Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n04_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N VAL 132.A O no hydrogen 3.026 N/A ARG 3.A NH1 GLU 25.A OE1.B no hydrogen 2.437 N/A ARG 3.A NH2 GLU 134.A OE2 no hydrogen 2.471 N/A TYR 5.A N ILE 130.A O no hydrogen 2.877 N/A TYR 5.A OH ALA 26.A O no hydrogen 3.112 N/A ARG 6.A NE ASP 129.A OD1 no hydrogen 2.720 N/A ARG 6.A NH1 ASP 129.A OD1 no hydrogen 3.283 N/A ARG 6.A NH1 ASP 129.A OD2 no hydrogen 2.731 N/A TYR 7.A N LEU 128.A O no hydrogen 2.891 N/A ALA 9.A N ASP 127.A OD1 no hydrogen 2.749 N/A THR 13.A OG1 ASP 103.A OD1 no hydrogen 2.654 N/A THR 13.A OG1 ASP 103.A OD2 no hydrogen 3.316 N/A ALA 15.A N THR 13.A OG1 no hydrogen 3.207 N/A THR 17.A N VAL 148.A O no hydrogen 2.745 N/A THR 17.A OG1 VAL 148.A O no hydrogen 3.172 N/A GLU 18.A N VAL 148.A O no hydrogen 3.186 N/A ALA 23.A N LYS 4.A O no hydrogen 2.819 N/A GLU 24.A N GLU 25.A OE2.A no hydrogen 3.104 N/A GLU 25.A N GLU 25.A OE2.A no hydrogen 2.675 N/A TYR 29.A OH GLU 134.A OE1 no hydrogen 2.626 N/A GLU 31.A N THR 41.A O no hydrogen 2.848 N/A SER 33.A N ALA 39.A O no hydrogen 2.832 N/A LYS 35.A N SER 33.A OG no hydrogen 3.338 N/A PHE 38.A N CYS 123.A O no hydrogen 2.887 N/A ALA 39.A N SER 33.A O no hydrogen 2.902 N/A PHE 40.A N VAL 121.A O no hydrogen 2.725 N/A THR 41.A N GLU 31.A O no hydrogen 2.899 N/A TYR 42.A N LEU 119.A O no hydrogen 2.805 N/A ASP 44.A N ASP 47.A OD2 no hydrogen 2.862 N/A ASP 46.A N ASP 44.A OD2 no hydrogen 3.100 N/A ASP 47.A N ASP 44.A O no hydrogen 3.003 N/A ILE 48.A N SER 93.A O no hydrogen 2.817 N/A VAL 49.A N ASN 60.A OD1 no hydrogen 3.302 N/A TYR 50.A N ILE 91.A O no hydrogen 2.816 N/A LEU 52.A N PHE 89.A O no hydrogen 2.783 N/A GLU 54.A N HIS 87.A ND1 no hydrogen 3.016 N/A SER 55.A N GLY 53.A O no hydrogen 2.874 N/A ASN 56.A ND2 THR 77.A O no hydrogen 2.725 N/A ASN 56.A ND2 LYS 80.A O no hydrogen 3.035 N/A ARG 57.A N ASN 56.A OD1 no hydrogen 2.870 N/A ILE 59.A N GLU 522.A OE1 no hydrogen 2.839 N/A ASN 60.A N GLU 522.A OE2 no hydrogen 2.963 N/A LYS 61.A N VAL 49.A O no hydrogen 2.797 N/A LYS 61.A NZ SER 55.A OG no hydrogen 3.069 N/A LYS 61.A NZ ASN 56.A O no hydrogen 2.836 N/A LYS 61.A NZ GLY 58.A O no hydrogen 2.804 N/A ARG 62.A N ASN 60.A OD1 no hydrogen 3.235 N/A ARG 62.A NH1 ASP 44.A O no hydrogen 2.822 N/A ARG 62.A NH1 ASP 47.A O no hydrogen 2.958 N/A GLY 63.A N ILE 112.A O no hydrogen 2.646 N/A CYS 65.A SG PHE 110.A O no hydrogen 3.865 N/A TYR 66.A N PHE 110.A O no hydrogen 2.924 N/A TYR 66.A OH LYS 61.A O no hydrogen 2.517 N/A ILE 67.A N ARG 81.A O no hydrogen 3.004 N/A SER 68.A N LEU 108.A O no hydrogen 2.767 N/A CYS 70.A N ASN 366.A OD1 no hydrogen 2.904 N/A CYS 70.A SG TYR 84.A O no hydrogen 3.236 N/A CYS 70.A SG ASN 366.A O no hydrogen 3.997 N/A CYS 70.A SG ASN 366.A OD1 no hydrogen 3.486 N/A CYS 70.A SG SER 393.A OG no hydrogen 3.528 N/A CYS 70.A SG SER 394.A O no hydrogen 3.578 N/A THR 71.A N LEU 83.A O no hydrogen 3.229 N/A ILE 75.A N ASP 73.A O no hydrogen 2.826 N/A THR 77.A OG1 HIS 413.A NE2 no hydrogen 2.608 N/A GLU 78.A N HIS 76.A ND1 no hydrogen 3.085 N/A ASP 79.A N HIS 76.A O no hydrogen 3.173 N/A LYS 80.A N THR 77.A O no hydrogen 2.970 N/A ARG 81.A NH2 TYR 64.A OH no hydrogen 3.073 N/A SER 82.A OG ILE 67.A O no hydrogen 2.759 N/A TYR 84.A N GLU 54.A OE1 no hydrogen 3.253 N/A TYR 84.A OH ASP 72.A OD2 no hydrogen 3.406 N/A ALA 86.A N SER 394.A O no hydrogen 2.967 N/A HIS 87.A NE2 SER 394.A OG no hydrogen 2.775 N/A PHE 89.A N HIS 87.A O no hydrogen 2.836 N/A ILE 90.A N LEU 100.A O no hydrogen 2.967 N/A ILE 91.A N TYR 50.A O no hydrogen 2.885 N/A