#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hxs s LEU 2 N 0.00 4.39 0.06 0.99 2.96 -1.26 -4.91 118.68 120.91 1hxs s LEU 2 Ca 0.00 2.68 -0.30 0.00 -0.22 0.00 0.00 54.13 56.29 1hxs s LEU 2 Cb 0.00 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.04 1hxs s LEU 2 CO 0.00 -0.98 1.87 -2.84 -1.32 0.00 0.00 176.35 173.07 1hxs s PRO 3 N 2.96 4.15 0.20 0.98 0.02 -1.26 -4.99 135.00 137.06 1hxs s PRO 3 Ca 0.80 2.54 0.07 0.00 0.02 0.00 0.00 61.00 64.43 1hxs s PRO 3 Cb -0.44 -3.93 -0.05 0.00 0.02 0.00 0.00 34.50 30.11 1hxs s PRO 3 CO 0.36 -0.89 -0.12 0.14 -0.33 0.00 0.00 177.00 176.15 1hxs s VAL 4 N 3.75 1.56 -0.10 3.83 -7.23 -1.26 -5.15 120.40 115.80 1hxs s VAL 4 Ca 0.83 -2.16 -0.03 0.00 -1.81 0.00 0.00 61.98 58.81 1hxs s VAL 4 Cb -0.42 -2.03 0.04 0.00 0.56 0.00 0.00 36.38 34.53 1hxs s VAL 4 CO 0.38 -0.61 0.06 -0.32 -0.31 0.00 0.00 175.10 174.31 1hxs s MET 5 N -3.68 0.08 0.24 4.82 1.75 -1.26 -5.12 119.30 116.11 1hxs s MET 5 Ca 0.22 0.14 -0.30 0.00 -1.25 0.00 0.00 55.69 54.50 1hxs s MET 5 Cb 0.01 -1.12 -0.10 0.00 2.84 0.00 0.00 34.83 36.46 1hxs s MET 5 CO 0.06 -0.47 1.44 -0.80 -0.65 0.00 0.00 175.02 174.60 1hxs s ASN 6 N 2.12 6.67 0.42 1.11 0.01 -1.26 -5.03 114.94 118.99 1hxs s ASN 6 Ca 0.04 2.64 0.08 0.00 -0.71 0.00 0.00 52.86 54.90 1hxs s ASN 6 Cb -0.14 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 38.91 1hxs s ASN 6 CO -0.06 -0.70 0.54 0.42 -1.51 0.00 0.00 177.10 175.79 1hxs s THR 7 N 0.11 2.94 0.49 1.60 -4.23 -1.26 -5.03 115.64 110.27 1hxs s THR 7 Ca 0.60 -1.06 -0.23 0.00 -1.18 0.00 0.00 61.69 59.82 1hxs s THR 7 Cb -0.41 -3.00 -0.08 0.00 1.34 0.00 0.00 72.50 70.35 1hxs s THR 7 CO 0.42 0.00 1.15 -2.65 -0.54 0.00 0.00 174.62 173.00 1hxs n PRO 8 N -1.80 1.49 0.00 3.99 -0.02 -1.26 -2.34 135.00 135.06 1hxs n PRO 8 Ca 0.07 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1hxs n PRO 8 Cb 0.59 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1hxs n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hxs n GLY 9 N 1.01 3.20 3.65 -1.23 0.00 -1.26 -5.05 105.19 105.51 1hxs n GLY 9 Ca 0.10 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.62 1hxs n GLY 9 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1hxs n SER 10 N 0.00 2.50 0.00 1.61 7.64 -0.99 -1.85 113.62 122.53 1hxs n SER 10 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1hxs n SER 10 Cb 0.00 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 61.91 1hxs n SER 10 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1hxs n ASN 11 N 3.81 -0.12 -4.81 6.43 3.02 -1.26 -5.02 115.26 117.31 1hxs n ASN 11 Ca 0.20 0.00 -0.32 0.00 -0.03 0.00 0.00 54.58 54.43 1hxs n ASN 11 Cb 0.23 -0.82 0.04 0.00 -0.61 0.00 0.00 39.78 38.62 1hxs n ASN 11 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hxs s GLN 12 N -0.33 3.02 -0.37 3.52 -2.07 -0.77 -5.02 119.66 117.63 1hxs s GLN 12 Ca 0.00 1.10 -0.00 0.00 -1.82 0.00 0.00 55.36 54.64 1hxs s GLN 12 Cb 0.00 -2.00 0.10 0.00 -1.09 0.00 0.00 33.01 30.02 1hxs s GLN 12 CO 0.00 -1.04 0.13 -0.47 -1.32 0.00 0.00 175.29 172.59 1hxs s TYR 13 N -2.75 3.62 -0.26 9.60 5.04 -1.26 -5.06 117.35 126.27 1hxs s TYR 13 Ca 0.61 -2.58 -0.22 0.00 -2.44 0.00 0.00 57.07 52.44 1hxs s TYR 13 Cb -0.15 -3.01 -0.01 0.00 0.35 0.00 0.00 41.96 39.13 1hxs s TYR 13 CO 0.47 -0.95 0.73 -1.17 -1.34 0.00 0.00 175.55 173.29 1hxs s LEU 14 N 1.07 4.08 0.38 6.97 2.96 -1.26 -4.95 118.68 127.93 1hxs s LEU 14 Ca 0.08 0.83 0.28 0.00 -0.22 0.00 0.00 54.13 55.09 1hxs s LEU 14 Cb -0.21 -3.02 1.24 0.00 0.50 0.00 0.00 46.19 44.70 1hxs s LEU 14 CO -0.05 -0.47 1.84 0.71 -1.32 0.00 0.00 176.35 177.06 1hxs h THR 15 N 5.45 0.00 -0.55 3.68 1.35 -2.07 -0.39 112.91 120.38 1hxs h THR 15 Ca -0.25 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1hxs h THR 15 Cb 1.11 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1hxs h THR 15 CO 0.83 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.10 1hxs n ALA 16 N -1.89 2.47 -0.99 6.62 0.00 -1.26 -5.00 120.51 120.46 1hxs n ALA 16 Ca 0.01 -1.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.15 1hxs n ALA 16 Cb 0.21 -0.96 0.23 0.00 0.00 0.00 0.00 19.45 18.93 1hxs n ALA 16 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1hxs s ASP 17 N -0.98 0.99 -0.46 0.00 1.47 -0.16 -5.02 116.67 112.51 1hxs s ASP 17 Ca 0.37 0.80 0.06 0.00 1.18 0.00 0.00 52.55 54.97 1hxs s ASP 17 Cb 0.20 -1.17 0.21 0.00 -0.34 0.00 0.00 42.92 41.82 1hxs s ASP 17 CO 0.25 -4.10 0.64 -3.20 0.68 0.00 0.00 175.17 169.44 1hxs n ASN 18 N -4.77 -1.81 -4.59 2.11 5.15 -1.26 -5.10 115.26 104.98 1hxs n ASN 18 Ca 0.11 -2.85 -0.25 0.00 -0.60 0.00 0.00 54.58 50.99 1hxs n ASN 18 Cb 0.59 0.71 -0.09 0.00 -0.53 0.00 0.00 39.78 40.46 1hxs n ASN 18 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1hxs s PHE 19 N 0.17 2.50 0.65 1.20 0.08 -1.26 -5.14 117.98 116.18 1hxs s PHE 19 Ca 0.32 -0.41 -0.13 0.00 0.12 0.00 0.00 56.93 56.83 1hxs s PHE 19 Cb 0.11 -1.36 -0.01 0.00 -0.57 0.00 0.00 43.02 41.19 1hxs s PHE 19 CO -0.15 0.55 1.06 -0.65 -0.10 0.00 0.00 175.22 175.93 1hxs s GLN 20 N -3.66 3.07 0.01 0.44 -0.21 -1.26 -5.10 119.66 112.95 1hxs s GLN 20 Ca 0.33 1.08 -0.22 0.00 0.02 0.00 0.00 55.36 56.57 1hxs s GLN 20 Cb -0.01 -2.00 0.05 0.00 1.00 0.00 0.00 33.01 32.04 1hxs s GLN 20 CO 0.18 -1.00 0.48 -1.54 -2.12 0.00 0.00 175.29 171.29 1hxs s SER 21 N -3.33 -0.40 0.55 5.90 1.04 -1.26 -5.15 113.70 111.05 1hxs s SER 21 Ca 0.61 0.25 -0.21 0.00 0.48 0.00 0.00 55.95 57.07 1hxs s SER 21 Cb -0.15 0.44 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 1hxs s SER 21 CO 0.47 -0.61 1.31 -2.16 0.98 0.00 0.00 173.24 173.23 1hxs s PRO 22 N -1.85 3.15 -0.12 4.02 0.04 -1.26 -4.99 135.00 134.00 1hxs s PRO 22 Ca -0.09 2.10 -0.22 0.00 0.04 0.00 0.00 61.00 62.83 1hxs s PRO 22 Cb -0.02 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1hxs s PRO 22 CO 0.03 -1.14 0.67 0.00 0.04 0.00 0.00 177.00 176.60 1hxs n ALA 24 N 4.26 2.09 -3.26 0.00 0.00 -1.26 -4.13 120.51 118.21 1hxs n ALA 24 Ca -0.01 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.14 1hxs n ALA 24 Cb 0.51 -1.41 -0.07 0.00 0.00 0.00 0.00 19.45 18.48 1hxs n ALA 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1hxs n LEU 25 N -1.83 1.90 -4.75 0.00 4.77 -1.26 -5.11 117.00 110.72 1hxs n LEU 25 Ca 0.05 -5.08 -0.38 0.00 -0.03 0.00 0.00 56.01 50.57 1hxs n LEU 25 Cb 0.32 0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1hxs n LEU 25 CO 0.24 2.10 0.99 -2.16 -1.33 0.00 0.00 177.39 177.24 1hxs s PRO 26 N -1.94 3.12 -1.71 3.23 0.04 -1.26 -2.62 135.00 133.85 1hxs s PRO 26 Ca 0.38 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.67 1hxs s PRO 26 Cb 0.19 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1hxs s PRO 26 CO -0.07 -1.21 0.00 0.39 0.04 0.00 0.00 177.00 176.14 1hxs n GLU 27 N -1.05 -1.40 -1.69 4.56 -0.58 -1.26 -4.93 120.64 114.29 1hxs n GLU 27 Ca 0.10 0.95 -0.44 0.00 -0.42 0.00 0.00 57.16 57.36 1hxs n GLU 27 Cb 0.45 -5.28 -0.02 0.00 -0.57 0.00 0.00 31.44 26.02 1hxs n GLU 27 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1hxs n PHE 28 N -2.18 2.34 -2.65 -0.32 -0.00 -1.08 -4.90 117.46 108.68 1hxs n PHE 28 Ca -0.17 0.41 -0.42 0.00 -0.00 0.00 0.00 57.45 57.27 1hxs n PHE 28 Cb 0.54 -2.49 -0.01 0.00 -0.00 0.00 0.00 39.48 37.52 1hxs n PHE 28 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1hxs s ASP 29 N 0.26 6.72 0.20 -2.13 2.15 -1.26 -4.99 116.67 117.62 1hxs s ASP 29 Ca 0.65 -2.11 -0.32 0.00 0.43 0.00 0.00 52.55 51.20 1hxs s ASP 29 Cb -0.60 -2.54 -0.12 0.00 -0.30 0.00 0.00 42.92 39.36 1hxs s ASP 29 CO 0.51 -1.23 1.69 -0.69 -0.17 0.00 0.00 175.17 175.28 1hxs s VAL 30 N 4.04 2.15 0.16 1.11 1.01 -1.26 -4.97 120.40 122.64 1hxs s VAL 30 Ca 0.48 0.10 -0.32 0.00 0.00 0.00 0.00 61.98 62.25 1hxs s VAL 30 Cb 0.01 -3.07 -0.10 0.00 0.00 0.00 0.00 36.38 33.22 1hxs s VAL 30 CO -0.01 0.01 1.58 -0.89 0.00 0.00 0.00 175.10 175.79 1hxs s THR 31 N 1.18 2.63 0.75 3.92 2.01 -1.26 -5.01 115.64 119.86 1hxs s THR 31 Ca 0.74 0.43 -0.12 0.00 0.31 0.00 0.00 61.69 63.05 1hxs