Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cgm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 9.A O no hydrogen 3.020 N/A GLY 5.A N ILE 7.A O no hydrogen 2.910 N/A ARG 6.A NH1 ARG 6.A O no hydrogen 3.142 N/A ARG 6.A NH1 GLU 40.A OE1 no hydrogen 2.583 N/A ARG 6.A NH2 GLU 40.A OE1 no hydrogen 3.303 N/A ARG 6.A NH2 GLU 40.A OE2 no hydrogen 2.777 N/A VAL 8.A N TRP 38.A O no hydrogen 2.969 N/A ILE 9.A N VAL 3.A O no hydrogen 2.895 N/A ASP 10.A N THR 36.A O no hydrogen 2.792 N/A GLN 13.A N ALA 34.A O no hydrogen 2.933 N/A VAL 15.A N GLN 13.A OE1 no hydrogen 3.035 N/A GLY 19.A N VAL 16.A O no hydrogen 2.884 N/A ARG 20.A N SER 17.A O no hydrogen 3.207 N/A TYR 21.A N VAL 16.A O no hydrogen 3.476 N/A ALA 23.A N GLY 193.A O no hydrogen 2.987 N/A LYS 24.A N ASP 459.A O no hydrogen 2.969 N/A LYS 24.A NZ ALA 427.A O no hydrogen 2.733 N/A LYS 24.A NZ ILE 460.A O no hydrogen 3.127 N/A ALA 25.A N TRP 195.A O no hydrogen 3.292 N/A VAL 26.A N GLU 29.A OE1 no hydrogen 3.035 N/A VAL 27.A N ASP 197.A O no hydrogen 2.992 N/A GLY 28.A N PRO 88.A O no hydrogen 2.928 N/A GLU 29.A N VAL 26.A O no hydrogen 3.069 N/A VAL 31.A N PHE 86.A O no hydrogen 2.841 N/A VAL 33.A N GLY 84.A O no hydrogen 2.874 N/A ALA 34.A N GLN 13.A O no hydrogen 3.030 N/A ALA 35.A N PHE 82.A O no hydrogen 3.084 N/A THR 36.A N ASP 10.A O no hydrogen 2.804 N/A VAL 37.A N ASP 80.A O no hydrogen 2.839 N/A TRP 38.A N VAL 8.A O no hydrogen 3.021 N/A ARG 39.A NE GLU 40.A OE1 no hydrogen 3.345 N/A ARG 39.A NH1 ALA 44.A O no hydrogen 3.309 N/A ARG 39.A NH1 GLU 184.A OE2 no hydrogen 3.411 N/A ARG 39.A NH2 GLU 40.A OE2 no hydrogen 2.996 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.809 N/A ALA 44.A N SER 107.A OG no hydrogen 2.895 N/A ALA 46.A N TRP 101.A O no hydrogen 2.830 N/A THR 48.A N ASP 99.A O no hydrogen 2.807 N/A LEU 49.A N LEU 71.A O no hydrogen 2.774 N/A VAL 50.A N ARG 97.A O no hydrogen 2.741 N/A VAL 51.A N GLN 69.A O no hydrogen 2.852 N/A ARG 52.A N THR 95.A O no hydrogen 2.965 N/A TYR 53.A OH VAL 91.A O no hydrogen 2.624 N/A HIS 54.A N LEU 93.A O no hydrogen 2.763 N/A TYR 58.A N ASN 405.A OD1 no hydrogen 2.931 N/A GLN 69.A N VAL 51.A O no hydrogen 2.891 N/A LEU 71.A N LEU 49.A O no hydrogen 2.744 N/A MET 73.A N ALA 47.A O no hydrogen 3.277 N/A SER 74.A N HIS 83.A O no hydrogen 2.824 N/A GLY 76.A N VAL 81.A O no hydrogen 3.055 N/A VAL 81.A N THR 78.A O no hydrogen 3.272 N/A PHE 82.A N ALA 35.A O no hydrogen 2.838 N/A HIS 83.A N SER 74.A O no hydrogen 2.876 N/A GLY 84.A N VAL 33.A O no hydrogen 2.803 N/A PHE 86.A N VAL 31.A O no hydrogen 3.230 N/A ARG 90.A NE ASP 89.A OD1 no hydrogen 2.889 N/A ARG 90.A NH2 ASP 89.A OD1 no hydrogen 3.415 N/A ARG 90.A NH2 ASP 89.A OD2 no hydrogen 2.785 N/A GLY 92.A N VAL 196.A O no hydrogen 2.861 N/A LEU 93.A N GLY 55.A O no hydrogen 2.887 N/A TRP 94.A N VAL 194.A O no hydrogen 2.880 N/A TRP 94.A NE1 ARG 90.A O no hydrogen 2.936 N/A THR 95.A N ARG 52.A O no hydrogen 2.885 N/A TYR 96.A N TYR 192.A O no hydrogen 3.005 N/A TYR 96.A OH PRO 14.A O no hydrogen 2.686 N/A ARG 97.A N VAL 50.A O no hydrogen 2.889 N/A ARG 97.A NE ASP 99.A OD1 no hydrogen 2.861 N/A ARG 97.A NH1 ASP 99.A OD2 no hydrogen 3.081 N/A ASP 99.A N THR 48.A O no hydrogen 2.812 N/A GLY 100.A N THR 187.A O no hydrogen 2.879 N/A TRP 101.A N ALA 46.A O no hydrogen 2.984 N/A TRP 101.A NE1 THR 48.A OG1 no hydrogen 2.828 N/A GLY 102.A N GLU 184.A O no hydrogen 2.765 N/A ASP 103.A N ALA 44.A O no hydrogen 3.038 N/A ALA 106.A N ASP 103.A OD1 no hydrogen 3.368 N/A SER 107.A N ASP 103.A O no hydrogen 3.370 N/A SER 107.A OG ASP 103.A O no hydrogen 3.308 N/A TRP 108.A N PRO 104.A O no hydrogen 2.898 N/A TRP 108.A NE1 ASP 125.A O no hydrogen 2.741 N/A ARG 109.A N ILE 105.A O no hydrogen 2.790 N/A HIS 110.A N ALA 106.A O no hydrogen 3.077 N/A ASN 111.A N SER 107.A O no hydrogen 3.062 