Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nm8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A NH1 ALA 62.A O no hydrogen 3.480 N/A SER 17.A N PRO 13.A O no hydrogen 3.246 N/A SER 17.A OG HIS 490.A ND1 no hydrogen 2.598 N/A LEU 18.A N LEU 14.A O no hydrogen 3.018 N/A ASP 19.A N GLN 15.A O no hydrogen 2.914 N/A HIS 20.A N GLN 16.A O no hydrogen 3.085 N/A TYR 21.A N SER 17.A O no hydrogen 2.853 N/A LEU 22.A N LEU 18.A O no hydrogen 3.071 N/A LYS 23.A N ASP 19.A O no hydrogen 3.079 N/A ALA 24.A N HIS 20.A O no hydrogen 2.937 N/A LEU 25.A N TYR 21.A O no hydrogen 3.093 N/A ILE 28.A N LEU 25.A O no hydrogen 2.875 N/A SER 30.A N GLU 33.A OE1 no hydrogen 2.875 N/A GLU 33.A N SER 30.A OG no hydrogen 3.149 N/A TRP 34.A N SER 30.A O no hydrogen 2.990 N/A TRP 34.A NE1 LEU 22.A O no hydrogen 2.854 N/A ALA 35.A N GLU 31.A O no hydrogen 3.046 N/A HIS 36.A N GLU 32.A O no hydrogen 3.085 N/A THR 37.A N GLU 33.A O no hydrogen 3.017 N/A THR 37.A OG1 GLU 33.A O no hydrogen 2.937 N/A THR 37.A OG1 ASP 511.A OD2 no hydrogen 2.581 N/A THR 37.A OG1 SER 513.A OG no hydrogen 2.616 N/A LYS 38.A N TRP 34.A O no hydrogen 2.880 N/A GLN 39.A N ALA 35.A O no hydrogen 3.278 N/A GLN 39.A NE2 GLU 43.A OE2 no hydrogen 3.187 N/A LEU 40.A N HIS 36.A O no hydrogen 3.034 N/A VAL 41.A N THR 37.A O no hydrogen 2.803 N/A ASP 42.A N LYS 38.A O no hydrogen 2.946 N/A GLU 43.A N GLN 39.A O no hydrogen 3.028 N/A PHE 44.A N LEU 40.A O no hydrogen 2.871 N/A GLN 45.A N VAL 41.A O no hydrogen 2.989 N/A GLN 45.A NE2 ASP 42.A OD1 no hydrogen 3.211 N/A ALA 46.A N GLU 43.A O no hydrogen 3.432 N/A GLY 48.A N GLU 52.A OE1 no hydrogen 2.752 N/A GLY 49.A N ALA 46.A O no hydrogen 2.897 N/A GLY 51.A N PHE 44.A O no hydrogen 2.869 N/A ARG 53.A N GLY 49.A O no hydrogen 3.338 N/A ARG 53.A NE ASP 501.A OD2 no hydrogen 3.355 N/A LEU 54.A N VAL 50.A O no hydrogen 3.007 N/A GLN 55.A N GLY 51.A O no hydrogen 2.910 N/A GLN 55.A NE2 PRO 12.A O no hydrogen 2.996 N/A GLN 55.A NE2 GLU 59.A OE2 no hydrogen 3.223 N/A LYS 56.A N GLU 52.A O no hydrogen 3.029 N/A LYS 56.A NZ LYS 56.A O no hydrogen 3.001 N/A GLY 57.A N ARG 53.A O no hydrogen 3.123 N/A LEU 58.A N LEU 54.A O no hydrogen 3.033 N/A GLU 59.A N GLN 55.A O no hydrogen 3.042 N/A ARG 60.A N LYS 56.A O no hydrogen 2.972 N/A ARG 61.A N GLY 57.A O no hydrogen 2.967 N/A ARG 61.A NE TRP 68.A O no hydrogen 2.960 N/A ALA 62.A N LEU 58.A O no hydrogen 2.888 N/A ARG 63.A N ARG 60.A O no hydrogen 2.960 N/A LYS 64.A N ARG 61.A O no hydrogen 3.008 N/A THR 65.A OG1 ARG 61.A O no hydrogen 2.862 N/A ASN 67.A ND2 HIS 432.A O no hydrogen 2.939 N/A TRP 68.A NE1 PRO 10.A O no hydrogen 3.039 N/A LEU 69.A N ASN 67.A OD1 no hydrogen 2.841 N/A SER 70.A N ASN 67.A OD1 no hydrogen 2.916 N/A SER 70.A OG ASN 67.A O no hydrogen 3.230 N/A TRP 73.A N LEU 69.A O no hydrogen 2.854 N/A LEU 74.A N SER 70.A O no hydrogen 3.135 N/A LYS 75.A N GLU 71.A O no hydrogen 3.150 N/A THR 76.A N TRP 72.A O no hydrogen 2.835 N/A THR 76.A OG1 TRP 72.A O no hydrogen 2.936 N/A ALA 77.A N TRP 73.A O no hydrogen 2.806 N/A TYR 78.A N LEU 74.A O no hydrogen 3.168 N/A TYR 78.A OH HIS 314.A ND1 no hydrogen 3.265 N/A LEU 79.A N LEU 74.A O no hydrogen 3.030 N/A GLN 80.A N LYS 75.A O no hydrogen 2.781 N/A TYR 81.A N TYR 78.A O no hydrogen 2.981 N/A ARG 82.A NH1 GLY 155.A O no hydrogen 3.386 N/A ARG 82.A NH1 ASP 159.A OD1 no hydrogen 2.995 N/A