N 0.00 1.02 0.00 0.86 3.07 -1.87 -3.39 114.58 114.28 2pox h GLU 85 Ca -0.00 -0.16 0.00 0.00 -0.50 0.00 0.00 59.36 58.70 2pox h GLU 85 Cb 0.49 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2pox h GLU 85 CO 0.00 0.82 0.00 0.41 -1.40 0.00 0.00 179.01 178.84 2pox n GLY 86 N -1.00 -1.79 3.69 -3.84 0.00 0.68 -4.80 105.19 98.14 2pox n GLY 86 Ca 0.06 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 2pox n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2pox s TYR 87 N 0.00 -0.15 0.18 1.61 1.13 -1.12 -0.81 117.35 118.19 2pox s TYR 87 Ca 0.00 -0.24 0.06 0.00 -1.41 0.00 0.00 57.07 55.48 2pox s TYR 87 Cb 0.00 0.55 -0.05 0.00 -1.10 0.00 0.00 41.96 41.37 2pox s TYR 87 CO 0.00 -1.08 -0.13 -1.54 -2.51 0.00 0.00 175.55 170.29 2pox s SER 88 N -2.90 2.27 0.05 -0.18 1.04 -0.37 -1.34 113.70 112.28 2pox s SER 88 Ca 0.11 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 55.53 2pox s SER 88 Cb -0.04 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.97 2pox s SER 88 CO 0.02 -0.23 -0.06 -1.66 0.98 0.00 0.00 173.24 172.29 2pox s TRP 89 N -3.11 0.62 0.02 5.02 1.48 0.19 -0.59 118.94 122.57 2pox s TRP 89 Ca 0.20 -0.73 0.05 0.00 -1.06 0.00 0.00 56.10 54.56 2pox s TRP 89 Cb 0.01 -0.39 -0.02 0.00 -1.16 0.00 0.00 33.47 31.91 2pox s TRP 89 CO 0.04 -0.18 -0.16 -1.21 -4.06 0.00 0.00 176.95 171.38 2pox s GLU 90 N -2.65 1.19 -0.12 3.25 2.02 -0.54 -1.22 118.70 120.65 2pox s GLU 90 Ca -0.02 -0.71 -0.10 0.00 0.02 0.00 0.00 54.97 54.16 2pox s GLU 90 Cb -0.02 -1.20 0.03 0.00 0.10 0.00 0.00 34.13 33.04 2pox s GLU 90 CO -0.03 0.32 0.31 0.50 0.02 0.00 0.00 175.26 176.37 2pox s ARG 91 N -0.78 0.35 -0.08 1.61 3.52 0.02 -0.49 118.95 123.10 2pox s ARG 91 Ca 0.05 0.44 -0.00 0.00 -0.13 0.00 0.00 55.73 56.09 2pox s ARG 91 Cb -0.07 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 2pox s ARG 91 CO 0.00 -0.05 -0.05 -1.54 -0.81 0.00 0.00 175.30 172.86 2pox s SER 92 N 0.23 4.80 -0.29 -2.12 1.04 -0.33 -1.03 113.70 116.00 2pox s SER 92 Ca -0.01 0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.45 2pox s SER 92 Cb -0.03 -1.28 0.08 0.00 0.10 0.00 0.00 66.02 64.90 2pox s SER 92 CO -0.00 0.36 0.03 -0.04 0.98 0.00 0.00 173.24 174.56 2pox s MET 93 N -0.76 1.29 -0.43 4.02 -1.94 0.43 -1.14 119.30 120.77 2pox s MET 93 Ca 0.12 -1.28 -0.10 0.00 -1.71 0.00 0.00 55.69 52.71 2pox s MET 93 Cb -0.11 -2.59 0.08 0.00 2.01 0.00 0.00 34.83 34.21 2pox s MET 93 CO 0.02 -0.82 0.29 1.21 -0.01 0.00 0.00 175.02 175.70 2pox s ASN 94 N 1.32 5.74 0.42 3.03 3.84 -0.37 -1.06 114.94 127.85 2pox s ASN 94 Ca 0.04 -1.46 -0.18 0.00 0.21 0.00 0.00 52.86 51.47 2pox s ASN 94 Cb -0.18 -2.03 -0.09 0.00 -0.55 0.00 0.00 41.25 38.39 2pox s ASN 94 CO -0.13 -0.56 0.89 -0.31 -2.79 0.00 0.00 177.10 174.20 2pox s TYR 95 N 1.47 3.37 0.51 0.43 1.51 0.76 -1.13 117.35 124.26 2pox s TYR 95 Ca 0.03 1.43 0.33 0.00 -1.01 0.00 0.00 57.07 57.86 2pox s TYR 95 Cb -0.23 -2.72 1.81 0.00 -0.11 0.00 0.00 41.96 40.70 2pox s TYR 95 CO 0.03 -0.11 2.20 1.05 -1.11 0.00 0.00 175.55 177.61 2pox h GLU 96 N 1.75 0.00 -0.53 -0.62 4.11 -1.47 -0.88 114.58 116.94 2pox h GLU 96 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2pox h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2pox h GLU 96 CO 0.62 0.04 0.00 -0.40 0.07 0.00 0.00 179.01 179.35 2pox n ASP 97 N -3.52 2.87 0.00 3.06 5.75 -1.26 -4.91 116.55 118.55 2pox n ASP 97 Ca -0.02 -2.11 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 2pox n ASP 97 Cb 0.15 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.87 2pox n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pox n GLY 98 N 1.13 0.56 3.75 6.12 0.00 -0.34 -4.81 105.19 111.60 2pox n GLY 98 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2pox n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pox s GLY 99 N -1.98 2.26 -0.05 -0.02 0.00 -1.18 -4.78 107.32 101.57 2pox s GLY 99 Ca 0.00 1.53 0.01 0.00 0.00 0.00 0.00 44.72 46.26 2pox s GLY 99 CO 0.00 2.46 -0.03 -0.42 0.00 0.00 0.00 173.10 175.11 2pox s ILE 100 N -0.16 0.45 -0.12 0.90 1.01 -0.86 -0.17 121.20 122.25 2pox s ILE 100 Ca 0.61 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 61.22 2pox s ILE 100 Cb -0.47 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.48 2pox s ILE 100 CO 0.49 0.22 -0.16 0.00 0.00 0.00 0.00 174.94 175.49 2pox s ASN 102 N 0.35 4.98 0.05 0.00 0.01 0.16 -0.43 114.94 120.06 2pox s ASN 102 Ca -0.13 -0.01 0.01 0.00 -0.71 0.00 0.00 52.86 52.02 2pox s ASN 102 Cb -0.16 -1.59 -0.03 0.00 0.41 0.00 0.00 41.25 39.87 2pox s ASN 102 CO 0.06 