N/A VAL 112.A N TRP 108.A O no hydrogen 2.949 N/A THR 113.A N ARG 109.A O no hydrogen 3.140 N/A THR 113.A OG1 ARG 109.A O no hydrogen 2.571 N/A THR 113.A OG1 HIS 110.A O no hydrogen 2.881 N/A ALA 114.A N HIS 110.A O no hydrogen 3.103 N/A LYS 115.A N ASN 111.A O no hydrogen 3.322 N/A LYS 115.A NZ ASP 125.A OD2 no hydrogen 2.718 N/A LEU 116.A N VAL 112.A O no hydrogen 2.906 N/A LEU 122.A N GLY 118.A O no hydrogen 3.249 N/A ASN 123.A N GLU 119.A O no hydrogen 2.902 N/A LEU 126.A N LEU 122.A O no hydrogen 2.891 N/A LEU 127.A N ASN 123.A O no hydrogen 3.078 N/A VAL 128.A N ASN 124.A O no hydrogen 2.892 N/A GLY 129.A N ASP 125.A O no hydrogen 2.923 N/A ALA 130.A N LEU 126.A O no hydrogen 3.110 N/A ARG 131.A N LEU 127.A O no hydrogen 3.222 N/A LEU 132.A N VAL 128.A O no hydrogen 3.026 N/A LEU 133.A N GLY 129.A O no hydrogen 3.055 N/A GLU 134.A N ALA 130.A O no hydrogen 3.237 N/A ARG 135.A N ARG 131.A O no hydrogen 2.967 N/A ALA 136.A N LEU 132.A O no hydrogen 2.872 N/A ALA 137.A N LEU 133.A O no hydrogen 2.877 N/A THR 138.A N GLU 134.A O no hydrogen 3.319 N/A THR 138.A OG1 ARG 135.A O no hydrogen 2.669 N/A GLY 139.A N ALA 136.A O no hydrogen 3.038 N/A VAL 140.A N ALA 137.A O no hydrogen 3.047 N/A LEU 144.A N PRO 141.A O no hydrogen 2.800 N/A ARG 145.A NE ALA 137.A O no hydrogen 2.933 N/A ARG 145.A NE VAL 140.A O no hydrogen 2.927 N/A ARG 145.A NH1 VAL 140.A O no hydrogen 3.443 N/A LEU 148.A N ARG 145.A O no hydrogen 2.911 N/A LEU 149.A N ARG 145.A O no hydrogen 3.118 N/A GLU 150.A N GLU 146.A O no hydrogen 2.943 N/A ALA 151.A N ALA 147.A O no hydrogen 3.122 N/A ALA 152.A N LEU 148.A O no hydrogen 3.066 N/A ALA 153.A N LEU 149.A O no hydrogen 3.135 N/A ALA 154.A N GLU 150.A O no hydrogen 3.004 N/A LEU 155.A N ALA 151.A O no hydrogen 3.038 N/A ARG 156.A N ALA 153.A O no hydrogen 3.085 N/A ARG 156.A NH1 GLU 134.A OE1 no hydrogen 2.892 N/A ARG 156.A NH1 GLU 134.A OE2 no hydrogen 3.366 N/A ARG 156.A NH2 GLU 134.A OE2 no hydrogen 2.660 N/A ALA 157.A N ALA 153.A O no hydrogen 3.015 N/A PHE 162.A N ASP 160.A OD1 no hydrogen 3.295 N/A THR 163.A N ASP 160.A OD2 no hydrogen 3.107 N/A THR 163.A OG1 ASP 160.A OD2 no hydrogen 2.774 N/A ARG 164.A N ASP 160.A O no hydrogen 3.156 N/A ARG 164.A NE LEU 155.A O no hydrogen 2.948 N/A ARG 164.A NH1 ASN 123.A OD1 no hydrogen 3.225 N/A ARG 164.A NH2 ASN 123.A OD1 no hydrogen 3.009 N/A ARG 164.A NH2 LEU 155.A O no hydrogen 2.814 N/A ALA 165.A N PRO 161.A O no hydrogen 2.852 N/A LEU 169.A N ALA 165.A O no hydrogen 2.998 N/A LEU 169.A N GLY 166.A O no hydrogen 3.221 N/A SER 170.A N ALA 167.A O no hydrogen 3.246 N/A SER 170.A OG ALA 167.A O no hydrogen 2.934 N/A VAL 173.A N SER 170.A OG no hydrogen 3.425 N/A SER 174.A N SER 170.A O no hydrogen 3.039 N/A ASP 175.A N ALA 171.A O no hydrogen 2.735 N/A LEU 176.A N GLU 172.A O no hydrogen 3.430 N/A LEU 177.A N VAL 173.A O no hydrogen 3.010 N/A ALA 178.A N SER 174.A O no hydrogen 3.036 N/A GLU 179.A N ASP 175.A O no hydrogen 3.238 N/A GLU 179.A N LEU 176.A O no hydrogen 3.149 N/A TYR 180.A N LEU 176.A O no hydrogen 2.872 N/A ARG 183.A NH1 THR 48.A OG1 no hydrogen 3.376 N/A GLU 184.A N GLY 102.A O no hydrogen 3.089 N/A THR 187.A N GLY 100.A O no hydrogen 2.768 N/A THR 187.A OG1 PHE 185.A O no hydrogen 2.899 N/A GLY 189.A N VAL 98.A O no hydrogen 2.834 N/A TYR 192.A N TYR 96.A O no hydrogen 2.927 N/A VAL 194.A N TRP 94.A O no hydrogen 2.742 N/A TRP 195.A N ALA 23.A O no hydrogen 3.040 N/A TRP 195.A NE1 ASP 197.A OD1 no hydrogen 2.904 N/A VAL 196.A N GLY 92.A O no hydrogen 2.809 N/A ASP 197.A N ALA 25.A O no hydrogen 3.078 N/A ARG 198.A NE ASP 409.A O no hydrogen 2.802 N/A ARG 198.A NH1 GLU 200.A OE1 no hydrogen 3.295 N/A ARG 198.A NH1 GLU 312.A OE1 no hydrogen 3.334 N/A ARG 198.A NH1 GLU 312.A OE2 no hydrogen 2.859 N/A ARG 198.A NH2 GLU 312.A OE1 no hydrogen 2.822 N/A ARG 