ARG 82.A NH2 GLY 155.A O no hydrogen 2.776 N/A ARG 82.A NH2 ASN 228.A OD1 no hydrogen 3.307 N/A TYR 88.A N VAL 86.A O no hydrogen 2.733 N/A SER 89.A N VAL 85.A O no hydrogen 2.917 N/A SER 90.A N VAL 85.A O no hydrogen 2.768 N/A GLY 92.A N PHE 536.A O no hydrogen 2.999 N/A VAL 93.A N LEU 310.A O no hydrogen 2.826 N/A MET 94.A N VAL 534.A O no hydrogen 2.977 N/A LEU 95.A N CYS 308.A O no hydrogen 2.996 N/A LYS 97.A NZ ASP 305.A O no hydrogen 2.708 N/A GLN 98.A N GLY 306.A O no hydrogen 2.787 N/A GLN 98.A NE2 PRO 96.A O no hydrogen 3.108 N/A GLY 105.A N ASP 102.A OD1 no hydrogen 2.835 N/A GLN 106.A N ASP 102.A O no hydrogen 3.096 N/A GLN 106.A NE2 VAL 302.A O no hydrogen 3.388 N/A LEU 107.A N LEU 103.A O no hydrogen 2.876 N/A ARG 108.A N GLN 104.A O no hydrogen 2.892 N/A ARG 108.A NE GLN 104.A OE1 no hydrogen 2.725 N/A PHE 109.A N GLY 105.A O no hydrogen 3.138 N/A ALA 110.A N GLN 106.A O no hydrogen 2.978 N/A ALA 111.A N LEU 107.A O no hydrogen 2.837 N/A LYS 112.A N ARG 108.A O no hydrogen 3.030 N/A LEU 113.A N PHE 109.A O no hydrogen 2.875 N/A ILE 114.A N ALA 110.A O no hydrogen 2.950 N/A GLU 115.A N ALA 111.A O no hydrogen 2.903 N/A GLY 116.A N LYS 112.A O no hydrogen 2.903 N/A VAL 117.A N LEU 113.A O no hydrogen 3.053 N/A LEU 118.A N ILE 114.A O no hydrogen 3.079 N/A ASP 119.A N GLU 115.A O no hydrogen 2.984 N/A PHE 120.A N GLY 116.A O no hydrogen 3.082 N/A LYS 121.A N VAL 117.A O no hydrogen 2.860 N/A LYS 121.A NZ ASP 125.A OD2 no hydrogen 2.650 N/A LYS 121.A NZ TYR 188.A OH no hydrogen 3.047 N/A VAL 122.A N LEU 118.A O no hydrogen 3.222 N/A VAL 122.A N ASP 119.A O no hydrogen 3.159 N/A MET 123.A N PHE 120.A O no hydrogen 3.019 N/A ASP 125.A N LYS 121.A O no hydrogen 2.864 N/A ASN 126.A N VAL 122.A O no hydrogen 3.086 N/A GLU 127.A N ILE 124.A O no hydrogen 3.261 N/A THR 128.A N MET 123.A O no hydrogen 2.826 N/A LEU 134.A N LYS 137.A O no hydrogen 2.847 N/A LYS 137.A N LEU 134.A O no hydrogen 2.966 N/A LEU 139.A N GLU 132.A O no hydrogen 2.896 N/A CYS 140.A N ARG 429.A O no hydrogen 2.706 N/A GLN 143.A NE2 GLY 434.A O no hydrogen 3.466 N/A TYR 144.A N MET 141.A O no hydrogen 3.117 N/A TYR 144.A OH GLU 132.A OE1 no hydrogen 2.613 N/A TYR 145.A N ASN 142.A O no hydrogen 2.995 N/A GLN 146.A N GLN 143.A O no hydrogen 2.977 N/A GLN 146.A NE2 ASN 142.A O no hydrogen 3.420 N/A GLN 146.A NE2 ASN 142.A OD1 no hydrogen 3.396 N/A SER 149.A N ILE 254.A O no hydrogen 2.818 N/A SER 150.A OG GLN 146.A O no hydrogen 2.744 N/A SER 150.A OG ILE 147.A O no hydrogen 3.219 N/A SER 150.A OG THR 297.A OG1 no hydrogen 2.588 N/A CYS 151.A N SER 162.A O no hydrogen 2.849 N/A CYS 151.A SG ARG 152.A O no hydrogen 3.439 N/A ARG 152.A N ASP 295.A O no hydrogen 2.915 N/A ARG 152.A NE ASP 159.A OD2 no hydrogen 2.787 N/A ARG 152.A NH1 GLU 313.A OE2 no hydrogen 2.882 N/A ARG 152.A NH2 TYR 78.A O no hydrogen 2.878 N/A ARG 152.A NH2 ASP 159.A OD2 no hydrogen 3.225 N/A VAL 153.A N THR 160.A O no hydrogen 2.801 N/A GLY 155.A N ASP 159.A OD1 no hydrogen 2.941 N/A ASP 159.A N LEU 79.A O no hydrogen 2.990 N/A THR 160.A N VAL 153.A O no hydrogen 3.015 N/A SER 162.A N CYS 151.A O no hydrogen 2.874 N/A ASN 163.A ND2 TYR 145.A O no hydrogen 3.095 N/A ASN 163.A ND2 GLN 146.A OE1 no hydrogen 3.085 N/A PHE 164.A N SER 149.A O no hydrogen 2.802 N/A SER 165.A N ASN 163.A OD1 no hydrogen 2.954 N/A SER 165.A OG ASN 163.A OD1 no