s THR 31 Cb -0.49 -3.28 0.05 0.00 0.01 0.00 0.00 72.50 68.80 1hxs s THR 31 CO 0.32 0.03 1.10 -2.16 -0.69 0.00 0.00 174.62 173.22 1hxs s PRO 32 N 1.25 2.33 0.72 4.92 0.04 -1.26 -5.02 135.00 137.99 1hxs s PRO 32 Ca 0.71 1.26 -0.11 0.00 0.04 0.00 0.00 61.00 62.89 1hxs s PRO 32 Cb -0.44 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.23 1hxs s PRO 32 CO 0.31 -1.60 1.08 -1.25 0.04 0.00 0.00 177.00 175.59 1hxs s PRO 33 N -4.65 2.62 0.35 0.56 0.04 -1.26 -5.08 135.00 127.58 1hxs s PRO 33 Ca 0.63 1.11 0.09 0.00 0.04 0.00 0.00 61.00 62.88 1hxs s PRO 33 Cb -0.19 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1hxs s PRO 33 CO 0.52 -1.36 -0.08 0.96 0.04 0.00 0.00 177.00 177.09 1hxs s ILE 34 N -2.88 2.24 -1.20 0.56 -4.36 -1.26 -5.06 121.20 109.24 1hxs s ILE 34 Ca 0.61 -2.17 -0.18 0.00 -0.26 0.00 0.00 60.65 58.65 1hxs s ILE 34 Cb -0.16 -2.70 0.09 0.00 1.25 0.00 0.00 42.46 40.94 1hxs s ILE 34 CO 0.53 -0.18 1.58 -0.62 0.24 0.00 0.00 174.94 176.49 1hxs s ASP 35 N -3.63 6.81 0.05 4.36 2.15 -1.26 -4.97 116.67 120.19 1hxs s ASP 35 Ca 0.33 -2.36 -0.31 0.00 0.43 0.00 0.00 52.55 50.64 1hxs s ASP 35 Cb 0.03 -2.53 -0.06 0.00 -0.30 0.00 0.00 42.92 40.07 1hxs s ASP 35 CO 0.17 -1.13 1.25 -0.63 -0.17 0.00 0.00 175.17 174.66 1hxs s ILE 36 N 3.69 3.90 0.64 4.11 1.01 -1.26 -5.01 121.20 128.28 1hxs s ILE 36 Ca 0.49 1.35 -0.18 0.00 0.00 0.00 0.00 60.65 62.31 1hxs s ILE 36 Cb 0.01 -3.86 -0.02 0.00 0.01 0.00 0.00 42.46 38.60 1hxs s ILE 36 CO 0.02 0.08 1.14 -2.65 0.00 0.00 0.00 174.94 173.54 1hxs n PRO 37 N 4.19 0.97 -0.73 2.79 -0.02 -1.26 -4.09 135.00 136.85 1hxs n PRO 37 Ca 0.10 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1hxs n PRO 37 Cb 0.45 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1hxs n PRO 37 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hxs n GLY 38 N 1.08 0.69 3.78 -1.23 0.00 -1.26 -5.04 105.19 103.21 1hxs n GLY 38 Ca 0.15 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 1hxs n GLY 38 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1hxs s GLU 39 N -1.53 4.08 -0.10 1.61 2.12 -1.26 -5.02 118.70 118.60 1hxs s GLU 39 Ca 0.00 2.48 0.00 0.00 0.36 0.00 0.00 54.97 57.82 1hxs s GLU 39 Cb 0.00 -2.93 -0.02 0.00 0.26 0.00 0.00 34.13 31.44 1hxs s GLU 39 CO 0.00 -0.52 -0.11 0.08 -0.54 0.00 0.00 175.26 174.17 1hxs s VAL 40 N -1.14 3.30 -0.03 3.70 1.01 -1.26 -5.03 120.40 120.95 1hxs s VAL 40 Ca 0.53 -0.60 0.17 0.00 0.00 0.00 0.00 61.98 62.09 1hxs s VAL 40 Cb -0.45 -2.37 -0.26 0.00 0.00 0.00 0.00 36.38 33.30 1hxs s VAL 40 CO 0.60 0.55 0.36 0.29 0.00 0.00 0.00 175.10 176.90 1hxs n LYS 41 N 2.99 0.58 -3.76 2.72 4.76 -1.26 -5.02 118.16 119.17 1hxs n LYS 41 Ca -0.18 -0.15 -0.13 0.00 -2.87 0.00 0.00 58.31 54.99 1hxs n LYS 41 Cb 0.53 -1.41 -0.11 0.00 -1.84 0.00 0.00 35.03 32.19 1hxs n LYS 41 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1hxs s ASN 42 N -4.05 -0.32 0.56 4.39 3.84 -1.26 -5.04 114.94 113.05 1hxs s ASN 42 Ca -0.06 0.61 0.24 0.00 0.21 0.00 0.00 52.86 53.86 1hxs s ASN 42 Cb 0.11 0.60 1.55 0.00 -0.55 0.00 0.00 41.25 42.95 1hxs s ASN 42 CO 0.71 -0.12 2.18 0.24 -2.79 0.00 0.00 177.10 177.32 1hxs h MET 43 N 5.94 0.00 0.00 0.43 2.86 -2.02 -1.15 114.93 120.99 1hxs h MET 43 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 1hxs h MET 43 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1hxs h MET 43 CO 0.32 0.00 0.00 0.52 1.06 0.00 0.00 176.91 178.81 1hxs h MET 44 N 0.00 0.00 -0.87 1.72 2.86 -1.96 -0.98 114.93 115.71 1hxs h MET 44 Ca 0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1hxs h MET 44 Cb 0.13 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.75 1hxs h MET 44 CO -0.00 0.00 0.50 0.93 1.06 0.00 0.00 176.91 179.40 1hxs h GLU 45 N 0.00 1.19 -0.27 1.72 5.08 -1.63 -1.71 114.58 118.97 1hxs h GLU 45 Ca 0.00 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 1hxs h GLU 45 Cb 0.33 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1hxs h GLU 45 CO 0.00 0.85 -0.39 -0.07 -1.00 0.00 0.00 179.01 178.40 1hxs h LEU 46 N 1.20 0.65 -1.90 1.33 3.38 -1.33 -2.44 115.31 116.20 1hxs h LEU 46 Ca 0.31 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1hxs h LEU 46 Cb -0.02 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1hxs h LEU 46 CO -0.05 0.97 -0.12 0.00 0.09 0.00 0.00 178.44 179.33 1hxs h ALA 47 N 1.06 1.27 0.00 1.53 0.00 -1.18 -2.12 119.26 119.82 1hxs h ALA 47 Ca 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1hxs h ALA 47 Cb 0.90 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1hxs h ALA 47 CO 0.08 0.15 0.00 0.39 0.00 0.00 0.00 179.25 179.86 1hxs n GLU 48 N -3.62 0.58 -3.00 0.00 1.02 -0.70 -0.61 120.64 114.32 1hxs n GLU 48 Ca -0.02 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.73 1hxs n GLU 48 Cb 0.24 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.12 1hxs n GLU 48 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1hxs s ILE 49 N -2.41 4.99 0.03 -3.67 1.01 -0.80 -4.59 121.20 115.76 1hxs s ILE 49 Ca 0.33 1.54 -0.32 0.00 0.00 0.00 0.00 60.65 62.20 1hxs s ILE 49 Cb 0.20 -4.08 -0.11 0.00 0.01 0.00 0.00 42.46 38.48 1hxs s ILE 49 CO 0.43 0.26 1.86 0.47 0.00 0.00 0.00 174.94 177.95 1hxs n ASP 50 N 3.66 3.76 -4.38 3.58 8.00 -1.26 -4.59 116.55 125.31 1hxs n ASP 50 Ca -0.01 0.97 -0.23 0.00 0.71 0.00 0.00 54.79 56.24 1hxs n ASP 50 Cb 0.51 -1.46 -0.11 0.00 -0.02 0.00 0.00 41.12 40.04 1hxs n ASP 50 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1hxs s THR 51 N 3.44 2.05 0.10 -3.53 -4.23 -0.95 -4.92 115.64 107.61 1hxs s THR 51 Ca 0.87 -2.09 -0.29 0.00 -1.18 0.00 0.00 61.69 59.00 1hxs s THR 51 Cb -0.57 -2.03 -0.06 0.00 1.34 0.00 0.00 72.50 71.19 1hxs s THR 51 CO 0.44 -0.34 0.92 -0.32 -0.54 0.00 0.00 174.62 174.78 1hxs s MET 52 N -3.06 4.66 -0.09 3.99 1.75 -1.26 -1.61 119.30 123.68 1hxs s MET 52 Ca 0.21 1.37 -0.24 0.00 -1.25 0.00 0.00 55.69 55.77 1hxs s MET 52 Cb -0.05 -3.37 -0.03 0.00 2.84 0.00 0.00 34.83 34.22 1hxs s MET 52 CO 0.09 0.24 0.75 0.42 -0.65 0.00 0.00 175.02 175.87 1hxs s ILE 53 N -0.06 4.99 -1.24 10.11 1.01 0.06 -4.85 121.20 131.21 1hxs s ILE 53 Ca 0.45 1.53 -0.18 0.00 0.00 0.00 0.00 60.65 62.45 1hxs s ILE 53 Cb -0.23 -4.08 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 1hxs s ILE 53 CO 0.28 0.18 2.03 -0.81 0.00 0.00 0.00 174.94 176.62 1hxs n PRO 54 N 4.21 2.50 -0.24 2.79 -0.04 -1.25 -4.53 135.00 138.44 1hxs n PRO 54 Ca 0.01 -2.56 -0.06 0.00 -0.04 0.00 0.00 63.50 60.85 1hxs n PRO 54 Cb 0.51 -3.29 0.08 0.00 -0.04 0.00 0.00 33.50 30.76 1hxs n PRO 54 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1hxs h PHE 55 N 7.12 1.14 -3.68 0.54 0.04 -1.65 -3.39 116.94 117.05 1hxs h PHE 55 Ca 0.48 -0.11 -0.79 0.00 2.80 0.00 0.00 57.97 60.35 1hxs h PHE 55 Cb 0.72 -0.33 -0.27 0.00 2.20 0.00 0.00 35.95 38.27 1hxs h PHE 55 CO 1.38 0.90 0.24 0.34 -0.60 0.00 0.00 178.31 180.57 1hxs s ASP 56 N -6.45 6.95 -0.53 2.17 -1.08 -0.28 -4.88 116.67 112.58 1hxs s ASP 56 Ca -0.12 -3.15 -0.02 0.00 -0.52 0.00 0.00 52.55 48.74 1hxs s ASP 56 Cb 0.15 -2.19 0.23 0.00 -1.46 0.00 0.00 42.92 39.65 1hxs s ASP 56 CO 0.84 -0.42 2.30 0.18 0.52 0.00 0.00 175.17 178.58 1hxs n LEU 57 N 3.31 6.90 -4.75 -1.34 4.77 -1.26 -4.02 117.00 120.61 1hxs n LEU 57 Ca 0.19 -4.04 -0.31 0.00 -0.03 0.00 0.00 56.01 51.82 1hxs n LEU 57 Cb 0.43 -1.11 0.11 0.00 -2.33 0.00 0.00 43.42 40.52 1hxs n LEU 57 CO 0.39 1.55 0.69 -0.94 -1.33 0.00 0.00 177.39 177.76 1hxs s SER 58 N -0.36 4.20 0.43 -1.43 1.04 -1.26 -4.54 113.70 111.77 1hxs s SER 58 Ca 0.51 1.82 0.19 0.00 0.48 0.00 0.00 55.95 58.95 1hxs s SER 58 Cb 0.38 -2.48 1.13 0.00 0.10 0.00 0.00 66.02 65.14 1hxs s SER 58 CO -0.16 -2.23 1.86 0.00 0.98 0.00 0.00 173.24 173.69 1hxs h ALA 59 N -1.27 2.27 0.00 5.32 0.00 -1.96 0.70 119.26 124.32 1hxs h ALA 59 Ca -0.44 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1hxs h ALA 59 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1hxs h ALA 59 CO 0.51 -0.55 -1.18 0.25 0.00 0.00 0.00 179.25 178.27 1hxs n THR 60 N -4.49 0.39 -0.03 0.00 -2.24 -1.26 -4.39 