VAL 92.A N PHE 98.A O no hydrogen 2.963 N/A SER 93.A N ILE 48.A O no hydrogen 2.745 N/A GLY 94.A N THR 97.A OG1 no hydrogen 3.227 N/A LYS 95.A NZ ASP 44.A OD1 no hydrogen 3.302 N/A LYS 95.A NZ ASP 44.A OD2 no hydrogen 2.629 N/A THR 97.A OG1 GLY 94.A O no hydrogen 3.023 N/A PHE 98.A N VAL 92.A O no hydrogen 3.022 N/A GLY 99.A N ILE 133.A O no hydrogen 2.755 N/A LEU 100.A N ILE 90.A O no hydrogen 2.825 N/A PHE 101.A N TYR 131.A O no hydrogen 2.934 N/A PHE 102.A N ASN 88.A O no hydrogen 3.014 N/A ASP 103.A N ASP 129.A O no hydrogen 2.804 N/A TYR 104.A N TYR 395.A OH no hydrogen 3.072 N/A SER 106.A OG ASP 362.A O no hydrogen 2.908 N/A LEU 108.A N SER 68.A O no hydrogen 3.332 N/A THR 109.A N SER 122.A O no hydrogen 2.916 N/A PHE 110.A N TYR 66.A O no hydrogen 2.704 N/A ASP 111.A N LYS 120.A O no hydrogen 2.837 N/A ILE 112.A N TYR 64.A O no hydrogen 3.016 N/A GLY 113.A N THR 118.A O no hydrogen 2.961 N/A TYR 114.A N ASP 111.A OD1 no hydrogen 3.212 N/A THR 115.A N ASP 111.A OD1 no hydrogen 3.081 N/A THR 115.A OG1 ASP 111.A OD2 no hydrogen 2.389 N/A ARG 116.A NE ASP 117.A OD1 no hydrogen 3.274 N/A ARG 116.A NH2 ASP 117.A OD1 no hydrogen 3.462 N/A ARG 116.A NH2 ASP 117.A OD2 no hydrogen 3.260 N/A THR 118.A N ARG 116.A O no hydrogen 2.997 N/A THR 118.A OG1 ASP 117.A OD1 no hydrogen 2.985 N/A LEU 119.A N TYR 42.A O no hydrogen 2.872 N/A LYS 120.A N ASP 111.A O no hydrogen 2.923 N/A VAL 121.A N PHE 40.A O no hydrogen 2.770 N/A SER 122.A N THR 109.A O no hydrogen 2.956 N/A CYS 123.A N PHE 38.A O no hydrogen 3.019 N/A CYS 123.A SG ASN 125.A O no hydrogen 3.414 N/A LEU 128.A N TYR 7.A O no hydrogen 3.070 N/A ASP 129.A N ASP 103.A O no hydrogen 3.289 N/A ILE 130.A N TYR 5.A O no hydrogen 2.804 N/A TYR 131.A N PHE 101.A O no hydrogen 2.886 N/A VAL 132.A N ARG 3.A O no hydrogen 2.882 N/A ILE 133.A N GLY 99.A O no hydrogen 2.809 N/A TYR 139.A OH ASP 504.A OD1 no hydrogen 2.663 N/A ASP 140.A N ASN 137.A OD1 no hydrogen 2.910 N/A ILE 141.A N ASN 137.A O no hydrogen 3.084 N/A VAL 142.A N ALA 138.A O no hydrogen 2.914 N/A LYS 143.A N TYR 139.A O no hydrogen 3.060 N/A GLN 144.A N ASP 140.A O no hydrogen 3.201 N/A GLN 144.A NE2 GLU 134.A O no hydrogen 2.669 N/A GLN 144.A NE2 ASP 140.A O no hydrogen 3.408 N/A PHE 145.A N ILE 141.A O no hydrogen 3.047 N/A ARG 146.A N VAL 142.A O no hydrogen 2.829 N/A ARG 146.A NH1 ASN 424.A O no hydrogen 3.026 N/A ARG 146.A NH1 ASP 504.A O no hydrogen 2.791 N/A ARG 147.A N LYS 143.A O no hydrogen 3.105 N/A ARG 147.A NE GLU 18.A OE1 no hydrogen 3.085 N/A ARG 147.A NH2 GLU 18.A OE2 no hydrogen 3.298 N/A VAL 148.A N GLN 144.A O no hydrogen 3.344 N/A ILE 149.A N PHE 145.A O no hydrogen 3.194 N/A GLY 150.A N ARG 147.A O no hydrogen 3.346 N/A SER 152.A OG GLY 426.A O no hydrogen 2.574 N/A TYR 153.A N HIS 398.A O no hydrogen 2.727 N/A TYR 153.A OH PHE 388.A O no hydrogen 2.659 N/A LYS 157.A N GLY 621.A O no hydrogen 2.936 N/A ALA 159.A N PRO 156.A O no hydrogen 3.078 N/A PHE 160.A N LYS 157.A O no hydrogen 2.921 N/A GLY 161.A N PHE 158.A O no hydrogen 3.038 N/A PHE 162.A N TYR 487.A OH no hydrogen 2.898 N/A GLN 164.A NE2 SER 165.A O no hydrogen 2.900 N/A GLN 164.A NE2 ASP 459.A OD1 no hydrogen 3.122 N/A SER 165.A N ASP 459.A O no hydrogen 2.894 N/A ARG 166.A NH1 GLU 467.A OE1 no hydrogen 3.431 N/A ARG 166.A NH2 GLU 467.A OE1 no hydrogen 3.041 N/A TRP 167.A N ALA 461.A O no hydrogen 2.907 N/A TYR 169.A N ARG 166.A O no hydrogen 3.247 N/A TYR 169.A OH GLU 469.A OE1 no hydrogen 2.697 N/A THR 170.A N ASP 174.A OD2 no hydrogen 2.651 N/A THR 170.A OG1 GLY 168.A O no hydrogen 2.764 N/A THR 171.A N ASP 174.A OD2 