#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hxr n GLY 91 N 0.00 1.62 3.31 -0.13 0.00 -1.26 -4.93 105.19 103.80 2hxr n GLY 91 Ca 0.00 -1.88 -0.16 0.00 0.00 0.00 0.00 46.02 43.98 2hxr n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hxr s SER 92 N -1.00 1.81 -0.17 1.61 0.01 -1.26 -2.43 113.70 112.27 2hxr s SER 92 Ca 0.00 -1.16 -0.04 0.00 1.31 0.00 0.00 55.95 56.06 2hxr s SER 92 Cb 0.00 0.01 0.08 0.00 0.21 0.00 0.00 66.02 66.32 2hxr s SER 92 CO 0.00 -0.46 0.23 -0.22 0.41 0.00 0.00 173.24 173.19 2hxr s LEU 93 N -3.27 -0.17 -0.43 2.44 2.96 -0.53 -4.85 118.68 114.84 2hxr s LEU 93 Ca 0.25 0.09 -0.15 0.00 -0.22 0.00 0.00 54.13 54.10 2hxr s LEU 93 Cb 0.05 0.47 0.03 0.00 0.50 0.00 0.00 46.19 47.24 2hxr s LEU 93 CO 0.06 -0.29 0.34 -0.13 -1.32 0.00 0.00 176.35 175.01 2hxr s ARG 94 N 2.35 2.99 -0.07 1.98 0.52 -1.26 -1.51 118.95 123.94 2hxr s ARG 94 Ca 0.05 -1.06 0.01 0.00 -0.52 0.00 0.00 55.73 54.20 2hxr s ARG 94 Cb -0.14 -4.01 -0.03 0.00 0.52 0.00 0.00 34.95 31.29 2hxr s ARG 94 CO -0.10 -0.83 -0.07 0.42 0.02 0.00 0.00 175.30 174.75 2hxr s ILE 95 N 1.73 3.72 0.01 1.52 1.01 0.10 -1.06 121.20 128.24 2hxr s ILE 95 Ca 0.06 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.27 2hxr s ILE 95 Cb -0.20 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2hxr s ILE 95 CO 0.10 0.60 -0.10 0.00 0.00 0.00 0.00 174.94 175.53 2hxr s ALA 96 N -0.78 0.83 0.03 9.38 0.00 -0.80 -0.99 121.76 129.43 2hxr s ALA 96 Ca 0.12 -0.54 -0.09 0.00 0.00 0.00 0.00 51.96 51.45 2hxr s ALA 96 Cb -0.11 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.85 2hxr s ALA 96 CO 0.01 0.17 0.18 0.54 0.00 0.00 0.00 175.76 176.66 2hxr s VAL 97 N -0.50 0.10 0.57 0.00 0.11 -0.70 -1.13 120.40 118.85 2hxr s VAL 97 Ca 0.01 -0.85 -0.16 0.00 -2.93 0.00 0.00 61.98 58.05 2hxr s VAL 97 Cb -0.05 -0.79 -0.05 0.00 -1.53 0.00 0.00 36.38 33.96 2hxr s VAL 97 CO 0.00 -0.47 1.04 0.42 -3.33 0.00 0.00 175.10 172.76 2hxr s THR 98 N -2.25 3.97 0.31 5.04 -4.23 -0.87 -4.10 115.64 113.51 2hxr s THR 98 Ca -0.08 0.96 0.07 0.00 -1.18 0.00 0.00 61.69 61.46 2hxr s THR 98 Cb -0.03 -3.46 0.39 0.00 1.34 0.00 0.00 72.50 70.74 2hxr s THR 98 CO -0.02 -0.53 1.50 -2.65 -0.54 0.00 0.00 174.62 172.38 2hxr n PRO 99 N -1.86 -0.07 -0.11 3.99 -0.02 -1.26 -2.23 135.00 133.44 2hxr n PRO 99 Ca 0.08 1.41 0.01 0.00 -2.02 0.00 0.00 63.50 62.98 2hxr n PRO 99 Cb 0.53 -2.31 0.31 0.00 -0.02 0.00 0.00 33.50 32.02 2hxr n PRO 99 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2hxr h THR 100 N 0.00 1.16 0.00 3.45 1.35 -2.00 -2.46 112.91 114.42 2hxr h THR 100 Ca 0.64 -0.37 -0.04 0.00 -0.55 0.00 0.00 66.41 66.08 2hxr h THR 100 Cb 1.45 0.37 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 2hxr h THR 100 CO -0.86 0.17 -0.21 -0.26 -0.25 0.00 0.00 175.52 174.11 2hxr h PHE 101 N 0.78 0.00 -0.41 4.73 -1.00 -1.82 -2.34 116.94 116.88 2hxr h PHE 101 Ca 0.20 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.97 2hxr h PHE 101 Cb -0.02 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 2hxr h PHE 101 CO 0.00 0.21 0.21 1.15 -1.61 0.00 0.00 178.31 178.28 2hxr h THR 102 N 0.00 1.14 -0.01 -1.55 2.02 -1.56 -0.29 112.91 112.66 2hxr h THR 102 Ca -0.00 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2hxr h THR 102 Cb 0.46 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2hxr h THR 102 CO 0.03 0.15 0.00 -1.20 0.37 0.00 0.00 175.52 174.87 2hxr n SER 103 N -4.42 0.34 0.00 4.18 7.64 -0.88 -4.51 113.62 115.96 2hxr n SER 103 Ca 0.03 -1.15 0.00 0.00 1.01 0.00 0.00 58.87 58.75 2hxr n SER 103 Cb 0.11 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 2hxr n SER 103 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hxr n TYR 104 N -0.72 0.00 -0.11 1.43 0.18 -1.03 -4.74 117.16 112.17 2hxr n TYR 104 Ca 0.22 0.00 -0.19 0.00 1.88 0.00 0.00 57.90 59.81 2hxr n TYR 104 Cb 0.16 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.05 2hxr n TYR 104 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2hxr n PHE 105 N -0.39 0.27 -0.04 -3.48 7.35 -0.20 -4.67 117.46 116.30 2hxr n PHE 105 Ca 0.00 0.12 -0.02 0.00 -0.76 0.00 0.00 57.45 56.79 2hxr n PHE 105 Cb 0.00 -0.82 0.24 0.00 0.35 0.00 0.00 39.48 39.25 2hxr n PHE 105 CO 0.00 0.00 0.00 0.97 -0.76 0.00 0.00 176.76 176.97 2hxr h ILE 106 N -1.00 1.22 0.35 -2.13 6.09 -1.62 -3.10 117.51 117.31 2hxr h ILE 106 Ca -0.34 -0.90 -0.00 0.00 -1.37 0.00 0.00 64.86 62.26 2hxr h ILE 106 Cb 1.23 0.94 -0.03 0.00 0.47 0.00 0.00 36.82 39.43 2hxr h ILE 106 CO -0.20 0.31 -0.50 1.23 -3.07 0.00 0.00 178.15 175.92 2hxr h GLY 107 N 0.91 -1.17 0.99 8.18 0.00 -1.79 -2.96 103.07 107.23 2hxr h GLY 107 Ca 0.12 0.59 0.01 0.00 0.00 0.00 0.00 47.33 48.05 2hxr h GLY 107 CO 0.02 -0.33 0.54 -2.55 0.00 0.00 0.00 176.54 174.22 2hxr h PRO 108 N -0.89 1.06 -0.15 4.80 0.11 -1.83 -1.47 132.00 133.63 2hxr h PRO 108 Ca -0.04 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2hxr h PRO 108 Cb 0.82 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.69 2hxr h PRO 108 CO -0.15 0.70 0.00 -0.11 -0.21 0.00 0.00 178.00 178.24 2hxr n LEU 109 N -4.52 0.15 0.00 2.35 7.94 -1.12 -1.47 117.00 120.33 2hxr n LEU 109 Ca 0.08 -0.08 0.00 0.00 -1.11 0.00 0.00 56.01 54.91 2hxr n LEU 109 Cb 0.02 -0.08 0.00 0.00 0.53 0.00 0.00 43.42 43.90 2hxr n LEU 109 CO 0.36 0.04 0.00 0.00 -1.11 0.00 0.00 177.39 176.68 2hxr n ALA 111 N 0.34 0.00 -0.13 1.96 0.00 -0.55 -0.95 120.51 121.18 2hxr n ALA 111 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2hxr n ALA 111 Cb 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.47 2hxr n ALA 111 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2hxr h ASP 112 N 0.00 0.65 0.04 0.00 3.32 -1.52 -1.57 116.42 117.35 2hxr h ASP 112 Ca 0.00 -0.31 0.01 0.00 0.02 0.00 0.00 57.03 56.75 2hxr h ASP 112 Cb 0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2hxr h ASP 112 CO 0.00 0.80 -0.08 0.15 -1.72 0.00 0.00 179.24 178.39 2hxr h PHE 113 N 0.49 -0.19 -0.42 4.55 3.57 -1.30 -1.34 116.94 122.29 2hxr h PHE 113 Ca 0.11 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.66 2hxr h PHE 113 Cb 0.47 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 2hxr h PHE 113 CO 0.04 -0.12 0.14 -0.92 -2.23 0.00 0.00 178.31 175.22 2hxr h TYR 114 N -0.16 0.25 -0.80 0.41 3.20 -1.79 0.45 116.97 118.53 2hxr h TYR 114 Ca 0.02 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.97 2hxr h TYR 114 Cb 0.17 -0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 2hxr h TYR 114 CO -0.12 0.09 0.48 0.00 -1.64 0.00 0.00 178.16 176.97 2hxr h ALA 115 N 1.28 1.09 -0.06 1.82 0.00 -1.04 0.40 119.26 122.75 2hxr h ALA 115 Ca 0.20 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 2hxr h ALA 115 Cb 0.20 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2hxr h ALA 115 CO -0.21 0.21 -0.80 -0.09 0.00 0.00 0.00 179.25 178.36 2hxr h ARG 116 N 0.89 0.45 -2.10 0.00 2.43 -0.38 -3.38 114.38 112.28 2hxr h ARG 116 Ca 0.35 -0.40 -0.57 0.00 -0.81 0.00 0.00 