114.28 102.26 1hxs n THR 60 Ca 0.19 -0.46 -0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1hxs n THR 60 Cb 0.72 -0.14 -0.14 0.00 -2.10 0.00 0.00 70.33 68.67 1hxs n THR 60 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hxs n LYS 61 N -2.41 0.66 -1.69 -0.78 5.02 -0.33 -4.89 118.16 113.73 1hxs n LYS 61 Ca -0.00 0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.90 1hxs n LYS 61 Cb 0.52 -1.61 0.03 0.00 -0.02 0.00 0.00 35.03 33.96 1hxs n LYS 61 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1hxs n LYS 62 N -2.65 1.55 -2.37 1.97 2.85 0.09 -2.16 118.16 117.45 1hxs n LYS 62 Ca -0.17 0.57 -0.21 0.00 -1.05 0.00 0.00 58.31 57.45 1hxs n LYS 62 Cb 0.88 -2.39 -0.01 0.00 -0.65 0.00 0.00 35.03 32.86 1hxs n LYS 62 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1hxs n ASN 63 N -0.49 -5.86 -4.16 -5.58 3.02 -1.26 -4.96 115.26 95.97 1hxs n ASN 63 Ca 0.10 0.01 -0.10 0.00 -0.03 0.00 0.00 54.58 54.56 1hxs n ASN 63 Cb 0.43 -4.89 -0.10 0.00 -0.61 0.00 0.00 39.78 34.61 1hxs n ASN 63 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1hxs s THR 64 N -3.02 0.22 0.59 3.41 -4.23 -0.92 -5.02 115.64 106.68 1hxs s THR 64 Ca 0.00 -1.92 0.29 0.00 -1.18 0.00 0.00 61.69 58.88 1hxs s THR 64 Cb 0.00 -2.02 0.37 0.00 1.34 0.00 0.00 72.50 72.19 1hxs s THR 64 CO 0.00 -0.51 1.98 0.24 -0.54 0.00 0.00 174.62 175.80 1hxs h MET 65 N 2.85 0.00 0.00 3.99 2.86 -1.94 -2.15 114.93 120.54 1hxs h MET 65 Ca -0.35 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 1hxs h MET 65 Cb 1.20 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 1hxs h MET 65 CO 0.60 0.00 -0.06 0.93 1.06 0.00 0.00 176.91 179.45 1hxs h GLU 66 N 0.00 0.00 0.00 1.72 4.39 -1.96 -2.75 114.58 115.97 1hxs h GLU 66 Ca 0.15 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 1hxs h GLU 66 Cb 0.85 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.50 1hxs h GLU 66 CO -0.00 0.06 -0.02 0.00 -1.16 0.00 0.00 179.01 177.89 1hxs h MET 67 N 0.00 0.00 0.00 2.33 -0.00 -1.35 -1.81 114.93 114.10 1hxs h MET 67 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1hxs h MET 67 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.04 1hxs h MET 67 CO 0.01 0.02 -0.37 0.66 -0.00 0.00 0.00 176.91 177.22 1hxs n TYR 68 N -3.32 0.30 -3.40 -0.10 4.01 -1.04 -1.13 117.16 112.49 1hxs n TYR 68 Ca -0.02 0.09 -0.40 0.00 -0.16 0.00 0.00 57.90 57.41 1hxs n TYR 68 Cb 0.12 -0.52 -0.09 0.00 -0.31 0.00 0.00 39.34 38.54 1hxs n TYR 68 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1hxs s ARG 69 N -3.07 3.87 -0.37 -0.72 0.52 -0.68 -4.60 118.95 113.90 1hxs s ARG 69 Ca 0.10 -0.11 -0.17 0.00 -0.52 0.00 0.00 55.73 55.03 1hxs s ARG 69 Cb 0.16 -3.70 0.00 0.00 0.52 0.00 0.00 34.95 31.93 1hxs s ARG 69 CO 0.66 -0.36 0.44 0.08 0.02 0.00 0.00 175.30 176.14 1hxs s VAL 70 N 2.06 5.08 -0.07 3.52 1.01 -0.53 -4.75 120.40 126.72 1hxs s VAL 70 Ca 0.14 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 1hxs s VAL 70 Cb -0.16 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 1hxs s VAL 70 CO 0.11 -0.25 0.98 -0.60 0.00 0.00 0.00 175.10 175.33 1hxs s ARG 71 N 2.20 4.46 0.39 2.72 3.52 -1.26 -1.03 118.95 129.96 1hxs s ARG 71 Ca 0.14 1.37 0.08 0.00 -0.13 0.00 0.00 55.73 57.19 1hxs s ARG 71 Cb -0.16 -3.51 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 1hxs s ARG 71 CO 0.13 -0.21 0.21 -0.51 -0.81 0.00 0.00 175.30 174.11 1hxs s LEU 72 N 1.63 3.24 0.24 -0.88 1.43 0.10 -4.97 118.68 119.47 1hxs s LEU 72 Ca 0.49 -0.89 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1hxs s LEU 72 Cb -0.19 -1.69 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 1hxs s LEU 72 CO 0.21 -0.48 0.42 -0.94 0.23 0.00 0.00 176.35 175.79 1hxs s SER 73 N -3.94 -0.05 -0.05 2.29 1.04 -1.26 -1.64 113.70 110.09 1hxs s SER 73 Ca 0.41 -1.00 0.02 0.00 0.48 0.00 0.00 55.95 55.87 1hxs s SER 73 Cb -0.00 0.55 0.13 0.00 0.10 0.00 0.00 66.02 66.81 1hxs s SER 73 CO 0.24 -1.09 0.79 -0.90 0.98 0.00 0.00 173.24 173.25 1hxs n ASP 74 N -0.36 2.03 -4.67 7.02 5.75 -0.14 -4.23 116.55 121.95 1hxs n ASP 74 Ca -0.01 -2.18 -0.33 0.00 -0.01 0.00 0.00 54.79 52.26 1hxs n ASP 74 Cb 0.63 -0.54 0.13 0.00 -1.03 0.00 0.00 41.12 40.31 1hxs n ASP 74 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1hxs n LYS 75 N 0.13 0.14 -1.45 0.11 2.85 -1.26 -4.74 118.16 113.93 1hxs n LYS 75 Ca 0.06 0.12 -0.37 0.00 -1.05 0.00 0.00 58.31 57.07 1hxs n LYS 75 Cb 0.46 -2.37 0.06 0.00 -0.65 0.00 0.00 35.03 32.53 1hxs n LYS 75 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1hxs n PRO 76 N -3.11 0.58 -1.58 -1.58 -0.02 -1.26 -4.61 135.00 123.42 1hxs n PRO 76 Ca 0.13 0.24 -0.50 0.00 -2.02 0.00 0.00 63.50 61.35 1hxs n PRO 76 Cb 0.51 -1.99 -0.05 0.00 -0.02 0.00 0.00 33.50 31.95 1hxs n PRO 76 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1hxs n HIS 77 N -2.05 1.36 -4.21 6.00 -0.00 -1.26 -5.00 115.22 110.06 1hxs n HIS 77 Ca 0.12 0.67 -0.18 0.00 -0.00 0.00 0.00 57.72 58.33 1hxs n HIS 77 Cb 0.48 -2.30 -0.11 0.00 -0.00 0.00 0.00 29.99 28.07 1hxs n HIS 77 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1hxs s THR 78 N 0.02 1.22 -2.12 3.57 -1.32 -1.26 -5.03 115.64 110.72 1hxs s THR 78 Ca 0.77 -1.60 0.18 0.00 -1.21 0.00 0.00 61.69 59.83 1hxs s THR 78 Cb -0.88 -1.39 0.46 0.00 -1.51 0.00 0.00 72.50 69.18 1hxs s THR 78 CO 0.50 -0.39 1.42 0.47 -2.21 0.00 0.00 174.62 174.42 1hxs n ASP 79 N 0.73 2.78 -4.84 8.08 8.00 -1.26 -4.45 116.55 125.59 1hxs n ASP 79 Ca -0.17 -1.95 -0.33 0.00 0.71 0.00 0.00 54.79 53.05 1hxs n ASP 79 Cb 0.56 -0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 1hxs n ASP 79 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1hxs s ASP 80 N -1.17 6.85 0.42 -2.24 1.01 -1.26 -1.41 116.67 118.87 1hxs s ASP 80 Ca 0.36 1.42 -0.25 0.00 0.71 0.00 0.00 52.55 54.78 1hxs s ASP 80 Cb 0.19 -2.43 -0.08 0.00 1.01 0.00 0.00 42.92 41.61 1hxs s ASP 80 CO 0.26 -0.24 1.28 -2.16 0.21 0.00 0.00 175.17 174.52 1hxs s PRO 81 N -2.97 3.89 0.05 8.23 0.04 -1.26 -4.57 135.00 138.41 1hxs s PRO 81 Ca 0.56 2.08 -0.15 0.00 0.04 0.00 0.00 61.00 63.53 1hxs s PRO 81 Cb -0.10 -2.67 -0.30 0.00 0.04 0.00 0.00 34.50 31.47 1hxs s PRO 81 CO 0.16 -0.54 1.09 0.82 0.04 0.00 0.00 177.00 178.58 1hxs h ILE 82 N 2.30 1.29 -3.05 0.56 2.04 -0.89 -3.48 117.51 116.27 1hxs h ILE 82 Ca -0.50 -2.52 -0.06 0.00 1.00 0.00 0.00 64.86 62.78 1hxs h ILE 82 Cb 1.25 2.76 -0.15 0.00 -0.74 0.00 0.00 36.82 39.93 1hxs h ILE 82 CO 0.62 0.76 -0.05 -1.48 0.00 0.00 0.00 178.15 178.00 1hxs s LEU 83 N -7.80 0.25 -0.03 1.44 0.05 -1.23 -4.98 118.68 106.39 1hxs s LEU 83 Ca -0.09 -0.03 0.00 0.00 0.05 0.00 0.00 54.13 54.05 1hxs s LEU 83 Cb 0.05 1.89 0.03 0.00 -2.05 0.00 0.00 46.19 46.11 1hxs s LEU 83 CO 0.94 -0.73 0.02 0.00 -0.55 0.00 0.00 176.35 176.02 1hxs s LEU 85 N 1.14 1.60 0.07 0.00 0.20 0.11 -5.01 118.68 116.79 1hxs s LEU 85 Ca -0.08 0.08 -0.19 0.00 0.69 0.00 0.00 54.13 54.63 1hxs s LEU 85 Cb -0.13 0.45 -0.07 0.00 -0.43 0.00 0.00 46.19 46.01 1hxs s LEU 85 CO -0.03 -0.14 0.56 -0.44 -0.29 0.00 0.00 176.35 176.02 1hxs s SER 86 N -0.39 7.05 -1.40 3.68 0.01 -1.26 -0.65 113.70 120.74 1hxs s SER 86 Ca -0.05 1.24 -0.15 0.00 1.31 0.00 0.00 55.95 58.30 1hxs s SER 86 Cb -0.03 -2.35 0.05 0.00 0.21 0.00 0.00 66.02 63.90 1hxs s SER 86 CO 0.00 0.27 2.04 -0.11 0.41 0.00 0.00 173.24 175.85 1hxs n LEU 87 N 1.70 6.12 -3.63 2.44 7.94 0.15 -4.67 117.00 127.05 1hxs n LEU 87 Ca -0.10 -4.06 -0.27 0.00 -1.11 0.00 0.00 56.01 50.46 1hxs n LEU 87 Cb 0.51 -1.69 -0.11 0.00 0.53 0.00 0.00 43.42 42.66 1hxs n LEU 87 CO 0.41 0.74 -0.18 -1.20 -1.11 0.00 0.00 177.39 176.05 1hxs n SER 88 N 6.96 1.19 0.26 1.96 7.64 -1.26 -3.49 113.62 126.88 1hxs n SER 88 Ca 0.51 -2.77 0.13 0.00 1.01 0.00 0.00 58.87 57.74 1hxs n SER 88 Cb 0.42 -0.65 0.71 0.00 -1.01 0.00 0.00 64.21 63.68 1hxs n SER 88 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1hxs h PRO 89 N 5.49 0.00 -0.02 1.43 0.13 -1.92 -0.02 132.00 137.08 1hxs h PRO 89 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1hxs h PRO 89 