Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hb3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N PHE 2.A O no hydrogen 2.327 N/A ARG 5.A NE ARG 5.A O no hydrogen 2.914 N/A TRP 6.A N PHE 3.A O no hydrogen 3.207 N/A PHE 7.A N PHE 3.A O no hydrogen 2.694 N/A SER 9.A N TRP 6.A O no hydrogen 3.130 N/A SER 9.A OG ASP 14.A OD2 no hydrogen 2.730 N/A ASN 11.A N SER 9.A OG no hydrogen 2.698 N/A HIS 12.A N ASP 108.A OD1 no hydrogen 2.969 N/A LYS 13.A NZ.A ASN 11.A OD1 no hydrogen 3.130 N/A LYS 13.A NZ.A THR 526.A OG1 no hydrogen 2.647 N/A LYS 13.A NZ.B PRO 522.A O no hydrogen 3.092 N/A LYS 13.A NZ.C THR 526.A OG1 no hydrogen 3.328 N/A ASP 14.A N ASN 11.A O no hydrogen 2.561 N/A ILE 15.A N ASN 11.A O no hydrogen 3.077 N/A GLY 16.A N HIS 12.A O no hydrogen 2.990 N/A ILE 17.A N ASP 14.A O no hydrogen 2.814 N/A LEU 18.A N ASP 14.A O no hydrogen 2.940 N/A TYR 19.A N ILE 15.A O no hydrogen 2.996 N/A TYR 19.A OH SER 118.A OG no hydrogen 2.343 N/A LEU 20.A N GLY 16.A O no hydrogen 3.192 N/A LEU 20.A N ILE 17.A O no hydrogen 3.214 N/A PHE 21.A N ILE 17.A O no hydrogen 3.239 N/A PHE 21.A N LEU 18.A O no hydrogen 3.059 N/A THR 22.A N LEU 18.A O no hydrogen 2.963 N/A THR 22.A OG1 LEU 18.A O no hydrogen 3.023 N/A THR 22.A OG1 TYR 119.A OH no hydrogen 2.506 N/A ALA 23.A N TYR 19.A O no hydrogen 2.819 N/A GLY 24.A N LEU 20.A O no hydrogen 3.127 N/A ILE 25.A N PHE 21.A O no hydrogen 2.846 N/A ILE 25.A N THR 22.A O no hydrogen 2.732 N/A VAL 26.A N THR 22.A O no hydrogen 3.086 N/A GLY 27.A N ALA 23.A O no hydrogen 2.910 N/A LEU 28.A N GLY 24.A O no hydrogen 3.116 N/A ILE 29.A N ILE 25.A O no hydrogen 2.999 N/A SER 30.A N VAL 26.A O no hydrogen 2.845 N/A SER 30.A OG HIS 78.A ND1 no hydrogen 3.270 N/A SER 30.A OG HIS 78.A O no hydrogen 3.214 N/A VAL 31.A N GLY 27.A O no hydrogen 3.013 N/A CYS 32.A N LEU 28.A O no hydrogen 2.905 N/A CYS 32.A SG LEU 28.A O no hydrogen 3.212 N/A PHE 33.A N ILE 29.A O no hydrogen 3.210 N/A VAL 35.A N VAL 31.A O no hydrogen 3.171 N/A VAL 35.A N CYS 32.A O no hydrogen 2.926 N/A TYR 36.A N CYS 32.A O no hydrogen 3.161 N/A TYR 36.A OH ARG 55.A O no hydrogen 2.385 N/A MET 37.A N PHE 33.A O no hydrogen 2.628 N/A ARG 38.A N THR 34.A O no hydrogen 3.019 N/A ARG 38.A NH1 SER 474.A OG no hydrogen 3.121 N/A MET 39.A N VAL 35.A O no hydrogen 2.968 N/A GLU 40.A N TYR 36.A O no hydrogen 2.965 N/A LEU 41.A N MET 37.A O no hydrogen 2.874 N/A GLN 42.A N MET 39.A O no hydrogen 3.419 N/A GLN 42.A NE2 ASN 471.A OD1 no hydrogen 3.171 N/A GLY 45.A N ASP 461.A OD1 no hydrogen 2.880 N/A GLY 45.A N ASP 461.A OD2 no hydrogen 3.201 N/A GLN 47.A N GLU 40.A OE2 no hydrogen 2.929 N/A GLN 47.A NE2 PRO 44.A O no hydrogen 3.121 N/A TYR 48.A N GLU 40.A OE1 no hydrogen 2.749 N/A MET 49.A N GLU 40.A OE1 no hydrogen 2.904 N/A CYS 50.A SG TYR 48.A O no hydrogen 3.593 N/A LEU 51.A N THR 65.A O no hydrogen 2.672 N/A GLU 52.A N GLU 52.A OE1 no hydrogen 2.369 N/A GLY 53.A N CYS 50.A O no hydrogen 3.094 N/A ARG 55.A N TYR 48.A O no hydrogen 2.909 N/A ARG 55.A NH1 ALA 62.A O no hydrogen 2.679 N/A ARG 55.A NH2 ALA 62.A O no hydrogen 2.968 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 3.292 N/A ALA 62.A N ASP 59.A O no hydrogen 3.147 N/A CYS 64.A SG