no hydrogen 3.176 N/A ASP 174.A N THR 171.A OG1 no hydrogen 3.251 N/A PHE 175.A N THR 171.A O no hydrogen 3.453 N/A ARG 176.A N LYS 172.A O no hydrogen 2.932 N/A ARG 176.A NE GLU 218.A OE2 no hydrogen 2.917 N/A ARG 176.A NH1 GLU 218.A OE1 no hydrogen 2.892 N/A ARG 176.A NH2 GLU 173.A OE2 no hydrogen 3.160 N/A ALA 177.A N GLU 173.A O no hydrogen 2.938 N/A VAL 178.A N ASP 174.A O no hydrogen 3.278 N/A ALA 179.A N PHE 175.A O no hydrogen 3.028 N/A LYS 180.A N ARG 176.A O no hydrogen 2.877 N/A LYS 180.A NZ GLU 184.A OE1 no hydrogen 3.289 N/A GLY 181.A N ALA 177.A O no hydrogen 2.830 N/A TYR 182.A N VAL 178.A O no hydrogen 3.152 N/A TYR 182.A OH GLN 164.A OE1 no hydrogen 2.336 N/A ARG 183.A N ALA 179.A O no hydrogen 3.045 N/A ARG 183.A NE GLN 221.A O no hydrogen 3.135 N/A ARG 183.A NH1 ILE 189.A O no hydrogen 3.384 N/A ARG 183.A NH1 GLU 595.A O no hydrogen 3.053 N/A ARG 183.A NH2 ILE 189.A O no hydrogen 2.951 N/A ARG 183.A NH2 GLN 221.A O no hydrogen 2.934 N/A GLU 184.A N LYS 180.A O no hydrogen 2.944 N/A ASN 185.A ND2 GLY 181.A O no hydrogen 2.667 N/A HIS 186.A N ARG 183.A O no hydrogen 3.063 N/A HIS 186.A ND1 GLU 595.A OE2 no hydrogen 2.857 N/A ILE 187.A N TYR 182.A O no hydrogen 2.883 N/A ILE 189.A N GLU 595.A O no hydrogen 3.122 N/A ASP 190.A N PHE 162.A O no hydrogen 2.903 N/A ILE 191.A N ARG 224.A O no hydrogen 2.990 N/A TYR 192.A N GLN 164.A O no hydrogen 2.867 N/A ILE 194.A N ASP 193.A OD2 no hydrogen 2.640 N/A TYR 196.A N ASP 193.A O no hydrogen 3.145 N/A TYR 196.A OH ILE 228.A O no hydrogen 2.776 N/A GLN 197.A N THR 203.A OG1 no hydrogen 3.066 N/A GLN 197.A NE2 ASP 198.A OD2 no hydrogen 3.022 N/A LYS 200.A N GLN 197.A O no hydrogen 2.847 N/A LYS 200.A NZ GLU 236.A OE1 no hydrogen 3.029 N/A THR 203.A N LYS 200.A O no hydrogen 3.243 N/A THR 203.A OG1 LYS 200.A O no hydrogen 2.554 N/A ASN 205.A N TYR 196.A O no hydrogen 2.767 N/A GLU 206.A N GLN 197.A OE1 no hydrogen 3.255 N/A ASN 208.A N ASN 205.A OD1 no hydrogen 2.641 N/A PHE 209.A N ASN 205.A O no hydrogen 2.863 N/A GLU 214.A N ASP 211.A OD1 no hydrogen 3.165 N/A PHE 215.A N ASP 211.A O no hydrogen 3.159 N/A VAL 216.A N PHE 212.A O no hydrogen 2.881 N/A LYS 217.A N PRO 213.A O no hydrogen 3.046 N/A GLU 218.A N GLU 214.A O no hydrogen 2.862 N/A LYS 219.A NZ GLY 293.A O no hydrogen 2.904 N/A LYS 219.A NZ GLU 295.A OE2 no hydrogen 2.770 N/A ASP 220.A N LYS 217.A O no hydrogen 2.738 N/A GLN 221.A NE2 GLU 218.A O no hydrogen 2.844 N/A GLU 222.A N LYS 219.A O no hydrogen 2.846 N/A ARG 224.A N ASP 190.A O no hydrogen 2.878 N/A ARG 224.A NE GLU 295.A OE2 no hydrogen 3.137 N/A ARG 224.A NH1 GLU 222.A OE2 no hydrogen 3.000 N/A ILE 226.A N ILE 191.A O no hydrogen 3.029 N/A ILE 229.A N TRP 298.A O no hydrogen 2.819 N/A ASP 230.A N ASP 201.A OD1 no hydrogen 3.100 N/A ALA 231.A N ASP 300.A O no hydrogen 3.369 N/A VAL 233.A N HIS 270.A O no hydrogen 2.792 N/A LYS 234.A NZ PRO 266.A O no hydrogen 2.957 N/A VAL 235.A N ASP 268.A O no hydrogen 2.944 N/A LYS 237.A NZ GLU 243.A OE2 no hydrogen 2.804 N/A GLY 238.A N GLU 243.A OE2 no hydrogen 3.024 N/A TYR 239.A N GLU 236.A O no hydrogen 3.187 N/A TYR 239.A OH ASP 201.A O no hydrogen 2.531 N/A GLU 243.A N TYR 239.A O no hydrogen 2.835 N/A GLU 244.A N GLU 240.A O no hydrogen 2.699 N/A GLY 245.A N VAL 241.A O no hydrogen 3.008 N/A VAL 246.A N TYR 242.A O no hydrogen 3.047 N/A LYS 247.A N GLU 243.A O no hydrogen 3.064 N/A ASN 248.A N GLU 244.A O no hydrogen 3.081 N/A ASN 248.A ND2 GLU 244.A O no hydrogen 3.203 N/A ASN 249.A N VAL 246.A O no hydrogen 3.113 N/A TYR 250.A N GLY 245.A O no hydrogen 2.948 N/A TYR 250.A OH GLU 277.A