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1hxs h PRO 89 CO 0.54 0.12 -0.27 0.00 -0.23 0.00 0.00 178.00 178.16 1hxs n ALA 90 N -2.28 3.09 0.00 -0.56 0.00 -1.26 -3.37 120.51 116.14 1hxs n ALA 90 Ca -0.02 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1hxs n ALA 90 Cb 0.25 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.85 1hxs n ALA 90 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1hxs n SER 91 N 0.41 0.61 -4.72 0.00 3.41 -0.54 -4.63 113.62 108.16 1hxs n SER 91 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.31 1hxs n SER 91 Cb 0.50 0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.53 1hxs n SER 91 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hxs s ASP 92 N -0.48 6.57 0.58 4.04 -1.08 -0.13 -4.83 116.67 121.34 1hxs s ASP 92 Ca 0.00 2.65 0.28 0.00 -0.52 0.00 0.00 52.55 54.96 1hxs s ASP 92 Cb 0.00 -2.60 1.70 0.00 -1.46 0.00 0.00 42.92 40.56 1hxs s ASP 92 CO 0.00 -0.82 2.19 1.55 0.52 0.00 0.00 175.17 178.60 1hxs h PRO 93 N 6.52 0.00 0.00 4.34 0.13 -1.95 0.06 132.00 141.11 1hxs h PRO 93 Ca -0.43 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.62 1hxs h PRO 93 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1hxs h PRO 93 CO 0.90 0.00 -0.37 0.00 -0.23 0.00 0.00 178.00 178.29 1hxs h ARG 94 N 0.00 0.00 0.00 0.86 3.08 -1.90 -3.37 114.38 113.05 1hxs h ARG 94 Ca 0.03 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.87 1hxs h ARG 94 Cb 0.19 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 1hxs h ARG 94 CO -0.00 0.37 -1.97 1.28 -1.07 0.00 0.00 179.97 178.58 1hxs n LEU 95 N -3.30 0.00 0.25 3.04 4.77 -0.15 -3.91 117.00 117.70 1hxs n LEU 95 Ca 0.01 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.17 1hxs n LEU 95 Cb 0.61 0.29 0.82 0.00 -2.33 0.00 0.00 43.42 42.81 1hxs n LEU 95 CO 0.38 0.29 1.01 0.77 -1.33 0.00 0.00 177.39 178.51 1hxs h SER 96 N 0.00 0.00 -0.44 -1.43 4.64 -1.14 -1.59 113.55 113.59 1hxs h SER 96 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1hxs h SER 96 Cb 1.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1hxs h SER 96 CO 0.02 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.39 1hxs n HIS 97 N -2.80 0.59 -1.51 4.77 8.25 -1.26 -2.88 115.22 120.37 1hxs n HIS 97 Ca -0.01 -0.49 -0.30 0.00 -0.26 0.00 0.00 57.72 56.66 1hxs n HIS 97 Cb 0.17 -0.02 0.08 0.00 1.12 0.00 0.00 29.99 31.34 1hxs n HIS 97 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1hxs s THR 98 N -1.00 3.33 0.27 1.59 -4.23 -0.60 -4.75 115.64 110.25 1hxs s THR 98 Ca 0.30 0.43 -0.01 0.00 -1.18 0.00 0.00 61.69 61.23 1hxs s THR 98 Cb 0.15 -3.14 0.25 0.00 1.34 0.00 0.00 72.50 71.11 1hxs s THR 98 CO 0.20 -0.56 1.82 -0.03 -0.54 0.00 0.00 174.62 175.51 1hxs h MET 99 N -1.02 0.85 -0.18 3.99 1.85 -1.92 0.40 114.93 118.90 1hxs h MET 99 Ca -0.46 -0.05 0.01 0.00 -0.61 0.00 0.00 59.70 58.59 1hxs h MET 99 Cb 1.25 -0.19 -0.02 0.00 0.43 0.00 0.00 31.60 33.07 1hxs h MET 99 CO 0.58 0.57 0.07 1.25 -0.40 0.00 0.00 176.91 178.98 1hxs h LEU 100 N 0.88 0.10 -0.72 3.39 5.85 -1.86 -1.83 115.31 121.11 1hxs h LEU 100 Ca 0.46 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.16 1hxs h LEU 100 Cb 0.46 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1hxs h LEU 100 CO -0.27 0.08 0.34 1.23 -0.34 0.00 0.00 178.44 179.49 1hxs h GLY 101 N 0.17 1.12 1.91 3.75 0.00 -1.45 -0.81 103.07 107.76 1hxs h GLY 101 Ca 0.08 -0.56 -0.13 0.00 0.00 0.00 0.00 47.33 46.72 1hxs h GLY 101 CO -0.07 0.53 -0.56 0.83 0.00 0.00 0.00 176.54 177.27 1hxs h GLU 102 N 1.01 0.09 -0.20 4.80 4.39 -0.71 -1.07 114.58 122.91 1hxs h GLU 102 Ca 0.25 -0.06 -0.20 0.00 0.34 0.00 0.00 59.36 59.68 1hxs h GLU 102 Cb 0.13 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1hxs h GLU 102 CO -0.03 0.63 -0.67 0.82 -1.16 0.00 0.00 179.01 178.60 1hxs h ILE 103 N 0.07 1.28 0.00 3.13 2.04 -1.14 -2.76 117.51 120.13 1hxs h ILE 103 Ca -0.00 -1.87 -0.01 0.00 1.00 0.00 0.00 64.86 63.98 1hxs h ILE 103 Cb 1.02 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.98 1hxs h ILE 103 CO 0.08 0.60 -0.04 -0.07 0.00 0.00 0.00 178.15 178.71 1hxs h LEU 104 N 0.54 0.00 0.00 1.44 4.07 -0.85 -1.23 115.31 119.28 1hxs h LEU 104 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1hxs h LEU 104 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.04 1hxs h LEU 104 CO 0.14 0.04 0.00 0.59 -1.08 0.00 0.00 178.44 178.13 1hxs n ASN 105 N -3.68 0.00 -1.17 -0.43 3.02 -0.43 -1.78 115.26 110.78 1hxs n ASN 105 Ca -0.03 -0.96 0.12 0.00 -0.03 0.00 0.00 54.58 53.68 1hxs n ASN 105 Cb 0.14 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.57 1hxs n ASN 105 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1hxs n TYR 106 N -0.96 0.63 -4.17 3.10 4.01 -0.47 -3.62 117.16 115.68 1hxs n TYR 106 Ca 0.20 -0.32 -0.15 0.00 -0.16 0.00 0.00 57.90 57.48 1hxs n TYR 106 Cb 0.09 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.01 1hxs n TYR 106 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1hxs s TYR 107 N -1.37 1.07 -0.05 -0.72 2.02 -0.74 -0.40 117.35 117.17 1hxs s TYR 107 Ca 0.41 -0.63 0.13 0.00 -0.37 0.00 0.00 57.07 56.61 1hxs s TYR 107 Cb 0.23 -0.59 -0.19 0.00 -0.40 0.00 0.00 41.96 41.02 1hxs s TYR 107 CO 0.32 0.01 0.84 1.15 -1.57 0.00 0.00 175.55 176.29 1hxs h THR 108 N 3.66 0.88 -4.29 -0.71 2.02 -0.13 -3.43 112.91 110.91 1hxs h THR 108 Ca -0.38 -2.60 -0.54 0.00 0.77 0.00 0.00 66.41 63.66 1hxs h THR 108 Cb 1.19 2.38 -0.29 0.00 -1.74 0.00 0.00 68.15 69.69 1hxs h THR 108 CO 0.51 0.50 -0.83 -1.00 0.37 0.00 0.00 175.52 175.07 1hxs s HIS 109 N -2.72 1.56 0.09 3.16 3.76 -0.54 -1.40 115.29 119.20 1hxs s HIS 109 Ca -0.03 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.63 1hxs s HIS 109 Cb 0.08 -0.99 -0.03 0.00 1.11 0.00 0.00 32.58 32.75 1hxs s HIS 109 CO 0.82 -0.01 -0.13 1.67 -0.85 0.00 0.00 174.74 176.23 1hxs s TRP 110 N -0.46 1.20 0.03 1.40 1.48 -0.12 -1.60 118.94 120.87 1hxs s TRP 110 Ca 0.06 -0.53 -0.21 0.00 -1.06 0.00 0.00 56.10 54.37 1hxs s TRP 110 Cb -0.07 -0.66 0.04 0.00 -1.16 0.00 0.00 33.47 31.63 1hxs s TRP 110 CO -0.00 0.06 0.47 0.00 -4.06 0.00 0.00 176.95 173.42 1hxs s ALA 111 N -1.78 -1.18 0.00 2.67 0.00 -0.15 -0.32 121.76 121.00 1hxs s ALA 111 Ca 0.02 0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1hxs s ALA 111 Cb -0.07 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.34 1hxs s ALA 111 CO 0.02 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.75 1hxs n GLY 112 N 0.60 1.52 3.84 0.00 0.00 -1.26 -0.81 105.19 109.09 1hxs n GLY 112 Ca -0.19 -2.22 -0.33 0.00 0.00 0.00 0.00 46.02 43.28 1hxs n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hxs s SER 113 N 0.00 6.85 0.31 1.61 0.01 -1.26 -4.24 113.70 116.97 1hxs s SER 113 Ca 0.00 1.36 0.08 0.00 1.31 0.00 0.00 55.95 58.70 1hxs s SER 113 Cb 0.00 -2.40 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 1hxs s SER 113 CO 0.00 -0.19 -0.07 -0.76 0.41 0.00 0.00 173.24 172.63 1hxs s LEU 114 N -2.84 2.58 -0.09 2.44 1.43 -0.88 -0.79 118.68 120.53 1hxs s LEU 114 Ca 0.53 -1.20 -0.08 0.00 -1.03 0.00 0.00 54.13 52.35 1hxs s LEU 114 Cb -0.11 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.35 1hxs s LEU 114 CO 0.17 -0.29 0.23 -1.59 0.23 0.00 0.00 176.35 175.11 1hxs s LYS 115 N -3.68 0.27 -0.20 1.70 -2.85 -0.31 0.06 119.74 114.73 1hxs s LYS 115 Ca 0.31 0.32 -0.04 0.00 -1.00 0.00 0.00 55.97 55.56 1hxs s LYS 115 Cb 0.03 0.13 -0.02 0.00 -2.06 0.00 0.00 37.83 35.92 1hxs s LYS 115 CO 0.14 -0.03 -0.04 -0.06 0.10 0.00 0.00 175.35 175.46 1hxs s PHE 116 N 0.12 2.97 -0.12 1.78 0.40 -0.31 -1.80 117.98 121.02 1hxs s PHE 116 Ca -0.00 -0.69 0.01 0.00 -0.60 0.00 0.00 56.93 55.65 1hxs s PHE 116 Cb -0.02 -2.06 -0.01 0.00 0.51 0.00 0.00 43.02 41.45 1hxs s PHE 116 CO 0.00 -0.37 -0.17 0.99 0.70 0.00 0.00 175.22 176.37 1hxs s THR 117 N 1.12 2.61 -0.12 0.64 2.01 -0.03 -0.47 115.64 121.40 1hxs s THR 117 Ca 0.02 -0.81 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 1hxs s THR 117 Cb -0.15 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 1hxs s THR 117 CO 0.00 0.54 0.03 -0.36 -0.69 0.00 0.00 174.62 174.13 1hxs s PHE 118 N 0.45 3.22 -0.23 4.92 0.08 -0.18 -0.27 117.98 125.97 1hxs s PHE 118 Ca -0.12 0.16 -0.06 0.00 0.12 0.00 0.00 56.93 57.03 1hxs s PHE 118 Cb -0.16 -1.88 -0.02 0.00 -0.57 0.00 0.00 43.02 40.38 1hxs s PHE 118 CO 0.05 0.39 0.03 -1.17 -0.10 0.00 0.00 175.22 174.42 1hxs s LEU 119 N -0.53 3.29 -0.18 -0.37 2.96 0.50 -1.33 118.68 123.02 1hxs s LEU 119 Ca 0.10 -0.23 -0.27 0.00 -0.22 0.00 0.00 54.13 53.50 1hxs s LEU 119 Cb -0.12 -1.86 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 1hxs s LEU 119 CO 0.02 0.00 0.93 0.12 -1.32 0.00 0.00 176.35 176.10 1hxs s PHE 120 N 1.37 3.41 -0.25 5.38 5.36 -0.81 -1.74 117.98 130.71 1hxs s PHE 120 Ca 0.05 1.38 0.12 0.00 -0.96 0.00 0.00 56.93 57.52 1hxs s PHE 120 Cb -0.15 -3.13 0.53 0.00 -0.34 0.00 0.00 43.02 39.94 1hxs s PHE 120 CO 0.02 -0.32 1.47 0.00 -1.46 0.00 0.00 175.22 174.93 1hxs n GLY 122 N -0.83 -1.60 3.75 0.00 0.00 -1.25 -4.54 105.19 100.72 1hxs n GLY 122 Ca 0.29 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 1hxs n GLY 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hxs s SER 123 N -3.17 3.76 0.41 1.61 1.04 -1.26 -4.94 113.70 111.15 1hxs s SER 123 Ca 0.35 1.31 0.13 0.00 0.48 0.00 0.00 55.95 58.22 1hxs s SER 123 Cb -0.01 -2.00 0.88 0.00 0.10 0.00 0.00 66.02 64.99 1hxs s SER 123 CO 0.25 -2.44 1.93 -0.03 0.98 0.00 0.00 173.24 173.93 1hxs h MET 124 N -1.41 0.02 0.00 4.02 4.05 -2.00 -1.78 114.93 117.83 1hxs h MET 124 Ca -0.49 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 58.92 1hxs h MET 124 Cb 1.29 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.09 1hxs h MET 124 CO 0.58 0.27 0.00 -1.33 0.23 0.00 0.00 176.91 176.65 1hxs n MET 125 N -4.24 0.08 -2.91 0.39 2.81 -1.26 -4.78 117.12 107.20 1hxs n MET 125 Ca -0.02 0.25 -0.40 0.00 -1.81 0.00 0.00 57.70 55.72 1hxs n MET 125 Cb 0.30 -1.63 -0.05 0.00 -0.71 0.00 0.00 33.22 31.13 1hxs n MET 125 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1hxs s ALA 126 N -3.10 3.36 0.42 3.04 0.00 -0.67 -4.44 121.76 120.37 1hxs s ALA 126 Ca 0.08 0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.47 1hxs s ALA 126 Cb 0.11 -3.06 -0.06 0.00 0.00 0.00 0.00 23.12 20.12 1hxs s ALA 126 CO 0.38 0.11 0.02 0.95 0.00 0.00 0.00 175.76 177.22 1hxs s THR 127 N -0.39 1.58 0.00 0.00 -4.23 -0.16 -4.88 115.64 107.56 1hxs s THR 127 Ca 0.40 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1hxs s THR 127 Cb -0.22 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 70.90 1hxs s THR 127 CO 0.26 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 1hxs n GLY 128 N -1.00 2.60 3.13 3.99 0.00 -1.26 -1.26 105.19 111.39 1hxs n GLY 128 Ca -0.08 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.84 1hxs n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hxs s LYS 129 N -2.00 2.26 0.26 1.61 1.02 -1.26 -0.74 119.74 120.89 1hxs s LYS 129 Ca 0.00 -0.64 0.11 0.00 0.02 0.00 0.00 55.97 55.46 1hxs s LYS 129 Cb 0.00 -1.80 -0.05 0.00 -0.52 0.00 0.00 37.83 35.46 1hxs s LYS 129 CO 0.00 0.14 -0.20 -0.51 -0.92 0.00 0.00 175.35 173.86 1hxs s LEU 130 N 0.39 2.57 -0.17 3.17 1.43 -0.36 -0.51 118.68 125.21 1hxs s LEU 130 Ca -0.14 -1.01 0.01 0.00 -1.03 0.00 0.00 54.13 51.96 1hxs s LEU 130 Cb -0.16 -1.05 0.01 0.00 0.03 0.00 0.00 46.19 45.02 1hxs s LEU 130 CO 0.05 0.02 -0.20 -0.22 0.23 0.00 0.00 176.35 176.24 1hxs s LEU 131 N -3.41 2.17 -0.18 1.79 0.20 -0.01 -0.09 118.68 119.16 1hxs s LEU 131 Ca 0.28 -0.62 -0.06 0.00 0.69 0.00 0.00 54.13 54.43 1hxs s LEU 131 Cb -0.05 -1.48 -0.04 0.00 -0.43 0.00 0.00 46.19 44.19 1hxs s LEU 131 CO 0.14 0.03 0.03 -0.69 -0.29 0.00 0.00 176.35 175.56 1hxs s VAL 132 N 1.12 4.44 0.02 1.68 1.01 -0.02 -0.68 120.40 127.96 1hxs s VAL 132 Ca 0.01 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1hxs s VAL 132 Cb -0.14 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 1hxs s VAL 132 CO -0.08 0.47 -0.12 -0.55 0.00 0.00 0.00 175.10 174.81 1hxs s SER 133 N 0.43 1.42 -0.15 3.32 0.15 0.40 -0.69 113.70 118.58 1hxs s SER 133 Ca 0.01 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1hxs s SER 133 Cb -0.13 -0.11 0.02 0.00 -1.71 0.00 0.00 66.02 64.10 1hxs s SER 133 CO 0.01 0.05 -0.13 -0.47 1.20 0.00 0.00 173.24 173.90 1hxs s TYR 134 N -0.65 2.13 -0.33 3.44 5.04 0.48 -1.11 117.35 126.35 1hxs s TYR 134 Ca 0.02 -1.21 -0.05 0.00 -2.44 0.00 0.00 57.07 53.38 1hxs s TYR 134 Cb -0.06 -1.57 0.05 0.00 0.35 0.00 0.00 41.96 40.72 1hxs s TYR 134 CO 0.01 -0.66 0.08 0.00 -1.34 0.00 0.00 175.55 173.63 1hxs s ALA 135 N 1.50 2.99 0.64 3.97 0.00 0.31 -1.16 121.76 130.02 1hxs s ALA 135 Ca 0.04 -1.80 -0.18 0.00 0.00 0.00 0.00 51.96 50.03 1hxs s ALA 135 Cb -0.13 -2.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 1hxs s ALA 135 CO -0.10 -1.35 1.03 -2.30 0.00 0.00 0.00 175.76 173.03 1hxs n PRO 136 N 4.75 0.84 -1.19 0.00 -0.02 -1.26 -0.57 135.00 137.55 1hxs n PRO 136 Ca -0.12 0.34 -0.29 0.00 -2.02 0.00 0.00 63.50 61.40 1hxs n PRO 136 Cb 0.44 -2.25 0.20 0.00 -0.02 0.00 0.00 33.50 31.87 1hxs n PRO 136 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1hxs s PRO 137 N -3.01 -0.31 0.00 0.52 0.04 -1.26 -4.58 135.00 126.39 1hxs s PRO 137 Ca 0.77 0.18 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1hxs s PRO 137 Cb -0.39 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1hxs s PRO 137 CO 0.46 -3.15 0.00 0.41 0.04 0.00 0.00 177.00 174.76 1hxs n GLY 138 N -1.22 0.62 3.53 0.56 0.00 -1.26 -5.00 105.19 102.42 1hxs n GLY 138 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1hxs n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hxs s ALA 139 N -2.00 2.94 0.02 4.61 0.00 -1.26 -5.09 121.76 120.97 1hxs s ALA 139 Ca 0.00 -1.35 -0.34 0.00 0.00 0.00 0.00 51.96 50.27 1hxs s ALA 139 Cb 0.00 0.63 -0.13 0.00 0.00 0.00 0.00 23.12 23.62 1hxs s ALA 139 CO 0.00 -0.29 1.74 -0.25 0.00 0.00 0.00 175.76 176.96 1hxs n ASP 140 N -1.14 3.24 -4.72 0.00 8.00 -1.26 -4.90 116.55 115.77 1hxs n ASP 140 Ca -0.07 1.02 -0.43 0.00 0.71 0.00 0.00 54.79 56.03 1hxs n ASP 140 Cb 0.66 -1.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.35 1hxs n ASP 140 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1hxs n PRO 141 N 5.17 2.45 -1.96 -0.24 -0.02 -1.26 -4.85 135.00 134.29 1hxs n PRO 141 Ca 0.20 0.87 -0.42 0.00 -2.02 0.00 0.00 63.50 62.13 1hxs n PRO 141 Cb 0.29 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.13 1hxs n PRO 141 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1hxs s PRO 142 N -0.46 4.21 0.00 0.52 0.02 -1.26 -4.85 135.00 133.17 1hxs s PRO 142 Ca 0.66 2.29 0.02 0.00 0.02 0.00 0.00 61.00 63.99 1hxs s PRO 142 Cb -0.55 -3.59 0.01 0.00 0.02 0.00 0.00 34.50 30.38 1hxs s PRO 142 CO 0.49 -0.72 0.47 1.63 -0.33 0.00 0.00 177.00 178.54 1hxs n LYS 143 N 5.57 0.83 -4.22 5.54 4.76 -1.26 -4.94 118.16 124.43 1hxs n LYS 143 Ca 0.16 -0.50 -0.18 0.00 -2.87 0.00 0.00 58.31 54.92 1hxs n LYS 143 Cb 0.41 -0.95 -0.13 0.00 -1.84 0.00 0.00 35.03 32.53 1hxs n LYS 143 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1hxs s LYS 144 N -0.40 0.76 0.34 1.97 -0.14 -1.26 -4.20 119.74 116.81 1hxs s LYS 144 Ca 0.02 -0.75 0.09 0.00 -1.36 0.00 0.00 55.97 53.97 1hxs s LYS 144 Cb 0.02 -0.71 0.82 0.00 -1.68 0.00 0.00 37.83 36.27 1hxs s LYS 144 CO 0.04 0.17 1.82 -0.09 -0.76 0.00 0.00 175.35 176.53 1hxs h ARG 145 N 4.78 0.67 -0.85 1.68 2.43 -1.60 -1.84 114.38 119.66 1hxs h ARG 145 Ca -0.37 -0.04 0.17 0.00 -0.81 0.00 0.00 59.98 58.93 1hxs h ARG 145 Cb 1.19 -0.15 -0.11 0.00 -0.42 0.00 0.00 29.97 30.48 1hxs h ARG 145 CO 0.43 0.45 0.39 -0.22 -1.51 0.00 0.00 179.97 179.50 1hxs h LYS 146 N 0.69 0.48 0.22 0.20 3.64 -1.97 0.54 116.57 120.39 1hxs h LYS 146 Ca 0.51 -0.03 -0.29 0.00 -1.27 0.00 0.00 60.65 59.57 1hxs h LYS 146 Cb 0.88 -0.11 0.03 0.00 -0.41 0.00 0.00 32.23 32.62 1hxs h LYS 146 CO -0.28 0.32 -1.29 0.93 -2.27 0.00 0.00 179.45 176.87 1hxs h GLU 147 N 0.50 0.47 -0.31 1.90 3.07 -1.78 -3.35 114.58 115.08 1hxs h GLU 147 Ca 0.49 -0.81 -0.02 0.00 -0.50 0.00 0.00 59.36 58.52 1hxs h GLU 147 Cb 0.80 0.30 -0.02 0.00 -0.84 0.00 0.00 28.75 28.99 1hxs h GLU 147 CO -0.44 1.39 0.12 0.00 -1.40 0.00 0.00 179.01 178.68 1hxs h ALA 148 N 0.13 1.63 0.00 3.43 0.00 -0.68 -2.11 119.26 121.67 1hxs h ALA 148 Ca -0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1hxs h ALA 148 Cb 2.