#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pox n SER 2 N 0.00 0.00 -1.20 7.83 7.64 -1.26 -4.77 113.62 121.86 2pox n SER 2 Ca 0.00 -0.42 0.11 0.00 1.01 0.00 0.00 58.87 59.57 2pox n SER 2 Cb 0.00 0.00 0.28 0.00 -1.01 0.00 0.00 64.21 63.48 2pox n SER 2 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2pox n VAL 3 N 0.00 0.78 -4.15 0.44 0.24 -1.26 -4.89 118.33 109.49 2pox n VAL 3 Ca 0.00 -0.84 -0.24 0.00 -2.04 0.00 0.00 64.34 61.21 2pox n VAL 3 Cb 0.10 0.58 -0.17 0.00 -1.47 0.00 0.00 33.84 32.88 2pox n VAL 3 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 2pox s ILE 4 N -1.22 0.88 0.27 1.34 2.07 -1.26 -4.97 121.20 118.31 2pox s ILE 4 Ca 0.43 -0.26 0.10 0.00 -1.41 0.00 0.00 60.65 59.51 2pox s ILE 4 Cb 0.23 -0.88 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 2pox s ILE 4 CO 0.31 0.32 -0.04 -0.54 -1.91 0.00 0.00 174.94 173.09 2pox s LYS 5 N 1.26 2.17 0.55 3.50 1.02 -1.26 -4.91 119.74 122.08 2pox s LYS 5 Ca -0.04 -1.50 0.25 0.00 0.02 0.00 0.00 55.97 54.70 2pox s LYS 5 Cb -0.14 -2.08 1.49 0.00 -0.52 0.00 0.00 37.83 36.58 2pox s LYS 5 CO -0.03 0.34 2.07 -1.35 -0.92 0.00 0.00 175.35 175.46 2pox h PRO 6 N 1.94 0.00 -4.98 -1.68 0.11 -2.00 -3.39 132.00 122.01 2pox h PRO 6 Ca -0.43 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.02 2pox h PRO 6 Cb 1.25 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 32.01 2pox h PRO 6 CO 0.61 0.00 -0.85 -0.51 -0.21 0.00 0.00 178.00 177.03 2pox s ASP 7 N -6.18 3.04 0.14 -2.05 1.01 -1.26 -4.03 116.67 107.34 2pox s ASP 7 Ca -0.05 -0.62 0.07 0.00 0.71 0.00 0.00 52.55 52.67 2pox s ASP 7 Cb 0.17 -1.42 -0.04 0.00 1.01 0.00 0.00 42.92 42.65 2pox s ASP 7 CO 0.64 -0.01 -0.17 -0.04 0.21 0.00 0.00 175.17 175.79 2pox s MET 8 N 1.33 1.16 0.34 8.23 -1.94 -0.50 -5.00 119.30 122.92 2pox s MET 8 Ca 0.05 -1.32 0.08 0.00 -1.71 0.00 0.00 55.69 52.79 2pox s MET 8 Cb -0.13 -1.18 -0.03 0.00 2.01 0.00 0.00 34.83 35.50 2pox s MET 8 CO -0.13 0.24 0.26 0.15 -0.01 0.00 0.00 175.02 175.53 2pox s LYS 9 N -2.65 2.63 -0.01 2.03 1.02 0.48 -0.92 119.74 122.32 2pox s LYS 9 Ca 0.12 -1.37 0.01 0.00 0.02 0.00 0.00 55.97 54.76 2pox s LYS 9 Cb -0.06 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.86 2pox s LYS 9 CO 0.05 0.09 -0.04 0.42 -0.92 0.00 0.00 175.35 174.95 2pox s ILE 10 N -2.34 0.31 -0.01 2.17 1.01 -0.33 -0.59 121.20 121.41 2pox s ILE 10 Ca 0.40 -0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.92 2pox s ILE 10 Cb -0.05 -0.28 0.01 0.00 0.01 0.00 0.00 42.46 42.15 2pox s ILE 10 CO 0.26 0.10 -0.00 -0.75 0.00 0.00 0.00 174.94 174.54 2pox s LYS 11 N 0.09 0.17 0.02 2.79 2.20 -0.40 -0.84 119.74 123.77 2pox s LYS 11 Ca -0.01 0.02 -0.10 0.00 -0.36 0.00 0.00 55.97 55.52 2pox s LYS 11 Cb -0.04 -0.27 0.01 0.00 -1.51 0.00 0.00 37.83 36.02 2pox s LYS 11 CO -0.00 -0.05 0.20 -0.48 -0.36 0.00 0.00 175.35 174.66 2pox s LEU 12 N 0.46 1.33 -0.06 5.43 0.05 -0.46 -1.00 118.68 124.43 2pox s LEU 12 Ca -0.04 -0.24 0.01 0.00 0.05 0.00 0.00 54.13 53.91 2pox s LEU 12 Cb -0.07 0.93 0.02 0.00 -2.05 0.00 0.00 46.19 45.03 2pox s LEU 12 CO -0.01 -0.49 -0.08 -0.60 -0.55 0.00 0.00 176.35 174.63 2pox s ARG 13 N -2.02 1.20 -0.15 1.48 3.52 -0.93 -1.84 118.95 120.21 2pox s ARG 13 Ca -0.09 -0.23 -0.03 0.00 -0.13 0.00 0.00 55.73 55.25 2pox s ARG 13 Cb -0.04 -1.10 -0.02 0.00 -1.56 0.00 0.00 34.95 32.23 2pox s ARG 13 CO -0.01 -0.05 -0.06 1.41 -0.81 0.00 0.00 175.30 175.78 2pox s MET 14 N 0.87 3.60 -0.03 5.12 -2.45 0.34 -1.46 119.30 125.30 2pox s MET 14 Ca -0.11 -0.56 0.06 0.00 -1.25 0.00 0.00 55.69 53.83 2pox s MET 14 Cb -0.15 -2.85 -0.02 0.00 1.25 0.00 0.00 34.83 33.06 2pox s MET 14 CO 0.01 0.24 -0.21 -1.21 1.05 0.00 0.00 175.02 174.90 2pox s GLU 15 N 0.35 2.26 0.03 4.11 2.02 -0.82 -1.24 118.70 125.41 2pox s GLU 15 Ca -0.06 -0.84 -0.05 0.00 0.02 0.00 0.00 54.97 54.04 2pox s GLU 15 Cb -0.15 -2.19 0.02 0.00 0.10 0.00 0.00 34.13 31.91 2pox s GLU 15 CO 0.04 0.58 0.23 0.41 0.02 0.00 0.00 175.26 176.54 2pox n GLY 16 N 2.30 1.08 3.40 -1.39 0.00 -0.71 -1.65 105.19 108.24 2pox n GLY 16 Ca -0.17 -0.96 -0.15 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.22 -1.33 -0.10 4.61 0.00 -0.11 -0.79 121.76 122.83 2pox s ALA 17 Ca 0.05 1.00 0.02 0.00 0.00 0.00 0.00 51.96 53.03 2pox s ALA 17 Cb -0.01 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 22.98 2pox s ALA 17 CO 0.01 -0.31 -0.14 0.08 0.00 0.00 0.00 175.76 175.40 2pox s VAL 18 N -0.95 1.38 -1.27 0.00 1.01 -0.88 -0.93 120.40 118.77 2pox s VAL 18 Ca -0.10 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 61.27 2pox s VAL 18 Cb -0.03 -1.27 0.03 0.00 0.00 0.00 0.00 36.38 35.11 2pox s VAL 18 CO 0.06 0.42 0.29 0.59 0.00 0.00 0.00 175.10 176.46 2pox n ASN 19 N 4.22 -4.35 0.00 3.32 3.02 0.80 -1.48 115.26 120.79 2pox n ASN 19 Ca -0.19 -0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.24 2pox n ASN 19 Cb 0.51 -3.61 0.00 0.00 -0.61 0.00 0.00 39.78 36.07 2pox n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pox n GLY 20 N -1.08 0.95 3.48 7.41 0.00 -1.26 -5.03 105.19 109.66 2pox n GLY 20 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.32 3.23 0.61 1.61 3.76 -0.55 -5.05 115.29 115.58 2pox s HIS 21 Ca 0.00 -0.45 -0.14 0.00 -0.15 0.00 0.00 55.06 54.31 2pox s HIS 21 Cb 0.00 -2.49 -0.03 0.00 1.11 0.00 0.00 32.58 31.17 2pox s HIS 21 CO 0.00 -0.47 1.05 -1.25 -0.85 0.00 0.00 174.74 173.21 2pox s PRO 22 N 1.68 3.33 0.26 8.40 0.04 -1.26 -2.07 135.00 145.38 2pox s PRO 22 Ca 0.05 1.08 -0.13 0.00 0.04 0.00 0.00 61.00 62.04 2pox s PRO 22 Cb -0.18 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2pox s PRO 22 CO 0.09 -0.79 0.52 -0.59 0.04 0.00 0.00 177.00 176.27 2pox s PHE 23 N -2.66 0.32 -0.16 0.56 -0.12 0.03 -4.32 117.98 111.63 2pox s PHE 23 Ca 0.61 -0.70 -0.15 0.00 -0.05 0.00 0.00 56.93 56.64 2pox s PHE 23 Cb -0.14 0.26 0.04 0.00 -0.63 0.00 0.00 43.02 42.55 2pox s PHE 23 CO 0.41 -1.05 0.43 0.00 -0.05 0.00 0.00 175.22 174.96 2pox s ALA 24 N -3.89 -1.07 -0.01 1.99 0.00 -0.27 -1.73 121.76 116.78 2pox s ALA 24 Ca 0.21 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.42 2pox s ALA 24 Cb -0.01 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.38 2pox s ALA 24 CO 0.09 -0.21 -0.02 0.42 0.00 0.00 0.00 175.76 176.04 2pox s ILE 25 N 0.30 0.22 0.17 0.00 1.01 -0.37 -0.31 121.20 122.21 2pox s ILE 25 Ca -0.01 -0.10 0.11 0.00 0.00 0.00 0.00 60.65 60.65 2pox s ILE 25 Cb -0.03 -0.20 -0.04 0.00 0.01 0.00 0.00 42.46 42.19 2pox s ILE 25 CO -0.00 0.07 -0.21 -1.61 0.00 0.00 0.00 174.94 173.19 2pox s GLU 26 N 0.06 1.63 -0.00 2.79 2.02 -0.74 -0.50 118.70 123.95 2pox s GLU 26 Ca -0.00 -1.40 -0.06 0.00 0.02 0.00 0.00 54.97 53.52 2pox s GLU 26 Cb -0.03 -1.95 0.00 0.00 0.10 0.00 0.00 34.13 32.26 2pox s GLU 26 CO -0.00 0.43 0.12 0.20 0.02 0.00 0.00 175.26 176.02 2pox s GLY 27 N -2.52 0.05 -0.03 -1.39 0.00 -0.77 -0.60 107.32 102.06 2pox s GLY 27 Ca 0.20 -0.11 0.02 0.00 0.00 0.00 0.00 44.72 44.82 2pox s GLY 27 CO 0.10 -0.23 -0.08 0.14 0.00 0.00 0.00 173.10 173.03 2pox s VAL 28 N -1.20 0.70 0.15 1.40 1.01 -0.64 -1.36 120.40 120.46 2pox s VAL 28 Ca -0.13 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.54 2pox s