hydrogen 2.585 N/A THR 167.A N PHE 164.A O no hydrogen 3.443 N/A THR 167.A OG1 PHE 164.A O no hydrogen 3.030 N/A HIS 173.A NE2 SER 249.A O no hydrogen 2.818 N/A ILE 174.A N LEU 185.A O no hydrogen 2.910 N/A THR 175.A N PHE 255.A O no hydrogen 3.094 N/A THR 175.A OG1 SER 253.A OG no hydrogen 2.935 N/A THR 175.A OG1 THR 256.A OG1 no hydrogen 2.769 N/A VAL 176.A N PHE 183.A O no hydrogen 3.015 N/A VAL 177.A N VAL 257.A O no hydrogen 3.002 N/A HIS 178.A N GLN 181.A O no hydrogen 3.028 N/A HIS 178.A ND1 LEU 259.A O no hydrogen 3.020 N/A ASN 179.A ND2 SER 211.A O no hydrogen 2.930 N/A TYR 180.A OH LEU 287.A O no hydrogen 3.054 N/A GLN 181.A N HIS 178.A O no hydrogen 3.020 N/A GLN 181.A NE2 GLN 213.A OE1 no hydrogen 3.280 N/A PHE 183.A N VAL 176.A O no hydrogen 2.786 N/A GLU 184.A N LYS 350.A O no hydrogen 2.720 N/A LEU 185.A N ILE 174.A O no hydrogen 2.776 N/A VAL 187.A N THR 172.A O no hydrogen 2.964 N/A HIS 189.A N THR 193.A O no hydrogen 2.730 N/A HIS 189.A NE2 GLN 199.A OE1 no hydrogen 2.869 N/A GLY 192.A N HIS 189.A O no hydrogen 2.885 N/A THR 193.A N ASP 191.A OD1 no hydrogen 2.928 N/A THR 193.A OG1 ASP 191.A OD1 no hydrogen 2.727 N/A LEU 195.A N VAL 187.A O no hydrogen 2.811 N/A THR 196.A N GLN 199.A OE1 no hydrogen 3.108 N/A THR 196.A OG1 ASP 198.A OD1 no hydrogen 2.583 N/A ALA 197.A N GLU 337.A OE1 no hydrogen 3.345 N/A ILE 200.A N THR 196.A O no hydrogen 2.936 N/A PHE 201.A N ALA 197.A O no hydrogen 2.935 N/A VAL 202.A N ASP 198.A O no hydrogen 3.147 N/A GLN 203.A N GLN 199.A O no hydrogen 3.070 N/A LEU 204.A N ILE 200.A O no hydrogen 2.870 N/A GLU 205.A N PHE 201.A O no hydrogen 3.049 N/A LYS 206.A N VAL 202.A O no hydrogen 3.384 N/A LYS 206.A NZ PRO 347.A O no hydrogen 3.482 N/A ILE 207.A N GLN 203.A O no hydrogen 3.022 N/A TRP 208.A N LEU 204.A O no hydrogen 2.823 N/A ASN 209.A N GLU 205.A O no hydrogen 2.956 N/A SER 210.A N ILE 207.A O no hydrogen 3.124 N/A SER 210.A OG LYS 206.A O no hydrogen 2.704 N/A SER 211.A N TRP 208.A O no hydrogen 3.049 N/A SER 211.A OG ILE 207.A O no hydrogen 2.747 N/A SER 211.A OG TRP 208.A O no hydrogen 3.277 N/A GLN 213.A N GLN 213.A OE1 no hydrogen 2.744 N/A VAL 219.A N GLU 217.A O no hydrogen 2.842 N/A ILE 221.A N PRO 218.A O no hydrogen 2.868 N/A LEU 222.A N VAL 219.A O no hydrogen 3.040 N/A THR 223.A N GLY 220.A O no hydrogen 3.091 N/A THR 223.A OG1 GLY 220.A O no hydrogen 2.655 N/A SER 224.A N ILE 221.A O no hydrogen 3.070 N/A SER 224.A OG ILE 221.A O no hydrogen 2.690 N/A ASN 225.A N LEU 222.A O no hydrogen 3.349 N/A HIS 226.A N ASN 225.A OD1 no hydrogen 2.675 N/A ARG 227.A N ARG 82.A O no hydrogen 2.934 N/A ARG 227.A NE ASP 159.A OD2 no hydrogen 2.772 N/A ARG 227.A NH1 ASP 295.A OD1 no hydrogen 3.053 N/A ARG 227.A NH2 ASP 159.A OD2 no hydrogen 2.866 N/A ARG 227.A NH2 ASP 295.A OD1 no hydrogen 2.868 N/A ASN 228.A N HIS 226.A ND1 no hydrogen 3.035 N/A TRP 230.A N HIS 226.A O no hydrogen 2.870 N/A TRP 230.A NE1 ASP 295.A OD2 no hydrogen 2.676 N/A ALA 231.A N ARG 227.A O no hydrogen 3.033 N/A LYS 232.A N ASN 228.A O no hydrogen 3.280 N/A LYS 232.A NZ ASP 363.A OD1 no hydrogen 2.972 N/A ALA 233.A N SER 229.A O no hydrogen 2.939 N/A TYR 234.A N TRP 230.A O no hydrogen 2.657 N/A ASN 235.A N ALA 231.A O no hydrogen 3.219 N/A THR 236.A N LYS 232.A O no hydrogen 3.307 N/A THR 236.A OG1 LYS 232.A O no hydrogen 3.469 N/A LEU 237.A N ALA 233.A O no