#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hxz s LYS 2 N 0.00 4.28 0.80 4.33 1.02 -1.26 -5.04 119.74 123.86 3hxz s LYS 2 Ca 0.00 1.62 -0.12 0.00 0.02 0.00 0.00 55.97 57.50 3hxz s LYS 2 Cb 0.00 -2.73 0.07 0.00 -0.52 0.00 0.00 37.83 34.65 3hxz s LYS 2 CO 0.00 -0.06 1.10 -1.54 -0.92 0.00 0.00 175.35 173.93 3hxz s SER 3 N -1.33 4.53 0.24 2.83 1.04 -1.26 -4.78 113.70 114.96 3hxz s SER 3 Ca 0.54 1.25 -0.05 0.00 0.48 0.00 0.00 55.95 58.17 3hxz s SER 3 Cb -0.26 -1.98 0.38 0.00 0.10 0.00 0.00 66.02 64.26 3hxz s SER 3 CO 0.32 -1.94 1.82 0.74 0.98 0.00 0.00 173.24 175.16 3hxz h THR 4 N -1.07 0.94 -0.62 2.02 2.02 -1.96 -0.51 112.91 113.73 3hxz h THR 4 Ca -0.47 -0.28 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 3hxz h THR 4 Cb 1.27 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 3hxz h THR 4 CO 0.60 0.15 0.32 0.00 0.37 0.00 0.00 175.52 176.96 3hxz h ALA 5 N 1.44 0.79 -0.44 6.16 0.00 -1.92 -1.26 119.26 124.03 3hxz h ALA 5 Ca 0.39 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 3hxz h ALA 5 Cb 0.32 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3hxz h ALA 5 CO -0.23 0.33 -0.10 0.93 0.00 0.00 0.00 179.25 180.18 3hxz h GLU 6 N 0.84 0.78 -0.38 0.00 5.08 -1.75 -1.99 114.58 117.17 3hxz h GLU 6 Ca 0.22 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3hxz h GLU 6 Cb 0.08 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3hxz h GLU 6 CO -0.03 0.86 -0.01 0.82 -1.00 0.00 0.00 179.01 179.64 3hxz h ILE 7 N 0.71 1.26 -0.41 3.13 2.04 -0.86 0.29 117.51 123.66 3hxz h ILE 7 Ca 0.12 -1.02 0.04 0.00 1.00 0.00 0.00 64.86 64.99 3hxz h ILE 7 Cb 0.58 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 3hxz h ILE 7 CO 0.04 0.34 0.19 -0.09 0.00 0.00 0.00 178.15 178.63 3hxz h ARG 8 N 0.50 0.38 -0.33 2.37 2.43 -1.09 -1.75 114.38 116.89 3hxz h ARG 8 Ca 0.11 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 3hxz h ARG 8 Cb 0.49 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3hxz h ARG 8 CO 0.02 0.25 -0.35 0.37 -1.51 0.00 0.00 179.97 178.76 3hxz h GLN 9 N 0.39 0.75 -0.68 0.20 5.75 -1.21 -2.84 115.11 117.46 3hxz h GLN 9 Ca 0.18 -0.36 -0.07 0.00 -0.15 0.00 0.00 58.65 58.24 3hxz h GLN 9 Cb 0.10 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.62 3hxz h GLN 9 CO -0.14 0.98 0.14 0.00 -2.65 0.00 0.00 178.83 177.16 3hxz h ALA 10 N 0.98 0.95 -0.14 3.38 0.00 -0.68 0.13 119.26 123.88 3hxz h ALA 10 Ca 0.06 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hxz h ALA 10 Cb 0.88 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hxz h ALA 10 CO 0.08 0.66 0.09 0.35 0.00 0.00 0.00 179.25 180.43 3hxz h PHE 11 N 1.05 0.18 -0.66 0.00 3.57 -1.27 -0.24 116.94 119.56 3hxz h PHE 11 Ca 0.21 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.63 3hxz h PHE 11 Cb 0.41 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 3hxz h PHE 11 CO 0.03 0.13 0.10 -0.07 -2.23 0.00 0.00 178.31 176.27 3hxz h LEU 12 N 0.18 1.05 -0.76 0.59 3.38 -1.25 -2.56 115.31 115.94 3hxz h LEU 12 Ca 0.05 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3hxz h LEU 12 Cb -0.00 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 3hxz h LEU 12 CO -0.01 1.05 0.40 0.44 0.09 0.00 0.00 178.44 180.40 3hxz h ASP 13 N 1.02 0.97 0.20 -0.43 3.32 -0.54 -0.41 116.42 120.55 3hxz h ASP 13 Ca 0.20 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3hxz h ASP 13 Cb 0.45 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3hxz h ASP 13 CO 0.01 0.80 -0.19 0.15 -1.72 0.00 0.00 179.24 178.30 3hxz h PHE 14 N 1.06 -0.51 -0.08 4.55 3.57 -0.78 -0.81 116.94 123.94 3hxz h PHE 14 Ca 0.27 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.63 3hxz h PHE 14 Cb 0.07 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3hxz h PHE 14 CO 0.00 -0.29 -0.55 0.74 -2.23 0.00 0.00 178.31 175.98 3hxz h PHE 15 N -0.42 0.30 -0.81 0.41 0.04 -1.34 -2.33 116.94 112.79 3hxz h PHE 15 Ca -0.00 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 3hxz h PHE 15 Cb 0.39 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.45 3hxz h PHE 15 CO -0.14 0.74 0.48 1.25 -0.60 0.00 0.00 178.31 180.03 3hxz h HIS 16 N 0.19 1.08 0.00 -0.55 2.76 -0.98 -0.04 115.15 117.61 3hxz h HIS 16 Ca 0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 3hxz h HIS 16 Cb 1.03 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.63 3hxz h HIS 16 CO 0.02 0.74 0.00 0.66 -1.30 0.00 0.00 177.93 178.04 3hxz h SER 17 N 1.12 0.00 -0.67 3.26 4.64 -0.74 -1.64 113.55 119.52 3hxz h SER 17 Ca 0.29 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.41 3hxz h SER 17 Cb -0.02 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 61.95 3hxz h SER 17 CO -0.05 0.00 0.25 0.29 -0.87 0.00 0.00 176.83 176.45 3hxz n LYS 18 N -2.98 3.47 -0.92 4.77 4.76 -0.44 -4.91 118.16 121.91 3hxz n LYS 18 Ca -0.00 -2.74 0.00 0.00 -2.87 0.00 0.00 58.31 52.70 3hxz n LYS 18 Cb 0.22 -2.12 0.00 0.00 -1.84 0.00 0.00 35.03 31.29 3hxz n LYS 18 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hxz n GLY 19 N -0.09 0.53 3.72 0.72 0.00 -0.62 -5.02 105.19 104.43 3hxz n GLY 19 Ca 0.37 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.94 3hxz n GLY 19 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hxz s HIS 20 N -2.00 3.59 -0.00 1.61 3.76 -0.16 -4.81 115.29 117.28 3hxz s HIS 20 Ca 0.00 1.31 -0.30 0.00 -0.15 0.00 0.00 55.06 55.91 3hxz s HIS 20 Cb 0.00 -2.84 -0.07 0.00 1.11 0.00 0.00 32.58 30.78 3hxz s HIS 20 CO 0.00 0.08 1.62 -1.14 -0.85 0.00 0.00 174.74 174.46 3hxz s GLN 21 N 0.80 4.20 -0.23 1.40 2.00 -0.51 -4.05 119.66 123.27 3hxz s GLN 21 Ca 0.39 2.21 -0.29 0.00 -2.00 0.00 0.00 55.36 55.68 3hxz s GLN 21 Cb -0.18 -3.80 -0.00 0.00 0.80 0.00 0.00 33.01 29.82 3hxz s GLN 21 CO 0.19 -0.77 1.24 0.08 -0.50 0.00 0.00 175.29 175.53 3hxz s VAL 22 N 3.34 4.29 -0.06 1.34 1.01 -1.26 -1.00 120.40 128.06 3hxz s VAL 22 Ca 0.73 1.52 0.03 0.00 0.00 0.00 0.00 61.98 64.26 3hxz s VAL 22 Cb -0.35 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 3hxz s VAL 22 CO 0.30 -0.29 -0.14 -0.69 0.00 0.00 0.00 175.10 174.29 3hxz s VAL 23 N 3.79 3.11 0.55 2.92 1.01 -0.64 -4.95 120.40 126.19 3hxz s VAL 23 Ca 0.53 -0.70 -0.20 0.00 0.00 0.00 0.00 61.98 61.61 3hxz s VAL 23 Cb -0.18 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.92 3hxz s VAL 23 CO 0.17 0.59 1.17 0.00 0.00 0.00 0.00 175.10 177.03 3hxz s ALA 24 N -0.67 2.67 0.29 5.51 0.00 -1.26 -4.43 121.76 123.87 3hxz s ALA 24 Ca 0.10 0.93 -0.29 0.00 0.00 0.00 0.00 51.96 52.71 3hxz s ALA 24 Cb -0.11 -3.41 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 3hxz s ALA 24 CO 0.01 -0.93 1.12 0.45 0.00 0.00 0.00 175.76 176.40 3hxz n SER 25 N -1.31 1.76 -4.78 0.00 2.88 -1.26 -4.96 113.62 105.96 3hxz n SER 25 Ca 0.12 1.18 -0.29 0.00 -1.33 0.00 0.00 58.87 58.55 3hxz n SER 25 Cb 0.50 -1.34 0.12 0.00 -0.75 0.00 0.00 64.21 62.74 3hxz n SER 25 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3hxz s SER 26 N -0.39 3.93 0.92 -3.46 1.04 -1.26 -5.01 113.70 109.47 3hxz s SER 26 Ca 0.60 0.81 -0.11 0.00 0.48 0.00 0.00 55.95 57.73 3hxz s SER 26 Cb -0.68 -1.30 0.14 0.00 0.10 0.00 0.00 66.02 64.29 3hxz s SER 26 CO 0.59 -2.27 1.09 -0.55 0.98 0.00 0.00 173.24 173.08 3hxz s SER 27 N -4.37 3.15 0.07 7.02 0.15 -1.26 -4.67 113.70 113.80 3hxz s SER 27 Ca 0.64 1.64 0.26 0.00 0.70 0.00 0.00 55.95 59.18 3hxz s SER 27 Cb -0.12 -2.29 1.02 0.00 -1.71 0.00 0.00 66.02 62.92 3hxz s SER 27 CO 0.51 -2.86 1.80 0.18 1.20 0.00 0.00 173.24 174.07 3hxz n LEU 28 N -4.04 0.25 -4.07 3.45 4.77 -1.26 -4.69 117.00 111.41 3hxz n LEU 28 Ca 0.07 0.53 -0.32 0.00 -0.03 0.00 0.00 56.01 56.27 3hxz n LEU 28 Cb 0.54 -0.46 -0.15 0.00 -2.33 0.00 0.00 43.42 41.02 3hxz n LEU 28 CO 0.55 -0.13 -0.48 -0.69 -1.33 0.00 0.00 177.39 175.31 3hxz s VAL 29 N -3.05 2.05 0.45 4.08 1.01 -1.26 -0.69 120.40 122.99 3hxz s VAL 29 Ca 0.11 -1.36 -0.23 0.00 0.00 0.00 0.00 61.98 60.51 3hxz s VAL 29 Cb 0.15 -2.08 -0.08 0.00 0.00 0.00 0.00 36.38 34.37 3hxz s VAL 29 CO 0.49 0.15 1.11 -2.16 0.00 0.00 0.00 175.10 174.68 3hxz s PRO 30 N 1.20 3.87 -0.10 2.72 0.04 -1.26 -4.96 135.00 136.50 3hxz s PRO 30 Ca -0.04 1.62 0.16 0.00 0.04 0.00 0.00 61.00 62.77 3hxz s PRO 30 Cb -0.18 -2.38 -0.23 0.00 0.04 0.00 0.00 34.50 31.75 3hxz s PRO 30 CO -0.08 -0.42 0.40 1.58 0.04 0.00 0.00 177.00 178.52 3hxz n HIS 31 N -0.48 0.49 -2.02 0.56 -0.00 -1.26 -4.64 115.22 107.88 3hxz n HIS 31 Ca 0.07 0.17 -0.03 0.00 0.46 0.00 0.00 57.72 58.39 3hxz n HIS 31 Cb 0.49 -1.05 0.11 0.00 -0.12 0.00 0.00 29.99 29.42 3hxz n HIS 31 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 3hxz n ASN 32 N -2.85 2.44 -3.54 0.26 3.02 -1.26 -4.92 115.26 108.41 3hxz n ASN 32 Ca -0.23 -3.30 -0.29 0.00 -0.03 0.00 0.00 54.58 50.73 3hxz n ASN 32 Cb 1.05 -0.43 -0.14 0.00 -0.61 0.00 0.00 39.78 39.65 3hxz n ASN 32 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hxz s ASP 33 N -3.18 3.41 0.40 6.41 -1.08 -1.26 -5.00 116.67 116.37 3hxz s ASP 33 Ca 0.40 -1.66 0.29 0.00 -0.52 0.00 0.00 52.55 51.05 3hxz s ASP 33 Cb 0.38 -0.44 1.26 0.00 -1.46 0.00 0.00 42.92 42.66 3hxz s ASP 33 CO -0.06 -0.39 1.86 -0.65 0.52 0.00 0.00 175.17 176.45 3hxz h PRO 34 N 7.87 0.00 -0.00 4.34 0.11 -1.95 -2.72 132.00 139.64 3hxz h PRO 34 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 3hxz h PRO 34 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3hxz h PRO 34 CO 0.39 0.00 -0.13 0.25 -0.21 0.00 0.00 178.00 178.29 3hxz n THR 35 N -2.61 0.00 -4.10 -1.15 -2.24 -1.26 -4.85 114.28 98.08 3hxz n THR 35 Ca 0.01 -0.07 -0.33 0.00 -2.27 0.00 0.00 64.05 61.39 3hxz n THR 35 Cb 0.22 -0.03 -0.16 0.00 -2.10 0.00 0.00 70.33 68.27 3hxz n THR 35 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3hxz s LEU 36 N -2.49 2.47 0.00 3.22 2.96 -1.03 -5.01 118.68 118.79 3hxz s LEU 36 Ca 0.28 -0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 53.35 3hxz s LEU 36 Cb 0.20 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.36 3hxz s LEU 36 CO 0.48 -0.05 0.68 0.25 -1.32 0.00 0.00 176.35 176.40 3hxz h LEU 37 N 7.91 -0.10 -8.63 -0.68 5.85 -1.88 -3.45 115.31 114.33 3hxz h LEU 37 Ca -0.40 0.00 -0.42 0.00 0.84 0.00 0.00 57.88 57.91 3hxz h LEU 37 Cb 1.12 0.03 -0.18 0.00 0.37 0.00 0.00 40.66 42.00 3hxz h LEU 37 CO 0.60 -0.05 -0.76 -0.36 -0.34 0.00 0.00 178.44 177.54 3hxz s PHE 38 N -2.54 1.44 -0.10 1.25 0.08 -1.26 -4.71 117.98 112.13 3hxz s PHE 38 Ca -0.02 -0.56 -0.34 0.00 0.12 0.00 0.00 56.93 56.13 3hxz s PHE 38 Cb 0.00 -0.74 -0.11 0.00 -0.57 0.00 0.00 43.02 41.59 3hxz s PHE 38 CO 0.05 0.16 1.90 2.41 -0.10 0.00 0.00 175.22 179.65 3hxz n THR 39 N 0.44 0.58 0.13 0.64 -1.04 0.13 -4.84 114.28 110.32 3hxz n THR 39 Ca -0.15 -0.12 0.02 0.00 -2.04 0.00 0.00 64.05 61.77 3hxz n THR 39 Cb 0.57 -1.91 0.02 0.00 -1.82 0.00 0.00 70.33 67.20 3hxz n THR 39 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3hxz n ASN 40 N 6.89 1.49 -3.49 8.00 0.23 -1.26 -1.00 115.26 126.12 3hxz n ASN 40 Ca 0.23 -1.30 -0.15 0.00 -0.53 0.00 0.00 54.58 52.84 3hxz n ASN 40 Cb 0.30 -0.01 -0.04 0.00 -2.08 0.00 0.00 39.78 37.94 3hxz n ASN 40 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hxz s ALA 41 N -0.43 -1.72 0.53 -2.53 0.00 -1.26 -4.86 121.76 111.47 3hxz s ALA 41 Ca 0.05 1.03 0.22 0.00 0.00 0.00 0.00 51.96 53.26 3hxz s ALA 41 Cb 0.03 0.29 1.35 0.00 0.00 0.00 0.00 23.12 24.80 3hxz s ALA 41 CO 0.05 -0.52 2.05 0.78 0.00 0.00 0.00 175.76 178.12 3hxz h GLY 42 N 2.57 0.00 2.00 0.00 0.00 -1.90 -2.56 103.07 103.18 3hxz h GLY 42 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 3hxz h GLY 42 CO 0.38 0.00 0.00 1.15 0.00 0.00 0.00 176.54 178.07 3hxz n MET 43 N -4.43 0.16 -0.20 4.80 0.00 -1.26 -4.04 117.12 112.14 3hxz n MET 43 Ca 0.05 0.25 0.01 0.00 0.00 0.00 0.00 57.70 58.01 3hxz n MET 43 Cb 0.42 -1.73 0.11 0.00 0.00 0.00 0.00 33.22 32.03 3hxz n MET 43 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 3hxz h ASN 44 N 0.00 0.02 0.54 3.17 -0.26 -1.87 0.01 115.58 117.19 3hxz h ASN 44 Ca 0.00 0.11 0.00 0.00 -0.56 0.00 0.00 56.30 55.85 3hxz h ASN 44 Cb 0.50 0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.91 3hxz h ASN 44 CO 0.00 0.01 0.00 0.00 -1.06 0.00 0.00 177.43 176.38 3hxz n GLN 45 N -5.12 0.16 -0.17 0.81 10.64 -1.26 -2.20 117.38 120.24 3hxz n GLN 45 Ca 0.09 0.11 0.05 0.00 -1.83 0.00 0.00 57.00 55.43 3hxz n GLN 45 Cb 0.33 -1.50 0.15 0.00 -0.86 0.00 0.00 30.24 28.36 3hxz n GLN 45 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3hxz n PHE 46 N -1.39 0.45 -0.14 2.61 3.72 -0.07 -4.75 117.46 117.89 3hxz n PHE 46 Ca 0.08 -0.50 -0.04 0.00 -0.05 0.00 0.00 57.45 56.93 3hxz n PHE 46 Cb 0.20 -0.03 0.02 0.00 -0.94 0.00 0.00 39.48 38.74 3hxz n PHE 46 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 3hxz h LYS 47 N 1.95 -0.01 0.00 -1.08 3.64 -0.90 0.13 116.57 120.30 3hxz h LYS 47 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3hxz h LYS 47 Cb 0.73 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3hxz h LYS 47 CO 0.00 -0.01 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.63 3hxz h ASP 48 N -0.01 0.00 -0.12 4.20 3.32 -1.85 -1.66 116.42 120.30 3hxz h ASP 48 Ca 0.22 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.22 3hxz h ASP 48 Cb 0.34 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 3hxz h ASP 48 CO -0.47 0.10 -0.12 0.58 -1.72 0.00 0.00 179.24 177.61 3hxz h VAL 49 N 0.00 1.35 -0.42 -1.35 2.07 -1.15 0.14 116.25 116.89 3hxz h VAL 49 Ca -0.00 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3hxz h VAL 49 Cb 0.54 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 3hxz h VAL 49 CO 0.01 0.37 0.28 -0.26 0.02 0.00 0.00 177.57 177.99 3hxz h PHE 50 N -0.10 0.53 0.00 1.57 0.04 -0.88 -1.24 116.94 116.86 3hxz h PHE 50 Ca 0.02 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.80 3hxz h PHE 50 Cb 0.64 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.61 3hxz h PHE 50 CO 0.09 0.34 0.00 1.28 -0.60 0.00 0.00 178.31 179.41 3hxz n LEU 51 N -4.47 0.38 0.00 1.54 4.77 -0.66 -4.60 117.00 113.96 3hxz n LEU 51 Ca 0.03 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 3hxz n LEU 51 Cb 0.06 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 3hxz n LEU 51 CO 0.35 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3hxz n GLY 52 N 0.97 0.45 0.08 -0.72 0.00 -0.47 -4.68 105.19 100.83 3hxz n GLY 52 Ca 0.05 -0.55 0.02 0.00 0.00 0.00 0.00 46.02 45.55 3hxz n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hxz n LEU 53 N 0.00 0.55 -4.17 0.99 4.77 0.37 -4.87 117.00 114.64 3hxz n LEU 53 Ca 0.00 0.23 -0.32 0.00 -0.03 0.00 0.00 56.01 55.89 3hxz n LEU 53 Cb 0.00 0.11 -0.17 0.00 -2.33 0.00 0.00 43.42 41.03 3hxz n LEU 53 CO 0.00 0.12 -0.54 -0.62 -1.33 0.00 0.00 177.39 175.02 3hxz s ASP 54 N -5.41 3.08 -0.07 -1.43 -1.08 -0.49 -4.97 116.67 106.29 3hxz s ASP 54 Ca -0.05 -0.59 -0.01 0.00 -0.52 0.00 0.00 52.55 51.38 3hxz s ASP 54 Cb 0.09 -1.43 -0.03 0.00 -1.46 0.00 0.00 42.92 40.10 3hxz s ASP 54 CO 0.83 0.08 -0.02 -0.54 0.52 0.00 0.00 175.17 176.05 3hxz s LYS 55 N 0.79 2.89 0.28 4.34 1.02 -1.26 -4.06 119.74 123.74 3hxz s LYS 55 Ca -0.08 -0.47 0.12 0.00 0.02 0.00 0.00 55.97 55.56 3hxz s LYS 55 Cb -0.16 -2.73 -0.05 0.00 -0.52 0.00 0.00 37.83 34.38 3hxz s LYS 55 CO -0.01 0.68 -0.16 1.03 -0.92 0.00 0.00 175.35 175.97 3hxz s ARG 56 N -0.97 1.80 0.00 1.68 1.81 -1.26 -5.02 118.95 116.99 3hxz s ARG 56 Ca 0.14 -1.70 0.24 0.00 -1.72 0.00 0.00 55.73 52.69 3hxz s ARG 56 Cb -0.11 -1.84 1.19 0.00 -0.45 0.00 0.00 