198.A NH2 ASN 381.A O no hydrogen 3.498 N/A ARG 198.A NH2 ASP 409.A O no hydrogen 3.293 N/A ALA 201.A N ARG 198.A O no hydrogen 3.157 N/A ARG 202.A N PRO 199.A O no hydrogen 2.978 N/A ARG 202.A NH1 GLU 562.A OE2 no hydrogen 3.389 N/A ARG 202.A NH2 GLU 562.A OE1 no hydrogen 3.284 N/A ARG 202.A NH2 GLU 562.A OE2 no hydrogen 3.195 N/A PHE 203.A N PRO 199.A O no hydrogen 2.966 N/A SER 204.A N PRO 497.A O no hydrogen 3.260 N/A SER 204.A OG GLU 200.A O no hydrogen 2.862 N/A SER 205.A N ASP 244.A OD1 no hydrogen 3.068 N/A TRP 206.A N TRP 499.A O no hydrogen 2.879 N/A TRP 206.A NE1 SER 204.A OG no hydrogen 3.122 N/A TYR 207.A N VAL 245.A O no hydrogen 2.893 N/A TYR 207.A OH SER 503.A OG.A no hydrogen 2.762 N/A TYR 207.A OH GLU 506.A OE2 no hydrogen 2.566 N/A GLU 208.A N VAL 501.A O no hydrogen 2.906 N/A MET 209.A N TYR 247.A O no hydrogen 3.095 N/A ARG 212.A NH1 GLY 274.A O no hydrogen 2.859 N/A ARG 212.A NH2 GLY 274.A O no hydrogen 3.001 N/A ARG 212.A NH2 GLU 524.A O no hydrogen 3.153 N/A ARG 212.A NH2 LYS 525.A O no hydrogen 2.993 N/A SER 213.A N PHE 210.A O no hydrogen 3.021 N/A SER 213.A OG GLU 524.A OE2 no hydrogen 2.665 N/A THR 214.A N PRO 211.A O no hydrogen 3.117 N/A THR 214.A OG1 PRO 211.A O no hydrogen 2.541 N/A THR 214.A OG1 THR 230.A OG1 no hydrogen 2.930 N/A ASP 218.A N ARG 222.A O no hydrogen 2.976 N/A GLU 220.A N ASP 218.A OD1 no hydrogen 3.008 N/A GLY 221.A N ASP 218.A O no hydrogen 3.076 N/A ARG 222.A N ASP 218.A OD1 no hydrogen 2.969 N/A ARG 222.A NE ASP 218.A OD2 no hydrogen 2.731 N/A ARG 222.A NH2 ASP 218.A OD2 no hydrogen 3.014 N/A VAL 224.A N GLY 216.A O no hydrogen 2.873 N/A HIS 225.A ND1 GLY 226.A O no hydrogen 2.803 N/A GLY 226.A N ARG 212.A O no hydrogen 2.756 N/A THR 227.A N THR 230.A OG1 no hydrogen 2.858 N/A PHE 228.A N LEU 293.A O no hydrogen 2.832 N/A THR 230.A N THR 227.A OG1 no hydrogen 3.205 N/A THR 230.A OG1 THR 214.A OG1 no hydrogen 2.930 N/A THR 230.A OG1 THR 227.A O no hydrogen 3.123 N/A ALA 231.A N THR 227.A O no hydrogen 2.966 N/A ALA 232.A N PHE 228.A O no hydrogen 3.026 N/A GLU 233.A N ALA 229.A O no hydrogen 3.279 N/A ALA 234.A N ALA 231.A O no hydrogen 3.033 N/A LEU 235.A N ALA 232.A O no hydrogen 3.179 N/A ARG 237.A NE GLU 544.A OE1 no hydrogen 3.342 N/A ARG 237.A NH1 GLU 506.A OE2 no hydrogen 2.895 N/A ARG 237.A NH1 GLU 544.A OE1 no hydrogen 2.895 N/A ARG 237.A NH2 TYR 207.A OH no hydrogen 3.298 N/A ARG 237.A NH2 GLU 506.A OE2 no hydrogen 3.498 N/A ALA 239.A N LEU 235.A O no hydrogen 2.963 N/A ARG 240.A N PRO 236.A O no hydrogen 2.933 N/A MET 241.A N ARG 237.A O no hydrogen 3.140 N/A MET 241.A N ILE 238.A O no hydrogen 3.227 N/A GLY 242.A N ALA 239.A O no hydrogen 2.967 N/A PHE 243.A N ILE 238.A O no hydrogen 3.461 N/A ASP 244.A N SER 205.A O no hydrogen 2.887 N/A VAL 245.A N SER 205.A O no hydrogen 3.047 N/A VAL 246.A N GLU 312.A O no hydrogen 2.917 N/A TYR 247.A N TYR 207.A O no hydrogen 2.833 N/A TYR 247.A OH ASP 316.A OD2 no hydrogen 2.517 N/A LEU 248.A N ALA 314.A O no hydrogen 3.011 N/A HIS 252.A ND1 ALA 288.A O no hydrogen 2.900 N/A GLY 255.A N ALA 278.A O no hydrogen 2.870 N/A LYS 256.A N ASP 324.A OD1 no hydrogen 3.179 N/A LYS 256.A N ASP 324.A OD2 no hydrogen 2.739 N/A LYS 256.A NZ ASP 282.A OD1 no hydrogen 2.813 N/A LYS 256.A NZ GLU 283.A OE2 no hydrogen 3.337 N/A VAL 257.A N ASP 324.A OD1 no hydrogen 3.302 N/A ARG 259.A NE GLY 255.A O no hydrogen 2.843 N/A ARG 259.A NH1 ASP 272.A O no hydrogen 2.934 N/A ARG 259.A NH2 ILE 254.A O no hydrogen 3.039 N/A ARG 259.A NH2 GLY 255.A O no hydrogen 3.232 N/A LYS 260.A NZ ASN 264.A OD1 no hydrogen 2.818 N/A LYS 260.A NZ LYS 348.A O no hydrogen 3.463 N/A LYS 260.A NZ GLN 350.A OE1 no hydrogen 3.337 N/A GLY 261.A N SER 265.A O no hydrogen 2.753 N/A ARG 262.A NH1 GLU 527.A OE2 no hydrogen 3.089 N/A ASN 263.A ND2 ASN 522.A OD1 no hydrogen 2.788 