hydrogen 2.785 N/A ILE 238.A N TYR 234.A O no hydrogen 3.057 N/A LYS 239.A N THR 236.A O no hydrogen 3.292 N/A LYS 241.A NZ ASP 245.A OD2 no hydrogen 2.541 N/A ASN 243.A N ASP 240.A OD2 no hydrogen 3.064 N/A ASN 243.A ND2 LEU 237.A O no hydrogen 3.062 N/A ASN 243.A ND2 ASN 355.A O no hydrogen 3.085 N/A ARG 244.A N ASP 240.A O no hydrogen 2.899 N/A ARG 244.A NH1 ILE 238.A O no hydrogen 2.907 N/A ARG 244.A NH1 LYS 239.A O no hydrogen 3.501 N/A ASP 245.A N LYS 241.A O no hydrogen 2.889 N/A SER 246.A N VAL 242.A O no hydrogen 2.971 N/A SER 246.A OG VAL 242.A O no hydrogen 3.247 N/A SER 246.A OG ARG 353.A O no hydrogen 2.698 N/A VAL 247.A N ASN 243.A O no hydrogen 2.874 N/A ARG 248.A N ARG 244.A O no hydrogen 2.903 N/A SER 249.A N ASP 245.A O no hydrogen 3.047 N/A SER 249.A OG HIS 173.A NE2 no hydrogen 3.360 N/A SER 249.A OG GLU 184.A OE1 no hydrogen 2.615 N/A ILE 250.A N SER 246.A O no hydrogen 3.109 N/A GLN 251.A N VAL 247.A O no hydrogen 2.893 N/A GLN 251.A NE2 TYR 234.A OH no hydrogen 3.030 N/A LYS 252.A N ARG 248.A O no hydrogen 2.939 N/A SER 253.A N SER 249.A O no hydrogen 3.020 N/A SER 253.A N ILE 250.A O no hydrogen 3.296 N/A SER 253.A OG THR 175.A OG1 no hydrogen 2.935 N/A SER 253.A OG ILE 250.A O no hydrogen 2.710 N/A ILE 254.A N HIS 173.A O no hydrogen 2.950 N/A THR 256.A N LEU 298.A O no hydrogen 3.104 N/A THR 256.A OG1 THR 175.A OG1 no hydrogen 2.769 N/A VAL 257.A N THR 175.A O no hydrogen 2.917 N/A CYS 258.A N PHE 300.A O no hydrogen 2.719 N/A CYS 258.A SG ASN 291.A O no hydrogen 3.393 N/A CYS 258.A SG GLN 299.A OE1 no hydrogen 3.638 N/A CYS 258.A SG PHE 300.A O no hydrogen 3.735 N/A LEU 259.A N VAL 177.A O no hydrogen 2.914 N/A ASP 260.A N VAL 302.A O no hydrogen 3.290 N/A ALA 261.A N ASN 288.A OD1 no hydrogen 2.909 N/A TYR 271.A OH SER 307.A OG no hydrogen 3.208 N/A HIS 274.A N VAL 270.A O no hydrogen 3.032 N/A VAL 275.A N TYR 271.A O no hydrogen 2.994 N/A ALA 276.A N ARG 272.A O no hydrogen 3.062 N/A GLY 277.A N SER 273.A O no hydrogen 3.309 N/A GLN 278.A N HIS 274.A O no hydrogen 3.076 N/A GLN 278.A NE2 ASP 260.A OD2 no hydrogen 2.830 N/A GLN 278.A NE2 ALA 261.A O no hydrogen 3.550 N/A MET 279.A N VAL 275.A O no hydrogen 2.943 N/A LEU 280.A N ALA 276.A O no hydrogen 2.911 N/A HIS 281.A N GLY 277.A O no hydrogen 2.861 N/A GLY 282.A N GLY 277.A O no hydrogen 3.280 N/A GLY 284.A N SER 289.A OG no hydrogen 2.935 N/A LEU 287.A N GLY 284.A O no hydrogen 2.820 N/A ASN 288.A N GLY 284.A O no hydrogen 3.322 N/A ASN 288.A ND2 ALA 261.A O no hydrogen 2.746 N/A SER 289.A N GLY 284.A O no hydrogen 3.360 N/A SER 289.A OG HIS 281.A O no hydrogen 2.720 N/A ASN 291.A N ASN 288.A O no hydrogen 3.041 N/A ARG 292.A NH1 ASP 260.A OD1 no hydrogen 2.867 N/A ARG 292.A NH1 ASP 260.A OD2 no hydrogen 3.529 N/A ARG 292.A NH1 ASN 291.A O no hydrogen 2.943 N/A ARG 292.A NH2 ASP 260.A OD2 no hydrogen 2.852 N/A ARG 292.A NH2 GLN 278.A O no hydrogen 3.099 N/A TRP 293.A N GLN 299.A OE1 no hydrogen 2.950 N/A PHE 294.A N THR 223.A OG1 no hydrogen 3.045 N/A LYS 296.A N TRP 293.A O no hydrogen 2.732 N/A LYS 296.A NZ SER 150.A O no hydrogen 2.842 N/A LYS 296.A NZ ILE 250.A O no hydrogen 3.331 N/A LYS 296.A NZ SER 253.A O no hydrogen 2.610 N/A THR 297.A OG1 SER 150.A OG no hydrogen 2.588 N/A GLN 299.A N VAL 311.A O no hydrogen 3.215 N/A PHE 300.A N THR 256.A O no hydrogen 2.844 N/A ILE 301.A N GLY 309.A O no