34.95 33.73 3hxz s ARG 56 CO 0.03 0.34 1.81 0.09 -0.68 0.00 0.00 175.30 176.88 3hxz n ASN 57 N -0.67 0.00 -4.40 0.23 3.02 -1.26 -4.75 115.26 107.43 3hxz n ASN 57 Ca -0.05 0.08 -0.27 0.00 -0.03 0.00 0.00 54.58 54.30 3hxz n ASN 57 Cb 0.60 -0.34 -0.12 0.00 -0.61 0.00 0.00 39.78 39.31 3hxz n ASN 57 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 3hxz s TYR 58 N -2.68 2.26 -1.18 3.10 -0.85 -1.26 -5.04 117.35 111.71 3hxz s TYR 58 Ca 0.20 -0.38 0.10 0.00 -0.52 0.00 0.00 57.07 56.47 3hxz s TYR 58 Cb 0.16 -1.17 0.09 0.00 0.38 0.00 0.00 41.96 41.43 3hxz s TYR 58 CO 0.39 0.41 0.84 -1.13 -1.52 0.00 0.00 175.55 174.54 3hxz n SER 59 N 0.59 1.89 -3.80 -0.18 3.41 -1.26 -4.95 113.62 109.32 3hxz n SER 59 Ca -0.15 -1.45 -0.13 0.00 -0.26 0.00 0.00 58.87 56.88 3hxz n SER 59 Cb 0.55 -0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.37 3hxz n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hxz s ARG 60 N -0.82 0.31 0.14 4.33 1.70 -1.26 -0.53 118.95 122.83 3hxz s ARG 60 Ca 0.12 0.24 -0.08 0.00 -0.47 0.00 0.00 55.73 55.55 3hxz s ARG 60 Cb 0.08 0.15 -0.01 0.00 -0.57 0.00 0.00 34.95 34.60 3hxz s ARG 60 CO 0.12 -0.05 0.23 0.00 -1.08 0.00 0.00 175.30 174.52 3hxz s ALA 61 N -0.07 0.10 -0.07 7.88 0.00 -0.50 -1.43 121.76 127.68 3hxz s ALA 61 Ca -0.02 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 50.96 3hxz s ALA 61 Cb -0.02 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.90 3hxz s ALA 61 CO 0.01 -0.59 0.17 -0.08 0.00 0.00 0.00 175.76 175.26 3hxz s THR 62 N -3.96 -0.01 0.06 0.00 -1.32 -0.18 -0.17 115.64 110.06 3hxz s THR 62 Ca 0.16 0.04 -0.04 0.00 -1.21 0.00 0.00 61.69 60.64 3hxz s THR 62 Cb 0.04 -0.25 -0.02 0.00 -1.51 0.00 0.00 72.50 70.76 3hxz s THR 62 CO -0.02 0.02 0.06 0.42 -2.21 0.00 0.00 174.62 172.88 3hxz s THR 63 N 0.34 0.17 -0.40 5.08 -4.23 -0.75 -1.61 115.64 114.24 3hxz s THR 63 Ca -0.02 -1.43 -0.03 0.00 -1.18 0.00 0.00 61.69 59.02 3hxz s THR 63 Cb -0.03 -1.26 0.10 0.00 1.34 0.00 0.00 72.50 72.65 3hxz s THR 63 CO -0.01 -0.79 0.20 -0.55 -0.54 0.00 0.00 174.62 172.92 3hxz s SER 64 N -2.64 5.27 -0.22 3.99 0.15 -1.26 -0.92 113.70 118.07 3hxz s SER 64 Ca 0.02 -1.92 -0.12 0.00 0.70 0.00 0.00 55.95 54.63 3hxz s SER 64 Cb 0.04 -1.84 -0.05 0.00 -1.71 0.00 0.00 66.02 62.47 3hxz s SER 64 CO -0.08 -0.52 0.22 -1.58 1.20 0.00 0.00 173.24 172.47 3hxz s GLN 65 N 1.18 4.13 0.07 5.44 2.00 -0.08 -4.27 119.66 128.13 3hxz s GLN 65 Ca 0.07 -0.12 -0.31 0.00 -2.00 0.00 0.00 55.36 53.00 3hxz s GLN 65 Cb -0.23 -3.51 -0.06 0.00 0.80 0.00 0.00 33.01 30.01 3hxz s GLN 65 CO -0.03 0.09 1.25 -0.98 -0.50 0.00 0.00 175.29 175.11 3hxz s ARG 66 N 0.97 4.40 0.07 1.67 1.70 -1.26 -0.87 118.95 125.63 3hxz s ARG 66 Ca 0.11 1.85 0.06 0.00 -0.47 0.00 0.00 55.73 57.28 3hxz s ARG 66 Cb -0.13 -3.32 -0.03 0.00 -0.57 0.00 0.00 34.95 30.90 3hxz s ARG 66 CO 0.04 -0.31 -0.18 0.00 -1.08 0.00 0.00 175.30 173.78 3hxz s VAL 68 N -1.03 1.46 -0.64 0.00 1.01 -0.17 -1.33 120.40 119.71 3hxz s VAL 68 Ca 0.03 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3hxz s VAL 68 Cb -0.09 -1.35 0.16 0.00 0.00 0.00 0.00 36.38 35.10 3hxz s VAL 68 CO 0.02 0.44 0.43 -0.13 0.00 0.00 0.00 175.10 175.86 3hxz s ARG 69 N 1.13 2.43 0.00 2.72 0.52 0.09 -4.32 118.95 121.52 3hxz s ARG 69 Ca -0.04 -2.82 0.05 0.00 -0.52 0.00 0.00 55.73 52.41 3hxz s ARG 69 Cb -0.14 -3.55 0.08 0.00 0.52 0.00 0.00 34.95 31.85 3hxz s ARG 69 CO -0.04 -1.18 1.03 0.00 0.02 0.00 0.00 175.30 175.13 3hxz n ALA 70 N 2.91 2.07 0.00 2.13 0.00 -1.24 -0.74 120.51 125.64 3hxz n ALA 70 Ca 0.11 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.31 3hxz n ALA 70 Cb 0.35 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.26 3hxz n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hxz n GLY 71 N 0.09 1.17 7.00 0.00 0.00 -1.25 -4.89 105.19 107.31 3hxz n GLY 71 Ca 0.01 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.06 3hxz n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hxz n GLY 72 N -0.50 0.64 0.25 -0.02 0.00 -1.26 -3.90 105.19 100.40 3hxz n GLY 72 Ca 0.00 -0.85 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 3hxz n GLY 72 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3hxz h LYS 73 N 0.00 0.84 -4.80 1.61 1.63 -1.95 -3.39 116.57 110.50 3hxz h LYS 73 Ca 0.00 -0.15 -0.67 0.00 -0.85 0.00 0.00 60.65 58.97 3hxz h LYS 73 Cb 0.00 -0.13 -0.36 0.00 -0.60 0.00 0.00 32.23 31.13 3hxz h LYS 73 CO 0.00 0.73 -0.75 -1.01 -3.45 0.00 0.00 179.45 174.97 3hxz s HIS 74 N -5.54 3.36 -0.19 1.91 3.76 -1.25 -5.07 115.29 112.26 3hxz s HIS 74 Ca -0.13 -2.33 -0.02 0.00 -0.15 0.00 0.00 55.06 52.44 3hxz s HIS 74 Cb 0.12 -2.18 0.06 0.00 1.11 0.00 0.00 32.58 31.69 3hxz s HIS 74 CO 0.79 -0.88 0.01 1.21 -0.85 0.00 0.00 174.74 175.02 3hxz s ASN 75 N 1.14 2.99 -0.01 1.40 3.84 -1.26 -3.62 114.94 119.42 3hxz s ASN 75 Ca -0.04 -0.82 0.09 0.00 0.21 0.00 0.00 52.86 52.30 3hxz s ASN 75 Cb -0.20 -0.73 0.27 0.00 -0.55 0.00 0.00 41.25 40.05 3hxz s ASN 75 CO -0.04 -0.27 1.22 0.47 -2.79 0.00 0.00 177.10 175.69 3hxz n ASP 76 N 4.97 2.84 -0.22 -4.21 8.00 0.08 -4.74 116.55 123.27 3hxz n ASP 76 Ca -0.10 -2.08 0.02 0.00 0.71 0.00 0.00 54.79 53.34 3hxz n ASP 76 Cb 0.47 -0.22 0.12 0.00 -0.02 0.00 0.00 41.12 41.47 3hxz n ASP 76 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3hxz h LEU 77 N 1.67 -0.23 0.00 0.64 5.85 -1.86 -0.64 115.31 120.74 3hxz h LEU 77 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3hxz h LEU 77 Cb 0.74 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.04 3hxz h LEU 77 CO 0.01 -0.10 0.00 -0.62 -0.34 0.00 0.00 178.44 177.39 3hxz n GLU 78 N -5.26 0.19 0.13 1.25 -0.58 -1.26 -2.40 120.64 112.72 3hxz n GLU 78 Ca 0.10 0.07 0.08 0.00 -0.42 0.00 0.00 57.16 56.99 3hxz n GLU 78 Cb 0.38 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.79 3hxz n GLU 78 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 3hxz h ASN 79 N 0.00 0.00 -2.81 1.62 2.35 -1.46 -3.45 115.58 111.83 3hxz h ASN 79 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 3hxz h ASN 79 Cb 0.32 0.00 0.04 0.00 0.05 0.00 0.00 38.32 38.73 3hxz h ASN 79 CO 0.00 0.19 0.89 -0.69 -1.65 0.00 0.00 177.43 176.18 3hxz s VAL 80 N -3.17 2.61 0.00 2.81 1.01 -1.01 -1.44 120.40 121.22 3hxz s VAL 80 Ca 0.02 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.43 3hxz s VAL 80 Cb 0.08 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.18 3hxz s VAL 80 CO 0.75 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.49 3hxz n GLY 81 N 3.78 2.47 0.01 4.51 0.00 -1.26 -4.82 105.19 109.87 3hxz n GLY 81 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 3hxz n GLY 81 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hxz n TYR 82 N -2.00 0.00 -4.33 1.61 4.01 -0.52 -4.95 117.16 110.98 3hxz n TYR 82 Ca 0.00 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.57 3hxz n TYR 82 Cb 0.00 -0.27 -0.10 0.00 -0.31 0.00 0.00 39.34 38.66 3hxz n TYR 82 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3hxz s THR 83 N -3.00 1.00 -2.45 -0.72 -4.23 -1.08 -5.04 115.64 100.13 3hxz s THR 83 Ca -0.02 -2.03 0.25 0.00 -1.18 0.00 0.00 61.69 58.71 3hxz s THR 83 Cb 0.12 -2.37 0.48 0.00 1.34 0.00 0.00 72.50 72.07 3hxz s THR 83 CO 0.71 -0.30 1.62 0.00 -0.54 0.00 0.00 174.62 176.10 3hxz n ALA 84 N -0.42 2.54 -0.04 3.99 0.00 -1.26 -4.32 120.51 121.00 3hxz n ALA 84 Ca -0.05 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.87 3hxz n ALA 84 Cb 0.64 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 19.00 3hxz n ALA 84 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 3hxz n ARG 85 N 0.39 4.38 -4.12 0.00 1.85 -1.26 -1.34 116.66 116.55 3hxz n ARG 85 Ca 0.18 -0.05 -0.34 0.00 -1.00 0.00 0.00 57.85 56.63 3hxz n ARG 85 Cb 0.38 -0.45 -0.10 0.00 -1.05 0.00 0.00 32.46 31.24 3hxz n ARG 85 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 3hxz s HIS 86 N -0.64 3.19 0.27 2.89 3.76 -1.26 -4.99 115.29 118.51 3hxz s HIS 86 Ca 0.00 -0.02 0.07 0.00 -0.15 0.00 0.00 55.06 54.96 3hxz s HIS 86 Cb 0.00 -2.04 -0.06 0.00 1.11 0.00 0.00 32.58 31.60 3hxz s HIS 86 CO 0.00 0.12 -0.07 -1.01 -0.85 0.00 0.00 174.74 172.93 3hxz s HIS 87 N 0.31 1.92 -0.13 1.40 3.76 -1.26 -4.50 115.29 116.80 3hxz s HIS 87 Ca 0.01 -0.68 -0.22 0.00 -0.15 0.00 0.00 55.06 54.03 3hxz s HIS 87 Cb -0.13 -1.07 -0.20 0.00 1.11 0.00 0.00 32.58 32.30 3hxz s HIS 87 CO 0.01 0.30 0.58 1.79 -0.85 0.00 0.00 174.74 176.57 3hxz h THR 88 N 2.32 1.35 -3.22 1.30 1.35 -1.86 -3.44 112.91 110.72 3hxz h THR 88 Ca -0.40 -2.01 -0.60 0.00 -0.55 0.00 0.00 66.41 62.85 3hxz h THR 88 Cb 1.23 2.55 -0.11 0.00 -1.73 0.00 0.00 68.15 70.09 3hxz h THR 88 CO 0.66 0.46 -0.44 0.12 -0.25 0.00 0.00 175.52 176.07 3hxz s PHE 89 N -2.07 3.44 0.24 4.73 5.36 -1.26 -0.73 117.98 127.69 3hxz s PHE 89 Ca -0.14 0.43 -0.18 0.00 -0.96 0.00 0.00 56.93 56.07 3hxz s PHE 89 Cb -0.02 -2.19 0.02 0.00 -0.34 0.00 0.00 43.02 40.49 3hxz s PHE 89 CO 0.52 0.32 0.60 -0.59 -1.46 0.00 0.00 175.22 174.61 3hxz s PHE 90 N 0.25 -0.07 -0.11 10.12 -0.12 -0.44 -4.90 117.98 122.70 3hxz s PHE 90 Ca 0.11 -0.31 -0.02 0.00 -0.05 0.00 0.00 56.93 56.65 3hxz s PHE 90 Cb -0.12 0.49 -0.03 0.00 -0.63 0.00 0.00 43.02 42.73 3hxz s PHE 90 CO 0.00 -1.06 -0.03 -1.21 -0.05 0.00 0.00 175.22 172.88 3hxz s GLU 91 N -3.92 3.24 -0.24 1.99 2.02 -1.26 -0.11 118.70 120.43 3hxz s GLU 91 Ca 0.12 -0.48 -0.10 0.00 0.02 0.00 0.00 54.97 54.53 3hxz s GLU 91 Cb -0.03 -2.81 -0.05 0.00 0.10 0.00 0.00 34.13 31.34 3hxz s GLU 91 CO 0.03 0.50 0.14 -1.64 0.02 0.00 0.00 175.26 174.31 3hxz s MET 92 N -0.33 4.03 -0.42 1.61 -1.94 -0.05 -1.70 119.30 120.49 3hxz s MET 92 Ca 0.06 -0.29 -0.22 0.00 -1.71 0.00 0.00 55.69 53.52 3hxz s MET 92 Cb -0.12 -3.49 0.02 0.00 2.01 0.00 0.00 34.83 33.25 3hxz s MET 92 CO 0.02 0.06 0.75 -0.51 -0.01 0.00 0.00 175.02 175.33 3hxz s LEU 93 N 1.04 4.27 0.07 -0.03 1.43 0.59 -0.90 118.68 125.16 3hxz s LEU 93 Ca 0.07 -0.04 0.08 0.00 -1.03 0.00 0.00 54.13 53.21 3hxz s LEU 93 Cb -0.14 -2.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 3hxz s LEU 93 CO 0.04 -0.83 -0.22 -0.83 0.23 0.00 0.00 176.35 174.75 3hxz s GLY 94 N 2.03 1.22 0.11 -3.19 0.00 -0.10 -0.16 107.32 107.22 3hxz s GLY 94 Ca 0.28 -1.17 0.10 0.00 0.00 0.00 0.00 44.72 43.93 3hxz s GLY 94 CO 0.20 -1.13 -0.24 0.54 0.00 0.00 0.00 173.10 172.47 3hxz s ASN 95 N -1.50 2.98 -0.02 1.64 4.22 -1.24 -1.80 114.94 119.22 3hxz s ASN 95 Ca 0.08 -0.70 0.01 0.00 -2.14 0.00 0.00 52.86 50.11 3hxz s ASN 95 Cb -0.09 -0.20 0.01 0.00 1.28 0.00 0.00 41.25 42.25 3hxz s ASN 95 CO 0.03 0.15 -0.03 -0.36 -2.04 0.00 0.00 177.10 174.84 3hxz s PHE 96 N -1.05 0.43 -0.23 1.54 0.08 0.76 -1.90 117.98 117.61 3hxz s PHE 96 Ca 0.11 -0.08 0.00 0.00 0.12 0.00 0.00 56.93 57.08 3hxz s PHE 96 Cb -0.10 -0.36 0.03 0.00 -0.57 0.00 0.00 43.02 42.03 3hxz s PHE 96 CO 0.05 -0.06 -0.12 0.45 -0.10 0.00 0.00 175.22 175.43 3hxz s SER 97 N 0.32 3.93 -1.09 1.36 0.15 -0.38 -1.41 113.70 116.58 3hxz s SER 97 Ca -0.03 -0.91 -0.10 0.00 0.70 0.00 0.00 55.95 55.60 3hxz s SER 97 Cb -0.07 -1.57 0.26 0.00 -1.71 0.00 0.00 66.02 62.93 3hxz s SER 97 CO -0.00 -0.09 1.12 -0.36 1.20 0.00 0.00 173.24 175.10 3hxz s PHE 98 N 1.26 4.10 -1.31 3.44 0.40 0.32 -1.35 117.98 124.84 3hxz s PHE 98 Ca -0.00 -2.52 -0.02 0.00 -0.60 0.00 0.00 56.93 53.78 3hxz s PHE 98 Cb -0.16 -3.91 0.00 0.00 0.51 0.00 0.00 43.02 39.46 3hxz s PHE 98 CO -0.08 -1.02 0.24 0.41 0.70 0.00 0.00 175.22 175.47 3hxz n GLY 99 N 3.07 -0.28 0.00 4.36 0.00 -1.26 -4.84 105.19 106.24 3hxz n GLY 99 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3hxz n GLY 99 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3hxz n ASP 100 N -1.36 0.00 -4.97 1.61 -0.08 -1.26 -5.07 116.55 105.43 3hxz n ASP 100 Ca -0.14 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 52.92 3hxz n ASP 100 Cb 0.62 0.00 0.01 0.00 2.34 0.00 0.00 41.12 44.09 3hxz n ASP 100 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 3hxz s TYR 101 N 0.62 3.11 0.00 -0.67 -0.85 -1.26 -5.12 117.35 113.18 3hxz s TYR 101 Ca 0.00 0.07 0.00 0.00 -0.52 0.00 0.00 57.07 56.62 3hxz s TYR 101 Cb 0.00 -2.35 0.00 0.00 0.38 0.00 0.00 41.96 39.99 3hxz s TYR 101 CO 0.00 -0.40 0.00 0.34 -1.52 0.00 0.00 175.55 173.97 3hxz n PHE 102 N -2.04 0.00 0.26 -3.49 7.35 -1.26 -4.61 117.46 113.66 3hxz n PHE 102 Ca 0.03 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.56 3hxz n PHE 102 Cb 0.58 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.33 3hxz n PHE 102 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 3hxz h LYS 103 N 0.00 -0.72 0.03 -4.13 1.57 -1.99 -1.98 116.57 109.35 3hxz h LYS 103 Ca 0.00 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3hxz h LYS 103 Cb 0.00 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3hxz h LYS 103 CO 0.00 -0.48 -0.01 1.25 -0.57 0.00 0.00 179.45 179.64 3hxz h LEU 104 N -0.74 -0.03 -1.04 2.94 5.85 -1.97 -2.25 115.31 118.07 3hxz h LEU 104 Ca -0.04 -0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.54 3hxz h LEU 104 Cb 0.63 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 3hxz h LEU 104 CO 0.01 0.02 -0.44 0.44 -0.34 0.00 0.00 178.44 178.14 3hxz h ASP 105 N -0.08 0.10 -0.21 1.25 3.32 -1.96 -0.51 116.42 118.33 3hxz h ASP 105 Ca -0.00 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 3hxz h ASP 105 Cb 0.07 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 3hxz h ASP 105 CO 0.01 0.52 0.11 0.00 -1.72 0.00 0.00 179.24 178.16 3hxz h ALA 106 N 1.48 0.27 -0.47 3.45 0.00 -1.19 -0.67 119.26 122.13 3hxz h ALA 106 Ca 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3hxz h ALA 106 Cb 0.81 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3hxz h ALA 106 CO 0.06 -0.19 0.13 0.82 0.00 0.00 0.00 179.25 180.08 3hxz h ILE 107 N 0.22 1.23 -0.40 0.00 2.04 -1.14 -2.60 117.51 116.86 3hxz h ILE 107 Ca 0.07 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 3hxz h ILE 107 Cb 0.09 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3hxz h ILE 107 CO -0.01 0.29 0.19 -0.07 0.00 0.00 0.00 178.15 178.55 3hxz h LEU 108 N 0.64 0.51 -0.38 1.44 3.38 -0.97 -0.89 115.31 119.04 3hxz h LEU 108 Ca 0.15 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.07 3hxz h LEU 108 Cb 0.30 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 3hxz h LEU 108 CO -0.00 0.49 0.03 -0.26 0.09 0.00 0.00 178.44 178.79 3hxz h PHE 109 N 0.50 0.03 -0.06 1.13 0.05 -1.07 -0.17 116.94 117.35 3hxz h PHE 109 Ca 0.14 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.95 3hxz h PHE 109 Cb 0.11 0.04 -0.00 0.00 2.00 0.00 0.00 35.95 38.10 3hxz h PHE 109 CO -0.01 -0.04 0.02 0.00 -0.18 0.00 0.00 178.31 178.09 3hxz h ALA 110 N 1.32 0.08 -0.87 2.45 0.00 -1.23 -1.96 119.26 119.05 3hxz h ALA 110 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hxz h ALA 110 Cb 0.25 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3hxz h ALA 110 CO -0.29 -0.32 0.55 2.35 0.00 0.00 0.00 179.25 181.55 3hxz h TRP 111 N -0.09 1.12 0.05 0.00 2.91 -1.03 -1.62 115.95 117.30 3hxz h TRP 111 Ca 0.02 0.01 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 3hxz h TRP 111 Cb 0.20 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 28.48 3hxz h TRP 111 CO -0.01 0.73 -0.03 1.25 -1.03 0.00 0.00 178.44 179.35 3hxz h LEU 112 N 1.19 -0.06 -0.58 0.65 5.85 -0.89 -0.17 115.31 121.30 3hxz h LEU 112 Ca 0.32 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 59.00 3hxz h LEU 112 Cb -0.09 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 3hxz h LEU 112 CO -0.06 0.01 0.37 0.25 -0.34 0.00 0.00 178.44 178.67 3hxz h LEU 113 N -0.13 0.62 -0.33 2.25 5.85 -1.19 -1.12 115.31 121.26 3hxz h LEU 113 Ca -0.01 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.57 3hxz h LEU 113 Cb 0.11 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3hxz h LEU 113 CO 0.01 0.44 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.16 3hxz h LEU 114 N 0.74 0.86 0.00 2.25 3.38 -1.12 -0.44 115.31 120.97 3hxz h LEU 114 Ca 0.22 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3hxz h LEU 114 Cb -0.03 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.48 3hxz h LEU 114 CO -0.08 1.15 -0.55 0.35 0.09 0.00 0.00 178.44 179.40 3hxz n THR 115 N -4.18 0.00 -2.09 0.22 -2.24 -0.09 -0.14 114.28 105.75 3hxz n THR 115 Ca -0.03 -0.30 -0.41 0.00 -2.27 0.00 0.00 64.05 61.04 3hxz n THR 115 Cb 0.50 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 3hxz n THR 115 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3hxz s SER 116 N -1.85 6.74 0.60 3.42 0.15 -0.43 -4.25 113.70 118.07 3hxz s SER 116 Ca 0.01 2.69 0.30 0.00 0.70 0.00 0.00 55.95 59.65 3hxz s SER 116 Cb 0.04 -2.64 1.76 0.00 -1.71 0.00 0.00 66.02 63.47 3hxz s SER 116 CO 0.23 -0.57 2.17 1.05 1.20 0.00 0.00 173.24 177.31 3hxz h GLU 117 N 3.70 0.00 0.00 5.44 4.11 -1.93 -0.29 114.58 125.61 3hxz h GLU 117 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3hxz h GLU 117 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3hxz h GLU 117 CO 0.68 0.00 -0.04 0.87 0.07 0.00 0.00 179.01 180.58 3hxz h LYS 118 N 0.00 0.00 0.00 1.06 1.57 -1.92 -3.45 116.57 113.83 3hxz h LYS 118 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3hxz h LYS 118 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3hxz h LYS 118 CO -0.00 0.00 0.00 0.91 -0.57 0.00 0.00 179.45 179.79 3hxz n TRP 119 N -2.39 0.00 0.25 -1.35 7.02 -0.20 -4.99 117.44 115.78 3hxz n TRP 119 Ca 0.05 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.67 3hxz n TRP 119 Cb 0.45 0.00 0.56 0.00 -2.42 0.00 0.00 31.31 29.89 3hxz n TRP 119 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 3hxz h PHE 120 N 0.00 0.00 -6.18 -5.99 0.04 -1.15 -3.47 116.94 100.19 3hxz h PHE 120 Ca 0.00 0.00 -0.47 0.00 2.80 0.00 0.00 57.97 60.30 3hxz h PHE 120 Cb 0.