OE1 no hydrogen 2.783 N/A CYS 252.A N PHE 271.A O no hydrogen 2.899 N/A CYS 252.A SG PHE 271.A O no hydrogen 3.647 N/A CYS 252.A SG PRO 272.A O no hydrogen 3.806 N/A LYS 253.A NZ ASN 249.A OD1 no hydrogen 2.968 N/A LYS 253.A NZ GLY 257.A O no hydrogen 3.387 N/A LYS 253.A NZ ASP 259.A OD1 no hydrogen 3.072 N/A ARG 254.A N SER 258.A O no hydrogen 2.700 N/A ARG 254.A NE GLU 310.A OE2 no hydrogen 2.938 N/A ARG 254.A NH1 SER 258.A OG no hydrogen 2.705 N/A GLY 257.A N ARG 254.A O no hydrogen 2.972 N/A SER 258.A N ASP 256.A OD1 no hydrogen 2.960 N/A SER 258.A OG ASP 256.A OD1 no hydrogen 2.832 N/A PHE 260.A N CYS 252.A O no hydrogen 3.107 N/A ALA 262.A N THR 269.A O no hydrogen 3.038 N/A ALA 263.A N TYR 307.A O no hydrogen 2.866 N/A VAL 264.A N GLY 267.A O no hydrogen 2.893 N/A GLY 267.A N VAL 264.A O no hydrogen 2.919 N/A THR 269.A N ALA 262.A O no hydrogen 2.756 N/A THR 269.A OG1 ALA 262.A O no hydrogen 2.848 N/A HIS 270.A N VAL 233.A O no hydrogen 2.932 N/A HIS 270.A ND1 PHE 260.A O no hydrogen 2.735 N/A ASP 273.A N TYR 250.A O no hydrogen 2.793 N/A ASN 275.A N ASP 273.A O no hydrogen 2.955 N/A ASN 275.A ND2 ASN 353.A O no hydrogen 2.921 N/A ALA 278.A N ASN 275.A OD1 no hydrogen 2.932 N/A ARG 279.A N ASN 275.A O no hydrogen 2.790 N/A LYS 280.A N PRO 276.A O no hydrogen 2.972 N/A LYS 280.A NZ ASP 284.A OD2 no hydrogen 2.731 N/A TRP 281.A N GLU 277.A O no hydrogen 3.082 N/A TRP 281.A NE1 GLU 244.A OE2 no hydrogen 2.942 N/A PHE 282.A N ALA 278.A O no hydrogen 2.955 N/A GLY 283.A N ARG 279.A O no hydrogen 2.979 N/A ASP 284.A N LYS 280.A O no hydrogen 2.969 N/A LYS 285.A N PHE 282.A O no hydrogen 3.026 N/A LYS 285.A NZ GLU 244.A OE2 no hydrogen 2.376 N/A TYR 286.A N GLY 283.A O no hydrogen 3.123 N/A ARG 287.A N ASP 284.A O no hydrogen 3.111 N/A PHE 288.A N LYS 285.A O no hydrogen 3.067 N/A LEU 289.A N TYR 286.A O no hydrogen 3.045 N/A ILE 290.A N TYR 286.A O no hydrogen 3.019 N/A ASP 291.A N ARG 287.A O no hydrogen 2.867 N/A GLN 292.A N LEU 289.A O no hydrogen 2.942 N/A GLN 292.A NE2 PHE 288.A O no hydrogen 3.108 N/A GLY 293.A N ILE 290.A O no hydrogen 2.876 N/A ILE 294.A N LEU 289.A O no hydrogen 3.294 N/A PHE 297.A N LEU 389.A O no hydrogen 2.872 N/A TRP 298.A N PRO 227.A O no hydrogen 3.212 N/A ASN 299.A N PHE 390.A O no hydrogen 2.962 N/A ASN 299.A ND2 TYR 286.A OH no hydrogen 2.671 N/A ASP 300.A N ILE 229.A O no hydrogen 2.955 N/A ASN 301.A ND2 SER 391.A OG no hydrogen 2.800 N/A ILE 305.A N ASN 342.A OD1 no hydrogen 2.958 N/A PHE 306.A N ALA 263.A O no hydrogen 2.978 N/A SER 308.A OG GLU 310.A OE1 no hydrogen 3.279 N/A SER 308.A OG ASP 346.A OD1 no hydrogen 2.644 N/A SER 308.A OG ASP 346.A OD2 no hydrogen 3.194 N/A GLU 310.A N GLU 310.A OE1 no hydrogen 2.829 N/A GLY 311.A N SER 308.A OG no hydrogen 2.906 N/A LEU 312.A N SER 308.A O no hydrogen 2.926 N/A ALA 313.A N SER 309.A O no hydrogen 3.115 N/A GLU 314.A N GLU 310.A O no hydrogen 3.171 N/A ALA 315.A N GLY 311.A O no hydrogen 2.968 N/A LYS 316.A N LEU 312.A O no hydrogen 2.917 N/A GLU 317.A N ALA 313.A O no hydrogen 2.900 N/A PHE 318.A N GLU 314.A O no hydrogen 2.882 N/A ALA 319.A N ALA 315.A O no hydrogen 2.961 N/A GLY 320.A N LYS 316.A O no hydrogen 3.027 N/A GLU 321.A N GLU 317.A O no hydrogen 3.230 N/A PHE 322.A N PHE 318.A O no hydrogen 2.962 N/A ALA 323.A N ALA 319.A O no hydrogen 2.869 N/A LYS 324.A N GLY 320.A O no hydrogen 3.453 N/A ASP 325.A N PHE 322.A O no hydrogen 3.254 N/A GLU 327.A N ASP 325.A OD2 no hydrogen 3.204 N/A LYS 329.A N ASP 325.A OD2 no hydrogen 3.482 N/A ILE 330.A N ASP 325.A OD1 no hydrogen 2.810 N/A ALA 334.A N HIS 331.A O no