Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dfm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLY 37.A O no hydrogen 3.038 N/A ALA 4.A N VAL 39.A O no hydrogen 2.911 N/A TRP 6.A NE1 ASP 51.A OD2 no hydrogen 2.705 N/A PHE 13.A N ALA 34.A O no hydrogen 2.955 N/A VAL 14.A N ARG 56.A O no hydrogen 2.761 N/A GLY 15.A N ALA 32.A O no hydrogen 2.863 N/A VAL 17.A N ALA 30.A O no hydrogen 3.064 N/A SER 19.A N ASP 27.A O no hydrogen 2.984 N/A ARG 20.A NE GLU 22.A OE1 no hydrogen 2.845 N/A ARG 20.A NH2 GLU 22.A OE2 no hydrogen 2.799 N/A LYS 21.A NZ ASP 285.A OD1 no hydrogen 3.451 N/A GLU 22.A N GLU 22.A OE1 no hydrogen 2.712 N/A TRP 25.A N GLU 22.A O no hydrogen 2.900 N/A ASP 27.A N SER 19.A OG no hydrogen 2.838 N/A LEU 28.A N TYR 46.A OH no hydrogen 2.834 N/A LEU 29.A N VAL 17.A O no hydrogen 2.859 N/A ALA 30.A N VAL 17.A O no hydrogen 3.454 N/A ALA 32.A N GLY 15.A O no hydrogen 2.851 N/A ALA 33.A N HIS 40.A O no hydrogen 2.812 N/A ALA 34.A N PHE 13.A O no hydrogen 2.780 N/A ARG 35.A N ARG 38.A O no hydrogen 3.018 N/A ARG 38.A N ARG 35.A O no hydrogen 3.036 N/A VAL 39.A N GLU 2.A O no hydrogen 2.957 N/A HIS 40.A N ALA 33.A O no hydrogen 2.650 N/A HIS 40.A ND1 PRO 5.A O no hydrogen 2.780 N/A ARG 41.A NE GLU 108.A OE2 no hydrogen 2.874 N/A ARG 41.A NH1 GLU 3.A OE2 no hydrogen 3.387 N/A ARG 41.A NH2 GLU 108.A OE1 no hydrogen 2.608 N/A ALA 42.A N LEU 31.A O no hydrogen 2.987 N/A TYR 46.A OH ASP 27.A OD1 no hydrogen 2.508 N/A ALA 48.A N GLU 44.A O no hydrogen 2.957 N/A LEU 49.A N PRO 45.A O no hydrogen 3.214 N/A LEU 49.A N TYR 46.A O no hydrogen 3.227 N/A ARG 50.A N LYS 47.A O no hydrogen 3.208 N/A ARG 50.A NH1 TYR 46.A O no hydrogen 2.748 N/A ASP 51.A N ALA 48.A O no hydrogen 2.970 N/A LEU 52.A N LEU 49.A O no hydrogen 3.076 N/A ALA 55.A N PRO 75.A O no hydrogen 2.844 N/A ARG 56.A NE ASP 78.A OD2 no hydrogen 2.894 N/A ARG 56.A NH1 GLY 11.A O no hydrogen 2.913 N/A ARG 56.A NH2 ASP 78.A OD2 no hydrogen 2.998 N/A GLY 57.A N ASP 78.A O no hydrogen 2.732 N/A LEU 58.A N SER 116.A OG no hydrogen 3.040 N/A LEU 59.A N ASP 79.A OD1 no hydrogen 3.337 N/A ALA 60.A N GLY 57.A O no hydrogen 3.159 N/A ALA 60.A N ASP 79.A OD2 no hydrogen 3.247 N/A LYS 61.A NZ GLU 152.A OE2 no hydrogen 2.706 N/A LYS 61.A NZ PHE 271.A O no hydrogen 2.945 N/A ASP 62.A N LEU 59.A O no hydrogen 3.051 N/A SER 64.A N ALA 60.A O no hydrogen 3.053 N/A SER 64.A OG LEU 74.A O no hydrogen 2.672 N/A VAL 65.A N LYS 61.A O no hydrogen 2.801 N/A LEU 66.A N ASP 62.A O no hydrogen 3.053 N/A ALA 67.A N LEU 63.A O no hydrogen 2.832 N/A LEU 68.A N SER 64.A O no hydrogen 2.812 N/A ARG 69.A N VAL 65.A O no hydrogen 2.893 N/A ARG 69.A NE GLU 70.A OE2 no hydrogen 2.801 N/A ARG 69.A NH1 ALA 26.A O no hydrogen 2.684 N/A ARG 69.A NH2 ALA 26.A O no hydrogen 3.059 N/A ARG 69.A NH2 GLU 70.A OE2 no hydrogen 3.072 N/A GLU 70.A N LEU 66.A O no hydrogen 3.149 N/A GLU 70.A N ALA 67.A O no hydrogen 2.965 N/A GLY 71.A N LEU 68.A O no hydrogen 2.970 N/A LEU 72.A N ALA 67.A O no hydrogen 2.886 N/A LEU 74.A N LEU 72.A O no hydrogen 2.850 N/A GLY 77.A N ALA 55.A O no hydrogen 2.677 N/A ASP 79.A N TYR 137.A OH no hydrogen 3.425 N/A MET 81.A N ASP 79.A OD1 no hydrogen 2.831 N/A LEU 82.A N ASP 