Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j5t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ALA 1.A O no hydrogen 2.960 N/A GLU 6.A N GLU 2.A O no hydrogen 3.097 N/A TYR 7.A N PHE 3.A O no hydrogen 2.941 N/A GLN 8.A N MET 4.A O no hydrogen 2.753 N/A GLN 8.A NE2 ASN 12.A OD1 no hydrogen 3.277 N/A GLN 8.A NE2 GLU 407.A OE1 no hydrogen 3.012 N/A GLN 8.A NE2 GLU 407.A OE2 no hydrogen 3.489 N/A LYS 9.A N GLU 5.A O no hydrogen 2.880 N/A PHE 10.A N GLU 6.A O no hydrogen 3.263 N/A THR 11.A N TYR 7.A O no hydrogen 2.914 N/A THR 11.A OG1 TYR 7.A O no hydrogen 2.918 N/A ASN 12.A N GLN 8.A O no hydrogen 2.908 N/A GLU 13.A N LYS 9.A O no hydrogen 3.088 N/A SER 14.A N.A PHE 10.A O no hydrogen 2.974 N/A SER 14.A N.B PHE 10.A O no hydrogen 2.993 N/A SER 14.A OG.B THR 11.A O no hydrogen 3.044 N/A LEU 15.A N THR 11.A O no hydrogen 3.051 N/A TYR 20.A N ALA 18.A O no hydrogen 2.704 N/A TYR 20.A OH LEU 15.A O no hydrogen 2.760 N/A ARG 21.A N GLY 27.A O no hydrogen 3.203 N/A ARG 21.A NH1 MET 40.A O no hydrogen 3.062 N/A ARG 21.A NH1 TYR 128.A OH no hydrogen 2.907 N/A ARG 21.A NH2 TYR 128.A OH no hydrogen 3.349 N/A ARG 21.A NH2 GLU 432.A OE2 no hydrogen 3.195 N/A SER 22.A OG GLY 335.A O no hydrogen 2.857 N/A ASN 23.A ND2 GLU 432.A OE2 no hydrogen 2.966 N/A CYS 24.A N ARG 21.A O no hydrogen 2.890 N/A TYR 25.A N HIS 58.A O no hydrogen 3.080 N/A TYR 25.A OH ASP 64.A OD2 no hydrogen 2.753 N/A MET 28.A N MET 40.A O no hydrogen 2.777 N/A ARG 29.A NH2 VAL 33.A O no hydrogen 3.320 N/A ARG 31.A N LEU 16.A O no hydrogen 2.786 N/A ARG 31.A NH1 GLU 407.A OE2 no hydrogen 2.847 N/A ARG 31.A NH2 GLU 407.A OE2 no hydrogen 3.164 N/A TYR 32.A OH SER 411.A OG no hydrogen 2.984 N/A GLU 35.A N GLU 161.A OE2 no hydrogen 2.799 N/A SER 36.A N GLU 161.A OE2 no hydrogen 2.927 N/A SER 36.A OG SER 159.A OG no hydrogen 3.251 N/A ILE 39.A N SER 130.A O no hydrogen 2.741 N/A MET 40.A N MET 28.A O no hydrogen 2.993 N/A GLY 41.A N TYR 128.A O no hydrogen 3.120 N/A ILE 42.A N PHE 26.A O no hydrogen 3.071 N/A MET 43.A N VAL 126.A O no hydrogen 2.777 N/A TRP 44.A N ARG 57.A O no hydrogen 3.412 N/A TRP 44.A NE1 ASP 86.A OD2 no hydrogen 3.003 N/A PHE 45.A N SER 124.A O no hydrogen 3.123 N/A SER 47.A N THR 122.A OG1 no hydrogen 2.963 N/A SER 47.A OG THR 122.A OG1 no hydrogen 2.588 N/A LEU 48.A N ASN 46.A OD1 no hydrogen 3.165 N/A SER 49.A OG ASN 46.A O no hydrogen 3.570 N/A SER 49.A OG ASP 51.A OD1 no hydrogen 3.519 N/A GLY 52.A N SER 49.A O no hydrogen 3.360 N/A HIS 54.A N ASP 51.A O no hydrogen 3.313 N/A SER 55.A N.A GLY 52.A O no hydrogen 3.037 N/A SER 55.A N.B GLY 52.A O no hydrogen 3.011 N/A SER 55.A OG.B GLY 52.A O no hydrogen 2.685 N/A SER 55.A OG.B ASN 89.A OD1 no hydrogen 3.145 N/A ARG 57.A N TRP 44.A O no hydrogen 2.928 N/A ARG 57.A NE ASP 86.A OD2 no hydrogen 2.877 N/A ARG 57.A NH2 ASP 86.A OD1 no hydrogen 2.947 N/A HIS 58.A NE2 TYR 128.A OH no hydrogen 2.552 N/A ALA 60.A N ASN 23.A O no hydrogen 2.858 N/A ASP 64.A N THR 61.A O no hydrogen 3.173 N/A LYS 65.A N PRO 62.A O no hydrogen 3.245 N/A GLN 67.A NE2 GLU 87.A OE2 no hydrogen 2.647 N/A LYS 68.A N ILE 85.A O no hydrogen 3.482 N/A LYS 68.A NZ GLU 327.A OE2 no hydrogen 2.708 N/A GLY 70.A N VAL 83.A O no hydrogen 3.118 N/A TRP 71.A N ASN 331.A OD1 no hydrogen 2.922 N/A GLU 72.A N LYS 81.A O no hydrogen 3.039 N/A TYR 74.A N SER 330.A OG no hydrogen 3.096 N/A ASP 75.A N GLY 79.A O no hydrogen 3.000 N/A ARG 77.A N ASP 75.A OD1 no hydrogen 2.932 N/A ARG 77.A NE ASP 401.A OD2 no hydrogen 2.653 N/A ARG 77.A NH2 ASP 401.A OD1 no hydrogen 3.092 N/A ARG 77.A NH2 ASP 401.A OD2 no hydrogen 3.524 N/A ILE 78.A N ASP 75.A O no hydrogen 2.804 N/A GLY 79.A N ASP 75.A O no hydrogen 2.834 N/A GLY 80.A N PHE 97.A O no hydrogen 2.875 N/A LYS 81.A N VAL 73.A O no hydrogen 2.866 N/A LYS 81.A NZ GLU 72.A OE1 no hydrogen 3.251 N/A GLU 82.A N VAL 95.A O no hydrogen 2.758 N/A VAL 83.A N GLY 70.A O no hydrogen 3.108 N/A PHE 84.A N LEU 93.A O no hydrogen 2.750 N/A ILE 85.A N LYS 68.A O no hydrogen 2.702 N/A ASP 86.A N LEU 91.A O no hydrogen 2.987 N/A