0.27 -0.05 0.00 -1.51 0.00 0.00 177.10 175.88 2pox s ALA 103 N -0.23 0.47 0.04 0.60 0.00 -0.20 -0.45 121.76 121.99 2pox s ALA 103 Ca 0.05 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.10 2pox s ALA 103 Cb -0.13 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 2pox s ALA 103 CO 0.02 -0.19 -0.07 0.95 0.00 0.00 0.00 175.76 176.47 2pox s THR 104 N -2.45 0.44 -0.04 0.00 -4.23 -0.68 -0.80 115.64 107.88 2pox s THR 104 Ca -0.04 -1.05 -0.01 0.00 -1.18 0.00 0.00 61.69 59.41 2pox s THR 104 Cb -0.03 -0.54 0.03 0.00 1.34 0.00 0.00 72.50 73.30 2pox s THR 104 CO -0.04 -0.41 0.03 0.21 -0.54 0.00 0.00 174.62 173.86 2pox s ASN 105 N -1.57 0.70 -0.27 3.99 2.47 -0.35 -1.91 114.94 118.00 2pox s ASN 105 Ca -0.11 0.01 -0.09 0.00 0.42 0.00 0.00 52.86 53.10 2pox s ASN 105 Cb -0.10 -0.19 -0.03 0.00 -1.45 0.00 0.00 41.25 39.49 2pox s ASN 105 CO 0.00 -0.16 0.11 -0.62 -3.72 0.00 0.00 177.10 172.71 2pox s ASP 106 N 1.50 5.40 -0.21 -4.21 2.15 -0.36 -0.64 116.67 120.30 2pox s ASP 106 Ca -0.03 -0.26 -0.03 0.00 0.43 0.00 0.00 52.55 52.65 2pox s ASP 106 Cb -0.13 -1.98 -0.00 0.00 -0.30 0.00 0.00 42.92 40.51 2pox s ASP 106 CO -0.03 -0.08 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.19 2pox s ILE 107 N 1.64 3.17 0.44 4.11 1.01 -0.45 -1.45 121.20 129.67 2pox s ILE 107 Ca 0.06 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.20 2pox s ILE 107 Cb -0.16 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 2pox s ILE 107 CO 0.06 0.44 0.04 0.42 0.00 0.00 0.00 174.94 175.90 2pox s THR 108 N 1.45 1.79 -0.07 2.92 -4.23 -0.54 -2.78 115.64 114.17 2pox s THR 108 Ca 0.06 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 58.64 2pox s THR 108 Cb -0.14 -2.73 0.02 0.00 1.34 0.00 0.00 72.50 70.99 2pox s THR 108 CO -0.05 0.00 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.72 2pox s LEU 109 N -3.80 1.46 -0.30 4.79 2.96 -1.26 -0.84 118.68 121.69 2pox s LEU 109 Ca 0.27 -0.27 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 2pox s LEU 109 Cb 0.06 -0.77 0.09 0.00 0.50 0.00 0.00 46.19 46.07 2pox s LEU 109 CO 0.14 -0.02 0.03 -0.62 -1.32 0.00 0.00 176.35 174.56 2pox s ASP 110 N 1.00 4.25 1.28 3.68 2.15 -0.31 -4.99 116.67 123.73 2pox s ASP 110 Ca -0.09 -1.67 0.00 0.00 0.43 0.00 0.00 52.55 51.22 2pox s ASP 110 Cb -0.15 -1.26 0.00 0.00 -0.30 0.00 0.00 42.92 41.21 2pox s ASP 110 CO -0.00 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.27 2pox n GLY 111 N 4.56 0.86 0.95 2.66 0.00 -1.26 -1.15 105.19 111.81 2pox n GLY 111 Ca -0.03 0.56 0.12 0.00 0.00 0.00 0.00 46.02 46.67 2pox n GLY 111 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2pox n ASP 112 N 9.03 2.99 -4.03 1.61 2.03 -1.26 -4.95 116.55 121.96 2pox n ASP 112 Ca 0.00 -1.99 -0.30 0.00 0.52 0.00 0.00 54.79 53.02 2pox n ASP 112 Cb 0.00 -0.01 -0.16 0.00 -0.72 0.00 0.00 41.12 40.23 2pox n ASP 112 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2pox s TYR 114 N 1.38 3.51 -0.14 0.00 1.51 0.09 -1.16 117.35 122.55 2pox s TYR 114 Ca 0.03 1.56 0.03 0.00 -1.01 0.00 0.00 57.07 57.67 2pox s TYR 114 Cb -0.13 -3.34 0.01 0.00 -0.11 0.00 0.00 41.96 38.38 2pox s TYR 114 CO -0.09 -0.84 -0.22 0.42 -1.11 0.00 0.00 175.55 173.71 2pox s ILE 115 N -0.44 2.06 -0.14 2.71 1.01 -0.02 -1.04 121.20 125.34 2pox s ILE 115 Ca 0.49 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 2pox s ILE 115 Cb -0.32 -1.82 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 2pox s ILE 115 CO 0.38 0.55 -0.08 -0.31 0.00 0.00 0.00 174.94 175.48 2pox s TYR 116 N 0.81 2.93 -0.33 3.97 2.02 -0.24 -1.47 117.35 125.04 2pox s TYR 116 Ca -0.07 -0.44 -0.05 0.00 -0.37 0.00 0.00 57.07 56.14 2pox s TYR 116 Cb -0.16 -1.91 0.04 0.00 -0.40 0.00 0.00 41.96 39.54 2pox s TYR 116 CO -0.02 -0.10 0.08 -2.00 -1.57 0.00 0.00 175.55 171.94 2pox s GLU 117 N 0.34 2.55 -0.07 -0.62 2.56 -0.53 -2.17 118.70 120.77 2pox s GLU 117 Ca -0.07 -1.23 0.04 0.00 0.00 0.00 0.00 54.97 53.72 2pox s GLU 117 Cb -0.15 -3.39 -0.02 0.00 2.00 0.00 0.00 34.13 32.58 2pox s GLU 117 CO 0.04 -0.67 -0.20 0.42 -0.56 0.00 0.00 175.26 174.29 2pox s ILE 118 N 1.35 2.51 -0.00 -3.70 1.01 -0.49 -1.22 121.20 120.66 2pox s ILE 118 Ca -0.02 -0.90 0.08 0.00 0.00 0.00 0.00 60.65 59.81 2pox s ILE 118 Cb -0.20 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.29 2pox s ILE 118 CO 0.02 0.57 -0.26 -0.60 0.00 0.00 0.00 174.94 174.67 2pox s ARG 119 N -0.26 2.03 -0.04 2.79 6.06 -0.80 -1.36 118.95 127.36 2pox s ARG 119 Ca 0.00 -0.98 -0.02 0.00 -2.50 0.00 0.00 55.73 52.24 2pox s ARG 119 Cb -0.13 -2.03 0.03 