79.A O no hydrogen 3.050 N/A ALA 84.A N PRO 80.A O no hydrogen 2.953 N/A TYR 85.A N MET 81.A O no hydrogen 2.856 N/A TYR 85.A OH THR 276.A O no hydrogen 2.625 N/A LEU 86.A N LEU 82.A O no hydrogen 3.119 N/A LEU 87.A N LEU 83.A O no hydrogen 3.106 N/A ASP 88.A N ALA 84.A O no hydrogen 2.970 N/A SER 90.A N ASP 88.A OD1 no hydrogen 3.069 N/A SER 90.A OG ASP 88.A OD1 no hydrogen 2.868 N/A SER 90.A OG ASP 88.A OD2 no hydrogen 3.280 N/A ASN 91.A N ASP 88.A O no hydrogen 2.838 N/A ASN 91.A ND2 ALA 84.A O no hydrogen 2.903 N/A ASN 91.A ND2 TYR 101.A OH no hydrogen 2.951 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.728 N/A GLY 96.A N THR 93.A OG1 no hydrogen 2.941 N/A VAL 97.A N THR 93.A O no hydrogen 2.930 N/A ALA 98.A N PRO 94.A O no hydrogen 2.964 N/A ARG 99.A N GLU 95.A O no hydrogen 3.252 N/A ARG 100.A N GLY 96.A O no hydrogen 2.954 N/A ARG 100.A NH1 ASP 88.A OD2 no hydrogen 2.906 N/A ARG 100.A NH1 ASN 91.A OD1 no hydrogen 3.082 N/A ARG 100.A NH2 ASP 88.A OD2 no hydrogen 3.275 N/A TYR 101.A N VAL 97.A O no hydrogen 2.852 N/A GLY 102.A N ALA 98.A O no hydrogen 2.984 N/A GLY 103.A N ALA 98.A O no hydrogen 2.822 N/A THR 106.A OG1 GLU 111.A OE1 no hydrogen 2.603 N/A GLY 110.A N GLU 108.A OE2 no hydrogen 2.907 N/A GLU 111.A N GLU 108.A OE1 no hydrogen 2.912 N/A ARG 112.A N GLU 108.A O no hydrogen 2.956 N/A ARG 112.A NE THR 106.A O no hydrogen 2.712 N/A ARG 112.A NH1 PHE 16.A O no hydrogen 2.794 N/A ARG 112.A NH2 THR 106.A O no hydrogen 2.973 N/A ALA 113.A N ALA 109.A O no hydrogen 2.826 N/A ALA 114.A N GLY 110.A O no hydrogen 3.044 N/A LEU 115.A N GLU 111.A O no hydrogen 2.903 N/A SER 116.A N ARG 112.A O no hydrogen 2.858 N/A SER 116.A OG VAL 14.A O no hydrogen 3.488 N/A SER 116.A OG ARG 112.A O no hydrogen 2.904 N/A GLU 117.A N ALA 113.A O no hydrogen 3.072 N/A ARG 118.A N ALA 114.A O no hydrogen 3.188 N/A ARG 118.A NH1 GLY 102.A O no hydrogen 3.262 N/A LEU 119.A N LEU 115.A O no hydrogen 2.899 N/A PHE 120.A N SER 116.A O no hydrogen 2.945 N/A ALA 121.A N GLU 117.A O no hydrogen 3.133 N/A ASN 122.A N ARG 118.A O no hydrogen 2.932 N/A ASN 122.A ND2 TYR 101.A O no hydrogen 2.713 N/A LEU 123.A N LEU 119.A O no hydrogen 2.834 N/A TRP 124.A N PHE 120.A O no hydrogen 2.836 N/A GLY 125.A N ALA 121.A O no hydrogen 3.243 N/A ARG 126.A N ASN 122.A O no hydrogen 3.123 N/A LEU 127.A N LEU 123.A O no hydrogen 3.128 N/A LEU 127.A N TRP 124.A O no hydrogen 3.221 N/A GLU 128.A N.A GLY 125.A O no hydrogen 3.165 N/A GLU 128.A N.B GLY 125.A O no hydrogen 3.193 N/A GLU 130.A N LEU 127.A O no hydrogen 3.167 N/A ARG 132.A NH2 LEU 430.A O no hydrogen 2.528 N/A LEU 134.A N GLU 130.A O no hydrogen 2.894 N/A TRP 135.A N GLU 131.A O no hydrogen 2.936 N/A LEU 136.A N ARG 132.A O no hydrogen 3.004 N/A TYR 137.A N LEU 133.A O no hydrogen 2.918 N/A TYR 137.A OH ASP 78.A OD1 no hydrogen 2.605 N/A ARG 138.A N LEU 134.A O no hydrogen 2.944 N/A GLU 139.A N TRP 135.A O no hydrogen 2.751 N/A VAL 140.A N LEU 136.A O no hydrogen 2.951 N/A GLU 141.A N LEU 136.A O no hydrogen 2.830 N/A ARG 142.A N TYR 137.A O no hydrogen 2.863 N/A ARG 142.A NH1 ASP 78.A OD1 no hydrogen 2.860 N/A LEU 144.A N VAL 140.A O no hydrogen 2.861 N/A SER 145.A N GLU 141.A O no hydrogen 