hydrogen 2.760 N/A VAL 302.A N CYS 258.A O no hydrogen 2.943 N/A ALA 303.A N SER 307.A O no hydrogen 2.849 N/A GLU 304.A N ASP 260.A O no hydrogen 3.284 N/A GLY 306.A N ALA 303.A O no hydrogen 3.149 N/A SER 307.A N ASP 305.A OD1 no hydrogen 3.044 N/A SER 307.A OG ASP 305.A OD1 no hydrogen 2.971 N/A SER 307.A OG ASP 305.A OD2 no hydrogen 2.823 N/A CYS 308.A SG GLY 306.A O no hydrogen 3.585 N/A GLY 309.A N ILE 301.A O no hydrogen 2.867 N/A LEU 310.A N VAL 93.A O no hydrogen 3.021 N/A VAL 311.A N GLN 299.A O no hydrogen 3.065 N/A TYR 312.A N PRO 91.A O no hydrogen 3.137 N/A TYR 312.A OH ALA 317.A O no hydrogen 3.090 N/A GLU 313.A N THR 297.A O no hydrogen 2.940 N/A HIS 314.A ND1 HIS 314.A O no hydrogen 2.807 N/A ALA 315.A N GLU 313.A OE1 no hydrogen 2.931 N/A GLU 318.A N GLN 143.A OE1 no hydrogen 2.889 N/A VAL 323.A N GLY 319.A O no hydrogen 3.045 N/A THR 324.A N PRO 320.A O no hydrogen 3.045 N/A THR 324.A N PRO 321.A O no hydrogen 3.248 N/A THR 324.A OG1 PRO 320.A O no hydrogen 2.835 N/A LEU 325.A N PRO 321.A O no hydrogen 3.021 N/A LEU 326.A N ILE 322.A O no hydrogen 2.962 N/A ASP 327.A N VAL 323.A O no hydrogen 2.787 N/A TYR 328.A N THR 324.A O no hydrogen 3.109 N/A TYR 328.A OH ASP 119.A OD2 no hydrogen 2.504 N/A VAL 329.A N LEU 325.A O no hydrogen 3.014 N/A ILE 330.A N LEU 326.A O no hydrogen 2.828 N/A GLU 331.A N ASP 327.A O no hydrogen 2.884 N/A TYR 332.A N TYR 328.A O no hydrogen 2.958 N/A THR 333.A N VAL 329.A O no hydrogen 2.999 N/A THR 333.A OG1 ILE 330.A O no hydrogen 2.592 N/A LYS 334.A N GLU 331.A O no hydrogen 3.157 N/A LYS 335.A N TYR 332.A O no hydrogen 3.056 N/A SER 341.A N THR 196.A OG1 no hydrogen 2.974 N/A SER 341.A OG HIS 189.A NE2 no hydrogen 3.327 N/A LYS 350.A N GLU 184.A O no hydrogen 3.200 N/A LEU 352.A N PHE 182.A O no hydrogen 2.847 N/A ASN 355.A N ASN 243.A OD1 no hydrogen 2.630 N/A ASN 355.A ND2 ASP 240.A OD1 no hydrogen 3.534 N/A ASN 355.A ND2 ASP 240.A OD2 no hydrogen 2.742 N/A ILE 360.A N THR 357.A OG1 no hydrogen 3.378 N/A LYS 361.A N THR 357.A O no hydrogen 2.874 N/A LYS 361.A NZ GLU 217.A OE1 no hydrogen 3.166 N/A LYS 361.A NZ GLU 217.A OE2 no hydrogen 2.736 N/A LYS 361.A NZ GLU 365.A OE2 no hydrogen 2.851 N/A SER 362.A N PRO 358.A O no hydrogen 2.910 N/A SER 362.A OG PRO 358.A O no hydrogen 3.000 N/A ASP 363.A N GLU 359.A O no hydrogen 3.052 N/A ILE 364.A N ILE 360.A O no hydrogen 2.876 N/A GLU 365.A N LYS 361.A O no hydrogen 2.924 N/A LYS 366.A N SER 362.A O no hydrogen 3.073 N/A ALA 367.A N ASP 363.A O no hydrogen 2.925 N/A LYS 368.A N ILE 364.A O no hydrogen 2.967 N/A LYS 368.A NZ GLU 365.A OE2 no hydrogen 2.933 N/A GLN 369.A N GLU 365.A O no hydrogen 3.052 N/A ASN 370.A N LYS 366.A O no hydrogen 2.998 N/A LEU 371.A N ALA 367.A O no hydrogen 3.013 N/A SER 372.A N LYS 368.A O no hydrogen 3.029 N/A SER 372.A OG LYS 368.A O no hydrogen 2.885 N/A ILE 373.A N GLN 369.A O no hydrogen 3.236 N/A MET 374.A N ASN 370.A O no hydrogen 3.110 N/A ILE 375.A N LEU 371.A O no hydrogen 2.827 N/A GLN 376.A N SER 372.A O no hydrogen 2.928 N/A ASP 377.A N ILE 373.A O no hydrogen 3.217 N/A ASP 377.A N MET 374.A O no hydrogen 3.249 N/A LEU 378.A N ILE 375.A O no hydrogen 3.096 N/A ASP 379.A N ALA 562.A O no hydrogen 2.766 N/A THR 381.A N LEU 560.A O no hydrogen 2.898 N/A VAL 382.A N SER 273.A OG no hydrogen 3.017 N/A MET 383.A N PHE 558.A O no hydrogen 2.925 N/A PHE 