0.00 0.06 0.00 0.00 34.95 32.88 2pox s ARG 119 CO 0.03 0.55 0.07 0.12 -2.50 0.00 0.00 175.30 173.56 2pox s PHE 120 N -0.68 0.01 -0.12 5.12 5.36 -0.42 -1.69 117.98 125.57 2pox s PHE 120 Ca 0.11 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 56.33 2pox s PHE 120 Cb -0.10 -0.37 0.04 0.00 -0.34 0.00 0.00 43.02 42.25 2pox s PHE 120 CO 0.00 -0.17 0.02 -0.51 -1.46 0.00 0.00 175.22 173.10 2pox s ASP 121 N 1.83 2.04 -0.05 6.13 1.01 0.40 -0.87 116.67 127.17 2pox s ASP 121 Ca 0.00 -0.35 0.05 0.00 0.71 0.00 0.00 52.55 52.96 2pox s ASP 121 Cb -0.12 -0.46 -0.02 0.00 1.01 0.00 0.00 42.92 43.33 2pox s ASP 121 CO -0.03 -0.24 -0.21 -0.83 0.21 0.00 0.00 175.17 174.06 2pox s GLY 122 N 1.96 1.38 0.07 0.21 0.00 -0.02 -0.66 107.32 110.26 2pox s GLY 122 Ca 0.03 -1.04 0.01 0.00 0.00 0.00 0.00 44.72 43.72 2pox s GLY 122 CO -0.06 -0.74 -0.05 -1.34 0.00 0.00 0.00 173.10 170.91 2pox s VAL 123 N -0.44 0.46 -1.28 1.40 -7.23 -0.61 -0.20 120.40 112.51 2pox s VAL 123 Ca 0.05 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 2pox s VAL 123 Cb -0.12 -1.50 0.00 0.00 0.56 0.00 0.00 36.38 35.32 2pox s VAL 123 CO 0.01 -0.89 0.00 0.59 -0.31 0.00 0.00 175.10 174.51 2pox n ASN 124 N 0.16 -4.38 -4.66 4.85 3.02 -1.26 -2.03 115.26 110.96 2pox n ASN 124 Ca -0.14 0.17 -0.43 0.00 -0.03 0.00 0.00 54.58 54.15 2pox n ASN 124 Cb 0.60 -3.29 -0.02 0.00 -0.61 0.00 0.00 39.78 36.46 2pox n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2pox s PHE 125 N -2.57 3.07 0.41 3.10 0.08 -1.26 -3.12 117.98 117.69 2pox s PHE 125 Ca 0.00 1.20 -0.26 0.00 0.12 0.00 0.00 56.93 57.99 2pox s PHE 125 Cb 0.00 -3.41 -0.09 0.00 -0.57 0.00 0.00 43.02 38.96 2pox s PHE 125 CO 0.00 -1.21 1.30 -2.14 -0.10 0.00 0.00 175.22 173.07 2pox s PRO 126 N 3.19 3.94 0.51 0.24 0.02 -1.26 -4.90 135.00 136.74 2pox s PRO 126 Ca 0.51 2.15 0.15 0.00 0.02 0.00 0.00 61.00 63.83 2pox s PRO 126 Cb -0.20 -2.74 1.23 0.00 0.02 0.00 0.00 34.50 32.81 2pox s PRO 126 CO 0.13 -0.51 2.14 0.00 -0.33 0.00 0.00 177.00 178.43 2pox h ALA 127 N 2.63 1.96 -0.02 -1.55 0.00 -1.97 -1.23 119.26 119.08 2pox h ALA 127 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2pox h ALA 127 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2pox h ALA 127 CO 0.62 0.03 -0.03 0.09 0.00 0.00 0.00 179.25 179.96 2pox n ASN 128 N -4.52 1.77 -4.63 0.00 3.02 -1.26 -4.36 115.26 105.28 2pox n ASN 128 Ca -0.03 -1.55 -0.29 0.00 -0.03 0.00 0.00 54.58 52.69 2pox n ASN 128 Cb 0.10 0.02 0.16 0.00 -0.61 0.00 0.00 39.78 39.44 2pox n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2pox s GLY 129 N -2.05 1.59 0.45 7.41 0.00 -0.47 -4.81 107.32 109.44 2pox s GLY 129 Ca 0.34 -0.59 0.20 0.00 0.00 0.00 0.00 44.72 44.67 2pox s GLY 129 CO 0.35 0.02 1.96 -0.56 0.00 0.00 0.00 173.10 174.87 2pox h PRO 130 N -1.68 0.00 0.19 2.90 0.13 -1.93 -1.51 132.00 130.09 2pox h PRO 130 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2pox h PRO 130 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2pox h PRO 130 CO 0.57 0.22 -0.09 0.28 -0.23 0.00 0.00 178.00 178.75 2pox h VAL 131 N 0.00 0.86 0.00 1.56 2.07 -1.93 0.75 116.25 119.56 2pox h VAL 131 Ca -0.00 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.51 2pox h VAL 131 Cb 0.46 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2pox h VAL 131 CO 0.03 0.20 -0.13 0.24 0.02 0.00 0.00 177.57 177.93 2pox h MET 132 N -0.79 0.00 -0.16 1.57 2.86 -1.76 0.17 114.93 116.82 2pox h MET 132 Ca -0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2pox h MET 132 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2pox h MET 132 CO 0.04 0.13 0.00 1.04 1.06 0.00 0.00 176.91 179.18 2pox n GLN 133 N -3.27 2.20 -3.62 1.72 6.02 -0.57 -4.70 117.38 115.16 2pox n GLN 133 Ca 0.00 -1.78 -0.24 0.00 -0.01 0.00 0.00 57.00 54.98 2pox n GLN 133 Cb 0.39 -1.47 0.04 0.00 1.02 0.00 0.00 30.24 30.22 2pox n GLN 133 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2pox n LYS 134 N 1.07 -3.23 -0.30 -1.09 5.02 -0.54 -4.92 118.16 114.18 2pox n LYS 134 Ca 0.17 0.61 0.07 0.00 -2.02 0.00 0.00 58.31 57.13 2pox n LYS 134 Cb 0.53 -4.94 0.20 0.00 -0.02 0.00 0.00 35.03 30.80 2pox n LYS 134 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2pox n ARG 135 N -4.06 2.83 -3.31 1.97 1.74 0.15 -5.00 116.66 110.98 2pox n ARG 135 Ca -0.20 -2.45 -0.27 0.00 -0.77 0.00 0.00 57.85 54.16 2pox n ARG 135 Cb 0.64 -1.56 -0.02 0.00 -1.02 0.00 0.00 32.46 30.50 2pox n ARG 135 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2pox s THR 136 N -2.01 5.04 0.01 0.55 -4.23 -1.26 -1.15 