VAL 46.A O no hydrogen 3.281 N/A THR 65.A N GLU 52.A OE1 no hydrogen 2.826 N/A THR 65.A OG1 GLU 52.A OE2 no hydrogen 2.823 N/A HIS 69.A NE2 MET 142.A O no hydrogen 3.197 N/A LEU 70.A N ASN 67.A O no hydrogen 2.691 N/A TRP 71.A N ASN 67.A O no hydrogen 3.444 N/A ASN 72.A N GLY 68.A O no hydrogen 3.036 N/A VAL 73.A N HIS 69.A O no hydrogen 3.194 N/A VAL 73.A N LEU 70.A O no hydrogen 2.964 N/A MET 74.A N LEU 70.A O no hydrogen 2.918 N/A ILE 75.A N TRP 71.A O no hydrogen 3.147 N/A THR 76.A N ASN 72.A O no hydrogen 3.112 N/A THR 76.A OG1 ASN 72.A O no hydrogen 2.483 N/A TYR 77.A N VAL 73.A O no hydrogen 3.096 N/A TYR 77.A N MET 74.A O no hydrogen 2.857 N/A TYR 77.A OH SER 132.A OG no hydrogen 2.300 N/A TYR 77.A OH SER 162.A OG no hydrogen 3.257 N/A HIS 78.A N MET 74.A O no hydrogen 2.668 N/A GLY 79.A N ILE 75.A O no hydrogen 3.184 N/A VAL 80.A N THR 76.A O no hydrogen 2.939 N/A LEU 81.A N TYR 77.A O no hydrogen 2.920 N/A MET 82.A N HIS 78.A O no hydrogen 2.916 N/A MET 83.A N GLY 79.A O no hydrogen 3.121 N/A PHE 84.A N VAL 80.A O no hydrogen 3.000 N/A PHE 85.A N LEU 81.A O no hydrogen 2.691 N/A VAL 87.A N MET 82.A O no hydrogen 3.376 N/A ALA 90.A N VAL 86.A O no hydrogen 2.960 N/A LEU 91.A N VAL 87.A O no hydrogen 2.966 N/A PHE 92.A N ILE 88.A O no hydrogen 2.858 N/A GLY 93.A N ILE 88.A O no hydrogen 3.258 N/A GLY 94.A N ALA 90.A O no hydrogen 2.555 N/A PHE 95.A N ALA 90.A O no hydrogen 3.081 N/A GLY 96.A N LEU 91.A O no hydrogen 2.962 N/A ASN 97.A N GLY 94.A O no hydrogen 3.116 N/A ASN 97.A ND2 GLY 93.A O no hydrogen 2.527 N/A TYR 98.A N GLY 94.A O no hydrogen 3.058 N/A PHE 99.A N PHE 95.A O no hydrogen 2.911 N/A MET 100.A N GLY 96.A O no hydrogen 3.253 N/A HIS 103.A N PHE 99.A O no hydrogen 2.797 N/A HIS 103.A NE2 GLU 515.A OE2 no hydrogen 2.874 N/A ILE 104.A N MET 100.A O no hydrogen 3.329 N/A ILE 104.A N PRO 101.A O no hydrogen 3.186 N/A GLY 105.A N LEU 102.A O no hydrogen 3.017 N/A ALA 106.A N PRO 101.A O no hydrogen 2.768 N/A MET 109.A N ASP 108.A OD1 no hydrogen 3.015 N/A ALA 110.A N THR 187.A OG1 no hydrogen 2.545 N/A PHE 111.A N ASN 183.A OD1 no hydrogen 2.876 N/A ASN 115.A N PHE 111.A O no hydrogen 3.115 N/A ASN 115.A N PRO 112.A O no hydrogen 3.068 N/A ASN 115.A ND2 ASN 97.A OD1 no hydrogen 3.273 N/A ASN 116.A N PRO 112.A O no hydrogen 3.061 N/A ASN 116.A ND2 PHE 7.A O no hydrogen 3.285 N/A ASN 116.A ND2 SER 9.A O no hydrogen 2.773 N/A LEU 117.A N ARG 113.A O no hydrogen 3.210 N/A SER 118.A N LEU 114.A O no hydrogen 2.972 N/A SER 118.A OG TYR 19.A OH no hydrogen 2.343 N/A SER 118.A OG ASN 115.A O no hydrogen 2.802 N/A TYR 119.A N ASN 115.A O no hydrogen 3.339 N/A TYR 119.A N ASN 116.A O no hydrogen 3.041 N/A TYR 119.A OH THR 22.A OG1 no hydrogen 2.506 N/A TRP 120.A N ASN 116.A O no hydrogen 3.151 N/A MET 121.A N LEU 117.A O no hydrogen 2.868 N/A TYR 122.A N SER 118.A O no hydrogen 3.130 N/A TYR 122.A OH PHE 85.A O no hydrogen 2.626 N/A VAL 123.A N TYR 119.A O no hydrogen 2.959 N/A CYS 124.A N TRP 120.A O no hydrogen 2.827 N/A CYS 124.A SG TRP 120.A O no hydrogen 3.544 N/A GLY 125.A N MET 121.A O no hydrogen 2.850 N/A VAL 126.A N TYR 122.A O no hydrogen 2.986 N/A ALA 127.A N CYS 124.A O no hydrogen 2.450 N/A LEU 128.A N