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.67 1hxs h ALA 148 CO 0.24 0.29 0.00 1.98 0.00 0.00 0.00 179.25 181.76 1hxs h MET 149 N 0.43 0.00 0.00 0.00 1.85 -1.06 -2.20 114.93 113.96 1hxs h MET 149 Ca 0.11 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.20 1hxs h MET 149 Cb 0.10 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.13 1hxs h MET 149 CO -0.01 0.00 -0.01 -0.07 -0.40 0.00 0.00 176.91 176.42 1hxs h LEU 150 N 0.00 0.00 0.00 3.39 3.38 -1.50 -3.46 115.31 117.11 1hxs h LEU 150 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1hxs h LEU 150 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1hxs h LEU 150 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1hxs n GLY 151 N 1.29 1.16 3.74 0.83 0.00 -0.83 -5.04 105.19 106.34 1hxs n GLY 151 Ca 0.05 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 1hxs n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hxs s THR 152 N 1.13 2.65 0.10 2.61 2.01 -0.31 -4.86 115.64 118.98 1hxs s THR 152 Ca 0.00 0.51 -0.25 0.00 0.31 0.00 0.00 61.69 62.26 1hxs s THR 152 Cb 0.00 -3.33 0.08 0.00 0.01 0.00 0.00 72.50 69.26 1hxs s THR 152 CO 0.00 0.07 0.67 -1.38 -0.69 0.00 0.00 174.62 173.29 1hxs s HIS 153 N 0.40 -0.51 -0.08 4.92 -0.00 -1.26 -0.39 115.29 118.37 1hxs s HIS 153 Ca 0.63 0.38 0.03 0.00 -0.00 0.00 0.00 55.06 56.10 1hxs s HIS 153 Cb -0.42 0.54 0.01 0.00 -0.00 0.00 0.00 32.58 32.70 1hxs s HIS 153 CO 0.39 -0.76 -0.19 0.08 -0.00 0.00 0.00 174.74 174.27 1hxs s VAL 154 N -3.37 1.63 -0.38 -5.38 1.01 0.13 -4.97 120.40 109.08 1hxs s VAL 154 Ca 0.01 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.02 1hxs s VAL 154 Cb -0.01 -1.44 0.01 0.00 0.00 0.00 0.00 36.38 34.94 1hxs s VAL 154 CO -0.10 0.47 0.58 -0.63 0.00 0.00 0.00 175.10 175.41 1hxs s ILE 155 N 0.50 4.93 -0.26 2.22 1.01 -1.26 -0.84 121.20 127.51 1hxs s ILE 155 Ca -0.17 0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.63 1hxs s ILE 155 Cb -0.17 -4.06 -0.02 0.00 0.01 0.00 0.00 42.46 38.22 1hxs s ILE 155 CO 0.06 -0.35 0.55 0.86 0.00 0.00 0.00 174.94 176.07 1hxs s TRP 156 N 2.58 3.27 -0.31 3.97 -0.00 0.87 -4.93 118.94 124.39 1hxs s TRP 156 Ca 0.21 0.69 -0.17 0.00 -0.00 0.00 0.00 56.10 56.84 1hxs s TRP 156 Cb -0.15 -2.76 -0.02 0.00 -0.00 0.00 0.00 33.47 30.54 1hxs s TRP 156 CO 0.15 -0.30 0.44 0.34 -0.00 0.00 0.00 176.95 177.59 1hxs s ASP 157 N 1.52 6.29 0.23 5.86 2.15 -1.26 -1.22 116.67 130.25 1hxs s ASP 157 Ca 0.23 0.14 -0.30 0.00 0.43 0.00 0.00 52.55 53.05 1hxs s ASP 157 Cb -0.16 -2.24 -0.09 0.00 -0.30 0.00 0.00 42.92 40.14 1hxs s ASP 157 CO 0.09 -0.33 1.19 -0.63 -0.17 0.00 0.00 175.17 175.32 1hxs s ILE 158 N 2.22 3.41 0.00 4.11 1.01 0.08 -4.94 121.20 127.08 1hxs s ILE 158 Ca 0.17 1.28 0.00 0.00 0.00 0.00 0.00 60.65 62.10 1hxs s ILE 158 Cb -0.16 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1hxs s ILE 158 CO 0.11 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.91 1hxs n GLY 159 N 1.71 0.93 0.35 6.18 0.00 -1.26 -4.55 105.19 108.55 1hxs n GLY 159 Ca 0.02 -0.39 -0.03 0.00 0.00 0.00 0.00 46.02 45.62 1hxs n GLY 159 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1hxs h LEU 160 N 0.00 1.05 -8.67 0.99 3.38 -1.98 -3.27 115.31 106.82 1hxs h LEU 160 Ca 0.00 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 57.37 1hxs h LEU 160 Cb 0.00 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 1hxs h LEU 160 CO 0.00 0.79 1.11 -1.10 0.09 0.00 0.00 178.44 179.33 1hxs s GLN 161 N -6.03 3.36 0.59 1.13 -1.52 -1.26 -4.85 119.66 111.09 1hxs s GLN 161 Ca -0.13 0.68 0.36 0.00 -1.95 0.00 0.00 55.36 54.32 1hxs s GLN 161 Cb 0.17 -4.11 1.87 0.00 -0.22 0.00 0.00 33.01 30.72 1hxs s GLN 161 CO 0.81 -1.85 2.19 0.66 -0.25 0.00 0.00 175.29 176.86 1hxs h SER 162 N 11.24 0.00 -3.39 5.90 4.64 -1.95 -3.46 113.55 126.52 1hxs h SER 162 Ca -0.27 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.61 1hxs h SER 162 Cb 1.10 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.04 1hxs h SER 162 CO 1.14 0.03 -0.74 -0.44 -0.87 0.00 0.00 176.83 175.96 1hxs s SER 163 N -5.65 2.45 -0.04 4.97 0.01 -1.26 -1.91 113.70 112.26 1hxs s SER 163 Ca -0.03 -0.99 -0.03 0.00 1.31 0.00 0.00 55.95 56.21 1hxs s SER 163 Cb 0.12 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.25 1hxs s SER 163 CO 0.50 -0.18 0.10 0.00 0.41 0.00 0.00 173.24 174.07 1hxs s THR 165 N 0.37 3.87 -0.17 0.00 2.01 -1.26 -1.01 115.64 119.46 1hxs s THR 165 Ca -0.03 -0.36 -0.04 0.00 0.31 0.00 0.00 61.69 61.57 1hxs s THR 165 Cb -0.04 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 1hxs s THR 165 CO -0.01 0.48 -0.02 -0.32 -0.69 0.00 0.00 174.62 174.05 1hxs s MET 166 N 0.52 3.68 -0.10 4.92 1.75 0.38 -4.97 119.30 125.48 1hxs s MET 166 Ca -0.03 -0.51 -0.20 0.00 -1.25 0.00 0.00 55.69 53.70 1hxs s MET 166 Cb -0.14 -2.98 -0.04 0.00 2.84 0.00 0.00 34.83 34.51 1hxs s MET 166 CO 0.03 0.18 0.57 0.08 -0.65 0.00 0.00 175.02 175.23 1hxs s VAL 167 N 0.53 5.12 -0.72 10.11 1.01 -1.26 -1.16 120.40 134.03 1hxs s VAL 167 Ca -0.02 1.16 -0.18 0.00 0.00 0.00 0.00 61.98 62.94 1hxs s VAL 167 Cb -0.14 -3.91 0.13 0.00 0.00 0.00 0.00 36.38 32.46 1hxs s VAL 167 CO 0.02 0.29 0.82 -0.69 0.00 0.00 0.00 175.10 175.54 1hxs s VAL 168 N 0.75 4.95 0.41 2.92 1.01 0.11 -4.99 120.40 125.56 1hxs s VAL 168 Ca 0.31 -1.42 -0.26 0.00 0.00 0.00 0.00 61.98 60.61 1hxs s VAL 168 Cb -0.16 -4.56 -0.08 0.00 0.00 0.00 0.00 36.38 31.57 1hxs s VAL 168 CO 0.13 -1.21 1.28 -2.16 0.00 0.00 0.00 175.10 173.15 1hxs s PRO 169 N 2.20 3.95 -0.39 2.72 0.05 -1.26 -2.08 135.00 140.20 1hxs s PRO 169 Ca 0.18 2.10 -0.28 0.00 0.05 0.00 0.00 61.00 63.05 1hxs s PRO 169 Cb -0.17 -2.72 -0.07 0.00 0.05 0.00 0.00 34.50 31.59 1hxs s PRO 169 CO -0.00 -0.49 2.33 1.87 0.05 0.00 0.00 177.00 180.76 1hxs n TRP 170 N 0.07 1.63 -3.85 0.56 -0.00 -1.26 -4.87 117.44 109.72 1hxs n TRP 170 Ca 0.04 0.04 -0.30 0.00 -0.00 0.00 0.00 57.50 57.29 1hxs n TRP 170 Cb 0.44 -2.66 -0.16 0.00 -0.00 0.00 0.00 31.31 28.94 1hxs n TRP 170 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 1hxs s ILE 171 N 10.16 1.19 -0.06 5.87 1.01 -1.26 -4.97 121.20 133.14 1hxs s ILE 171 Ca 1.02 -1.13 -0.19 0.00 0.00 0.00 0.00 60.65 60.34 1hxs s ILE 171 Cb -0.33 -1.61 0.04 0.00 0.01 0.00 0.00 42.46 40.56 1hxs s ILE 171 CO 0.32 -0.25 0.44 -0.55 0.00 0.00 0.00 174.94 174.90 1hxs s SER 172 N 1.53 -0.37 -0.09 3.58 0.15 -1.26 -4.97 113.70 112.27 1hxs s SER 172 Ca -0.01 0.42 -0.26 0.00 0.70 0.00 0.00 55.95 56.80 1hxs s SER 172 Cb -0.18 0.50 -0.26 0.00 -1.71 0.00 0.00 66.02 64.37 1hxs s SER 172 CO -0.10 -0.43 0.90 -0.55 1.20 0.00 0.00 173.24 174.26 1hxs h ASN 173 N 3.94 0.15 -4.33 5.45 -1.07 -1.93 -3.46 115.58 114.33 1hxs h ASN 173 Ca -0.28 -0.89 -0.50 0.00 0.07 0.00 0.00 56.30 54.69 1hxs h ASN 173 Cb 1.17 -0.05 0.05 0.00 -2.07 0.00 0.00 38.32 37.42 1hxs h ASN 173 CO 0.36 1.03 0.41 0.42 0.07 0.00 0.00 177.43 179.72 1hxs s THR 174 N -2.65 4.67 -0.44 6.14 -4.23 -1.26 -4.95 115.64 112.92 1hxs s THR 174 Ca -0.17 0.94 0.26 0.00 -1.18 0.00 0.00 61.69 61.54 1hxs s THR 174 Cb -0.01 -3.84 0.31 0.00 1.34 0.00 0.00 72.50 70.31 1hxs s THR 174 CO 0.73 -1.06 1.76 0.71 -0.54 0.00 0.00 174.62 176.22 1hxs h THR 175 N -0.09 0.00 -3.54 3.99 1.35 -1.97 -3.43 112.91 109.21 1hxs h THR 175 Ca -0.45 -0.56 -0.15 0.00 -0.55 0.00 0.00 66.41 64.71 1hxs h THR 175 Cb 1.19 1.49 -0.21 0.00 -1.73 0.00 0.00 68.15 68.90 1hxs h THR 175 CO 0.62 0.00 -0.51 -0.31 -0.25 0.00 0.00 175.52 175.07 1hxs s TYR 176 N -3.29 0.05 0.22 4.73 1.51 -1.26 -4.79 117.35 114.52 1hxs s TYR 176 Ca 0.06 -0.14 0.06 0.00 -1.01 0.00 0.00 57.07 56.04 1hxs s TYR 176 Cb 0.09 -0.05 -0.03 0.00 -0.11 0.00 0.00 41.96 41.85 1hxs s TYR 176 CO 0.56 -0.27 0.25 1.03 -1.11 0.00 0.00 175.55 176.01 1hxs s ARG 177 N -1.33 3.16 0.47 -0.62 0.52 0.57 -4.88 118.95 116.85 1hxs s ARG 177 Ca -0.14 -0.87 -0.21 0.00 -0.52 0.00 0.00 55.73 53.99 1hxs s ARG 177 Cb -0.07 -2.73 -0.08 0.00 0.52 0.00 0.00 34.95 32.58 1hxs s ARG 177 CO 0.01 0.44 1.04 -0.65 0.02 0.00 0.00 175.30 176.17 1hxs s GLN 178 N -3.71 3.85 -0.31 3.54 -1.52 -1.26 -0.95 119.66 119.31 1hxs s GLN 178 Ca 0.33 1.40 0.01 0.00 -1.95 0.00 0.00 55.36 55.15 1hxs s GLN 178 Cb -0.09 -2.17 0.30 0.00 -0.22 0.00 0.00 33.01 30.83 1hxs s GLN 178 CO 0.26 -0.39 1.77 0.25 -0.25 0.00 0.00 175.29 176.93 1hxs n THR 179 N -0.81 2.56 -4.24 -0.19 -2.24 -0.49 -4.78 114.28 104.08 1hxs n THR 179 Ca 0.09 -1.44 -0.13 0.00 -2.27 0.00 0.00 64.05 60.29 1hxs n THR 179 Cb 0.52 -1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 67.63 1hxs n THR 179 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1hxs s ILE 180 N -2.22 0.54 -0.03 2.28 -4.36 -1.26 -4.50 121.20 111.65 1hxs s ILE 180 Ca 0.33 -1.97 -0.30 0.00 -0.26 0.00 0.00 60.65 58.45 1hxs s ILE 180 Cb 0.27 -2.21 -0.06 0.00 1.25 0.00 0.00 42.46 41.71 1hxs s ILE 180 CO 0.03 -0.38 1.62 -1.81 0.24 0.00 0.00 174.94 174.64 1hxs s ASP 181 N -3.18 6.68 -0.19 4.36 1.01 -1.26 -4.92 116.67 119.17 1hxs s ASP 181 Ca 0.27 2.26 -0.09 0.00 0.71 0.00 0.00 52.55 55.70 1hxs s ASP 181 Cb 0.07 -2.54 0.07 0.00 1.01 0.00 0.00 42.92 41.53 1hxs s ASP 181 CO 0.05 -0.89 0.44 -0.62 0.21 0.00 0.00 175.17 174.37 1hxs s ASP 182 N 2.96 -0.47 0.19 0.27 2.15 -1.26 -5.06 116.67 115.46 1hxs s ASP 182 Ca 0.72 1.00 -0.09 0.00 0.43 0.00 0.00 52.55 54.60 1hxs s ASP 182 Cb -0.34 1.08 0.11 0.00 -0.30 0.00 0.00 42.92 43.46 1hxs s ASP 182 CO 0.29 -0.21 1.72 0.28 -0.17 0.00 0.00 175.17 177.08 1hxs h SER 183 N 7.54 1.01 -0.78 -0.34 0.02 -1.98 -1.83 113.55 117.18 1hxs h SER 183 Ca -0.28 -0.21 0.03 0.00 -0.84 0.00 0.00 61.79 60.49 1hxs h SER 183 Cb 1.16 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 63.39 1hxs h SER 183 CO 0.21 0.96 0.51 0.15 -1.14 0.00 0.00 176.83 177.53 1hxs h PHE 184 N 1.01 0.93 -0.55 3.45 3.57 -2.01 -2.40 116.94 120.95 1hxs h PHE 184 Ca 0.22 0.02 -0.31 0.00 3.53 0.00 0.00 57.97 61.43 1hxs h PHE 184 Cb 0.32 -0.31 -0.19 0.00 2.79 0.00 0.00 35.95 38.56 1hxs h PHE 184 CO 0.02 0.55 0.06 0.25 -2.23 0.00 0.00 178.31 176.97 1hxs n THR 185 N -4.45 2.76 -1.82 4.41 -2.24 -1.11 -4.88 114.28 106.96 1hxs n THR 185 Ca 0.10 -2.75 -0.38 0.00 -2.27 0.00 0.00 64.05 58.75 1hxs n THR 185 Cb 0.10 -0.48 0.05 0.00 -2.10 0.00 0.00 70.33 67.90 1hxs n THR 185 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1hxs s GLU 186 N -3.34 3.00 0.00 -0.78 -1.05 -0.71 -4.64 118.70 111.18 1hxs s GLU 186 Ca 0.49 2.13 0.17 0.00 -0.15 0.00 0.00 54.97 57.61 1hxs s GLU 186 Cb 0.43 -2.13 -0.18 0.00 -0.44 0.00 0.00 34.13 31.82 1hxs s GLU 186 CO 0.02 -1.27 0.72 0.41 0.95 0.00 0.00 175.26 176.09 1hxs n GLY 187 N 0.74 -0.56 0.00 -3.83 0.00 -1.23 -4.79 105.19 95.52 1hxs n GLY 187 Ca 0.12 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1hxs n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hxs n GLY 188 N 1.39 -1.16 2.98 -0.02 0.00 -1.26 -4.28 105.19 102.84 1hxs n GLY 188 Ca 0.03 -2.10 -0.24 0.00 0.00 0.00 0.00 46.02 43.72 1hxs n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hxs s TYR 189 N 0.00 1.26 -0.17 1.61 2.02 0.27 -0.67 117.35 121.67 1hxs s TYR 189 Ca 0.00 -0.46 -0.06 0.00 -0.37 0.00 0.00 57.07 56.18 1hxs s TYR 189 Cb 0.00 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.55 1hxs s TYR 189 CO 0.00 -0.28 0.03 0.42 -1.57 0.00 0.00 175.55 174.16 1hxs s ILE 190 N 0.84 4.51 0.05 2.71 1.09 0.17 -0.53 121.20 130.05 1hxs s ILE 190 Ca -0.12 -0.14 -0.10 0.00 -1.10 0.00 0.00 60.65 59.20 1hxs s ILE 190 Cb -0.15 -3.01 0.01 0.00 -1.06 0.00 0.00 42.46 38.24 1hxs s ILE 190 CO 0.02 0.48 0.21 -0.94 -0.10 0.00 0.00 174.94 174.61 1hxs s SER 191 N 0.26 0.03 -0.03 3.58 1.04 -0.27 -0.71 113.70 117.59 1hxs s SER 191 Ca 0.02 -0.41 0.05 0.00 0.48 0.00 0.00 55.95 56.08 1hxs s SER 191 Cb -0.13 0.32 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 1hxs s SER 191 CO 0.01 -0.61 -0.17 -0.69 0.98 0.00 0.00 173.24 172.76 1hxs s VAL 192 N -2.91 1.41 0.15 5.02 1.01 -1.02 -0.45 120.40 123.61 1hxs s VAL 192 Ca -0.02 -0.72 0.06 0.00 0.00 0.00 0.00 61.98 61.29 1hxs s VAL 192 Cb 0.01 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1hxs s VAL 192 CO -0.06 0.40 -0.12 -0.36 0.00 0.00 0.00 175.10 174.97 1hxs s PHE 193 N -0.08 1.39 -0.01 5.22 0.40 0.14 -0.13 117.98 124.91 1hxs s PHE 193 Ca -0.01 -0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 55.36 1hxs s PHE 193 Cb -0.10 -0.70 -0.04 0.00 0.51 0.00 0.00 43.02 42.69 1hxs s PHE 193 CO 0.01 0.16 1.14 0.71 0.70 0.00 0.00 175.22 177.94 1hxs s TYR 194 N -2.91 3.39 -0.19 0.36 2.02 -1.26 -0.83 117.35 117.93 1hxs s TYR 194 Ca 0.15 1.36 -0.21 0.00 -0.37 0.00 0.00 57.07 58.01 1hxs s TYR 194 Cb -0.00 -3.35 -0.18 0.00 -0.40 0.00 0.00 41.96 38.03 1hxs s TYR 194 CO 0.03 -0.97 0.27 0.37 -1.57 0.00 0.00 175.55 173.67 1hxs h GLN 195 N 7.09 0.00 0.00 -0.62 5.75 -1.07 -3.44 115.11 122.81 1hxs h GLN 195 Ca -0.38 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.12 1hxs h GLN 195 Cb 1.19 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.74 1hxs h GLN 195 CO 0.83 0.89 0.00 0.25 -2.65 0.00 0.00 178.83 178.15 1hxs n THR 196 N -4.49 0.00 -3.71 2.39 -2.24 -0.99 -5.01 114.28 100.24 1hxs n THR 196 Ca -0.26 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.43 1hxs n THR 196 Cb 0.60 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1hxs n THR 196 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hxs s ARG 197 N 1.49 1.49 0.11 -0.78 1.70 -1.26 -4.45 118.95 117.24 1hxs s ARG 197 Ca 0.00 -0.83 -0.30 0.00 -0.47 0.00 0.00 55.73 54.13 1hxs s ARG 197 Cb 0.00 0.56 -0.07 0.00 -0.57 0.00 0.00 34.95 34.88 1hxs s ARG 197 CO 0.00 -0.65 1.18 0.42 -1.08 0.00 0.00 175.30 175.17 1hxs s ILE 198 N -3.87 3.89 -0.06 4.99 -1.09 -1.26 -4.20 121.20 119.60 1hxs s ILE 198 Ca 0.08 1.44 0.05 0.00 -2.23 0.00 0.00 60.65 60.00 1hxs s ILE 198 Cb -0.03 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 1hxs s ILE 198 CO -0.02 0.16 -0.23 -0.69 -1.23 0.00 0.00 174.94 172.94 1hxs s VAL 199 N 0.59 1.88 0.15 2.92 1.01 -0.39 -4.32 120.40 122.23 1hxs s VAL 199 Ca 0.56 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.65 1hxs s VAL 199 Cb -0.30 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1hxs s VAL 199 CO 0.32 0.52 -0.15 0.68 0.00 0.00 0.00 175.10 176.47 1hxs s VAL 200 N -0.05 1.56 0.64 2.92 -7.23 -1.26 -0.99 120.40 115.99 1hxs s VAL 200 Ca -0.05 -1.87 -0.11 0.00 -1.81 0.00 0.00 61.98 58.14 1hxs s VAL 200 Cb -0.14 -1.73 0.15 0.00 0.56 0.00 0.00 36.38 35.22 1hxs s VAL 200 CO 0.04 -0.41 0.86 -0.81 -0.31 0.00 0.00 175.10 174.46 1hxs n PRO 201 N 0.30 -0.90 -1.06 4.82 -0.04 -1.26 -5.04 135.00 131.82 1hxs n PRO 201 Ca -0.13 -1.33 -0.30 0.00 -0.04 0.00 0.00 63.50 61.70 1hxs n PRO 201 Cb 0.58 -0.90 0.16 0.00 -0.04 0.00 0.00 33.50 33.30 1hxs n PRO 201 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hxs s LEU 202 N 0.00 2.11 -1.67 1.53 1.43 -1.26 -3.88 118.68 116.95 1hxs s LEU 202 Ca 0.49 1.57 -0.00 0.00 -1.03 0.00 0.00 54.13 55.15 1hxs s LEU 202 Cb -0.01 -3.91 0.00 0.00 0.03 0.00 0.00 46.19 42.30 1hxs s LEU 202 CO 0.34 -2.92 0.01 -1.20 0.23 0.00 0.00 176.35 172.81 1hxs n SER 203 N -4.07 -5.61 -4.05 2.29 7.64 -1.26 -4.98 113.62 103.57 1hxs n SER 203 Ca 0.07 -0.02 -0.19 0.00 1.01 0.00 0.00 58.87 59.74 1hxs n SER 203 Cb 0.55 -4.64 -0.15 0.00 -1.01 0.00 0.00 64.21 58.96 1hxs n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1hxs s THR 204 N -2.98 0.83 0.15 0.44 2.01 -1.25 -5.11 115.64 109.74 1hxs s THR 204 Ca 0.00 -0.52 -0.33 0.00 0.31 0.00 0.00 61.69 61.16 1hxs s THR 204 Cb -0.00 -0.71 -0.12 0.00 0.01 0.00 0.00 72.50 71.68 1hxs s THR 204 CO 0.00 0.18 1.71 -2.65 -0.69 0.00 0.00 174.62 173.18 1hxs n PRO 205 N 2.68 2.54 0.00 4.92 -0.02 -1.26 -4.88 135.00 138.99 1hxs n PRO 205 Ca -0.14 0.92 0.13 0.00 -2.02 0.00 0.00 63.50 62.39 1hxs n PRO 205 Cb 