115.64 112.61 2pox s THR 136 Ca 0.32 -0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 60.71 2pox s THR 136 Cb 0.23 -3.78 -0.01 0.00 1.34 0.00 0.00 72.50 70.28 2pox s THR 136 CO 0.11 -0.42 -0.06 0.52 -0.54 0.00 0.00 174.62 174.22 2pox n VAL 137 N -1.26 0.91 -3.46 2.29 0.31 0.18 -4.77 118.33 112.53 2pox n VAL 137 Ca -0.02 0.20 -0.11 0.00 -0.01 0.00 0.00 64.34 64.40 2pox n VAL 137 Cb 0.55 -1.67 -0.02 0.00 -0.91 0.00 0.00 33.84 31.79 2pox n VAL 137 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2pox s LYS 138 N -2.13 1.08 0.11 5.55 -2.85 -1.24 -4.99 119.74 115.27 2pox s LYS 138 Ca -0.06 -0.36 -0.30 0.00 -1.00 0.00 0.00 55.97 54.25 2pox s LYS 138 Cb 0.01 0.50 -0.06 0.00 -2.06 0.00 0.00 37.83 36.22 2pox s LYS 138 CO 0.08 -0.47 0.97 -1.58 0.10 0.00 0.00 175.35 174.45 2pox s TRP 139 N -3.35 3.80 0.36 1.78 0.52 -1.26 -0.83 118.94 119.95 2pox s TRP 139 Ca 0.02 1.79 -0.26 0.00 0.02 0.00 0.00 56.10 57.67 2pox s TRP 139 Cb -0.01 -3.07 -0.09 0.00 -1.15 0.00 0.00 33.47 29.16 2pox s TRP 139 CO -0.10 0.17 1.14 -1.21 0.02 0.00 0.00 176.95 176.97 2pox s GLU 140 N 0.01 4.25 0.47 4.98 0.41 0.02 -4.75 118.70 124.09 2pox s GLU 140 Ca 0.47 1.81 -0.24 0.00 -0.41 0.00 0.00 54.97 56.61 2pox s GLU 140 Cb -0.23 -2.82 -0.08 0.00 -1.78 0.00 0.00 34.13 29.21 2pox s GLU 140 CO 0.30 -0.14 1.24 -2.30 -0.49 0.00 0.00 175.26 173.87 2pox n PRO 141 N 0.41 1.72 -3.22 0.39 -0.02 -1.26 -4.73 135.00 128.28 2pox n PRO 141 Ca 0.03 0.62 -0.11 0.00 -2.02 0.00 0.00 63.50 62.02 2pox n PRO 141 Cb 0.46 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 2pox n PRO 141 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2pox n SER 142 N -0.14 -0.68 -3.76 2.55 3.41 -0.87 -5.00 113.62 109.14 2pox n SER 142 Ca 0.08 -2.27 -0.25 0.00 -0.26 0.00 0.00 58.87 56.17 2pox n SER 142 Cb 0.41 1.36 -0.17 0.00 -0.26 0.00 0.00 64.21 65.56 2pox n SER 142 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2pox s THR 143 N -2.75 0.45 0.25 6.66 2.01 -1.26 -1.55 115.64 119.44 2pox s THR 143 Ca 0.21 -0.13 -0.27 0.00 0.31 0.00 0.00 61.69 61.81 2pox s THR 143 Cb 0.00 -0.73 -0.09 0.00 0.01 0.00 0.00 72.50 71.70 2pox s THR 143 CO 0.15 0.10 0.89 -0.70 -0.69 0.00 0.00 174.62 174.37 2pox s GLU 144 N 1.93 4.66 -0.26 4.92 2.12 0.19 -4.76 118.70 127.50 2pox s GLU 144 Ca 0.03 1.32 -0.10 0.00 0.36 0.00 0.00 54.97 56.58 2pox s GLU 144 Cb -0.14 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 2pox s GLU 144 CO -0.06 0.45 0.14 0.15 -0.54 0.00 0.00 175.26 175.40 2pox s LYS 145 N -1.50 3.87 -0.10 4.30 3.01 0.28 -1.27 119.74 128.34 2pox s LYS 145 Ca 0.43 -0.36 0.02 0.00 -1.01 0.00 0.00 55.97 55.04 2pox s LYS 145 Cb -0.22 -3.51 -0.02 0.00 -1.01 0.00 0.00 37.83 33.07 2pox s LYS 145 CO 0.27 -0.12 -0.14 -0.51 0.51 0.00 0.00 175.35 175.36 2pox s LEU 146 N 1.54 2.68 0.12 3.17 1.02 0.05 -1.18 118.68 126.08 2pox s LEU 146 Ca 0.07 -0.29 -0.22 0.00 0.02 0.00 0.00 54.13 53.71 2pox s LEU 146 Cb -0.15 -1.58 0.06 0.00 0.02 0.00 0.00 46.19 44.54 2pox s LEU 146 CO 0.07 0.23 0.55 -0.72 0.02 0.00 0.00 176.35 176.50 2pox s TYR 147 N -0.07 -0.45 -0.06 0.29 1.13 -0.57 -1.19 117.35 116.43 2pox s TYR 147 Ca -0.03 0.30 -0.14 0.00 -1.41 0.00 0.00 57.07 55.79 2pox s TYR 147 Cb -0.14 0.45 -0.05 0.00 -1.10 0.00 0.00 41.96 41.12 2pox s TYR 147 CO 0.04 -0.77 0.36 0.08 -2.51 0.00 0.00 175.55 172.75 2pox s VAL 148 N -3.41 5.16 -0.02 -3.49 1.01 -1.26 -0.28 120.40 118.12 2pox s VAL 148 Ca -0.00 0.73 -0.00 0.00 0.00 0.00 0.00 61.98 62.70 2pox s VAL 148 Cb -0.00 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2pox s VAL 148 CO -0.10 0.51 0.03 -0.60 0.00 0.00 0.00 175.10 174.94 2pox s ARG 149 N -0.52 -0.03 -1.56 2.72 3.52 -0.70 -4.93 118.95 117.45 2pox s ARG 149 Ca 0.22 0.15 -0.11 0.00 -0.13 0.00 0.00 55.73 55.86 2pox s ARG 149 Cb -0.15 -0.19 0.09 0.00 -1.56 0.00 0.00 34.95 33.13 2pox s ARG 149 CO 0.10 -0.13 0.71 -0.25 -0.81 0.00 0.00 175.30 174.91 2pox n ASP 150 N 3.95 -2.57 0.00 -2.12 8.00 -1.26 -1.78 116.55 120.76 2pox n ASP 150 Ca -0.25 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.30 2pox n ASP 150 Cb 0.52 -3.13 0.00 0.00 -0.02 0.00 0.00 41.12 38.49 2pox n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2pox n GLY 151 N -1.65 0.37 3.17 0.44 0.00 -1.26 -4.97 105.19 101.29 2pox n GLY 151 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 2pox n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pox s VAL 152 N -1.75 0.74 -0.08 1.61 0.11 -0.73 -5.02 120.40 115.28 2pox s VAL 152 Ca 0.00 -1.90 -0.11 0.00 -2.93 0.00 