385.A N ILE 556.A O no hydrogen 2.828 N/A HIS 387.A NE2 GLU 579.A OE2 no hydrogen 2.994 N/A GLY 389.A N ASP 391.A OD1 no hydrogen 2.928 N/A LYS 390.A N MET 552.A O no hydrogen 2.900 N/A ASP 391.A N GLU 553.A O no hydrogen 2.974 N/A PHE 392.A N ASP 391.A OD1 no hydrogen 2.633 N/A LYS 394.A N LYS 390.A O no hydrogen 3.111 N/A SER 395.A N ASP 391.A O no hydrogen 3.049 N/A SER 395.A OG PHE 392.A O no hydrogen 2.588 N/A GLU 396.A N PRO 393.A O no hydrogen 2.986 N/A LYS 397.A N LYS 394.A O no hydrogen 2.976 N/A LEU 398.A N PRO 393.A O no hydrogen 2.907 N/A ALA 402.A N SER 399.A OG no hydrogen 3.318 N/A PHE 403.A N SER 399.A O no hydrogen 2.898 N/A ILE 404.A N PRO 400.A O no hydrogen 2.939 N/A GLN 405.A N ASP 401.A O no hydrogen 2.932 N/A GLN 405.A NE2 THR 524.A OG1 no hydrogen 3.023 N/A GLN 405.A NE2 TYR 549.A OH no hydrogen 2.828 N/A MET 406.A N ALA 402.A O no hydrogen 2.978 N/A ALA 407.A N PHE 403.A O no hydrogen 3.010 N/A LEU 408.A N ILE 404.A O no hydrogen 2.982 N/A GLN 409.A N GLN 405.A O no hydrogen 3.060 N/A GLN 409.A NE2 THR 422.A OG1 no hydrogen 3.101 N/A LEU 410.A N MET 406.A O no hydrogen 2.928 N/A ALA 411.A N ALA 407.A O no hydrogen 2.890 N/A TYR 412.A N LEU 408.A O no hydrogen 2.950 N/A TYR 413.A N GLN 409.A O no hydrogen 3.008 N/A ARG 414.A N LEU 410.A O no hydrogen 2.943 N/A ARG 414.A NE ASP 454.A OD2 no hydrogen 2.934 N/A ARG 414.A NH1 ASP 584.A OD2 no hydrogen 2.792 N/A ARG 414.A NH2 ASP 454.A OD1 no hydrogen 2.841 N/A ARG 414.A NH2 ASP 584.A OD2 no hydrogen 2.943 N/A ILE 415.A N ALA 411.A O no hydrogen 3.244 N/A ILE 415.A N TYR 412.A O no hydrogen 3.241 N/A TYR 416.A N TYR 412.A O no hydrogen 3.002 N/A TYR 416.A OH TYR 545.A OH no hydrogen 2.723 N/A TYR 416.A OH GLU 568.A O no hydrogen 2.714 N/A CYS 420.A SG ALA 421.A O no hydrogen 3.772 N/A CYS 420.A SG THR 422.A OG1 no hydrogen 3.732 N/A THR 422.A OG1 CYS 420.A O no hydrogen 2.947 N/A TYR 423.A N LEU 522.A O no hydrogen 2.858 N/A GLU 424.A N ILE 439.A O no hydrogen 2.746 N/A SER 425.A N THR 524.A O no hydrogen 3.151 N/A SER 425.A OG SER 525.A OG no hydrogen 2.799 N/A ALA 426.A N ASP 437.A O no hydrogen 3.079 N/A LEU 428.A N ARG 435.A O no hydrogen 2.938 N/A ARG 429.A N SER 427.A OG no hydrogen 3.336 N/A ARG 429.A NH1 GLU 132.A OE1 no hydrogen 2.967 N/A ARG 429.A NH1 CYS 140.A O no hydrogen 3.063 N/A ARG 429.A NH2 GLU 132.A OE1 no hydrogen 3.068 N/A PHE 431.A N LEU 428.A O no hydrogen 3.053 N/A HIS 432.A N PRO 7.A O no hydrogen 2.978 N/A GLY 434.A N PHE 431.A O no hydrogen 2.871 N/A ARG 435.A NE GLU 318.A OE2 no hydrogen 2.817 N/A ARG 435.A NH1 ALA 315.A O no hydrogen 3.067 N/A ARG 435.A NH2 HIS 314.A O no hydrogen 3.113 N/A ARG 435.A NH2 GLU 318.A OE2 no hydrogen 2.903 N/A ASP 437.A N ALA 426.A O no hydrogen 3.131 N/A THR 438.A N ASP 437.A OD1 no hydrogen 2.646 N/A ILE 439.A N GLU 424.A O no hydrogen 2.891 N/A ARG 440.A NE ASP 488.A OD2 no hydrogen 2.907 N/A ARG 440.A NH1 ALA 517.A O no hydrogen 2.751 N/A ARG 440.A NH2 ASP 488.A OD1 no hydrogen 2.793 N/A ARG 440.A NH2 ASP 488.A OD2 no hydrogen 3.548 N/A ARG 440.A NH2 ALA 517.A O no hydrogen 3.084 N/A SER 441.A OG GLN 405.A OE1 no hydrogen 2.638 N/A SER 443.A N SER 446.A OG no hydrogen 2.851 N/A SER 446.A N SER 443.A OG no hydrogen 3.010 N/A SER 446.A OG SER 443.A O no hydrogen 2.990 N/A LEU 447.A N SER 443.A O no hydrogen 2.900 N/A THR 448.A N MET 444.A O no hydrogen 