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 3hxz h PHE 120 CO 0.00 0.11 -0.74 0.00 -0.60 0.00 0.00 178.31 177.08 3hxz n ALA 121 N -2.16 -1.25 -1.77 2.45 0.00 -0.72 -4.90 120.51 112.17 3hxz n ALA 121 Ca 0.00 0.19 -0.38 0.00 0.00 0.00 0.00 53.44 53.25 3hxz n ALA 121 Cb 0.37 -4.33 -0.02 0.00 0.00 0.00 0.00 19.45 15.47 3hxz n ALA 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hxz s LEU 122 N -7.21 4.16 -0.10 0.00 1.43 0.80 -4.94 118.68 112.82 3hxz s LEU 122 Ca 0.64 2.36 -0.29 0.00 -1.03 0.00 0.00 54.13 55.80 3hxz s LEU 122 Cb -0.32 -4.06 -0.06 0.00 0.03 0.00 0.00 46.19 41.77 3hxz s LEU 122 CO 0.79 -0.73 2.02 -2.16 0.23 0.00 0.00 176.35 176.50 3hxz s PRO 123 N -2.38 3.68 0.43 1.29 0.04 -1.26 -4.59 135.00 132.21 3hxz s PRO 123 Ca 0.58 2.25 0.13 0.00 0.04 0.00 0.00 61.00 64.00 3hxz s PRO 123 Cb -0.31 -4.23 1.00 0.00 0.04 0.00 0.00 34.50 31.00 3hxz s PRO 123 CO 0.38 -1.47 1.98 0.87 0.04 0.00 0.00 177.00 178.80 3hxz h LYS 124 N 12.44 0.43 0.00 4.56 1.57 -1.92 -2.08 116.57 131.58 3hxz h LYS 124 Ca -0.44 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3hxz h LYS 124 Cb 1.23 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3hxz h LYS 124 CO 0.96 0.29 0.00 1.05 -0.57 0.00 0.00 179.45 181.17 3hxz h GLU 125 N 0.45 0.00 -0.20 3.15 9.09 -2.03 -2.18 114.58 122.85 3hxz h GLU 125 Ca 0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.69 3hxz h GLU 125 Cb 0.50 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.60 3hxz h GLU 125 CO -0.08 0.00 0.00 0.54 0.05 0.00 0.00 179.01 179.52 3hxz n ARG 126 N -2.58 2.20 -3.79 1.06 1.74 -0.78 -4.90 116.66 109.61 3hxz n ARG 126 Ca 0.01 -1.78 -0.35 0.00 -0.77 0.00 0.00 57.85 54.95 3hxz n ARG 126 Cb 0.21 -1.47 -0.09 0.00 -1.02 0.00 0.00 32.46 30.09 3hxz n ARG 126 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hxz s LEU 127 N -1.70 4.09 0.16 0.55 1.43 -0.82 -0.97 118.68 121.43 3hxz s LEU 127 Ca 0.34 0.18 0.10 0.00 -1.03 0.00 0.00 54.13 53.72 3hxz s LEU 127 Cb 0.21 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 3hxz s LEU 127 CO 0.30 0.16 -0.20 0.26 0.23 0.00 0.00 176.35 177.11 3hxz s TRP 128 N 0.45 2.44 0.07 0.29 0.52 -0.05 -4.97 118.94 117.69 3hxz s TRP 128 Ca 0.07 -0.31 0.06 0.00 0.02 0.00 0.00 56.10 55.94 3hxz s TRP 128 Cb -0.12 -1.25 -0.03 0.00 -1.15 0.00 0.00 33.47 30.93 3hxz s TRP 128 CO -0.01 0.45 -0.16 0.14 0.02 0.00 0.00 176.95 177.39 3hxz s VAL 129 N -1.44 1.29 0.08 4.03 -7.23 -0.54 -0.10 120.40 116.49 3hxz s VAL 129 Ca 0.20 -1.29 0.09 0.00 -1.81 0.00 0.00 61.98 59.17 3hxz s VAL 129 Cb -0.09 -1.19 -0.03 0.00 0.56 0.00 0.00 36.38 35.62 3hxz s VAL 129 CO 0.10 -0.11 -0.24 0.42 -0.31 0.00 0.00 175.10 174.96 3hxz s THR 130 N -1.13 2.40 0.14 5.32 -4.23 -0.23 -0.80 115.64 117.10 3hxz s THR 130 Ca 0.01 -1.47 0.05 0.00 -1.18 0.00 0.00 61.69 59.11 3hxz s THR 130 Cb -0.09 -2.01 -0.04 0.00 1.34 0.00 0.00 72.50 71.69 3hxz s THR 130 CO 0.02 0.25 -0.12 0.68 -0.54 0.00 0.00 174.62 174.91 3hxz s VAL 131 N -0.95 1.25 0.24 2.29 -7.23 0.38 -1.86 120.40 114.51 3hxz s VAL 131 Ca 0.14 -1.90 -0.30 0.00 -1.81 0.00 0.00 61.98 58.11 3hxz s VAL 131 Cb -0.10 -1.69 -0.10 0.00 0.56 0.00 0.00 36.38 35.05 3hxz s VAL 131 CO 0.05 -0.60 1.42 -0.47 -0.31 0.00 0.00 175.10 175.19 3hxz s TYR 132 N -2.77 3.06 0.27 2.82 5.04 -1.23 -0.59 117.35 123.95 3hxz s TYR 132 Ca 0.13 1.06 -0.01 0.00 -2.44 0.00 0.00 57.07 55.81 3hxz s TYR 132 Cb -0.01 -3.78 0.58 0.00 0.35 0.00 0.00 41.96 39.10 3hxz s TYR 132 CO 0.02 -2.53 1.69 1.49 -1.34 0.00 0.00 175.55 174.88 3hxz h GLU 133 N 5.10 0.33 -0.00 4.97 4.81 -1.45 0.22 114.58 128.55 3hxz h GLU 133 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3hxz h GLU 133 Cb 1.22 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3hxz h GLU 133 CO 0.78 0.22 -0.01 -1.13 -0.73 0.00 0.00 179.01 178.13 3hxz n SER 134 N -5.10 0.02 -4.23 1.04 3.41 -1.26 -4.53 113.62 102.97 3hxz n SER 134 Ca 0.18 -0.01 -0.43 0.00 -0.26 0.00 0.00 58.87 58.35 3hxz n SER 134 Cb 0.54 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 3hxz n SER 134 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hxz n ASP 135 N -1.33 4.82 0.11 4.04 -0.08 0.76 -4.75 116.55 120.13 3hxz n ASP 135 Ca 0.12 -2.96 0.02 0.00 -1.51 0.00 0.00 54.79 50.47 3hxz n ASP 135 Cb 0.27 -1.63 0.37 0.00 2.34 0.00 0.00 41.12 42.46 3hxz n ASP 135 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 3hxz h ASP 136 N 6.77 0.23 -0.32 1.67 3.32 -1.82 -2.64 116.42 123.64 3hxz h ASP 136 Ca 0.43 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.41 3hxz h ASP 136 Cb 0.78 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 3hxz h ASP 136 CO 1.52 0.42 0.12 -0.33 -1.72 0.00 0.00 179.24 179.25 3hxz h GLU 137 N 0.23 0.48 -0.58 3.56 5.08 -1.97 -1.66 114.58 119.72 3hxz h GLU 137 Ca 0.04 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3hxz h GLU 137 Cb 0.43 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 3hxz h GLU 137 CO 0.03 0.50 0.27 0.00 -1.00 0.00 0.00 179.01 178.81 3hxz h ALA 138 N 0.96 0.75 -0.18 3.43 0.00 -1.92 -1.63 119.26 120.68 3hxz h ALA 138 Ca 0.11 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3hxz h ALA 138 Cb 0.20 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3hxz h ALA 138 CO -0.01 0.31 -0.08 -0.92 0.00 0.00 0.00 179.25 178.55 3hxz h TYR 139 N 0.79 -0.20 -0.97 0.00 3.20 -1.35 -2.07 116.97 116.37 3hxz h TYR 139 Ca 0.20 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.09 3hxz h TYR 139 Cb 0.13 0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 3hxz h TYR 139 CO -0.00 -0.13 0.64 1.49 -1.64 0.00 0.00 178.16 178.51 3hxz h GLU 140 N -0.06 1.29 -0.04 1.82 4.22 -1.12 -0.87 114.58 119.81 3hxz h GLU 140 Ca 0.10 -0.08 -0.00 0.00 0.08 0.00 0.00 59.36 59.45 3hxz h GLU 140 Cb 0.21 -0.29 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3hxz h GLU 140 CO -0.22 0.86 0.02 0.82 -2.18 0.00 0.00 179.01 178.32 3hxz h ILE 141 N 1.33 1.05 -0.62 2.32 2.04 -0.99 0.21 117.51 122.84 3hxz h ILE 141 Ca 0.36 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 66.04 3hxz h ILE 141 Cb -0.14 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3hxz h ILE 141 CO -0.08 0.04 0.25 -0.50 0.00 0.00 0.00 178.15 177.86 3hxz h TRP 142 N 0.01 0.96 0.02 1.37 4.06 -1.15 0.01 115.95 121.22 3hxz h TRP 142 Ca 0.01 -0.07 -0.00 0.00 2.06 0.00 0.00 58.89 60.89 3hxz h TRP 142 Cb 0.05 -0.29 0.00 0.00 -1.00 0.00 0.00 29.16 27.92 3hxz h TRP 142 CO -0.06 0.76 -0.01 1.49 -3.56 0.00 0.00 178.44 177.06 3hxz h GLU 143 N 0.88 -0.02 0.00 0.49 4.81 -1.00 -0.23 114.58 119.50 3hxz h GLU 143 Ca 0.21 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.09 3hxz h GLU 143 Cb 0.21 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.53 3hxz h GLU 143 CO -0.02 0.54 -2.31 1.63 -0.73 0.00 0.00 179.01 178.12 3hxz n LYS 144 N -4.83 0.79 -0.01 1.92 5.02 0.73 -3.08 118.16 118.70 3hxz n LYS 144 Ca -0.09 0.06 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 3hxz n LYS 144 Cb 0.29 -1.47 -0.14 0.00 -0.02 0.00 0.00 35.03 33.68 3hxz n LYS 144 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3hxz h GLU 145 N 0.00 0.18 0.10 1.97 4.39 -1.19 -3.39 114.58 116.63 3hxz h GLU 145 Ca -0.52 -0.31 -0.26 0.00 0.34 0.00 0.00 59.36 58.62 3hxz h GLU 145 Cb 1.99 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 30.75 3hxz h GLU 145 CO -0.03 1.15 -1.32 0.28 -1.16 0.00 0.00 179.01 177.93 3hxz h VAL 146 N -0.57 1.06 -0.06 3.13 2.07 -1.13 -3.50 116.25 117.25 3hxz h VAL 146 Ca -0.18 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 64.97 3hxz h VAL 146 Cb 1.49 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.97 3hxz h VAL 146 CO 0.05 0.67 0.00 0.61 0.02 0.00 0.00 177.57 178.92 3hxz n GLY 147 N 1.71 1.44 3.70 2.17 0.00 -0.32 -5.03 105.19 108.87 3hxz n GLY 147 Ca -0.25 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 3hxz n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hxz s ILE 148 N -2.06 3.77 0.30 -0.61 -1.09 -0.25 -4.98 121.20 116.28 3hxz s ILE 148 Ca 0.00 1.22 -0.29 0.00 -2.23 0.00 0.00 60.65 59.35 3hxz s ILE 148 Cb 0.00 -3.78 -0.13 0.00 -1.58 0.00 0.00 42.46 36.97 3hxz s ILE 148 CO 0.00 0.05 1.33 -2.65 -1.23 0.00 0.00 174.94 172.44 3hxz n PRO 149 N 4.55 2.07 -0.10 2.79 -0.02 -1.26 -4.45 135.00 138.58 3hxz n PRO 149 Ca 0.11 0.73 0.21 0.00 -2.02 0.00 0.00 63.50 62.53 3hxz n PRO 149 Cb 0.44 -2.34 0.64 0.00 -0.02 0.00 0.00 33.50 32.22 3hxz n PRO 149 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hxz h ARG 150 N 3.26 0.13 0.00 -0.52 3.08 -1.94 -0.58 114.38 117.81 3hxz h ARG 150 Ca -0.45 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3hxz h ARG 150 Cb 1.28 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3hxz h ARG 150 CO 0.68 0.09 0.00 -0.85 -1.07 0.00 0.00 179.97 178.82 3hxz n GLU 151 N -4.39 0.19 -0.33 0.04 0.00 -1.26 -1.69 120.64 113.20 3hxz n GLU 151 Ca 0.14 0.50 0.07 0.00 0.00 0.00 0.00 57.16 57.86 3hxz n GLU 151 Cb 0.67 -1.92 0.22 0.00 0.00 0.00 0.00 31.44 30.41 3hxz n GLU 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 3hxz n ARG 152 N -2.29 2.96 -3.80 3.44 1.74 -0.23 -4.88 116.66 113.61 3hxz n ARG 152 Ca 0.01 -2.48 -0.37 0.00 -0.77 0.00 0.00 57.85 54.24 3hxz n ARG 152 Cb 0.18 -1.59 -0.13 0.00 -1.02 0.00 0.00 32.46 29.90 3hxz n ARG 152 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3hxz s ILE 153 N -1.94 3.79 -0.16 0.55 1.01 -0.68 -1.46 121.20 122.31 3hxz s ILE 153 Ca 0.34 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 3hxz s ILE 153 Cb 0.24 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 3hxz s ILE 153 CO 0.13 0.13 -0.09 -0.63 0.00 0.00 0.00 174.94 174.48 3hxz s ILE 154 N 1.48 3.28 -0.11 2.92 1.01 0.02 -4.99 121.20 124.80 3hxz s ILE 154 Ca 0.03 -0.56 -0.20 0.00 0.00 0.00 0.00 60.65 59.92 3hxz s ILE 154 Cb -0.17 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 3hxz s ILE 154 CO 0.01 0.49 0.55 -0.13 0.00 0.00 0.00 174.94 175.86 3hxz s ARG 155 N 0.67 4.35 -0.12 2.79 0.52 -1.26 -0.47 118.95 125.43 3hxz s ARG 155 Ca -0.05 0.57 0.02 0.00 -0.52 0.00 0.00 55.73 55.75 3hxz s ARG 155 Cb -0.15 -3.45 0.01 0.00 0.52 0.00 0.00 34.95 31.88 3hxz s ARG 155 CO 0.02 0.10 -0.17 0.42 0.02 0.00 0.00 175.30 175.68 3hxz s ILE 156 N 0.79 1.67 0.00 1.52 1.01 0.25 -4.83 121.20 121.61 3hxz s ILE 156 Ca 0.29 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.19 3hxz s ILE 156 Cb -0.16 -1.51 0.00 0.00 0.01 0.00 0.00 42.46 40.80 3hxz s ILE 156 CO 0.12 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.15 3hxz n GLY 157 N 4.12 1.42 2.87 6.18 0.00 -1.26 -1.14 105.19 117.38 3hxz n GLY 157 Ca -0.19 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 3hxz n GLY 157 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hxz n ASP 158 N 0.00 4.14 0.00 1.61 8.00 -1.26 -4.52 116.55 124.51 3hxz n ASP 158 Ca 0.00 -2.87 0.11 0.00 0.71 0.00 0.00 54.79 52.73 3hxz n ASP 158 Cb 0.00 -1.66 0.64 0.00 -0.02 0.00 0.00 41.12 40.08 3hxz n ASP 158 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3hxz n ASN 159 N 6.26 0.00 -1.18 -2.24 6.94 -1.16 -2.96 115.26 120.92 3hxz n ASN 159 Ca 0.50 -0.93 0.09 0.00 -0.02 0.00 0.00 54.58 54.23 3hxz n ASN 159 Cb 0.40 0.00 0.28 0.00 -2.36 0.00 0.00 39.78 38.10 3hxz n ASN 159 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3hxz n LYS 160 N -0.92 3.01 -0.97 -3.83 5.02 -0.77 -4.97 118.16 114.73 3hxz n LYS 160 Ca 0.16 -2.55 0.00 0.00 -2.02 0.00 0.00 58.31 53.90 3hxz n LYS 160 Cb 0.07 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3hxz n LYS 160 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hxz n GLY 161 N 1.10 0.51 3.47 0.72 0.00 -1.15 -4.96 105.19 104.87 3hxz n GLY 161 Ca 0.21 -0.89 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 3hxz n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hxz s ALA 162 N -2.00 -1.69 0.09 4.61 0.00 -1.26 -5.06 121.76 116.44 3hxz s ALA 162 Ca 0.00 0.89 -0.34 0.00 0.00 0.00 0.00 51.96 52.50 3hxz s ALA 162 Cb 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 23.12 23.44 3hxz s ALA 162 CO 0.00 -0.59 1.65 -2.30 0.00 0.00 0.00 175.76 174.52 3hxz n PRO 163 N 0.18 2.11 -0.81 0.00 -0.02 -1.26 -0.96 135.00 134.24 3hxz n PRO 163 Ca -0.17 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3hxz n PRO 163 Cb 0.61 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3hxz n PRO 163 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3hxz n TYR 164 N 4.26 0.00 -2.97 6.00 4.01 -1.26 -4.95 117.16 122.26 3hxz n TYR 164 Ca 0.19 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.49 3hxz n TYR 164 Cb 0.28 -0.90 -0.04 0.00 -0.31 0.00 0.00 39.34 38.38 3hxz n TYR 164 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hxz s ALA 165 N -2.10 3.24 -0.07 -0.72 0.00 -0.14 -4.75 121.76 117.23 3hxz s ALA 165 Ca 0.00 -1.93 -0.29 0.00 0.00 0.00 0.00 51.96 49.73 3hxz s ALA 165 Cb 0.00 -3.70 0.07 0.00 0.00 0.00 0.00 23.12 19.49 3hxz s ALA 165 CO 0.00 -2.54 0.66 0.45 0.00 0.00 0.00 175.76 174.33 3hxz s SER 166 N 3.53 -0.64 0.34 0.00 0.15 -1.26 -1.85 113.70 113.97 3hxz s SER 166 Ca 0.18 0.76 0.26 0.00 0.70 0.00 0.00 55.95 57.85 3hxz s SER 166 Cb -0.19 0.62 1.18 0.00 -1.71 0.00 