VAL 28 Cb -0.07 -0.64 0.01 0.00 0.00 0.00 0.00 36.38 35.68 2pox s VAL 28 CO 0.01 0.23 0.24 0.61 0.00 0.00 0.00 175.10 176.19 2pox n GLY 29 N 3.49 2.30 3.32 4.51 0.00 -0.02 -0.87 105.19 117.94 2pox n GLY 29 Ca -0.20 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.34 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 0.40 0.24 0.99 1.43 -0.08 -1.18 118.68 120.48 2pox s LEU 30 Ca 0.10 0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.26 2pox s LEU 30 Cb -0.01 1.66 0.02 0.00 0.03 0.00 0.00 46.19 47.89 2pox s LEU 30 CO 0.07 -0.52 0.59 -0.83 0.23 0.00 0.00 176.35 175.90 2pox s GLY 31 N -1.38 0.07 -0.44 -3.19 0.00 -0.09 -0.98 107.32 101.31 2pox s GLY 31 Ca -0.12 -0.42 0.04 0.00 0.00 0.00 0.00 44.72 44.21 2pox s GLY 31 CO 0.05 -0.28 0.18 0.54 0.00 0.00 0.00 173.10 173.59 2pox s LYS 32 N -3.93 1.68 0.36 2.90 1.02 0.73 -1.42 119.74 121.08 2pox s LYS 32 Ca 0.14 -2.24 0.04 0.00 0.02 0.00 0.00 55.97 53.92 2pox s LYS 32 Cb -0.03 -3.11 0.70 0.00 -0.52 0.00 0.00 37.83 34.87 2pox s LYS 32 CO 0.04 -1.05 2.01 -1.35 -0.92 0.00 0.00 175.35 174.08 2pox h PRO 33 N 6.97 0.76 0.00 -1.68 0.11 -1.80 0.83 132.00 137.18 2pox h PRO 33 Ca -0.06 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2pox h PRO 33 Cb 0.94 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2pox h PRO 33 CO 0.60 0.50 -0.12 0.74 -0.21 0.00 0.00 178.00 179.52 2pox h PHE 34 N 0.78 0.00 0.00 0.65 -1.00 -1.84 -3.16 116.94 112.38 2pox h PHE 34 Ca 0.23 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.01 2pox h PHE 34 Cb -0.02 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.54 2pox h PHE 34 CO -0.00 0.00 -0.85 0.39 -1.61 0.00 0.00 178.31 176.24 2pox n GLU 35 N -2.75 0.08 -2.95 1.51 1.02 -0.65 -4.71 120.64 112.18 2pox n GLU 35 Ca 0.04 -0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 57.07 2pox n GLU 35 Cb 0.50 -1.52 0.04 0.00 -0.02 0.00 0.00 31.44 30.43 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 1.47 0.17 2.97 0.62 0.00 0.19 -4.66 105.19 105.95 2pox n GLY 36 Ca 0.04 -0.21 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2pox n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pox s LYS 37 N -5.38 0.34 0.06 1.61 1.02 -1.07 -1.00 119.74 115.30 2pox s LYS 37 Ca 0.21 -0.36 -0.18 0.00 0.02 0.00 0.00 55.97 55.66 2pox s LYS 37 Cb -0.09 -0.21 0.04 0.00 -0.52 0.00 0.00 37.83 37.04 2pox s LYS 37 CO 0.36 0.05 0.42 1.14 -0.92 0.00 0.00 175.35 176.40 2pox s GLN 38 N -0.67 0.96 0.11 1.68 -2.07 -0.47 -0.20 119.66 119.00 2pox s GLN 38 Ca -0.04 -0.40 -0.04 0.00 -1.82 0.00 0.00 55.36 53.06 2pox s GLN 38 Cb -0.05 0.43 -0.03 0.00 -1.09 0.00 0.00 33.01 32.27 2pox s GLN 38 CO -0.00 -0.34 0.10 -1.54 -1.32 0.00 0.00 175.29 172.19 2pox s SER 39 N -2.12 0.28 0.06 12.60 1.04 -0.15 -1.52 113.70 123.89 2pox s SER 39 Ca -0.04 -1.01 -0.21 0.00 0.48 0.00 0.00 55.95 55.18 2pox s SER 39 Cb -0.00 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.47 2pox s SER 39 CO -0.04 -0.73 0.49 0.00 0.98 0.00 0.00 173.24 173.94 2pox s MET 40 N -3.97 1.03 -0.09 4.02 0.23 -0.35 -0.90 119.30 119.27 2pox s MET 40 Ca 0.15 -0.33 -0.01 0.00 -1.03 0.00 0.00 55.69 54.48 2pox s MET 40 Cb 0.06 0.47 -0.03 0.00 -1.53 0.00 0.00 34.83 33.80 2pox s MET 40 CO -0.04 -0.38 -0.05 -0.51 -2.03 0.00 0.00 175.02 172.02 2pox s ASP 41 N -2.12 4.79 -0.01 -1.18 1.01 -0.05 -0.65 116.67 118.46 2pox s ASP 41 Ca -0.04 -0.01 0.05 0.00 0.71 0.00 0.00 52.55 53.26 2pox s ASP 41 Cb -0.00 -1.35 -0.01 0.00 1.01 0.00 0.00 42.92 42.57 2pox s ASP 41 CO -0.04 0.33 -0.15 -0.76 0.21 0.00 0.00 175.17 174.76 2pox s LEU 42 N -0.61 2.02 -0.07 1.23 1.43 0.30 -1.62 118.68 121.36 2pox s LEU 42 Ca 0.09 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.93 2pox s LEU 42 Cb -0.12 -0.80 0.02 0.00 0.03 0.00 0.00 46.19 45.32 2pox s LEU 42 CO 0.02 0.18 -0.10 -0.54 0.23 0.00 0.00 176.35 176.15 2pox s LYS 43 N -0.32 1.49 -0.06 1.70 1.02 0.23 -1.62 119.74 122.18 2pox s LYS 43 Ca 0.05 -0.32 -0.30 0.00 0.02 0.00 0.00 55.97 55.42 2pox s LYS 43 Cb -0.06 -1.34 -0.03 0.00 -0.52 0.00 0.00 37.83 35.88 2pox s LYS 43 CO -0.00 -0.06 1.24 0.08 -0.92 0.00 0.00 175.35 175.69 2pox s VAL 44 N 0.95 4.17 -0.15 3.17 1.01 -0.42 -1.80 120.40 127.33 2pox s VAL 44 Ca -0.10 1.50 0.11 0.00 0.00 0.00 0.00 61.98 63.49 2pox s VAL 44 Cb -0.15 -3.96 -0.17 0.00 0.00 0.00 0.00 36.38 32.10 2pox s VAL 44 CO 0.00 -0.01 0.01 0.29 0.00 0.00 0.00 175.10 175.39 2pox n LYS 45 N 5.36 1.42 -3.81 2.72 4.76 0.58 -4.92 118.16 124.25 2pox n LYS 45 Ca 0.12 0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.45 2pox n LYS 45 Cb 0.46 -1.37 -0.12 0.00 -1.84 0.00 0.00 35.03 32.16 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 -2.36 0.27 0.00 1.97 2.02 -0.99 -4.89 118.70 114.72 2pox s GLU 46 Ca -0.10 0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.04 2pox s GLU 46 Cb 0.05 0.13 0.00 0.00 0.10 0.00 0.00 34.13 34.40 2pox s GLU 46 CO 0.57 -0.04 0.00 0.41 0.02 0.00 0.00 175.26 176.21 2pox n GLY 47 N 2.70 0.73 3.85 -1.39 0.00 -1.26 -1.11 105.19 108.72 2pox n GLY 47 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.88 1.85 0.21 -0.02 0.00 -1.26 -3.73 107.32 102.48 2pox s GLY 48 Ca 0.00 0.06 -0.30 0.00 0.00 0.00 0.00 44.72 44.48 2pox s GLY 48 CO 0.00 0.34 1.34 2.56 0.00 0.00 0.00 173.10 177.34 2pox s PRO 49 N -4.67 4.36 0.21 2.90 0.04 -1.26 -5.06 135.00 131.51 2pox s PRO 49 Ca 0.57 2.11 -0.32 0.00 0.04 0.00 0.00 61.00 63.40 2pox s PRO 49 Cb -0.11 -3.18 -0.12 0.00 0.04 0.00 0.00 34.50 31.13 2pox s PRO 49 CO 0.44 -0.29 1.72 1.28 0.04 0.00 0.00 177.00 180.19 2pox n LEU 50 N 2.61 3.94 -0.62 -3.56 4.77 -1.24 -4.87 117.00 118.03 2pox n LEU 50 Ca 0.06 1.06 0.05 0.00 -0.03 0.00 0.00 56.01 57.16 2pox n LEU 50 Cb 0.42 -1.57 0.14 0.00 -2.33 0.00 0.00 43.42 40.09 2pox n LEU 50 CO 0.58 0.15 0.61 -0.81 -1.33 0.00 0.00 177.39 176.60 2pox n PRO 51 N 3.94 1.80 -4.25 3.23 -0.04 -1.26 -4.90 135.00 133.51 2pox n PRO 51 Ca 0.16 -1.15 -0.14 0.00 -0.04 0.00 0.00 63.50 62.33 2pox n PRO 51 Cb 0.34 -1.29 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 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 -1.59 1.24 -0.17 0.54 -0.12 -1.26 -4.63 117.98 111.99 2pox s PHE 52 Ca 0.21 -0.88 -0.32 0.00 -0.05 0.00 0.00 56.93 55.89 2pox s PHE 52 Cb 0.11 -0.68 -0.10 0.00 -0.63 0.00 0.00 43.02 41.73 2pox s PHE 52 CO 0.14 -0.06 2.05 0.00 -0.05 0.00 0.00 175.22 177.30 2pox n ALA 53 N -0.22 1.22 -0.18 1.99 0.00 0.49 -4.86 120.51 118.95 2pox n ALA 53 Ca -0.09 0.06 0.20 0.00 0.00 0.00 0.00 53.44 53.62 2pox n ALA 53 Cb 0.62 -2.64 0.58 0.00 0.00 0.00 0.00 19.45 18.01 2pox n ALA 53 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2pox h TYR 54 N 11.58 0.34 -0.51 0.00 3.20 -1.95 -2.23 116.97 127.39 2pox h TYR 54 Ca -0.42 0.01 0.15 0.00 3.14 0.00 0.00 58.73 61.61 2pox h TYR 54 Cb 1.27 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.42 2pox h TYR 54 CO 0.92 0.10 0.46 -0.44 -1.64 0.00 0.00 178.16 177.56 2pox h ASP 55 N 0.26 0.00 0.41 -2.11 3.32 -1.96 0.13 116.42 116.47 2pox h ASP 55 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 2pox h ASP 55 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2pox h ASP 55 CO -0.10 