59.98 58.55 2hxr h ARG 116 Cb 0.17 0.09 -0.41 0.00 -0.42 0.00 0.00 29.97 29.41 2hxr h ARG 116 CO -0.17 1.04 -0.88 0.66 -1.51 0.00 0.00 179.97 179.11 2hxr n TYR 117 N -3.82 1.62 0.32 2.20 4.01 0.15 -4.96 117.16 116.69 2hxr n TYR 117 Ca -0.05 -3.85 0.19 0.00 -0.16 0.00 0.00 57.90 54.02 2hxr n TYR 117 Cb 0.75 -0.45 0.99 0.00 -0.31 0.00 0.00 39.34 40.32 2hxr n TYR 117 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2hxr h PRO 118 N 3.89 0.00 -0.00 -0.72 0.13 -1.12 -2.27 132.00 131.90 2hxr h PRO 118 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2hxr h PRO 118 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2hxr h PRO 118 CO 0.64 0.00 -0.09 0.45 -0.23 0.00 0.00 178.00 178.77 2hxr n SER 119 N -3.05 0.19 -4.60 1.44 2.88 -1.26 -4.77 113.62 104.45 2hxr n SER 119 Ca -0.02 -0.07 -0.39 0.00 -1.33 0.00 0.00 58.87 57.06 2hxr n SER 119 Cb 0.25 -0.23 -0.10 0.00 -0.75 0.00 0.00 64.21 63.39 2hxr n SER 119 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2hxr s ILE 120 N -2.73 5.23 0.11 2.46 1.01 -0.86 -4.31 121.20 122.11 2hxr s ILE 120 Ca 0.22 0.37 -0.31 0.00 0.00 0.00 0.00 60.65 60.93 2hxr s ILE 120 Cb 0.19 -3.63 -0.07 0.00 0.01 0.00 0.00 42.46 38.96 2hxr s ILE 120 CO 0.52 0.18 1.26 -0.89 0.00 0.00 0.00 174.94 176.01 2hxr s THR 121 N 1.93 3.68 -0.01 2.92 2.01 -1.02 -4.92 115.64 120.23 2hxr s THR 121 Ca 0.11 1.25 0.04 0.00 0.31 0.00 0.00 61.69 63.40 2hxr s THR 121 Cb -0.16 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2hxr s THR 121 CO 0.10 0.12 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.30 2hxr s LEU 122 N 0.73 3.01 -0.09 4.42 1.43 -1.26 -1.45 118.68 125.47 2hxr s LEU 122 Ca 0.59 -0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.50 2hxr s LEU 122 Cb -0.33 -1.71 0.03 0.00 0.03 0.00 0.00 46.19 44.21 2hxr s LEU 122 CO 0.32 0.30 -0.01 -1.58 0.23 0.00 0.00 176.35 175.60 2hxr s GLN 123 N -1.23 0.79 -0.11 1.70 0.74 -0.57 -4.97 119.66 116.01 2hxr s GLN 123 Ca 0.15 0.01 0.03 0.00 0.05 0.00 0.00 55.36 55.59 2hxr s GLN 123 Cb -0.11 -1.16 -0.00 0.00 1.10 0.00 0.00 33.01 32.84 2hxr s GLN 123 CO 0.05 -0.32 -0.20 -1.17 -0.55 0.00 0.00 175.29 173.10 2hxr s LEU 124 N 1.91 2.29 -0.07 3.68 1.98 -1.26 0.02 118.68 127.24 2hxr s LEU 124 Ca 0.05 -0.49 -0.01 0.00 -2.89 0.00 0.00 54.13 50.79 2hxr s LEU 124 Cb -0.13 -1.48 0.03 0.00 0.66 0.00 0.00 46.19 45.27 2hxr s LEU 124 CO -0.06 0.16 -0.02 -1.10 -1.89 0.00 0.00 176.35 173.44 2hxr s GLN 125 N 0.36 0.72 0.14 1.98 -0.21 -0.16 -5.00 119.66 117.49 2hxr s GLN 125 Ca -0.16 0.02 -0.11 0.00 0.02 0.00 0.00 55.36 55.13 2hxr s GLN 125 Cb -0.17 -0.96 -0.07 0.00 1.00 0.00 0.00 33.01 32.81 2hxr s GLN 125 CO 0.08 -0.24 0.50 -1.83 -2.12 0.00 0.00 175.29 171.68 2hxr s GLU 126 N 1.64 3.86 0.60 2.91 -1.05 -1.26 -1.71 118.70 123.69 2hxr s GLU 126 Ca 0.00 0.32 -0.15 0.00 -0.15 0.00 0.00 54.97 55.00 2hxr s GLU 126 Cb -0.13 -2.89 -0.03 0.00 -0.44 0.00 0.00 34.13 30.64 2hxr s GLU 126 CO -0.04 0.47 1.05 -1.54 0.95 0.00 0.00 175.26 176.15 2hxr s SER 128 N -1.90 5.84 0.19 0.83 1.04 -1.26 -4.93 113.70 113.51 2hxr s SER 128 Ca 0.38 1.72 -0.12 0.00 0.48 0.00 0.00 55.95 58.41 2hxr s SER 128 Cb -0.14 -2.52 0.13 0.00 0.10 0.00 0.00 66.02 63.60 2hxr s SER 128 CO 0.19 -1.13 1.83 -0.61 0.98 0.00 0.00 173.24 174.51 2hxr h GLN 129 N 0.23 0.70 -0.43 4.02 4.15 -1.95 -1.89 115.11 119.93 2hxr h GLN 129 Ca -0.46 -0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.00 2hxr h GLN 129 Cb 1.21 -0.16 -0.07 0.00 0.21 0.00 0.00 27.48 28.67 2hxr h GLN 129 CO 0.58 0.46 -0.01 0.93 -1.93 0.00 0.00 178.83 178.86 2hxr h GLU 130 N 0.72 0.10 -0.18 1.69 3.07 -2.02 0.10 114.58 118.06 2hxr h GLU 130 Ca 0.23 -0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 59.03 2hxr h GLU 130 Cb 0.01 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2hxr h GLU 130 CO -0.09 0.06 -0.17 0.87 -1.40 0.00 0.00 179.01 178.28 2hxr h LYS 131 N 0.10 0.30 -0.23 2.33 1.57 -1.90 -0.58 116.57 118.15 2hxr h LYS 131 Ca 0.21 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 2hxr h LYS 131 Cb 0.31 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2hxr h LYS 131 CO -0.37 0.46 -0.12 0.82 -0.57 0.00 0.00 179.45 179.68 2hxr h ILE 132 N 0.28 1.30 -0.53 1.86 2.04 -0.34 -3.13 117.51 118.99 2hxr h ILE 132 Ca 0.05 -1.20 -0.02 0.00 1.00 0.00 0.00 64.86 64.69 2hxr h ILE 132 Cb 0.46 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 2hxr h ILE 132 CO 0.03 0.37 0.25 -0.33 0.00 0.00 0.00 178.15 178.47 2hxr h GLU 133 N 0.20 0.77 -0.32 2.37 5.08 -0.53 -1.38 114.58 120.77 2hxr h GLU 133 Ca 0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2hxr h GLU 133 Cb 0.62 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2hxr h GLU 133 CO 0.04 0.63 0.00 -3.47 -1.00 0.00 0.00 179.01 175.21 2hxr n ASP 134 N -4.58 0.11 0.00 1.42 2.03 -0.25 -1.91 116.55 113.37 2hxr n ASP 134 Ca 0.02 -0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.16 2hxr n ASP 134 Cb 0.12 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 2hxr n ASP 134 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2hxr n LEU 136 N 0.52 0.00 0.22 -2.67 4.77 -0.52 -2.20 117.00 117.12 2hxr n LEU 136 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 2hxr n LEU 136 Cb 0.02 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.62 2hxr n LEU 136 CO 0.00 0.00 0.85 0.00 -1.33 0.00 0.00 177.39 176.91 2hxr n ARG 138 N -4.05 2.49 -3.11 0.00 1.74 -0.93 -4.93 116.66 107.87 2hxr n ARG 138 Ca -0.02 -1.97 -0.22 0.00 -0.77 0.00 0.00 57.85 54.87 2hxr n ARG 138 Cb 0.31 -1.52 0.02 0.00 -1.02 0.00 0.00 32.46 30.24 2hxr n ARG 138 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2hxr n ASP 139 N 0.96 -5.05 -0.93 0.55 9.92 -0.72 -4.84 116.55 116.43 2hxr n ASP 139 Ca 0.18 -0.30 0.12 0.00 -0.53 0.00 0.00 54.79 54.27 2hxr n ASP 139 Cb 0.53 -4.12 0.16 0.00 -0.64 0.00 0.00 41.12 37.05 2hxr n ASP 139 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2hxr n GLU 140 N -3.83 2.28 -3.91 -1.24 1.02 -1.26 -4.90 120.64 108.79 2hxr n GLU 140 Ca -0.08 -1.87 -0.09 0.00 -0.02 0.00 0.00 57.16 55.10 2hxr n GLU 140 Cb 0.59 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.45 2hxr n GLU 140 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2hxr s LEU 141 N -1.92 1.70 -0.23 -4.62 1.43 -1.26 -4.94 118.68 108.83 2hxr s LEU 141 Ca 0.31 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 2hxr s LEU 141 Cb 0.20 0.73 -0.16 0.00 0.03 0.00 0.00 46.19 47.00 2hxr s LEU 141 CO 0.31 -0.58 -0.20 0.47 0.23 0.00 0.00 176.35 176.57 2hxr n ASP 142 N 0.49 2.14 -3.83 2.29 8.00 -0.22 -4.75 116.55 120.66 2hxr n ASP 142 Ca -0.17 -0.12 -0.12 0.00 0.71 0.00 0.00 54.79 55.08 2hxr n ASP 142 Cb 0.60 -0.35 -0.12 0.00 -0.02 0.00 0.00 41.12 41.24 2hxr n ASP 142 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2hxr s VAL 143 N -2.47 0.03 0.14 2.53 1.01 -1.05 -4.71 120.40 115.88 2hxr s VAL 143 Ca -0.31 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.48 