LYS 88.A NZ SER 55.A OG.A no hydrogen 2.648 N/A ASN 89.A ND2 SER 55.A O.A no hydrogen 3.228 N/A ASN 89.A ND2 SER 55.A O.B no hydrogen 3.247 N/A ASN 89.A ND2 ASP 86.A OD2 no hydrogen 2.818 N/A ASN 90.A N GLU 87.A O no hydrogen 3.015 N/A ASN 90.A ND2 ASP 116.A O no hydrogen 3.081 N/A ASN 90.A ND2 SER 121.A OG no hydrogen 2.869 N/A LEU 91.A N ASP 86.A O no hydrogen 3.009 N/A ASN 92.A N GLU 113.A O no hydrogen 2.797 N/A LEU 93.A N PHE 84.A O no hydrogen 2.976 N/A THR 94.A N GLN 111.A O no hydrogen 2.672 N/A VAL 95.A N GLU 82.A O no hydrogen 2.707 N/A TYR 96.A N ARG 109.A O no hydrogen 2.868 N/A PHE 97.A N GLY 80.A O no hydrogen 2.908 N/A VAL 98.A N SER 107.A O no hydrogen 2.968 N/A LYS 99.A NZ SER 14.A O.A no hydrogen 2.868 N/A LYS 99.A NZ SER 14.A O.B no hydrogen 2.857 N/A LYS 99.A NZ TRP 17.A O no hydrogen 2.935 N/A LYS 99.A NZ PRO 76.A O no hydrogen 2.720 N/A SER 100.A N ASN 105.A O no hydrogen 2.944 N/A SER 100.A OG ASN 102.A OD1 no hydrogen 2.669 N/A ASN 102.A N GLN 279.A OE1 no hydrogen 2.877 N/A GLY 103.A N SER 100.A O no hydrogen 2.699 N/A GLU 104.A N ASN 102.A OD1 no hydrogen 3.185 N/A ASN 105.A N SER 100.A OG no hydrogen 3.143 N/A ASN 105.A ND2 THR 277.A OG1 no hydrogen 2.700 N/A ASN 105.A ND2 GLN 279.A O no hydrogen 2.866 N/A TRP 106.A N TYR 272.A O no hydrogen 3.044 N/A SER 107.A N VAL 98.A O no hydrogen 2.901 N/A SER 107.A OG ILE 270.A O no hydrogen 3.332 N/A SER 107.A OG THR 271.A OG1 no hydrogen 2.901 N/A VAL 108.A N ILE 270.A O no hydrogen 2.704 N/A ARG 109.A N TYR 96.A O no hydrogen 2.992 N/A ARG 109.A NE ASP 269.A OD1 no hydrogen 2.968 N/A ARG 109.A NH1 THR 288.A OG1 no hydrogen 2.998 N/A ARG 109.A NH2 ASP 269.A OD2 no hydrogen 3.276 N/A ARG 109.A NH2 ARG 284.A O no hydrogen 3.161 N/A ARG 109.A NH2 THR 288.A OG1 no hydrogen 3.143 N/A VAL 110.A N PHE 268.A O no hydrogen 2.935 N/A GLN 111.A N THR 94.A O no hydrogen 2.757 N/A GLY 112.A N PHE 266.A O no hydrogen 2.958 N/A GLU 113.A N ASN 92.A O no hydrogen 3.027 N/A LEU 115.A N ASN 90.A O no hydrogen 2.852 N/A ASP 116.A N ASN 90.A OD1 no hydrogen 2.738 N/A LYS 118.A N ASP 116.A OD1 no hydrogen 3.497 N/A ARG 119.A N ASP 116.A O no hydrogen 3.310 N/A ARG 119.A NH2 LYS 88.A O no hydrogen 2.851 N/A SER 121.A OG ARG 119.A O no hydrogen 3.010 N/A THR 122.A N ASN 46.A OD1 no hydrogen 2.985 N/A THR 122.A OG1 ASN 46.A OD1 no hydrogen 3.529 N/A THR 122.A OG1 SER 47.A OG no hydrogen 2.588 N/A ALA 123.A N PHE 258.A O no hydrogen 2.978 N/A SER 124.A N PHE 45.A O no hydrogen 2.914 N/A SER 124.A OG THR 257.A OG1 no hydrogen 3.084 N/A VAL 125.A N LYS 256.A O no hydrogen 2.860 N/A VAL 126.A N MET 43.A O no hydrogen 2.754 N/A LEU 127.A N ILE 254.A O no hydrogen 2.772 N/A TYR 128.A N GLY 41.A O no hydrogen 3.060 N/A TYR 128.A OH HIS 58.A NE2 no hydrogen 2.552 N/A PHE 129.A N HIS 252.A O no hydrogen 2.911 N/A SER 130.A N ILE 39.A O no hydrogen 2.799 N/A SER 130.A OG ASN 132.A OD1 no hydrogen 2.611 N/A GLN 131.A N ASN 250.A O no hydrogen 3.170 N/A GLN 131.A NE2 SER 36.A O no hydrogen 3.081 N/A GLN 131.A NE2 ASN 132.A O no hydrogen 2.863 N/A ASN 132.A N PRO 37.A O no hydrogen 2.921 N/A GLY 133.A N ASP 205.A OD1 no hydrogen 3.381 N/A GLY 133.A N ASP 205.A OD2 no hydrogen 3.022 N/A ILE 136.A N GLY 133.A O no hydrogen 2.777 N/A ASP 137.A N GLY 133.A O no hydrogen 2.736 N/A GLY 138.A N GLY 134.A O no hydrogen 2.894 N/A LYS 139.A N ASP 137.A OD1 no hydrogen 2.761 N/A SER 140.A N ASP 137.A OD1 no hydrogen 2.852 N/A SER 140.A OG ASP 137.A OD1 no hydrogen 3.485 N/A SER 140.A OG ASP 137.A OD2 no hydrogen 2.676 N/A SER 141.A N TYR 158.A O no hydrogen 2.923 N/A ALA 143.A N PHE 156.A O no hydrogen 2.886 N/A ILE 145.A N LYS 154.A O no hydrogen 2.860 N/A HIS 147.A ND1 GLY 149.A O no hydrogen 2.938 N/A ASP 148.A N ASP 152.A O no hydrogen 2.958 N/A MET 153.A N VAL 169.A O no hydrogen 2.829 N/A LYS 154.A N GLY 146.A O no hydrogen 2.882 N/A PHE 155.A N LEU 167.A O no hydrogen 2.688 N/A PHE 156.A N ALA 143.A O no hydrogen 2.764 N/A GLY 157.A N TYR 165.A O no hydrogen 2.959 N/A TYR 158.A N SER 141.A O no hydrogen 2.843 N/A