0.00 0.00 0.16 -1.72 0.00 0.00 179.24 177.58 2pox h ILE 56 N 0.00 0.00 0.00 0.35 3.07 -1.79 -3.04 117.51 116.09 2pox h ILE 56 Ca 0.24 -0.20 -0.05 0.00 1.55 0.00 0.00 64.86 66.40 2pox h ILE 56 Cb 1.16 1.19 -0.01 0.00 -0.27 0.00 0.00 36.82 38.88 2pox h ILE 56 CO -0.00 0.00 -1.48 0.18 -1.05 0.00 0.00 178.15 175.80 2pox n LEU 57 N -3.05 0.53 -0.07 0.16 4.77 0.03 -4.66 117.00 114.70 2pox n LEU 57 Ca -0.02 0.21 -0.09 0.00 -0.03 0.00 0.00 56.01 56.09 2pox n LEU 57 Cb 0.16 0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.34 2pox n LEU 57 CO 0.23 -0.03 0.64 0.71 -1.33 0.00 0.00 177.39 177.61 2pox h THR 58 N 0.00 1.28 0.00 -5.08 1.35 -1.57 -1.58 112.91 107.31 2pox h THR 58 Ca -0.06 -1.45 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2pox h THR 58 Cb 1.17 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.93 2pox h THR 58 CO 0.01 0.48 0.00 0.35 -0.25 0.00 0.00 175.52 176.11 2pox n THR 59 N -4.08 0.32 0.04 6.82 -2.24 -1.26 -2.80 114.28 111.08 2pox n THR 59 Ca -0.01 0.08 -0.22 0.00 -2.27 0.00 0.00 64.05 61.63 2pox n THR 59 Cb 0.48 -0.71 -0.14 0.00 -2.10 0.00 0.00 70.33 67.86 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 0.80 0.00 2.28 2.07 -1.59 -3.46 116.25 116.36 2pox h VAL 60 Ca 0.00 -2.43 -0.30 0.00 0.82 0.00 0.00 66.70 64.79 2pox h VAL 60 Cb 0.23 2.64 0.04 0.00 -1.52 0.00 0.00 31.29 32.69 2pox h VAL 60 CO 0.00 0.86 1.60 0.49 0.02 0.00 0.00 177.57 180.54 2pox n PHE 61 N -3.58 0.53 0.00 1.57 0.99 -1.03 -5.02 117.46 110.93 2pox n PHE 61 Ca -0.28 -0.98 0.00 0.00 -0.00 0.00 0.00 57.45 56.19 2pox n PHE 61 Cb 1.05 -1.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.53 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 6.08 0.00 0.00 4.37 5.15 -1.26 -5.12 115.26 124.47 2pox n ASN 65 Ca 0.27 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 54.33 2pox n ASN 65 Cb 0.18 0.00 0.52 0.00 -0.53 0.00 0.00 39.78 39.95 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 0.65 0.21 1.20 5.12 -1.26 -2.22 116.66 120.36 2pox n ARG 66 Ca 0.00 0.00 0.06 0.00 -1.93 0.00 0.00 57.85 55.98 2pox n ARG 66 Cb 0.00 -1.42 0.55 0.00 -1.16 0.00 0.00 32.46 30.43 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 1.07 -0.74 1.55 2.07 -1.96 -2.79 116.25 115.45 2pox h VAL 67 Ca 0.00 -0.29 -0.43 0.00 0.82 0.00 0.00 66.70 66.79 2pox h VAL 67 Cb 0.00 1.07 -0.17 0.00 -1.52 0.00 0.00 31.29 30.67 2pox h VAL 67 CO 0.00 0.09 0.50 0.49 0.02 0.00 0.00 177.57 178.67 2pox n PHE 68 N -4.44 1.86 -5.11 1.57 3.01 -0.94 -4.65 117.46 108.75 2pox n PHE 68 Ca -0.02 -2.14 -0.32 0.00 1.01 0.00 0.00 57.45 55.98 2pox n PHE 68 Cb 0.15 -1.14 -0.16 0.00 -0.01 0.00 0.00 39.48 38.32 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 -2.17 2.33 -0.32 4.37 0.00 -1.05 -3.95 121.76 120.97 2pox s ALA 69 Ca 0.43 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 2pox s ALA 69 Cb 0.32 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2pox s ALA 69 CO -0.07 0.39 1.13 0.21 0.00 0.00 0.00 175.76 177.42 2pox s LYS 70 N -0.09 4.02 -0.19 0.00 2.20 -0.43 -4.68 119.74 120.56 2pox s LYS 70 Ca -0.05 1.10 -0.07 0.00 -0.36 0.00 0.00 55.97 56.60 2pox s LYS 70 Cb -0.14 -3.78 -0.04 0.00 -1.51 0.00 0.00 37.83 32.36 2pox s LYS 70 CO 0.04 -0.97 0.06 0.71 -0.36 0.00 0.00 175.35 174.84 2pox s TYR 71 N 3.84 3.21 0.88 4.03 2.02 -1.26 -0.63 117.35 129.44 2pox s TYR 71 Ca 0.48 -0.03 -0.11 0.00 -0.37 0.00 0.00 57.07 57.04 2pox s TYR 71 Cb -0.13 -2.11 0.12 0.00 -0.40 0.00 0.00 41.96 39.44 2pox s TYR 71 CO 0.18 0.05 1.09 -1.25 -1.57 0.00 0.00 175.55 174.05 2pox s PRO 72 N 0.61 1.36 0.52 -1.71 0.04 -1.26 -4.92 135.00 129.65 2pox s PRO 72 Ca 0.03 0.87 0.25 0.00 0.04 0.00 0.00 61.00 62.20 2pox s PRO 72 Cb -0.13 -1.82 1.43 0.00 0.04 0.00 0.00 34.50 34.03 2pox s PRO 72 CO 0.01 -2.18 2.09 1.49 0.04 0.00 0.00 177.00 178.45 2pox h GLU 73 N -1.51 0.00 -0.01 4.56 4.81 -1.99 -2.80 114.58 117.64 2pox h GLU 73 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2pox h GLU 73 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2pox h GLU 73 CO 0.54 0.11 -0.06 0.27 -0.73 0.00 0.00 179.01 179.14 2pox n ASN 74 N -3.79 0.82 -4.26 1.04 6.94 -1.26 -4.71 115.26 110.03 2pox n ASN 74 Ca -0.02 -1.06 -0.33 0.00 -0.02 0.00 0.00 54.58 53.15 2pox n ASN 74 Cb 0.21 -0.01 -0.15 0.00 -2.36 0.00 0.00 39.78 37.47 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 -2.19 2.63 0.13 1.53 1.01 -1.06 -5.07 121.20 118.18 2pox s ILE 75 Ca 0.36 -0.78 -0.33 0.00 0.00 0.00 0.00 60.65 59.90 2pox s ILE 75 Cb 0.21 -2.11 -0.12 0.00 0.01 0.00 0.00 42.46 40.45 2pox s ILE 75 CO 0.40 0.52 1.72 0.52 0.00 0.00 0.00 174.94 178.10 2pox n VAL 76 N 4.09 0.18 -3.28 2.92 0.31 -1.26 -4.73 118.33 116.56 2pox n VAL 76 Ca -0.19 -0.03 -0.46 0.00 -0.01 0.00 0.00 64.34 63.64 2pox n VAL 76 Cb 0.52 -1.83 -0.03 0.00 -0.91 0.00 0.00 33.84 31.59 2pox n VAL 76 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2pox s ASP 77 N 1.88 6.60 0.35 4.52 -1.08 -1.26 -4.69 116.67 123.00 2pox s ASP 77 Ca 0.81 -2.39 0.02 0.00 -0.52 0.00 0.00 52.55 50.48 2pox s ASP 77 Cb -0.59 -2.23 0.65 0.00 -1.46 0.00 0.00 42.92 39.28 2pox s ASP 77 CO 0.38 -0.70 2.01 0.22 0.52 0.00 0.00 175.17 177.60 2pox h TYR 78 N 8.17 0.78 0.01 -5.34 3.20 -1.92 -2.75 116.97 119.12 2pox h TYR 78 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2pox h TYR 78 Cb 1.05 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.06 2pox h TYR 78 CO 0.97 0.50 -0.00 0.74 -1.64 0.00 0.00 178.16 178.73 2pox h PHE 79 N 0.84 -0.01 -0.26 -3.82 -1.00 -1.90 -2.78 116.94 108.02 2pox h PHE 79 Ca 0.23 -0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.00 2pox h PHE 79 Cb -0.09 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.46 2pox h PHE 79 CO 0.00 0.80 0.14 0.87 -1.61 0.00 0.00 178.31 178.51 2pox h LYS 80 N -0.86 0.35 0.00 1.51 1.57 -1.88 -2.22 116.57 115.03 2pox h LYS 80 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2pox h LYS 80 Cb 0.82 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2pox h LYS 80 CO 0.00 0.26 0.00 1.96 -0.57 0.00 0.00 179.45 181.10 2pox h GLN 81 N 0.35 0.00 0.00 3.15 1.08 -1.46 -3.21 115.11 115.02 2pox h GLN 81 Ca 0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 2pox h GLN 81 Cb 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 2pox h GLN 81 CO -0.02 0.00 0.00 -1.13 -0.95 0.00 0.00 178.83 176.73 2pox n SER 82 N -2.49 0.30 -4.91 1.46 3.41 -0.83 -4.84 113.62 105.72 2pox n SER 82 Ca 0.03 0.53 -0.29 0.00 -0.26 0.00 0.00 58.87 58.88 2pox n SER 82 Cb 0.33 -0.61 -0.03 0.00 -0.26 0.00 0.00 64.21 63.64 2pox n SER 82 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2pox s PHE 83 N -3.04 3.47 0.09 7.33 0.40 -1.21 0.14 117.98 125.15 2pox s PHE 83 Ca 0.12 0.59 0.28 0.00 -0.60 0.00 0.00 56.93 57.32 2pox s PHE 83 Cb 0.16 -2.05 1.07 0.00 0.51 0.00 0.00 43.02 42.71 2pox s PHE 83 CO 0.54 0.25 1.88 -1.00 0.70 0.00 0.00 175.22 177.59 2pox h PRO 84 N 1.91 0.00 -0.62 0.24 0.13 -1.91 -3.46 132.00 128.29 2pox h PRO 84 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 2pox h PRO 84 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2pox h PRO 84 CO 0.67 0.12 0.20 0.93 -0.23 0.00 0.00 178.00 