N/A SER 265.A N GLY 261.A O no hydrogen 3.339 N/A SER 265.A N ARG 262.A O no hydrogen 3.286 N/A SER 265.A OG THR 267.A O no hydrogen 3.127 N/A ALA 269.A N ASP 272.A OD2 no hydrogen 2.840 N/A ASP 272.A N ALA 269.A O no hydrogen 2.879 N/A TRP 277.A N SER 275.A OG no hydrogen 3.232 N/A TRP 277.A NE1 ASP 316.A OD2 no hydrogen 3.212 N/A ALA 278.A N SER 275.A O no hydrogen 2.982 N/A GLY 280.A N PRO 253.A O no hydrogen 2.834 N/A SER 281.A N GLY 284.A O no hydrogen 3.063 N/A SER 281.A OG GLU 283.A OE1 no hydrogen 2.731 N/A GLU 283.A N SER 281.A OG no hydrogen 2.946 N/A GLY 284.A N SER 281.A O no hydrogen 2.997 N/A HIS 286.A ND1 HIS 325.A NE2 no hydrogen 2.795 N/A HIS 286.A NE2 ALA 318.A O no hydrogen 2.785 N/A ALA 288.A N GLY 285.A O no hydrogen 3.223 N/A HIS 290.A N ILE 251.A O no hydrogen 2.838 N/A GLN 292.A N HIS 290.A ND1 no hydrogen 2.973 N/A LEU 293.A N HIS 290.A O no hydrogen 2.972 N/A THR 295.A N ASP 298.A OD2 no hydrogen 2.900 N/A THR 295.A OG1 GLU 297.A OE1 no hydrogen 3.331 N/A THR 295.A OG1 ASP 298.A OD2 no hydrogen 3.335 N/A GLU 297.A N THR 295.A OG1 no hydrogen 3.248 N/A ASP 298.A N THR 295.A OG1 no hydrogen 3.347 N/A PHE 299.A N THR 295.A O no hydrogen 3.130 N/A ASP 300.A N ILE 296.A O no hydrogen 3.124 N/A GLU 301.A N GLU 297.A O no hydrogen 3.227 N/A PHE 302.A N ASP 298.A O no hydrogen 2.984 N/A VAL 303.A N PHE 299.A O no hydrogen 2.932 N/A ALA 304.A N ASP 300.A O no hydrogen 3.000 N/A SER 305.A N GLU 301.A O no hydrogen 2.933 N/A SER 305.A OG GLU 301.A O no hydrogen 2.790 N/A ALA 306.A N PHE 302.A O no hydrogen 2.990 N/A ARG 307.A N VAL 303.A O no hydrogen 2.960 N/A ASP 308.A N ALA 304.A O no hydrogen 3.082 N/A LEU 309.A N SER 305.A O no hydrogen 3.252 N/A LEU 309.A N ALA 306.A O no hydrogen 3.051 N/A GLY 310.A N ARG 307.A O no hydrogen 2.961 N/A LEU 311.A N ALA 306.A O no hydrogen 2.812 N/A GLU 312.A N ASP 244.A O no hydrogen 2.877 N/A ALA 314.A N VAL 246.A O no hydrogen 2.917 N/A LEU 315.A N ILE 382.A O no hydrogen 3.147 N/A LEU 317.A N ARG 384.A O no hydrogen 2.833 N/A GLN 320.A N ALA 318.A O no hydrogen 3.078 N/A GLN 320.A NE2 TRP 277.A O no hydrogen 2.853 N/A CYS 321.A N TYR 353.A O no hydrogen 3.088 N/A CYS 321.A SG.B ALA 322.A O no hydrogen 3.674 N/A ALA 322.A N ILE 279.A O no hydrogen 2.830 N/A ASP 324.A N ASP 324.A OD1 no hydrogen 2.717 N/A HIS 325.A N ALA 322.A O no hydrogen 3.063 N/A HIS 325.A NE2 HIS 286.A ND1 no hydrogen 2.795 N/A TRP 327.A N HIS 325.A ND1 no hydrogen 2.881 N/A TRP 327.A NE1 GLU 367.A OE2 no hydrogen 3.009 N/A ALA 328.A N HIS 325.A O no hydrogen 3.072 N/A ARG 329.A N PRO 326.A O no hydrogen 3.020 N/A GLU 330.A N PRO 326.A O no hydrogen 2.856 N/A HIS 331.A N TRP 327.A O no hydrogen 2.721 N/A HIS 331.A ND1 GLU 333.A OE2 no hydrogen 2.886 N/A GLU 333.A N GLU 333.A OE1 no hydrogen 2.801 N/A TRP 334.A N HIS 331.A O no hydrogen 3.004 N/A TRP 334.A NE1 ASP 360.A OD2 no hydrogen 2.928 N/A PHE 335.A N PRO 332.A O no hydrogen 3.161 N/A LEU 338.A N SER 342.A O no hydrogen 2.793 N/A GLY 341.A N LEU 338.A O no hydrogen 2.942 N/A SER 342.A N ASP 340.A OD1 no hydrogen 2.926 N/A SER 342.A OG ASP 340.A OD1 no hydrogen 2.612 N/A SER 342.A OG ASP 340.A OD2 no hydrogen 3.490 N/A ALA 346.A N ILE 352.A O no hydrogen 2.922 N/A TYR 349.A N ALA 346.A O no hydrogen 2.966 N/A GLN 350.A N GLN 350.A OE1 no hydrogen 2.871 N/A ASP 351.A N ASP 351.A OD1 no hydrogen 2.662 N/A ILE 352.A N TYR 349.A O no hydrogen 3.281 N/A TYR 353.A N CYS 321.A O no hydrogen 2.725 N/A ASN 356.A N TRP 334.A O no hydrogen 2.773 N/A ASN 356.A ND2 THR 336.A OG1 no hydrogen 2.883 N/A ASP 358.A N ASN 356.A OD1 no hydrogen 2.938 N/A ASN 359.A N ASN 356.A OD1 no hydrogen 3.026 N/A ASN 359.A ND2 GLU 333.A O no hydrogen 2.915 N/A ASN 359.A ND2 PHE 335.A O no hydrogen 2.998 N/A GLY 363.A N ASP 360.A OD1 no hydrogen 3.132 N/A ILE 364.A N ASP 360.A O no