0.00 66.02 65.92 3hxz s SER 166 CO 0.09 -0.56 1.78 0.44 1.20 0.00 0.00 173.24 176.19 3hxz h ASP 167 N 3.28 0.00 -0.24 5.45 3.32 -1.93 -2.83 116.42 123.46 3hxz h ASP 167 Ca -0.27 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.70 3hxz h ASP 167 Cb 1.14 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 3hxz h ASP 167 CO 0.36 0.00 -0.08 0.59 -1.72 0.00 0.00 179.24 178.39 3hxz n ASN 168 N -2.41 2.85 -3.69 6.45 4.13 -1.26 -4.82 115.26 116.51 3hxz n ASN 168 Ca 0.01 -3.44 -0.26 0.00 1.68 0.00 0.00 54.58 52.57 3hxz n ASN 168 Cb 0.17 -0.57 -0.17 0.00 -1.54 0.00 0.00 39.78 37.68 3hxz n ASN 168 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3hxz s PHE 169 N -3.06 0.58 -0.14 3.10 5.36 -1.07 -1.27 117.98 121.47 3hxz s PHE 169 Ca 0.41 -0.47 -0.12 0.00 -0.96 0.00 0.00 56.93 55.80 3hxz s PHE 169 Cb 0.36 -0.82 -0.05 0.00 -0.34 0.00 0.00 43.02 42.17 3hxz s PHE 169 CO 0.03 -0.50 0.24 -0.46 -1.46 0.00 0.00 175.22 173.07 3hxz s TRP 170 N 2.01 3.51 -0.04 10.12 -0.00 -0.32 -4.42 118.94 129.79 3hxz s TRP 170 Ca 0.01 0.57 0.06 0.00 -0.00 0.00 0.00 56.10 56.74 3hxz s TRP 170 Cb -0.16 -2.22 -0.01 0.00 -0.00 0.00 0.00 33.47 31.09 3hxz s TRP 170 CO -0.08 0.39 -0.21 -0.65 -0.00 0.00 0.00 176.95 176.41 3hxz s GLN 171 N -0.02 2.01 0.17 5.86 -0.21 -1.26 -2.17 119.66 124.03 3hxz s GLN 171 Ca 0.15 -0.75 -0.09 0.00 0.02 0.00 0.00 55.36 54.69 3hxz s GLN 171 Cb -0.13 -1.78 0.05 0.00 1.00 0.00 0.00 33.01 32.15 3hxz s GLN 171 CO 0.04 0.36 1.58 1.98 -2.12 0.00 0.00 175.29 177.12 3hxz h MET 172 N 5.99 0.98 0.00 2.91 1.85 -1.82 -3.49 114.93 121.35 3hxz h MET 172 Ca -0.35 -0.40 0.00 0.00 -0.61 0.00 0.00 59.70 58.35 3hxz h MET 172 Cb 1.16 -0.04 0.00 0.00 0.43 0.00 0.00 31.60 33.15 3hxz h MET 172 CO 0.48 1.07 0.00 0.41 -0.40 0.00 0.00 176.91 178.47 3hxz n GLY 173 N -0.17 1.78 0.25 1.39 0.00 -1.26 -4.83 105.19 102.35 3hxz n GLY 173 Ca 0.00 -0.80 0.08 0.00 0.00 0.00 0.00 46.02 45.30 3hxz n GLY 173 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hxz h ASP 174 N 0.00 0.00 -2.84 1.61 3.45 -1.95 -3.42 116.42 113.27 3hxz h ASP 174 Ca 0.00 0.00 -0.51 0.00 0.43 0.00 0.00 57.03 56.95 3hxz h ASP 174 Cb 0.00 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 38.63 3hxz h ASP 174 CO 0.00 0.05 -0.73 0.42 -1.57 0.00 0.00 179.24 177.41 3hxz s THR 175 N -4.92 1.93 0.00 0.35 -4.23 -1.26 -4.39 115.64 103.11 3hxz s THR 175 Ca -0.05 -2.24 0.00 0.00 -1.18 0.00 0.00 61.69 58.22 3hxz s THR 175 Cb 0.16 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.79 3hxz s THR 175 CO 0.67 -0.47 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 3hxz n GLY 176 N -0.50 1.73 3.69 3.99 0.00 -0.95 -4.67 105.19 108.48 3hxz n GLY 176 Ca -0.07 -2.19 -0.43 0.00 0.00 0.00 0.00 46.02 43.33 3hxz n GLY 176 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hxz n PRO 177 N -0.65 2.06 -3.84 1.61 -0.02 -1.26 -1.13 135.00 131.78 3hxz n PRO 177 Ca 0.00 0.72 -0.08 0.00 -2.02 0.00 0.00 63.50 62.13 3hxz n PRO 177 Cb 0.00 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.16 3hxz n PRO 177 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hxz n GLY 179 N -0.44 0.25 3.74 0.00 0.00 -0.92 -1.17 105.19 106.65 3hxz n GLY 179 Ca -0.05 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 3hxz n GLY 179 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hxz s PRO 180 N -2.00 2.70 0.09 1.61 0.02 -1.24 -1.17 135.00 135.01 3hxz s PRO 180 Ca 0.00 2.09 -0.01 0.00 0.02 0.00 0.00 61.00 63.10 3hxz s PRO 180 Cb 0.00 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 3hxz s PRO 180 CO 0.00 -1.49 -0.00 0.00 -0.33 0.00 0.00 177.00 175.18 3hxz s THR 182 N -3.92 1.37 0.03 0.00 -1.32 0.02 -3.51 115.64 108.32 3hxz s THR 182 Ca 0.14 -0.70 0.09 0.00 -1.21 0.00 0.00 61.69 60.01 3hxz s THR 182 Cb 0.07 -1.17 -0.03 0.00 -1.51 0.00 0.00 72.50 69.87 3hxz s THR 182 CO -0.05 0.39 -0.25 -1.61 -2.21 0.00 0.00 174.62 170.89 3hxz s GLU 183 N -0.09 1.79 -0.19 7.08 2.02 -0.78 -0.68 118.70 127.85 3hxz s GLU 183 Ca -0.01 -1.05 -0.06 0.00 0.02 0.00 0.00 54.97 53.88 3hxz s GLU 183 Cb -0.10 -1.91 -0.03 0.00 0.10 0.00 0.00 34.13 32.19 3hxz s GLU 183 CO 0.01 0.50 0.03 0.42 0.02 0.00 0.00 175.26 176.24 3hxz s ILE 184 N -0.76 4.31 0.02 -1.63 1.01 0.25 -1.07 121.20 123.33 3hxz s ILE 184 Ca 0.11 -0.20 0.05 0.00 0.00 0.00 0.00 60.65 60.61 3hxz s ILE 184 Cb -0.10 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 3hxz s ILE 184 CO 0.01 0.44 -0.14 -0.36 0.00 0.00 0.00 174.94 174.89 3hxz s PHE 185 N 0.71 2.68 -0.13 3.97 0.40 0.86 -0.66 117.98 125.79 3hxz s PHE 185 Ca 0.01 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.16 3hxz s PHE 185 Cb -0.14 -1.53 -0.02 0.00 0.51 0.00 0.00 43.02 41.85 3hxz s PHE 185 CO 0.02 0.28 -0.12 -0.47 0.70 0.00 0.00 175.22 175.63 3hxz s TYR 186 N -0.92 2.84 -0.41 0.36 5.04 -0.15 -0.87 117.35 123.24 3hxz s TYR 186 Ca 0.15 -0.59 -0.26 0.00 -2.44 0.00 0.00 57.07 53.93 3hxz s TYR 186 Cb -0.11 -1.86 0.02 0.00 0.35 0.00 0.00 41.96 40.36 3hxz s TYR 186 CO 0.05 -0.19 0.92 0.34 -1.34 0.00 0.00 175.55 175.34 3hxz s ASP 187 N 0.36 6.59 0.12 4.32 2.15 -0.14 -1.08 116.67 128.98 3hxz s ASP 187 Ca -0.10 0.35 0.26 0.00 0.43 0.00 0.00 52.55 53.49 3hxz s ASP 187 Cb -0.16 -2.45 0.96 0.00 -0.30 0.00 0.00 42.92 40.97 3hxz s ASP 187 CO 0.05 -0.95 1.79 1.41 -0.17 0.00 0.00 175.17 177.31 3hxz n HIS 188 N 6.95 0.51 0.00 -5.34 8.25 0.06 -4.96 115.22 120.71 3hxz n HIS 188 Ca 0.06 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.68 3hxz n HIS 188 Cb 0.48 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.83 3hxz n HIS 188 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hxz n GLY 189 N 1.10 2.51 0.00 -1.41 0.00 -1.26 -4.80 105.19 101.32 3hxz n GLY 189 Ca 0.05 -2.04 0.08 0.00 0.00 0.00 0.00 46.02 44.11 3hxz n GLY 189 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hxz n ASP 190 N 0.00 0.00 0.11 1.61 5.68 -1.26 -1.99 116.55 120.70 3hxz n ASP 190 Ca 0.00 0.04 0.12 0.00 -0.50 0.00 0.00 54.79 54.45 3hxz n ASP 190 Cb 0.00 -0.27 0.46 0.00 -1.14 0.00 0.00 41.12 40.17 3hxz n ASP 190 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3hxz n HIS 191 N -1.27 0.78 -4.74 2.11 8.25 -1.26 -4.72 115.22 114.36 3hxz n HIS 191 Ca 0.08 0.27 -0.33 0.00 -0.26 0.00 0.00 57.72 57.48 3hxz n HIS 191 Cb 0.12 -0.94 -0.13 0.00 1.12 0.00 0.00 29.99 30.16 3hxz n HIS 191 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3hxz s ILE 192 N -3.22 3.29 0.41 1.59 -1.09 -0.84 -5.11 121.20 116.23 3hxz s ILE 192 Ca 0.07 -0.61 -0.25 0.00 -2.23 0.00 0.00 60.65 57.63 3hxz s ILE 192 Cb 0.11 -2.35 -0.08 0.00 -1.58 0.00 0.00 42.46 38.55 3hxz s ILE 192 CO 0.46 0.56 1.16 0.86 -1.23 0.00 0.00 174.94 176.75 3hxz s TRP 193 N -0.28 3.05 0.00 3.97 -0.00 -1.26 -4.68 118.94 119.74 3hxz s TRP 193 Ca 0.03 1.56 0.00 0.00 -0.00 0.00 0.00 56.10 57.68 3hxz s TRP 193 Cb -0.13 -3.37 0.00 0.00 -0.00 0.00 0.00 33.47 29.97 3hxz s TRP 193 CO 0.03 -1.29 0.00 0.41 -0.00 0.00 0.00 176.95 176.09 3hxz n GLY 194 N 0.58 4.24 3.70 5.86 0.00 -1.26 -2.88 105.19 115.42 3hxz n GLY 194 Ca 0.05 -1.54 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 3hxz n GLY 194 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hxz s GLY 195 N 0.00 2.66 0.96 -0.02 0.00 0.21 -4.82 107.32 106.30 3hxz s GLY 195 Ca 0.00 -1.54 -0.12 0.00 0.00 0.00 0.00 44.72 43.06 3hxz s GLY 195 CO 0.00 -2.10 1.09 2.56 0.00 0.00 0.00 173.10 174.65 3hxz s PRO 196 N -3.82 0.78 0.31 2.90 0.04 -1.26 -3.88 135.00 130.06 3hxz s PRO 196 Ca 0.25 0.66 -0.29 0.00 0.04 0.00 0.00 61.00 61.66 3hxz s PRO 196 Cb 0.06 -1.77 -0.13 0.00 0.04 0.00 0.00 34.50 32.70 3hxz s PRO 196 CO 0.13 -2.53 1.33 -2.30 0.04 0.00 0.00 177.00 173.68 3hxz n PRO 197 N -4.06 2.12 0.00 0.56 -0.02 -1.26 -1.87 135.00 130.47 3hxz n PRO 197 Ca 0.06 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3hxz n PRO 197 Cb 0.56 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3hxz n PRO 197 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hxz n GLY 198 N 1.24 2.73 3.91 -1.23 0.00 -1.26 -4.99 105.19 105.58 3hxz n GLY 198 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 3hxz n GLY 198 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hxz s SER 199 N -1.48 6.06 0.53 1.61 1.04 -0.78 -4.98 113.70 115.70 3hxz s SER 199 Ca 0.00 0.87 0.21 0.00 0.48 0.00 0.00 55.95 57.52 3hxz s SER 199 Cb 0.00 -2.09 1.36 0.00 0.10 0.00 0.00 66.02 65.39 3hxz s SER 199 CO 0.00 -0.73 2.07 -0.65 0.98 0.00 0.00 173.24 174.91 3hxz h PRO 200 N 0.09 0.00 -0.73 4.02 0.11 -1.96 -2.18 132.00 131.35 3hxz h PRO 200 Ca -0.46 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.41 3hxz h PRO 200 Cb 1.22 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.19 3hxz h PRO 200 CO 0.61 0.00 0.28 0.39 -0.21 0.00 0.00 178.00 179.08 3hxz n GLU 201 N -4.42 3.47 0.26 1.05 1.02 -1.26 -4.61 120.64 116.15 3hxz n GLU 201 Ca 0.04 -3.09 0.11 0.00 -0.02 0.00 0.00 57.16 54.20 3hxz n GLU 201 Cb 0.37 -2.18 0.70 0.00 -0.02 0.00 0.00 31.44 30.30 3hxz n GLU 201 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 3hxz h GLU 202 N 2.40 0.00 0.00 3.49 4.11 -1.50 0.60 114.58 123.68 3hxz h GLU 202 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.72 3hxz h GLU 202 Cb 2.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.58 3hxz h GLU 202 CO 0.74 0.12 0.00 -3.47 0.07 0.00 0.00 179.01 176.47 3hxz n ASP 203 N -3.86 0.00 -4.66 3.06 2.03 -1.26 -4.76 116.55 107.10 3hxz n ASP 203 Ca -0.02 0.08 -0.30 0.00 0.52 0.00 0.00 54.79 55.07 3hxz n ASP 203 Cb 0.21 -0.32 0.17 0.00 -0.72 0.00 0.00 41.12 40.46 3hxz n ASP 203 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 3hxz s GLY 204 N -2.64 1.62 0.00 0.27 0.00 -0.91 -4.94 107.32 100.72 3hxz s GLY 204 Ca 0.17 0.10 0.14 0.00 0.00 0.00 0.00 44.72 45.13 3hxz s GLY 204 CO 0.31 0.62 1.36 1.22 0.00 0.00 0.00 173.10 176.60 3hxz n ASP 205 N -4.18 1.61 0.07 1.64 8.00 -1.18 -4.36 116.55 118.15 3hxz n ASP 205 Ca 0.07 -1.88 -0.09 0.00 0.71 0.00 0.00 54.79 53.60 3hxz n ASP 205 Cb 0.54 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 41.41 3hxz n ASP 205 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3hxz h ARG 206 N 1.88 -0.26 -4.59 -1.24 2.43 -1.80 -3.40 114.38 107.39 3hxz h ARG 206 Ca 0.00 0.02 -0.71 0.00 -0.81 0.00 0.00 59.98 58.48 3hxz h ARG 206 Cb 0.42 0.06 -0.20 0.00 -0.42 0.00 0.00 29.97 29.83 3hxz h ARG 206 CO 0.00 0.09 0.06 0.71 -1.51 0.00 0.00 179.97 179.32 3hxz s TYR 207 N -3.20 3.03 -0.14 2.20 2.02 -1.26 -0.76 117.35 119.26 3hxz s TYR 207 Ca -0.11 -1.01 -0.16 0.00 -0.37 0.00 0.00 57.07 55.42 3hxz s TYR 207 Cb 0.00 -3.98 -0.04 0.00 -0.40 0.00 0.00 41.96 37.54 3hxz s TYR 207 CO 0.39 -1.25 0.39 0.42 -1.57 0.00 0.00 175.55 173.92 3hxz s ILE 208 N 2.52 5.24 -0.36 2.71 -1.09 -0.24 -4.83 121.20 125.15 3hxz s ILE 208 Ca 0.10 0.76 -0.28 0.00 -2.23 0.00 0.00 60.65 58.99 3hxz s ILE 208 Cb -0.25 -3.73 -0.01 0.00 -1.58 0.00 0.00 42.46 36.89 3hxz s ILE 208 CO 0.06 0.36 1.67 -0.70 -1.23 0.00 0.00 174.94 175.10 3hxz s GLU 209 N 0.50 3.41 -0.25 2.79 2.12 -1.26 -0.98 118.70 125.03 3hxz s GLU 209 Ca 0.21 1.27 0.05 0.00 0.36 0.00 0.00 54.97 56.86 3hxz s GLU 209 Cb -0.14 -4.14 -0.18 0.00 0.26 0.00 0.00 34.13 29.92 3hxz s GLU 209 CO 0.07 -1.77 -0.18 0.44 -0.54 0.00 0.00 175.26 173.29 3hxz n ILE 210 N 7.31 1.47 -3.69 -3.70 -5.35 0.16 -4.84 119.36 110.72 3hxz n ILE 210 Ca 0.21 -0.62 -0.18 0.00 -0.27 0.00 0.00 62.75 61.89 3hxz n ILE 210 Cb 0.47 -1.25 -0.17 0.00 -1.74 0.00 0.00 39.64 36.96 3hxz n ILE 210 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 3hxz s TRP 211 N -2.51 -0.03 -0.19 4.28 -0.11 -1.09 -1.66 118.94 117.63 3hxz s TRP 211 Ca -0.30 0.36 -0.07 0.00 1.22 0.00 0.00 56.10 57.31 3hxz s TRP 211 Cb 0.08 -0.35 -0.04 0.00 -1.50 0.00 0.00 33.47 31.66 3hxz s TRP 211 CO 0.64 -0.20 0.04 1.21 -4.62 0.00 0.00 176.95 174.02 3hxz s ASN 212 N 1.97 5.37 -0.29 5.86 2.47 -0.26 -0.58 114.94 129.49 3hxz s ASN 212 Ca 0.01 -0.01 -0.00 0.00 0.42 0.00 0.00 52.86 53.28 3hxz s ASN 212 Cb -0.12 -1.92 0.05 0.00 -1.45 0.00 0.00 41.25 37.81 3hxz s ASN 212 CO -0.04 0.14 -0.03 -0.63 -3.72 0.00 0.00 177.10 172.82 3hxz s ILE 213 N 0.57 2.74 -0.21 -5.21 1.01 0.14 -1.05 121.20 119.19 3hxz s ILE 213 Ca 0.02 -1.48 -0.11 0.00 0.00 0.00 0.00 60.65 59.09 3hxz s ILE 213 Cb -0.13 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 3hxz s ILE 213 CO 0.02 -0.09 0.16 -0.69 0.00 0.00 0.00 174.94 174.33 3hxz s VAL 214 N 1.20 5.38 -0.87 2.92 1.01 0.15 -0.80 120.40 129.39 3hxz s VAL 214 Ca -0.06 0.22 -0.17 0.00 0.00 0.00 0.00 61.98 61.98 3hxz s VAL 214 Cb -0.20 -3.50 0.17 0.00 0.00 0.00 0.00 36.38 32.85 3hxz s VAL 214 CO -0.02 0.39 0.95 -0.36 0.00 0.00 0.00 175.10 176.05 3hxz s PHE 215 N 0.69 3.42 0.04 5.22 0.08 0.33 -1.11 117.98 126.65 3hxz s PHE 215 Ca 0.09 -1.66 -0.30 0.00 0.12 0.00 0.00 56.93 55.18 3hxz s PHE 215 Cb -0.12 -4.06 -0.08 0.00 -0.57 0.00 0.00 43.02 38.18 3hxz s PHE 215 CO 0.01 -1.25 1.86 -1.64 -0.10 0.00 0.00 175.22 174.10 3hxz s MET 216 N 1.51 4.15 0.00 0.44 -1.94 -0.07 -3.67 119.30 119.72 3hxz s MET 216 Ca 0.25 2.51 0.00 0.00 -1.71 0.00 0.00 55.69 56.74 3hxz s MET 216 Cb -0.08 -3.98 0.00 0.00 2.01 0.00 0.00 34.83 32.78 3hxz s MET 216 CO -0.09 -0.89 0.00 1.04 -0.01 0.00 0.00 175.02 175.07 3hxz n GLN 217 N 6.95 1.97 -4.26 2.03 1.13 -0.31 -1.73 117.38 123.16 3hxz n GLN 217 Ca 0.19 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 55.10 3hxz n GLN 217 Cb 0.41 -0.70 -0.10 0.00 0.11 0.00 0.00 30.24 29.96 3hxz n GLN 217 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 3hxz s PHE 218 N -1.28 1.28 -0.27 1.08 0.08 -0.42 -0.73 117.98 117.72 3hxz s PHE 218 Ca 0.00 -0.88 -0.03 0.00 0.12 0.00 0.00 56.93 56.14 3hxz s PHE 218 Cb 0.00 -0.70 0.02 0.00 -0.57 0.00 0.00 43.02 41.77 3hxz s PHE 218 CO 0.00 -0.05 -0.02 1.21 -0.10 0.00 0.00 175.22 176.27 3hxz s ASN 219 N -3.19 4.58 0.17 1.36 2.47 0.71 -0.64 114.94 120.41 3hxz s ASN 219 Ca 0.21 -0.86 -0.30 0.00 0.42 0.00 0.00 52.86 52.33 3hxz s ASN 219 Cb 0.04 -1.73 -0.07 0.00 -1.45 0.00 0.00 41.25 38.04 3hxz s ASN 219 CO 0.03 -0.16 1.05 -0.60 -3.72 0.00 0.00 177.10 173.70 3hxz s ARG 220 N 1.37 4.65 0.39 0.43 3.52 -0.28 -1.62 118.95 127.40 3hxz s ARG 220 Ca 0.00 1.63 -0.00 0.00 -0.13 0.00 0.00 55.73 57.23 3hxz s ARG 220 Cb -0.17 -3.30 -0.03 0.00 -1.56 0.00 0.00 34.95 29.89 3hxz s ARG 220 CO -0.02 0.16 0.60 -0.65 -0.81 0.00 0.00 175.30 174.58 3hxz s GLN 221 N -0.40 3.38 0.51 5.12 -1.52 -0.06 -2.25 119.66 124.43 3hxz s GLN 221 Ca 0.48 -0.33 0.21 0.00 -1.95 0.00 0.00 55.36 53.77 3hxz s GLN 221 Cb -0.28 -2.61 1.32 0.00 -0.22 0.00 0.00 33.01 31.23 3hxz s GLN 221 CO 0.34 0.01 2.09 0.00 -0.25 0.00 0.00 175.29 177.47 3hxz h ALA 222 N 0.61 1.63 0.00 6.09 0.00 -1.89 -0.31 119.26 125.38 3hxz h ALA 222 Ca -0.48 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3hxz h ALA 222 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3hxz h ALA 222 CO 0.60 0.12 0.00 -0.40 0.00 0.00 0.00 179.25 179.57 3hxz n ASP 223 N -4.11 0.17 0.00 0.00 3.85 -1.26 -4.91 116.55 110.28 3hxz n ASP 223 Ca -0.03 0.52 0.00 0.00 -0.71 0.00 0.00 54.79 54.57 3hxz n ASP 223 Cb 0.18 -0.56 0.00 0.00 -1.35 0.00 0.00 41.12 39.39 3hxz n ASP 223 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3hxz n GLY 224 N 1.21 0.41 3.81 6.12 0.00 -0.13 -5.09 105.19 111.52 3hxz n GLY 224 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3hxz n GLY 224 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hxz