3.058 N/A SER 145.A N ARG 142.A O no hydrogen 3.279 N/A SER 145.A OG ARG 142.A O no hydrogen 2.703 N/A ALA 146.A N PRO 143.A O no hydrogen 3.055 N/A VAL 147.A N PRO 143.A O no hydrogen 3.358 N/A LEU 148.A N LEU 144.A O no hydrogen 2.783 N/A ALA 149.A N SER 145.A O no hydrogen 3.040 N/A HIS 150.A N ALA 146.A O no hydrogen 3.228 N/A MET 151.A N VAL 147.A O no hydrogen 3.047 N/A GLU 152.A N LEU 148.A O no hydrogen 2.854 N/A ALA 153.A N ALA 149.A O no hydrogen 3.027 N/A THR 154.A N HIS 150.A O no hydrogen 3.041 N/A THR 154.A N MET 151.A O no hydrogen 3.227 N/A THR 154.A OG1 HIS 150.A O no hydrogen 2.604 N/A GLY 155.A N MET 151.A O no hydrogen 3.305 N/A VAL 156.A N LEU 267.A O no hydrogen 2.928 N/A ARG 157.A NH1 ALA 307.A O no hydrogen 3.148 N/A ASP 159.A N ALA 304.A O no hydrogen 2.796 N/A TYR 162.A N ASP 159.A OD1 no hydrogen 3.110 N/A TYR 162.A OH ARG 300.A O no hydrogen 2.677 N/A LEU 163.A N ASP 159.A O no hydrogen 3.211 N/A ARG 164.A N VAL 160.A O no hydrogen 2.915 N/A ARG 164.A NH1 ASP 258.A OD1 no hydrogen 3.372 N/A ARG 164.A NH2 ASP 258.A OD1 no hydrogen 2.974 N/A ALA 165.A N ALA 161.A O no hydrogen 3.069 N/A LEU 166.A N TYR 162.A O no hydrogen 2.862 N/A SER 167.A N LEU 163.A O no hydrogen 2.904 N/A SER 167.A OG ASP 254.A OD1 no hydrogen 2.591 N/A GLU 169.A N ALA 165.A O no hydrogen 3.361 N/A VAL 170.A N LEU 166.A O no hydrogen 2.898 N/A ALA 171.A N SER 167.A O no hydrogen 2.877 N/A GLU 172.A N LEU 168.A O no hydrogen 3.239 N/A GLU 173.A N GLU 169.A O no hydrogen 3.358 N/A ILE 174.A N VAL 170.A O no hydrogen 2.846 N/A ALA 175.A N ALA 171.A O no hydrogen 2.948 N/A ARG 176.A N GLU 172.A O no hydrogen 3.110 N/A LEU 177.A N GLU 173.A O no hydrogen 3.021 N/A GLU 178.A N ILE 174.A O no hydrogen 2.875 N/A ALA 179.A N ALA 175.A O no hydrogen 3.095 N/A GLU 180.A N ARG 176.A O no hydrogen 3.095 N/A VAL 181.A N LEU 177.A O no hydrogen 2.890 N/A PHE 182.A N GLU 178.A O no hydrogen 2.865 N/A ARG 183.A N ALA 179.A O no hydrogen 2.932 N/A ARG 183.A NE GLU 180.A OE1 no hydrogen 3.368 N/A ARG 183.A NE GLU 180.A OE2 no hydrogen 2.962 N/A ARG 183.A NH2 GLU 180.A OE1 no hydrogen 2.624 N/A LEU 184.A N GLU 180.A O no hydrogen 2.947 N/A ALA 185.A N VAL 181.A O no hydrogen 2.900 N/A GLY 186.A N PHE 182.A O no hydrogen 2.860 N/A GLY 186.A N ARG 183.A O no hydrogen 3.027 N/A HIS 187.A N PHE 182.A O no hydrogen 3.001 N/A HIS 187.A ND1 PRO 188.A O no hydrogen 3.153 N/A HIS 187.A NE2 GLU 204.A OE1 no hydrogen 2.630 N/A ASN 190.A N GLN 196.A OE1 no hydrogen 2.852 N/A ASN 192.A N ASN 190.A OD1 no hydrogen 2.913 N/A SER 193.A N ASN 190.A O no hydrogen 2.890 N/A ARG 194.A NH1 ASP 195.A OD1 no hydrogen 2.869 N/A ARG 194.A NH1 GLU 198.A OE1 no hydrogen 2.806 N/A ARG 194.A NH2 ARG 219.A O no hydrogen 2.772 N/A GLN 196.A N SER 193.A OG no hydrogen 3.209 N/A LEU 197.A N SER 193.A O no hydrogen 3.011 N/A GLU 198.A N ARG 194.A O no hydrogen 2.946 N/A ARG 199.A N ASP 195.A O no hydrogen 3.442 N/A VAL 200.A N GLN 196.A O no hydrogen 3.185 N/A LEU 201.A N LEU 197.A O no hydrogen 2.960 N/A PHE 202.A N GLU 198.A O no hydrogen 2.967 N/A ASP 203.A N ARG 199.A O no hydrogen 2.977 N/A GLU 204.A N ARG 199.A O no hydrogen 2.952 N/A LEU 205.A N VAL 200.A O no hydrogen 