2hxr s VAL 143 Cb 0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 2hxr s VAL 143 CO 0.55 -0.13 -0.11 -0.83 0.00 0.00 0.00 175.10 174.57 2hxr s GLY 144 N -0.41 1.09 -0.08 4.51 0.00 -0.55 -1.91 107.32 109.96 2hxr s GLY 144 Ca -0.05 -1.44 -0.01 0.00 0.00 0.00 0.00 44.72 43.22 2hxr s GLY 144 CO 0.01 -1.53 -0.03 -0.42 0.00 0.00 0.00 173.10 171.12 2hxr s ILE 145 N -2.99 0.62 0.00 0.90 1.01 -0.29 0.30 121.20 120.76 2hxr s ILE 145 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.75 2hxr s ILE 145 Cb 0.00 -0.72 0.00 0.00 0.01 0.00 0.00 42.46 41.75 2hxr s ILE 145 CO 0.02 0.30 0.00 0.00 0.00 0.00 0.00 174.94 175.25 2hxr n ALA 146 N 4.98 0.00 -2.32 9.38 0.00 -0.25 -2.05 120.51 130.24 2hxr n ALA 146 Ca -0.10 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.21 2hxr n ALA 146 Cb 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.85 2hxr n ALA 146 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2hxr s PHE 147 N 0.71 0.98 0.43 0.00 0.40 -1.26 0.14 117.98 119.38 2hxr s PHE 147 Ca 0.00 -0.79 -0.23 0.00 -0.60 0.00 0.00 56.93 55.32 2hxr s PHE 147 Cb 0.00 -0.54 -0.09 0.00 0.51 0.00 0.00 43.02 42.90 2hxr s PHE 147 CO 0.00 -0.06 1.05 0.00 0.70 0.00 0.00 175.22 176.90 2hxr s ALA 148 N -3.08 3.01 0.18 5.36 0.00 -0.41 -4.16 121.76 122.67 2hxr s ALA 148 Ca 0.09 0.67 -0.14 0.00 0.00 0.00 0.00 51.96 52.58 2hxr s ALA 148 Cb 0.01 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 2hxr s ALA 148 CO -0.02 -0.25 0.57 -1.25 0.00 0.00 0.00 175.76 174.81 2hxr s PRO 149 N -2.76 3.96 0.07 0.00 0.04 -1.26 -4.70 135.00 130.35 2hxr s PRO 149 Ca 0.61 0.48 -0.24 0.00 0.04 0.00 0.00 61.00 61.89 2hxr s PRO 149 Cb -0.20 -2.84 -0.06 0.00 0.04 0.00 0.00 34.50 31.44 2hxr s PRO 149 CO 0.25 0.42 0.75 0.08 0.04 0.00 0.00 177.00 178.54 2hxr s VAL 150 N -1.57 4.66 -0.16 -0.36 1.01 -1.26 -4.98 120.40 117.74 2hxr s VAL 150 Ca 0.41 1.60 0.19 0.00 0.00 0.00 0.00 61.98 64.18 2hxr s VAL 150 Cb -0.14 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 2hxr s VAL 150 CO 0.20 0.41 0.89 1.41 0.00 0.00 0.00 175.10 178.01 2hxr n HIS 151 N 2.48 0.97 -3.22 5.22 8.25 -1.26 -4.86 115.22 122.79 2hxr n HIS 151 Ca -0.04 0.31 -0.39 0.00 -0.26 0.00 0.00 57.72 57.34 2hxr n HIS 151 Cb 0.50 -1.04 -0.07 0.00 1.12 0.00 0.00 29.99 30.50 2hxr n HIS 151 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2hxr s SER 152 N -5.62 6.58 0.43 0.41 0.15 -1.26 -4.97 113.70 109.43 2hxr s SER 152 Ca -0.02 0.70 0.18 0.00 0.70 0.00 0.00 55.95 57.51 2hxr s SER 152 Cb 0.09 -2.30 1.00 0.00 -1.71 0.00 0.00 66.02 63.09 2hxr s SER 152 CO 0.81 -0.20 1.92 -0.65 1.20 0.00 0.00 173.24 176.32 2hxr h PRO 153 N 7.48 0.00 0.00 5.44 0.11 -2.02 -2.89 132.00 140.12 2hxr h PRO 153 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2hxr h PRO 153 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2hxr h PRO 153 CO 0.75 0.26 0.00 -0.85 -0.21 0.00 0.00 178.00 177.94 2hxr n GLU 154 N -3.92 0.92 -4.43 1.05 0.00 -1.26 -4.77 120.64 108.22 2hxr n GLU 154 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.81 2hxr n GLU 154 Cb 0.34 -1.39 -0.10 0.00 0.00 0.00 0.00 31.44 30.29 2hxr n GLU 154 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2hxr s LEU 155 N -1.77 3.35 -0.10 -1.84 1.43 -1.09 -1.16 118.68 117.50 2hxr s LEU 155 Ca 0.34 -0.02 -0.05 0.00 -1.03 0.00 0.00 54.13 53.38 2hxr s LEU 155 Cb 0.16 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2hxr s LEU 155 CO 0.26 0.32 0.08 -0.70 0.23 0.00 0.00 176.35 176.55 2hxr s GLU 156 N -1.20 3.24 -0.08 1.70 2.12 0.10 -4.81 118.70 119.77 2hxr s GLU 156 Ca 0.16 -0.26 0.03 0.00 0.36 0.00 0.00 54.97 55.26 2hxr s GLU 156 Cb -0.11 -3.02 -0.02 0.00 0.26 0.00 0.00 34.13 31.24 2hxr s GLU 156 CO 0.06 0.74 -0.15 0.00 -0.54 0.00 0.00 175.26 175.37 2hxr s ALA 157 N -0.98 2.60 -0.19 6.30 0.00 -1.26 -2.77 121.76 125.46 2hxr s ALA 157 Ca 0.15 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.16 2hxr s ALA 157 Cb -0.12 -1.02 0.03 0.00 0.00 0.00 0.00 23.12 22.02 2hxr s ALA 157 CO 0.04 0.44 -0.14 0.42 0.00 0.00 0.00 175.76 176.52 2hxr s ILE 158 N -0.32 1.85 0.25 0.00 1.01 -0.61 -4.94 121.20 118.44 2hxr s ILE 158 Ca 0.03 -1.02 -0.31 0.00 0.00 0.00 0.00 60.65 59.35 2hxr s ILE 158 Cb -0.13 -1.81 -0.14 0.00 0.01 0.00 0.00 42.46 40.40 2hxr s ILE 158 CO 0.02 0.31 1.34 -2.65 0.00 0.00 0.00 174.94 173.96 2hxr n PRO 159 N 4.64 1.90 -0.01 2.79 -0.02 -1.26 -0.99 135.00 142.05 2hxr n PRO 159 Ca -0.17 0.68 -0.05 0.00 -2.02 0.00 0.00 63.50 61.94 2hxr n PRO 159 Cb 0.48 -2.28 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2hxr n PRO 159 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2hxr n LEU 160 N 1.87 0.94 -3.78 2.45 7.94 0.40 -4.82 117.00 122.00 2hxr n LEU 160 Ca 0.11 0.14 -0.05 0.00 -1.11 0.00 0.00 56.01 55.10 2hxr n LEU 160 Cb 0.31 -0.33 -0.02 0.00 0.53 0.00 0.00 43.42 43.92 2hxr n LEU 160 CO 0.62 -0.28 0.62 -1.48 -1.11 0.00 0.00 177.39 175.77 2hxr s LEU 161 N -6.83 -0.22 -0.22 -1.96 0.05 -1.21 -4.87 118.68 103.42 2hxr s LEU 161 Ca -0.08 -0.46 -0.07 0.00 0.05 0.00 0.00 54.13 53.56 2hxr s LEU 161 Cb 0.02 2.37 -0.03 0.00 -2.05 0.00 0.00 46.19 46.50 2hxr s LEU 161 CO 0.11 -1.06 0.06 -0.89 -0.55 0.00 0.00 176.35 174.02 2hxr s THR 162 N -3.52 4.42 -0.23 5.48 2.01 -1.26 0.09 115.64 122.62 2hxr s THR 162 Ca 0.11 -0.15 -0.08 0.00 0.31 0.00 0.00 61.69 61.89 2hxr s THR 162 Cb -0.03 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2hxr s THR 162 CO 0.03 0.39 0.08 -0.70 -0.69 0.00 0.00 174.62 173.73 2hxr s GLU 163 N 1.15 3.79 -0.05 4.92 2.12 0.80 -4.93 118.70 126.50 2hxr s GLU 163 Ca 0.04 -0.42 0.06 0.00 0.36 0.00 0.00 54.97 55.01 2hxr s GLU 163 Cb -0.14 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 30.91 2hxr s GLU 163 CO 0.03 -0.03 -0.23 -1.54 -0.54 0.00 0.00 175.26 172.95 2hxr s SER 164 N 1.21 2.77 0.23 -1.70 1.04 -1.26 -0.27 113.70 115.71 2hxr s SER 164 Ca 0.05 -0.46 -0.30 0.00 0.48 0.00 0.00 55.95 55.73 2hxr s SER 164 Cb -0.14 -0.71 -0.09 0.00 0.10 0.00 0.00 66.02 65.18 2hxr s SER 164 CO 0.04 0.22 1.13 -0.76 0.98 0.00 0.00 173.24 174.85 2hxr s LEU 165 N -0.15 4.51 0.25 2.42 1.43 -0.46 -2.22 118.68 124.46 2hxr s LEU 165 Ca -0.02 2.22 0.05 0.00 -1.03 0.00 0.00 54.13 55.34 2hxr s LEU 165 Cb -0.13 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 2hxr s LEU 165 CO 0.03 -0.23 -0.02 0.00 0.23 0.00 0.00 176.35 176.36 2hxr s ALA 166 N -0.63 2.04 -0.46 4.21 0.00 0.24 -4.66 121.76 122.50 2hxr s ALA 166 Ca 0.48 -1.83 -0.24 0.00 0.00 0.00 0.00 51.96 50.37 2hxr s ALA 166 Cb -0.31 0.37 0.03 0.00 0.00 0.00 0.00 23.12 23.20 2hxr s ALA 166 CO 0.38 -0.18 0.85 -1.17 0.00 0.00 0.00 175.76 175.65 2hxr s LEU 167 N -3.37 4.14 -0.22 0.00 2.96 -0.62 -1.76 118.68 119.81 2hxr s LEU 167 Ca 0.29 -0.00 -0.15 0.00 -0.22 0.00 0.00 54.13 54.05 2hxr s LEU 167 Cb 0.05 -3.08 -0.04 0.00 0.50 0.00 0.00 46.19 43.62 2hxr s LEU 167 CO 0.10 -0.98 0.36 -0.69 -1.32 0.00 0.00 176.35 173.82 2hxr s