CYS 124.A O no hydrogen 2.636 N/A GLY 129.A N GLY 125.A O no hydrogen 2.978 N/A VAL 130.A N VAL 126.A O no hydrogen 3.181 N/A ALA 131.A N ALA 127.A O no hydrogen 2.888 N/A SER 132.A N LEU 128.A O no hydrogen 2.962 N/A SER 132.A OG TYR 77.A OH no hydrogen 2.300 N/A SER 132.A OG SER 162.A O no hydrogen 2.680 N/A LEU 133.A N GLY 129.A O no hydrogen 3.027 N/A LEU 134.A N ALA 131.A O no hydrogen 2.514 N/A ALA 135.A N ALA 131.A O no hydrogen 2.667 N/A ALA 135.A N SER 132.A O no hydrogen 3.205 N/A GLY 137.A N GLN 141.A O no hydrogen 2.769 N/A GLY 143.A N ALA 135.A O no hydrogen 2.774 N/A SER 144.A N TYR 77.A OH no hydrogen 3.231 N/A SER 144.A OG GLU 158.A OE1 no hydrogen 3.182 N/A SER 144.A OG SER 162.A OG no hydrogen 2.877 N/A GLY 145.A N GLU 158.A OE2 no hydrogen 2.836 N/A LEU 150.A N GLY 147.A O no hydrogen 3.027 N/A SER 155.A N TYR 151.A O no hydrogen 2.950 N/A SER 155.A OG LEU 150.A O no hydrogen 2.846 N/A THR 156.A OG1 PRO 153.A O no hydrogen 3.071 N/A GLU 158.A N LEU 154.A O no hydrogen 3.081 N/A TYR 161.A N PRO 136.A O no hydrogen 2.731 N/A SER 162.A N PRO 136.A O no hydrogen 2.947 N/A SER 162.A OG TYR 77.A OH no hydrogen 3.257 N/A SER 162.A OG SER 132.A O no hydrogen 3.215 N/A SER 162.A OG SER 144.A OG no hydrogen 2.877 N/A LEU 165.A N TYR 161.A O no hydrogen 3.027 N/A LEU 165.A N SER 162.A O no hydrogen 3.210 N/A ALA 166.A N SER 162.A O no hydrogen 3.017 N/A ILE 167.A N MET 163.A O no hydrogen 3.159 N/A PHE 168.A N ASP 164.A O no hydrogen 3.131 N/A ALA 169.A N LEU 165.A O no hydrogen 2.751 N/A VAL 170.A N ALA 166.A O no hydrogen 2.837 N/A HIS 171.A N ILE 167.A O no hydrogen 3.047 N/A VAL 172.A N PHE 168.A O no hydrogen 3.003 N/A VAL 172.A N ALA 169.A O no hydrogen 2.893 N/A SER 173.A N ALA 169.A O no hydrogen 2.978 N/A SER 173.A OG PHE 84.A O no hydrogen 3.324 N/A GLY 174.A N VAL 170.A O no hydrogen 3.046 N/A ALA 175.A N HIS 171.A O no hydrogen 3.279 N/A ALA 175.A N VAL 172.A O no hydrogen 3.028 N/A SER 176.A N VAL 172.A O no hydrogen 3.111 N/A SER 176.A OG SER 118.A O no hydrogen 2.939 N/A SER 177.A N SER 173.A O no hydrogen 2.890 N/A SER 177.A OG SER 173.A O no hydrogen 3.399 N/A ILE 178.A N GLY 174.A O no hydrogen 2.952 N/A LEU 179.A N ALA 175.A O no hydrogen 2.900 N/A GLY 180.A N SER 176.A O no hydrogen 2.822 N/A ALA 181.A N SER 177.A O no hydrogen 2.974 N/A ILE 182.A N ILE 178.A O no hydrogen 3.055 N/A ILE 182.A N LEU 179.A O no hydrogen 3.255 N/A ASN 183.A N LEU 179.A O no hydrogen 3.443 N/A ASN 183.A ND2 PHE 111.A O no hydrogen 2.819 N/A ILE 184.A N GLY 180.A O no hydrogen 2.926 N/A ILE 185.A N ALA 181.A O no hydrogen 2.966 N/A ILE 185.A N ILE 182.A O no hydrogen 3.210 N/A THR 186.A N ILE 182.A O no hydrogen 2.953 N/A THR 186.A N ASN 183.A O no hydrogen 2.996 N/A THR 186.A OG1 ILE 182.A O no hydrogen 2.901 N/A THR 187.A N ASN 183.A O no hydrogen 2.896 N/A THR 187.A OG1 ASN 183.A O no hydrogen 3.106 N/A PHE 188.A N ILE 184.A O no hydrogen 3.329 N/A LEU 189.A N ILE 185.A O no hydrogen 3.187 N/A ASN 190.A N THR 186.A O no hydrogen 2.811 N/A ASN 190.A N THR 187.A O no hydrogen 2.964 N/A MET 191.A N THR 187.A O no hydrogen 2.774 N/A ARG 192.A NE PHE 188.A O no hydrogen 2.977 N/A ARG 192.A NH1 MET 196.A O no hydrogen 3.122 