2.779 N/A THR 213.A N LYS 218.A O no hydrogen 2.794 N/A GLY 217.A N THR 213.A O no hydrogen 3.225 N/A LYS 218.A N THR 213.A OG1 no hydrogen 2.978 N/A LYS 218.A NZ ASP 195.A OD1 no hydrogen 2.995 N/A LYS 218.A NZ ASP 195.A OD2 no hydrogen 2.772 N/A ARG 219.A N GLU 198.A OE2 no hydrogen 2.935 N/A ARG 219.A NE GLU 198.A OE2 no hydrogen 2.832 N/A ARG 219.A NH1 ASP 203.A OD1 no hydrogen 2.777 N/A ARG 219.A NH2 GLU 198.A OE2 no hydrogen 3.520 N/A ARG 219.A NH2 ASP 203.A OD1 no hydrogen 3.338 N/A ARG 219.A NH2 ASP 203.A OD2 no hydrogen 3.034 N/A SER 220.A N GLY 211.A O no hydrogen 2.786 N/A SER 222.A N SER 220.A OG no hydrogen 3.103 N/A SER 222.A OG SER 220.A OG no hydrogen 3.347 N/A LEU 226.A N SER 222.A O no hydrogen 2.959 N/A GLU 227.A N ALA 223.A O no hydrogen 2.829 N/A ALA 228.A N ALA 224.A O no hydrogen 3.322 N/A LEU 229.A N VAL 225.A O no hydrogen 3.211 N/A LEU 229.A N LEU 226.A O no hydrogen 2.986 N/A ARG 230.A N GLU 227.A O no hydrogen 3.261 N/A ALA 232.A N LEU 229.A O no hydrogen 3.149 N/A ILE 235.A N HIS 233.A ND1 no hydrogen 3.044 N/A VAL 236.A N HIS 233.A O no hydrogen 3.213 N/A ILE 239.A N ILE 235.A O no hydrogen 2.962 N/A LEU 240.A N VAL 236.A O no hydrogen 2.981 N/A GLN 241.A N GLU 237.A O no hydrogen 3.003 N/A TYR 242.A N LYS 238.A O no hydrogen 2.982 N/A TYR 242.A OH ASN 192.A OD1 no hydrogen 2.651 N/A ARG 243.A N ILE 239.A O no hydrogen 2.859 N/A ARG 243.A NH1 THR 221.A O no hydrogen 2.773 N/A ARG 243.A NH2 THR 221.A O no hydrogen 3.325 N/A ARG 243.A NH2 THR 221.A OG1 no hydrogen 2.860 N/A GLU 244.A N LEU 240.A O no hydrogen 3.129 N/A LEU 245.A N GLN 241.A O no hydrogen 3.127 N/A THR 246.A N TYR 242.A O no hydrogen 2.891 N/A THR 246.A OG1 TYR 242.A O no hydrogen 2.793 N/A THR 246.A OG1 ARG 243.A O no hydrogen 3.340 N/A LYS 247.A N ARG 243.A O no hydrogen 2.964 N/A LEU 248.A N GLU 244.A O no hydrogen 3.155 N/A LYS 249.A N LEU 245.A O no hydrogen 2.926 N/A LYS 249.A NZ ASP 254.A OD2 no hydrogen 2.632 N/A SER 250.A N THR 246.A O no hydrogen 2.904 N/A SER 250.A OG THR 246.A O no hydrogen 2.773 N/A SER 250.A OG LYS 247.A O no hydrogen 3.384 N/A THR 251.A N LYS 247.A O no hydrogen 3.050 N/A THR 251.A OG1 LYS 247.A O no hydrogen 3.042 N/A TYR 252.A N LEU 248.A O no hydrogen 2.998 N/A TYR 252.A OH ASN 290.A O no hydrogen 2.723 N/A ILE 253.A N LEU 248.A O no hydrogen 3.077 N/A ASP 254.A N LYS 249.A O no hydrogen 2.949 N/A LEU 256.A N TYR 252.A O no hydrogen 3.218 N/A ASP 258.A N PRO 255.A O no hydrogen 3.035 N/A LEU 259.A N LEU 256.A O no hydrogen 2.919 N/A HIS 261.A N ARG 266.A O no hydrogen 2.890 N/A HIS 261.A NE2 MET 24.A O no hydrogen 3.018 N/A ARG 263.A N HIS 261.A ND1 no hydrogen 3.043 N/A ARG 263.A NH1 GLU 70.A OE1 no hydrogen 3.356 N/A THR 264.A OG1 ARG 266.A O no hydrogen 3.554 N/A THR 264.A OG1 HIS 268.A NE2 no hydrogen 2.659 N/A GLY 265.A N HIS 261.A O no hydrogen 2.639 N/A ARG 266.A N THR 264.A OG1 no hydrogen 3.058 N/A ARG 266.A NE THR 154.A O no hydrogen 3.198 N/A ARG 266.A NE GLY 155.A O no hydrogen 3.287 N/A ARG 266.A NH1 GLU 497.A OE1 no hydrogen 3.444 N/A ARG 266.A NH2 GLY 155.A O no hydrogen 3.036 N/A ARG 266.A NH2 GLU 497.A OE1 no hydrogen 2.703 N/A LEU 267.A N VAL 156.A O no hydrogen 2.808 N/A HIS 