VAL 168 N 3.52 5.21 0.25 1.68 1.01 0.45 -0.33 120.40 132.19 2hxr s VAL 168 Ca 0.33 0.62 0.01 0.00 0.00 0.00 0.00 61.98 62.94 2hxr s VAL 168 Cb -0.11 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 2hxr s VAL 168 CO 0.24 0.25 0.11 0.68 0.00 0.00 0.00 175.10 176.38 2hxr s VAL 169 N 1.40 0.44 0.52 2.92 -7.23 -0.07 -1.68 120.40 116.71 2hxr s VAL 169 Ca 0.17 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.25 2hxr s VAL 169 Cb -0.15 -2.60 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 2hxr s VAL 169 CO 0.08 0.00 0.90 0.00 -0.31 0.00 0.00 175.10 175.76 2hxr s ALA 170 N -3.83 3.24 0.54 1.32 0.00 -1.26 -0.09 121.76 121.70 2hxr s ALA 170 Ca 0.38 -0.23 0.23 0.00 0.00 0.00 0.00 51.96 52.34 2hxr s ALA 170 Cb 0.08 -2.85 1.45 0.00 0.00 0.00 0.00 23.12 21.79 2hxr s ALA 170 CO 0.14 -0.41 2.11 1.96 0.00 0.00 0.00 175.76 179.56 2hxr h GLN 171 N 0.26 0.00 -0.12 0.00 4.20 -1.81 0.03 115.11 117.67 2hxr h GLN 171 Ca -0.46 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.25 2hxr h GLN 171 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2hxr h GLN 171 CO 0.62 0.00 0.00 -2.39 -0.67 0.00 0.00 178.83 176.39 2hxr n HIS 172 N -4.27 0.15 -2.32 2.96 1.44 -1.26 -4.74 115.22 107.19 2hxr n HIS 172 Ca 0.01 -0.07 -0.41 0.00 -2.01 0.00 0.00 57.72 55.24 2hxr n HIS 172 Cb 0.27 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.34 2hxr n HIS 172 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 2hxr s HIS 173 N -1.85 3.35 0.50 -1.40 5.04 -0.00 -4.92 115.29 116.01 2hxr s HIS 173 Ca 0.27 1.55 0.28 0.00 -1.54 0.00 0.00 55.06 55.62 2hxr s HIS 173 Cb 0.14 -3.46 1.37 0.00 0.04 0.00 0.00 32.58 30.66 2hxr s HIS 173 CO 0.21 -1.16 1.87 -1.00 -2.34 0.00 0.00 174.74 172.32 2hxr h PRO 174 N 3.79 0.12 -0.00 2.88 0.13 -1.89 -0.31 132.00 136.72 2hxr h PRO 174 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2hxr h PRO 174 Cb 1.22 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2hxr h PRO 174 CO 0.67 0.08 -0.43 1.28 -0.23 0.00 0.00 178.00 179.37 2hxr n LEU 175 N -4.35 0.85 0.23 1.56 4.77 -1.26 -4.21 117.00 114.59 2hxr n LEU 175 Ca 0.20 -0.19 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 2hxr n LEU 175 Cb 0.92 -0.16 0.69 0.00 -2.33 0.00 0.00 43.42 42.53 2hxr n LEU 175 CO 0.36 0.18 0.94 0.00 -1.33 0.00 0.00 177.39 177.54 2hxr h ALA 176 N 3.35 1.11 0.00 -1.18 0.00 -1.32 -0.27 119.26 120.95 2hxr h ALA 176 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2hxr h ALA 176 Cb 0.52 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2hxr h ALA 176 CO 0.00 -0.11 -0.09 -0.24 0.00 0.00 0.00 179.25 178.81 2hxr h VAL 177 N 0.00 0.20 -2.82 0.00 3.04 -1.76 -3.45 116.25 111.46 2hxr h VAL 177 Ca 0.00 -0.88 -0.48 0.00 -1.01 0.00 0.00 66.70 64.33 2hxr h VAL 177 Cb 0.27 1.73 0.01 0.00 -2.01 0.00 0.00 31.29 31.29 2hxr h VAL 177 CO 0.00 0.09 -0.20 -1.00 -1.01 0.00 0.00 177.57 175.45 2hxr s HIS 178 N -3.53 3.50 -0.10 3.17 4.02 -0.11 -5.00 115.29 117.24 2hxr s HIS 178 Ca 0.02 0.36 0.20 0.00 1.02 0.00 0.00 55.06 56.67 2hxr s HIS 178 Cb 0.08 -1.90 -0.30 0.00 -1.02 0.00 0.00 32.58 29.44 2hxr s HIS 178 CO 0.61 0.14 0.31 -1.91 1.02 0.00 0.00 174.74 174.91 2hxr n GLU 179 N -1.67 0.69 -3.81 1.40 2.13 -1.26 -4.85 120.64 113.28 2hxr n GLU 179 Ca -0.05 -0.12 -0.12 0.00 0.66 0.00 0.00 57.16 57.53 2hxr n GLU 179 Cb 0.56 -1.51 -0.11 0.00 0.27 0.00 0.00 31.44 30.65 2hxr n GLU 179 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 2hxr s GLN 180 N -3.09 0.39 0.06 5.31 0.74 -1.26 -1.14 119.66 120.67 2hxr s GLN 180 Ca -0.09 0.08 0.01 0.00 0.05 0.00 0.00 55.36 55.41 2hxr s GLN 180 Cb 0.11 0.18 -0.03 0.00 1.10 0.00 0.00 33.01 34.36 2hxr s GLN 180 CO 0.86 -0.08 -0.05 0.14 -0.55 0.00 0.00 175.29 175.62 2hxr s VAL 181 N -0.45 0.41 0.37 1.34 -7.23 0.14 -4.91 120.40 110.06 2hxr s VAL 181 Ca -0.06 -1.51 -0.27 0.00 -1.81 0.00 0.00 61.98 58.34 2hxr s VAL 181 Cb -0.04 -1.12 -0.09 0.00 0.56 0.00 0.00 36.38 35.70 2hxr s VAL 181 CO 0.01 -0.73 1.23 0.00 -0.31 0.00 0.00 175.10 175.30 2hxr s ALA 182 N -2.78 3.29 0.50 1.32 0.00 -1.26 0.55 121.76 123.38 2hxr s ALA 182 Ca 0.00 1.10 0.21 0.00 0.00 0.00 0.00 51.96 53.27 2hxr s ALA 182 Cb -0.00 -3.42 1.27 0.00 0.00 0.00 0.00 23.12 20.96 2hxr s ALA 182 CO -0.04 -0.58 1.98 1.25 0.00 0.00 0.00 175.76 178.36 2hxr h LEU 183 N 2.97 0.13 -2.37 0.00 5.85 -1.90 -0.78 115.31 119.21 2hxr h LEU 183 Ca -0.49 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2hxr h LEU 183 Cb 1.23 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2hxr h LEU 183 CO 0.64 0.07 0.03 0.77 -0.34 0.00 0.00 178.44 179.61 2hxr h SER 184 N 0.14 0.00 0.09 1.25 4.64 -1.96 -1.97 113.55 115.75 2hxr h SER 184 Ca 0.27 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.57 2hxr h SER 184 Cb 0.88 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2hxr h SER 184 CO -0.04 0.00 -0.09 0.03 -0.87 0.00 0.00 176.83 175.86 2hxr h ARG 185 N 0.00 0.01 -0.40 4.77 2.47 -1.51 -2.60 114.38 117.12 2hxr h ARG 185 Ca 0.00 -0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.84 2hxr h ARG 185 Cb 0.05 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.35 2hxr h ARG 185 CO 0.00 0.10 0.32 -0.07 0.56 0.00 0.00 179.97 180.88 2hxr h LEU 186 N 0.01 0.00 -0.97 3.04 3.38 -1.56 -2.17 115.31 117.03 2hxr h LEU 186 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2hxr h LEU 186 Cb 0.17 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 2hxr h LEU 186 CO 0.01 0.00 0.62 -0.74 0.09 0.00 0.00 178.44 178.42 2hxr h HIS 187 N 0.00 1.14 -0.01 1.13 2.76 -1.69 -1.79 115.15 116.69 2hxr h HIS 187 Ca 0.19 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 2hxr h HIS 187 Cb 0.83 -0.37 0.00 0.00 1.55 0.00 0.00 27.41 29.42 2hxr h HIS 187 CO 0.00 0.55 -0.15 -0.25 -1.30 0.00 0.00 177.93 176.78 2hxr n ASP 188 N -4.56 1.00 -4.76 3.26 8.00 -0.82 -4.55 116.55 114.12 2hxr n ASP 188 Ca 0.16 -0.99 -0.40 0.00 0.71 0.00 0.00 54.79 54.27 2hxr n ASP 188 Cb 0.23 0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 2hxr n ASP 188 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2hxr s GLU 189 N -2.34 4.73 -0.31 -1.24 0.41 -0.67 -5.01 118.70 114.26 2hxr s GLU 189 Ca 0.30 1.35 -0.12 0.00 -0.41 0.00 0.00 54.97 56.08 2hxr s GLU 189 Cb 0.20 -3.28 -0.03 0.00 -1.78 0.00 0.00 34.13 29.24 2hxr s GLU 189 CO 0.46 0.52 0.23 0.15 -0.49 0.00 0.00 175.26 176.12 2hxr s LYS 190 N -1.07 3.73 0.13 1.61 1.02 -1.26 -3.45 119.74 120.44 2hxr s LYS 190 Ca 0.39 -0.46 0.03 0.00 0.02 0.00 0.00 55.97 55.96 2hxr s LYS 190 Cb -0.25 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 33.29 2hxr s LYS 190 CO 0.29 -0.32 0.16 -0.51 -0.92 0.00 0.00 175.35 174.05 2hxr s LEU 191 N 1.77 3.98 -0.24 3.17 1.43 0.26 -2.44 118.68 126.60 2hxr s LEU 191 Ca 0.07 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2hxr s LEU 191 Cb -0.17 -2.60 0.03 0.00 0.03 0.00 0.00 46.19 43.48 2hxr s LEU 191 CO 0.11 0.11 -0.08 -0.69 0.23 0.00 0.00 176.35 176.02 2hxr s