2.916 N/A THR 448.A OG1 MET 444.A O no hydrogen 2.727 N/A PHE 449.A N ASP 445.A O no hydrogen 2.991 N/A VAL 450.A N SER 446.A O no hydrogen 2.955 N/A LYS 451.A N LEU 447.A O no hydrogen 3.051 N/A ALA 452.A N THR 448.A O no hydrogen 3.243 N/A ALA 452.A N PHE 449.A O no hydrogen 3.193 N/A MET 453.A N PHE 449.A O no hydrogen 2.956 N/A ASP 455.A N ALA 452.A O no hydrogen 3.095 N/A SER 457.A N ASP 455.A OD1 no hydrogen 2.780 N/A SER 457.A OG ASP 455.A OD1 no hydrogen 2.599 N/A VAL 458.A N ASP 455.A O no hydrogen 3.199 N/A GLN 462.A N THR 459.A OG1 no hydrogen 3.014 N/A LYS 463.A N THR 459.A O no hydrogen 3.048 N/A LYS 463.A NZ MET 453.A O no hydrogen 3.012 N/A LYS 463.A NZ ASP 455.A O no hydrogen 3.182 N/A VAL 464.A N GLU 460.A O no hydrogen 3.034 N/A GLU 465.A N HIS 461.A O no hydrogen 3.143 N/A LEU 466.A N GLN 462.A O no hydrogen 2.934 N/A LEU 467.A N LYS 463.A O no hydrogen 2.881 N/A ARG 468.A N VAL 464.A O no hydrogen 2.963 N/A ARG 468.A NH1 GLU 396.A O no hydrogen 3.058 N/A ARG 468.A NH2 GLU 396.A O no hydrogen 3.155 N/A LYS 469.A N GLU 465.A O no hydrogen 2.926 N/A ALA 470.A N LEU 466.A O no hydrogen 3.015 N/A VAL 471.A N LEU 467.A O no hydrogen 2.986 N/A GLN 472.A N ARG 468.A O no hydrogen 2.896 N/A ALA 473.A N LYS 469.A O no hydrogen 2.945 N/A HIS 474.A N ALA 470.A O no hydrogen 3.001 N/A HIS 474.A NE2 GLU 424.A OE1 no hydrogen 2.837 N/A ARG 475.A N VAL 471.A O no hydrogen 2.968 N/A GLY 476.A N GLN 472.A O no hydrogen 3.031 N/A TYR 477.A N ALA 473.A O no hydrogen 3.049 N/A THR 478.A N HIS 474.A O no hydrogen 2.910 N/A THR 478.A OG1 HIS 474.A O no hydrogen 2.927 N/A ASP 479.A N ARG 475.A O no hydrogen 2.925 N/A ARG 480.A N GLY 476.A O no hydrogen 3.083 N/A ALA 481.A N TYR 477.A O no hydrogen 2.919 N/A ILE 482.A N THR 478.A O no hydrogen 3.016 N/A ARG 483.A N ASP 479.A O no hydrogen 3.260 N/A ARG 483.A N ARG 480.A O no hydrogen 3.178 N/A GLY 484.A N ALA 481.A O no hydrogen 3.025 N/A GLU 485.A N ARG 480.A O no hydrogen 2.803 N/A ARG 489.A N ASP 437.A OD1 no hydrogen 3.176 N/A HIS 490.A ND1 SER 17.A OG no hydrogen 2.598 N/A HIS 490.A NE2 GLN 55.A OE1 no hydrogen 2.813 N/A LEU 491.A N PHE 487.A O no hydrogen 2.945 N/A LEU 492.A N ASP 488.A O no hydrogen 3.098 N/A GLY 493.A N ARG 489.A O no hydrogen 2.846 N/A LEU 494.A N HIS 490.A O no hydrogen 2.941 N/A LYS 495.A N LEU 491.A O no hydrogen 3.068 N/A LEU 496.A N LEU 492.A O no hydrogen 2.886 N/A GLN 497.A N GLY 493.A O no hydrogen 2.745 N/A GLN 497.A NE2 ASP 501.A OD1 no hydrogen 2.653 N/A ALA 498.A N LEU 494.A O no hydrogen 3.069 N/A ILE 499.A N LYS 495.A O no hydrogen 3.394 N/A GLU 500.A N LEU 496.A O no hydrogen 3.105 N/A ASP 501.A N GLN 497.A O no hydrogen 2.890 N/A LEU 502.A N ILE 499.A O no hydrogen 3.087 N/A VAL 503.A N ALA 498.A O no hydrogen 3.060 N/A PHE 509.A N PRO 506.A O no hydrogen 3.000 N/A MET 510.A N ASP 507.A O no hydrogen 3.024 N/A SER 513.A N ASP 511.A OD1 no hydrogen 3.146 N/A SER 513.A OG GLU 33.A O no hydrogen 3.528 N/A SER 513.A OG THR 37.A OG1 no hydrogen 2.616 N/A TYR 514.A N ASP 511.A O no hydrogen 3.003 N/A ALA 515.A N ASP 511.A O no hydrogen 3.294 N/A ILE 516.A N THR 512.A O no hydrogen 3.049 N/A ALA 517.A N SER 513.A O no hydrogen 2.884 N/A MET 518.A N TYR 514.A O no hydrogen 2.909 N/A HIS 519.A N ILE 516.A O no hydrogen 3.257 N/A HIS 521.A ND1 ASP 543.A O no hydrogen 3.240 N/A SER 523.A N TYR 545.A O no