SER 159.A N GLY 163.A O no hydrogen 2.970 N/A SER 159.A OG SER 36.A O no hydrogen 2.871 N/A SER 159.A OG SER 36.A OG no hydrogen 3.251 N/A LYS 160.A N SER 140.A OG no hydrogen 3.041 N/A GLU 161.A N SER 36.A OG no hydrogen 3.141 N/A LEU 162.A N SER 159.A OG no hydrogen 2.967 N/A GLY 163.A N SER 159.A O no hydrogen 2.663 N/A TYR 165.A N GLY 157.A O no hydrogen 2.971 N/A TYR 165.A OH GLN 131.A OE1 no hydrogen 2.767 N/A HIS 166.A N ASN 273.A O no hydrogen 2.828 N/A LEU 167.A N PHE 155.A O no hydrogen 3.043 N/A THR 168.A N THR 271.A O no hydrogen 2.877 N/A VAL 169.A N MET 153.A O no hydrogen 2.952 N/A LYS 170.A N ASP 269.A O no hydrogen 2.927 N/A ASP 171.A N ASP 152.A OD1 no hydrogen 3.131 N/A ASN 172.A N GLN 267.A O no hydrogen 2.850 N/A ASN 172.A ND2 GLN 267.A OE1 no hydrogen 2.824 N/A ASN 172.A ND2 ASP 269.A OD2 no hydrogen 3.132 N/A PHE 173.A N GLN 267.A O no hydrogen 3.184 N/A TYR 176.A OH ASP 171.A OD1 no hydrogen 3.329 N/A TYR 176.A OH ASP 171.A OD2 no hydrogen 2.280 N/A TYR 176.A OH THR 196.A OG1 no hydrogen 2.919 N/A PHE 177.A N THR 257.A O no hydrogen 3.013 N/A ASN 179.A ND2 ASP 232.A OD2 no hydrogen 2.591 N/A GLU 181.A N ASN 179.A OD1 no hydrogen 3.273 N/A TYR 182.A N ASN 179.A O no hydrogen 3.250 N/A TYR 182.A OH ASP 232.A OD1 no hydrogen 2.762 N/A TYR 182.A OH ASP 232.A OD2 no hydrogen 3.229 N/A VAL 187.A N SER 191.A O no hydrogen 3.197 N/A SER 191.A N ALA 188.A O no hydrogen 2.936 N/A SER 191.A OG THR 239.A O no hydrogen 3.529 N/A CYS 193.A N SER 236.A OG no hydrogen 3.153 N/A CYS 193.A SG PHE 177.A O no hydrogen 3.440 N/A CYS 193.A SG SER 236.A OG no hydrogen 3.084 N/A SER 194.A N ASP 192.A OD1 no hydrogen 3.147 N/A SER 194.A OG ASP 192.A OD1 no hydrogen 2.798 N/A SER 194.A OG ASP 192.A OD2 no hydrogen 2.897 N/A THR 196.A N ASN 151.A OD1 no hydrogen 2.761 N/A THR 196.A OG1 ASN 151.A OD1 no hydrogen 2.739 N/A SER 197.A N GLN 255.A O no hydrogen 2.916 N/A SER 197.A OG ILE 240.A O no hydrogen 2.732 N/A HIS 198.A NE2 HIS 252.A ND1 no hydrogen 2.943 N/A LEU 199.A N TYR 253.A O no hydrogen 3.032 N/A SER 200.A OG PHE 251.A O no hydrogen 3.532 N/A LEU 201.A N PHE 251.A O no hydrogen 2.967 N/A ILE 203.A N ASN 250.A OD1 no hydrogen 2.999 N/A ASP 205.A N GLU 135.A OE1 no hydrogen 2.898 N/A GLU 207.A N PRO 204.A O no hydrogen 2.855 N/A VAL 208.A N ASP 205.A O no hydrogen 3.308 N/A LYS 210.A N GLU 207.A O no hydrogen 3.004 N/A LYS 210.A NZ GLU 207.A OE1 no hydrogen 2.986 N/A ARG 212.A NE ASP 213.A OD1 no hydrogen 3.350 N/A ARG 212.A NH2 ASP 213.A OD1 no hydrogen 2.661 N/A VAL 214.A N LYS 210.A O no hydrogen 2.981 N/A PHE 215.A N ALA 211.A O no hydrogen 3.112 N/A GLN 216.A N ARG 212.A O no hydrogen 2.935 N/A GLN 216.A NE2 LEU 53.A O no hydrogen 2.987 N/A SER 217.A N ASP 213.A O no hydrogen 2.929 N/A LEU 218.A N VAL 214.A O no hydrogen 2.983 N/A VAL 219.A N PHE 215.A O no hydrogen 2.973 N/A SER 220.A N GLN 216.A O no hydrogen 2.932 N/A SER 220.A OG GLN 216.A O no hydrogen 2.829 N/A ASP 221.A N SER 217.A O no hydrogen 3.128 N/A SER 222.A N LEU 218.A O no hydrogen 3.182 N/A ILE 223.A N VAL 219.A O no hydrogen 2.946 N/A ARG 224.A N SER 220.A O no hydrogen 3.000 N/A ASP 225.A N ASP 221.A O no hydrogen 3.149 N/A ILE 226.A N SER 222.A O no hydrogen 2.948 N/A LEU 227.A N ILE 223.A O no hydrogen 3.022 N/A GLU 228.A N ASP 225.A O no hydrogen 3.347 N/A LEU 233.A N PRO 230.A O no hydrogen 3.188 N/A ILE 234.A N ALA 231.A O no hydrogen 3.273 N/A SER 236.A OG MET 185.A O no hydrogen 2.795 N/A VAL 237.A N LEU 233.A O no hydrogen 3.074 N/A LEU 238.A N ILE 234.A O no hydrogen 2.897 N/A THR 239.A N SER 236.A O no hydrogen 3.229 N/A THR 239.A OG1 PRO 235.A O no hydrogen 2.771 N/A ILE 240.A N GLN 255.A OE1 no hydrogen 2.840 N/A ARG 241.A NE SER 222.A OG no hydrogen 2.660 N/A ARG 241.A NH2 SER 222.A O no hydrogen 3.376 N/A ARG 241.A NH2 SER 222.A OG no hydrogen 3.133 N/A ARG 241.A NH2 ASP 225.A OD2 no hydrogen 3.390 N/A ASN 242.A ND2 PHE 246.A O no hydrogen 3.162 N/A LEU 243.A N ARG 241.A O no hydrogen 2.916 N/A TYR 244.A OH ASP 221.A OD2 no hydrogen 2.812 N/A ASN 245.A