0.00 61.98 57.04 2pox s VAL 152 Cb 0.00 -1.65 -0.05 0.00 -1.53 0.00 0.00 36.38 33.16 2pox s VAL 152 CO 0.00 -0.83 0.27 -0.22 -3.33 0.00 0.00 175.10 170.98 2pox s LEU 153 N -2.98 4.41 0.13 2.54 2.96 -1.02 -1.73 118.68 122.99 2pox s LEU 153 Ca 0.11 0.68 0.11 0.00 -0.22 0.00 0.00 54.13 54.81 2pox s LEU 153 Cb 0.04 -2.32 -0.04 0.00 0.50 0.00 0.00 46.19 44.37 2pox s LEU 153 CO -0.04 0.34 -0.26 -0.54 -1.32 0.00 0.00 176.35 174.53 2pox s LYS 154 N -0.87 1.44 -0.04 1.98 -0.14 0.62 0.08 119.74 122.81 2pox s LYS 154 Ca 0.19 -1.35 -0.01 0.00 -1.36 0.00 0.00 55.97 53.44 2pox s LYS 154 Cb -0.14 -1.92 0.03 0.00 -1.68 0.00 0.00 37.83 34.12 2pox s LYS 154 CO 0.08 0.45 0.02 0.20 -0.76 0.00 0.00 175.35 175.33 2pox s GLY 155 N -2.11 0.29 0.03 -3.33 0.00 -0.44 -1.51 107.32 100.26 2pox s GLY 155 Ca 0.15 0.09 0.08 0.00 0.00 0.00 0.00 44.72 45.05 2pox s GLY 155 CO 0.07 0.93 -0.24 0.99 0.00 0.00 0.00 173.10 174.85 2pox s ASP 156 N 1.55 2.86 -0.27 1.64 1.01 -0.32 -0.76 116.67 122.37 2pox s ASP 156 Ca -0.02 -0.54 -0.24 0.00 0.71 0.00 0.00 52.55 52.45 2pox s ASP 156 Cb -0.13 -0.26 0.07 0.00 1.01 0.00 0.00 42.92 43.61 2pox s ASP 156 CO -0.03 0.23 0.72 0.54 0.21 0.00 0.00 175.17 176.84 2pox s VAL 157 N -0.76 -0.00 -0.56 -1.27 0.11 -0.96 -0.56 120.40 116.40 2pox s VAL 157 Ca 0.10 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 58.92 2pox s VAL 157 Cb -0.09 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.81 2pox s VAL 157 CO 0.01 0.00 0.89 0.20 -3.33 0.00 0.00 175.10 172.88 2pox s ASN 158 N 0.45 6.30 0.26 3.54 0.02 -1.26 -0.52 114.94 123.72 2pox s ASN 158 Ca -0.01 -0.54 0.02 0.00 -1.02 0.00 0.00 52.86 51.31 2pox s ASN 158 Cb -0.05 -2.41 -0.04 0.00 0.02 0.00 0.00 41.25 38.78 2pox s ASN 158 CO -0.00 -1.20 0.43 -0.04 0.02 0.00 0.00 177.10 176.31 2pox s MET 159 N 3.75 3.48 -0.03 -0.60 -1.94 0.10 -4.95 119.30 119.11 2pox s MET 159 Ca 0.27 -0.48 0.01 0.00 -1.71 0.00 0.00 55.69 53.77 2pox s MET 159 Cb -0.14 -2.80 0.03 0.00 2.01 0.00 0.00 34.83 33.92 2pox s MET 159 CO 0.17 0.33 -0.01 0.00 -0.01 0.00 0.00 175.02 175.49 2pox s ALA 160 N -2.05 0.42 -0.25 3.03 0.00 -1.26 -1.38 121.76 120.26 2pox s ALA 160 Ca 0.37 0.10 -0.10 0.00 0.00 0.00 0.00 51.96 52.34 2pox s ALA 160 Cb -0.10 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 2pox s ALA 160 CO 0.31 -0.05 0.14 -1.17 0.00 0.00 0.00 175.76 174.99 2pox s LEU 161 N 0.98 3.89 0.50 0.00 2.96 -0.15 -0.80 118.68 126.06 2pox s LEU 161 Ca -0.10 -0.01 -0.20 0.00 -0.22 0.00 0.00 54.13 53.59 2pox s LEU 161 Cb -0.14 -2.05 -0.07 0.00 0.50 0.00 0.00 46.19 44.43 2pox s LEU 161 CO -0.01 0.01 1.09 -0.94 -1.32 0.00 0.00 176.35 175.19 2pox s SER 162 N 1.35 6.07 0.34 3.68 1.04 -0.01 -0.43 113.70 125.74 2pox s SER 162 Ca 0.06 2.08 0.08 0.00 0.48 0.00 0.00 55.95 58.66 2pox s SER 162 Cb -0.15 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.35 2pox s SER 162 CO 0.06 -0.97 0.10 -0.76 0.98 0.00 0.00 173.24 172.65 2pox s LEU 163 N -3.52 3.18 0.26 2.42 1.43 -0.53 -0.64 118.68 121.27 2pox s LEU 163 Ca 0.69 -0.83 0.18 0.00 -1.03 0.00 0.00 54.13 53.14 2pox s LEU 163 Cb -0.21 -1.63 0.95 0.00 0.03 0.00 0.00 46.19 45.33 2pox s LEU 163 CO 0.25 -0.27 1.55 -0.62 0.23 0.00 0.00 176.35 177.49 2pox n GLU 164 N -1.08 0.12 0.00 1.70 1.02 -0.30 -1.80 120.64 120.29 2pox n GLU 164 Ca -0.04 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 2pox n GLU 164 Cb 0.61 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2pox n GLU 164 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pox n GLY 165 N -1.24 -1.23 0.00 0.62 0.00 -1.26 -5.05 105.19 97.04 2pox n GLY 165 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2pox n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pox n GLY 166 N 0.09 0.47 0.63 -0.02 0.00 -0.75 -5.13 105.19 100.48 2pox n GLY 166 Ca 0.00 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2pox n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pox n GLY 167 N 0.86 -1.92 3.13 -0.02 0.00 -1.26 -4.59 105.19 101.39 2pox n GLY 167 Ca 0.00 -2.00 -0.18 0.00 0.00 0.00 0.00 46.02 43.83 2pox n GLY 167 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2pox s HIS 168 N -0.08 1.12 -0.20 1.61 0.09 -1.26 -1.45 115.29 115.12 2pox s HIS 168 Ca 0.00 -0.39 -0.01 0.00 -0.00 0.00 0.00 55.06 54.66 2pox s HIS 168 Cb 0.00 -0.65 0.01 0.00 -0.00 0.00 0.00 32.58 31.94 2pox s HIS 168 CO 0.00 0.03 -0.14 -0.47 -0.00 0.00 0.00 174.74 174.16 2pox s TYR 169 N -1.01 2.85 0.22 1.40 5.04 0.43 -4.94 117.35 121.33 2pox s TYR 169 Ca -0.01 -1.38 0.00 0.00 -2.44 