s THR 225 N -2.00 3.96 -0.38 2.61 -4.23 -1.26 -4.71 115.64 109.63 3hxz s THR 225 Ca 0.00 0.98 -0.04 0.00 -1.18 0.00 0.00 61.69 61.46 3hxz s THR 225 Cb 0.00 -3.46 0.08 0.00 1.34 0.00 0.00 72.50 70.46 3hxz s THR 225 CO 0.00 -0.49 0.15 -0.32 -0.54 0.00 0.00 174.62 173.42 3hxz s MET 226 N -3.91 2.24 -0.15 3.99 1.75 -1.26 -0.89 119.30 121.07 3hxz s MET 226 Ca 0.63 -1.58 -0.14 0.00 -1.25 0.00 0.00 55.69 53.35 3hxz s MET 226 Cb -0.15 -3.49 -0.05 0.00 2.84 0.00 0.00 34.83 33.99 3hxz s MET 226 CO 0.32 -0.91 0.32 -1.21 -0.65 0.00 0.00 175.02 172.89 3hxz s GLU 227 N 1.23 4.27 0.40 4.11 2.02 -0.64 -4.88 118.70 125.20 3hxz s GLU 227 Ca 0.03 0.14 -0.27 0.00 0.02 0.00 0.00 54.97 54.90 3hxz s GLU 227 Cb -0.22 -3.43 -0.10 0.00 0.10 0.00 0.00 34.13 30.49 3hxz s GLU 227 CO -0.02 0.23 1.44 -2.14 0.02 0.00 0.00 175.26 174.79 3hxz s PRO 228 N 0.49 3.95 0.51 0.39 0.02 -1.26 0.26 135.00 139.35 3hxz s PRO 228 Ca 0.18 2.47 -0.18 0.00 0.02 0.00 0.00 61.00 63.48 3hxz s PRO 228 Cb -0.13 -2.84 -0.08 0.00 0.02 0.00 0.00 34.50 31.47 3hxz s PRO 228 CO 0.05 -0.62 1.00 -0.51 -0.33 0.00 0.00 177.00 176.59 3hxz s LEU 229 N -2.34 3.70 0.29 -5.54 1.43 0.09 -4.66 118.68 111.66 3hxz s LEU 229 Ca 0.56 1.70 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 3hxz s LEU 229 Cb -0.44 -4.53 0.51 0.00 0.03 0.00 0.00 46.19 41.76 3hxz s LEU 229 CO 0.59 -0.68 1.89 -0.65 0.23 0.00 0.00 176.35 177.72 3hxz h PRO 230 N 1.13 1.02 -3.63 1.29 0.11 -1.83 -3.41 132.00 126.68 3hxz h PRO 230 Ca -0.48 -0.06 -0.41 0.00 0.11 0.00 0.00 66.00 65.16 3hxz h PRO 230 Cb 1.20 -0.23 -0.38 0.00 0.11 0.00 0.00 31.00 31.70 3hxz h PRO 230 CO 0.60 0.68 -0.76 0.15 -0.21 0.00 0.00 178.00 178.46 3hxz s LYS 231 N -5.94 0.42 0.22 1.05 1.02 -1.26 -5.12 119.74 110.13 3hxz s LYS 231 Ca -0.12 0.16 -0.32 0.00 0.02 0.00 0.00 55.97 55.71 3hxz s LYS 231 Cb 0.21 -0.80 -0.14 0.00 -0.52 0.00 0.00 37.83 36.58 3hxz s LYS 231 CO 0.81 -0.28 1.44 -2.30 -0.92 0.00 0.00 175.35 174.09 3hxz n PRO 232 N 5.01 2.01 -4.30 -1.68 -0.02 -1.26 -4.66 135.00 130.10 3hxz n PRO 232 Ca -0.09 0.72 -0.19 0.00 -2.02 0.00 0.00 63.50 61.92 3hxz n PRO 232 Cb 0.50 -2.39 -0.08 0.00 -0.02 0.00 0.00 33.50 31.50 3hxz n PRO 232 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3hxz s SER 233 N 0.42 1.56 -0.07 2.55 0.01 -0.71 -4.07 113.70 113.39 3hxz s SER 233 Ca 0.71 -1.68 0.04 0.00 1.31 0.00 0.00 55.95 56.33 3hxz s SER 233 Cb -0.67 0.51 0.00 0.00 0.21 0.00 0.00 66.02 66.08 3hxz s SER 233 CO 0.47 -1.00 -0.19 -0.69 0.41 0.00 0.00 173.24 172.24 3hxz s VAL 234 N -3.54 1.61 -0.19 3.43 1.01 -0.46 -0.89 120.40 121.36 3hxz s VAL 234 Ca 0.38 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 3hxz s VAL 234 Cb 0.03 -1.40 0.05 0.00 0.00 0.00 0.00 36.38 35.06 3hxz s VAL 234 CO 0.23 0.46 -0.03 -0.62 0.00 0.00 0.00 175.10 175.14 3hxz s ASP 235 N 0.35 3.17 0.28 3.32 2.15 -0.27 -1.25 116.67 124.43 3hxz s ASP 235 Ca -0.13 -0.87 0.12 0.00 0.43 0.00 0.00 52.55 52.10 3hxz s ASP 235 Cb -0.16 -0.91 -0.05 0.00 -0.30 0.00 0.00 42.92 41.51 3hxz s ASP 235 CO 0.05 -0.23 -0.19 0.42 -0.17 0.00 0.00 175.17 175.05 3hxz s THR 236 N 1.62 2.43 -0.28 1.71 -4.23 -0.80 0.33 115.64 116.41 3hxz s THR 236 Ca -0.02 -2.39 -0.11 0.00 -1.18 0.00 0.00 61.69 57.99 3hxz s THR 236 Cb -0.17 -2.30 0.11 0.00 1.34 0.00 0.00 72.50 71.48 3hxz s THR 236 CO -0.07 -0.40 0.63 0.00 -0.54 0.00 0.00 174.62 174.24 3hxz s ALA 237 N -2.54 -1.91 -0.15 3.99 0.00 -0.22 -3.65 121.76 117.28 3hxz s ALA 237 Ca 0.30 2.27 -0.04 0.00 0.00 0.00 0.00 51.96 54.49 3hxz s ALA 237 Cb -0.04 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 3hxz s ALA 237 CO 0.15 -0.79 -0.03 1.41 0.00 0.00 0.00 175.76 176.50 3hxz s MET 238 N 2.58 3.67 -0.18 0.00 1.75 0.77 -1.10 119.30 126.79 3hxz s MET 238 Ca -0.07 -0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 53.57 3hxz s MET 238 Cb -0.10 -2.92 -0.04 0.00 2.84 0.00 0.00 34.83 34.61 3hxz s MET 238 CO -0.18 0.25 1.73 0.20 -0.65 0.00 0.00 175.02 176.36 3hxz s GLY 239 N 0.33 1.18 0.18 2.11 0.00 -0.67 -0.30 107.32 110.16 3hxz s GLY 239 Ca -0.04 0.62 -0.13 0.00 0.00 0.00 0.00 44.72 45.17 3hxz s GLY 239 CO 0.03 3.15 1.79 -2.00 0.00 0.00 0.00 173.10 176.07 3hxz h LEU 240 N 11.89 0.40 -0.92 0.66 5.85 -1.68 -0.89 115.31 130.64 3hxz h LEU 240 Ca -0.36 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.32 3hxz h LEU 240 Cb 1.17 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 3hxz h LEU 240 CO 0.99 0.28 0.15 -0.33 -0.34 0.00 0.00 178.44 179.19 3hxz h GLU 241 N 0.53 0.95 -0.22 1.25 3.07 -1.90 -0.20 114.58 118.05 3hxz h GLU 241 Ca 0.21 -0.20 -0.11 0.00 -0.50 0.00 0.00 59.36 58.76 3hxz h GLU 241 Cb 0.09 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 27.86 3hxz h GLU 241 CO -0.13 0.84 -0.30 0.00 -1.40 0.00 0.00 179.01 178.02 3hxz h ARG 242 N 0.91 0.60 -0.05 2.33 3.08 -1.79 -1.86 114.38 117.60 3hxz h ARG 242 Ca 0.20 -0.34 -0.13 0.00 0.07 0.00 0.00 59.98 59.78 3hxz h ARG 242 Cb 0.32 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 3hxz h ARG 242 CO -0.00 0.95 -0.55 0.97 -1.07 0.00 0.00 179.97 180.27 3hxz h ILE 243 N 0.29 1.38 -0.78 2.04 6.09 -1.10 -2.67 117.51 122.75 3hxz h ILE 243 Ca 0.03 -1.86 -0.00 0.00 -1.37 0.00 0.00 64.86 61.65 3hxz h ILE 243 Cb 0.88 1.95 -0.04 0.00 0.47 0.00 0.00 36.82 40.08 3hxz h ILE 243 CO 0.07 0.54 0.48 0.00 -3.07 0.00 0.00 178.15 176.17 3hxz h ALA 244 N 1.33 1.00 -0.43 0.18 0.00 -0.95 -0.17 119.26 120.21 3hxz h ALA 244 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hxz h ALA 244 Cb 1.00 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 3hxz h ALA 244 CO 0.08 0.46 0.28 0.00 0.00 0.00 0.00 179.25 180.07 3hxz h ALA 245 N 1.26 0.55 0.13 0.00 0.00 -1.10 0.36 119.26 120.45 3hxz h ALA 245 Ca 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3hxz h ALA 245 Cb -0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3hxz h ALA 245 CO -0.05 0.01 -0.13 0.28 0.00 0.00 0.00 179.25 179.36 3hxz h VAL 246 N 0.59 0.71 0.00 0.00 2.07 -1.15 -1.17 116.25 117.29 3hxz h VAL 246 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.61 3hxz h VAL 246 Cb -0.05 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3hxz h VAL 246 CO -0.03 0.00 -0.31 -0.07 0.02 0.00 0.00 177.57 177.18 3hxz h LEU 247 N -0.29 0.00 -1.90 2.57 3.38 -0.82 -2.39 115.31 115.86 3hxz h LEU 247 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hxz h LEU 247 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3hxz h LEU 247 CO -0.04 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.80 3hxz n GLN 248 N -3.69 2.21 -2.86 1.13 6.02 0.10 -4.66 117.38 115.63 3hxz n GLN 248 Ca -0.01 -1.87 -0.18 0.00 -0.01 0.00 0.00 57.00 54.93 3hxz n GLN 248 Cb 0.42 -1.43 0.03 0.00 1.02 0.00 0.00 30.24 30.27 3hxz n GLN 248 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hxz n HIS 249 N 1.03 -1.59 -4.65 1.08 8.25 -0.90 -5.01 115.22 113.44 3hxz n HIS 249 Ca 0.18 0.41 -0.29 0.00 -0.26 0.00 0.00 57.72 57.76 3hxz n HIS 249 Cb 0.46 -3.89 -0.10 0.00 1.12 0.00 0.00 29.99 27.58 3hxz n HIS 249 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3hxz s VAL 250 N -3.06 1.84 -0.20 1.59 -7.23 -0.48 -5.06 120.40 107.80 3hxz s VAL 250 Ca 0.24 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.48 3hxz s VAL 250 Cb -0.10 -2.84 -0.17 0.00 0.56 0.00 0.00 36.38 33.83 3hxz s VAL 250 CO 0.29 0.00 -0.09 0.59 -0.31 0.00 0.00 175.10 175.58 3hxz n ASN 251 N -1.03 1.70 -4.89 4.85 5.03 -1.26 -4.20 115.26 115.46 3hxz n ASN 251 Ca -0.08 -0.07 -0.35 0.00 0.87 0.00 0.00 54.58 54.95 3hxz n ASN 251 Cb 0.67 0.17 -0.05 0.00 -1.02 0.00 0.00 39.78 39.54 3hxz n ASN 251 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3hxz s SER 252 N -5.70 6.45 0.40 6.41 0.15 -1.26 -4.96 113.70 115.18 3hxz s SER 252 Ca -0.21 0.50 0.13 0.00 0.70 0.00 0.00 55.95 57.07 3hxz s SER 252 Cb 0.07 -2.07 0.95 0.00 -1.71 0.00 0.00 66.02 63.26 3hxz s SER 252 CO 0.58 0.31 1.90 0.78 1.20 0.00 0.00 173.24 178.01 3hxz h ASN 253 N 4.27 0.50 0.28 5.45 4.21 -1.50 -1.20 115.58 127.60 3hxz h ASN 253 Ca -0.51 0.03 0.00 0.00 1.21 0.00 0.00 56.30 57.02 3hxz h ASN 253 Cb 1.21 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.33 3hxz h ASN 253 CO 0.64 0.26 0.00 -1.22 -1.29 0.00 0.00 177.43 175.82 3hxz n TYR 254 N -4.51 0.00 1.03 1.19 4.01 -1.26 -2.27 117.16 115.35 3hxz n TYR 254 Ca 0.15 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.01 3hxz n TYR 254 Cb 0.49 -0.19 0.12 0.00 -0.31 0.00 0.00 39.34 39.45 3hxz n TYR 254 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3hxz n ASP 255 N -1.19 2.82 -4.79 7.72 8.00 -0.45 -3.74 116.55 124.91 3hxz n ASP 255 Ca 0.13 -1.92 -0.31 0.00 0.71 0.00 0.00 54.79 53.40 3hxz n ASP 255 Cb 0.14 0.04 0.08 0.00 -0.02 0.00 0.00 41.12 41.36 3hxz n ASP 255 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3hxz s ILE 256 N -2.04 3.53 0.23 0.53 -4.36 -0.96 -4.73 121.20 113.40 3hxz s ILE 256 Ca 0.28 0.50 -0.08 0.00 -0.26 0.00 0.00 60.65 61.09 3hxz s ILE 256 Cb 0.20 -3.15 0.22 0.00 1.25 0.00 0.00 42.46 40.98 3hxz s ILE 256 CO 0.33 -0.65 1.67 -2.24 0.24 0.00 0.00 174.94 174.29 3hxz h ASP 257 N -0.98 -0.12 -0.06 4.36 2.03 -1.93 -0.42 116.42 119.30 3hxz h ASP 257 Ca -0.45 0.15 0.04 0.00 -0.73 0.00 0.00 57.03 56.04 3hxz h ASP 257 Cb 1.23 0.23 -0.05 0.00 -0.83 0.00 0.00 39.33 39.92 3hxz h ASP 257 CO 0.56 -0.08 -0.22 0.25 -1.03 0.00 0.00 179.24 178.72 3hxz h LEU 258 N 0.20 -0.67 -0.45 0.15 6.46 -1.92 -2.51 115.31 116.57 3hxz h LEU 258 Ca 0.38 0.10 -0.16 0.00 -0.12 0.00 0.00 57.88 58.07 3hxz h LEU 258 Cb 0.63 0.29 -0.02 0.00 -0.73 0.00 0.00 40.66 40.82 3hxz h LEU 258 CO -0.52 -0.28 -0.78 -0.26 -0.62 0.00 0.00 178.44 175.98 3hxz h PHE 259 N -0.32 0.02 -0.29 1.25 -1.00 -1.66 -2.44 116.94 112.50 3hxz h PHE 259 Ca 0.08 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.85 3hxz h PHE 259 Cb 0.43 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.97 3hxz h PHE 259 CO -0.29 0.78 0.18 0.00 -1.61 0.00 0.00 178.31 177.37 3hxz h ARG 260 N 0.01 0.40 -0.63 1.51 3.08 -0.96 0.18 114.38 117.97 3hxz h ARG 260 Ca -0.01 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 3hxz h ARG 260 Cb 1.37 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.31 3hxz h ARG 260 CO 0.10 0.31 0.12 1.15 -1.07 0.00 0.00 179.97 180.58 3hxz h THR 261 N 0.37 1.26 -0.40 2.04 2.02 -1.46 -2.33 112.91 114.42 3hxz h THR 261 Ca 0.10 -0.98 -0.09 0.00 0.77 0.00 0.00 66.41 66.21 3hxz h THR 261 Cb 0.01 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3hxz h THR 261 CO -0.02 0.37 -0.12 0.25 0.37 0.00 0.00 175.52 176.37 3hxz h LEU 262 N 0.95 0.79 -0.93 2.58 5.85 -1.17 -2.55 115.31 120.83 3hxz h LEU 262 Ca 0.19 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 3hxz h LEU 262 Cb 0.41 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 3hxz h LEU 262 CO 0.01 0.99 0.22 0.40 -0.34 0.00 0.00 178.44 179.71 3hxz h ILE 263 N 0.59 1.24 -0.91 4.05 2.04 -0.60 -1.23 117.51 122.70 3hxz h ILE 263 Ca 0.10 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.17 3hxz h ILE 263 Cb 0.65 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.18 3hxz h ILE 263 CO 0.04 0.32 0.59 1.56 0.00 0.00 0.00 178.15 180.66 3hxz h GLN 264 N 0.96 1.14 -0.65 2.37 4.20 -1.29 -0.53 115.11 121.32 3hxz h GLN 264 Ca 0.22 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.78 3hxz h GLN 264 Cb 0.26 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 3hxz h GLN 264 CO -0.01 0.75 0.09 0.00 -0.67 0.00 0.00 178.83 178.99 3hxz h ALA 265 N 1.36 0.86 -0.44 3.87 0.00 -0.98 -1.29 119.26 122.64 3hxz h ALA 265 Ca 0.35 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3hxz h ALA 265 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3hxz h ALA 265 CO -0.10 0.63 0.24 0.28 0.00 0.00 0.00 179.25 180.30 3hxz h VAL 266 N 0.99 1.15 -0.70 0.00 2.07 -0.72 -1.84 116.25 117.21 3hxz h VAL 266 Ca 0.19 -0.39 0.02 0.00 0.82 0.00 0.00 66.70 67.34 3hxz h VAL 266 Cb 0.45 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 3hxz h VAL 266 CO 0.02 0.16 0.45 0.00 0.02 0.00 0.00 177.57 178.21 3hxz h ALA 267 N 1.10 0.90 -0.32 1.67 0.00 -0.92 -1.74 119.26 119.94 3hxz h ALA 267 Ca 0.15 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.04 3hxz h ALA 267 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3hxz h ALA 267 CO -0.03 0.25 0.19 -0.22 0.00 0.00 0.00 179.25 179.45 3hxz h LYS 268 N 0.89 0.39 0.00 0.00 3.64 -0.92 0.05 116.57 120.62 3hxz h LYS 268 Ca 0.27 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.59 3hxz h LYS 268 Cb -0.04 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3hxz h LYS 268 CO -0.08 0.26 -0.23 -0.39 -2.27 0.00 0.00 179.45 176.73 3hxz h VAL 269 N 0.40 0.26 0.00 2.00 -1.51 -1.15 -3.25 116.25 113.00 3hxz h VAL 269 Ca 0.12 -1.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 3hxz h VAL 269 Cb -0.01 2.10 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 3hxz h VAL 269 CO -0.05 0.15 -1.51 0.35 -1.23 0.00 0.00 177.57 175.28 3hxz n THR 270 N -3.11 0.23 -0.85 7.19 -2.24 -0.67 -4.84 114.28 109.99 3hxz n THR 270 Ca 0.03 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3hxz n THR 270 Cb 0.60 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 3hxz n THR 270 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hxz n GLY 271 N 1.26 0.54 3.80 3.38 0.00 -0.05 -3.35 105.19 110.77 3hxz n GLY 271 Ca -0.02 -0.29 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 3hxz n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hxz s ALA 272 N -2.00 2.89 -0.02 4.61 0.00 -0.88 -4.98 121.76 121.37 3hxz s ALA 272 Ca 0.00 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.56 3hxz s ALA 272 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 3hxz s ALA 272 CO 0.00 -0.28 0.03 0.25 0.00 0.00 0.00 175.76 175.75 3hxz n THR 273 N -0.98 0.16 -2.68 0.00 -2.24 -1.26 -4.62 114.28 102.67 3hxz n THR 273 Ca 0.09 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 3hxz n THR 273 Cb 0.53 -0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 68.12 3hxz n THR 273 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hxz s ASP 274 N -3.15 6.17 0.00 3.42 2.15 -1.26 -4.88 116.67 119.13 3hxz s ASP 274 Ca -0.01 -0.69 0.12 0.00 0.43 0.00 0.00 52.55 52.40 3hxz s ASP 274 Cb 0.01 -2.50 0.74 0.00 -0.30 0.00 0.00 42.92 40.87 3hxz s ASP 274 CO 0.13 -1.67 1.20 0.18 -0.17 0.00 0.00 175.17 174.83 3hxz n LEU 275 N 8.68 0.00 -0.14 -1.34 4.77 -1.26 -2.54 117.00 125.17 3hxz n LEU 275 Ca 0.01 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.07 3hxz n LEU 275 Cb 0.48 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.50 3hxz n LEU 275 CO 0.68 0.00 0.07 -1.54 -1.33 0.00 0.00 177.39 175.27 3hxz n SER 276 N -0.84 1.14 -4.73 -1.43 3.41 -1.26 -4.97 113.62 104.94 3hxz n SER 276 Ca 0.09 -1.07 -0.42 0.00 -0.26 0.00 0.00 58.87 57.22 3hxz n SER 276 Cb 0.04 0.82 -0.03 0.00 -0.26 0.00 0.00 64.21 64.79 3hxz n SER 276 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3hxz s ASN 277 N -2.46 6.54 0.55 4.04 3.84 -1.05 -4.89 114.94 121.50 3hxz s ASN 277 Ca 0.09 2.72 0.32 0.00 0.21 0.00 0.00 52.86 56.20 3hxz s ASN 277 Cb 0.14 -2.61 1.54 0.00 -0.55 0.00 0.00 41.25 39.77 3hxz s ASN 277 CO 0.63 -0.82 2.07 0.07 -2.79 0.00 0.00 177.10 176.26 3hxz h LYS 278 N 5.90 0.00 0.00 0.43 2.10 -1.92 -2.40 116.57 120.68 3hxz h LYS 278 Ca -0.44 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.15 3hxz h LYS 278 