hydrogen 3.016 N/A THR 524.A N TYR 423.A O no hydrogen 2.738 N/A THR 524.A OG1 TYR 423.A O no hydrogen 2.771 N/A SER 525.A N VAL 547.A O no hydrogen 3.058 N/A SER 525.A OG SER 425.A OG no hydrogen 2.799 N/A VAL 527.A N TYR 549.A O no hydrogen 2.912 N/A LYS 530.A N ASP 327.A OD2 no hydrogen 2.880 N/A THR 531.A N ASP 327.A OD1 no hydrogen 2.896 N/A THR 531.A OG1 ASP 327.A OD1 no hydrogen 2.699 N/A CYS 533.A N THR 531.A O no hydrogen 2.719 N/A CYS 533.A SG THR 531.A O no hydrogen 3.679 N/A VAL 534.A N MET 94.A O no hydrogen 3.254 N/A PHE 536.A N GLY 92.A O no hydrogen 2.894 N/A GLY 538.A N ILE 87.A O no hydrogen 3.038 N/A GLY 544.A N VAL 541.A O no hydrogen 3.150 N/A TYR 545.A N HIS 521.A O no hydrogen 2.726 N/A TYR 545.A OH TYR 416.A OH no hydrogen 2.723 N/A GLY 546.A N SER 561.A O no hydrogen 3.046 N/A VAL 547.A N SER 523.A O no hydrogen 2.904 N/A CYS 548.A N SER 559.A O no hydrogen 2.987 N/A CYS 548.A SG SER 525.A O no hydrogen 3.464 N/A TYR 549.A N SER 525.A O no hydrogen 3.268 N/A TYR 549.A OH ASP 401.A OD1 no hydrogen 2.586 N/A ASN 550.A N ASN 557.A O no hydrogen 2.903 N/A ASN 550.A ND2 ALA 529.A O no hydrogen 3.546 N/A MET 552.A N HIS 555.A O no hydrogen 2.780 N/A HIS 555.A NE2 ASP 532.A OD1 no hydrogen 2.741 N/A ILE 556.A N PHE 385.A O no hydrogen 2.941 N/A ASN 557.A N ASN 550.A O no hydrogen 3.058 N/A ASN 557.A ND2 ASP 532.A OD1 no hydrogen 2.760 N/A ASN 557.A ND2 CYS 533.A O no hydrogen 3.072 N/A PHE 558.A N MET 383.A O no hydrogen 2.823 N/A SER 559.A N CYS 548.A O no hydrogen 2.799 N/A LEU 560.A N THR 381.A O no hydrogen 2.954 N/A SER 561.A N GLY 546.A O no hydrogen 2.828 N/A SER 561.A OG PHE 537.A O no hydrogen 2.659 N/A SER 561.A OG GLY 546.A O no hydrogen 3.290 N/A ALA 562.A N ASP 379.A O no hydrogen 2.749 N/A TYR 563.A OH PRO 539.A O no hydrogen 2.841 N/A ASN 564.A N ASP 377.A O no hydrogen 2.774 N/A ASN 564.A ND2 GLN 376.A O no hydrogen 2.985 N/A SER 565.A N ASP 377.A OD1 no hydrogen 2.671 N/A SER 565.A OG ASP 377.A OD1 no hydrogen 3.417 N/A SER 565.A OG ASP 377.A OD2 no hydrogen 3.276 N/A CYS 566.A N TYR 563.A O no hydrogen 3.155 N/A CYS 566.A SG GLU 568.A OE1 no hydrogen 3.208 N/A GLU 568.A N GLU 568.A OE1 no hydrogen 2.537 N/A THR 569.A N CYS 566.A O no hydrogen 3.171 N/A THR 569.A OG1 CYS 566.A O no hydrogen 3.161 N/A ASN 570.A N TYR 545.A OH no hydrogen 3.085 N/A ALA 571.A N ASP 379.A OD2 no hydrogen 2.825 N/A ARG 573.A N ASN 570.A OD1 no hydrogen 2.867 N/A LEU 574.A N ASN 570.A O no hydrogen 3.090 N/A ALA 575.A N ALA 571.A O no hydrogen 2.919 N/A HIS 576.A N ALA 572.A O no hydrogen 2.974 N/A TYR 577.A N ARG 573.A O no hydrogen 3.050 N/A LEU 578.A N LEU 574.A O no hydrogen 2.809 N/A GLU 579.A N ALA 575.A O no hydrogen 2.937 N/A LYS 580.A N HIS 576.A O no hydrogen 3.098 N/A LYS 580.A NZ ASP 584.A OD1 no hydrogen 3.099 N/A ALA 581.A N TYR 577.A O no hydrogen 2.813 N/A LEU 582.A N LEU 578.A O no hydrogen 3.027 N/A LEU 583.A N GLU 579.A O no hydrogen 3.134 N/A ASP 584.A N LYS 580.A O no hydrogen 2.770 N/A MET 585.A N ALA 581.A O no hydrogen 2.944 N/A ARG 586.A N LEU 582.A O no hydrogen 3.098 N/A ALA 587.A N LEU 583.A O no hydrogen 2.953 N/A LEU 588.A N ASP 584.A O no hydrogen 2.964 N/A LEU 589.A N MET 585.A O no hydrogen 3.097 N/A GLN 590.A N ARG 586.A O no hydrogen 2.892 N/A SER 591.A N LEU 588.A O no hydrogen 3.413 N/A SER 591.A OG LEU 588.A O no hydrogen 2.774 N/A