hydrogen 3.026 N/A ALA 336.A N TRP 333.A O no hydrogen 3.017 N/A LYS 337.A N ALA 334.A O no hydrogen 3.122 N/A LYS 337.A NZ GLU 314.A OE1 no hydrogen 3.303 N/A ASP 339.A N ALA 336.A O no hydrogen 2.870 N/A VAL 341.A N LYS 338.A O no hydrogen 3.215 N/A ASN 342.A N ILE 305.A O no hydrogen 2.770 N/A SER 343.A OG GLU 345.A OE2 no hydrogen 2.875 N/A GLU 345.A N GLU 345.A OE2 no hydrogen 3.210 N/A TYR 347.A N SER 343.A O no hydrogen 3.228 N/A TYR 347.A OH PRO 303.A O no hydrogen 2.620 N/A LYS 348.A N GLU 345.A O no hydrogen 3.213 N/A ARG 349.A N ASP 346.A O no hydrogen 2.999 N/A ARG 349.A NH1 ASP 346.A OD1 no hydrogen 2.613 N/A TYR 351.A N LYS 253.A O no hydrogen 2.804 N/A HIS 352.A N ILE 359.A O no hydrogen 2.816 N/A HIS 352.A ND1 ASP 273.A OD1 no hydrogen 2.851 N/A ASN 353.A N ASP 273.A OD2 no hydrogen 2.602 N/A VAL 354.A N LYS 357.A O no hydrogen 2.830 N/A GLY 356.A N ASN 353.A OD1 no hydrogen 2.956 N/A LYS 357.A N VAL 354.A O no hydrogen 2.873 N/A ILE 359.A N HIS 352.A O no hydrogen 2.936 N/A ARG 360.A NE ASP 362.A OD1 no hydrogen 2.751 N/A ARG 360.A NH2 ASP 362.A OD1 no hydrogen 3.552 N/A ARG 360.A NH2 ASP 362.A OD2 no hydrogen 3.059 N/A HIS 361.A N PHE 350.A O no hydrogen 2.882 N/A LYS 363.A N ARG 360.A O no hydrogen 3.043 N/A VAL 364.A N HIS 361.A O no hydrogen 2.839 N/A HIS 365.A NE2 CYS 70.A O no hydrogen 2.684 N/A ASN 366.A N PRO 105.A O no hydrogen 3.071 N/A ASN 366.A ND2 SER 68.A O no hydrogen 3.110 N/A LEU 367.A N VAL 364.A O no hydrogen 2.972 N/A PHE 368.A N HIS 365.A O no hydrogen 3.301 N/A TYR 370.A OH THR 13.A O no hydrogen 2.992 N/A ASN 371.A N LEU 367.A O no hydrogen 2.968 N/A ASN 371.A ND2 LEU 367.A O no hydrogen 2.982 N/A THR 372.A OG1 ASN 299.A OD1 no hydrogen 3.518 N/A THR 372.A OG1 GLY 369.A O no hydrogen 3.154 N/A ARG 373.A N TYR 370.A O no hydrogen 2.907 N/A ARG 373.A NE GLU 377.A OE1 no hydrogen 3.262 N/A ARG 373.A NH1 GLU 14.A OE1 no hydrogen 3.265 N/A ARG 373.A NH1 ASN 371.A OD1 no hydrogen 3.254 N/A ARG 373.A NH2 GLU 14.A OE1 no hydrogen 2.826 N/A ALA 374.A N ASN 371.A O no hydrogen 2.946 N/A GLY 376.A N THR 372.A O no hydrogen 2.914 N/A GLU 377.A N ARG 373.A O no hydrogen 2.900 N/A ALA 378.A N ALA 374.A O no hydrogen 3.169 N/A PHE 379.A N ALA 375.A O no hydrogen 2.915 N/A GLU 380.A N GLY 376.A O no hydrogen 3.137 N/A ARG 381.A N GLU 377.A O no hydrogen 3.019 N/A ARG 381.A NE ASP 284.A OD1 no hydrogen 3.194 N/A ARG 381.A NH2 ASP 284.A OD1 no hydrogen 2.390 N/A ILE 382.A N ALA 378.A O no hydrogen 2.813 N/A ASP 383.A N PHE 379.A O no hydrogen 2.860 N/A LYS 386.A N ASP 383.A O no hydrogen 3.099 N/A LYS 386.A NZ GLU 295.A OE1 no hydrogen 2.917 N/A ARG 387.A N ILE 622.A O no hydrogen 3.192 N/A ARG 387.A NE HIS 623.A O no hydrogen 2.712 N/A ARG 387.A NH1 TYR 494.A OH no hydrogen 3.173 N/A ARG 387.A NH1 ASP 619.A OD1 no hydrogen 3.434 N/A ARG 387.A NH1 HIS 623.A O no hydrogen 2.951 N/A ARG 387.A NH2 PRO 155.A O no hydrogen 2.959 N/A ARG 387.A NH2 TYR 494.A OH no hydrogen 2.820 N/A LEU 389.A N GLU 295.A O no hydrogen 3.067 N/A SER 391.A N GLY 402.A O no hydrogen 2.950 N/A SER 391.A OG THR 372.A OG1 no hydrogen 3.195 N/A SER 391.A OG SER 393.A O no hydrogen 2.847 N/A ARG 392.A N ASN 299.A O no hydrogen 3.218 N/A ARG 392.A NE GLU 302.A OE2 no hydrogen 2.883 N/A ARG 392.A NH1 GLU 302.A OE1 no hydrogen 2.689 N/A SER 393.A N ASN 301.A OD1 no hydrogen 2.967 N/A SER 394.A OG HIS 87.A NE2 no hydrogen 2.775 N/A TYR 395.A OH ASP 103.A OD1 no hydrogen 2.841 N/A TYR 395.A OH TYR 104.A O no hydrogen 3.271 N/A GLY 397.A N HIS 398.A ND1 no hydrogen 2.999 N/A HIS 398.A NE2 GLY 150.A O no hydrogen 3.010 N/A