N/A ARG 192.A NH2 PHE 188.A O no hydrogen 3.522 N/A ARG 192.A NH2 LEU 189.A O no hydrogen 2.865 N/A ALA 193.A N ILE 104.A O no hydrogen 3.007 N/A MET 196.A N ALA 193.A O no hydrogen 3.074 N/A LYS 200.A N THR 197.A O no hydrogen 2.749 N/A VAL 201.A N THR 197.A O no hydrogen 3.153 N/A PHE 204.A N HIS 276.A NE2 no hydrogen 3.045 N/A TRP 206.A N PRO 202.A O no hydrogen 3.133 N/A TRP 206.A NE1 TYR 289.A OH no hydrogen 3.069 N/A SER 207.A N LEU 203.A O no hydrogen 2.656 N/A SER 207.A OG PHE 204.A O no hydrogen 2.870 N/A VAL 208.A N PHE 204.A O no hydrogen 3.296 N/A PHE 209.A N ALA 205.A O no hydrogen 3.173 N/A PHE 209.A N TRP 206.A O no hydrogen 2.771 N/A ILE 210.A N TRP 206.A O no hydrogen 2.905 N/A THR 211.A N SER 207.A O no hydrogen 3.048 N/A THR 211.A OG1 SER 207.A O no hydrogen 2.727 N/A ALA 212.A N VAL 208.A O no hydrogen 3.147 N/A TRP 213.A N ILE 210.A O no hydrogen 2.827 N/A LEU 214.A N ILE 210.A O no hydrogen 3.062 N/A ILE 215.A N THR 211.A O no hydrogen 2.945 N/A LEU 216.A N ALA 212.A O no hydrogen 3.079 N/A LEU 217.A N TRP 213.A O no hydrogen 3.347 N/A LEU 217.A N LEU 214.A O no hydrogen 3.340 N/A SER 218.A N LEU 214.A O no hydrogen 3.018 N/A SER 218.A OG LEU 214.A O no hydrogen 3.289 N/A LEU 219.A N ILE 215.A O no hydrogen 3.039 N/A VAL 221.A N SER 218.A O no hydrogen 3.048 N/A LEU 222.A N SER 218.A O no hydrogen 3.225 N/A ALA 223.A N LEU 219.A O no hydrogen 2.918 N/A GLY 224.A N PRO 220.A O no hydrogen 3.118 N/A ALA 225.A N VAL 221.A O no hydrogen 3.087 N/A ILE 226.A N LEU 222.A O no hydrogen 2.963 N/A THR 227.A N ALA 223.A O no hydrogen 3.030 N/A MET 228.A N GLY 224.A O no hydrogen 2.859 N/A LEU 229.A N ALA 225.A O no hydrogen 3.195 N/A LEU 230.A N ILE 226.A O no hydrogen 3.129 N/A MET 231.A N THR 227.A O no hydrogen 2.994 N/A ASP 232.A N MET 228.A O no hydrogen 3.074 N/A ARG 233.A N LEU 229.A O no hydrogen 3.077 N/A ARG 233.A NE SER 155.A O no hydrogen 2.879 N/A ARG 233.A NH1 ASP 164.A OD1 no hydrogen 2.780 N/A ASN 234.A N MET 231.A O no hydrogen 2.900 N/A ASN 234.A ND2 ASP 164.A OD1 no hydrogen 2.773 N/A ASN 234.A ND2 LEU 230.A O no hydrogen 2.641 N/A PHE 235.A N MET 231.A O no hydrogen 2.706 N/A GLY 236.A N MET 231.A O no hydrogen 3.254 N/A THR 237.A OG1 ASP 232.A OD1 no hydrogen 3.082 N/A PHE 239.A N ASP 232.A OD1 no hydrogen 2.595 N/A PHE 240.A N ASP 232.A OD2 no hydrogen 3.008 N/A GLY 244.A N ASP 241.A O no hydrogen 3.088 N/A GLY 245.A N PRO 242.A O no hydrogen 2.693 N/A GLY 246.A N ASP 241.A O no hydrogen 2.963 N/A ASP 247.A N PHE 239.A O no hydrogen 3.338 N/A VAL 249.A N ASP 247.A OD1 no hydrogen 3.166 N/A LEU 250.A N ASP 247.A O no hydrogen 3.224 N/A TYR 251.A OH VAL 149.A O no hydrogen 2.505 N/A HIS 253.A N VAL 249.A O no hydrogen 3.286 N/A HIS 253.A N LEU 250.A O no hydrogen 3.068 N/A ILE 254.A N LEU 250.A O no hydrogen 3.227 N/A LEU 255.A N TYR 251.A O no hydrogen 2.651 N/A TRP 256.A N GLN 252.A O no hydrogen 2.757 N/A TRP 256.A NE1 TYR 151.A OH no hydrogen 2.800 N/A PHE 257.A N HIS 253.A O no hydrogen 2.772 N/A PHE 258.A N LEU 255.A O no hydrogen 2.997 N/A GLY 259.A N LEU 255.A O no hydrogen 3.039 N/A GLY 259.A N TRP 256.A O no hydrogen 2.931 N/A HIS 260.A N TRP 256.A O no hydrogen 3.060 N/A GLU 262.A