VAL 192 N -1.62 2.71 0.28 -1.59 1.01 -0.42 -1.42 120.40 119.35 2hxr s VAL 192 Ca 0.32 -1.10 0.07 0.00 0.00 0.00 0.00 61.98 61.27 2hxr s VAL 192 Cb -0.11 -2.39 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 2hxr s VAL 192 CO 0.25 0.20 -0.07 -0.76 0.00 0.00 0.00 175.10 174.71 2hxr s LEU 193 N 1.29 2.51 0.60 3.92 1.43 -0.33 -4.39 118.68 123.70 2hxr s LEU 193 Ca -0.01 -1.17 -0.17 0.00 -1.03 0.00 0.00 54.13 51.75 2hxr s LEU 193 Cb -0.17 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.34 2hxr s LEU 193 CO -0.05 -0.31 1.10 -0.76 0.23 0.00 0.00 176.35 176.56 2hxr s LEU 194 N -3.45 3.56 0.91 1.79 1.43 -1.26 -1.39 118.68 120.27 2hxr s LEU 194 Ca 0.29 2.02 -0.12 0.00 -1.03 0.00 0.00 54.13 55.29 2hxr s LEU 194 Cb 0.03 -4.56 0.14 0.00 0.03 0.00 0.00 46.19 41.83 2hxr s LEU 194 CO 0.12 -1.35 1.13 -0.94 0.23 0.00 0.00 176.35 175.54 2hxr s SER 195 N -2.31 3.51 0.31 2.29 1.04 -0.86 -4.74 113.70 112.94 2hxr s SER 195 Ca 0.68 1.01 0.17 0.00 0.48 0.00 0.00 55.95 58.29 2hxr s SER 195 Cb -0.21 -1.61 0.92 0.00 0.10 0.00 0.00 66.02 65.22 2hxr s SER 195 CO 0.34 -2.55 1.46 0.00 0.98 0.00 0.00 173.24 173.47 2hxr n ALA 196 N -3.77 0.84 0.87 5.32 0.00 -1.26 -1.82 120.51 120.70 2hxr n ALA 196 Ca 0.06 0.16 0.14 0.00 0.00 0.00 0.00 53.44 53.80 2hxr n ALA 196 Cb 0.59 -1.06 0.54 0.00 0.00 0.00 0.00 19.45 19.52 2hxr n ALA 196 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2hxr n GLU 197 N -2.13 0.09 -3.28 0.00 4.71 -1.26 -4.66 120.64 114.11 2hxr n GLU 197 Ca -0.01 0.07 -0.38 0.00 -0.01 0.00 0.00 57.16 56.83 2hxr n GLU 197 Cb 0.16 -1.60 -0.06 0.00 -1.01 0.00 0.00 31.44 28.93 2hxr n GLU 197 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2hxr s PHE 198 N -3.03 3.65 0.40 -0.32 0.40 -0.75 -4.95 117.98 113.36 2hxr s PHE 198 Ca 0.13 1.09 0.07 0.00 -0.60 0.00 0.00 56.93 57.61 2hxr s PHE 198 Cb 0.17 -2.54 0.82 0.00 0.51 0.00 0.00 43.02 41.98 2hxr s PHE 198 CO 0.55 0.35 2.03 0.00 0.70 0.00 0.00 175.22 178.86 2hxr h ALA 199 N 5.75 1.71 -0.91 5.36 0.00 -1.89 -1.23 119.26 128.06 2hxr h ALA 199 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2hxr h ALA 199 Cb 1.20 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2hxr h ALA 199 CO 0.70 0.24 0.57 1.15 0.00 0.00 0.00 179.25 181.90 2hxr h THR 200 N 0.62 1.24 -0.39 0.00 2.02 -1.93 -0.09 112.91 114.38 2hxr h THR 200 Ca 0.20 -0.50 -0.14 0.00 0.77 0.00 0.00 66.41 66.74 2hxr h THR 200 Cb 0.04 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.39 2hxr h THR 200 CO -0.05 0.25 -0.31 -0.09 0.37 0.00 0.00 175.52 175.69 2hxr h ARG 201 N 1.24 0.90 -0.30 6.66 9.65 -1.52 -1.17 114.38 129.84 2hxr h ARG 201 Ca 0.33 -0.44 0.05 0.00 -1.10 0.00 0.00 59.98 58.81 2hxr h ARG 201 Cb -0.09 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.45 2hxr h ARG 201 CO -0.06 1.09 0.02 0.93 2.80 0.00 0.00 179.97 184.75 2hxr h GLU 202 N 0.71 0.12 -0.66 0.20 5.08 -0.69 -0.08 114.58 119.26 2hxr h GLU 202 Ca 0.07 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 2hxr h GLU 202 Cb 0.89 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 2hxr h GLU 202 CO 0.08 0.08 0.10 1.96 -1.00 0.00 0.00 179.01 180.22 2hxr h GLN 203 N 0.12 1.10 0.03 2.33 1.08 -0.95 -1.29 115.11 117.54 2hxr h GLN 203 Ca 0.14 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.05 2hxr h GLN 203 Cb 0.18 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2hxr h GLN 203 CO -0.22 1.02 -0.07 0.82 -0.95 0.00 0.00 178.83 179.43 2hxr h ILE 204 N 1.02 0.82 -0.28 2.54 2.04 -0.58 -0.85 117.51 122.23 2hxr h ILE 204 Ca 0.20 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.08 2hxr h ILE 204 Cb 0.46 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2hxr h ILE 204 CO 0.02 0.00 0.13 0.44 0.00 0.00 0.00 178.15 178.74 2hxr h ASP 205 N -0.15 0.20 0.03 1.72 3.32 -0.85 -0.10 116.42 120.58 2hxr h ASP 205 Ca 0.02 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.10 2hxr h ASP 205 Cb 0.16 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2hxr h ASP 205 CO -0.05 0.15 -0.12 -0.74 -1.72 0.00 0.00 179.24 176.76 2hxr h HIS 206 N 0.28 -0.31 0.00 4.55 2.76 -0.98 -0.53 115.15 120.92 2hxr h HIS 206 Ca 0.11 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.26 2hxr h HIS 206 Cb 0.04 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2hxr h HIS 206 CO -0.10 -0.19 -0.17 1.88 -1.30 0.00 0.00 177.93 178.05 2hxr h TYR 207 N -0.22 0.00 -0.07 5.26 -1.99 -1.04 -1.20 116.97 117.71 2hxr h TYR 207 Ca 0.03 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.68 2hxr h TYR 207 Cb 0.26 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.00 2hxr h TYR 207 CO -0.17 0.17 -0.28 0.00 -0.00 0.00 0.00 178.16 177.88 2hxr h GLU 209 N -0.20 -0.09 -0.95 0.00 4.57 -0.97 0.29 114.58 117.23 2hxr h GLU 209 Ca -0.02 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.24 2hxr h GLU 209 Cb 0.93 0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 29.48 2hxr h GLU 209 CO 0.06 -0.06 0.61 -0.22 -1.18 0.00 0.00 179.01 178.22 2hxr h LYS 210 N -0.09 1.05 -0.01 1.92 3.64 -1.22 -0.64 116.57 121.22 2hxr h LYS 210 Ca 0.10 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2hxr h LYS 210 Cb 0.24 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2hxr h LYS 210 CO -0.23 0.69 -0.02 0.00 -2.27 0.00 0.00 179.45 177.63 2hxr n ALA 211 N -2.38 2.66 -2.76 5.00 0.00 -0.54 -4.91 120.51 117.57 2hxr n ALA 211 Ca 0.15 -0.30 -0.09 0.00 0.00 0.00 0.00 53.44 53.20 2hxr n ALA 211 Cb 0.20 -1.36 0.02 0.00 0.00 0.00 0.00 19.45 18.31 2hxr n ALA 211 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hxr n GLY 212 N 1.11 0.31 3.26 0.00 0.00 -0.07 -5.04 105.19 104.77 2hxr n GLY 212 Ca 0.21 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 2hxr n GLY 212 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hxr s LEU 213 N -3.19 2.27 -0.43 0.99 1.43 0.83 -5.01 118.68 115.57 2hxr s LEU 213 Ca 0.18 -0.49 0.09 0.00 -1.03 0.00 0.00 54.13 52.88 2hxr s LEU 213 Cb -0.08 -1.47 0.31 0.00 0.03 0.00 0.00 46.19 44.98 2hxr s LEU 213 CO 0.22 0.16 0.69 1.41 0.23 0.00 0.00 176.35 179.06 2hxr n HIS 214 N 3.52 0.84 -1.84 0.29 8.25 -1.26 -3.95 115.22 121.07 2hxr n HIS 214 Ca -0.19 -3.79 -0.36 0.00 -0.26 0.00 0.00 57.72 53.12 2hxr n HIS 214 Cb 0.53 -0.42 0.05 0.00 1.12 0.00 0.00 29.99 31.27 2hxr n HIS 214 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2hxr s PRO 215 N -2.16 2.72 0.08 -0.41 0.04 -1.26 -4.95 135.00 129.04 2hxr s PRO 215 Ca 0.40 1.88 -0.31 0.00 0.04 0.00 0.00 61.00 63.01 2hxr s PRO 215 Cb 0.26 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.85 2hxr s PRO 215 CO -0.09 -1.42 1.28 -1.14 0.04 0.00 0.00 177.00 175.67 2hxr s GLN 216 N -3.45 4.38 -0.43 4.56 0.74 -1.22 -4.93 119.66 119.31 2hxr s GLN 216 Ca 0.78 1.89 -0.09 0.00 0.05 0.00 0.00 55.36 57.99 2hxr s GLN 216 Cb -0.32 -3.32 0.09 0.00 1.10 0.00 0.00 33.01 30.55 2hxr s GLN 216 CO 0.37 -0.34 0.28 0.08 -0.55 0.00 0.00 175.29 175.12 2hxr s VAL 217 N 1.16 4.17 -0.36 