ARG 399.A N GLY 397.A O no hydrogen 3.328 N/A ARG 399.A NH1 ALA 15.A O no hydrogen 2.870 N/A ARG 399.A NH1 ILE 149.A O no hydrogen 2.754 N/A ARG 399.A NH2 GLU 14.A O no hydrogen 2.849 N/A ILE 403.A N TYR 428.A O no hydrogen 2.929 N/A TRP 404.A N SER 391.A O no hydrogen 2.909 N/A TRP 404.A NE1 ASP 432.A OD2 no hydrogen 2.480 N/A ASN 407.A N ASP 432.A O no hydrogen 2.721 N/A ASN 407.A ND2 ASN 417.A OD1 no hydrogen 2.634 N/A LYS 408.A N ASP 406.A OD1 no hydrogen 2.846 N/A LYS 408.A NZ ASP 406.A OD2 no hydrogen 3.531 N/A LYS 408.A NZ GLU 463.A OE1 no hydrogen 2.648 N/A SER 409.A OG THR 440.A OG1 no hydrogen 2.738 N/A TRP 410.A N ASN 407.A O no hydrogen 2.836 N/A SER 412.A OG HIS 413.A ND1 no hydrogen 2.955 N/A HIS 413.A N TRP 410.A O no hydrogen 3.071 N/A HIS 413.A ND1 SER 412.A OG no hydrogen 2.955 N/A HIS 413.A NE2 THR 77.A OG1 no hydrogen 2.608 N/A ILE 414.A N TRP 411.A O no hydrogen 3.335 N/A LEU 416.A N SER 412.A O no hydrogen 3.427 N/A ASN 417.A N HIS 413.A O no hydrogen 2.847 N/A ASN 417.A ND2 ASN 407.A OD1 no hydrogen 3.125 N/A LEU 418.A N ILE 414.A O no hydrogen 3.077 N/A LYS 419.A N LEU 415.A O no hydrogen 3.053 N/A LYS 419.A NZ GLU 522.A OE1 no hydrogen 2.673 N/A ASN 424.A N LEU 420.A O no hydrogen 3.093 N/A ASN 424.A ND2 LEU 420.A O no hydrogen 2.899 N/A CYS 425.A SG SER 422.A O no hydrogen 3.561 N/A GLY 426.A N ASN 424.A O no hydrogen 3.196 N/A PHE 427.A N LEU 423.A O no hydrogen 3.069 N/A TYR 428.A OH ALA 159.A O no hydrogen 2.787 N/A ASP 432.A N GLY 405.A O no hydrogen 3.029 N/A GLY 434.A N ASP 406.A OD1 no hydrogen 2.688 N/A GLY 435.A N LYS 408.A O no hydrogen 3.025 N/A ASP 439.A N PHE 436.A O no hydrogen 2.863 N/A THR 440.A OG1 SER 409.A OG no hydrogen 2.738 N/A THR 441.A OG1 ASP 443.A OD1 no hydrogen 2.669 N/A ARG 442.A NE GLU 474.A O no hydrogen 2.613 N/A ARG 442.A NH2 GLU 474.A O no hydrogen 3.164 N/A ARG 442.A NH2 ASN 475.A O no hydrogen 3.254 N/A ARG 442.A NH2 ASP 478.A OD2 no hydrogen 2.379 N/A LEU 445.A N THR 441.A O no hydrogen 3.228 N/A LEU 446.A N ARG 442.A O no hydrogen 3.081 N/A ARG 447.A N ASP 443.A O no hydrogen 3.036 N/A ARG 447.A NH1 VAL 573.A O no hydrogen 3.337 N/A ARG 447.A NH1 ALA 574.A O no hydrogen 3.227 N/A ARG 447.A NH2 ALA 539.A O no hydrogen 2.898 N/A ARG 447.A NH2 VAL 573.A O no hydrogen 2.998 N/A PHE 448.A N LEU 444.A O no hydrogen 2.923 N/A LEU 449.A N LEU 445.A O no hydrogen 2.931 N/A ALA 450.A N LEU 446.A O no hydrogen 3.080 N/A LEU 451.A N ARG 447.A O no hydrogen 3.403 N/A GLY 452.A N PHE 448.A O no hydrogen 3.015 N/A VAL 453.A N LEU 449.A O no hydrogen 2.838 N/A PHE 454.A N LEU 451.A O no hydrogen 2.958 N/A THR 455.A N GLY 452.A O no hydrogen 3.112 N/A THR 455.A OG1 GLY 452.A O no hydrogen 3.221 N/A THR 455.A OG1 LEU 457.A O no hydrogen 3.121 N/A LEU 457.A N THR 429.A O no hydrogen 3.179 N/A ARG 458.A NE ASP 432.A OD1 no hydrogen 2.842 N/A ARG 458.A NH2 ASP 432.A OD2 no hydrogen 2.713 N/A ASP 459.A N GLY 163.A O no hydrogen 2.911 N/A HIS 460.A NE2 ASP 193.A OD1 no hydrogen 2.982 N/A ALA 461.A N SER 165.A O no hydrogen 3.429 N/A ALA 462.A N GLY 434.A O no hydrogen 2.776 N/A GLY 464.A N GLY 434.A O no hydrogen 3.133 N/A THR 465.A N GLY 437.A O no hydrogen 2.714 N/A THR 465.A OG1 ASP 438.A OD1 no hydrogen 3.295 N/A ARG 466.A N GLY 437.A O no hydrogen 3.393 N/A ARG 466.A NE ASP 438.A O no hydrogen 3.146 N/A ARG 466.A NH2 ASP 438.A O no hydrogen 2.621 N/A GLN 468.A NE2 LEU 433.A O no hydrogen 2.889 N/A GLN 468.A NE2 ASP 459.A OD1 no hydrogen 3.060 N/A CYS 470.A N TYR 182.A OH no hydrogen 3.291 N/A CYS 470.A SG TYR 182.A OH no hydrogen 3.685 N/A GLN 472.A N GLU 469.A O