hydrogen 3.304 N/A TYR 365.A N PRO 361.A O no hydrogen 2.913 N/A GLN 366.A N ALA 362.A O no hydrogen 3.194 N/A GLU 367.A N GLY 363.A O no hydrogen 3.058 N/A VAL 368.A N ILE 364.A O no hydrogen 2.992 N/A LEU 369.A N TYR 365.A O no hydrogen 3.010 N/A ARG 370.A N GLN 366.A O no hydrogen 3.001 N/A ARG 370.A NE GLU 367.A OE1 no hydrogen 2.933 N/A ARG 370.A NH1 ASP 287.A OD2 no hydrogen 2.995 N/A ARG 370.A NH2 ASP 287.A OD2 no hydrogen 2.976 N/A ARG 370.A NH2 GLU 367.A OE2 no hydrogen 2.700 N/A VAL 371.A N GLU 367.A O no hydrogen 3.053 N/A VAL 372.A N VAL 368.A O no hydrogen 2.923 N/A ARG 373.A N LEU 369.A O no hydrogen 2.933 N/A ARG 373.A NE.A GLU 406.A OE1 no hydrogen 3.230 N/A ARG 373.A NE.B GLU 406.A OE1 no hydrogen 2.734 N/A ARG 373.A NE.B GLU 406.A OE2 no hydrogen 3.280 N/A ARG 373.A NH2.B GLU 406.A OE2 no hydrogen 2.684 N/A PHE 374.A N ARG 370.A O no hydrogen 2.820 N/A TRP 375.A N VAL 371.A O no hydrogen 3.166 N/A TRP 375.A NE1 HIS 286.A O no hydrogen 2.729 N/A ILE 376.A N VAL 372.A O no hydrogen 3.020 N/A SER 377.A N ARG 373.A O no hydrogen 2.925 N/A SER 377.A OG PHE 374.A O no hydrogen 2.673 N/A HIS 378.A N TRP 375.A O no hydrogen 3.003 N/A HIS 378.A ND1 PHE 374.A O no hydrogen 3.142 N/A GLY 379.A N ILE 376.A O no hydrogen 2.948 N/A VAL 380.A N TRP 375.A O no hydrogen 3.194 N/A PHE 383.A N LEU 411.A O no hydrogen 2.964 N/A ARG 384.A N LEU 315.A O no hydrogen 2.875 N/A ARG 384.A NE TYR 435.A OH no hydrogen 3.155 N/A VAL 385.A N LEU 413.A O no hydrogen 2.813 N/A ASP 386.A N LEU 317.A O no hydrogen 3.170 N/A ASN 387.A N GLU 415.A OE1 no hydrogen 2.963 N/A THR 390.A N ASN 387.A O no hydrogen 2.988 N/A THR 390.A OG1 ASN 387.A O no hydrogen 2.931 N/A LYS 391.A N PRO 388.A O no hydrogen 3.152 N/A LYS 391.A NZ ASP 386.A O no hydrogen 3.214 N/A LYS 391.A NZ ASN 387.A O no hydrogen 3.115 N/A LYS 391.A NZ THR 390.A OG1 no hydrogen 2.972 N/A ASN 394.A ND2 ASP 63.A O no hydrogen 3.179 N/A PHE 395.A N PRO 392.A O no hydrogen 3.121 N/A TRP 396.A NE1 PRO 388.A O no hydrogen 2.821 N/A ALA 397.A N PRO 393.A O no hydrogen 3.355 N/A TRP 398.A N ASN 394.A O no hydrogen 3.064 N/A LEU 399.A N PHE 395.A O no hydrogen 2.912 N/A ILE 400.A N TRP 396.A O no hydrogen 2.893 N/A GLY 401.A N ALA 397.A O no hydrogen 2.963 N/A GLN 402.A N TRP 398.A O no hydrogen 2.840 N/A ILE 403.A N LEU 399.A O no hydrogen 2.971 N/A LYS 404.A N ILE 400.A O no hydrogen 2.850 N/A LYS 404.A NZ ASP 197.A OD1 no hydrogen 2.753 N/A LYS 404.A NZ PRO 408.A O no hydrogen 2.957 N/A LYS 404.A NZ VAL 410.A O no hydrogen 2.783 N/A ASN 405.A N GLY 401.A O no hydrogen 3.179 N/A ASN 405.A ND2 TYR 58.A O no hydrogen 2.655 N/A ASN 405.A ND2 GLY 401.A O no hydrogen 2.910 N/A GLU 406.A N ILE 403.A O no hydrogen 3.126 N/A ASN 407.A N ILE 403.A O no hydrogen 2.733 N/A ASN 407.A ND2 ILE 403.A O no hydrogen 3.498 N/A VAL 410.A N ASN 407.A O no hydrogen 3.153 N/A LEU 411.A N ASN 381.A O no hydrogen 2.896 N/A PHE 412.A N THR 432.A OG1 no hydrogen 2.923 N/A LEU 413.A N PHE 383.A O no hydrogen 2.873 N/A SER 414.A N GLN 433.A O no hydrogen 2.876 N/A GLU 415.A N VAL 385.A O no hydrogen 3.078 N/A ARG 419.A N THR 418.A OG1 no hydrogen 2.799 N/A ARG 422.A N ARG 419.A O no hydrogen 3.119 N/A ARG 422.A NE THR 418.A OG1 no hydrogen 3.123 N/A ARG 422.A NH1 THR 418.A OG1 no hydrogen 3.297 N/A LEU 423.A N ARG 419.A O no hydrogen 2.938 N/A TYR 424.A N PRO 420.A O no hydrogen 2.882 N/A TYR 424.A OH GLU 453.A OE2 no hydrogen 2.670 N/A GLY 425.A N ALA 421.A O no hydrogen 2.917 N/A LEU 426.A N ARG 422.A O no hydrogen 3.004 N/A ALA 427.A N LEU 423.A O no hydrogen 3.405 N/A LYS 428.A N TYR 424.A O no hydrogen 2.967 N/A LYS 428.A NZ SER 17.A OG no hydrogen 3.042 N/A LEU 429.A N GLY 425.A O no hydrogen 3.071 N/A GLY 430.A N ALA 427.A O no hydrogen 3.090 N/A PHE 431.A N LEU 426.A O no hydrogen 3.226 N/A THR 432.A OG1 PHE 412.A O