N PHE 258.A O no hydrogen 2.897 N/A VAL 263.A N HIS 260.A O no hydrogen 2.714 N/A TYR 264.A N HIS 260.A O no hydrogen 3.379 N/A TYR 264.A N PRO 261.A O no hydrogen 2.510 N/A ILE 265.A N PRO 261.A O no hydrogen 2.842 N/A ILE 266.A N GLU 262.A O no hydrogen 3.088 N/A ILE 267.A N TYR 264.A O no hydrogen 2.843 N/A PHE 271.A N ILE 267.A O no hydrogen 2.834 N/A GLY 272.A N LEU 268.A O no hydrogen 2.879 N/A ILE 273.A N PRO 269.A O no hydrogen 3.204 N/A ILE 273.A N GLY 270.A O no hydrogen 3.082 N/A ILE 274.A N GLY 270.A O no hydrogen 3.017 N/A SER 275.A N PHE 271.A O no hydrogen 3.238 N/A HIS 276.A N GLY 272.A O no hydrogen 3.515 N/A VAL 277.A N ILE 273.A O no hydrogen 2.992 N/A ILE 278.A N ILE 274.A O no hydrogen 2.895 N/A SER 279.A N SER 275.A O no hydrogen 2.967 N/A SER 279.A OG LYS 284.A O no hydrogen 3.161 N/A THR 280.A N HIS 276.A O no hydrogen 3.130 N/A THR 280.A OG1 HIS 276.A O no hydrogen 3.405 N/A THR 280.A OG1 TYR 414.A OH no hydrogen 3.139 N/A PHE 281.A N VAL 277.A O no hydrogen 3.228 N/A ALA 282.A N ILE 278.A O no hydrogen 2.932 N/A ALA 282.A N SER 279.A O no hydrogen 3.124 N/A LYS 283.A N SER 279.A O no hydrogen 2.830 N/A LYS 284.A NZ THR 345.A O no hydrogen 2.870 N/A LYS 284.A NZ TRP 347.A O no hydrogen 2.602 N/A PHE 287.A N THR 345.A OG1 no hydrogen 2.915 N/A TYR 289.A OH LEU 198.A O no hydrogen 3.360 N/A TYR 289.A OH VAL 201.A O no hydrogen 2.599 N/A MET 292.A N GLY 288.A O no hydrogen 2.992 N/A MET 292.A N TYR 289.A O no hydrogen 2.751 N/A VAL 293.A N TYR 289.A O no hydrogen 3.038 N/A LEU 294.A N LEU 290.A O no hydrogen 2.906 N/A ALA 295.A N PRO 291.A O no hydrogen 2.814 N/A MET 296.A N MET 292.A O no hydrogen 3.285 N/A ALA 297.A N VAL 293.A O no hydrogen 3.137 N/A ALA 298.A N LEU 294.A O no hydrogen 2.958 N/A ILE 299.A N ALA 295.A O no hydrogen 2.932 N/A GLY 300.A N MET 296.A O no hydrogen 2.911 N/A ILE 301.A N ALA 297.A O no hydrogen 2.951 N/A LEU 302.A N ALA 298.A O no hydrogen 2.905 N/A GLY 303.A N ILE 299.A O no hydrogen 2.906 N/A PHE 304.A N ILE 301.A O no hydrogen 3.153 N/A VAL 305.A N LEU 302.A O no hydrogen 2.961 N/A HIS 309.A ND1 THR 328.A OG1 no hydrogen 2.868 N/A HIS 309.A NE2 HIS 310.A NE2 no hydrogen 2.974 N/A HIS 310.A N TRP 307.A O no hydrogen 3.214 N/A MET 311.A N ALA 308.A O no hydrogen 3.171 N/A TYR 312.A OH SER 378.A O no hydrogen 2.494 N/A ALA 314.A N MET 311.A O no hydrogen 3.212 N/A SER 317.A N GLN 320.A OE1 no hydrogen 3.052 N/A GLN 320.A N SER 317.A OG no hydrogen 3.231 N/A GLN 321.A N SER 317.A O no hydrogen 2.911 N/A GLN 321.A NE2 MET 316.A O no hydrogen 2.822 N/A GLN 321.A NE2 SER 317.A O no hydrogen 3.525 N/A ALA 322.A N LEU 318.A O no hydrogen 2.825 N/A TYR 323.A N THR 319.A O no hydrogen 2.797 N/A TYR 323.A OH VAL 305.A O no hydrogen 3.150 N/A PHE 324.A N GLN 320.A O no hydrogen 3.076 N/A MET 325.A N GLN 321.A O no hydrogen 2.925 N/A LEU 326.A N ALA 322.A O no hydrogen 3.172 N/A LEU 326.A N TYR 323.A O no hydrogen 2.822 N/A ALA 327.A N TYR 323.A O no hydrogen 2.900 N/A THR 328.A N PHE 324.A O no hydrogen 3.225 N/A THR 328.A OG1 HIS 309.A ND1 no hydrogen 2.868 N/A THR 328.A OG1 PHE 324.A O no hydrogen 2.744 N/A MET 329.A N MET 325.A O no hydrogen 3.171 N/A THR 330.A N ALA 327.A O no