179.69 2pox h GLU 85 N 0.00 0.94 0.00 0.86 3.07 -1.93 -3.37 114.58 114.15 2pox h GLU 85 Ca -0.00 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 2pox h GLU 85 Cb 0.67 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2pox h GLU 85 CO 0.02 0.81 0.00 0.41 -1.40 0.00 0.00 179.01 178.84 2pox n GLY 86 N -0.89 -1.80 3.69 -3.84 0.00 0.36 -4.79 105.19 97.92 2pox n GLY 86 Ca 0.05 -1.76 -0.11 0.00 0.00 0.00 0.00 46.02 44.20 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 0.42 0.10 1.61 1.13 -1.16 -1.59 117.35 117.86 2pox s TYR 87 Ca 0.00 -0.90 0.01 0.00 -1.41 0.00 0.00 57.07 54.77 2pox s TYR 87 Cb 0.00 0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 41.29 2pox s TYR 87 CO 0.00 -1.35 -0.03 -1.54 -2.51 0.00 0.00 175.55 170.12 2pox s SER 88 N -3.11 0.93 0.06 -0.18 1.04 -0.49 -1.09 113.70 110.87 2pox s SER 88 Ca 0.21 -1.05 0.01 0.00 0.48 0.00 0.00 55.95 55.59 2pox s SER 88 Cb -0.03 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 2pox s SER 88 CO 0.14 -0.54 -0.05 -1.66 0.98 0.00 0.00 173.24 172.11 2pox s TRP 89 N -3.74 0.64 0.05 5.02 1.48 -0.29 -1.40 118.94 120.71 2pox s TRP 89 Ca 0.14 -0.86 0.05 0.00 -1.06 0.00 0.00 56.10 54.37 2pox s TRP 89 Cb 0.06 -0.41 -0.02 0.00 -1.16 0.00 0.00 33.47 31.94 2pox s TRP 89 CO -0.04 -0.23 -0.14 -1.83 -4.06 0.00 0.00 176.95 170.65 2pox s GLU 90 N -3.24 0.90 -0.15 3.25 -1.05 -0.72 -1.72 118.70 115.97 2pox s GLU 90 Ca 0.03 -0.81 -0.13 0.00 -0.15 0.00 0.00 54.97 53.92 2pox s GLU 90 Cb 0.02 -0.91 0.04 0.00 -0.44 0.00 0.00 34.13 32.84 2pox s GLU 90 CO -0.05 0.22 0.38 0.50 0.95 0.00 0.00 175.26 177.26 2pox s ARG 91 N -1.30 0.43 -0.07 -4.83 3.52 -0.18 -0.56 118.95 115.97 2pox s ARG 91 Ca 0.01 0.57 -0.02 0.00 -0.13 0.00 0.00 55.73 56.16 2pox s ARG 91 Cb -0.08 0.18 -0.03 0.00 -1.56 0.00 0.00 34.95 33.45 2pox s ARG 91 CO 0.02 -0.07 0.01 0.45 -0.81 0.00 0.00 175.30 174.89 2pox s SER 92 N 0.39 5.26 -0.27 -2.12 0.15 -0.58 -0.96 113.70 115.57 2pox s SER 92 Ca -0.02 0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.78 2pox s SER 92 Cb -0.04 -1.47 0.08 0.00 -1.71 0.00 0.00 66.02 62.88 2pox s SER 92 CO -0.01 0.37 0.01 -0.04 1.20 0.00 0.00 173.24 174.76 2pox s MET 93 N -0.99 1.32 -0.45 5.44 -1.94 0.95 -1.64 119.30 121.99 2pox s MET 93 Ca 0.14 -1.13 -0.10 0.00 -1.71 0.00 0.00 55.69 52.89 2pox s MET 93 Cb -0.11 -2.53 0.09 0.00 2.01 0.00 0.00 34.83 34.29 2pox s MET 93 CO 0.04 -0.75 0.32 1.21 -0.01 0.00 0.00 175.02 175.82 2pox s ASN 94 N 1.39 5.76 0.51 3.03 3.84 -0.35 -0.97 114.94 128.14 2pox s ASN 94 Ca 0.01 -1.63 -0.14 0.00 0.21 0.00 0.00 52.86 51.31 2pox s ASN 94 Cb -0.18 -2.03 -0.07 0.00 -0.55 0.00 0.00 41.25 38.42 2pox s ASN 94 CO -0.11 -0.62 0.94 -0.31 -2.79 0.00 0.00 177.10 174.20 2pox s TYR 95 N 1.44 3.49 0.48 0.43 1.51 0.14 -1.04 117.35 123.79 2pox s TYR 95 Ca 0.04 1.32 0.33 0.00 -1.01 0.00 0.00 57.07 57.75 2pox s TYR 95 Cb -0.25 -2.68 1.78 0.00 -0.11 0.00 0.00 41.96 40.70 2pox s TYR 95 CO 0.02 -0.36 2.18 1.05 -1.11 0.00 0.00 175.55 177.33 2pox h GLU 96 N 0.76 0.00 -0.63 -0.62 4.11 -1.29 -1.52 114.58 115.39 2pox h GLU 96 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2pox h GLU 96 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2pox h GLU 96 CO 0.62 0.05 0.00 -0.40 0.07 0.00 0.00 179.01 179.35 2pox n ASP 97 N -3.46 3.91 0.00 3.06 5.75 -1.26 -4.93 116.55 119.62 2pox n ASP 97 Ca -0.02 -2.29 0.00 0.00 -0.01 0.00 0.00 54.79 52.47 2pox n ASP 97 Cb 0.17 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 39.76 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 1.12 1.81 3.74 6.12 0.00 -0.57 -4.84 105.19 112.57 2pox n GLY 98 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.15 1.86 -0.05 -0.02 0.00 -1.19 -4.82 107.32 100.95 2pox s GLY 99 Ca 0.00 1.57 0.02 0.00 0.00 0.00 0.00 44.72 46.31 2pox s GLY 99 CO 0.00 2.64 -0.09 -0.42 0.00 0.00 0.00 173.10 175.22 2pox s ILE 100 N 0.35 0.88 -0.13 0.90 1.01 -0.89 -0.68 121.20 122.64 2pox s ILE 100 Ca 0.66 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.97 2pox s ILE 100 Cb -0.48 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.17 2pox s ILE 100 CO 0.43 0.29 -0.17 0.00 0.00 0.00 0.00 174.94 175.49 2pox s ASN 102 N 0.53 5.34 0.02 0.00 0.01 -0.23 -0.03 114.94 120.58 2pox s ASN 102 Ca -0.11 0.15 -0.04 0.00 -0.71 0.00 0.00 52.86 52.15 2pox s ASN 102 Cb -0.16 -1.58 -0.01 0.00 0.41 0.00 0.00 41.25 39.90 2pox s ASN 102 CO 0.04 0.35 0.07 0.00 -1.51 0.00 0.00 177.10 176.05 2pox s ALA 103 N -0.73 -0.05 0.04 0.60 0.00 -0.14 -0.77 121.76 120.71 2pox s ALA 103 Ca 0.12 -0.49 0.02 0.00 0.00 0.00 0.00 51.96 51.60 2pox s ALA 103 Cb -0.12 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 2pox s ALA 103 CO 0.02 -0.25 -0.07 0.95 0.00 0.00 0.00 175.76 176.41 2pox s THR 104 N -2.07 0.45 -0.05 0.00 -4.23 -0.41 -1.01 115.64 108.32 2pox s THR 104 Ca -0.10 -1.03 -0.00 0.00 -1.18 0.00 0.00 61.69 59.38 2pox s THR 104 Cb -0.05 -0.53 0.03 0.00 1.34 0.00 0.00 72.50 73.29 2pox s THR 104 CO -0.02 -0.40 0.00 0.21 -0.54 0.00 0.00 174.62 173.87 2pox s ASN 105 N -1.54 0.97 -0.29 3.99 3.84 -0.70 -1.39 114.94 119.83 2pox s ASN 105 Ca -0.11 -0.04 -0.09 0.00 0.21 0.00 0.00 52.86 52.82 2pox s ASN 105 Cb -0.10 -0.31 -0.02 0.00 -0.55 0.00 0.00 41.25 40.27 2pox s ASN 105 CO 0.00 -0.14 0.13 -0.62 -2.79 0.00 0.00 177.10 173.68 2pox s ASP 106 N 1.47 5.46 -0.25 -4.21 2.15 -0.60 -1.14 116.67 119.55 2pox s ASP 106 Ca -0.03 -0.39 -0.06 0.00 0.43 0.00 0.00 52.55 52.50 2pox s ASP 106 Cb -0.13 -1.99 -0.02 0.00 -0.30 0.00 0.00 42.92 40.49 2pox s ASP 106 CO -0.03 -0.13 0.04 -0.63 -0.17 0.00 0.00 175.17 174.25 2pox s ILE 107 N 1.63 3.97 0.43 4.11 1.01 -0.25 -1.60 121.20 130.50 2pox s ILE 107 Ca 0.05 -0.35 0.06 0.00 0.00 0.00 0.00 60.65 60.41 2pox s ILE 107 Cb -0.16 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 2pox s ILE 107 CO 0.06 0.32 0.16 0.42 0.00 0.00 0.00 174.94 175.90 2pox s THR 108 N 1.56 2.08 -0.10 2.92 -4.23 0.02 -3.00 115.64 114.88 2pox s THR 108 Ca 0.06 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 2pox s THR 108 Cb -0.15 -2.84 0.02 0.00 1.34 0.00 0.00 72.50 70.88 2pox s THR 108 CO 0.01 0.00 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.79 2pox s LEU 109 N -3.91 1.27 -0.30 4.79 2.96 -1.26 -0.51 118.68 121.73 2pox s LEU 109 Ca 0.36 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 2pox s LEU 109 Cb 0.04 -0.80 0.08 0.00 0.50 0.00 0.00 46.19 46.01 2pox s LEU 109 CO 0.20 -0.09 0.01 -0.62 -1.32 0.00 0.00 176.35 174.53 2pox s ASP 110 N 1.45 4.34 1.87 3.68 2.15 0.56 -4.99 116.67 125.73 2pox s ASP 110 Ca -0.00 -1.70 0.00 0.00 0.43 0.00 0.00 52.55 51.28 2pox s ASP 110 Cb -0.13 -1.35 0.00 0.00 -0.30 0.00 0.00 42.92 41.13 2pox s ASP 110 CO -0.05 -0.32 0.00 0.61 -0.17 0.00 0.00 175.17 175.24 2pox n GLY 111 N 4.50 3.19 1.46 2.66 0.00 -1.26 -1.26 105.19 114.48 2pox n GLY 111 Ca -0.04 0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.24 2pox n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2pox n ASP 112 N 9.93 4.55 -4.34 1.61 3.85 -1.26 -4.94 116.55 125.95 2pox n ASP 112 Ca 0.00 -2.43 -0.33 0.00 -0.71 0.00 0.00 54.79 51.32 2pox n ASP 112 Cb 0.00 -0.55 -0.15 