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 3hxz h LYS 278 CO 0.85 0.08 -0.26 0.77 -2.00 0.00 0.00 179.45 178.89 3hxz h SER 279 N 0.00 0.00 -0.57 7.07 0.02 -1.94 -1.04 113.55 117.10 3hxz h SER 279 Ca -0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 3hxz h SER 279 Cb 0.37 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 3hxz h SER 279 CO 0.01 0.26 0.06 -0.07 -1.14 0.00 0.00 176.83 175.95 3hxz h LEU 280 N 0.00 0.96 -0.38 5.07 3.38 -1.80 -1.45 115.31 121.10 3hxz h LEU 280 Ca -0.00 -0.24 -0.18 0.00 0.09 0.00 0.00 57.88 57.55 3hxz h LEU 280 Cb 0.48 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3hxz h LEU 280 CO 0.03 0.98 -0.58 0.03 0.09 0.00 0.00 178.44 179.00 3hxz h ARG 281 N 0.93 0.73 -0.29 1.13 3.08 -1.47 -1.85 114.38 116.64 3hxz h ARG 281 Ca 0.18 -0.48 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3hxz h ARG 281 Cb 0.46 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 3hxz h ARG 281 CO 0.02 1.10 0.14 0.28 -1.07 0.00 0.00 179.97 180.44 3hxz h VAL 282 N 0.55 1.15 -0.57 2.04 2.07 -1.10 -1.72 116.25 118.67 3hxz h VAL 282 Ca 0.00 -0.42 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 3hxz h VAL 282 Cb 1.16 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 3hxz h VAL 282 CO 0.12 0.15 0.03 0.40 0.02 0.00 0.00 177.57 178.29 3hxz h ILE 283 N 0.33 1.26 -0.87 4.57 2.04 -1.25 -0.01 117.51 123.58 3hxz h ILE 283 Ca 0.10 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.91 3hxz h ILE 283 Cb 0.11 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 3hxz h ILE 283 CO -0.01 0.39 0.56 0.00 0.00 0.00 0.00 178.15 179.09 3hxz h ALA 284 N 0.98 1.15 -0.36 1.87 0.00 -1.26 -0.91 119.26 120.72 3hxz h ALA 284 Ca 0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3hxz h ALA 284 Cb 0.51 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3hxz h ALA 284 CO 0.02 0.41 -0.01 0.22 0.00 0.00 0.00 179.25 179.89 3hxz h ASP 285 N 1.09 0.63 0.04 0.00 3.58 -0.98 -3.28 116.42 117.50 3hxz h ASP 285 Ca 0.35 -0.31 -0.12 0.00 0.42 0.00 0.00 57.03 57.37 3hxz h ASP 285 Cb 0.01 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 3hxz h ASP 285 CO -0.12 0.79 -0.38 0.45 -2.88 0.00 0.00 179.24 177.11 3hxz h HIS 286 N 0.46 0.53 -0.35 0.28 3.86 -0.51 -2.54 115.15 116.87 3hxz h HIS 286 Ca 0.10 -0.14 -0.05 0.00 -1.16 0.00 0.00 60.37 59.12 3hxz h HIS 286 Cb 0.48 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.81 3hxz h HIS 286 CO 0.04 0.77 0.00 0.97 0.86 0.00 0.00 177.93 180.57 3hxz h ILE 287 N 0.38 1.20 0.29 2.45 6.09 -1.26 -0.35 117.51 126.31 3hxz h ILE 287 Ca 0.04 -0.79 -0.01 0.00 -1.37 0.00 0.00 64.86 62.72 3hxz h ILE 287 Cb 0.84 0.93 0.00 0.00 0.47 0.00 0.00 36.82 39.06 3hxz h ILE 287 CO 0.07 0.27 -0.14 0.03 -3.07 0.00 0.00 178.15 175.31 3hxz h ARG 288 N 0.52 -0.38 -0.27 2.19 3.08 -1.52 -0.14 114.38 117.86 3hxz h ARG 288 Ca 0.11 0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3hxz h ARG 288 Cb 0.33 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 3hxz h ARG 288 CO 0.01 -0.14 0.10 0.66 -1.07 0.00 0.00 179.97 179.54 3hxz h SER 289 N -0.57 0.39 0.05 7.04 4.64 -1.43 -2.55 113.55 121.11 3hxz h SER 289 Ca -0.04 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3hxz h SER 289 Cb 0.42 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3hxz h SER 289 CO 0.07 0.46 -0.02 0.00 -0.87 0.00 0.00 176.83 176.46 3hxz h ALA 291 N 0.73 0.65 -0.25 0.00 0.00 -1.07 -2.24 119.26 117.08 3hxz h ALA 291 Ca -0.01 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 3hxz h ALA 291 Cb 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hxz h ALA 291 CO 0.01 0.27 -0.44 0.74 0.00 0.00 0.00 179.25 179.84 3hxz h PHE 292 N 0.67 0.75 -0.61 0.00 0.04 -1.46 -1.39 116.94 114.94 3hxz h PHE 292 Ca 0.17 -0.23 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 3hxz h PHE 292 Cb 0.22 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.18 3hxz h PHE 292 CO 0.01 0.95 0.29 -0.07 -0.60 0.00 0.00 178.31 178.89 3hxz h LEU 293 N 0.50 0.80 -0.55 1.54 3.38 -1.08 -0.83 115.31 119.08 3hxz h LEU 293 Ca 0.04 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3hxz h LEU 293 Cb 0.96 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 3hxz h LEU 293 CO 0.09 0.71 0.08 0.40 0.09 0.00 0.00 178.44 179.80 3hxz h ILE 294 N 0.84 1.26 -0.38 1.22 2.04 -1.32 -1.04 117.51 120.12 3hxz h ILE 294 Ca 0.21 -0.98 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 3hxz h ILE 294 Cb 0.12 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3hxz h ILE 294 CO -0.03 0.36 0.23 0.00 0.00 0.00 0.00 178.15 178.71 3hxz h ALA 295 N 0.99 1.70 -0.36 1.87 0.00 -1.00 -1.66 119.26 120.80 3hxz h ALA 295 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hxz h ALA 295 Cb 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hxz h ALA 295 CO 0.01 0.27 0.00 -0.25 0.00 0.00 0.00 179.25 179.28 3hxz n ASP 296 N -4.46 1.96 0.00 0.00 8.00 -0.34 -4.91 116.55 116.80 3hxz n ASP 296 Ca 0.03 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.54 3hxz n ASP 296 Cb 0.07 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 3hxz n ASP 296 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hxz n GLY 297 N 1.09 0.76 3.73 0.44 0.00 -0.62 -4.66 105.19 105.92 3hxz n GLY 297 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3hxz n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hxz s VAL 298 N -2.00 4.73 -0.06 1.61 1.01 -0.44 -4.99 120.40 120.26 3hxz s VAL 298 Ca 0.00 1.89 0.04 0.00 0.00 0.00 0.00 61.98 63.91 3hxz s VAL 298 Cb 0.00 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 3hxz s VAL 298 CO 0.00 0.28 -0.16 -0.04 0.00 0.00 0.00 175.10 175.17 3hxz s MET 299 N 0.36 2.55 0.35 2.72 -1.94 -1.26 -4.13 119.30 117.96 3hxz s MET 299 Ca 0.45 -0.74 -0.28 0.00 -1.71 0.00 0.00 55.69 53.41 3hxz s MET 299 Cb -0.21 -2.35 -0.12 0.00 2.01 0.00 0.00 34.83 34.16 3hxz s MET 299 CO 0.26 0.55 1.31 -2.30 -0.01 0.00 0.00 175.02 174.83 3hxz n PRO 300 N 2.51 2.16 -1.93 2.03 -0.02 -1.26 -4.13 135.00 134.35 3hxz n PRO 300 Ca -0.17 0.76 -0.02 0.00 -2.02 0.00 0.00 63.50 62.05 3hxz n PRO 300 Cb 0.52 -2.37 0.01 0.00 -0.02 0.00 0.00 33.50 31.64 3hxz n PRO 300 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3hxz n SER 301 N 0.67 -0.62 -1.20 2.55 3.41 -0.85 -4.95 113.62 112.63 3hxz n SER 301 Ca 0.04 -1.40 0.08 0.00 -0.26 0.00 0.00 58.87 57.34 3hxz n SER 301 Cb 0.37 1.03 0.30 0.00 -0.26 0.00 0.00 64.21 65.64 3hxz n SER 301 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3hxz n ASN 302 N -1.03 4.32 -3.94 4.04 3.02 -1.26 -2.98 115.26 117.43 3hxz n ASN 302 Ca -0.02 -2.76 -0.11 0.00 -0.03 0.00 0.00 54.58 51.66 3hxz n ASN 302 Cb 0.17 -0.54 -0.12 0.00 -0.61 0.00 0.00 39.78 38.68 3hxz n ASN 302 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 3hxz s GLU 303 N -2.40 0.20 2.85 3.52 -1.05 -1.26 -4.82 118.70 115.74 3hxz s GLU 303 Ca 0.44 -0.34 0.00 0.00 -0.15 0.00 0.00 54.97 54.91 3hxz s GLU 303 Cb 0.33 0.01 0.00 0.00 -0.44 0.00 0.00 34.13 34.03 3hxz s GLU 303 CO 0.14 -0.01 0.00 0.09 0.95 0.00 0.00 175.26 176.43 3hxz n ASN 304 N 2.28 0.00 -0.24 0.83 3.02 -1.26 -2.12 115.26 117.76 3hxz n ASN 304 Ca -0.18 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.30 3hxz n ASN 304 Cb 0.57 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.79 3hxz n ASN 304 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 3hxz h ARG 305 N 0.00 0.96 -0.36 3.52 3.08 -1.95 -2.53 114.38 117.10 3hxz h ARG 305 Ca 0.00 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 59.94 3hxz h ARG 305 Cb 0.00 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 3hxz h ARG 305 CO 0.00 0.76 0.24 0.78 -1.07 0.00 0.00 179.97 180.68 3hxz h GLY 306 N 0.93 0.44 1.55 0.04 0.00 -1.58 -2.29 103.07 102.16 3hxz h GLY 306 Ca 0.23 -0.15 -0.24 0.00 0.00 0.00 0.00 47.33 47.17 3hxz h GLY 306 CO -0.03 0.14 -1.01 -1.82 0.00 0.00 0.00 176.54 173.82 3hxz h TYR 307 N 0.39 0.60 -0.48 5.60 3.20 -1.02 -0.73 116.97 124.53 3hxz h TYR 307 Ca 0.14 -0.35 -0.00 0.00 3.14 0.00 0.00 58.73 61.66 3hxz h TYR 307 Cb 0.09 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 3hxz h TYR 307 CO -0.00 1.19 0.29 0.28 -1.64 0.00 0.00 178.16 178.28 3hxz h VAL 308 N 0.20 1.15 -0.10 1.81 2.07 -1.22 0.53 116.25 120.69 3hxz h VAL 308 Ca -0.09 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.09 3hxz h VAL 308 Cb 1.66 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 3hxz h VAL 308 CO 0.17 0.15 0.07 0.25 0.02 0.00 0.00 177.57 178.23 3hxz h LEU 309 N 0.65 0.12 -0.65 2.57 5.85 -1.39 -1.81 115.31 120.65 3hxz h LEU 309 Ca 0.17 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.94 3hxz h LEU 309 Cb -0.01 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 40.93 3hxz h LEU 309 CO -0.03 0.11 0.33 -0.09 -0.34 0.00 0.00 178.44 178.42 3hxz h ARG 310 N 0.12 0.58 -0.40 1.25 2.43 -0.92 -0.45 114.38 117.00 3hxz h ARG 310 Ca 0.04 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3hxz h ARG 310 Cb 0.01 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 3hxz h ARG 310 CO -0.01 0.38 0.23 0.00 -1.51 0.00 0.00 179.97 179.07 3hxz h ARG 311 N 0.60 0.45 -0.35 0.20 3.08 -0.63 -0.50 114.38 117.23 3hxz h ARG 311 Ca 0.30 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.24 3hxz h ARG 311 Cb 0.26 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3hxz h ARG 311 CO -0.22 0.30 -0.12 0.82 -1.07 0.00 0.00 179.97 179.68 3hxz h ILE 312 N 0.46 1.28 -0.25 2.04 2.04 -0.90 -1.59 117.51 120.60 3hxz h ILE 312 Ca 0.16 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 64.85 3hxz h ILE 312 Cb 0.01 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 3hxz h ILE 312 CO -0.08 0.39 0.05 0.40 0.00 0.00 0.00 178.15 178.91 3hxz h ILE 313 N 0.47 0.89 -0.32 -0.67 2.04 -0.89 -1.38 117.51 117.65 3hxz h ILE 313 Ca 0.08 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 65.80 3hxz h ILE 313 Cb 0.63 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3hxz h ILE 313 CO 0.04 0.03 -0.21 0.03 0.00 0.00 0.00 178.15 178.04 3hxz h ARG 314 N 0.14 0.60 -0.57 2.37 3.08 -1.03 -1.07 114.38 117.91 3hxz h ARG 314 Ca 0.11 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 3hxz h ARG 314 Cb 0.11 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3hxz h ARG 314 CO -0.15 0.77 0.11 0.00 -1.07 0.00 0.00 179.97 179.63 3hxz h ARG 315 N 0.54 0.91 -0.36 0.04 3.08 -1.10 -1.01 114.38 116.47 3hxz h ARG 315 Ca 0.08 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 3hxz h ARG 315 Cb 0.65 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 3hxz h ARG 315 CO 0.05 0.83 0.08 0.00 -1.07 0.00 0.00 179.97 179.86 3hxz h ALA 316 N 1.25 0.48 -0.82 0.04 0.00 -0.65 -1.78 119.26 117.78 3hxz h ALA 316 Ca 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hxz h ALA 316 Cb 0.36 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3hxz h ALA 316 CO 0.01 0.16 0.49 0.28 0.00 0.00 0.00 179.25 180.18 3hxz h VAL 317 N 0.44 1.23 -0.25 0.00 2.07 -1.06 -1.25 116.25 117.43 3hxz h VAL 317 Ca 0.11 -0.52 0.02 0.00 0.82 0.00 0.00 66.70 67.13 3hxz h VAL 317 Cb 0.32 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3hxz h VAL 317 CO 0.00 0.24 0.11 -0.09 0.02 0.00 0.00 177.57 177.85 3hxz h ARG 318 N 1.13 0.23 -0.76 1.57 1.12 -0.97 -0.47 114.38 116.23 3hxz h ARG 318 Ca 0.29 -0.01 0.03 0.00 -1.11 0.00 0.00 59.98 59.18 3hxz h ARG 318 Cb -0.03 -0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 29.84 3hxz h ARG 318 CO -0.05 0.15 0.50 0.45 -3.11 0.00 0.00 179.97 177.91 3hxz h HIS 319 N 0.23 0.90 -0.70 2.20 3.86 -0.99 -1.04 115.15 119.61 3hxz h HIS 319 Ca 0.11 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3hxz h HIS 319 Cb 0.05 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.19 3hxz h HIS 319 CO -0.11 0.53 0.36 0.78 0.86 0.00 0.00 177.93 180.35 3hxz h GLY 320 N 0.94 1.06 1.09 2.45 0.00 -0.48 -2.06 103.07 106.08 3hxz h GLY 320 Ca 0.30 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 3hxz h GLY 320 CO -0.08 0.47 0.09 -0.57 0.00 0.00 0.00 176.54 176.44 3hxz h ASN 321 N 0.99 1.07 -0.13 0.19 -0.73 0.10 -0.93 115.58 116.14 3hxz h ASN 321 Ca 0.25 -0.27 -0.05 0.00 1.87 0.00 0.00 56.30 58.10 3hxz h ASN 321 Cb 0.07 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.36 3hxz h ASN 321 CO -0.04 1.07 -0.05 -0.03 -0.37 0.00 0.00 177.43 178.02 3hxz h MET 322 N 1.03 0.39 0.00 6.67 4.05 -0.88 -1.85 114.93 124.35 3hxz h MET 322 Ca 0.20 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.54 3hxz h MET 322 Cb 0.47 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 3hxz h MET 322 CO 0.02 0.46 0.00 1.28 0.23 0.00 0.00 176.91 178.90 3hxz n LEU 323 N -4.29 0.26 0.00 3.39 4.77 -0.81 -4.93 117.00 115.40 3hxz n LEU 323 Ca 0.01 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3hxz n LEU 323 Cb 0.25 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 3hxz n LEU 323 CO 0.38 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3hxz n GLY 324 N 1.31 1.35 3.70 -0.72 0.00 -0.69 -4.52 105.19 105.62 3hxz n GLY 324 Ca 0.06 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3hxz n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hxz n ALA 325 N -1.08 2.41 0.55 4.61 0.00 -0.41 -4.85 120.51 121.74 3hxz n ALA 325 Ca 0.00 0.35 0.11 0.00 0.00 0.00 0.00 53.44 53.90 3hxz n ALA 325 Cb 0.09 -2.56 -0.03 0.00 0.00 0.00 0.00 19.45 16.95 3hxz n ALA 325 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hxz n LYS 326 N 4.93 0.30 -4.01 0.00 4.01 -1.26 -4.79 118.16 117.34 3hxz n LYS 326 Ca 0.17 -0.03 -0.09 0.00 -0.51 0.00 0.00 58.31 57.85 3hxz n LYS 326 Cb 0.36 -1.57 -0.08 0.00 -0.51 0.00 0.00 35.03 33.23 3hxz n LYS 326 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 3hxz s GLU 327 N -3.21 0.99 -0.15 1.97 -1.05 -1.26 -5.11 118.70 110.87 3hxz s GLU 327 Ca 0.03 -1.22 -0.39 0.00 -0.15 0.00 0.00 54.97 53.24 3hxz s GLU 327 Cb 0.15 0.32 -0.16 0.00 -0.44 0.00 0.00 34.13 33.99 3hxz s GLU 327 CO 0.83 -0.32 1.58 2.41 0.95 0.00 0.00 175.26 180.71 3hxz n THR 328 N -0.12 0.18 0.00 1.83 -1.04 -1.26 -4.84 114.28 109.02 3hxz n THR 328 Ca -0.09 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 3hxz n THR 328 Cb 0.63 -1.