0.00 0.00 57.07 53.24 2pox s TYR 169 Cb -0.08 -1.99 -0.04 0.00 0.35 0.00 0.00 41.96 40.20 2pox s TYR 169 CO 0.01 -0.71 0.40 1.03 -1.34 0.00 0.00 175.55 174.94 2pox s ARG 170 N 1.36 3.50 -0.16 4.97 0.52 -1.26 -0.98 118.95 126.90 2pox s ARG 170 Ca 0.05 -0.41 -0.09 0.00 -0.52 0.00 0.00 55.73 54.76 2pox s ARG 170 Cb -0.13 -2.83 0.06 0.00 0.52 0.00 0.00 34.95 32.56 2pox s ARG 170 CO -0.09 0.38 0.38 0.00 0.02 0.00 0.00 175.30 175.99 2pox s ASP 172 N 1.31 6.42 -0.16 0.00 -1.08 -0.28 0.01 116.67 122.89 2pox s ASP 172 Ca -0.09 0.31 -0.10 0.00 -0.52 0.00 0.00 52.55 52.14 2pox s ASP 172 Cb -0.08 -2.30 -0.05 0.00 -1.46 0.00 0.00 42.92 39.03 2pox s ASP 172 CO -0.11 -0.43 0.17 -0.36 0.52 0.00 0.00 175.17 174.97 2pox s PHE 173 N 2.46 3.48 -0.12 -5.34 0.40 0.32 -1.24 117.98 117.94 2pox s PHE 173 Ca 0.22 0.46 -0.02 0.00 -0.60 0.00 0.00 56.93 56.99 2pox s PHE 173 Cb -0.15 -2.14 0.04 0.00 0.51 0.00 0.00 43.02 41.27 2pox s PHE 173 CO 0.12 0.41 0.01 0.15 0.70 0.00 0.00 175.22 176.60 2pox s LYS 174 N -0.03 0.70 0.01 0.44 1.02 -0.29 -2.28 119.74 119.32 2pox s LYS 174 Ca 0.12 -0.13 0.08 0.00 0.02 0.00 0.00 55.97 56.06 2pox s LYS 174 Cb -0.12 -1.47 -0.03 0.00 -0.52 0.00 0.00 37.83 35.69 2pox s LYS 174 CO 0.01 -0.43 -0.23 0.99 -0.92 0.00 0.00 175.35 174.77 2pox s THR 175 N 1.91 2.38 -0.13 2.17 2.01 0.06 -1.19 115.64 122.84 2pox s THR 175 Ca 0.03 -1.17 0.01 0.00 0.31 0.00 0.00 61.69 60.87 2pox s THR 175 Cb -0.14 -1.92 -0.00 0.00 0.01 0.00 0.00 72.50 70.45 2pox s THR 175 CO -0.07 0.46 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.25 2pox s THR 176 N -0.76 2.52 -0.10 -0.82 2.01 0.36 -1.32 115.64 117.52 2pox s THR 176 Ca 0.12 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.26 2pox s THR 176 Cb -0.10 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 2pox s THR 176 CO 0.02 0.53 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.13 2pox s TYR 177 N 0.56 3.02 -0.25 4.92 2.02 0.11 -1.46 117.35 126.27 2pox s TYR 177 Ca -0.11 -0.05 -0.02 0.00 -0.37 0.00 0.00 57.07 56.52 2pox s TYR 177 Cb -0.16 -1.82 0.08 0.00 -0.40 0.00 0.00 41.96 39.66 2pox s TYR 177 CO 0.04 0.23 0.07 0.15 -1.57 0.00 0.00 175.55 174.47 2pox s LYS 178 N -0.41 0.63 0.50 -0.62 1.02 0.25 -2.45 119.74 118.67 2pox s LYS 178 Ca 0.07 -0.70 -0.23 0.00 0.02 0.00 0.00 55.97 55.12 2pox s LYS 178 Cb -0.12 -1.94 -0.06 0.00 -0.52 0.00 0.00 37.83 35.18 2pox s LYS 178 CO 0.02 -0.83 1.37 0.00 -0.92 0.00 0.00 175.35 174.99 2pox s ALA 179 N 1.79 2.99 -1.59 5.17 0.00 -1.26 -1.24 121.76 127.62 2pox s ALA 179 Ca 0.04 1.35 0.11 0.00 0.00 0.00 0.00 51.96 53.47 2pox s ALA 179 Cb -0.17 -3.56 0.40 0.00 0.00 0.00 0.00 23.12 19.79 2pox s ALA 179 CO -0.19 -1.25 1.28 1.63 0.00 0.00 0.00 175.76 177.23 2pox n LYS 180 N -0.66 2.33 -4.02 0.00 5.02 0.01 -4.87 118.16 115.96 2pox n LYS 180 Ca 0.08 -1.59 -0.11 0.00 -2.02 0.00 0.00 58.31 54.67 2pox n LYS 180 Cb 0.44 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.90 2pox n LYS 180 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2pox s LYS 181 N -1.60 1.69 -0.16 1.97 -2.85 -1.26 -4.91 119.74 112.62 2pox s LYS 181 Ca 0.29 -1.44 -0.29 0.00 -1.00 0.00 0.00 55.97 53.52 2pox s LYS 181 Cb 0.17 0.46 -0.01 0.00 -2.06 0.00 0.00 37.83 36.40 2pox s LYS 181 CO 0.16 -0.71 1.13 0.08 0.10 0.00 0.00 175.35 176.11 2pox s VAL 182 N -3.60 4.50 0.34 1.79 1.01 -1.26 -5.02 120.40 118.16 2pox s VAL 182 Ca 0.25 1.81 0.07 0.00 0.00 0.00 0.00 61.98 64.11 2pox s VAL 182 Cb -0.01 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 2pox s VAL 182 CO 0.13 -0.10 -0.02 0.68 0.00 0.00 0.00 175.10 175.79 2pox s VAL 183 N 2.89 1.76 0.12 2.92 -7.23 -1.26 -5.05 120.40 114.55 2pox s VAL 183 Ca 0.50 -2.07 -0.30 0.00 -1.81 0.00 0.00 61.98 58.30 2pox s VAL 183 Cb -0.19 -2.73 -0.07 0.00 0.56 0.00 0.00 36.38 33.95 2pox s VAL 183 CO 0.14 -0.12 1.11 -1.58 -0.31 0.00 0.00 175.10 174.33 2pox s GLN 184 N -3.74 4.55 0.08 4.82 2.00 -1.26 -5.01 119.66 121.10 2pox s GLN 184 Ca 0.33 1.69 -0.25 0.00 -2.00 0.00 0.00 55.36 55.13 2pox s GLN 184 Cb 0.07 -3.32 -0.06 0.00 0.80 0.00 0.00 33.01 30.49 2pox s GLN 184 CO 0.15 -0.02 0.77 -0.51 -0.50 0.00 0.00 175.29 175.18 2pox s LEU 185 N 0.18 4.50 0.65 3.68 1.43 -1.26 -4.67 118.68 123.18 2pox s LEU 185 Ca 0.52 1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 55.03 2pox s LEU 185 Cb -0.28 -3.26 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 2pox s LEU 185 CO 0.32 0.08 1.05 -2.16 0.23 0.00 0.00 176.35 175.87 2pox s PRO 186 N -0.40 3.38 0.93 1.29 0.04 -1.26 -4.99 