N ASN 242.A O no hydrogen 3.435 N/A PHE 246.A N ASN 242.A OD1 no hydrogen 2.723 N/A GLY 249.A N SER 200.A OG no hydrogen 2.855 N/A ASN 250.A N GLN 202.A OE1 no hydrogen 3.460 N/A ASN 250.A ND2 SER 130.A OG no hydrogen 3.007 N/A ASN 250.A ND2 ILE 203.A O no hydrogen 3.040 N/A PHE 251.A N LEU 201.A O no hydrogen 3.031 N/A HIS 252.A N PHE 129.A O no hydrogen 2.724 N/A HIS 252.A ND1 HIS 198.A NE2 no hydrogen 2.943 N/A HIS 252.A NE2 LEU 142.A O no hydrogen 2.898 N/A TYR 253.A N LEU 199.A O no hydrogen 2.784 N/A TYR 253.A OH ALA 211.A O no hydrogen 2.434 N/A ILE 254.A N LEU 127.A O no hydrogen 2.767 N/A GLN 255.A N SER 197.A O no hydrogen 2.821 N/A GLN 255.A NE2 SER 124.A OG no hydrogen 2.804 N/A GLN 255.A NE2 LEU 238.A O no hydrogen 3.126 N/A LYS 256.A N VAL 125.A O no hydrogen 2.939 N/A LYS 256.A NZ ASN 151.A O no hydrogen 2.911 N/A LYS 256.A NZ ASP 171.A OD1 no hydrogen 2.739 N/A LYS 256.A NZ TYR 176.A OH no hydrogen 3.057 N/A LYS 256.A NZ THR 196.A OG1 no hydrogen 2.714 N/A THR 257.A OG1 SER 124.A OG no hydrogen 3.084 N/A PHE 258.A N ALA 123.A O no hydrogen 3.142 N/A ASP 259.A N HIS 175.A O no hydrogen 2.842 N/A LEU 260.A N SER 121.A O no hydrogen 3.094 N/A THR 261.A N ASP 259.A OD1 no hydrogen 3.046 N/A THR 261.A OG1 ASP 259.A OD1 no hydrogen 2.791 N/A THR 261.A OG1 ASP 259.A OD2 no hydrogen 3.108 N/A GLY 265.A N LYS 262.A O no hydrogen 3.424 N/A PHE 266.A N GLY 112.A O no hydrogen 2.847 N/A GLN 267.A N PHE 173.A O no hydrogen 2.900 N/A GLN 267.A NE2 GLN 111.A OE1 no hydrogen 2.818 N/A PHE 268.A N VAL 110.A O no hydrogen 3.017 N/A ASP 269.A N LYS 170.A O no hydrogen 2.726 N/A ILE 270.A N VAL 108.A O no hydrogen 2.700 N/A THR 271.A N THR 168.A O no hydrogen 2.882 N/A THR 271.A OG1 SER 107.A OG no hydrogen 2.901 N/A TYR 272.A N TRP 106.A O no hydrogen 2.814 N/A ASN 273.A N HIS 166.A O no hydrogen 2.902 N/A ASN 273.A ND2 ILE 281.A O no hydrogen 2.991 N/A LYS 274.A N ASN 105.A OD1 no hydrogen 2.875 N/A LEU 275.A N GLU 164.A O no hydrogen 2.935 N/A THR 277.A N LYS 274.A O no hydrogen 3.145 N/A THR 277.A OG1 GLU 104.A OE1 no hydrogen 2.576 N/A GLN 279.A N THR 277.A OG1 no hydrogen 3.117 N/A SER 280.A OG SER 282.A OG no hydrogen 3.016 N/A ILE 281.A N ASN 273.A OD1 no hydrogen 2.726 N/A SER 282.A N GLN 286.A OE1 no hydrogen 2.815 N/A SER 282.A OG SER 280.A OG no hydrogen 3.016 N/A GLN 286.A N THR 283.A OG1 no hydrogen 3.104 N/A GLN 286.A NE2 SER 280.A O no hydrogen 2.950 N/A VAL 287.A N THR 283.A O no hydrogen 3.135 N/A THR 288.A N ARG 284.A O no hydrogen 3.064 N/A THR 288.A OG1 ARG 284.A O no hydrogen 3.005 N/A GLU 289.A N GLU 285.A O no hydrogen 3.147 N/A LEU 290.A N GLN 286.A O no hydrogen 2.980 N/A ILE 291.A N VAL 287.A O no hydrogen 2.883 N/A THR 292.A N THR 288.A O no hydrogen 3.144 N/A THR 292.A OG1 THR 288.A O no hydrogen 3.128 N/A TRP 293.A N GLU 289.A O no hydrogen 2.873 N/A SER 294.A N LEU 290.A O no hydrogen 2.744 N/A SER 294.A OG LEU 290.A O no hydrogen 2.829 N/A LEU 295.A N ILE 291.A O no hydrogen 3.048 N/A ASN 296.A N THR 292.A O no hydrogen 3.253 N/A GLU 297.A N TRP 293.A O no hydrogen 2.910 N/A ILE 298.A N SER 294.A O no hydrogen 3.015 N/A ASN 299.A N LEU 295.A O no hydrogen 3.104 N/A ASN 299.A ND2 LEU 295.A O no hydrogen 2.669 N/A ALA 300.A N ASN 296.A O no hydrogen 2.873 N/A ARG 301.A N GLU 297.A O no hydrogen 2.929 N/A ARG 301.A NE GLU 297.A OE2 no hydrogen 2.888 N/A PHE 302.A N ILE 298.A O no hydrogen 2.892 N/A ASP 303.A N ASN 299.A O no hydrogen 3.039 N/A LYS 304.A N ALA 300.A O no hydrogen 3.049 N/A GLN 305.A N ARG 301.A O no hydrogen 3.249 N/A GLN 305.A N PHE 302.A O no hydrogen 3.184 N/A PHE 306.A N PHE 302.A O no hydrogen 2.968 N/A SER 307.A N GLY 778.A O no hydrogen 2.988 N/A SER 314.A N ASN 737.A OD1 no hydrogen 2.773 N/A ILE 315.A N ASP 313.A OD2 no hydrogen 3.205 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.794 N/A VAL 320.A N SER 317.A OG no hydrogen 3.019 N/A LYS 321.A N SER 317.A O no hydrogen 3.013 N/A LYS 321.A NZ GLY 309.A O no hydrogen 3.058 N/A LYS 321.A NZ GLY 311.A O no hydrogen 3.190 N/A LYS 321.A