no hydrogen 3.006 N/A GLN 472.A NE2 GLU 469.A OE2 no hydrogen 2.818 N/A ASN 475.A ND2 GLU 477.A OE2 no hydrogen 2.897 N/A GLU 477.A N GLU 477.A OE1 no hydrogen 2.970 N/A ASP 478.A N ASN 475.A O no hydrogen 3.031 N/A ARG 480.A N ILE 476.A O no hydrogen 3.129 N/A ARG 480.A NE ASN 185.A O no hydrogen 2.994 N/A ARG 480.A NH2 ASN 185.A O no hydrogen 2.718 N/A SER 481.A N GLU 477.A O no hydrogen 2.892 N/A SER 481.A OG.A ASN 576.A O no hydrogen 3.255 N/A SER 481.A OG.B GLU 477.A O no hydrogen 2.739 N/A SER 481.A OG.B PRO 555.A O no hydrogen 3.428 N/A VAL 482.A N ASP 478.A O no hydrogen 3.140 N/A ILE 483.A N PHE 479.A O no hydrogen 2.979 N/A ASN 484.A N ARG 480.A O no hydrogen 2.749 N/A ALA 485.A N SER 481.A O no hydrogen 3.207 N/A ARG 486.A N VAL 482.A O no hydrogen 3.449 N/A ARG 486.A NE PHE 160.A O no hydrogen 2.923 N/A ARG 486.A NH1 PHE 160.A O no hydrogen 3.178 N/A ARG 486.A NH1 GLY 161.A O no hydrogen 3.425 N/A ARG 486.A NH1 THR 455.A O no hydrogen 3.418 N/A ARG 486.A NH1 PRO 456.A O no hydrogen 2.748 N/A ARG 486.A NH2 VAL 453.A O no hydrogen 2.672 N/A ARG 486.A NH2 THR 455.A O no hydrogen 2.800 N/A TYR 487.A N ILE 483.A O no hydrogen 3.208 N/A TYR 487.A OH ASP 190.A OD2 no hydrogen 2.802 N/A ARG 488.A N ASN 484.A O no hydrogen 2.914 N/A ARG 488.A NE ALA 591.A O no hydrogen 2.945 N/A ARG 488.A NH1 GLY 557.A O no hydrogen 2.926 N/A LEU 489.A N ALA 485.A O no hydrogen 3.099 N/A LEU 489.A N ARG 486.A O no hydrogen 3.045 N/A VAL 490.A N TYR 487.A O no hydrogen 3.433 N/A TYR 492.A OH LEU 526.A O no hydrogen 3.375 N/A TYR 492.A OH GLU 529.A OE1 no hydrogen 2.776 N/A LEU 493.A N LEU 489.A O no hydrogen 2.841 N/A TYR 494.A N VAL 490.A O no hydrogen 2.835 N/A TYR 494.A OH ASP 619.A OD1 no hydrogen 2.589 N/A SER 495.A N PRO 491.A O no hydrogen 2.956 N/A SER 495.A OG TYR 614.A OH no hydrogen 2.732 N/A GLU 496.A N TYR 492.A O no hydrogen 2.803 N/A TYR 497.A N LEU 493.A O no hydrogen 2.926 N/A TYR 497.A OH TYR 153.A O no hydrogen 2.706 N/A LYS 498.A NZ GLU 496.A OE2 no hydrogen 2.903 N/A LYS 498.A NZ THR 615.A O no hydrogen 2.762 N/A ALA 499.A N GLU 496.A O no hydrogen 3.053 N/A ALA 500.A N TYR 497.A O no hydrogen 2.813 N/A ASN 502.A N LYS 498.A O no hydrogen 3.146 N/A ASN 502.A ND2 LYS 498.A O no hydrogen 2.878 N/A ASP 503.A N ALA 500.A O no hydrogen 3.403 N/A ASP 504.A N ALA 499.A O no hydrogen 2.767 N/A TYR 505.A N ASN 424.A OD1 no hydrogen 2.841 N/A TYR 505.A OH PHE 454.A O no hydrogen 2.966 N/A PHE 506.A N ASN 424.A OD1 no hydrogen 3.096 N/A LYS 507.A NZ TYR 139.A OH no hydrogen 3.414 N/A LYS 507.A NZ GLY 527.A O no hydrogen 3.009 N/A PHE 511.A N PRO 508.A O no hydrogen 3.030 N/A VAL 512.A N LEU 509.A O no hydrogen 3.054 N/A TYR 513.A N LEU 509.A O no hydrogen 2.818 N/A TYR 513.A OH GLU 548.A OE2 no hydrogen 2.459 N/A ASP 516.A N TYR 513.A O no hydrogen 3.176 N/A ILE 519.A N ASP 516.A O no hydrogen 3.138 N/A ARG 520.A NH1 ASP 46.A O no hydrogen 3.115 N/A VAL 521.A N ALA 518.A O no hydrogen 3.207 N/A GLN 524.A NE2 TYR 545.A O no hydrogen 2.920 N/A LEU 525.A N ILE 531.A O no hydrogen 3.081 N/A GLY 527.A N TYR 505.A O no hydrogen 2.909 N/A ASN 528.A N GLU 529.A OE1 no hydrogen 2.888 N/A ILE 530.A N LEU 526.A O no hydrogen 3.488 N/A ILE 531.A N LEU 525.A O no hydrogen 2.772 N/A TYR 535.A OH ASP 523.A OD2 no hydrogen 2.524 N/A GLN 537.A NE2 ASP 443.A OD2 no hydrogen 3.195 N/A ALA 539.A N GLU 536.A O no hydrogen 3.342 N/A ARG 542.A N VAL 571.A O no hydrogen 2.988 N/A ARG 542.A NE TYR 543.A O no hydrogen 2.840 N/A ARG 542.A NH1 ASP 523.A O no hydrogen 2.845 N/A ARG 542.A NH1 PRO 533.A O no hydrogen 2.926 N/A ARG 542.A NH2 