hydrogen 3.315 N/A THR 330.A OG1 ALA 327.A O no hydrogen 2.639 N/A ILE 331.A N THR 328.A O no hydrogen 3.295 N/A ALA 332.A N MET 329.A O no hydrogen 3.112 N/A VAL 333.A N THR 330.A O no hydrogen 2.760 N/A THR 335.A OG1 ILE 331.A O no hydrogen 2.912 N/A GLY 336.A N ALA 332.A O no hydrogen 3.234 N/A ILE 337.A N VAL 333.A O no hydrogen 3.080 N/A LYS 338.A N PRO 334.A O no hydrogen 3.287 N/A LYS 338.A NZ MET 292.A O no hydrogen 3.521 N/A VAL 339.A N THR 335.A O no hydrogen 2.902 N/A PHE 340.A N GLY 336.A O no hydrogen 2.836 N/A SER 341.A N ILE 337.A O no hydrogen 2.713 N/A SER 341.A OG ILE 337.A O no hydrogen 2.967 N/A TRP 342.A N LYS 338.A O no hydrogen 2.887 N/A TRP 342.A NE1 SER 275.A OG no hydrogen 2.783 N/A ILE 343.A N VAL 339.A O no hydrogen 3.054 N/A ALA 344.A N PHE 340.A O no hydrogen 2.694 N/A THR 345.A N SER 341.A O no hydrogen 2.645 N/A THR 345.A OG1 SER 341.A O no hydrogen 3.293 N/A MET 346.A N TRP 342.A O no hydrogen 3.213 N/A TRP 347.A N ALA 344.A O no hydrogen 2.831 N/A GLY 349.A N MET 346.A O no hydrogen 3.176 N/A SER 350.A N ALA 282.A O no hydrogen 2.667 N/A GLU 352.A N PHE 281.A O no hydrogen 3.385 N/A THR 355.A N GLU 426.A OE2 no hydrogen 3.128 N/A THR 355.A OG1 GLU 426.A OE2 no hydrogen 3.218 N/A MET 357.A N LYS 354.A O no hydrogen 2.536 N/A LEU 358.A N LYS 354.A O no hydrogen 2.937 N/A TRP 359.A N THR 355.A O no hydrogen 3.017 N/A ALA 360.A N PRO 356.A O no hydrogen 3.214 N/A PHE 361.A N MET 357.A O no hydrogen 2.853 N/A GLY 362.A N LEU 358.A O no hydrogen 3.041 N/A PHE 363.A N TRP 359.A O no hydrogen 3.033 N/A LEU 364.A N ALA 360.A O no hydrogen 3.036 N/A LEU 364.A N PHE 361.A O no hydrogen 2.931 N/A PHE 365.A N PHE 361.A O no hydrogen 3.310 N/A LEU 366.A N GLY 362.A O no hydrogen 3.021 N/A PHE 367.A N PHE 363.A O no hydrogen 2.908 N/A THR 368.A N PHE 365.A O no hydrogen 2.622 N/A THR 368.A OG1 LEU 364.A O no hydrogen 2.884 N/A VAL 369.A N PHE 365.A O no hydrogen 2.999 N/A GLY 370.A N LEU 366.A O no hydrogen 3.125 N/A GLY 371.A N PHE 367.A O no hydrogen 3.015 N/A VAL 372.A N THR 368.A O no hydrogen 3.078 N/A THR 373.A N VAL 369.A O no hydrogen 3.289 N/A THR 373.A OG1 VAL 369.A O no hydrogen 3.534 N/A GLY 374.A N GLY 370.A O no hydrogen 3.104 N/A VAL 376.A N VAL 372.A O no hydrogen 3.003 N/A LEU 377.A N THR 373.A O no hydrogen 2.778 N/A SER 378.A N VAL 375.A O no hydrogen 2.951 N/A SER 378.A OG VAL 375.A O no hydrogen 2.276 N/A GLN 379.A N VAL 376.A O no hydrogen 2.878 N/A GLN 379.A NE2 VAL 375.A O no hydrogen 3.650 N/A GLN 379.A NE2 SER 378.A OG no hydrogen 2.815 N/A LEU 382.A N GLN 379.A O no hydrogen 2.649 N/A ASP 383.A N GLN 379.A O no hydrogen 2.752 N/A ARG 384.A N ALA 380.A O no hydrogen 2.828 N/A ARG 384.A NH1 TYR 312.A O no hydrogen 3.181 N/A ARG 384.A NH1 GLN 321.A OE1 no hydrogen 3.295 N/A ARG 384.A NH2 GLN 321.A OE1 no hydrogen 2.544 N/A TYR 386.A N LEU 382.A O no hydrogen 3.148 N/A HIS 387.A N ASP 383.A O no hydrogen 2.578 N/A THR 389.A N TYR 386.A O no hydrogen 2.850 N/A THR 389.A OG1 TYR 386.A O no hydrogen 2.752 N/A TYR 390.A N MET 455.A O no hydrogen 3.206 N/A TYR 391.A N THR 389.A OG1 no hydrogen 3.088 N/A VAL 392.A N THR 389.A O no hydrogen 3.036 N/A ALA 394.A N TYR 390.A O no hydrogen 2.889 N/A