135.00 133.98 2pox s PRO 186 Ca 0.38 0.72 -0.13 0.00 0.04 0.00 0.00 61.00 62.01 2pox s PRO 186 Cb -0.21 -2.06 0.15 0.00 0.04 0.00 0.00 34.50 32.42 2pox s PRO 186 CO 0.24 -0.72 1.14 -0.51 0.04 0.00 0.00 177.00 177.19 2pox s ASP 187 N -4.17 3.37 0.25 6.66 1.01 -1.26 -4.61 116.67 117.93 2pox s ASP 187 Ca 0.56 0.94 -0.31 0.00 0.71 0.00 0.00 52.55 54.45 2pox s ASP 187 Cb -0.11 -1.49 -0.13 0.00 1.01 0.00 0.00 42.92 42.19 2pox s ASP 187 CO 0.54 -2.63 1.41 0.00 0.21 0.00 0.00 175.17 174.69 2pox n TYR 188 N -3.82 2.24 -3.58 4.23 9.36 -1.26 -4.81 117.16 119.52 2pox n TYR 188 Ca 0.07 0.43 -0.06 0.00 3.32 0.00 0.00 57.90 61.65 2pox n TYR 188 Cb 0.59 -2.47 0.02 0.00 -0.63 0.00 0.00 39.34 36.85 2pox n TYR 188 CO 0.00 0.00 0.00 -2.39 0.22 0.00 0.00 176.86 174.69 2pox n HIS 189 N 1.77 -1.87 -4.14 2.98 1.44 -0.33 -4.97 115.22 110.10 2pox n HIS 189 Ca 0.11 -1.31 -0.16 0.00 -2.01 0.00 0.00 57.72 54.35 2pox n HIS 189 Cb 0.32 0.62 -0.12 0.00 0.12 0.00 0.00 29.99 30.93 2pox n HIS 189 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2pox s PHE 190 N -4.24 1.02 -0.19 -1.40 0.40 -0.65 -0.77 117.98 112.15 2pox s PHE 190 Ca 0.12 -0.51 -0.01 0.00 -0.60 0.00 0.00 56.93 55.93 2pox s PHE 190 Cb -0.03 -0.58 0.05 0.00 0.51 0.00 0.00 43.02 42.97 2pox s PHE 190 CO 0.09 0.00 -0.04 0.08 0.70 0.00 0.00 175.22 176.05 2pox s VAL 191 N -1.53 1.14 0.23 -0.44 1.01 -0.39 -0.79 120.40 119.63 2pox s VAL 191 Ca -0.03 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 2pox s VAL 191 Cb -0.09 -1.40 -0.09 0.00 0.00 0.00 0.00 36.38 34.81 2pox s VAL 191 CO 0.01 0.01 1.03 -1.81 0.00 0.00 0.00 175.10 174.34 2pox s ASP 192 N 1.60 7.44 0.05 3.32 1.01 -0.33 -0.64 116.67 129.12 2pox s ASP 192 Ca -0.01 2.08 -0.07 0.00 0.71 0.00 0.00 52.55 55.26 2pox s ASP 192 Cb -0.17 -2.61 -0.01 0.00 1.01 0.00 0.00 42.92 41.14 2pox s ASP 192 CO -0.07 -0.03 0.13 -1.38 0.21 0.00 0.00 175.17 174.03 2pox s HIS 193 N -0.94 0.18 -0.14 4.23 -3.43 -0.60 -1.32 115.29 113.28 2pox s HIS 193 Ca 0.44 -0.50 -0.04 0.00 -0.80 0.00 0.00 55.06 54.16 2pox s HIS 193 Cb -0.29 -0.12 0.07 0.00 -1.43 0.00 0.00 32.58 30.81 2pox s HIS 193 CO 0.36 -0.41 0.20 -1.58 -2.00 0.00 0.00 174.74 171.30 2pox s HIS 194 N -2.89 -0.24 -0.08 0.38 2.46 -0.75 -2.04 115.29 112.13 2pox s HIS 194 Ca -0.03 0.50 0.03 0.00 0.47 0.00 0.00 55.06 56.03 2pox s HIS 194 Cb 0.00 -0.28 -0.01 0.00 -0.13 0.00 0.00 32.58 32.16 2pox s HIS 194 CO -0.06 -0.41 -0.19 -1.50 -2.47 0.00 0.00 174.74 170.11 2pox s ILE 195 N 2.32 2.60 0.01 0.89 2.07 -1.26 -2.02 121.20 125.80 2pox s ILE 195 Ca 0.04 -0.86 0.02 0.00 -1.41 0.00 0.00 60.65 58.44 2pox s ILE 195 Cb -0.13 -2.02 -0.01 0.00 0.13 0.00 0.00 42.46 40.43 2pox s ILE 195 CO -0.09 0.56 -0.06 -1.61 -1.91 0.00 0.00 174.94 171.84 2pox s GLU 196 N -0.08 0.44 -0.50 3.50 2.02 0.08 -4.61 118.70 119.55 2pox s GLU 196 Ca -0.04 -0.31 -0.25 0.00 0.02 0.00 0.00 54.97 54.39 2pox s GLU 196 Cb -0.14 -0.38 0.03 0.00 0.10 0.00 0.00 34.13 33.74 2pox s GLU 196 CO 0.04 0.10 0.92 0.42 0.02 0.00 0.00 175.26 176.76 2pox s ILE 197 N -0.39 4.45 -0.03 -1.63 1.01 -1.26 -0.74 121.20 122.61 2pox s ILE 197 Ca -0.01 0.52 0.12 0.00 0.00 0.00 0.00 60.65 61.28 2pox s ILE 197 Cb -0.04 -4.47 -0.08 0.00 0.01 0.00 0.00 42.46 37.88 2pox s ILE 197 CO -0.00 -0.95 1.29 0.11 0.00 0.00 0.00 174.94 175.39 2pox h LYS 198 N 9.18 0.00 -2.88 2.79 1.79 -1.24 -3.47 116.57 122.74 2pox h LYS 198 Ca -0.25 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.18 2pox h LYS 198 Cb 1.08 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.59 2pox h LYS 198 CO 1.05 0.70 0.13 -1.54 -1.08 0.00 0.00 179.45 178.71 2pox s SER 199 N -6.51 -0.50 -0.02 0.86 1.04 -1.18 -5.00 113.70 102.39 2pox s SER 199 Ca 0.02 0.08 -0.28 0.00 0.48 0.00 0.00 55.95 56.25 2pox s SER 199 Cb 0.09 0.55 0.10 0.00 0.10 0.00 0.00 66.02 66.85 2pox s SER 199 CO 0.79 -0.85 0.83 -1.38 0.98 0.00 0.00 173.24 173.61 2pox s HIS 200 N -3.14 -0.43 0.82 5.02 -3.43 -1.26 -0.99 115.29 111.88 2pox s HIS 200 Ca -0.02 0.48 -0.07 0.00 -0.80 0.00 0.00 55.06 54.65 2pox s HIS 200 Cb -0.00 0.50 0.15 0.00 -1.43 0.00 0.00 32.58 31.80 2pox s HIS 200 CO -0.07 -0.56 1.13 0.16 -2.00 0.00 0.00 174.74 173.40 2pox s ASP 201 N -2.00 3.85 0.24 7.38 1.47 -0.79 -4.96 116.67 121.85 2pox s ASP 201 Ca 0.00 -0.06 -0.06 0.00 1.18 0.00 0.00 52.55 53.61 2pox s ASP 201 Cb -0.01 -0.19 0.29 0.00 -0.34 0.00 0.00 42.92 42.68 2pox s ASP 201 CO -0.04 -2.22 1.87 0.50 0.68 0.00 0.00 175.17 175.97 2pox h LYS 202 N -1.00 1.03 -0.52 2.11 3.64 -2.02 -2.39 116.57 