0.00 -1.35 0.00 0.00 41.12 39.07 2pox n ASP 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2pox s TYR 114 N 0.22 3.73 -0.14 0.00 1.51 0.24 -0.32 117.35 122.59 2pox s TYR 114 Ca -0.10 1.40 0.01 0.00 -1.01 0.00 0.00 57.07 57.37 2pox s TYR 114 Cb -0.16 -2.75 -0.00 0.00 -0.11 0.00 0.00 41.96 38.94 2pox s TYR 114 CO 0.06 0.31 -0.17 0.42 -1.11 0.00 0.00 175.55 175.06 2pox s ILE 115 N -0.17 2.52 -0.14 2.71 1.01 0.33 -1.27 121.20 126.19 2pox s ILE 115 Ca 0.36 -0.83 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 2pox s ILE 115 Cb -0.20 -2.04 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 2pox s ILE 115 CO 0.21 0.53 -0.06 -0.31 0.00 0.00 0.00 174.94 175.31 2pox s TYR 116 N 0.71 2.96 -0.34 3.97 2.02 -0.17 -0.80 117.35 125.70 2pox s TYR 116 Ca -0.08 -0.36 -0.07 0.00 -0.37 0.00 0.00 57.07 56.20 2pox s TYR 116 Cb -0.16 -1.91 0.04 0.00 -0.40 0.00 0.00 41.96 39.53 2pox s TYR 116 CO 0.01 -0.05 0.11 -2.00 -1.57 0.00 0.00 175.55 172.05 2pox s GLU 117 N 0.26 2.64 -0.05 -0.62 2.12 -0.63 -2.18 118.70 120.25 2pox s GLU 117 Ca -0.05 -1.17 0.05 0.00 0.36 0.00 0.00 54.97 54.16 2pox s GLU 117 Cb -0.14 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.75 2pox s GLU 117 CO 0.04 -0.66 -0.18 0.42 -0.54 0.00 0.00 175.26 174.34 2pox s ILE 118 N 1.41 2.77 -0.03 -3.70 1.01 -0.54 -1.56 121.20 120.57 2pox s ILE 118 Ca -0.01 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.87 2pox s ILE 118 Cb -0.19 -2.06 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 2pox s ILE 118 CO 0.03 0.59 -0.22 -0.60 0.00 0.00 0.00 174.94 174.74 2pox s ARG 119 N -0.64 1.94 -0.05 2.79 6.06 -0.49 -1.95 118.95 126.62 2pox s ARG 119 Ca 0.10 -0.78 -0.00 0.00 -2.50 0.00 0.00 55.73 52.55 2pox s ARG 119 Cb -0.11 -1.78 0.03 0.00 0.06 0.00 0.00 34.95 33.15 2pox s ARG 119 CO 0.00 0.41 -0.00 0.12 -2.50 0.00 0.00 175.30 173.33 2pox s PHE 120 N -0.34 0.49 -0.09 5.12 5.36 -0.66 -1.29 117.98 126.58 2pox s PHE 120 Ca 0.04 -0.07 -0.03 0.00 -0.96 0.00 0.00 56.93 55.91 2pox s PHE 120 Cb -0.10 -0.59 0.04 0.00 -0.34 0.00 0.00 43.02 42.03 2pox s PHE 120 CO 0.01 -0.21 0.09 -0.51 -1.46 0.00 0.00 175.22 173.14 2pox s ASP 121 N 1.39 1.35 -0.00 6.13 1.01 0.05 -0.93 116.67 125.67 2pox s ASP 121 Ca -0.04 -0.04 0.05 0.00 0.71 0.00 0.00 52.55 53.23 2pox s ASP 121 Cb -0.13 -0.06 -0.03 0.00 1.01 0.00 0.00 42.92 43.71 2pox s ASP 121 CO -0.02 -0.28 -0.16 -0.83 0.21 0.00 0.00 175.17 174.09 2pox s GLY 122 N 2.19 1.56 0.08 0.21 0.00 -0.10 -1.06 107.32 110.19 2pox s GLY 122 Ca 0.04 -1.08 0.01 0.00 0.00 0.00 0.00 44.72 43.68 2pox s GLY 122 CO -0.05 -0.93 -0.05 -1.34 0.00 0.00 0.00 173.10 170.73 2pox s VAL 123 N -0.84 0.49 -1.17 1.40 -7.23 -0.67 -0.14 120.40 112.24 2pox s VAL 123 Ca 0.13 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2pox s VAL 123 Cb -0.11 -1.54 0.00 0.00 0.56 0.00 0.00 36.38 35.30 2pox s VAL 123 CO 0.03 -0.89 0.00 0.59 -0.31 0.00 0.00 175.10 174.52 2pox n ASN 124 N 0.12 -4.22 -4.65 4.85 3.02 -1.26 -2.08 115.26 111.04 2pox n ASN 124 Ca -0.14 -0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.99 2pox n ASN 124 Cb 0.60 -3.38 -0.03 0.00 -0.61 0.00 0.00 39.78 36.36 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 -2.67 3.32 0.45 3.10 0.08 -1.26 -3.14 117.98 117.85 2pox s PHE 125 Ca 0.00 1.27 -0.24 0.00 0.12 0.00 0.00 56.93 58.08 2pox s PHE 125 Cb 0.00 -3.14 -0.08 0.00 -0.57 0.00 0.00 43.02 39.24 2pox s PHE 125 CO 0.00 -0.43 1.24 -2.14 -0.10 0.00 0.00 175.22 173.79 2pox s PRO 126 N 2.97 3.77 0.37 0.24 0.02 -1.26 -4.90 135.00 136.20 2pox s PRO 126 Ca 0.38 1.98 0.11 0.00 0.02 0.00 0.00 61.00 63.49 2pox s PRO 126 Cb -0.15 -2.54 0.88 0.00 0.02 0.00 0.00 34.50 32.71 2pox s PRO 126 CO 0.07 -0.60 1.85 0.00 -0.33 0.00 0.00 177.00 177.99 2pox h ALA 127 N 2.24 1.91 -0.55 -1.55 0.00 -1.98 -1.76 119.26 117.58 2pox h ALA 127 Ca -0.50 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2pox h ALA 127 Cb 1.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2pox h ALA 127 CO 0.61 -0.19 0.00 0.27 0.00 0.00 0.00 179.25 179.94 2pox n ASN 128 N -4.58 3.68 -4.85 0.00 6.94 -1.26 -4.35 115.26 110.84 2pox n ASN 128 Ca 0.19 -2.24 -0.23 0.00 -0.02 0.00 0.00 54.58 52.27 2pox n ASN 128 Cb 0.55 -0.48 0.07 0.00 -2.36 0.00 0.00 39.78 37.56 2pox n ASN 128 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2pox s GLY 129 N -0.88 1.77 0.50 4.83 0.00 -0.66 -4.92 107.32 107.96 2pox s GLY 129 Ca 0.41 -1.31 0.29 0.00 0.00 0.00 0.00 44.72 44.10 2pox s GLY 129 CO 0.22 -0.90 1.94 -0.56 0.00 0.00 0.00 173.10 173.80 2pox h PRO 130 N -0.34 0.00 0.27 2.90 0.13 -1.93 -1.76 132.00 131.28 2pox h PRO 130 Ca -0.41 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 2pox h PRO 130 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2pox h PRO 130 CO 0.51 0.12 -0.13 0.28 -0.23 0.00 0.00 178.00 178.54 2pox h VAL 131 N 0.00 0.50 0.00 1.56 2.07 -1.95 0.92 116.25 119.35 2pox h VAL 131 Ca -0.00 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 2pox h VAL 131 Cb 0.57 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2pox h VAL 131 CO 0.02 0.12 -0.09 0.24 0.02 0.00 0.00 177.57 177.88 2pox h MET 132 N -0.96 0.00 -0.01 1.57 2.86 -1.77 0.15 114.93 116.76 2pox h MET 132 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2pox h MET 132 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 2pox h MET 132 CO 0.06 0.09 -0.15 1.04 1.06 0.00 0.00 176.91 179.01 2pox n GLN 133 N -3.22 1.26 -3.54 1.72 6.02 -0.66 -4.71 117.38 114.25 2pox n GLN 133 Ca 0.01 -0.78 -0.19 0.00 -0.01 0.00 0.00 57.00 56.03 2pox n GLN 133 Cb 0.37 -1.48 0.06 0.00 1.02 0.00 0.00 30.24 30.21 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 -0.19 -5.02 -0.43 -1.09 5.02 -0.68 -4.93 118.16 110.84 2pox n LYS 134 Ca 0.15 0.73 0.08 0.00 -2.02 0.00 0.00 58.31 57.25 2pox n LYS 134 Cb 0.37 -5.46 0.25 0.00 -0.02 0.00 0.00 35.03 30.17 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 -4.08 3.14 -3.55 1.97 1.74 0.23 -4.99 116.66 111.13 2pox n ARG 135 Ca -0.26 -2.67 -0.27 0.00 -0.77 0.00 0.00 57.85 53.88 2pox n ARG 135 Cb 0.66 -1.74 -0.03 0.00 -1.02 0.00 0.00 32.46 30.34 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 -2.26 5.13 -0.02 0.55 -4.23 -1.26 -0.69 115.64 112.87 2pox s THR 136 Ca 0.39 -0.24 -0.04 0.00 -1.18 0.00 0.00 61.69 60.62 2pox s THR 136 Cb 0.29 -3.75 -0.02 0.00 1.34 0.00 0.00 72.50 70.36 2pox s THR 136 CO 0.13 -0.26 -0.09 0.52 -0.54 0.00 0.00 174.62 174.38 2pox n VAL 137 N -0.87 0.91 -3.46 2.29 0.31 0.04 -4.74 118.33 112.80 2pox n VAL 137 Ca -0.04 0.15 -0.10 0.00 -0.01 0.00 0.00 64.34 64.34 2pox n VAL 137 Cb 0.54 -1.70 -0.02 0.00 -0.91 0.00 0.00 33.84 31.75 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 -2.19 1.03 0.01 5.55 -2.85 -1.25 -4.99 119.74 115.05 2pox s LYS 138 Ca -0.09 -0.38 -0.29 0.00 -1.00 0.00 0.00 55.97 54.21 2pox s LYS 138 Cb 0.02 0.48 -0.03 0.00 -2.06 0.00 0.00 37.83 36.23 2pox s LYS 138 CO 0.12 -0.45 0.95 -1.58 0.10 0.00 0.00 175.35 174.49 2pox s TRP 139 N -3.41 3.67 0.39 1.78 0.52 -1.26 -0.81 118.94 119.81 2pox s TRP 139 Ca 0.03 1.67 -0.27 0.00 0.02 0.00 0.00 56.10 57.55 2pox s TRP 139 Cb -0.01 -3.08 -0.10 0.00 -1.15 0.00 