268.A ND1 GLU 152.A O no hydrogen 2.806 N/A HIS 268.A NE2 THR 264.A OG1 no hydrogen 2.659 N/A THR 269.A OG1 ARG 270.A O no hydrogen 3.473 N/A THR 269.A OG1 SER 283.A OG no hydrogen 2.728 N/A THR 269.A OG1 SER 284.A O no hydrogen 3.257 N/A THR 269.A OG1 PRO 286.A O no hydrogen 2.630 N/A ARG 270.A N SER 284.A O no hydrogen 2.895 N/A ARG 270.A NH2 ASP 62.A OD1 no hydrogen 3.270 N/A PHE 271.A N GLU 152.A OE2 no hydrogen 2.831 N/A ASN 272.A N SER 282.A O no hydrogen 2.789 N/A ASN 272.A ND2 SER 282.A O no hydrogen 3.536 N/A ASN 272.A ND2 SER 282.A OG no hydrogen 3.034 N/A ASN 272.A ND2 SER 284.A OG no hydrogen 3.047 N/A GLN 273.A NE2 GLU 141.A O no hydrogen 2.808 N/A GLN 273.A NE2 GLU 141.A OE1 no hydrogen 2.874 N/A THR 274.A OG1 THR 92.A O no hydrogen 3.436 N/A THR 276.A OG1 TYR 85.A OH no hydrogen 3.272 N/A THR 276.A OG1 ARG 280.A O no hydrogen 2.704 N/A THR 278.A OG1 GLN 461.A OE1 no hydrogen 2.591 N/A GLY 279.A N THR 276.A OG1 no hydrogen 3.204 N/A SER 282.A N ASN 272.A O no hydrogen 3.190 N/A SER 283.A OG THR 269.A OG1 no hydrogen 2.728 N/A SER 283.A OG ASN 287.A OD1 no hydrogen 3.528 N/A SER 284.A N ARG 270.A O no hydrogen 2.946 N/A SER 284.A OG ASP 285.A OD2 no hydrogen 2.748 N/A LEU 288.A N SER 283.A OG no hydrogen 2.808 N/A GLN 289.A N ASN 287.A OD1 no hydrogen 2.715 N/A GLN 289.A NE2 GLN 489.A O no hydrogen 2.879 N/A THR 295.A OG1 GLU 244.A OE2 no hydrogen 2.921 N/A GLY 298.A N THR 295.A OG1 no hydrogen 3.114 N/A GLN 299.A N THR 295.A O no hydrogen 2.825 N/A GLN 299.A NE2 VAL 293.A O no hydrogen 3.461 N/A GLN 299.A NE2 ARG 294.A O no hydrogen 3.605 N/A ARG 300.A N PRO 296.A O no hydrogen 3.069 N/A ILE 301.A N LEU 297.A O no hydrogen 3.084 N/A ARG 302.A N GLY 298.A O no hydrogen 2.972 N/A ARG 302.A NE PRO 292.A O no hydrogen 3.018 N/A ARG 302.A NH2 ILE 291.A O no hydrogen 2.649 N/A ARG 303.A N GLN 299.A O no hydrogen 3.033 N/A ALA 304.A N ILE 301.A O no hydrogen 2.856 N/A PHE 305.A N ARG 302.A O no hydrogen 3.132 N/A ILE 306.A N ARG 157.A O no hydrogen 3.098 N/A ALA 307.A N GLU 532.A O no hydrogen 2.956 N/A GLU 308.A N GLU 497.A OE2 no hydrogen 2.714 N/A GLU 309.A N GLU 309.A OE1 no hydrogen 2.627 N/A TRP 311.A N GLU 308.A O no hydrogen 2.853 N/A LEU 312.A N ALA 498.A O no hydrogen 2.869 N/A LEU 313.A N GLY 531.A O no hydrogen 2.776 N/A VAL 314.A N LEU 496.A O no hydrogen 2.829 N/A ALA 315.A N GLY 529.A O no hydrogen 2.909 N/A LEU 316.A N LEU 494.A O no hydrogen 2.846 N/A ASP 317.A N GLU 527.A O no hydrogen 2.944 N/A TYR 318.A N ASP 492.A O no hydrogen 2.967 N/A TYR 318.A OH MET 514.A O no hydrogen 2.654 N/A SER 319.A N GLU 525.A O no hydrogen 2.837 N/A GLN 320.A NE2 ARG 343.A O no hydrogen 3.284 N/A ARG 324.A N GLN 320.A O no hydrogen 3.088 N/A ARG 324.A NE SER 319.A O no hydrogen 2.789 N/A ARG 324.A NH1 PRO 523.A O no hydrogen 2.871 N/A ARG 324.A NH2 SER 319.A OG no hydrogen 3.183 N/A VAL 325.A N ILE 321.A O no hydrogen 2.968 N/A LEU 326.A N GLU 322.A O no hydrogen 2.877 N/A ALA 327.A N LEU 323.A O no hydrogen 3.006 N/A HIS 328.A N ARG 324.A O no hydrogen 3.128 N/A LEU 329.A N VAL 325.A O no hydrogen 2.878 N/A SER 330.A N LEU 326.A O no hydrogen 2.865 N/A SER 330.A OG LEU 326.A O no hydrogen 2.783 N/A SER 330.A OG