HIS 395.A N TYR 391.A O no hydrogen 3.049 N/A HIS 395.A ND1 GLY 370.A O no hydrogen 2.873 N/A PHE 396.A N VAL 392.A O no hydrogen 3.065 N/A HIS 397.A N VAL 393.A O no hydrogen 3.111 N/A HIS 397.A ND1 VAL 393.A O no hydrogen 2.972 N/A TYR 398.A N ALA 394.A O no hydrogen 2.934 N/A TYR 398.A OH ASN 441.A OD1 no hydrogen 2.542 N/A VAL 399.A N HIS 395.A O no hydrogen 3.213 N/A MET 400.A N PHE 396.A O no hydrogen 2.918 N/A MET 400.A N HIS 397.A O no hydrogen 3.163 N/A SER 401.A N HIS 397.A O no hydrogen 2.584 N/A LEU 402.A N HIS 397.A O no hydrogen 3.023 N/A ALA 404.A N VAL 399.A O no hydrogen 3.036 N/A GLY 407.A N GLY 403.A O no hydrogen 3.200 N/A ILE 408.A N ALA 404.A O no hydrogen 3.100 N/A PHE 409.A N VAL 405.A O no hydrogen 2.925 N/A ALA 410.A N PHE 406.A O no hydrogen 2.871 N/A GLY 411.A N GLY 407.A O no hydrogen 2.806 N/A VAL 412.A N ILE 408.A O no hydrogen 2.922 N/A TYR 413.A N PHE 409.A O no hydrogen 2.864 N/A TYR 413.A OH HIS 432.A ND1 no hydrogen 2.680 N/A TYR 414.A N ALA 410.A O no hydrogen 3.116 N/A TYR 414.A N GLY 411.A O no hydrogen 3.286 N/A TYR 414.A OH THR 280.A OG1 no hydrogen 3.139 N/A TRP 415.A N GLY 411.A O no hydrogen 2.980 N/A TRP 415.A NE1 GLU 515.A OE2 no hydrogen 2.982 N/A LYS 418.A NZ PRO 504.A O no hydrogen 2.968 N/A LYS 418.A NZ GLU 515.A O no hydrogen 3.191 N/A LYS 418.A NZ LEU 518.A O no hydrogen 3.170 N/A LYS 418.A NZ SER 520.A OG no hydrogen 2.453 N/A MET 419.A N TRP 415.A O no hydrogen 2.894 N/A SER 420.A N ILE 416.A O no hydrogen 2.647 N/A SER 420.A OG ILE 416.A O no hydrogen 2.585 N/A GLY 421.A N GLY 417.A O no hydrogen 2.779 N/A ARG 422.A N SER 420.A OG no hydrogen 3.033 N/A ARG 422.A NE GLY 498.A O no hydrogen 2.792 N/A ARG 422.A NH2 GLY 498.A O no hydrogen 3.166 N/A GLN 423.A N LYS 499.A O no hydrogen 3.219 N/A TYR 424.A OH GLU 426.A OE1 no hydrogen 2.304 N/A ALA 428.A N PRO 425.A O no hydrogen 2.962 N/A GLY 429.A N PRO 425.A O no hydrogen 3.072 N/A GLN 430.A N GLU 426.A O no hydrogen 3.104 N/A GLN 430.A N TRP 427.A O no hydrogen 3.283 N/A GLN 430.A NE2 GLU 426.A OE2 no hydrogen 2.666 N/A LEU 431.A N TRP 427.A O no hydrogen 3.153 N/A HIS 432.A N ALA 428.A O no hydrogen 2.939 N/A HIS 432.A ND1 TYR 413.A OH no hydrogen 2.680 N/A PHE 433.A N GLY 429.A O no hydrogen 3.054 N/A TRP 434.A N GLN 430.A O no hydrogen 3.057 N/A MET 435.A N LEU 431.A O no hydrogen 2.863 N/A MET 436.A N HIS 432.A O no hydrogen 2.998 N/A ILE 438.A N TRP 434.A O no hydrogen 3.024 N/A GLY 439.A N MET 435.A O no hydrogen 2.833 N/A SER 440.A N MET 436.A O no hydrogen 3.076 N/A ASN 441.A N ILE 438.A O no hydrogen 3.371 N/A ASN 441.A ND2 PHE 437.A O no hydrogen 2.845 N/A LEU 442.A N ILE 438.A O no hydrogen 3.228 N/A ILE 443.A N GLY 439.A O no hydrogen 3.032 N/A PHE 444.A N SER 440.A O no hydrogen 3.198 N/A PHE 445.A N ASN 441.A O no hydrogen 2.816 N/A GLN 447.A N PHE 444.A O no hydrogen 2.955 N/A GLN 447.A NE2 SER 473.A OG no hydrogen 3.367 N/A HIS 448.A N PHE 445.A O no hydrogen 3.111 N/A HIS 448.A ND1 PHE 445.A O no hydrogen 2.980 N/A LEU 450.A N PRO 446.A O no hydrogen 3.101 N/A GLY 451.A N GLN 447.A O no hydrogen 3.371 N/A ARG 452.A N HIS 448.A O no hydrogen 2.930 N/A ARG 452.A NE TYR 386.A OH no hydrogen 3.081 N/A ARG 452.A