NZ ASP 313.A OD1 no hydrogen 2.599 N/A ARG 322.A N VAL 318.A O no hydrogen 2.920 N/A ARG 322.A NE ASP 303.A OD1 no hydrogen 2.697 N/A ARG 322.A NH2 ASN 299.A OD1 no hydrogen 2.953 N/A ARG 322.A NH2 ASP 303.A OD1 no hydrogen 3.110 N/A ARG 322.A NH2 ASP 303.A OD2 no hydrogen 3.271 N/A ARG 323.A N GLU 319.A O no hydrogen 3.055 N/A PHE 324.A N VAL 320.A O no hydrogen 2.913 N/A ALA 325.A N LYS 321.A O no hydrogen 2.939 N/A LEU 326.A N ARG 322.A O no hydrogen 2.833 N/A GLU 327.A N ARG 323.A O no hydrogen 2.992 N/A THR 328.A N PHE 324.A O no hydrogen 3.021 N/A THR 328.A OG1 PHE 324.A O no hydrogen 2.820 N/A LEU 329.A N ALA 325.A O no hydrogen 2.940 N/A SER 330.A N LEU 326.A O no hydrogen 2.820 N/A SER 330.A OG LEU 326.A O no hydrogen 2.600 N/A ASN 331.A N GLU 327.A O no hydrogen 2.953 N/A LEU 332.A N THR 328.A O no hydrogen 3.103 N/A LEU 333.A N LEU 329.A O no hydrogen 2.949 N/A GLY 334.A N SER 330.A O no hydrogen 2.794 N/A GLY 335.A N ASN 331.A O no hydrogen 3.068 N/A GLY 335.A N LEU 332.A O no hydrogen 3.174 N/A ILE 336.A N LEU 333.A O no hydrogen 3.109 N/A GLY 337.A N THR 374.A O no hydrogen 2.923 N/A TYR 338.A N TYR 20.A O no hydrogen 3.093 N/A TYR 338.A OH GLU 371.A OE1 no hydrogen 2.702 N/A PHE 339.A N LEU 372.A O no hydrogen 2.815 N/A GLY 341.A N PHE 370.A O no hydrogen 2.965 N/A ASN 342.A ND2 GLU 366.A OE1 no hydrogen 3.418 N/A GLN 343.A N GLU 367.A O no hydrogen 2.846 N/A ILE 345.A N LYS 365.A O no hydrogen 3.022 N/A ASP 346.A N GLN 444.A O no hydrogen 3.180 N/A ARG 347.A NE GLU 367.A OE1 no hydrogen 2.977 N/A ARG 347.A NE GLU 367.A OE2 no hydrogen 3.299 N/A ARG 347.A NH2 GLU 367.A OE2 no hydrogen 2.673 N/A THR 349.A N ASP 346.A OD1 no hydrogen 3.020 N/A THR 349.A OG1 ASP 346.A OD1 no hydrogen 3.080 N/A THR 349.A OG1 ASP 346.A OD2 no hydrogen 2.610 N/A THR 349.A OG1 ASN 363.A OD1 no hydrogen 2.993 N/A SER 354.A N ASP 352.A OD1 no hydrogen 3.158 N/A SER 354.A OG ASP 352.A OD1 no hydrogen 3.110 N/A GLN 355.A N ASP 352.A O no hydrogen 3.347 N/A GLN 355.A NE2 THR 357.A O no hydrogen 3.131 N/A THR 357.A N GLN 355.A OE1 no hydrogen 2.963 N/A THR 357.A OG1 GLN 355.A OE1 no hydrogen 2.371 N/A ASN 363.A N ASP 346.A OD2 no hydrogen 2.909 N/A LYS 365.A N ILE 345.A O no hydrogen 3.012 N/A GLU 367.A N GLN 343.A O no hydrogen 2.934 N/A PHE 370.A N GLY 341.A O no hydrogen 2.729 N/A LEU 372.A N PHE 339.A O no hydrogen 2.853 N/A PHE 373.A N SER 411.A OG no hydrogen 2.904 N/A THR 374.A N GLY 337.A O no hydrogen 3.146 N/A THR 374.A OG1 SER 375.A O no hydrogen 2.830 N/A SER 375.A N GLU 390.A OE2 no hydrogen 3.185 N/A SER 375.A OG GLU 390.A OE1 no hydrogen 2.940 N/A SER 375.A OG GLU 390.A OE2 no hydrogen 2.438 N/A SER 375.A OG HIS 393.A ND1 no hydrogen 2.984 N/A SER 378.A OG GLU 764.A O no hydrogen 2.974 N/A SER 378.A OG HIS 765.A O no hydrogen 3.403 N/A ARG 379.A NE SER 22.A O no hydrogen 2.932 N/A ARG 379.A NH1 GLU 82.A OE2 no hydrogen 2.851 N/A ARG 379.A NH2 CYS 24.A O no hydrogen 2.849 N/A ARG 379.A NH2 TYR 25.A O no hydrogen 2.848 N/A ARG 379.A NH2 GLU 82.A OE2 no hydrogen 3.230 N/A PHE 381.A N SER 378.A OG no hydrogen 3.331 N/A PHE 382.A N SER 378.A O no hydrogen 2.862 N/A ARG 384.A N PHE 382.A O no hydrogen 2.796 N/A ARG 384.A NE GLU 426.A OE2 no hydrogen 2.681 N/A ARG 384.A NH2 GLU 426.A OE2 no hydrogen 2.991 N/A TYR 387.A N ARG 425.A O no hydrogen 2.851 N/A TYR 387.A OH HIS 498.A NE2 no hydrogen 2.377 N/A GLU 390.A N PHE 386.A O no hydrogen 3.091 N/A GLY 391.A N THR 453.A OG1 no hydrogen 3.197 N/A PHE 392.A N ASP 389.A O no hydrogen 3.126 N/A HIS 393.A N ASP 389.A O no hydrogen 3.196 N/A HIS 393.A ND1 GLU 390.A OE1 no hydrogen 2.938 N/A LEU 394.A N GLU 390.A O no hydrogen 2.960 N/A LEU 395.A N GLY 391.A O no hydrogen 3.197 N/A GLN 396.A N HIS 393.A O no hydrogen 3.100 N/A GLN 396.A NE2 ASN 775.A OD1 no hydrogen 3.012 N/A ILE 397.A N HIS 393.A O no hydrogen 2.902 N/A MET 398.A N LEU 394.A O no hydrogen 2.805 N/A GLU 399.A N GLN 396.A O no hydrogen 3.246 N/A TYR 400.A N ILE 397.A O no hydrogen 2.960 N/A TYR 400.A OH ASP 75.A OD2 no hydrogen 2.593 N/A ASP 