ALA 327.A O no hydrogen 3.468 N/A GLY 331.A N ALA 327.A O no hydrogen 2.864 N/A ASP 332.A N SER 330.A OG no hydrogen 3.159 N/A GLU 333.A N GLU 333.A OE1 no hydrogen 2.803 N/A ASN 334.A ND2 SER 406.A O no hydrogen 2.689 N/A LEU 335.A N ASP 332.A OD2 no hydrogen 2.810 N/A ILE 336.A N ASP 332.A O no hydrogen 2.966 N/A ARG 337.A N GLU 333.A O no hydrogen 2.752 N/A VAL 338.A N ASN 334.A O no hydrogen 3.065 N/A PHE 339.A N LEU 335.A O no hydrogen 3.351 N/A GLN 340.A N ILE 336.A O no hydrogen 3.000 N/A GLU 341.A N ARG 337.A O no hydrogen 3.009 N/A GLY 342.A N PHE 339.A O no hydrogen 3.178 N/A ARG 343.A N VAL 338.A O no hydrogen 3.148 N/A ARG 343.A NE GLU 348.A OE2 no hydrogen 2.929 N/A ARG 343.A NH2 GLU 348.A OE1 no hydrogen 3.049 N/A ARG 343.A NH2 GLU 348.A OE2 no hydrogen 3.457 N/A ILE 345.A N GLN 320.A OE1 no hydrogen 2.951 N/A THR 347.A N ASP 344.A OD1 no hydrogen 3.012 N/A GLU 348.A N ASP 344.A O no hydrogen 3.065 N/A THR 349.A N ILE 345.A O no hydrogen 2.930 N/A THR 349.A OG1 ILE 345.A O no hydrogen 3.150 N/A THR 349.A OG1 ASN 373.A OD1 no hydrogen 2.550 N/A ALA 350.A N HIS 346.A O no hydrogen 3.004 N/A SER 351.A N THR 347.A O no hydrogen 2.874 N/A SER 351.A OG GLU 348.A O no hydrogen 2.778 N/A TRP 352.A N GLU 348.A O no hydrogen 3.202 N/A MET 353.A N THR 349.A O no hydrogen 2.759 N/A PHE 354.A N ALA 350.A O no hydrogen 3.032 N/A GLY 355.A N TRP 352.A O no hydrogen 3.299 N/A VAL 356.A N SER 351.A O no hydrogen 2.975 N/A ALA 360.A N PRO 357.A O no hydrogen 2.907 N/A VAL 361.A N ARG 358.A O no hydrogen 3.464 N/A MET 365.A N ASP 362.A OD1 no hydrogen 2.627 N/A ARG 366.A N ASP 362.A O no hydrogen 3.037 N/A ARG 366.A NE ASP 344.A OD2 no hydrogen 3.193 N/A ARG 366.A NH2 ASP 344.A OD1 no hydrogen 3.514 N/A ARG 366.A NH2 ASP 344.A OD2 no hydrogen 3.148 N/A ARG 367.A N PRO 363.A O no hydrogen 2.811 N/A ALA 368.A N LEU 364.A O no hydrogen 3.151 N/A ALA 369.A N MET 365.A O no hydrogen 3.019 N/A LYS 370.A N ARG 366.A O no hydrogen 3.019 N/A LYS 370.A N ARG 367.A O no hydrogen 3.112 N/A ASN 373.A N ALA 369.A O no hydrogen 2.865 N/A ASN 373.A ND2 ILE 345.A O no hydrogen 3.268 N/A ASN 373.A ND2 HIS 346.A ND1 no hydrogen 3.008 N/A PHE 374.A N LYS 370.A O no hydrogen 2.998 N/A GLY 375.A N THR 371.A O no hydrogen 2.733 N/A VAL 376.A N ILE 372.A O no hydrogen 2.940 N/A LEU 377.A N ASN 373.A O no hydrogen 3.092 N/A TYR 378.A N PHE 374.A O no hydrogen 2.943 N/A TYR 378.A OH GLU 322.A OE1 no hydrogen 2.751 N/A GLY 379.A N VAL 376.A O no hydrogen 3.238 N/A MET 380.A N GLY 375.A O no hydrogen 2.792 N/A ARG 384.A N SER 381.A OG no hydrogen 3.387 N/A ARG 384.A NE GLU 388.A OE1 no hydrogen 2.691 N/A LEU 385.A N SER 381.A O no hydrogen 2.874 N/A SER 386.A N ALA 382.A O no hydrogen 2.586 N/A SER 386.A OG ALA 382.A O no hydrogen 3.048 N/A SER 386.A OG HIS 383.A O no hydrogen 2.619 N/A GLN 387.A N HIS 383.A O no hydrogen 2.825 N/A GLU 388.A N ARG 384.A O no hydrogen 2.747 N/A LEU 389.A N LEU 385.A O no hydrogen 3.062 N/A ALA 390.A N GLN 387.A O no hydrogen 3.227 N/A ILE 391.A N SER 386.A O no hydrogen 3.068 N/A GLU 394.A N GLU 394.A OE1 no hydrogen 2.639 N/A GLU 395.A N PRO 392.A O no hydrogen 3.032 N/A ALA 396.A N PRO 392.A O no hydrogen 3.294 N/A GLN 