0.00 33.47 29.13 2pox s TRP 139 CO -0.11 0.02 1.37 -1.21 0.02 0.00 0.00 176.95 177.04 2pox s GLU 140 N 0.88 4.05 0.24 4.98 0.41 0.14 -4.74 118.70 124.66 2pox s GLU 140 Ca 0.50 2.31 -0.31 0.00 -0.41 0.00 0.00 54.97 57.06 2pox s GLU 140 Cb -0.21 -2.87 -0.13 0.00 -1.78 0.00 0.00 34.13 29.14 2pox s GLU 140 CO 0.27 -0.48 1.41 -2.30 -0.49 0.00 0.00 175.26 173.68 2pox n PRO 141 N 0.32 2.04 -3.28 0.39 -0.02 -1.26 -4.74 135.00 128.45 2pox n PRO 141 Ca 0.02 0.73 -0.11 0.00 -2.02 0.00 0.00 63.50 62.12 2pox n PRO 141 Cb 0.42 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.47 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 2.18 -0.67 -3.72 2.55 3.41 -1.02 -5.01 113.62 111.34 2pox n SER 142 Ca 0.12 -2.32 -0.25 0.00 -0.26 0.00 0.00 58.87 56.16 2pox n SER 142 Cb 0.31 1.36 -0.17 0.00 -0.26 0.00 0.00 64.21 65.45 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 -2.77 0.31 0.14 6.66 2.01 -1.26 -1.58 115.64 119.14 2pox s THR 143 Ca 0.22 -0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.80 2pox s THR 143 Cb 0.00 -0.67 -0.07 0.00 0.01 0.00 0.00 72.50 71.78 2pox s THR 143 CO 0.16 0.01 0.99 -0.70 -0.69 0.00 0.00 174.62 174.39 2pox s GLU 144 N 1.98 4.70 -0.29 4.92 2.12 0.30 -4.76 118.70 127.67 2pox s GLU 144 Ca 0.03 1.51 -0.17 0.00 0.36 0.00 0.00 54.97 56.70 2pox s GLU 144 Cb -0.14 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.88 2pox s GLU 144 CO -0.07 0.23 0.45 0.15 -0.54 0.00 0.00 175.26 175.49 2pox s LYS 145 N -0.22 3.91 -0.11 4.30 1.02 0.66 -1.31 119.74 127.99 2pox s LYS 145 Ca 0.47 0.05 -0.02 0.00 0.02 0.00 0.00 55.97 56.49 2pox s LYS 145 Cb -0.25 -3.70 -0.03 0.00 -0.52 0.00 0.00 37.83 33.33 2pox s LYS 145 CO 0.31 -0.41 -0.02 -0.51 -0.92 0.00 0.00 175.35 173.80 2pox s LEU 146 N 2.23 3.39 0.08 3.17 1.02 0.11 -0.39 118.68 128.29 2pox s LEU 146 Ca 0.18 0.02 -0.22 0.00 0.02 0.00 0.00 54.13 54.13 2pox s LEU 146 Cb -0.16 -1.78 0.05 0.00 0.02 0.00 0.00 46.19 44.32 2pox s LEU 146 CO 0.11 0.30 0.52 -0.72 0.02 0.00 0.00 176.35 176.58 2pox s TYR 147 N -0.43 -0.42 -0.23 0.29 1.13 -0.47 -1.53 117.35 115.70 2pox s TYR 147 Ca 0.07 0.37 -0.07 0.00 -1.41 0.00 0.00 57.07 56.04 2pox s TYR 147 Cb -0.12 0.37 -0.03 0.00 -1.10 0.00 0.00 41.96 41.08 2pox s TYR 147 CO 0.02 -0.69 0.06 0.08 -2.51 0.00 0.00 175.55 172.52 2pox s VAL 148 N -2.84 4.39 -0.09 -3.49 1.01 -1.26 -0.26 120.40 117.86 2pox s VAL 148 Ca -0.03 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2pox s VAL 148 Cb -0.00 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.37 2pox s VAL 148 CO -0.05 0.37 -0.12 -0.60 0.00 0.00 0.00 175.10 174.71 2pox s ARG 149 N 1.26 1.79 -1.43 2.72 3.52 -0.64 -4.82 118.95 121.35 2pox s ARG 149 Ca 0.05 -0.41 -0.10 0.00 -0.13 0.00 0.00 55.73 55.14 2pox s ARG 149 Cb -0.15 -1.57 0.05 0.00 -1.56 0.00 0.00 34.95 31.72 2pox s ARG 149 CO 0.03 -0.07 1.01 -3.47 -0.81 0.00 0.00 175.30 171.99 2pox n ASP 150 N 4.20 -4.66 -0.21 -2.12 2.03 -1.26 -1.52 116.55 113.02 2pox n ASP 150 Ca -0.19 -0.70 -0.03 0.00 0.52 0.00 0.00 54.79 54.39 2pox n ASP 150 Cb 0.51 -4.34 -0.01 0.00 -0.72 0.00 0.00 41.12 36.56 2pox n ASP 150 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2pox n GLY 151 N -1.74 0.57 3.05 0.27 0.00 -1.26 -5.02 105.19 101.06 2pox n GLY 151 Ca -0.03 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 2pox n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2pox s VAL 152 N -1.93 1.15 -0.06 1.61 1.01 -0.57 -5.10 120.40 116.50 2pox s VAL 152 Ca 0.00 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 2pox s VAL 152 Cb 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 2pox s VAL 152 CO 0.00 0.35 1.10 -0.22 0.00 0.00 0.00 175.10 176.33 2pox s LEU 153 N 0.44 4.29 0.13 3.92 2.96 -1.26 -1.62 118.68 127.54 2pox s LEU 153 Ca -0.10 1.71 0.06 0.00 -0.22 0.00 0.00 54.13 55.58 2pox s LEU 153 Cb -0.14 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 2pox s LEU 153 CO 0.03 -0.48 -0.15 -0.54 -1.32 0.00 0.00 176.35 173.88 2pox s LYS 154 N 1.89 1.09 -0.05 1.98 1.02 0.65 -0.95 119.74 125.36 2pox s LYS 154 Ca 0.53 -1.28 0.01 0.00 0.02 0.00 0.00 55.97 55.25 2pox s LYS 154 Cb -0.22 -1.01 0.02 0.00 -0.52 0.00 0.00 37.83 36.10 2pox s LYS 154 CO 0.22 0.20 -0.07 0.20 -0.92 0.00 0.00 175.35 174.98 2pox s GLY 155 N -2.52 0.56 0.05 -3.33 0.00 -0.27 -1.36 107.32 100.45 2pox s GLY 155 Ca 0.11 -0.18 0.09 0.00 0.00 0.00 0.00 44.72 44.74 2pox s GLY 155 CO 0.04 0.38 -0.24 0.99 0.00 0.00 0.00 173.10 174.28 2pox s ASP 156 N 0.91 3.40 -0.22 1.64 1.01 0.47 -0.69 116.67 123.20 2pox s ASP 156 Ca -0.11 -0.55 -0.18 0.00 0.71 0.00 0.00 52.55 52.42 2pox s ASP 156 Cb -0.15 -0.39 0.06 0.00 1.01 0.00 0.00 42.92 43.45 2pox s ASP 156 CO 0.01 0.25 0.57 0.54 0.21 0.00 0.00 175.17 176.74 2pox s VAL 157 N -0.87 -0.00 -0.50 -1.27 0.11 -0.95 -0.24 120.40 116.68 2pox s VAL 157 Ca 0.13 0.01 -0.22 0.00 -2.93 0.00 0.00 61.98 58.97 2pox s VAL 157 Cb -0.10 -0.80 0.04 0.00 -1.53 0.00 0.00 36.38 33.99 2pox s VAL 157 CO 0.04 0.00 0.77 0.20 -3.33 0.00 0.00 175.10 172.78 2pox s ASN 158 N 0.62 6.32 0.27 3.54 -0.87 -1.26 -0.90 114.94 122.65 2pox s ASN 158 Ca -0.03 -0.46 0.04 0.00 -1.57 0.00 0.00 52.86 50.84 2pox s ASN 158 Cb -0.05 -2.36 -0.03 0.00 -0.02 0.00 0.00 41.25 38.79 2pox s ASN 158 CO -0.04 -0.99 0.41 -0.04 -2.57 0.00 0.00 177.10 173.88 2pox s MET 159 N 3.23 3.45 -0.08 -0.60 -1.94 0.41 -4.92 119.30 118.86 2pox s MET 159 Ca 0.25 -0.62 -0.05 0.00 -1.71 0.00 0.00 55.69 53.55 2pox s MET 159 Cb -0.15 -2.83 0.04 0.00 2.01 0.00 0.00 34.83 33.91 2pox s MET 159 CO 0.18 0.35 0.20 0.00 -0.01 0.00 0.00 175.02 175.74 2pox s ALA 160 N -2.07 -0.44 -0.15 3.03 0.00 -1.26 -1.02 121.76 119.85 2pox s ALA 160 Ca 0.36 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 52.94 2pox s ALA 160 Cb -0.09 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 2pox s ALA 160 CO 0.31 -0.16 0.46 -0.51 0.00 0.00 0.00 175.76 175.86 2pox s LEU 161 N 1.00 4.23 0.43 0.00 1.43 -0.30 -0.69 118.68 124.79 2pox s LEU 161 Ca -0.07 0.72 -0.25 0.00 -1.03 0.00 0.00 54.13 53.49 2pox s LEU 161 Cb -0.09 -2.64 -0.08 0.00 0.03 0.00 0.00 46.19 43.41 2pox s LEU 161 CO -0.06 -0.04 1.36 -0.55 0.23 0.00 0.00 176.35 177.30 2pox s SER 162 N 0.78 6.05 0.14 2.29 0.15 0.01 -0.60 113.70 122.51 2pox s SER 162 Ca 0.24 2.78 0.06 0.00 0.70 0.00 0.00 55.95 59.73 2pox s SER 162 Cb -0.15 -2.64 -0.04 0.00 -1.71 0.00 0.00 66.02 61.48 2pox s SER 162 CO 0.09 -1.04 0.02 -0.76 1.20 0.00 0.00 173.24 172.75 2pox s LEU 163 N -2.63 3.44 0.14 3.45 1.43 -0.39 -0.78 118.68 123.33 2pox s LEU 163 Ca 0.60 -0.27 -0.32 0.00 -1.03 0.00 0.00 54.13 53.11 2pox s LEU 163 Cb -0.41 -2.13 -0.11 0.00 0.03 0.00 0.00 46.19 43.57 2pox s LEU 163 CO 0.52 0.12 1.78 1.21 0.23 0.00 0.00 176.35 180.21 2pox n GLU 164 N 0.14 2.69 -0.37 1.70 2.13 0.13 -1.50 120.64 125.56 2pox n GLU 164 Ca -0.10 0.97 0.00 0.00 0.66 0.00 0.00 57.16 58.69 2pox n GLU 164 Cb 0.54 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.41 2pox n GLU 164 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2pox n GLY 165 N 4.08 1.29 0.00 8.31 0.00 -1.26 -4.92 105.19 112.69 2pox n GLY 165 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 