401.A N ILE 397.A O no hydrogen 2.760 N/A ASP 403.A N THR 474.A O no hydrogen 2.875 N/A LEU 404.A N ASP 401.A OD1 no hydrogen 2.875 N/A ALA 405.A N ASP 401.A O no hydrogen 3.242 N/A PHE 406.A N PHE 402.A O no hydrogen 3.299 N/A GLU 407.A N ASP 403.A O no hydrogen 3.088 N/A ILE 408.A N LEU 404.A O no hydrogen 3.077 N/A LEU 409.A N.A ALA 405.A O no hydrogen 3.006 N/A LEU 409.A N.B ALA 405.A O no hydrogen 3.013 N/A ALA 410.A N PHE 406.A O no hydrogen 3.017 N/A SER 411.A N GLU 407.A O no hydrogen 3.070 N/A SER 411.A OG TYR 32.A OH no hydrogen 2.984 N/A TRP 412.A N ILE 408.A O no hydrogen 3.122 N/A TRP 412.A NE1 THR 374.A OG1 no hydrogen 3.042 N/A PHE 413.A N LEU 409.A O.A no hydrogen 3.240 N/A PHE 413.A N LEU 409.A O.B no hydrogen 3.257 N/A GLU 414.A N ALA 410.A O no hydrogen 3.009 N/A GLU 414.A N SER 411.A O no hydrogen 3.192 N/A MET 415.A N TRP 412.A O no hydrogen 3.068 N/A ILE 416.A N PHE 413.A O no hydrogen 3.400 N/A SER 420.A N GLU 417.A O no hydrogen 3.494 N/A TRP 422.A N SER 420.A OG no hydrogen 3.084 N/A ARG 425.A NH1 GLU 426.A OE1 no hydrogen 3.184 N/A ILE 427.A N GLY 385.A O no hydrogen 2.820 N/A GLY 430.A N ASN 342.A O no hydrogen 3.027 N/A ARG 434.A N GLY 430.A O no hydrogen 2.962 N/A ARG 434.A NH1 GLU 366.A OE2 no hydrogen 2.966 N/A ARG 434.A NH1 ASN 431.A OD1 no hydrogen 3.547 N/A ARG 434.A NH2 ASN 342.A O no hydrogen 3.056 N/A ARG 434.A NH2 GLU 366.A OE1 no hydrogen 2.823 N/A SER 435.A N ASN 431.A O no hydrogen 3.046 N/A SER 435.A OG GLU 432.A O no hydrogen 2.572 N/A LYS 436.A N ALA 433.A O no hydrogen 3.248 N/A LYS 436.A NZ ALA 60.A O no hydrogen 2.979 N/A LYS 436.A NZ GLY 380.A O no hydrogen 3.190 N/A VAL 437.A N ARG 434.A O no hydrogen 2.991 N/A GLN 439.A N GLN 439.A OE1 no hydrogen 2.782 N/A GLU 440.A N.A GLU 440.A OE1.A no hydrogen 2.573 N/A GLU 440.A N.B GLU 440.A OE1.B no hydrogen 3.284 N/A PHE 441.A N PRO 438.A O no hydrogen 2.920 N/A GLN 442.A N GLN 439.A O no hydrogen 3.361 N/A GLN 442.A NE2 VAL 437.A O no hydrogen 2.831 N/A GLN 444.A N LEU 344.A O no hydrogen 2.759 N/A GLN 444.A NE2 GLN 442.A O no hydrogen 3.156 N/A ASN 447.A N ASN 445.A OD1 no hydrogen 2.875 N/A ILE 448.A N ASN 445.A O no hydrogen 3.156 N/A ASN 450.A ND2 LEU 543.A O no hydrogen 3.423 N/A THR 453.A N PRO 451.A O no hydrogen 2.874 N/A THR 453.A OG1 TRP 388.A O no hydrogen 2.719 N/A LEU 455.A N PRO 452.A O no hydrogen 3.149 N/A ALA 457.A N THR 453.A O no hydrogen 2.944 N/A PHE 458.A N LEU 454.A O no hydrogen 2.858 N/A SER 459.A N LEU 455.A O no hydrogen 2.881 N/A SER 459.A OG GLN 578.A OE1 no hydrogen 2.650 N/A GLU 460.A N LEU 456.A O no hydrogen 3.169 N/A MET 461.A N ALA 457.A O no hydrogen 3.023 N/A LEU 462.A N PHE 458.A O no hydrogen 2.924 N/A SER 463.A N.A SER 459.A O no hydrogen 2.998 N/A SER 463.A N.B SER 459.A O no hydrogen 2.995 N/A SER 463.A OG.A SER 459.A O no hydrogen 2.767 N/A ARG 464.A N GLU 460.A O no hydrogen 3.362 N/A ARG 464.A NE GLU 478.A OE2 no hydrogen 2.860 N/A ARG 464.A NH1 GLU 478.A OE1 no hydrogen 3.427 N/A ARG 464.A NH1 GLU 478.A OE2 no hydrogen 2.917 N/A ARG 464.A NH2 GLU 399.A OE2 no hydrogen 3.153 N/A ALA 465.A N MET 461.A O no hydrogen 2.993 N/A ILE 466.A N LEU 462.A O no hydrogen 2.804 N/A GLU 467.A N SER 463.A O.A no hydrogen 2.974 N/A GLU 467.A N SER 463.A O.B no hydrogen 2.971 N/A ASN 468.A N ARG 464.A O no hydrogen 2.939 N/A ILE 469.A N ALA 465.A O no hydrogen 2.850 N/A GLY 470.A N ILE 466.A O no hydrogen 3.217 N/A ASN 475.A ND2 GLU 478.A OE1 no hydrogen 2.903 N/A ASN 476.A N ASP 403.A OD2 no hydrogen 3.020 N/A ASN 476.A ND2 ASP 403.A OD2 no hydrogen 3.500 N/A LEU 477.A N ASP 403.A OD1 no hydrogen 3.184 N/A GLU 478.A N ASN 475.A O no hydrogen 2.865 N/A ALA 479.A N ASN 475.A O no hydrogen 3.284 N/A ALA 479.A N ASN 476.A O no hydrogen 3.312 N/A ASN 480.A N ASN 476.A O no hydrogen 2.857 N/A LEU 483.A N ASN 480.A OD1 no hydrogen 3.175 N/A LEU 484.A N ASN 480.A O no hydrogen 2.959 N/A THR 485.A N PRO 481.A O no hydrogen 2.909 N/A THR 485.A OG1 PRO 481.A O no hydrogen 2.726 N/A GLU 486.A N GLY 482.A O no hydrogen 3.317 N/A TYR 