117.42 2pox h LYS 202 Ca -0.40 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2pox h LYS 202 Cb 1.26 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2pox h LYS 202 CO 0.40 0.68 0.00 -0.40 -2.27 0.00 0.00 179.45 177.86 2pox n ASP 203 N -4.56 3.66 -0.59 4.20 5.68 -1.26 -4.95 116.55 118.73 2pox n ASP 203 Ca 0.11 -2.00 -0.08 0.00 -0.50 0.00 0.00 54.79 52.33 2pox n ASP 203 Cb 0.12 -0.34 -0.03 0.00 -1.14 0.00 0.00 41.12 39.72 2pox n ASP 203 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2pox n TYR 204 N 1.56 0.00 -0.28 2.11 4.02 -0.90 -4.33 117.16 119.34 2pox n TYR 204 Ca 0.21 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.19 2pox n TYR 204 Cb 0.62 -1.62 0.32 0.00 -0.02 0.00 0.00 39.34 38.64 2pox n TYR 204 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2pox h SER 205 N 0.00 0.75 -3.31 7.72 0.02 -1.93 -3.40 113.55 113.40 2pox h SER 205 Ca -0.16 0.03 -0.60 0.00 -0.84 0.00 0.00 61.79 60.22 2pox h SER 205 Cb 0.52 -0.12 -0.34 0.00 0.14 0.00 0.00 62.40 62.60 2pox h SER 205 CO 0.23 0.42 -0.85 0.20 -1.14 0.00 0.00 176.83 175.70 2pox s ASN 206 N -5.86 2.54 -0.03 3.07 0.01 -1.26 -1.31 114.94 112.10 2pox s ASN 206 Ca -0.11 -0.45 0.02 0.00 -0.71 0.00 0.00 52.86 51.61 2pox s ASN 206 Cb 0.21 -1.16 0.01 0.00 0.41 0.00 0.00 41.25 40.73 2pox s ASN 206 CO 0.79 0.06 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.69 2pox s VAL 207 N 0.74 0.58 -0.22 1.60 1.01 -0.56 -1.89 120.40 121.66 2pox s VAL 207 Ca -0.11 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 2pox s VAL 207 Cb -0.16 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 2pox s VAL 207 CO 0.02 0.20 0.03 0.21 0.00 0.00 0.00 175.10 175.57 2pox s ASN 208 N 0.42 5.00 -0.07 3.32 3.84 -0.16 -0.21 114.94 127.07 2pox s ASN 208 Ca -0.06 -0.19 0.04 0.00 0.21 0.00 0.00 52.86 52.86 2pox s ASN 208 Cb -0.10 -1.88 -0.00 0.00 -0.55 0.00 0.00 41.25 38.73 2pox s ASN 208 CO 0.00 0.02 -0.21 -0.22 -2.79 0.00 0.00 177.10 173.90 2pox s LEU 209 N 1.27 1.99 0.00 3.21 2.96 -0.04 -0.63 118.68 127.44 2pox s LEU 209 Ca 0.04 -0.47 0.06 0.00 -0.22 0.00 0.00 54.13 53.54 2pox s LEU 209 Cb -0.15 -1.24 -0.02 0.00 0.50 0.00 0.00 46.19 45.29 2pox s LEU 209 CO 0.02 0.17 -0.20 -2.28 -1.32 0.00 0.00 176.35 172.74 2pox s HIS 210 N 0.17 1.79 0.03 5.38 5.65 0.08 -0.89 115.29 127.50 2pox s HIS 210 Ca -0.11 -0.35 0.02 0.00 0.25 0.00 0.00 55.06 54.87 2pox s HIS 210 Cb -0.15 -1.13 -0.02 0.00 -1.18 0.00 0.00 32.58 30.10 2pox s HIS 210 CO 0.05 0.00 -0.07 -2.00 -0.65 0.00 0.00 174.74 172.08 2pox s GLU 211 N -0.67 0.50 0.00 2.88 2.12 -0.47 -0.74 118.70 122.32 2pox s GLU 211 Ca 0.08 -0.60 0.02 0.00 0.36 0.00 0.00 54.97 54.83 2pox s GLU 211 Cb -0.08 -0.32 -0.01 0.00 0.26 0.00 0.00 34.13 33.98 2pox s GLU 211 CO -0.00 0.07 -0.06 -3.38 -0.54 0.00 0.00 175.26 171.35 2pox s HIS 212 N -1.03 0.53 -0.05 5.30 -3.43 -0.86 -1.29 115.29 114.47 2pox s HIS 212 Ca -0.07 -0.15 -0.06 0.00 -0.80 0.00 0.00 55.06 53.98 2pox s HIS 212 Cb -0.08 -0.34 0.01 0.00 -1.43 0.00 0.00 32.58 30.75 2pox s HIS 212 CO 0.00 -0.02 0.16 0.00 -2.00 0.00 0.00 174.74 172.88 2pox s ALA 213 N -0.30 -0.39 -0.04 -1.38 0.00 -0.15 -1.81 121.76 117.69 2pox s ALA 213 Ca 0.01 0.32 -0.01 0.00 0.00 0.00 0.00 51.96 52.28 2pox s ALA 213 Cb -0.03 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 22.94 2pox s ALA 213 CO -0.00 -0.11 0.07 -1.21 0.00 0.00 0.00 175.76 174.51 2pox s GLU 214 N -0.26 -0.03 0.34 0.00 8.01 -0.43 -1.25 118.70 125.08 2pox s GLU 214 Ca -0.03 0.30 -0.25 0.00 0.01 0.00 0.00 54.97 54.99 2pox s GLU 214 Cb -0.03 -0.31 -0.10 0.00 -4.31 0.00 0.00 34.13 29.38 2pox s GLU 214 CO 0.01 -0.23 0.95 0.00 0.01 0.00 0.00 175.26 176.00 2pox s ALA 215 N 1.50 3.19 0.11 5.21 0.00 0.11 -1.18 121.76 130.70 2pox s ALA 215 Ca -0.04 0.51 -0.09 0.00 0.00 0.00 0.00 51.96 52.34 2pox s ALA 215 Cb -0.12 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.81 2pox s ALA 215 CO -0.04 0.16 0.22 -3.38 0.00 0.00 0.00 175.76 172.73 2pox s HIS 216 N -1.69 0.21 -0.13 0.00 -3.43 0.03 -4.46 115.29 105.82 2pox s HIS 216 Ca 0.52 -0.61 0.19 0.00 -0.80 0.00 0.00 55.06 54.35 2pox s HIS 216 Cb -0.18 -0.05 -0.22 0.00 -1.43 0.00 0.00 32.58 30.71 2pox s HIS 216 CO 0.23 -0.60 0.50 0.43 -2.00 0.00 0.00 174.74 173.30 2pox n SER 217 N -0.11 0.38 0.00 7.38 7.64 -1.26 -1.63 113.62 126.02 2pox n SER 217 Ca -0.13 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2pox n SER 217 Cb 0.63 0.88 0.00 0.00 -1.01 0.00 0.00 64.21 64.71 2pox n SER 217 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41