397.A N TYR 393.A O no hydrogen 3.038 N/A GLN 397.A NE2 GLU 401.A OE2 no hydrogen 2.667 N/A ALA 398.A N GLU 394.A O no hydrogen 3.225 N/A PHE 399.A N GLU 395.A O no hydrogen 2.981 N/A ILE 400.A N ALA 396.A O no hydrogen 3.192 N/A GLU 401.A N GLN 397.A O no hydrogen 3.039 N/A ARG 402.A N ALA 398.A O no hydrogen 3.212 N/A TYR 403.A N PHE 399.A O no hydrogen 2.951 N/A PHE 404.A N ILE 400.A O no hydrogen 3.385 N/A GLN 405.A N GLU 401.A O no hydrogen 2.917 N/A SER 406.A N ARG 402.A O no hydrogen 3.074 N/A SER 406.A OG ARG 402.A O no hydrogen 2.716 N/A PHE 407.A N PHE 404.A O no hydrogen 3.051 N/A LYS 409.A N ASP 332.A OD1 no hydrogen 2.858 N/A LYS 409.A NZ GLU 333.A OE2 no hydrogen 3.451 N/A VAL 410.A N PHE 407.A O no hydrogen 3.176 N/A TRP 413.A N LYS 409.A O no hydrogen 2.862 N/A ILE 414.A N VAL 410.A O no hydrogen 2.901 N/A GLU 415.A N ARG 411.A O no hydrogen 2.851 N/A LYS 416.A N ALA 412.A O no hydrogen 2.979 N/A THR 417.A N TRP 413.A O no hydrogen 2.836 N/A THR 417.A OG1 TRP 413.A O no hydrogen 2.772 N/A LEU 418.A N ILE 414.A O no hydrogen 2.916 N/A GLU 419.A N GLU 415.A O no hydrogen 2.905 N/A GLU 420.A N LYS 416.A O no hydrogen 2.929 N/A GLY 421.A N THR 417.A O no hydrogen 2.875 N/A ARG 422.A N LEU 418.A O no hydrogen 2.941 N/A ARG 423.A N GLU 419.A O no hydrogen 3.190 N/A ARG 424.A N GLU 420.A O no hydrogen 2.956 N/A ARG 424.A NH2 TYR 426.A O no hydrogen 3.347 N/A GLY 425.A N GLY 421.A O no hydrogen 2.848 N/A VAL 427.A N ARG 435.A O no hydrogen 2.972 N/A THR 429.A N ARG 433.A O no hydrogen 2.880 N/A THR 429.A OG1 ASP 466.A OD2 no hydrogen 2.657 N/A LEU 430.A N THR 463.A OG1 no hydrogen 3.014 N/A GLY 432.A N THR 429.A O no hydrogen 2.920 N/A ARG 433.A N THR 429.A OG1 no hydrogen 3.143 N/A ARG 433.A NE ASP 466.A OD1 no hydrogen 2.747 N/A ARG 433.A NH1 GLU 141.A OE2 no hydrogen 2.824 N/A ARG 433.A NH2 GLU 141.A OE2 no hydrogen 2.632 N/A ARG 433.A NH2 ASP 466.A OD1 no hydrogen 2.778 N/A ARG 434.A NH1 GLU 130.A OE2 no hydrogen 3.210 N/A ARG 434.A NH2 GLU 130.A OE1 no hydrogen 2.329 N/A ARG 435.A N VAL 427.A O no hydrogen 2.968 N/A VAL 437.A N GLY 425.A O no hydrogen 2.998 N/A LEU 440.A N VAL 437.A O no hydrogen 3.263 N/A GLU 441.A N PRO 438.A O no hydrogen 3.316 N/A ALA 442.A N ASP 439.A O no hydrogen 3.094 N/A ARG 448.A N VAL 444.A O no hydrogen 2.829 N/A ARG 448.A NH1 ALA 442.A O no hydrogen 3.102 N/A GLU 449.A N LYS 445.A O no hydrogen 2.709 N/A ALA 450.A N SER 446.A O no hydrogen 2.999 N/A ALA 451.A N VAL 447.A O no hydrogen 2.998 N/A GLU 452.A N ARG 448.A O no hydrogen 2.870 N/A ARG 453.A N GLU 449.A O no hydrogen 3.093 N/A MET 454.A N ALA 450.A O no hydrogen 3.088 N/A ALA 455.A N ALA 451.A O no hydrogen 2.796 N/A PHE 456.A N GLU 452.A O no hydrogen 3.019 N/A ASN 457.A N ARG 453.A O no hydrogen 3.224 N/A MET 458.A N MET 454.A O no hydrogen 3.211 N/A VAL 460.A N ASN 457.A O no hydrogen 2.972 N/A GLN 461.A N ASN 457.A O no hydrogen 2.959 N/A GLY 462.A N MET 458.A O no hydrogen 2.658 N/A THR 463.A N PRO 459.A O no hydrogen 2.989 N/A THR 463.A OG1 PRO 459.A O no hydrogen 2.588 N/A ALA 464.A N VAL 460.A O no hydrogen 3.149 N/A ALA 465.A N GLN 461.A O no hydrogen 2.934 N/A ASP 466.A N GLY 462.A O no hydrogen 2.815 N/A LEU 