3.07 1.94 -0.02 0.00 -0.56 -5.15 105.19 102.46 2pox n GLY 166 Ca 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.03 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 -0.67 -2.58 3.12 -0.02 0.00 -1.26 -4.36 105.19 99.42 2pox n GLY 167 Ca 0.00 -1.74 -0.08 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.53 0.36 -0.16 1.61 0.09 -1.26 -1.27 115.29 114.14 2pox s HIS 168 Ca 0.00 -0.84 -0.01 0.00 -0.00 0.00 0.00 55.06 54.21 2pox s HIS 168 Cb 0.00 -0.26 0.04 0.00 -0.00 0.00 0.00 32.58 32.37 2pox s HIS 168 CO 0.00 -0.42 -0.03 -0.47 -0.00 0.00 0.00 174.74 173.83 2pox s TYR 169 N -3.62 1.46 0.17 1.40 5.04 0.23 -4.91 117.35 117.11 2pox s TYR 169 Ca 0.04 -0.95 0.02 0.00 -2.44 0.00 0.00 57.07 53.74 2pox s TYR 169 Cb 0.05 -1.20 -0.04 0.00 0.35 0.00 0.00 41.96 41.12 2pox s TYR 169 CO -0.09 -0.58 0.31 1.03 -1.34 0.00 0.00 175.55 174.88 2pox s ARG 170 N 1.71 3.46 -0.11 4.97 0.52 -1.26 -1.15 118.95 127.09 2pox s ARG 170 Ca 0.01 -0.53 -0.06 0.00 -0.52 0.00 0.00 55.73 54.62 2pox s ARG 170 Cb -0.15 -2.93 0.04 0.00 0.52 0.00 0.00 34.95 32.43 2pox s ARG 170 CO -0.07 0.49 0.27 0.00 0.02 0.00 0.00 175.30 176.00 2pox s ASP 172 N 1.12 6.19 -0.18 0.00 2.15 -0.21 -0.44 116.67 125.30 2pox s ASP 172 Ca -0.08 -0.01 -0.09 0.00 0.43 0.00 0.00 52.55 52.80 2pox s ASP 172 Cb -0.09 -2.20 -0.05 0.00 -0.30 0.00 0.00 42.92 40.29 2pox s ASP 172 CO -0.08 -0.26 0.14 -0.36 -0.17 0.00 0.00 175.17 174.44 2pox s PHE 173 N 2.02 3.46 -0.14 -5.34 0.40 -0.08 -1.21 117.98 117.08 2pox s PHE 173 Ca 0.13 0.39 -0.03 0.00 -0.60 0.00 0.00 56.93 56.82 2pox s PHE 173 Cb -0.16 -2.12 0.05 0.00 0.51 0.00 0.00 43.02 41.30 2pox s PHE 173 CO 0.11 0.39 0.03 0.15 0.70 0.00 0.00 175.22 176.60 2pox s LYS 174 N 0.03 0.56 -0.05 0.44 1.02 -0.65 -2.23 119.74 118.86 2pox s LYS 174 Ca 0.10 -0.18 0.04 0.00 0.02 0.00 0.00 55.97 55.95 2pox s LYS 174 Cb -0.11 -1.64 -0.02 0.00 -0.52 0.00 0.00 37.83 35.53 2pox s LYS 174 CO -0.00 -0.52 -0.16 0.99 -0.92 0.00 0.00 175.35 174.74 2pox s THR 175 N 1.94 2.89 -0.14 2.17 2.01 0.14 -1.52 115.64 123.12 2pox s THR 175 Ca 0.02 -0.79 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 2pox s THR 175 Cb -0.15 -2.11 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 2pox s THR 175 CO -0.07 0.59 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.46 2pox s THR 176 N -0.69 3.33 -0.08 -0.82 2.01 0.28 -1.12 115.64 118.56 2pox s THR 176 Ca 0.11 -0.56 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 2pox s THR 176 Cb -0.11 -2.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 2pox s THR 176 CO 0.00 0.51 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.11 2pox s TYR 177 N 0.40 3.08 -0.28 4.92 2.02 -0.12 -1.76 117.35 125.61 2pox s TYR 177 Ca -0.08 0.13 -0.03 0.00 -0.37 0.00 0.00 57.07 56.72 2pox s TYR 177 Cb -0.15 -1.76 0.11 0.00 -0.40 0.00 0.00 41.96 39.76 2pox s TYR 177 CO 0.04 0.42 0.19 0.15 -1.57 0.00 0.00 175.55 174.79 2pox s LYS 178 N -0.88 0.23 0.53 -0.62 1.02 -0.49 -4.14 119.74 115.39 2pox s LYS 178 Ca 0.13 -0.34 -0.22 0.00 0.02 0.00 0.00 55.97 55.56 2pox s LYS 178 Cb -0.11 -1.01 -0.05 0.00 -0.52 0.00 0.00 37.83 36.13 2pox s LYS 178 CO 0.02 -0.99 1.30 0.00 -0.92 0.00 0.00 175.35 174.76 2pox s ALA 179 N 2.20 2.84 -0.02 5.17 0.00 -1.26 -1.39 121.76 129.30 2pox s ALA 179 Ca 0.09 1.22 0.27 0.00 0.00 0.00 0.00 51.96 53.53 2pox s ALA 179 Cb -0.15 -3.52 0.90 0.00 0.00 0.00 0.00 23.12 20.36 2pox s ALA 179 CO -0.33 -1.18 1.81 0.87 0.00 0.00 0.00 175.76 176.92 2pox h LYS 180 N 1.57 0.00 -5.30 0.00 1.79 -1.59 -3.45 116.57 109.59 2pox h LYS 180 Ca -0.50 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.51 2pox h LYS 180 Cb 1.29 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.80 2pox h LYS 180 CO 0.58 0.11 -0.64 -1.59 -1.08 0.00 0.00 179.45 176.83 2pox s LYS 181 N -3.51 1.54 -0.06 3.15 -2.85 -1.26 -5.05 119.74 111.69 2pox s LYS 181 Ca 0.02 -1.81 -0.29 0.00 -1.00 0.00 0.00 55.97 52.89 2pox s LYS 181 Cb 0.08 -0.92 -0.07 0.00 -2.06 0.00 0.00 37.83 34.87 2pox s LYS 181 CO 0.62 -0.08 1.90 0.08 0.10 0.00 0.00 175.35 177.97 2pox s VAL 182 N -3.22 3.22 -0.01 1.79 1.01 -1.26 -4.99 120.40 116.94 2pox s VAL 182 Ca 0.32 0.26 0.05 0.00 0.00 0.00 0.00 61.98 62.61 2pox s VAL 182 Cb 0.06 -3.19 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 2pox s VAL 182 CO 0.12 -0.05 -0.16 -0.69 0.00 0.00 0.00 175.10 174.32 2pox s VAL 183 N 5.14 1.30 -0.20 2.92 1.01 -1.26 -5.09 120.40 124.21 2pox s VAL 183 Ca 0.85 -0.70 -0.39 0.00 0.00 0.00 0.00 61.98 61.75 2pox s VAL 183 Cb -0.37 -1.08 -0.15 0.00 0.00 0.00 0.00 36.38 34.78 2pox s VAL 183 CO 0.36 0.37 1.73 1.67 0.00 0.00 0.00 175.10 179.23 2pox n GLN 184 N 2.68 1.36 -2.57 2.72 7.27 -1.26 -4.95 117.38 122.64 2pox n GLN 184 Ca -0.15 0.50 -0.40 0.00 0.07 0.00 0.00 57.00 57.02 2pox n GLN 184 Cb 0.54 -2.21 -0.05 0.00 2.41 0.00 0.00 30.24 30.94 2pox n GLN 184 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 2pox s LEU 185 N 3.33 4.58 0.75 1.69 1.43 -1.26 -4.69 118.68 124.50 2pox s LEU 185 Ca 0.96 2.15 -0.09 0.00 -1.03 0.00 0.00 54.13 56.11 2pox s LEU 185 Cb -0.98 -3.62 0.07 0.00 0.03 0.00 0.00 46.19 41.69 2pox s LEU 185 CO 0.61 -0.06 1.09 -2.16 0.23 0.00 0.00 176.35 176.06 2pox s PRO 186 N -1.23 2.11 0.77 1.29 0.04 -1.26 -4.98 135.00 131.73 2pox s PRO 186 Ca 0.44 -0.07 -0.11 0.00 0.04 0.00 0.00 61.00 61.30 2pox s PRO 186 Cb -0.30 -2.07 0.06 0.00 0.04 0.00 0.00 34.50 32.23 2pox s PRO 186 CO 0.38 -1.40 1.14 -0.51 0.04 0.00 0.00 177.00 176.65 2pox s ASP 187 N -4.54 4.82 0.54 6.66 1.01 -1.26 -4.67 116.67 119.23 2pox s ASP 187 Ca 0.61 0.85 -0.22 0.00 0.71 0.00 0.00 52.55 54.50 2pox s ASP 187 Cb -0.11 -1.46 -0.05 0.00 1.01 0.00 0.00 42.92 42.31 2pox s ASP 187 CO 0.47 -1.70 1.38 0.00 0.21 0.00 0.00 175.17 175.52 2pox n TYR 188 N -3.18 2.38 -3.65 4.23 0.18 -1.26 -4.83 117.16 111.02 2pox n TYR 188 Ca 0.08 0.43 -0.01 0.00 1.88 0.00 0.00 57.90 60.27 2pox n TYR 188 Cb 0.60 -2.38 0.01 0.00 -0.38 0.00 0.00 39.34 37.19 2pox n TYR 188 CO 0.00 0.00 0.00 -2.39 -2.08 0.00 0.00 176.86 172.39 2pox n HIS 189 N -0.98 -0.91 -4.14 -3.48 1.44 -0.58 -4.91 115.22 101.65 2pox n HIS 189 Ca 0.10 -0.57 -0.16 0.00 -2.01 0.00 0.00 57.72 55.08 2pox n HIS 189 Cb 0.44 0.28 -0.12 0.00 0.12 0.00 0.00 29.99 30.71 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 -4.19 0.85 -0.20 -1.40 0.40 -0.39 -0.71 117.98 112.34 2pox s PHE 190 Ca 0.11 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 56.02 2pox s PHE 190 Cb -0.01 -0.50 0.04 0.00 0.51 0.00 0.00 43.02 43.06 2pox s PHE 190 CO 0.02 -0.03 -0.09 0.08 0.70 0.00 0.00 175.22 175.91 2pox s VAL 191 N -1.12 1.53 0.26 -0.44 1.01 -0.43 -0.42 120.40 120.79 2pox s VAL 191 Ca -0.05 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 2pox s VAL 191 Cb -0.09 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 2pox s VAL 191 CO 0.01 0.12 1.01 -1.81 0.00 0.00 0.00 175.10 174.44 2pox s ASP 192 N 1.44 7.46 0.02 3.32 1.01 0.08 -0.54 116.67 129.46 2pox s ASP 192 Ca -0.02 2.10 -0.04 0.00 0.71 0.00 0.00 52.55 55.30 2pox s ASP 192 Cb -0.16 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.14 2pox s ASP 192 CO -0.08 0.01 0.06 -1.38 0.21 0.00 0.00 175.17 173.99 2pox s HIS 193 N -1.19 0.18 -0.06 4.23 -3.43 -0.62 -0.83 115.29 113.58 2pox s HIS 193 Ca 0.43 -0.40 -0.01 0.00 -0.80 0.00 0.00 55.06 54.27 2pox s HIS 193 Cb -0.29 -0.14 0.03 0.00 -1.43 0.00 0.00 32.58 30.76 2pox s HIS 193 CO 0.36 -0.27 0.02 -1.58 -2.00 0.00 0.00 174.74 171.27 2pox s HIS 194 N -1.79 0.42 -0.07 0.38 2.46 -0.31 -2.42 115.29 113.95 2pox s HIS 194 Ca -0.12 0.00 0.04 0.00 0.47 0.00 0.00 55.06 55.45 2pox s HIS 194 Cb -0.06 -0.65 -0.00 0.00 -0.13 0.00 0.00 32.58 31.74 2pox s HIS 194 CO -0.01 -0.26 -0.19 -1.50 -2.47 0.00 0.00 174.74 170.30 2pox s ILE 195 N 1.95 1.66 -0.02 0.89 2.07 -1.26 -1.61 121.20 124.88 2pox s ILE 195 Ca 0.04 -0.82 0.00 0.00 -1.41 0.00 0.00 60.65 58.46 2pox s ILE 195 Cb -0.12 -1.44 0.02 0.00 0.13 0.00 0.00 42.46 41.05 2pox s ILE 195 CO -0.04 0.47 0.02 -1.61 -1.91 0.00 0.00 174.94 171.87 2pox s GLU 196 N 0.21 0.05 -0.49 3.50 2.02 -0.15 -4.54 118.70 119.30 2pox s GLU 196 Ca -0.10 0.13 -0.29 0.00 0.02 0.00 0.00 54.97 54.73 2pox s GLU 196 Cb -0.15 -0.26 0.02 0.00 0.10 0.00 0.00 34.13 33.84 2pox s GLU 196 CO 0.05 -0.13 1.26 0.42 0.02 0.00 0.00 175.26 176.87 2pox s ILE 197 N 0.88 4.03 0.06 -1.63 1.01 -1.26 -0.29 121.20 124.01 2pox s ILE 197 Ca -0.08 1.01 0.03 0.00 0.00 0.00 0.00 60.65 61.62 2pox s ILE 197 Cb -0.11 -4.49 -0.24 0.00 0.01 0.00 0.00 42.46 37.62 2pox s ILE 197 CO -0.02 -1.02 1.06 0.11 0.00 0.00 0.00 174.94 175.07 2pox h LYS 198 N 9.94 0.11 -3.22 2.79 1.79 -1.34 -3.47 116.57 123.16 2pox h LYS 198 Ca -0.25 -0.18 -0.07 0.00 -2.18 0.00 0.00 60.65 57.97 2pox h LYS 198 Cb 1.08 0.07 -0.15 0.00 -1.58 0.00 0.00 32.23 31.65 2pox h LYS 198 CO 1.13 0.99 -0.10 -1.54 -1.08 0.00 0.00 179.45 178.85 2pox s SER 199 N -6.76 -0.24 0.07 0.86 1.04 -1.18 -5.01 113.70 102.48 2pox s SER 199 Ca -0.03 -0.17 -0.26 0.00 0.48 0.00 0.00 55.95 55.97 2pox s SER 199 Cb 0.08 0.44 0.08 0.00 0.10 0.00 0.00 66.02 66.72 2pox s SER 199 CO 0.84 -0.75 0.68 -1.38 0.98 0.00 0.00 173.24 173.61 2pox s HIS 200 N -3.10 -0.54 0.75 5.02 -3.43 -1.26 -0.80 115.29 111.94 2pox s HIS 200 Ca -0.01 0.52 -0.05 0.00 -0.80 0.00 0.00 55.06 54.71 2pox s HIS 200 Cb 0.01 0.52 0.12 0.00 -1.43 0.00 0.00 32.58 31.79 2pox s HIS 200 CO -0.07 -0.73 1.05 0.16 -2.00 0.00 0.00 174.74 173.15 2pox s ASP 201 N -2.27 4.29 0.26 7.38 1.47 -0.88 -4.97 116.67 121.95 2pox s ASP 201 Ca -0.01 0.02 -0.02 0.00 1.18 0.00 0.00 52.55 53.72 2pox s ASP 201 Cb -0.01 -0.45 0.53 0.00 -0.34 0.00 0.00 42.92 42.65 2pox s ASP 201 CO -0.06 -1.91 1.73 0.50 0.68 0.00 0.00 175.17 176.11 2pox h LYS 202 N -0.73 0.47 -0.53 2.11 3.11 -2.03 -1.63 116.57 117.35 2pox h LYS 202 Ca -0.41 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.40 2pox h LYS 202 Cb 1.28 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 32.40 2pox h LYS 202 CO 0.46 0.31 0.00 -0.40 -2.81 0.00 0.00 179.45 177.01 2pox n ASP 203 N -4.97 4.12 -1.11 4.20 5.68 -1.26 -4.95 116.55 118.26 2pox n ASP 203 Ca 0.16 -2.39 -0.15 0.00 -0.50 0.00 0.00 54.79 51.92 2pox n ASP 203 Cb 0.46 -0.48 -0.06 0.00 -1.14 0.00 0.00 41.12 39.90 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 0.78 0.00 0.26 2.11 4.02 -0.61 -4.24 117.16 119.48 2pox n TYR 204 Ca 0.22 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.24 2pox n TYR 204 Cb 0.76 -2.65 0.70 0.00 -0.02 0.00 0.00 39.34 38.13 2pox n TYR 204 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2pox h SER 205 N 0.00 0.00 -3.37 7.72 4.64 -1.92 -3.40 113.55 117.22 2pox h SER 205 Ca -0.30 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.47 2pox h SER 205 Cb 1.00 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.76 2pox h SER 205 CO 0.44 0.12 -0.83 0.20 -0.87 0.00 0.00 176.83 175.89 2pox s ASN 206 N -6.03 2.13 -0.02 4.97 0.01 -1.26 -1.31 114.94 113.43 2pox s ASN 206 Ca -0.02 -0.37 0.00 0.00 -0.71 0.00 0.00 52.86 51.77 2pox s ASN 206 Cb 0.12 -0.97 0.03 0.00 0.41 0.00 0.00 41.25 40.84 2pox s ASN 206 CO 0.58 0.05 0.02 -0.69 -1.51 0.00 0.00 177.10 175.55 2pox s VAL 207 N 0.70 -0.02 -0.25 1.60 1.01 -0.64 -2.07 120.40 120.73 2pox s VAL 207 Ca -0.13 0.19 -0.08 0.00 0.00 0.00 0.00 61.98 61.96 2pox s VAL 207 Cb -0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 2pox s VAL 207 CO 0.03 0.10 0.10 0.21 0.00 0.00 0.00 175.10 175.54 2pox s ASN 208 N 1.05 5.37 -0.10 3.32 3.84 0.02 -0.54 114.94 127.91 2pox s ASN 208 Ca -0.09 -0.15 0.04 0.00 0.21 0.00 0.00 52.86 52.87 2pox s ASN 208 Cb -0.13 -1.97 -0.00 0.00 -0.55 0.00 0.00 41.25 38.60 2pox s ASN 208 CO -0.03 -0.03 -0.24 -0.22 -2.79 0.00 0.00 177.10 173.79 2pox s LEU 209 N 1.61 2.08 0.09 3.21 2.96 0.17 -0.80 118.68 128.01 2pox s LEU 209 Ca 0.06 -0.56 0.09 0.00 -0.22 0.00 0.00 54.13 53.51 2pox s LEU 209 Cb -0.15 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.10 2pox s LEU 209 CO 0.05 0.16 -0.22 -1.00 -1.32 0.00 0.00 176.35 174.03 2pox s HIS 210 N 0.33 2.45 -0.03 5.38 3.76 0.61 -1.21 115.29 126.58 2pox s HIS 210 Ca -0.19 -0.32 -0.05 0.00 -0.15 0.00 0.00 55.06 54.36 2pox s HIS 210 Cb -0.18 -1.36 0.01 0.00 1.11 0.00 0.00 32.58 32.16 2pox s HIS 210 CO 0.09 0.30 0.12 -2.00 -0.85 0.00 0.00 174.74 172.39 2pox s GLU 211 N -1.79 0.28 0.02 1.40 2.12 -0.58 -0.97 118.70 119.17 2pox s GLU 211 Ca 0.15 -0.08 0.03 0.00 0.36 0.00 0.00 54.97 55.43 2pox s GLU 211 Cb -0.10 0.12 -0.01 0.00 0.26 0.00 0.00 34.13 34.39 2pox s GLU 211 CO 0.06 -0.05 -0.09 -3.38 -0.54 0.00 0.00 175.26 171.26 2pox s HIS 212 N -0.54 0.77 -0.07 5.30 -3.43 -0.63 -1.37 115.29 115.32 2pox s HIS 212 Ca -0.06 -0.26 -0.07 0.00 -0.80 0.00 0.00 55.06 53.87 2pox s HIS 212 Cb -0.04 -0.48 0.02 0.00 -1.43 0.00 0.00 32.58 30.65 2pox s HIS 212 CO 0.01 -0.02 0.19 0.00 -2.00 0.00 0.00 174.74 172.92 2pox s ALA 213 N -0.60 -0.47 -0.03 -1.38 0.00 -0.17 -1.16 121.76 117.94 2pox s ALA 213 Ca -0.01 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.49 2pox s ALA 213 Cb -0.06 -0.31 0.03 0.00 0.00 0.00 0.00 23.12 22.78 2pox s ALA 213 CO 0.00 -0.09 0.01 -1.21 0.00 0.00 0.00 175.76 174.47 2pox s GLU 214 N 0.10 0.18 0.23 0.00 8.01 -0.01 -1.32 118.70 125.89 2pox s GLU 214 Ca -0.00 0.13 -0.22 0.00 0.01 0.00 0.00 54.97 54.89 2pox s GLU 214 Cb -0.01 -0.41 -0.08 0.00 -4.31 0.00 0.00 34.13 29.31 2pox s GLU 214 CO 0.00 -0.16 0.77 0.00 0.01 0.00 0.00 175.26 175.88 2pox s ALA 215 N 1.10 3.39 0.09 5.21 0.00 0.20 -0.74 121.76 131.01 2pox s ALA 215 Ca -0.09 0.25 -0.10 0.00 0.00 0.00 0.00 51.96 52.02 2pox s ALA 215 Cb -0.13 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.09 2pox s ALA 215 CO -0.02 0.30 0.23 -3.38 0.00 0.00 0.00 175.76 172.89 2pox s HIS 216 N -1.48 0.08 0.90 0.00 -3.43 0.44 -4.42 115.29 107.38 2pox s HIS 216 Ca 0.43 -0.48 -0.11 0.00 -0.80 0.00 0.00 55.06 54.10 2pox s HIS 216 Cb -0.18 0.01 0.20 0.00 -1.43 0.00 0.00 32.58 31.17 2pox s HIS 216 CO 0.22 -0.57 1.23 -1.12 -2.00 0.00 0.00 174.74 172.50 2pox s SER 217 N -2.84 3.32 0.00 7.38 0.01 -1.26 -1.26 113.70 119.05 2pox s SER 217 Ca 0.04 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2pox s SER 217 Cb 0.04 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2pox s SER 217 CO -0.11 -2.57 0.00 -0.62 0.41 0.00 0.00 173.24 170.34