ASP 523.A O no hydrogen 3.468 N/A ARG 542.A NH2 ASP 523.A OD1 no hydrogen 2.920 N/A ARG 542.A NH2 TYR 543.A O no hydrogen 3.022 N/A VAL 544.A N HIS 569.A O no hydrogen 2.676 N/A TYR 545.A N GLN 524.A OE1 no hydrogen 2.890 N/A TYR 545.A OH ASP 516.A OD1 no hydrogen 3.356 N/A TYR 545.A OH ASP 516.A OD2 no hydrogen 2.551 N/A LEU 546.A N GLY 567.A O no hydrogen 2.870 N/A LYS 550.A N ILE 582.A O no hydrogen 2.897 N/A LYS 550.A NZ GLU 561.A OE2 no hydrogen 2.753 N/A LYS 550.A NZ GLY 608.A O no hydrogen 2.999 N/A PHE 551.A N GLU 562.A O no hydrogen 2.683 N/A ILE 552.A N LEU 580.A O no hydrogen 2.778 N/A LYS 553.A N SER 560.A O no hydrogen 3.049 N/A LYS 553.A NZ ASP 572.A O no hydrogen 2.687 N/A LYS 553.A NZ GLU 577.A OE1 no hydrogen 3.200 N/A PHE 554.A N VAL 578.A O no hydrogen 3.051 N/A SER 558.A N ASP 556.A OD1 no hydrogen 3.105 N/A SER 558.A OG ASP 556.A OD1 no hydrogen 2.654 N/A SER 560.A N LYS 553.A O no hydrogen 2.938 N/A SER 560.A OG LYS 553.A O no hydrogen 3.496 N/A GLU 562.A N PHE 551.A O no hydrogen 2.923 N/A GLY 567.A N LEU 546.A O no hydrogen 2.761 N/A HIS 569.A N VAL 544.A O no hydrogen 2.791 N/A HIS 569.A NE2 GLU 565.A O no hydrogen 2.792 N/A VAL 571.A N ARG 542.A O no hydrogen 2.813 N/A VAL 573.A N ARG 540.A O no hydrogen 2.886 N/A ALA 574.A N GLU 577.A OE1 no hydrogen 2.904 N/A ASN 576.A ND2 ASP 478.A OD1 no hydrogen 2.971 N/A GLU 577.A N ALA 574.A O no hydrogen 2.931 N/A VAL 578.A N PHE 554.A O no hydrogen 3.259 N/A LEU 580.A N ILE 552.A O no hydrogen 2.832 N/A ILE 582.A N LYS 550.A O no hydrogen 2.946 N/A ARG 583.A N GLU 529.A O no hydrogen 2.847 N/A ARG 583.A NE GLU 548.A OE2 no hydrogen 2.942 N/A SER 584.A N GLU 549.A O no hydrogen 3.110 N/A LYS 586.A N ARG 583.A O no hydrogen 3.079 N/A LYS 586.A NZ ASN 528.A O no hydrogen 3.522 N/A CYS 587.A SG SER 612.A O no hydrogen 3.787 N/A ILE 588.A N ILE 607.A O no hydrogen 2.934 N/A VAL 590.A N GLN 605.A O no hydrogen 2.614 N/A ALA 591.A N ARG 488.A O no hydrogen 3.006 N/A CYS 596.A SG ASP 599.A OD2 no hydrogen 3.104 N/A VAL 597.A N ASP 190.A OD2 no hydrogen 2.843 N/A LYS 598.A NZ ASP 599.A OD1 no hydrogen 3.365 N/A ASP 599.A N CYS 596.A O no hydrogen 3.081 N/A ILE 600.A N VAL 597.A O no hydrogen 3.249 N/A THR 602.A OG1 GLU 618.A OE1 no hydrogen 3.197 N/A GLU 603.A N ASP 601.A OD1 no hydrogen 2.859 N/A GLN 605.A N VAL 590.A O no hydrogen 3.051 N/A ILE 607.A N ILE 588.A O no hydrogen 2.893 N/A TYR 609.A N LYS 586.A O no hydrogen 3.022 N/A TYR 609.A OH GLU 549.A OE2 no hydrogen 2.781 N/A GLY 611.A N LYS 637.A O no hydrogen 2.788 N/A SER 612.A N TYR 609.A O no hydrogen 3.272 N/A SER 612.A OG TYR 609.A O no hydrogen 2.536 N/A TYR 614.A N LEU 635.A O no hydrogen 2.789 N/A TYR 614.A OH SER 495.A OG no hydrogen 2.732 N/A TYR 614.A OH GLU 496.A OE2 no hydrogen 2.569 N/A LEU 616.A N ARG 633.A O no hydrogen 2.716 N/A TYR 617.A N SER 495.A OG no hydrogen 2.823 N/A TYR 617.A OH ASP 619.A OD2 no hydrogen 2.683 N/A GLU 618.A N ASN 631.A O no hydrogen 2.782 N/A GLY 621.A N ASP 619.A OD1 no hydrogen 2.975 N/A ILE 622.A N ASP 620.A OD1 no hydrogen 2.777 N/A HIS 623.A N ASP 620.A OD1 no hydrogen 2.971 N/A HIS 623.A ND1 ASP 620.A OD2 no hydrogen 2.629 N/A LYS 628.A NZ ASP 625.A OD2 no hydrogen 2.776 N/A ASN 631.A N LYS 628.A O no hydrogen 3.038 N/A ASN 631.A ND2 ASP 625.A O no hydrogen 2.893 N/A ASN 631.A ND2 TYR 626.A O no hydrogen 2.968 N/A TYR 632.A N LYS 629.A O no hydrogen 3.056 N/A ARG 633.A N LEU 616.A O no hydrogen 2.900 N/A ARG 633.A NH2 GLU 618.A OE2 no hydrogen 2.601 N/A LEU 635.A N TYR 614.A O no hydrogen 2.689 N/A LYS 637.A N SER 612.A O no hydrogen 2.967 N/A