487.A N LEU 483.A O no hydrogen 3.097 N/A TYR 487.A OH PHE 406.A O no hydrogen 2.689 N/A ALA 488.A N LEU 484.A O no hydrogen 2.885 N/A LYS 489.A N THR 485.A O no hydrogen 2.976 N/A LYS 489.A NZ GLU 486.A OE2 no hydrogen 3.017 N/A LYS 490.A N GLU 486.A O no hydrogen 3.225 N/A ILE 491.A N TYR 487.A O no hydrogen 3.101 N/A TYR 492.A N ALA 488.A O no hydrogen 2.889 N/A LYS 494.A N ILE 491.A O no hydrogen 2.956 N/A LYS 494.A NZ GLU 414.A OE1 no hydrogen 2.691 N/A LYS 494.A NZ LYS 490.A O no hydrogen 3.497 N/A LEU 495.A N ILE 491.A O no hydrogen 3.051 N/A LEU 496.A N TYR 492.A O no hydrogen 2.917 N/A LYS 497.A N PRO 493.A O no hydrogen 3.141 N/A HIS 498.A N LYS 494.A O no hydrogen 3.016 N/A HIS 498.A ND1 GLY 421.A O no hydrogen 2.765 N/A HIS 498.A NE2 TYR 387.A OH no hydrogen 2.377 N/A TYR 499.A N LEU 495.A O no hydrogen 2.671 N/A TYR 499.A OH THR 573.A OG1 no hydrogen 2.684 N/A ASN 500.A N LEU 496.A O no hydrogen 2.817 N/A TRP 501.A N LYS 497.A O no hydrogen 3.002 N/A PHE 502.A N HIS 498.A O no hydrogen 2.869 N/A ARG 503.A N TYR 499.A O no hydrogen 3.093 N/A ARG 503.A NH1 GLU 530.A OE1 no hydrogen 3.021 N/A ARG 503.A NH1 GLU 530.A OE2 no hydrogen 3.443 N/A ARG 503.A NH2 GLU 530.A OE2 no hydrogen 3.093 N/A LYS 504.A N ASN 500.A O no hydrogen 3.085 N/A SER 505.A N TRP 501.A O no hydrogen 3.053 N/A SER 505.A OG TRP 501.A O no hydrogen 2.918 N/A SER 505.A OG PHE 502.A O no hydrogen 3.209 N/A GLN 506.A N PHE 502.A O no hydrogen 3.131 N/A GLN 506.A NE2 SER 505.A OG no hydrogen 2.993 N/A THR 507.A N LYS 504.A O no hydrogen 3.133 N/A THR 507.A OG1 ARG 503.A O no hydrogen 2.673 N/A THR 507.A OG1 LYS 504.A O no hydrogen 3.117 N/A GLY 508.A N VAL 531.A O no hydrogen 2.924 N/A TYR 513.A OH ALA 559.A O no hydrogen 2.532 N/A LEU 517.A N TYR 513.A O no hydrogen 2.523 N/A GLU 518.A N GLU 514.A O no hydrogen 2.734 N/A ASP 519.A N GLU 515.A O no hydrogen 3.129 N/A GLU 520.A N ILE 516.A O no hydrogen 3.037 N/A GLY 521.A N GLU 518.A O no hydrogen 3.034 N/A ILE 522.A N LEU 517.A O no hydrogen 3.033 N/A TRP 523.A N LEU 517.A O no hydrogen 3.099 N/A LYS 525.A N ILE 522.A O no hydrogen 3.066 N/A HIS 527.A N ASN 602.A OD1 no hydrogen 2.989 N/A HIS 527.A NE2 GLU 601.A OE1 no hydrogen 2.679 N/A LYS 528.A NZ TRP 523.A O no hydrogen 2.627 N/A LYS 528.A NZ ILE 526.A O no hydrogen 3.313 N/A GLU 530.A N HIS 527.A O no hydrogen 3.147 N/A TYR 532.A OH GLU 530.A OE1 no hydrogen 2.642 N/A ARG 533.A N GLN 506.A O no hydrogen 2.906 N/A ARG 533.A NH2 GLU 353.A O no hydrogen 3.428 N/A TRP 534.A N ASN 562.A OD1 no hydrogen 2.838 N/A TRP 534.A NE1 ASP 564.A OD1 no hydrogen 3.041 N/A TRP 534.A NE1 ASP 564.A OD2 no hydrogen 2.952 N/A VAL 535.A N GLN 506.A OE1 no hydrogen 2.943 N/A ARG 537.A NE THR 538.A O no hydrogen 3.091 N/A ARG 537.A NH1 ALA 553.A O no hydrogen 2.848 N/A ARG 537.A NH1 GLU 560.A OE1 no hydrogen 3.450 N/A ARG 537.A NH2 THR 538.A O no hydrogen 3.375 N/A ARG 537.A NH2 PHE 539.A O no hydrogen 3.541 N/A ARG 537.A NH2 ALA 553.A O no hydrogen 3.244 N/A THR 538.A N HIS 541.A O no hydrogen 2.748 N/A THR 538.A OG1 HIS 541.A O no hydrogen 3.306 N/A THR 540.A OG1 HIS 541.A ND1 no hydrogen 3.087 N/A HIS 541.A N THR 538.A OG1 no hydrogen 3.217 N/A HIS 541.A ND1 THR 540.A OG1 no hydrogen 3.087 N/A CYS 542.A N ASP 548.A O no hydrogen 2.809 N/A CYS 542.A SG SER 545.A OG no hydrogen 3.771 N/A SER 545.A N CYS 542.A O no hydrogen 3.383 N/A SER 545.A OG CYS 542.A O no hydrogen 2.882 N/A GLY 546.A N LEU 543.A O no hydrogen 3.018 N/A MET 547.A N SER 545.A OG no hydrogen 3.343 N/A TYR 550.A N MET 547.A O no hydrogen 2.961 N/A TYR 550.A OH HIS 633.A O no hydrogen 2.441 N/A ARG 552.A NH1 ASP 564.A OD2 no hydrogen 2.744 N/A ARG 552.A NH2 ASP 564.A OD1 no hydrogen 2.955 N/A ARG 552.A NH2 ASP 564.A OD2 no hydrogen 3.561 N/A ARG 552.A NH2 ASP 617.A OD2 no hydrogen 2.883 N/A GLN 554.A NE2 PHE 539.A O no hydrogen 3.007 N/A ALA 559.A N ASP 557.A OD2 no hydrogen 3.068 N/A GLU 560.A N ASP 557.A O no hydrogen 3.202 N/A LEU 561.A N ILE 618.A O no hydrogen 2.932 N/A ASN 562.A N TYR 532.A O no hydrogen 2.847 