NH2 TYR 386.A OH no hydrogen 2.989 N/A GLN 453.A N PHE 449.A O no hydrogen 2.868 N/A GLY 454.A N GLY 451.A O no hydrogen 3.106 N/A MET 455.A N LEU 450.A O no hydrogen 3.033 N/A ARG 457.A N ASP 388.A O no hydrogen 2.900 N/A TYR 462.A N ASP 461.A OD1 no hydrogen 2.654 N/A TYR 462.A OH LEU 41.A O no hydrogen 2.774 N/A PHE 466.A N PRO 463.A O no hydrogen 3.234 N/A ASN 471.A N ALA 467.A O no hydrogen 2.867 N/A ILE 472.A N TYR 468.A O no hydrogen 3.451 N/A SER 473.A N TRP 469.A O no hydrogen 2.941 N/A SER 473.A OG ILE 443.A O no hydrogen 2.911 N/A SER 474.A N ASN 470.A O no hydrogen 3.139 N/A SER 474.A N ASN 471.A O no hydrogen 3.094 N/A SER 474.A OG ARG 38.A O no hydrogen 2.514 N/A SER 474.A OG ASN 470.A O no hydrogen 3.355 N/A ILE 475.A N ASN 471.A O no hydrogen 3.067 N/A GLY 476.A N ILE 472.A O no hydrogen 3.055 N/A ALA 477.A N SER 474.A O no hydrogen 2.839 N/A TYR 478.A N ILE 475.A O no hydrogen 2.411 N/A TYR 478.A OH ARG 38.A O no hydrogen 3.378 N/A TYR 478.A OH GLN 42.A OE1 no hydrogen 2.519 N/A ILE 479.A N ILE 475.A O no hydrogen 3.068 N/A SER 480.A N GLY 476.A O no hydrogen 3.029 N/A SER 480.A OG GLY 476.A O no hydrogen 2.617 N/A PHE 481.A N ALA 477.A O no hydrogen 3.197 N/A PHE 481.A N TYR 478.A O no hydrogen 2.874 N/A ALA 482.A N TYR 478.A O no hydrogen 3.007 N/A SER 483.A N ILE 479.A O no hydrogen 3.151 N/A SER 483.A OG SER 480.A O no hydrogen 3.045 N/A PHE 484.A N PHE 481.A O no hydrogen 2.884 N/A LEU 485.A N PHE 481.A O no hydrogen 3.056 N/A LEU 485.A N ALA 482.A O no hydrogen 3.070 N/A PHE 486.A N ALA 482.A O no hydrogen 2.996 N/A PHE 487.A N SER 483.A O no hydrogen 3.013 N/A ILE 488.A N PHE 484.A O no hydrogen 3.089 N/A GLY 489.A N LEU 485.A O no hydrogen 2.827 N/A ILE 490.A N PHE 486.A O no hydrogen 2.803 N/A VAL 491.A N PHE 487.A O no hydrogen 2.865 N/A PHE 492.A N ILE 488.A O no hydrogen 2.954 N/A TYR 493.A N GLY 489.A O no hydrogen 2.869 N/A THR 494.A N ILE 490.A O no hydrogen 2.912 N/A THR 494.A OG1 ILE 490.A O no hydrogen 3.070 N/A LEU 495.A N VAL 491.A O no hydrogen 3.045 N/A PHE 496.A N TYR 493.A O no hydrogen 3.157 N/A ALA 497.A N TYR 493.A O no hydrogen 2.832 N/A ARG 500.A NH1.A SER 520.A O no hydrogen 2.854 N/A ARG 500.A NH2.A SER 520.A O no hydrogen 3.024 N/A VAL 501.A N GLY 421.A O no hydrogen 2.675 N/A ASN 505.A ND2 ASN 508.A O no hydrogen 2.908 N/A TYR 506.A OH TYR 414.A O no hydrogen 2.930 N/A TRP 507.A N ASN 505.A OD1 no hydrogen 2.831 N/A TRP 507.A NE1 TYR 414.A O no hydrogen 3.079 N/A ASN 508.A N ASN 505.A OD1 no hydrogen 3.084 N/A ASN 508.A ND2 THR 280.A O no hydrogen 2.897 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 2.566 N/A HIS 510.A N ASN 508.A OD1 no hydrogen 2.892 N/A ALA 511.A N ASN 508.A O no hydrogen 3.024 N/A ALA 511.A N ASN 508.A OD1 no hydrogen 3.301 N/A THR 513.A OG1 GLU 515.A OE1 no hydrogen 2.734 N/A THR 513.A OG1 GLU 515.A OE2 no hydrogen 3.494 N/A GLU 515.A N GLU 515.A OE1 no hydrogen 2.926 N/A TRP 516.A N THR 513.A O no hydrogen 2.971 N/A THR 517.A N LEU 514.A O no hydrogen 2.802 N/A THR 517.A OG1 LEU 514.A O no hydrogen 2.697 N/A LEU 518.A N GLU 515.A O no hydrogen 3.310 N/A SER 520.A N ASN 502.A O no hydrogen 3.069 N/A SER 520.A OG VAL 503.A O no hydrogen 2.908 N/A