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 3hxz n THR 328 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 3hxz n PHE 329 N 4.23 0.00 -0.35 -1.42 1.16 -1.26 -4.89 117.46 114.93 3hxz n PHE 329 Ca 0.24 0.00 -0.03 0.00 -1.87 0.00 0.00 57.45 55.79 3hxz n PHE 329 Cb 0.14 0.00 0.09 0.00 -1.61 0.00 0.00 39.48 38.11 3hxz n PHE 329 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 3hxz h PHE 330 N 0.00 1.20 0.00 2.97 3.57 -1.92 -0.93 116.94 121.83 3hxz h PHE 330 Ca 0.00 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 3hxz h PHE 330 Cb 0.53 -0.40 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 3hxz h PHE 330 CO 0.00 0.78 -0.04 0.10 -2.23 0.00 0.00 178.31 176.92 3hxz h TYR 331 N 1.27 0.00 0.00 0.41 -0.00 -1.87 -2.51 116.97 114.28 3hxz h TYR 331 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.07 3hxz h TYR 331 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.63 3hxz h TYR 331 CO -0.00 0.04 0.00 1.63 -0.00 0.00 0.00 178.16 179.83 3hxz n LYS 332 N -3.21 0.12 0.00 0.10 5.02 -0.35 -2.79 118.16 117.04 3hxz n LYS 332 Ca -0.01 0.16 0.12 0.00 -2.02 0.00 0.00 58.31 56.55 3hxz n LYS 332 Cb 0.23 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 33.94 3hxz n LYS 332 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3hxz n LEU 333 N -1.40 0.87 -0.21 -0.35 4.77 -0.94 -4.18 117.00 115.55 3hxz n LEU 333 Ca 0.06 -0.23 -0.07 0.00 -0.03 0.00 0.00 56.01 55.74 3hxz n LEU 333 Cb 0.18 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.15 3hxz n LEU 333 CO 0.16 0.19 1.01 0.58 -1.33 0.00 0.00 177.39 178.00 3hxz h VAL 334 N 0.55 1.22 0.77 4.08 2.07 -1.71 -1.15 116.25 122.09 3hxz h VAL 334 Ca 0.00 -0.63 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 3hxz h VAL 334 Cb 0.53 0.53 0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3hxz h VAL 334 CO 0.00 0.25 -0.38 1.23 0.02 0.00 0.00 177.57 178.69 3hxz h GLY 335 N 0.81 -1.11 0.09 2.17 0.00 -1.81 -1.49 103.07 101.74 3hxz h GLY 335 Ca 0.20 0.42 0.21 0.00 0.00 0.00 0.00 47.33 48.16 3hxz h GLY 335 CO -0.02 -0.40 0.62 -2.55 0.00 0.00 0.00 176.54 174.18 3hxz h PRO 336 N -1.06 0.63 -0.31 4.80 0.11 -1.77 -1.95 132.00 132.45 3hxz h PRO 336 Ca -0.10 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.94 3hxz h PRO 336 Cb 0.82 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 3hxz h PRO 336 CO 0.16 0.42 0.07 1.25 -0.21 0.00 0.00 178.00 179.69 3hxz h LEU 337 N 0.65 0.47 -1.03 2.35 5.85 -0.93 -2.72 115.31 119.95 3hxz h LEU 337 Ca 0.57 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 59.11 3hxz h LEU 337 Cb 1.05 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 3hxz h LEU 337 CO -0.35 0.58 0.65 0.40 -0.34 0.00 0.00 178.44 179.38 3hxz h ILE 338 N 0.34 1.14 0.00 4.05 2.04 -0.76 -2.39 117.51 121.92 3hxz h ILE 338 Ca 0.10 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 3hxz h ILE 338 Cb 0.30 -0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.19 3hxz h ILE 338 CO 0.00 0.22 -0.10 0.44 0.00 0.00 0.00 178.15 178.72 3hxz h ASP 339 N 1.22 0.00 -0.00 1.72 3.32 -1.07 -2.95 116.42 118.65 3hxz h ASP 339 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 3hxz h ASP 339 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3hxz h ASP 339 CO -0.14 0.10 -0.89 1.33 -1.72 0.00 0.00 179.24 177.92 3hxz n VAL 340 N -3.50 0.00 0.81 -1.35 0.24 -0.94 -4.53 118.33 109.06 3hxz n VAL 340 Ca -0.02 -0.06 0.12 0.00 -2.04 0.00 0.00 64.34 62.35 3hxz n VAL 340 Cb 0.24 1.01 0.22 0.00 -1.47 0.00 0.00 33.84 33.83 3hxz n VAL 340 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 3hxz n MET 341 N -1.41 0.13 0.00 7.34 2.81 -0.98 -4.89 117.12 120.12 3hxz n MET 341 Ca 0.04 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 3hxz n MET 341 Cb 0.30 -1.57 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 3hxz n MET 341 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3hxz n GLY 342 N 1.43 2.84 0.29 3.03 0.00 -1.25 -2.08 105.19 109.46 3hxz n GLY 342 Ca 0.04 -0.33 0.19 0.00 0.00 0.00 0.00 46.02 45.92 3hxz n GLY 342 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hxz h SER 343 N 8.16 0.00 0.62 1.61 4.64 -1.95 -2.42 113.55 124.21 3hxz h SER 343 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hxz h SER 343 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3hxz h SER 343 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3hxz n ALA 344 N -2.09 1.87 0.04 5.18 0.00 -0.88 -2.67 120.51 121.96 3hxz n ALA 344 Ca -0.00 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.48 3hxz n ALA 344 Cb 0.25 -1.30 0.24 0.00 0.00 0.00 0.00 19.45 18.64 3hxz n ALA 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hxz n GLY 345 N 0.42 2.01 0.27 0.00 0.00 -0.91 -4.67 105.19 102.31 3hxz n GLY 345 Ca 0.05 -0.71 0.03 0.00 0.00 0.00 0.00 46.02 45.38 3hxz n GLY 345 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3hxz h GLU 346 N 4.14 0.04 0.00 1.61 5.08 -1.66 0.36 114.58 124.15 3hxz h GLU 346 Ca 0.00 -0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3hxz h GLU 346 Cb 0.95 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 3hxz h GLU 346 CO 0.00 0.03 -0.41 -0.44 -1.00 0.00 0.00 179.01 177.19 3hxz h ASP 347 N 0.04 0.00 -0.04 1.42 3.32 -1.87 -1.75 116.42 117.55 3hxz h ASP 347 Ca 0.38 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.28 3hxz h ASP 347 Cb 0.62 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.18 3hxz h ASP 347 CO -0.70 0.41 -0.57 0.25 -1.72 0.00 0.00 179.24 176.91 3hxz h LEU 348 N 0.00 0.56 -0.72 1.55 5.85 -1.47 -3.19 115.31 117.90 3hxz h LEU 348 Ca -0.00 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.01 3hxz h LEU 348 Cb 0.77 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 3hxz h LEU 348 CO 0.05 1.20 0.47 0.50 -0.34 0.00 0.00 178.44 180.32 3hxz h LYS 349 N -0.02 0.95 -0.48 1.25 3.64 -0.80 -0.58 116.57 120.53 3hxz h LYS 349 Ca -0.06 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.34 3hxz h LYS 349 Cb 1.25 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.83 3hxz h LYS 349 CO 0.11 0.64 0.33 -0.09 -2.27 0.00 0.00 179.45 178.17 3hxz h ARG 350 N 0.97 0.29 -0.16 1.90 2.43 -1.41 -2.76 114.38 115.64 3hxz h ARG 350 Ca 0.26 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.35 3hxz h ARG 350 Cb -0.10 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.35 3hxz h ARG 350 CO -0.06 0.19 -0.20 1.04 -1.51 0.00 0.00 179.97 179.43 3hxz n GLN 351 N -4.46 1.78 -0.06 0.20 6.02 -0.73 -4.85 117.38 115.28 3hxz n GLN 351 Ca 0.07 -3.09 -0.08 0.00 -0.01 0.00 0.00 57.00 53.89 3hxz n GLN 351 Cb 0.34 -1.70 -0.02 0.00 1.02 0.00 0.00 30.24 29.88 3hxz n GLN 351 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 3hxz h GLN 352 N 0.92 -0.27 -0.53 -1.09 4.15 -0.83 -0.83 115.11 116.64 3hxz h GLN 352 Ca 0.08 0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.54 3hxz h GLN 352 Cb 1.30 0.06 -0.03 0.00 0.21 0.00 0.00 27.48 29.01 3hxz h GLN 352 CO 0.17 -0.18 0.33 0.00 -1.93 0.00 0.00 178.83 177.22 3hxz h ALA 353 N 0.71 0.68 -0.25 3.38 0.00 -1.88 -0.50 119.26 121.41 3hxz h ALA 353 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hxz h ALA 353 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3hxz h ALA 353 CO -0.42 0.06 0.16 0.37 0.00 0.00 0.00 179.25 179.41 3hxz h GLN 354 N 0.66 0.33 -0.49 0.00 4.15 -1.81 -1.92 115.11 116.03 3hxz h GLN 354 Ca 0.21 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 3hxz h GLN 354 Cb -0.01 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 3hxz h GLN 354 CO -0.08 0.24 0.22 0.28 -1.93 0.00 0.00 178.83 177.56 3hxz h VAL 355 N 0.33 1.20 -0.47 2.39 2.07 -0.83 -2.34 116.25 118.60 3hxz h VAL 355 Ca 0.09 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.06 3hxz h VAL 355 Cb -0.02 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 3hxz h VAL 355 CO -0.02 0.23 0.22 -0.33 0.02 0.00 0.00 177.57 177.69 3hxz h GLU 356 N 0.65 0.42 -0.42 1.57 5.08 -0.92 -2.00 114.58 118.96 3hxz h GLU 356 Ca 0.17 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3hxz h GLU 356 Cb 0.16 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3hxz h GLU 356 CO -0.02 0.28 0.25 0.37 -1.00 0.00 0.00 179.01 178.89 3hxz h GLN 357 N 0.43 0.58 -0.28 2.33 -0.00 -1.17 -0.24 115.11 116.76 3hxz h GLN 357 Ca 0.21 -0.06 0.02 0.00 -0.00 0.00 0.00 58.65 58.82 3hxz h GLN 357 Cb 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 27.48 27.49 3hxz h GLN 357 CO -0.17 0.43 0.14 0.28 0.00 0.00 0.00 178.83 179.52 3hxz h VAL 358 N 0.56 1.00 -0.43 2.39 2.07 -1.17 -0.36 116.25 120.31 3hxz h VAL 358 Ca 0.15 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.47 3hxz h VAL 358 Cb 0.01 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 3hxz h VAL 358 CO -0.03 0.05 -0.12 -0.07 0.02 0.00 0.00 177.57 177.43 3hxz h LEU 359 N 0.30 0.76 -0.06 2.57 3.38 -1.17 -1.54 115.31 119.55 3hxz h LEU 359 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3hxz h LEU 359 Cb 0.02 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3hxz h LEU 359 CO -0.07 0.90 0.01 0.50 0.09 0.00 0.00 178.44 179.88 3hxz h LYS 360 N 0.70 0.10 -0.57 1.13 3.64 -0.79 -1.82 116.57 118.96 3hxz h LYS 360 Ca 0.12 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.49 3hxz h LYS 360 Cb 0.60 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 3hxz h LYS 360 CO 0.04 0.30 0.36 1.15 -2.27 0.00 0.00 179.45 179.03 3hxz h THR 361 N -0.13 1.10 -0.62 1.00 2.02 -0.99 -1.07 112.91 114.23 3hxz h THR 361 Ca 0.02 -0.25 -0.05 0.00 0.77 0.00 0.00 66.41 66.90 3hxz h THR 361 Cb 0.25 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 3hxz h THR 361 CO 0.00 0.13 0.19 -0.08 0.37 0.00 0.00 175.52 176.14 3hxz h GLU 362 N 0.72 0.96 -0.34 6.66 4.57 -1.22 -0.44 114.58 125.48 3hxz h GLU 362 Ca 0.22 -0.21 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 3hxz h GLU 362 Cb -0.03 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 3hxz h GLU 362 CO -0.07 0.85 -0.05 1.49 -1.18 0.00 0.00 179.01 180.04 3hxz h GLU 363 N 0.89 0.64 -0.78 1.92 4.81 -1.12 -1.64 114.58 119.30 3hxz h GLU 363 Ca 0.20 -0.23 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3hxz h GLU 363 Cb 0.29 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 3hxz h GLU 363 CO -0.01 0.79 0.50 0.93 -0.73 0.00 0.00 179.01 180.49 3hxz h GLU 364 N 0.43 0.94 -0.57 1.92 5.08 -1.05 0.55 114.58 121.88 3hxz h GLU 364 Ca 0.09 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3hxz h GLU 364 Cb 0.54 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 3hxz h GLU 364 CO 0.03 0.62 0.27 0.37 -1.00 0.00 0.00 179.01 179.30 3hxz h GLN 365 N 0.97 0.83 -0.10 2.33 5.75 -0.95 -2.91 115.11 121.03 3hxz h GLN 365 Ca 0.31 -0.12 -0.13 0.00 -0.15 0.00 0.00 58.65 58.56 3hxz h GLN 365 Cb 0.00 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.39 3hxz h GLN 365 CO -0.11 0.68 -0.51 0.35 -2.65 0.00 0.00 178.83 176.59 3hxz h PHE 366 N 0.78 0.32 0.00 3.99 3.57 -0.88 -2.94 116.94 121.78 3hxz h PHE 366 Ca 0.20 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 3hxz h PHE 366 Cb 0.12 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 3hxz h PHE 366 CO -0.00 0.72 -0.00 0.00 -2.23 0.00 0.00 178.31 176.80 3hxz h ALA 367 N 1.26 1.05 0.00 2.41 0.00 -0.70 -0.24 119.26 123.04 3hxz h ALA 367 Ca 0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3hxz h ALA 367 Cb 0.97 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3hxz h ALA 367 CO 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 179.25 179.31 3hxz h ARG 368 N 0.00 0.00 0.00 0.00 3.08 -1.49 -3.31 114.38 112.66 3hxz h ARG 368 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3hxz h ARG 368 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 3hxz h ARG 368 CO 0.00 0.03 -0.11 0.25 -1.07 0.00 0.00 179.97 179.07 3hxz n THR 369 N -3.68 0.00 0.37 2.04 -2.24 -0.43 -4.90 114.28 105.45 3hxz n THR 369 Ca -0.03 -0.17 -0.18 0.00 -2.27 0.00 0.00 64.05 61.40 3hxz n THR 369 Cb 0.12 0.81 -0.09 0.00 -2.10 0.00 0.00 70.33 69.07 3hxz n THR 369 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3hxz h LEU 370 N 0.00 -1.02 -0.83 3.22 5.85 -1.19 0.74 115.31 122.09 3hxz h LEU 370 Ca 0.00 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3hxz h LEU 370 Cb 0.00 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 3hxz h LEU 370 CO 0.00 -0.63 0.39 -0.33 -0.34 0.00 0.00 178.44 177.52 3hxz h GLU 371 N -1.01 1.20 -0.63 1.25 5.08 -1.87 -0.13 114.58 118.47 3hxz h GLU 371 Ca -0.09 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.05 3hxz h GLU 371 Cb 0.82 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 3hxz h GLU 371 CO 0.09 0.93 0.23 0.00 -1.00 0.00 0.00 179.01 179.26 3hxz h ARG 372 N 1.18 0.96 -0.55 2.33 3.08 -1.88 -0.39 114.38 119.10 3hxz h ARG 372 Ca 0.28 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 3hxz h ARG 372 Cb 0.13 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3hxz h ARG 372 CO -0.03 0.82 -0.02 0.78 -1.07 0.00 0.00 179.97 180.45 3hxz h GLY 373 N 0.89 1.05 1.29 0.04 0.00 -0.48 -1.70 103.07 104.15 3hxz h GLY 373 Ca 0.21 -0.76 -0.08 0.00 0.00 0.00 0.00 47.33 46.69 3hxz h GLY 373 CO -0.01 0.70 -0.03 1.41 0.00 0.00 0.00 176.54 178.61 3hxz h LEU 374 N 0.89 0.83 -0.34 3.11 3.38 -0.77 -0.58 115.31 121.83 3hxz h LEU 374 Ca 0.16 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3hxz h LEU 374 Cb 0.55 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 3hxz h LEU 374 CO 0.03 0.91 0.20 0.00 0.09 0.00 0.00 178.44 179.67 3hxz h ALA 375 N 1.18 0.43 -0.31 1.53 0.00 -0.80 0.62 119.26 121.90 3hxz h ALA 375 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3hxz h ALA 375 Cb 0.51 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hxz h ALA 375 CO 0.03 -0.06 0.20 1.25 0.00 0.00 0.00 179.25 180.67 3hxz h LEU 376 N 0.44 0.37 -0.84 0.00 5.85 -1.06 -0.33 115.31 119.73 3hxz h LEU 376 Ca 0.12 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 3hxz h LEU 376 Cb 0.02 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3hxz h LEU 376 CO -0.02 0.28 0.52 0.25 -0.34 0.00 0.00 178.44 179.13 3hxz h LEU 377 N 0.42 1.00 -0.13 2.25 5.85 -0.89 0.19 115.31 124.01 3hxz h LEU 377 Ca 0.11 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3hxz h LEU 377 Cb -0.03 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 3hxz h LEU 377 CO -0.02 0.76 0.08 0.44 -0.34 0.00 0.00 178.44 179.35 3hxz h ASP 378 N 1.15 0.13 -0.54 1.25 3.32 -0.59 -0.11 116.42 121.02 3hxz h ASP 378 Ca 0.30 -0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.43 3hxz h ASP 378 Cb -0.07 -0.03 -0.07 0.00 0.22 0.00 0.00 39.33 39.39 3hxz h ASP 378 CO -0.06 0.10 0.18 -0.33 -1.72 0.00 0.00 179.24 177.40 3hxz h GLU 379 N 0.16 0.34 -0.38 3.56 5.08 -0.53 -0.14 114.58 122.67 3hxz h GLU 379 Ca 0.05 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.25 3hxz h GLU 379 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3hxz h GLU 379 CO -0.02 0.22 -0.30 0.93 -1.00 0.00 0.00 179.01 178.85 3hxz h GLU 380 N 0.35 0.81 -0.05 2.33 4.39 -0.72 -3.07 114.58 118.62 3hxz h GLU 380 Ca 0.27 -0.37 -0.15 0.00 0.34 0.00 0.00 59.36 59.45 3hxz h GLU 380 Cb 0.32 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 3hxz h GLU 380 CO -0.29 1.00 -0.63 -0.07 -1.16 0.00 0.00 179.01 177.87 3hxz h LEU 381 N 0.69 0.22 -1.73 1.33 3.38 -0.71 -1.98 115.31 116.51 3hxz h LEU 381 Ca 0.08 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3hxz h LEU 381 Cb 0.84 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 3hxz h LEU 381 CO 0.07 0.79 -0.16 0.00 0.09 0.00 0.00 178.44 179.23 3hxz h ALA 382 N 1.21 1.59 -0.09 1.53 0.00 -0.93 -2.67 119.26 119.91 3hxz h ALA 382 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3hxz h ALA 382 Cb 1.