no hydrogen 3.407 N/A GLN 433.A N PHE 412.A O no hydrogen 3.207 N/A GLN 433.A NE2 ALA 201.A O no hydrogen 2.966 N/A GLN 433.A NE2 SER 204.A OG no hydrogen 3.373 N/A SER 434.A N ARG 462.A O no hydrogen 2.851 N/A TYR 435.A N SER 414.A O no hydrogen 2.902 N/A TYR 437.A OH THR 418.A O no hydrogen 2.621 N/A PHE 438.A N THR 436.A OG1 no hydrogen 3.068 N/A TRP 440.A N TYR 437.A O no hydrogen 2.949 N/A TRP 440.A NE1 GLU 518.A OE1 no hydrogen 3.056 N/A ARG 441.A N PHE 438.A O no hydrogen 2.964 N/A THR 442.A N GLU 446.A OE1 no hydrogen 2.994 N/A SER 443.A N GLU 446.A OE1 no hydrogen 3.035 N/A LYS 444.A NZ VAL 571.A O no hydrogen 2.845 N/A LYS 444.A NZ ASN 573.A O no hydrogen 2.917 N/A LYS 444.A NZ LEU 576.A O no hydrogen 3.071 N/A GLU 446.A N SER 443.A OG no hydrogen 3.170 N/A LEU 447.A N SER 443.A O no hydrogen 2.904 N/A THR 448.A N LYS 444.A O no hydrogen 3.011 N/A THR 448.A OG1 LYS 444.A O no hydrogen 2.735 N/A GLU 449.A N TRP 445.A O no hydrogen 3.114 N/A PHE 450.A N GLU 446.A O no hydrogen 2.945 N/A GLY 451.A N LEU 447.A O no hydrogen 3.011 N/A GLN 452.A N THR 448.A O no hydrogen 3.078 N/A GLU 453.A N GLU 449.A O no hydrogen 2.922 N/A ILE 454.A N PHE 450.A O no hydrogen 3.043 N/A ALA 455.A N GLY 451.A O no hydrogen 3.204 N/A ALA 456.A N GLN 452.A O no hydrogen 2.984 N/A LYS 457.A N GLU 453.A O no hydrogen 3.032 N/A ALA 458.A N ALA 455.A O no hydrogen 3.327 N/A ILE 460.A N LYS 457.A O no hydrogen 2.949 N/A ALA 461.A N LYS 457.A O no hydrogen 3.058 N/A ARG 462.A NH1 THR 432.A O no hydrogen 2.866 N/A ARG 462.A NH2 ALA 25.A O no hydrogen 2.967 N/A ASN 464.A N SER 434.A O no hydrogen 2.950 N/A ASN 464.A ND2 GLN 433.A OE1 no hydrogen 2.963 N/A LEU 465.A N ALA 498.A O no hydrogen 2.935 N/A VAL 467.A N GLY 500.A O no hydrogen 3.078 N/A ASN 468.A ND2 TYR 502.A O no hydrogen 3.090 N/A ASN 468.A ND2 TYR 520.A OH no hydrogen 2.905 N/A THR 469.A N ILE 472.A O no hydrogen 3.360 N/A ASP 471.A N THR 469.A OG1 no hydrogen 3.040 N/A ILE 472.A N THR 469.A O no hydrogen 3.012 N/A LEU 473.A N GLU 518.A O no hydrogen 2.719 N/A HIS 474.A ND1 SER 476.A OG no hydrogen 2.808 N/A GLU 475.A N GLU 475.A OE1 no hydrogen 2.805 N/A SER 476.A N HIS 474.A ND1 no hydrogen 3.177 N/A SER 476.A OG HIS 474.A ND1 no hydrogen 2.808 N/A LEU 477.A N HIS 474.A O no hydrogen 2.927 N/A GLN 478.A N HIS 474.A O no hydrogen 3.114 N/A GLN 478.A NE2 LEU 473.A O no hydrogen 2.928 N/A GLN 478.A NE2 SER 517.A O no hydrogen 2.940 N/A HIS 479.A N GLU 475.A O no hydrogen 3.002 N/A MET 484.A N GLY 481.A O no hydrogen 3.125 N/A ALA 486.A N PRO 482.A O no hydrogen 3.162 N/A ILE 487.A N GLY 483.A O no hydrogen 2.985 N/A ARG 488.A N MET 484.A O no hydrogen 2.963 N/A ARG 488.A NH1 ARG 441.A O no hydrogen 2.801 N/A ARG 488.A NH2 PHE 438.A O no hydrogen 2.764 N/A ARG 488.A NH2 ARG 441.A O no hydrogen 3.120 N/A ALA 489.A N PHE 485.A O no hydrogen 3.265 N/A VAL 490.A N ALA 486.A O no hydrogen 3.069 N/A LEU 491.A N ILE 487.A O no hydrogen 3.082 N/A ALA 492.A N ARG 488.A O no hydrogen 2.982 N/A ALA 493.A N ALA 489.A O no hydrogen 2.975 N/A THR 494.A N VAL 490.A O no hydrogen 3.010 N/A THR 494.A OG1 VAL 490.A O no hydrogen 2.652 N/A THR 494.A OG1 TYR 579.A OH no hydrogen 2.608 N/A MET 495.A N LEU 491.A O no hydrogen 2.877 N/A GLY 496.A N ALA 492.A O no hydrogen 2.932 N/A TRP 499.A N SER 204.A O no hydrogen 3.243 N/A GLY 500.A N LEU 465.A O no hydrogen 2.936 N/A VAL 501.A N TRP 206.A O no hydrogen 3.022 N/A TYR 502.A N ASN 468.A OD1 no hydrogen 2.794 N/A TYR 502.A OH GLU 524.A OE1 no hydrogen 2.549 N/A SER 503.A N GLU 208.A O no hydrogen 2.943 N/A SER 503.A OG.A TYR 207.A OH no hydrogen 2.762 N/A SER 503.A OG.B GLU 208.A O no hydrogen 3.216 N/A GLY 504.A N GLU 506.A OE1 no hydrogen 2.852 N/A TYR 505.A N TYR 502.A O no hydrogen 3.160 N/A TYR 505.A OH PHE 485.A O no hydrogen 2.578 