467.A N THR 463.A O no hydrogen 2.909 N/A MET 468.A N ALA 464.A O no hydrogen 3.065 N/A LYS 469.A N ALA 465.A O no hydrogen 2.990 N/A LYS 469.A NZ GLU 141.A OE1 no hydrogen 3.316 N/A LYS 469.A NZ GLU 141.A OE2 no hydrogen 2.670 N/A LYS 469.A NZ GLY 279.A O no hydrogen 2.824 N/A LEU 470.A N ASP 466.A O no hydrogen 2.960 N/A ALA 471.A N LEU 467.A O no hydrogen 2.966 N/A MET 472.A N MET 468.A O no hydrogen 2.907 N/A VAL 473.A N LYS 469.A O no hydrogen 3.004 N/A LYS 474.A N LEU 470.A O no hydrogen 2.985 N/A LYS 474.A NZ VAL 517.A O no hydrogen 2.940 N/A LEU 475.A N ALA 471.A O no hydrogen 2.802 N/A PHE 476.A N MET 472.A O no hydrogen 2.984 N/A LEU 479.A N LEU 475.A O no hydrogen 3.127 N/A GLU 480.A N PHE 476.A O no hydrogen 3.057 N/A GLU 481.A N PRO 477.A O no hydrogen 3.139 N/A MET 482.A N ARG 478.A O no hydrogen 3.212 N/A MET 482.A N LEU 479.A O no hydrogen 2.827 N/A GLY 483.A N GLU 480.A O no hydrogen 3.148 N/A ALA 484.A N LEU 479.A O no hydrogen 2.933 N/A ARG 485.A N GLU 497.A O no hydrogen 2.777 N/A ARG 485.A NH1 GLU 308.A OE1 no hydrogen 2.862 N/A ARG 485.A NH1 GLU 497.A OE1 no hydrogen 3.062 N/A LEU 487.A N VAL 495.A O no hydrogen 2.862 N/A LEU 488.A N VAL 495.A O no hydrogen 3.178 N/A VAL 490.A N GLU 493.A O no hydrogen 2.827 N/A HIS 491.A N GLN 489.A OE1 no hydrogen 2.820 N/A ASP 492.A N VAL 490.A O no hydrogen 2.840 N/A LEU 494.A N LEU 316.A O no hydrogen 2.781 N/A VAL 495.A N LEU 488.A O no hydrogen 2.905 N/A LEU 496.A N VAL 314.A O no hydrogen 2.731 N/A GLU 497.A N ARG 485.A O no hydrogen 2.769 N/A ALA 498.A N LEU 312.A O no hydrogen 2.940 N/A LYS 500.A N GLY 310.A O no hydrogen 3.099 N/A LYS 500.A NZ TRP 311.A O no hydrogen 2.921 N/A LYS 500.A NZ GLU 532.A OE2 no hydrogen 3.132 N/A ARG 502.A N PRO 499.A O no hydrogen 2.833 N/A ALA 503.A N LYS 500.A O no hydrogen 3.273 N/A VAL 506.A N ARG 502.A O no hydrogen 2.861 N/A ALA 507.A N ALA 503.A O no hydrogen 2.955 N/A ARG 508.A N GLU 504.A O no hydrogen 3.112 N/A LEU 509.A N ALA 505.A O no hydrogen 3.019 N/A ALA 510.A N VAL 506.A O no hydrogen 2.874 N/A LYS 511.A N ALA 507.A O no hydrogen 3.034 N/A LYS 511.A NZ GLU 515.A OE2 no hydrogen 2.380 N/A LYS 511.A NZ VAL 526.A O no hydrogen 3.139 N/A GLU 512.A N ARG 508.A O no hydrogen 3.116 N/A VAL 513.A N LEU 509.A O no hydrogen 2.902 N/A MET 514.A N ALA 510.A O no hydrogen 2.918 N/A GLU 515.A N LYS 511.A O no hydrogen 2.865 N/A GLY 516.A N GLU 512.A O no hydrogen 2.936 N/A ALA 521.A N HIS 328.A ND1 no hydrogen 2.940 N/A VAL 526.A N GLU 515.A OE2 no hydrogen 2.805 N/A GLU 527.A N ASP 317.A O no hydrogen 2.938 N/A GLY 529.A N ALA 315.A O no hydrogen 2.901 N/A GLY 531.A N LEU 313.A O no hydrogen 2.995 N/A ASP 533.A N SER 536.A OG.B no hydrogen 3.045 N/A TRP 534.A N PHE 305.A O no hydrogen 2.837 N/A TRP 534.A NE1 GLU 493.A OE2 no hydrogen 2.989 N/A SER 536.A N ASP 533.A OD1 no hydrogen 2.849 N/A SER 536.A OG.A ASP 533.A OD2 no hydrogen 3.105 N/A SER 536.A OG.B ASP 533.A O no hydrogen 2.779 N/A ALA 537.A N ASP 533.A O no hydrogen 2.864 N/A LYS 538.A N LEU 535.A O no hydrogen 3.120 N/A LYS 538.A NZ ASP 317.A OD2 no hydrogen 3.349 N/A LYS 538.A NZ GLU 493.A OE1 no hydrogen 3.005 N/A GLU 539.A N SER 536.A O no hydrogen 3.343 N/A