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3hxz h ALA 382 CO 0.09 0.20 0.00 0.36 0.00 0.00 0.00 179.25 179.91 3hxz n LYS 383 N -4.15 1.04 -2.04 0.00 2.85 -1.20 -5.00 118.16 109.66 3hxz n LYS 383 Ca -0.02 -1.35 -0.42 0.00 -1.05 0.00 0.00 58.31 55.47 3hxz n LYS 383 Cb 0.24 -1.22 -0.03 0.00 -0.65 0.00 0.00 35.03 33.36 3hxz n LYS 383 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 3hxz s LEU 384 N -0.94 4.37 -0.33 -5.58 2.96 -0.75 -5.00 118.68 113.42 3hxz s LEU 384 Ca 0.15 2.51 -0.11 0.00 -0.22 0.00 0.00 54.13 56.46 3hxz s LEU 384 Cb 0.10 -3.59 -0.00 0.00 0.50 0.00 0.00 46.19 43.19 3hxz s LEU 384 CO 0.14 -0.74 0.19 -0.55 -1.32 0.00 0.00 176.35 174.06 3hxz s SER 385 N 1.04 5.71 0.00 3.68 0.15 -1.26 -4.98 113.70 118.05 3hxz s SER 385 Ca 0.67 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.73 3hxz s SER 385 Cb -0.41 -2.04 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 3hxz s SER 385 CO 0.32 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.13 3hxz n GLY 386 N 5.02 -0.60 0.95 9.45 0.00 -1.26 -4.81 105.19 113.93 3hxz n GLY 386 Ca -0.13 -2.23 0.08 0.00 0.00 0.00 0.00 46.02 43.73 3hxz n GLY 386 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hxz n ASP 387 N 0.00 3.52 -3.84 1.61 5.75 -1.26 -4.95 116.55 117.38 3hxz n ASP 387 Ca 0.00 -2.21 -0.22 0.00 -0.01 0.00 0.00 54.79 52.36 3hxz n ASP 387 Cb 0.00 -0.37 -0.17 0.00 -1.03 0.00 0.00 41.12 39.55 3hxz n ASP 387 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3hxz s THR 388 N -1.38 0.50 0.15 2.12 2.01 -1.26 0.19 115.64 117.98 3hxz s THR 388 Ca 0.35 -0.03 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 3hxz s THR 388 Cb 0.21 -0.58 -0.08 0.00 0.01 0.00 0.00 72.50 72.06 3hxz s THR 388 CO 0.19 0.25 1.30 -0.22 -0.69 0.00 0.00 174.62 175.45 3hxz s LEU 389 N 1.41 4.40 0.63 4.42 2.96 0.47 -4.87 118.68 128.10 3hxz s LEU 389 Ca -0.03 2.30 -0.17 0.00 -0.22 0.00 0.00 54.13 56.00 3hxz s LEU 389 Cb -0.13 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 42.95 3hxz s LEU 389 CO -0.03 -0.53 1.18 1.51 -1.32 0.00 0.00 176.35 177.17 3hxz s ASP 390 N 0.62 4.98 0.40 3.68 -4.77 -1.26 -1.22 116.67 119.09 3hxz s ASP 390 Ca 0.58 2.29 0.12 0.00 -3.30 0.00 0.00 52.55 52.24 3hxz s ASP 390 Cb -0.35 -2.59 0.81 0.00 -1.09 0.00 0.00 42.92 39.71 3hxz s ASP 390 CO 0.34 -1.73 1.90 1.23 0.70 0.00 0.00 175.17 177.61 3hxz h GLY 391 N 0.47 0.09 1.08 2.12 0.00 -1.84 -2.76 103.07 102.23 3hxz h GLY 391 Ca -0.49 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 3hxz h GLY 391 CO 0.54 0.06 0.22 -2.09 0.00 0.00 0.00 176.54 175.27 3hxz h GLU 392 N 0.08 1.15 -0.24 4.80 4.81 -1.92 -0.10 114.58 123.16 3hxz h GLU 392 Ca 0.01 -0.25 -0.10 0.00 -0.13 0.00 0.00 59.36 58.89 3hxz h GLU 392 Cb 0.47 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 3hxz h GLU 392 CO 0.03 0.98 -0.24 1.15 -0.73 0.00 0.00 179.01 180.21 3hxz h THR 393 N 1.10 1.32 -0.72 0.32 2.02 -1.89 -0.01 112.91 115.05 3hxz h THR 393 Ca 0.24 -1.40 0.06 0.00 0.77 0.00 0.00 66.41 66.07 3hxz h THR 393 Cb 0.32 1.68 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 3hxz h THR 393 CO -0.01 0.44 0.42 0.00 0.37 0.00 0.00 175.52 176.74 3hxz h ALA 394 N 0.67 0.96 -0.50 6.16 0.00 -1.35 -0.63 119.26 124.58 3hxz h ALA 394 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3hxz h ALA 394 Cb 0.79 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3hxz h ALA 394 CO 0.06 0.13 -0.10 0.35 0.00 0.00 0.00 179.25 179.68 3hxz h PHE 395 N 0.78 1.02 -0.58 0.00 3.57 -0.87 -1.77 116.94 119.08 3hxz h PHE 395 Ca 0.31 -0.20 0.01 0.00 3.53 0.00 0.00 57.97 61.62 3hxz h PHE 395 Cb 0.16 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 3hxz h PHE 395 CO -0.06 0.96 0.38 -0.09 -2.23 0.00 0.00 178.31 177.28 3hxz h ARG 396 N 0.82 0.77 -0.44 1.11 9.65 -0.46 0.30 114.38 126.14 3hxz h ARG 396 Ca 0.13 -0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 58.91 3hxz h ARG 396 Cb 0.63 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.02 3hxz h ARG 396 CO 0.04 0.51 0.05 -0.07 2.80 0.00 0.00 179.97 183.30 3hxz h LEU 397 N 0.79 0.64 0.22 3.80 3.38 -0.93 -0.76 115.31 122.45 3hxz h LEU 397 Ca 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 3hxz h LEU 397 Cb -0.09 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3hxz h LEU 397 CO -0.05 0.68 -0.10 0.22 0.09 0.00 0.00 178.44 179.28 3hxz h TYR 398 N 0.65 -0.27 -0.20 1.13 3.20 -0.78 -0.89 116.97 119.81 3hxz h TYR 398 Ca 0.14 -0.01 -0.21 0.00 3.14 0.00 0.00 58.73 61.80 3hxz h TYR 398 Cb 0.34 0.09 0.01 0.00 1.54 0.00 0.00 36.73 38.70 3hxz h TYR 398 CO 0.02 0.10 -0.69 0.22 -1.64 0.00 0.00 178.16 176.17 3hxz h ASP 399 N -0.73 0.93 0.11 -2.11 3.58 -0.31 -1.82 116.42 116.08 3hxz h ASP 399 Ca -0.03 -0.57 -0.37 0.00 0.42 0.00 0.00 57.03 56.49 3hxz h ASP 399 Cb 0.50 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.25 3hxz h ASP 399 CO 0.05 1.36 -2.07 0.41 -2.88 0.00 0.00 179.24 176.11 3hxz n THR 400 N -3.96 1.74 0.65 2.25 -1.04 -0.30 -4.57 114.28 109.05 3hxz n THR 400 Ca -0.06 -0.65 0.07 0.00 -2.04 0.00 0.00 64.05 61.37 3hxz n THR 400 Cb 0.70 -1.68 -0.02 0.00 -1.82 0.00 0.00 70.33 67.51 3hxz n THR 400 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3hxz n TYR 401 N -3.44 0.00 -2.21 -1.42 4.01 -0.86 -4.99 117.16 108.25 3hxz n TYR 401 Ca -0.34 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.31 3hxz n TYR 401 Cb 1.04 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 40.07 3hxz n TYR 401 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hxz n GLY 402 N 1.14 -0.01 3.56 2.72 0.00 -0.68 -4.73 105.19 107.20 3hxz n GLY 402 Ca 0.05 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 3hxz n GLY 402 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hxz s PHE 403 N -2.49 2.95 0.61 1.61 0.40 -0.41 -4.94 117.98 115.70 3hxz s PHE 403 Ca 0.01 0.37 -0.19 0.00 -0.60 0.00 0.00 56.93 56.52 3hxz s PHE 403 Cb -0.00 -3.88 -0.03 0.00 0.51 0.00 0.00 43.02 39.61 3hxz s PHE 403 CO 0.01 -1.05 1.23 -2.30 0.70 0.00 0.00 175.22 173.81 3hxz n PRO 404 N 7.05 1.19 0.15 0.24 -0.02 -1.26 -3.39 135.00 138.96 3hxz n PRO 404 Ca 0.05 0.46 0.06 0.00 -2.02 0.00 0.00 63.50 62.05 3hxz n PRO 404 Cb 0.48 -2.45 0.52 0.00 -0.02 0.00 0.00 33.50 32.03 3hxz n PRO 404 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3hxz h VAL 405 N 0.73 1.07 0.00 -1.45 3.04 -1.96 -1.21 116.25 116.46 3hxz h VAL 405 Ca -0.50 -0.21 -0.10 0.00 -1.01 0.00 0.00 66.70 64.88 3hxz h VAL 405 Cb 1.34 0.88 -0.01 0.00 -2.01 0.00 0.00 31.29 31.48 3hxz h VAL 405 CO 0.53 0.08 -0.46 -2.24 -1.01 0.00 0.00 177.57 174.47 3hxz h ASP 406 N 0.22 0.00 -0.27 3.17 3.04 -1.98 -0.48 116.42 120.12 3hxz h ASP 406 Ca 0.06 0.00 -0.13 0.00 -3.24 0.00 0.00 57.03 53.72 3hxz h ASP 406 Cb 0.05 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.33 3hxz h ASP 406 CO -0.01 0.46 -0.32 0.25 -2.04 0.00 0.00 179.24 177.58 3hxz h LEU 407 N 0.00 0.76 -0.52 0.15 6.46 -1.59 -1.07 115.31 119.49 3hxz h LEU 407 Ca -0.00 -0.49 -0.02 0.00 -0.12 0.00 0.00 57.88 57.24 3hxz h LEU 407 Cb 1.05 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.75 3hxz h LEU 407 CO 0.06 1.09 0.24 0.74 -0.62 0.00 0.00 178.44 179.96 3hxz h THR 408 N 0.43 1.20 -0.60 1.05 2.02 -1.28 -2.53 112.91 113.20 3hxz h THR 408 Ca 0.04 -0.58 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 3hxz h THR 408 Cb 0.90 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 3hxz h THR 408 CO 0.08 0.23 0.28 0.00 0.37 0.00 0.00 175.52 176.47 3hxz h ALA 409 N 1.08 1.37 -0.52 6.16 0.00 -1.06 -1.90 119.26 124.39 3hxz h ALA 409 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3hxz h ALA 409 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3hxz h ALA 409 CO -0.02 0.49 0.28 0.22 0.00 0.00 0.00 179.25 180.22 3hxz h ASP 410 N 0.85 0.65 -0.36 0.00 3.58 -0.89 0.12 116.42 120.37 3hxz h ASP 410 Ca 0.21 -0.10 -0.04 0.00 0.42 0.00 0.00 57.03 57.52 3hxz h ASP 410 Cb 0.10 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 3hxz h ASP 410 CO -0.03 0.56 0.06 0.58 -2.88 0.00 0.00 179.24 177.53 3hxz h VAL 411 N 0.69 1.24 -0.52 2.25 2.07 -1.24 -3.07 116.25 117.67 3hxz h VAL 411 Ca 0.18 -0.83 -0.08 0.00 0.82 0.00 0.00 66.70 66.79 3hxz h VAL 411 Cb 0.06 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 3hxz h VAL 411 CO -0.03 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.85 3hxz h ARG 413 N 0.81 0.80 0.00 0.00 2.43 -0.70 0.70 114.38 118.43 3hxz h ARG 413 Ca 0.15 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3hxz h ARG 413 Cb 0.48 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 3hxz h ARG 413 CO 0.02 0.53 0.00 0.93 -1.51 0.00 0.00 179.97 179.94 3hxz h GLU 414 N 0.83 0.00 -0.19 0.20 5.08 -1.41 -1.94 114.58 117.15 3hxz h GLU 414 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3hxz h GLU 414 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3hxz h GLU 414 CO -0.05 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.50 3hxz n ARG 415 N -2.81 2.50 -3.08 2.33 1.74 -0.28 -4.97 116.66 112.09 3hxz n ARG 415 Ca -0.01 -2.70 -0.22 0.00 -0.77 0.00 0.00 57.85 54.15 3hxz n ARG 415 Cb 0.17 -1.70 0.04 0.00 -1.02 0.00 0.00 32.46 29.95 3hxz n ARG 415 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3hxz n ASN 416 N -0.70 -6.07 -4.34 0.55 3.02 -0.73 -5.01 115.26 102.00 3hxz n ASN 416 Ca 0.19 -0.32 -0.32 0.00 -0.03 0.00 0.00 54.58 54.10 3hxz n ASN 416 Cb 0.79 -4.85 -0.15 0.00 -0.61 0.00 0.00 39.78 34.95 3hxz n ASN 416 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hxz s ILE 417 N -3.19 2.46 0.62 2.41 -1.09 0.08 -4.96 121.20 117.54 3hxz s ILE 417 Ca 0.34 -0.92 -0.02 0.00 -2.23 0.00 0.00 60.65 57.82 3hxz s ILE 417 Cb -0.15 -1.94 0.05 0.00 -1.58 0.00 0.00 42.46 38.84 3hxz s ILE 417 CO 0.42 0.57 0.88 -0.54 -1.23 0.00 0.00 174.94 175.04 3hxz s LYS 418 N -0.22 2.35 -0.07 2.79 1.02 0.13 -3.08 119.74 122.67 3hxz s LYS 418 Ca -0.01 -0.59 0.05 0.00 0.02 0.00 0.00 55.97 55.44 3hxz s LYS 418 Cb -0.13 -2.35 -0.00 0.00 -0.52 0.00 0.00 37.83 34.82 3hxz s LYS 418 CO 0.03 -0.97 -0.23 0.08 -0.92 0.00 0.00 175.35 173.35 3hxz s VAL 419 N -2.98 1.89 -1.01 3.17 1.01 -1.26 -0.40 120.40 120.83 3hxz s VAL 419 Ca 0.59 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 61.38 3hxz s VAL 419 Cb -0.10 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 3hxz s VAL 419 CO 0.41 0.53 1.77 -0.62 0.00 0.00 0.00 175.10 177.19 3hxz s ASP 420 N 0.07 5.69 0.27 3.32 2.15 -0.36 -4.80 116.67 123.00 3hxz s ASP 420 Ca -0.09 -1.19 -0.02 0.00 0.43 0.00 0.00 52.55 51.68 3hxz s ASP 420 Cb -0.15 -2.57 0.37 0.00 -0.30 0.00 0.00 42.92 40.28 3hxz s ASP 420 CO 0.05 -2.28 1.84 -0.33 -0.17 0.00 0.00 175.17 174.28 3hxz h GLU 421 N 10.32 0.91 -0.64 4.34 4.39 -1.97 -1.36 114.58 130.57 3hxz h GLU 421 Ca 0.17 -0.16 -0.06 0.00 0.34 0.00 0.00 59.36 59.65 3hxz h GLU 421 Cb 0.99 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.46 3hxz h GLU 421 CO 1.30 0.77 0.17 0.00 -1.16 0.00 0.00 179.01 180.10 3hxz h ALA 422 N 1.34 0.84 -0.60 3.43 0.00 -1.99 -0.73 119.26 121.55 3hxz h ALA 422 Ca 0.20 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3hxz h ALA 422 Cb 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3hxz h ALA 422 CO -0.01 0.54 0.22 0.78 0.00 0.00 0.00 179.25 180.78 3hxz h GLY 423 N 0.94 0.98 0.98 0.00 0.00 -1.83 -0.38 103.07 103.76 3hxz h GLY 423 Ca 0.20 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 3hxz h GLY 423 CO -0.00 0.52 0.24 -2.75 0.00 0.00 0.00 176.54 174.55 3hxz h PHE 424 N 0.84 0.56 -0.13 5.60 3.04 -1.03 -0.83 116.94 124.99 3hxz h PHE 424 Ca 0.20 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 62.05 3hxz h PHE 424 Cb 0.24 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.56 3hxz h PHE 424 CO 0.01 0.41 -0.32 0.93 -2.02 0.00 0.00 178.31 177.33 3hxz h GLU 425 N 0.54 0.26 -0.52 1.11 5.08 -0.99 -0.74 114.58 119.32 3hxz h GLU 425 Ca 0.15 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3hxz h GLU 425 Cb 0.03 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3hxz h GLU 425 CO -0.03 0.56 -0.15 0.00 -1.00 0.00 0.00 179.01 178.40 3hxz h ALA 426 N 1.44 0.75 -0.64 3.43 0.00 -0.76 -1.07 119.26 122.41 3hxz h ALA 426 Ca 0.03 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 3hxz h ALA 426 Cb 0.69 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3hxz h ALA 426 CO 0.05 0.67 0.09 0.00 0.00 0.00 0.00 179.25 180.07 3hxz h ALA 427 N 0.93 0.85 -0.51 0.00 0.00 -0.79 -0.87 119.26 118.87 3hxz h ALA 427 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3hxz h ALA 427 Cb 0.72 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3hxz h ALA 427 CO 0.06 0.62 0.29 0.52 0.00 0.00 0.00 179.25 180.73 3hxz h MET 428 N 0.98 0.70 -0.51 0.00 2.07 -0.98 -2.26 114.93 114.92 3hxz h MET 428 Ca 0.19 -0.08 -0.09 0.00 -2.07 0.00 0.00 59.70 57.66 3hxz h MET 428 Cb 0.45 -0.14 -0.02 0.00 -1.87 0.00 0.00 31.60 30.02 3hxz h MET 428 CO 0.01 0.53 -0.03 1.49 1.07 0.00 0.00 176.91 179.99 3hxz h GLU 429 N 0.67 0.92 -0.92 1.72 4.57 -1.05 -1.69 114.58 118.81 3hxz h GLU 429 Ca 0.18 -0.31 0.09 0.00 -1.18 0.00 0.00 59.36 58.14 3hxz h GLU 429 Cb 0.03 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.47 3hxz h GLU 429 CO -0.03 0.96 0.56 0.93 -1.18 0.00 0.00 179.01 180.25 3hxz h GLU 430 N 0.79 0.92 -0.39 1.92 5.08 -1.01 -0.73 114.58 121.16 3hxz h GLU 430 Ca 0.14 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 3hxz h GLU 430 Cb 0.56 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3hxz h GLU 430 CO 0.03 0.61 -0.35 0.37 -1.00 0.00 0.00 179.01 178.67 3hxz h GLN 431 N 0.95 0.91 -0.90 2.33 4.15 -1.10 -1.78 115.11 119.67 3hxz h GLN 431 Ca 0.43 -0.45 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 3hxz h GLN 431 Cb 0.35 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 3hxz h GLN 431 CO -0.23 1.11 0.53 0.00 -1.93 0.00 0.00 178.83 178.31 3hxz h ARG 432 N 0.75 1.23 -0.53 1.69 3.08 -0.74 -0.35 114.38 119.52 3hxz h ARG 432 Ca 0.07 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3hxz h ARG 432 Cb 0.93 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 3hxz h ARG 432 CO 0.09 0.87 0.23 0.00 -1.07 0.00 0.00 179.97 180.09 3hxz h ARG 433 N 1.25 0.77 -0.77 0.04 2.47 -0.92 -0.04 114.38 117.19 3hxz h ARG 433 Ca 0.32 -0.13 0.02 0.00 -1.26 0.00 0.00 59.98 58.93 3hxz h ARG 433 Cb -0.04 -0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.11 3hxz h ARG 433 CO -0.06 0.66 0.50 0.00 0.56 0.00 0.00 179.97 181.63 3hxz h ARG 434 N 0.71 0.97 -0.59 0.04 3.08 -0.94 -0.05 114.38 117.59 3hxz h ARG 434 Ca 0.18 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3hxz h ARG 434 Cb 0.17 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 3hxz h ARG 434 CO -0.02 0.64 0.27 0.00 -1.07 0.00 0.00 179.97 179.79 3hxz h ALA 435 N 1.30 0.76 -0.45 0.04 0.00 -0.63 -1.51 119.26 118.77 3hxz h ALA 435 Ca 0.29 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3hxz h ALA 435 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3hxz h ALA 435 CO -0.09 0.34 0.17 0.00 0.00 0.00 0.00 179.25 179.68 3hxz h ARG 436 N 0.81 0.68 -0.61 0.00 3.08 -0.67 -0.30 114.38 117.37 3hxz h ARG 436 Ca 0.20 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 60.14 3hxz h ARG 436 Cb 0.15 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 3hxz h ARG 436 CO -0.02 0.63 0.39 1.49 -1.07 0.00 0.00 179.97 181.39 3hxz h GLU 437 N 0.59 0.75 -0.08 0.04 4.81 -0.84 -1.06 114.58 118.78 3hxz h GLU 437 Ca 0.15 -0.05 -0.23 0.00 -0.13 0.00 0.00 59.36 59.10 3hxz h GLU 437 Cb 0.21 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 29.43 3hxz h GLU 437 CO -0.01 0.50 -0.87 0.00 -0.73 0.00 0.00 179.01 177.90 3hxz h ALA 438 N 1.25 0.30 -0.05 2.92 0.00 -1.16 -3.31 119.26 119.20 3hxz h ALA 438 Ca 0.24 -0.64 -0.19 0.00 0.00 0.00 0.00 54.91 54.32 3hxz h ALA 438 Cb -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3hxz h ALA 438 CO -0.08 0.71 -0.76 1.03 0.00 0.00 0.00 179.25 180.14 3hxz h SER 439 N 0.44 0.42 0.00 0.00 0.87 -0.96 -3.49 113.55 110.83 3hxz h SER 439 Ca -0.08 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 3hxz h SER 439 Cb 1.50 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 3hxz h SER 439 CO 0.17 1.04 0.00 0.61 -0.53 0.00 0.00 176.83 178.12 3hxz n GLY 440 N 0.62 -0.10 0.00 5.77 0.00 -0.41 -5.09 105.19 105.99 3hxz n GLY 440 Ca -0.04 -1.17 0.01 0.00 0.00 0.00 0.00 46.02 44.82 3hxz n GLY 440 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65