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.766 N/A LEU 507.A N GLY 504.A O no hydrogen 2.975 N/A PHE 508.A N TYR 505.A O no hydrogen 3.022 N/A GLU 509.A N GLY 504.A O no hydrogen 3.435 N/A VAL 513.A N GLU 519.A O no hydrogen 2.870 N/A SER 517.A N ARG 514.A O no hydrogen 3.184 N/A GLU 519.A N SER 517.A OG no hydrogen 2.905 N/A LEU 521.A N GLN 511.A O no hydrogen 2.932 N/A ASN 522.A N ASN 263.A OD1 no hydrogen 2.665 N/A LYS 525.A N SER 523.A OG no hydrogen 3.200 N/A LYS 525.A NZ ASP 471.A OD1 no hydrogen 2.704 N/A LYS 525.A NZ GLU 519.A OE1 no hydrogen 2.998 N/A LYS 525.A NZ GLU 519.A OE2 no hydrogen 3.289 N/A TYR 526.A N SER 523.A O no hydrogen 3.031 N/A ARG 529.A N SER 213.A OG no hydrogen 2.961 N/A ARG 529.A NH1 ASN 522.A O no hydrogen 2.890 N/A ARG 531.A NE GLU 509.A OE2 no hydrogen 2.545 N/A ARG 531.A NH1 GLU 524.A OE1 no hydrogen 2.979 N/A ARG 531.A NH1 GLU 524.A OE2 no hydrogen 3.551 N/A ARG 531.A NH2 TYR 502.A OH no hydrogen 3.528 N/A ARG 531.A NH2 GLU 509.A OE1 no hydrogen 2.954 N/A ARG 531.A NH2 GLU 524.A OE1 no hydrogen 3.320 N/A SER 535.A N ASP 532.A OD1 no hydrogen 3.205 N/A SER 535.A OG.A ASP 532.A O no hydrogen 3.346 N/A SER 535.A OG.B ASP 532.A OD2 no hydrogen 2.689 N/A ALA 536.A N ASP 532.A O no hydrogen 3.315 N/A LEU 537.A N PHE 533.A O no hydrogen 3.022 N/A ALA 538.A N GLU 534.A O no hydrogen 3.043 N/A ARG 539.A N SER 535.A O no hydrogen 3.078 N/A ARG 539.A NE GLU 541.A OE1 no hydrogen 2.739 N/A ARG 539.A NH2 GLU 541.A OE1 no hydrogen 3.546 N/A ARG 539.A NH2 GLU 541.A OE2 no hydrogen 3.205 N/A GLY 540.A N LEU 537.A O no hydrogen 3.127 N/A GLU 541.A N ALA 536.A O no hydrogen 2.859 N/A LEU 543.A N GLU 506.A O no hydrogen 2.776 N/A GLU 544.A N SER 542.A OG no hydrogen 3.005 N/A LEU 547.A N LEU 543.A O no hydrogen 2.928 N/A THR 548.A N GLU 544.A O no hydrogen 3.069 N/A THR 548.A OG1 GLU 544.A O no hydrogen 2.867 N/A ARG 549.A N PRO 545.A O no hydrogen 3.094 N/A ARG 549.A NE GLU 626.A O no hydrogen 3.365 N/A ARG 549.A NH1 GLU 552.A OE1 no hydrogen 2.849 N/A ARG 549.A NH2 GLU 626.A O no hydrogen 3.068 N/A LEU 550.A N PHE 546.A O no hydrogen 2.967 N/A ASN 551.A N LEU 547.A O no hydrogen 3.090 N/A GLU 552.A N THR 548.A O no hydrogen 2.986 N/A ILE 553.A N ARG 549.A O no hydrogen 2.880 N/A ARG 554.A N LEU 550.A O no hydrogen 3.089 N/A ARG 554.A NE SER 205.A OG no hydrogen 3.301 N/A ARG 554.A NH1 ALA 493.A O no hydrogen 2.882 N/A ARG 554.A NH1 GLY 496.A O no hydrogen 2.867 N/A ARG 554.A NH1 PRO 497.A O no hydrogen 3.550 N/A ARG 554.A NH2 SER 205.A OG no hydrogen 3.118 N/A ARG 554.A NH2 PRO 497.A O no hydrogen 2.754 N/A ARG 555.A N ASN 551.A O no hydrogen 3.099 N/A LEU 556.A N GLU 552.A O no hydrogen 3.088 N/A HIS 557.A N ILE 553.A O no hydrogen 3.039 N/A HIS 557.A N ARG 554.A O no hydrogen 3.371 N/A HIS 557.A ND1 ASP 588.A OD1 no hydrogen 2.760 N/A HIS 557.A NE2 GLU 626.A OE2 no hydrogen 2.678 N/A ALA 559.A N ASP 588.A OD2 no hydrogen 2.817 N/A LEU 560.A N HIS 557.A O no hydrogen 2.922 N/A ARG 561.A N PRO 558.A O no hydrogen 3.040 N/A GLU 562.A N ALA 559.A O no hydrogen 3.119 N/A ARG 564.A NH1.B GLU 29.A OE2 no hydrogen 2.810 N/A ARG 564.A NH2.A ASP 459.A OD1 no hydrogen 2.676 N/A ARG 564.A NH2.B ASP 459.A OD1 no hydrogen 2.927 N/A THR 565.A OG1 PHE 582.A O no hydrogen 2.813 N/A ARG 567.A N SER 580.A O no hydrogen 2.931 N/A ARG 567.A NE GLU 612.A OE1 no hydrogen 3.268 N/A ARG 567.A NH2 ARG 564.A O no hydrogen 2.963 N/A ARG 567.A NH2 ILE 566.A O no hydrogen 2.836 N/A HIS 569.A N ALA 578.A O no hydrogen 3.004 N/A ASP 572.A N THR 605.A O no hydrogen 3.302 N/A ASN 573.A N VAL 571.A O no hydrogen 2.961 N/A ASN 573.A ND2 GLU 602.A OE1 no hydrogen 3.069 N/A ASN 573.A ND2 GLU 603.A O no hydrogen 2.881 N/A ALA 575.A N ASN 573.A OD1 no hydrogen 2.914 N/A LEU 576.A N ASN 573.A O no hydrogen 3.048 N/A LEU 577.A N VAL 594.A O no hydrogen 2.874 N/A TYR 