0.56 -2.75 0.42 0.00 -0.02 0.00 0.00 33.50 31.71 1hxs n PRO 205 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1hxs n ARG 206 N 4.35 0.38 -4.64 -0.52 1.74 -1.26 -4.84 116.66 111.87 1hxs n ARG 206 Ca 0.17 -0.18 -0.25 0.00 -0.77 0.00 0.00 57.85 56.82 1hxs n ARG 206 Cb 0.33 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.13 1hxs n ARG 206 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1hxs s GLU 207 N -2.75 1.35 0.26 5.56 2.02 -1.26 -0.96 118.70 122.91 1hxs s GLU 207 Ca 0.19 -0.88 -0.21 0.00 0.02 0.00 0.00 54.97 54.08 1hxs s GLU 207 Cb 0.19 -1.43 0.03 0.00 0.10 0.00 0.00 34.13 33.02 1hxs s GLU 207 CO 0.58 0.37 0.72 0.00 0.02 0.00 0.00 175.26 176.94 1hxs s MET 208 N -1.08 1.71 0.08 1.61 0.23 -0.65 -5.00 119.30 116.20 1hxs s MET 208 Ca 0.07 -0.92 0.04 0.00 -1.03 0.00 0.00 55.69 53.85 1hxs s MET 208 Cb -0.08 0.60 -0.04 0.00 -1.53 0.00 0.00 34.83 33.77 1hxs s MET 208 CO 0.01 -0.78 0.03 -0.51 -2.03 0.00 0.00 175.02 171.75 1hxs s ASP 209 N -2.90 5.25 0.14 -1.18 1.01 -1.26 0.03 116.67 117.76 1hxs s ASP 209 Ca 0.10 -0.10 0.09 0.00 0.71 0.00 0.00 52.55 53.35 1hxs s ASP 209 Cb -0.05 -1.33 -0.04 0.00 1.01 0.00 0.00 42.92 42.51 1hxs s ASP 209 CO 0.05 0.18 -0.15 0.27 0.21 0.00 0.00 175.17 175.73 1hxs s ILE 210 N -1.33 2.97 0.00 0.77 -4.36 -0.19 -0.97 121.20 118.09 1hxs s ILE 210 Ca 0.27 -1.57 0.07 0.00 -0.26 0.00 0.00 60.65 59.16 1hxs s ILE 210 Cb -0.12 -2.41 -0.03 0.00 1.25 0.00 0.00 42.46 41.16 1hxs s ILE 210 CO 0.20 0.02 -0.21 -0.76 0.24 0.00 0.00 174.94 174.42 1hxs s LEU 211 N -2.41 2.38 0.10 0.37 1.43 -0.71 -1.45 118.68 118.39 1hxs s LEU 211 Ca 0.21 -0.41 0.10 0.00 -1.03 0.00 0.00 54.13 52.99 1hxs s LEU 211 Cb -0.10 -1.43 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1hxs s LEU 211 CO 0.12 0.30 -0.23 -0.83 0.23 0.00 0.00 176.35 175.94 1hxs s GLY 212 N -0.97 1.58 0.05 -3.19 0.00 -1.26 -0.37 107.32 103.17 1hxs s GLY 212 Ca 0.12 -1.37 0.05 0.00 0.00 0.00 0.00 44.72 43.52 1hxs s GLY 212 CO 0.01 -1.33 -0.14 -1.36 0.00 0.00 0.00 173.10 170.29 1hxs s PHE 213 N -1.03 1.24 0.02 1.90 0.40 0.62 -0.76 117.98 120.37 1hxs s PHE 213 Ca 0.15 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 56.14 1hxs s PHE 213 Cb -0.10 -0.72 -0.02 0.00 0.51 0.00 0.00 43.02 42.69 1hxs s PHE 213 CO 0.06 0.05 -0.19 0.54 0.70 0.00 0.00 175.22 176.38 1hxs s VAL 214 N -1.04 1.54 0.08 -0.44 0.11 -0.63 -0.85 120.40 119.17 1hxs s VAL 214 Ca 0.00 -1.01 -0.16 0.00 -2.93 0.00 0.00 61.98 57.88 1hxs s VAL 214 Cb -0.09 -1.32 0.03 0.00 -1.53 0.00 0.00 36.38 33.47 1hxs s VAL 214 CO 0.02 0.28 0.37 -0.94 -3.33 0.00 0.00 175.10 171.50 1hxs s SER 215 N -0.85 -0.20 0.46 3.54 1.04 -0.74 -2.23 113.70 114.71 1hxs s SER 215 Ca 0.07 -0.21 -0.20 0.00 0.48 0.00 0.00 55.95 56.10 1hxs s SER 215 Cb -0.08 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.36 1hxs s SER 215 CO 0.01 -0.73 0.97 0.00 0.98 0.00 0.00 173.24 174.47 1hxs s ALA 216 N -3.08 3.02 0.82 5.32 0.00 0.22 -1.16 121.76 126.89 1hxs s ALA 216 Ca -0.01 0.37 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 1hxs s ALA 216 Cb 0.01 -3.16 0.15 0.00 0.00 0.00 0.00 23.12 20.12 1hxs s ALA 216 CO -0.07 -0.04 1.13 0.00 0.00 0.00 0.00 175.76 176.78 1hxs n ASN 218 N -3.21 0.00 -1.45 0.00 2.04 -1.26 -2.37 115.26 109.00 1hxs n ASN 218 Ca 0.15 -0.47 0.09 0.00 -0.44 0.00 0.00 54.58 53.91 1hxs n ASN 218 Cb 0.60 -0.07 0.33 0.00 -2.53 0.00 0.00 39.78 38.11 1hxs n ASN 218 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1hxs n ASP 219 N -1.07 4.54 -4.77 0.53 5.75 -1.26 -4.99 116.55 115.28 1hxs n ASP 219 Ca 0.14 -2.46 -0.38 0.00 -0.01 0.00 0.00 54.79 52.08 1hxs n ASP 219 Cb 0.09 -0.55 -0.06 0.00 -1.03 0.00 0.00 41.12 39.57 1hxs n ASP 219 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1hxs s PHE 220 N -1.86 3.60 0.11 2.11 2.19 -1.00 -4.29 117.98 118.84 1hxs s PHE 220 Ca 0.48 0.90 -0.06 0.00 0.33 0.00 0.00 56.93 58.59 1hxs s PHE 220 Cb 0.31 -2.42 -0.02 0.00 -1.31 0.00 0.00 43.02 39.58 1hxs s PHE 220 CO 0.23 0.37 0.14 -1.54 1.83 0.00 0.00 175.22 176.25 1hxs s SER 221 N -0.09 0.22 0.13 6.13 1.04 0.01 -5.00 113.70 116.13 1hxs s SER 221 Ca 0.24 -0.90 0.04 0.00 0.48 0.00 0.00 55.95 55.81 1hxs s SER 221 Cb -0.16 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.25 1hxs s SER 221 CO 0.11 -0.74 -0.09 0.68 0.98 0.00 0.00 173.24 174.17 1hxs s VAL 222 N -3.94 1.01 0.31 5.02 -7.23 -1.26 -0.98 120.40 113.33 1hxs s VAL 222 Ca 0.12 -1.97 -0.15 0.00 -1.81 0.00 0.00 61.98 58.17 1hxs s VAL 222 Cb 0.06 -1.74 0.02 0.00 0.56 0.00 0.00 36.38 35.28 1hxs s VAL 222 CO -0.05 -0.76 0.65 0.00 -0.31 0.00 0.00 175.10 174.63 1hxs s ARG 223 N -3.65 1.88 -0.37 4.82 1.70 -0.62 -5.01 118.95 117.70 1hxs s ARG 223 Ca 0.14 -1.29 -0.10 0.00 -0.47 0.00 0.00 55.73 54.01 1hxs s ARG 223 Cb 0.03 0.56 0.01 0.00 -0.57 0.00 0.00 34.95 34.98 1hxs s ARG 223 CO -0.01 -0.84 0.34 -0.11 -1.08 0.00 0.00 175.30 173.60 1hxs n LEU 224 N -0.48 -7.59 -4.69 -1.89 0.00 -1.26 -1.46 117.00 99.63 1hxs n LEU 224 Ca -0.04 0.87 -0.43 0.00 0.00 0.00 0.00 56.01 56.41 1hxs n LEU 224 Cb 0.60 -3.24 -0.01 0.00 0.00 0.00 0.00 43.42 40.78 1hxs n LEU 224 CO 0.22 -2.58 0.87 -0.11 0.00 0.00 0.00 177.39 175.79 1hxs n LEU 225 N 0.17 3.40 -3.60 -1.96 7.94 -1.26 -0.58 117.00 121.11 1hxs n LEU 225 Ca 0.06 1.20 -0.11 0.00 -1.11 0.00 0.00 56.01 56.04 1hxs n LEU 225 Cb 0.29 -1.47 -0.04 0.00 0.53 0.00 0.00 43.42 42.73 1hxs n LEU 225 CO 0.45 -0.59 0.21 0.00 -1.11 0.00 0.00 177.39 176.36 1hxs s ARG 226 N -1.87 1.08 0.62 1.96 1.70 0.47 -4.81 118.95 118.10 1hxs s ARG 226 Ca 0.56 -0.58 -0.16 0.00 -0.47 0.00 0.00 55.73 55.08 1hxs s ARG 226 Cb -0.58 0.48 -0.02 0.00 -0.57 0.00 0.00 34.95 34.27 1hxs s ARG 226 CO 0.62 -0.43 1.09 -0.51 -1.08 0.00 0.00 175.30 174.99 1hxs s ASP 227 N -2.62 5.43 0.24 -2.89 1.01 -1.26 -4.34 116.67 112.23 1hxs s ASP 227 Ca 0.01 1.93 -0.04 0.00 0.71 0.00 0.00 52.55 55.17 1hxs s ASP 227 Cb 0.01 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 1hxs s ASP 227 CO -0.10 -1.41 0.48 0.28 0.21 0.00 0.00 175.17 174.63 1hxs s THR 228 N -2.35 5.09 -2.34 -1.27 -1.32 -1.24 -4.77 115.64 107.45 1hxs s THR 228 Ca 0.66 -0.05 0.25 0.00 -1.21 0.00 0.00 61.69 61.33 1hxs s THR 228 Cb -0.19 -3.71 0.54 0.00 -1.51 0.00 0.00 72.50 67.63 1hxs s THR 228 CO 0.39 -0.21 1.70 0.35 -2.21 0.00 0.00 174.62 174.64 1hxs n THR 229 N -0.65 0.09 1.59 5.08 -2.24 -1.26 -4.31 114.28 112.58 1hxs n THR 229 Ca -0.03 -0.26 0.06 0.00 -2.27 0.00 0.00 64.05 61.56 1hxs n THR 229 Cb 0.53 0.32 0.26 0.00 -2.10 0.00 0.00 70.33 69.34 1hxs n THR 229 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1hxs n HIS 230 N 0.09 0.15 -3.75 4.78 8.25 -1.26 -4.79 115.22 118.69 1hxs n HIS 230 Ca 0.18 -0.07 -0.14 0.00 -0.26 0.00 0.00 57.72 57.43 1hxs n HIS 230 Cb 0.31 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.33 1hxs n HIS 230 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1hxs s ILE 231 N -1.85 0.05 0.30 1.59 1.10 -1.26 -5.17 121.20 115.96 1hxs s ILE 231 Ca 0.19 -0.45 -0.13 0.00 -0.51 0.00 0.00 60.65 59.75 1hxs s ILE 231 Cb 0.10 -0.64 0.01 0.00 0.15 0.00 0.00 42.46 42.08 1hxs s ILE 231 CO 0.15 -0.25 0.58 -1.83 -2.11 0.00 0.00 174.94 171.48 1hxs s GLU 232 N -1.34 1.80 -0.26 3.50 -1.05 -1.26 -4.97 118.70 115.11 1hxs s GLU 232 Ca -0.13 -1.34 -0.04 0.00 -0.15 0.00 0.00 54.97 53.30 1hxs s GLU 232 Cb -0.05 0.52 0.09 0.00 -0.44 0.00 0.00 34.13 34.25 1hxs s GLU 232 CO 0.04 -0.78 0.13 -1.14 0.95 0.00 0.00 175.26 174.46 1hxs s GLN 233 N -3.48 0.17 -0.36 -4.83 0.74 -1.26 -5.10 119.66 105.53 1hxs s GLN 233 Ca 0.21 -0.39 -0.22 0.00 0.05 0.00 0.00 55.36 55.01 1hxs s GLN 233 Cb -0.02 -1.30 0.01 0.00 1.10 0.00 0.00 33.01 32.79 1hxs s GLN 233 CO 0.11 -0.93 0.71 0.15 -0.55 0.00 0.00 175.29 174.78 1hxs s LYS 234 N 2.13 3.71 0.00 1.67 -0.14 -1.26 -5.35 119.74 120.51 1hxs s LYS 234 Ca 0.07 0.18 0.00 0.00 -1.36 0.00 0.00 55.97 54.86 1hxs s LYS 234 Cb -0.16 -3.81 0.00 0.00 -1.68 0.00 0.00 37.83 32.18 1hxs s LYS 234 CO -0.30 -0.79 0.00 0.00 -0.76 0.00 0.00 175.35 173.51