1.34 1.01 -1.26 -0.57 120.40 125.88 2hxr s VAL 217 Ca 0.61 -1.52 0.23 0.00 0.00 0.00 0.00 61.98 61.30 2hxr s VAL 217 Cb -0.32 -3.61 0.04 0.00 0.00 0.00 0.00 36.38 32.48 2hxr s VAL 217 CO 0.29 -0.58 1.16 -0.37 0.00 0.00 0.00 175.10 175.61 2hxr h VAL 218 N 6.11 0.00 -3.24 2.92 -1.51 -1.59 -3.47 116.25 115.47 2hxr h VAL 218 Ca -0.22 -0.86 -0.19 0.00 -1.23 0.00 0.00 66.70 64.20 2hxr h VAL 218 Cb 1.08 1.41 -0.27 0.00 -2.13 0.00 0.00 31.29 31.38 2hxr h VAL 218 CO 0.78 0.00 -0.50 -0.63 -1.23 0.00 0.00 177.57 175.98 2hxr s ILE 219 N -3.30 -0.01 0.02 7.19 1.01 -1.11 -5.05 121.20 119.95 2hxr s ILE 219 Ca 0.02 0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.76 2hxr s ILE 219 Cb 0.10 -0.28 -0.02 0.00 0.01 0.00 0.00 42.46 42.27 2hxr s ILE 219 CO 0.76 0.01 -0.18 -1.61 0.00 0.00 0.00 174.94 173.93 2hxr s GLU 220 N 0.34 1.28 -0.01 2.79 2.02 -1.26 -1.19 118.70 122.68 2hxr s GLU 220 Ca -0.02 -0.75 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 2hxr s GLU 220 Cb -0.03 -1.30 0.00 0.00 0.10 0.00 0.00 34.13 32.89 2hxr s GLU 220 CO -0.01 0.34 0.12 0.00 0.02 0.00 0.00 175.26 175.73 2hxr s ALA 221 N -0.63 -0.29 -0.39 5.21 0.00 -0.48 -4.93 121.76 120.25 2hxr s ALA 221 Ca 0.06 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.98 2hxr s ALA 221 Cb -0.08 0.03 0.49 0.00 0.00 0.00 0.00 23.12 23.57 2hxr s ALA 221 CO 0.01 -0.17 1.79 0.27 0.00 0.00 0.00 175.76 177.65 2hxr n ASN 222 N 1.83 4.35 -3.69 0.00 6.94 -1.26 -2.03 115.26 121.39 2hxr n ASN 222 Ca -0.20 -3.31 -0.10 0.00 -0.02 0.00 0.00 54.58 50.94 2hxr n ASN 222 Cb 0.56 -0.82 -0.10 0.00 -2.36 0.00 0.00 39.78 37.06 2hxr n ASN 222 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2hxr s SER 223 N -0.85 -0.49 0.18 0.53 0.15 -1.26 -4.99 113.70 106.97 2hxr s SER 223 Ca 0.46 0.94 -0.10 0.00 0.70 0.00 0.00 55.95 57.95 2hxr s SER 223 Cb 0.38 0.89 0.09 0.00 -1.71 0.00 0.00 66.02 65.67 2hxr s SER 223 CO 0.07 -0.20 1.71 0.40 1.20 0.00 0.00 173.24 176.41 2hxr h ILE 224 N 5.62 1.25 -0.29 6.45 5.03 -1.95 -2.25 117.51 131.39 2hxr h ILE 224 Ca -0.33 -0.89 0.05 0.00 -0.12 0.00 0.00 64.86 63.57 2hxr h ILE 224 Cb 1.17 0.59 -0.05 0.00 -3.03 0.00 0.00 36.82 35.51 2hxr h ILE 224 CO 0.26 0.34 -0.01 0.28 -0.68 0.00 0.00 178.15 178.34 2hxr h SER 225 N 0.95 -0.14 -0.75 1.72 0.02 -1.99 -0.22 113.55 113.14 2hxr h SER 225 Ca 0.21 0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.26 2hxr h SER 225 Cb 0.32 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 2hxr h SER 225 CO -0.00 -0.04 0.47 0.00 -1.14 0.00 0.00 176.83 176.12 2hxr h ALA 226 N 1.25 0.99 -0.05 3.77 0.00 -1.94 -1.06 119.26 122.22 2hxr h ALA 226 Ca 0.14 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2hxr h ALA 226 Cb 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2hxr h ALA 226 CO -0.24 0.24 -0.04 0.28 0.00 0.00 0.00 179.25 179.49 2hxr h VAL 227 N 0.90 0.87 -0.64 0.00 2.07 -0.74 -1.08 116.25 117.63 2hxr h VAL 227 Ca 0.31 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.87 2hxr h VAL 227 Cb 0.05 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 2hxr h VAL 227 CO -0.12 0.00 0.36 -0.07 0.02 0.00 0.00 177.57 177.76 2hxr h LEU 228 N -0.05 0.55 -0.81 2.57 3.38 -0.57 -0.59 115.31 119.79 2hxr h LEU 228 Ca 0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2hxr h LEU 228 Cb 0.10 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2hxr h LEU 228 CO -0.08 0.36 0.43 -0.08 0.09 0.00 0.00 178.44 179.17 2hxr h GLU 229 N 0.68 1.13 -0.56 1.13 4.57 -0.90 -0.60 114.58 120.04 2hxr h GLU 229 Ca 0.28 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.26 2hxr h GLU 229 Cb 0.14 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2hxr h GLU 229 CO -0.16 0.84 0.12 -0.07 -1.18 0.00 0.00 179.01 178.57 2hxr h LEU 230 N 1.13 0.85 -0.62 1.64 3.38 -0.47 -2.43 115.31 118.80 2hxr h LEU 230 Ca 0.28 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2hxr h LEU 230 Cb 0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2hxr h LEU 230 CO -0.04 0.87 0.12 0.40 0.09 0.00 0.00 178.44 179.88 2hxr h ILE 231 N 0.80 1.26 -0.98 1.22 1.08 -0.73 -2.29 117.51 117.87 2hxr h ILE 231 Ca 0.17 -0.96 0.00 0.00 -0.39 0.00 0.00 64.86 63.68 2hxr h ILE 231 Cb 0.36 0.69 -0.05 0.00 -3.07 0.00 0.00 36.82 34.75 2hxr h ILE 231 CO 0.00 0.36 0.62 0.03 -0.69 0.00 0.00 178.15 178.47 2hxr h ARG 232 N 0.92 1.30 -0.11 2.37 3.08 -0.95 -3.05 114.38 117.94 2hxr h ARG 232 Ca 0.19 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2hxr h ARG 232 Cb 0.39 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2hxr h ARG 232 CO 0.01 0.89 0.00 0.54 -1.07 0.00 0.00 179.97 180.33 2hxr n ARG 233 N -4.37 1.82 -2.24 0.04 1.74 -0.93 -4.92 116.66 107.80 2hxr n ARG 233 Ca 0.11 -1.21 -0.02 0.00 -0.77 0.00 0.00 57.85 55.96 2hxr n ARG 233 Cb 0.03 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.02 2hxr n ARG 233 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2hxr n THR 234 N 0.45 0.00 -1.03 0.55 -2.24 -0.88 -5.04 114.28 106.09 2hxr n THR 234 Ca 0.17 -0.26 0.06 0.00 -2.27 0.00 0.00 64.05 61.76 2hxr n THR 234 Cb 0.39 0.12 0.27 0.00 -2.10 0.00 0.00 70.33 69.01 2hxr n THR 234 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2hxr n SER 235 N -2.58 4.01 -4.71 3.42 7.64 -1.26 -4.78 113.62 115.37 2hxr n SER 235 Ca 0.00 -3.10 -0.28 0.00 1.01 0.00 0.00 58.87 56.51 2hxr n SER 235 Cb 0.06 -0.58 0.11 0.00 -1.01 0.00 0.00 64.21 62.79 2hxr n SER 235 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2hxr s LEU 236 N -2.88 2.70 0.19 -3.43 1.43 -1.26 -4.91 118.68 110.52 2hxr s LEU 236 Ca 0.45 0.45 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 2hxr s LEU 236 Cb 0.36 -2.88 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 2hxr s LEU 236 CO 0.09 -2.00 0.00 -0.94 0.23 0.00 0.00 176.35 173.74 2hxr s SER 237 N -4.65 1.36 0.22 2.29 1.04 -1.02 -4.58 113.70 108.36 2hxr s SER 237 Ca 0.65 -1.19 -0.00 0.00 0.48 0.00 0.00 55.95 55.89 2hxr s SER 237 Cb -0.09 0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.08 2hxr s SER 237 CO 0.48 -0.56 0.12 0.28 0.98 0.00 0.00 173.24 174.54 2hxr s THR 238 N -3.60 0.21 -0.28 2.02 -1.32 -0.67 -1.30 115.64 110.69 2hxr s THR 238 Ca 0.25 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.74 2hxr s THR 238 Cb 0.06 -2.55 0.06 0.00 -1.51 0.00 0.00 72.50 68.55 2hxr s THR 238 CO 0.05 0.00 -0.05 -0.76 -2.21 0.00 0.00 174.62 171.66 2hxr s LEU 239 N -3.22 3.72 0.17 9.08 1.43 -1.26 -0.41 118.68 128.19 2hxr s LEU 239 Ca 0.39 -1.35 -0.11 0.00 -1.03 0.00 0.00 54.13 52.03 2hxr s LEU 239 Cb 0.07 -1.64 -0.00 0.00 0.03 0.00 0.00 46.19 44.65 2hxr s LEU 239 CO 0.13 -0.23 0.33 -0.76 0.23 0.00 0.00 176.35 176.05 2hxr s LEU 240 N 1.18 0.79 0.11 1.79 1.43 -0.72 -4.90 118.68 118.36 2hxr s LEU 240 Ca -0.07 -0.77 -0.35 0.00 -1.03 0.00 0.00 54.13 51.91 2hxr s LEU 240 Cb -0.20 1.39 -0.15 0.00 0.03 0.00 0.00 46.19 47.26 2hxr s LEU 240 CO -0.03 -0.92 1.50 -2.65 0.23 0.00 0.00 176.35 174.48 