579.A N VAL 592.A O no hydrogen 3.028 N/A TYR 579.A OH THR 494.A OG1 no hydrogen 2.608 N/A SER 580.A N ARG 567.A O no hydrogen 2.859 N/A LYS 581.A N VAL 590.A O no hydrogen 3.042 N/A LYS 581.A NZ THR 494.A O no hydrogen 3.275 N/A LYS 581.A NZ MET 495.A O no hydrogen 2.982 N/A LYS 581.A NZ GLU 562.A O no hydrogen 2.667 N/A PHE 582.A N THR 565.A OG1 no hydrogen 3.203 N/A ASP 583.A N ASP 588.A O no hydrogen 2.807 N/A GLY 585.A N ASP 583.A OD1 no hydrogen 3.197 N/A THR 586.A N ASP 583.A OD2 no hydrogen 3.057 N/A THR 586.A OG1 ASP 583.A OD2 no hydrogen 2.623 N/A GLY 587.A N ASP 583.A O no hydrogen 2.817 N/A ASP 588.A N THR 586.A OG1 no hydrogen 3.306 N/A THR 589.A OG1 GLY 587.A O no hydrogen 2.982 N/A VAL 590.A N LYS 581.A O no hydrogen 2.978 N/A LEU 591.A N LEU 652.A O no hydrogen 2.882 N/A VAL 592.A N TYR 579.A O no hydrogen 2.794 N/A VAL 593.A N HIS 650.A O no hydrogen 2.970 N/A VAL 594.A N LEU 577.A O no hydrogen 2.807 N/A THR 595.A N VAL 648.A O no hydrogen 3.114 N/A THR 595.A OG1 ALA 575.A O no hydrogen 3.436 N/A THR 595.A OG1 ASN 597.A O no hydrogen 3.479 N/A LEU 596.A N ALA 575.A O no hydrogen 2.706 N/A ASN 597.A N THR 595.A OG1 no hydrogen 3.081 N/A ASN 597.A ND2 GLU 602.A OE2 no hydrogen 2.754 N/A PHE 599.A N ASN 597.A OD1 no hydrogen 2.900 N/A GLY 600.A N ASN 597.A OD1 no hydrogen 3.314 N/A GLU 602.A N LEU 642.A O no hydrogen 2.971 N/A ALA 604.A N VAL 640.A O no hydrogen 2.981 N/A LEU 606.A N ASN 638.A O no hydrogen 2.646 N/A TRP 607.A N HIS 570.A O no hydrogen 2.743 N/A TRP 607.A NE1 ASP 572.A OD2 no hydrogen 2.832 N/A LEU 608.A N GLN 636.A O no hydrogen 2.800 N/A LEU 613.A N MET 610.A O no hydrogen 2.922 N/A GLY 614.A N PRO 611.A O no hydrogen 2.969 N/A MET 615.A N MET 610.A O no hydrogen 3.045 N/A GLU 616.A N ASP 619.A OD2 no hydrogen 2.721 N/A ASP 619.A N GLU 616.A O no hydrogen 2.954 N/A PHE 621.A N TRP 634.A O no hydrogen 2.872 N/A VAL 623.A N TYR 632.A O no hydrogen 2.977 N/A ARG 624.A N ASN 653.A O no hydrogen 3.193 N/A ARG 624.A NH1 GLU 626.A OE1 no hydrogen 3.188 N/A ASP 625.A N GLU 630.A O no hydrogen 2.759 N/A GLU 626.A N VAL 651.A O no hydrogen 2.744 N/A ILE 627.A N ASP 625.A OD1 no hydrogen 3.219 N/A THR 628.A N ASP 625.A OD2 no hydrogen 3.260 N/A THR 628.A OG1 ASP 625.A OD2 no hydrogen 2.634 N/A GLY 629.A N ASP 625.A O no hydrogen 2.920 N/A TYR 632.A N VAL 623.A O no hydrogen 3.060 N/A TYR 632.A OH GLU 630.A OE1 no hydrogen 2.848 N/A TRP 634.A N PHE 621.A O no hydrogen 2.691 N/A ASN 638.A N LEU 606.A O no hydrogen 2.855 N/A ASN 638.A ND2 GLY 635.A O no hydrogen 3.463 N/A TYR 639.A OH GLU 603.A OE1 no hydrogen 2.599 N/A VAL 640.A N ALA 604.A O no hydrogen 2.772 N/A LEU 642.A N GLU 602.A O no hydrogen 2.946 N/A ALA 645.A N ASP 643.A OD1 no hydrogen 3.327 N/A LYS 646.A N ASP 643.A O no hydrogen 2.841 N/A ALA 647.A N ASP 643.A O no hydrogen 2.920 N/A HIS 650.A N VAL 593.A O no hydrogen 2.882 N/A VAL 651.A N ASP 625.A OD1 no hydrogen 3.083 N/A LEU 652.A N LEU 591.A O no hydrogen 2.781 N/A ASN 653.A N ARG 624.A O no hydrogen 2.808 N/A MET 654.A N THR 589.A O no hydrogen 3.025 N/A ILE 657.A N GLY 587.A O no hydrogen 2.905 N/A ARG 662.A N PRO 658.A O no hydrogen 3.041 N/A ARG 662.A NE PRO 584.A O no hydrogen 2.978 N/A ARG 662.A NH1 GLY 585.A O no hydrogen 3.092 N/A ARG 662.A NH2 ILE 657.A O no hydrogen 2.724 N/A LEU 663.A N ALA 659.A O no hydrogen 3.466 N/A GLN 664.A N ASP 660.A O no hydrogen 3.332 N/A LEU 665.A N LYS 661.A O no hydrogen 2.780 N/A LEU 666.A N ARG 662.A O no hydrogen 3.114 N/A LEU 666.A N LEU 663.A O no hydrogen 3.234 N/A ARG 667.A N GLN 664.A O no hydrogen 3.207 N/A ARG 668.A NE PRO 32.A O no hydrogen 2.667 N/A ARG 668.A NH1 ASP 459.A OD2 no hydrogen 2.796 N/A ARG 668.A NH2 PRO 32.A O no hydrogen 3.072 N/A ARG 668.A NH2 ASP 459.A OD1 no hydrogen 2.883 N/A ARG 668.A NH2 ASP 459.A OD2 no hydrogen 3.553 N/A