2hxr n PRO 241 N -0.23 1.75 -0.02 1.29 -0.02 -1.26 -0.60 135.00 135.91 2hxr n PRO 241 Ca -0.08 0.63 0.20 0.00 -2.02 0.00 0.00 63.50 62.23 2hxr n PRO 241 Cb 0.63 -2.35 0.67 0.00 -0.02 0.00 0.00 33.50 32.43 2hxr n PRO 241 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hxr h ALA 242 N 5.56 2.48 0.00 3.55 0.00 -1.77 -1.31 119.26 127.77 2hxr h ALA 242 Ca -0.46 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2hxr h ALA 242 Cb 1.29 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2hxr h ALA 242 CO 0.85 -0.64 -0.03 0.00 0.00 0.00 0.00 179.25 179.43 2hxr h ALA 243 N 1.72 1.49 -0.62 0.00 0.00 -1.87 -2.63 119.26 117.35 2hxr h ALA 243 Ca 0.27 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 2hxr h ALA 243 Cb 1.02 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2hxr h ALA 243 CO -0.01 0.04 0.00 0.82 0.00 0.00 0.00 179.25 180.09 2hxr h ILE 244 N 0.00 1.27 -0.64 0.00 2.04 -1.52 -3.04 117.51 115.62 2hxr h ILE 244 Ca -0.00 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.70 2hxr h ILE 244 Cb 0.07 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 2hxr h ILE 244 CO 0.00 0.42 0.40 0.00 0.00 0.00 0.00 178.15 178.98 2hxr h ALA 245 N 0.99 1.51 -0.75 1.87 0.00 -1.63 -1.93 119.26 119.33 2hxr h ALA 245 Ca 0.18 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.10 2hxr h ALA 245 Cb 0.56 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2hxr h ALA 245 CO 0.03 0.44 0.49 1.15 0.00 0.00 0.00 179.25 181.36 2hxr h THR 246 N 0.87 0.99 0.00 0.00 2.02 -1.61 -1.24 112.91 113.94 2hxr h THR 246 Ca 0.23 -0.25 -0.05 0.00 0.77 0.00 0.00 66.41 67.11 2hxr h THR 246 Cb -0.07 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.52 2hxr h THR 246 CO -0.05 0.13 -0.26 1.56 0.37 0.00 0.00 175.52 177.28 2hxr h GLN 247 N 0.73 0.00 -5.20 6.66 1.08 -1.42 -3.43 115.11 113.54 2hxr h GLN 247 Ca 0.33 0.00 -0.66 0.00 -1.45 0.00 0.00 58.65 56.87 2hxr h GLN 247 Cb 0.34 0.00 -0.28 0.00 -0.05 0.00 0.00 27.48 27.49 2hxr h GLN 247 CO -0.12 0.26 -0.77 -1.01 -0.95 0.00 0.00 178.83 176.24 2hxr s HIS 248 N -3.72 2.83 0.09 2.96 3.76 -0.47 -5.04 115.29 115.71 2hxr s HIS 248 Ca -0.00 -0.88 -0.29 0.00 -0.15 0.00 0.00 55.06 53.74 2hxr s HIS 248 Cb 0.11 -1.92 -0.14 0.00 1.11 0.00 0.00 32.58 31.74 2hxr s HIS 248 CO 0.65 -0.39 1.64 -0.44 -0.85 0.00 0.00 174.74 175.34 2hxr h ASP 249 N 7.25 -0.71 0.00 1.40 3.32 -1.83 -2.71 116.42 123.13 2hxr h ASP 249 Ca -0.32 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.78 2hxr h ASP 249 Cb 1.19 0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.97 2hxr h ASP 249 CO 0.58 -0.41 0.00 0.61 -1.72 0.00 0.00 179.24 178.30 2hxr n GLY 250 N -1.40 -0.41 3.23 2.75 0.00 -1.26 -4.74 105.19 103.36 2hxr n GLY 250 Ca -0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 2hxr n GLY 250 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hxr s LEU 251 N -0.93 2.14 0.00 0.99 1.43 -1.03 -2.32 118.68 118.96 2hxr s LEU 251 Ca 0.00 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.66 2hxr s LEU 251 Cb 0.00 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.27 2hxr s LEU 251 CO 0.00 0.16 -0.13 -0.75 0.23 0.00 0.00 176.35 175.86 2hxr s LYS 252 N -1.02 1.03 -0.24 1.70 2.20 0.88 -4.70 119.74 119.58 2hxr s LYS 252 Ca 0.07 -0.54 -0.09 0.00 -0.36 0.00 0.00 55.97 55.05 2hxr s LYS 252 Cb -0.08 -1.00 -0.04 0.00 -1.51 0.00 0.00 37.83 35.19 2hxr s LYS 252 CO 0.01 0.27 0.13 0.00 -0.36 0.00 0.00 175.35 175.41 2hxr s ALA 253 N -0.44 3.46 -0.23 3.13 0.00 -1.26 -0.89 121.76 125.54 2hxr s ALA 253 Ca 0.04 -0.97 -0.08 0.00 0.00 0.00 0.00 51.96 50.95 2hxr s ALA 253 Cb -0.06 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 2hxr s ALA 253 CO -0.00 -0.30 0.09 0.42 0.00 0.00 0.00 175.76 175.97 2hxr s ILE 254 N 1.27 4.71 0.52 0.00 1.01 0.55 -4.92 121.20 124.34 2hxr s ILE 254 Ca 0.06 -0.05 -0.21 0.00 0.00 0.00 0.00 60.65 60.45 2hxr s ILE 254 Cb -0.14 -3.18 -0.06 0.00 0.01 0.00 0.00 42.46 39.09 2hxr s ILE 254 CO 0.06 0.37 1.22 -0.44 0.00 0.00 0.00 174.94 176.15 2hxr s SER 255 N 1.10 5.67 -0.26 3.58 0.01 -0.29 -1.59 113.70 121.93 2hxr s SER 255 Ca 0.05 2.43 -0.10 0.00 1.31 0.00 0.00 55.95 59.64 2hxr s SER 255 Cb -0.14 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 2hxr s SER 255 CO 0.04 -1.27 0.15 -0.76 0.41 0.00 0.00 173.24 171.81 2hxr s LEU 256 N -3.46 3.87 0.00 2.44 1.43 -1.26 -0.68 118.68 121.02 2hxr s LEU 256 Ca 0.70 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 2hxr s LEU 256 Cb -0.32 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 43.84 2hxr s LEU 256 CO 0.37 -0.02 0.00 0.00 0.23 0.00 0.00 176.35 176.93 2hxr n ALA 257 N 4.87 0.00 -1.99 4.21 0.00 0.19 -3.03 120.51 124.76 2hxr n ALA 257 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 2hxr n ALA 257 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 2hxr n ALA 257 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2hxr s PRO 258 N 0.00 4.21 0.72 0.00 0.02 -1.26 -4.88 135.00 133.81 2hxr s PRO 258 Ca 0.00 2.25 -0.16 0.00 0.02 0.00 0.00 61.00 63.11 2hxr s PRO 258 Cb 0.00 -3.70 0.00 0.00 0.02 0.00 0.00 34.50 30.82 2hxr s PRO 258 CO 0.00 -0.74 0.96 -0.35 -0.33 0.00 0.00 177.00 176.54 2hxr n PRO 259 N 5.99 0.51 -0.10 5.54 -0.04 -1.17 -4.67 135.00 141.05 2hxr n PRO 259 Ca 0.16 0.23 -0.24 0.00 -0.04 0.00 0.00 63.50 63.61 2hxr n PRO 259 Cb 0.42 -2.21 -0.11 0.00 -0.04 0.00 0.00 33.50 31.55 2hxr n PRO 259 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2hxr n LEU 260 N -1.63 2.04 -3.70 1.53 7.94 -1.26 -5.00 117.00 116.91 2hxr n LEU 260 Ca 0.13 0.34 -0.11 0.00 -1.11 0.00 0.00 56.01 55.26 2hxr n LEU 260 Cb 0.49 -0.94 -0.11 0.00 0.53 0.00 0.00 43.42 43.40 2hxr n LEU 260 CO 0.49 0.47 0.05 -0.22 -1.11 0.00 0.00 177.39 177.06 2hxr s LEU 261 N -7.60 0.04 -0.06 -1.96 2.96 -1.26 -4.88 118.68 105.92 2hxr s LEU 261 Ca -0.31 0.86 0.01 0.00 -0.22 0.00 0.00 54.13 54.46 2hxr s LEU 261 Cb 0.09 1.33 0.02 0.00 0.50 0.00 0.00 46.19 48.13 2hxr s LEU 261 CO 0.58 -0.18 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.76 2hxr s GLU 262 N 1.14 1.08 0.09 1.98 2.02 -1.26 -1.35 118.70 122.40 2hxr s GLU 262 Ca -0.08 -0.16 0.08 0.00 0.02 0.00 0.00 54.97 54.83 2hxr s GLU 262 Cb -0.07 -1.09 -0.03 0.00 0.10 0.00 0.00 34.13 33.04 2hxr s GLU 262 CO -0.10 -0.12 -0.20 1.03 0.02 0.00 0.00 175.26 175.90 2hxr s ARG 263 N 1.15 1.09 -0.38 1.61 0.52 0.62 -4.97 118.95 118.59 2hxr s ARG 263 Ca -0.07 -1.10 -0.18 0.00 -0.52 0.00 0.00 55.73 53.86 2hxr s ARG 263 Cb -0.14 -1.29 0.01 0.00 0.52 0.00 0.00 34.95 34.04 2hxr s ARG 263 CO -0.01 0.30 0.50 0.99 0.02 0.00 0.00 175.30 177.10 2hxr s THR 264 N -1.15 5.02 0.35 0.02 2.01 -1.26 -0.14 115.64 120.49 2hxr s THR 264 Ca 0.05 0.10 -0.26 0.00 0.31 0.00 0.00 61.69 61.90 2hxr s THR 264 Cb -0.10 -4.00 -0.09 0.00 0.01 0.00 0.00 72.50 68.32 2hxr s THR 264 CO 0.04 -0.31 1.02 0.00 -0.69 0.00 0.00 174.62 174.68 2hxr s ALA 265 N 2.35 3.18 0.02 7.40 0.00 0.11 -1.28 121.76 133.54 2hxr s ALA 265 Ca 0.17 0.67 -0.00 0.00 0.00 0.00 0.00 51.96 52.79 2hxr s ALA 265 Cb -0.16 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 2hxr s ALA 265 CO 0.14 -0.06 -0.02 0.54 0.00 0.00 0.00 175.76 176.36 2hxr s VAL 266 N -1.56 0.10 0.02 0.00 0.11 0.12 -0.45 120.40 118.74 2hxr s VAL 266 Ca 0.53 -0.83 -0.18 0.00 -2.93 0.00 0.00 61.98 58.57 2hxr s VAL 266 Cb -0.22 -0.25 -0.06 0.00 -1.53 0.00 0.00 36.38 34.32 2hxr s VAL 266 CO 0.28 -0.46 0.51 -0.76 -3.33 0.00 0.00 175.10 171.35 2hxr s LEU 267 N -1.34 4.47 -0.01 2.54 1.43 -0.16 -1.09 118.68 124.52 2hxr s LEU 267 Ca -0.15 1.10 0.08 0.00 -1.03 0.00 0.00 54.13 54.13 2hxr s LEU 267 Cb -0.09 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.33 2hxr s LEU 267 CO -0.01 0.24 -0.24 -0.76 0.23 0.00 0.00 176.35 175.81 2hxr s LEU 268 N -0.78 2.06 -0.16 1.79 1.43 0.15 -1.58 118.68 121.59 2hxr s LEU 268 Ca 0.27 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.74 2hxr s LEU 268 Cb -0.18 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 44.86 2hxr s LEU 268 CO 0.16 0.29 0.50 0.00 0.23 0.00 0.00 176.35 177.53 2hxr s ARG 269 N -0.64 0.65 -0.08 1.70 1.70 -1.11 -1.48 118.95 119.69 2hxr s ARG 269 Ca 0.09 0.56 -0.30 0.00 -0.47 0.00 0.00 55.73 55.61 2hxr s ARG 269 Cb -0.09 0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 2hxr s ARG 269 CO -0.01 -0.11 1.33 -0.98 -1.08 0.00 0.00 175.30 174.46 2hxr s ARG 270 N -0.06 4.27 0.72 3.89 1.70 -1.26 -0.72 118.95 127.48 2hxr s ARG 270 Ca -0.03 1.81 -0.15 0.00 -0.47 0.00 0.00 55.73 56.90 2hxr s ARG 270 Cb -0.03 -3.68 0.03 0.00 -0.57 0.00 0.00 34.95 30.70 2hxr s ARG 270 CO 0.02 -0.61 1.18 -1.59 -1.08 0.00 0.00 175.30 173.22 2hxr s LYS 271 N 2.90 2.29 -0.65 3.89 -2.85 -0.30 -3.23 119.74 121.78 2hxr s LYS 271 Ca 0.60 1.66 0.00 0.00 -1.00 0.00 0.00 55.97 57.23 2hxr s LYS 271 Cb -0.27 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.64 2hxr s LYS 271 CO 0.22 -1.70 0.00 0.09 0.10 0.00 0.00 175.35 174.06 2hxr n ASN 272 N -2.67 -5.75 -3.96 0.03 3.02 -1.26 -4.90 115.26 99.78 2hxr n ASN 272 Ca 0.13 0.15 -0.31 0.00 -0.03 0.00 0.00 54.58 54.52 2hxr n ASN 272 Cb 0.51 -3.84 -0.15 0.00 -0.61 0.00 0.00 39.78 35.69 2hxr n ASN 272 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2hxr s SER 273 N -2.19 4.53 0.33 6.41 0.15 -1.20 -5.10 113.70 116.63 2hxr s SER 273 Ca 0.00 -2.32 -0.27 0.00 0.70 0.00 0.00 55.95 54.06 2hxr s SER 273 Cb 0.00 -1.52 -0.13 0.00 -1.71 0.00 0.00 66.02 62.66 2hxr s SER 273 CO 0.00 -0.34 1.01 0.79 1.20 0.00 0.00 173.24 175.89 2hxr n TRP 274 N 4.02 1.24 -3.36 3.44 8.01 -1.26 -4.83 117.44 124.70 2hxr n TRP 274 Ca 0.04 0.65 -0.27 0.00 -1.31 0.00 0.00 57.50 56.62 2hxr n TRP 274 Cb 0.39 -2.24 -0.02 0.00 -2.01 0.00 0.00 31.31 27.43 2hxr n TRP 274 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.69 176.03 2hxr s GLN 275 N -1.69 3.56 0.74 -0.99 -0.21 -1.26 -5.10 119.66 114.70 2hxr s GLN 275 Ca 0.60 -0.16 -0.11 0.00 0.02 0.00 0.00 55.36 55.71 2hxr s GLN 275 Cb -0.65 -2.66 0.05 0.00 1.00 0.00 0.00 33.01 30.74 2hxr s GLN 275 CO 0.59 0.19 1.10 0.95 -2.12 0.00 0.00 175.29 176.01 2hxr s THR 276 N -2.18 2.73 0.24 -0.19 -4.23 -1.26 -4.87 115.64 105.88 2hxr s THR 276 Ca 0.42 0.15 -0.07 0.00 -1.18 0.00 0.00 61.69 61.00 2hxr s THR 276 Cb -0.10 -3.22 0.23 0.00 1.34 0.00 0.00 72.50 70.75 2hxr s THR 276 CO 0.33 -0.28 1.91 0.00 -0.54 0.00 0.00 174.62 176.05 2hxr h ALA 277 N -0.77 1.19 0.04 3.99 0.00 -1.99 -1.75 119.26 119.97 2hxr h ALA 277 Ca -0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2hxr h ALA 277 Cb 1.29 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2hxr h ALA 277 CO 0.64 0.56 -0.02 0.00 0.00 0.00 0.00 179.25 180.43 2hxr h ALA 278 N 1.35 -0.05 -0.59 0.00 0.00 -1.93 0.06 119.26 118.11 2hxr h ALA 278 Ca 0.35 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2hxr h ALA 278 Cb -0.12 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2hxr h ALA 278 CO -0.08 -0.48 0.31 0.00 0.00 0.00 0.00 179.25 178.99 2hxr h ALA 279 N 0.81 0.77 -0.48 0.00 0.00 -1.83 0.20 119.26 118.73 2hxr h ALA 279 Ca -0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2hxr h ALA 279 Cb 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2hxr h ALA 279 CO 0.01 -0.03 0.14 0.87 0.00 0.00 0.00 179.25 180.23 2hxr h LYS 280 N 0.58 0.75 -0.68 0.00 1.57 -1.15 -1.52 116.57 116.12 2hxr h LYS 280 Ca 0.26 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2hxr h LYS 280 Cb 0.17 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 2hxr h LYS 280 CO -0.18 0.72 0.37 0.00 -0.57 0.00 0.00 179.45 179.80 2hxr h ALA 281 N 1.00 0.88 -0.29 3.86 0.00 -0.29 -1.87 119.26 122.54 2hxr h ALA 281 Ca 0.15 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2hxr h ALA 281 Cb 0.30 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2hxr h ALA 281 CO -0.00 0.39 0.15 0.35 0.00 0.00 0.00 179.25 180.15 2hxr h PHE 282 N 0.94 0.29 -0.48 0.00 3.57 -0.29 -2.61 116.94 118.36 2hxr h PHE 282 Ca 0.24 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.79 2hxr h PHE 282 Cb 0.04 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 2hxr h PHE 282 CO -0.00 0.17 0.25 -0.07 -2.23 0.00 0.00 178.31 176.42 2hxr h LEU 283 N 0.32 0.36 -1.36 0.59 3.38 -0.96 0.11 115.31 117.76 2hxr h LEU 283 Ca 0.12 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2hxr h LEU 283 Cb 0.02 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2hxr h LEU 283 CO -0.07 0.26 0.00 1.41 0.09 0.00 0.00 178.44 180.13 2hxr n HIS 284 N -4.88 0.00 0.00 1.13 8.25 -0.73 -1.44 115.22 117.54 2hxr n HIS 284 Ca 0.04 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2hxr n HIS 284 Cb 0.12 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.19 2hxr n HIS 284 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hxr n ALA 286 N 0.66 0.00 -0.06 -1.41 0.00 0.37 -0.75 120.51 119.31 2hxr n ALA 286 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2hxr n ALA 286 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.40 2hxr n ALA 286 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hxr h LEU 287 N 0.00 0.74 -0.78 0.00 3.38 -1.50 -3.11 115.31 114.04 2hxr h LEU 287 Ca 0.00 -0.55 0.05 0.00 0.09 0.00 0.00 57.88 57.47 2hxr h LEU 287 Cb 0.00 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 2hxr h LEU 287 CO 0.00 1.16 0.48 0.44 0.09 0.00 0.00 178.44 180.61 2hxr h ASP 288 N 0.36 0.76 0.52 -0.43 3.32 -1.21 0.14 116.42 119.88 2hxr h ASP 288 Ca 0.01 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2hxr h ASP 288 Cb 1.04 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.44 2hxr h ASP 288 CO 0.10 0.51 0.00 0.07 -1.72 0.00 0.00 179.24 178.19 2hxr h LYS 289 N 0.90 0.00 0.00 3.56 5.09 -1.81 -1.70 116.57 122.62 2hxr h LYS 289 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.07 2hxr h LYS 289 Cb 0.10 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.43 2hxr h LYS 289 CO -0.15 0.00 -1.09 0.00 -2.09 0.00 0.00 179.45 176.13