N/A ASN 562.A ND2 ASP 617.A OD2 no hydrogen 3.139 N/A VAL 563.A N ASP 617.A OD1 no hydrogen 2.846 N/A LEU 566.A N ASN 562.A O no hydrogen 3.222 N/A ALA 567.A N VAL 563.A O no hydrogen 2.991 N/A TRP 568.A N ASP 564.A O no hydrogen 2.961 N/A VAL 569.A N ALA 565.A O no hydrogen 3.169 N/A GLY 570.A N LEU 566.A O no hydrogen 3.028 N/A VAL 571.A N ALA 567.A O no hydrogen 3.054 N/A MET 572.A N TRP 568.A O no hydrogen 3.002 N/A THR 573.A N VAL 569.A O no hydrogen 2.901 N/A THR 573.A OG1 TYR 499.A OH no hydrogen 2.684 N/A THR 573.A OG1 VAL 569.A O no hydrogen 2.821 N/A ARG 574.A N GLY 570.A O no hydrogen 2.974 N/A ARG 574.A NE GLU 596.A OE2 no hydrogen 3.023 N/A ARG 574.A NH1 LEU 644.A O no hydrogen 3.060 N/A ARG 574.A NH2 LEU 644.A O no hydrogen 3.042 N/A SER 575.A N VAL 571.A O no hydrogen 3.175 N/A SER 575.A OG MET 572.A O no hydrogen 2.740 N/A MET 576.A N MET 572.A O no hydrogen 3.087 N/A LYS 577.A N THR 573.A O no hydrogen 2.949 N/A LYS 577.A NZ GLU 596.A OE1 no hydrogen 2.757 N/A GLN 578.A N ARG 574.A O no hydrogen 3.080 N/A GLN 578.A NE2 SER 459.A O no hydrogen 3.086 N/A GLN 578.A NE2 SER 463.A OG.A no hydrogen 2.617 N/A ILE 579.A N SER 575.A O no hydrogen 2.971 N/A ALA 580.A N MET 576.A O no hydrogen 2.944 N/A HIS 581.A N LYS 577.A O no hydrogen 2.985 N/A HIS 581.A ND1 GLU 589.A OE2 no hydrogen 3.183 N/A VAL 582.A N GLN 578.A O no hydrogen 3.029 N/A LEU 583.A N ILE 579.A O no hydrogen 3.010 N/A LYS 584.A N HIS 581.A O no hydrogen 3.057 N/A LEU 585.A N ALA 580.A O no hydrogen 2.873 N/A THR 586.A N LYS 584.A O no hydrogen 3.032 N/A GLU 589.A N LEU 585.A O no hydrogen 2.744 N/A GLN 590.A N THR 586.A O no hydrogen 2.990 N/A ARG 591.A N GLN 587.A O no hydrogen 3.090 N/A ARG 591.A NH2 ASP 588.A OD2 no hydrogen 2.854 N/A TYR 592.A N ASP 588.A O no hydrogen 3.026 N/A ALA 593.A N GLU 589.A O no hydrogen 2.882 N/A GLN 594.A N GLN 590.A O no hydrogen 3.073 N/A GLN 594.A NE2 GLU 598.A OE2 no hydrogen 3.460 N/A ILE 595.A N ARG 591.A O no hydrogen 2.940 N/A GLU 596.A N TYR 592.A O no hydrogen 2.865 N/A GLN 597.A N ALA 593.A O no hydrogen 3.133 N/A GLN 597.A NE2 GLU 601.A OE2 no hydrogen 3.241 N/A GLU 598.A N GLN 594.A O no hydrogen 2.838 N/A VAL 599.A N ILE 595.A O no hydrogen 2.874 N/A VAL 600.A N GLU 596.A O no hydrogen 2.979 N/A GLU 601.A N GLN 597.A O no hydrogen 2.925 N/A ASN 602.A N GLU 598.A O no hydrogen 2.952 N/A ASN 602.A ND2 HIS 527.A O no hydrogen 2.739 N/A ASN 602.A ND2 GLU 530.A O no hydrogen 2.777 N/A LEU 603.A N VAL 599.A O no hydrogen 3.034 N/A ASP 604.A N VAL 600.A O no hydrogen 3.443 N/A LEU 605.A N GLU 601.A O no hydrogen 2.884 N/A LEU 606.A N ASN 602.A O no hydrogen 2.787 N/A HIS 607.A N LEU 603.A O no hydrogen 3.229 N/A HIS 607.A ND1 CYS 616.A O no hydrogen 2.800 N/A SER 609.A N CYS 614.A O.A no hydrogen 2.816 N/A SER 609.A N CYS 614.A O.B no hydrogen 2.844 N/A SER 609.A OG ASP 612.A OD1 no hydrogen 2.717 N/A ASP 612.A N SER 609.A OG no hydrogen 3.274 N/A CYS 614.A N.A SER 609.A O no hydrogen 3.450 N/A CYS 614.A N.B SER 609.A O no hydrogen 3.468 N/A CYS 614.A SG.A TYR 615.A O no hydrogen 3.186 N/A CYS 614.A SG.B ASP 612.A O no hydrogen 3.454 N/A TYR 615.A OH ASP 604.A OD1 no hydrogen 2.666 N/A CYS 616.A N HIS 607.A O no hydrogen 2.659 N/A CYS 616.A SG CYS 614.A O.A no hydrogen 3.879 N/A CYS 616.A SG CYS 614.A O.B no hydrogen 3.851 N/A ILE 618.A N LEU 561.A O no hydrogen 2.893 N/A SER 619.A N GLU 629.A O no hydrogen 3.044 N/A SER 619.A OG GLU 629.A OE2 no hydrogen 3.257 N/A ASP 621.A N ILE 627.A O no hydrogen 2.938 N/A GLU 623.A N ASP 621.A OD1 no hydrogen 3.067 N/A ASP 624.A N ASP 621.A OD1 no hydrogen 3.367 N/A ASP 625.A N ASP 621.A O no hydrogen 3.081 N/A ARG 628.A NE GLU 520.A OE2 no hydrogen 3.169 N/A ARG 628.A NH1 LEU 606.A O no hydrogen 2.661 N/A ARG 628.A NH2 GLU 520.A OE1 no hydrogen 2.924 N/A GLU 629.A N SER 619.A O no hydrogen 2.715 N/A VAL 631.A N ASP 617.A O no hydrogen 2.807 N/A CYS 632.A SG ASP 612.A OD1 no hydrogen 3.439 N/A HIS 633.A ND1 ASP 680.A OD2 no hydrogen 2.916 N/A GLY 635.A N SER 638.A OG no hydrogen 3.237 N/A TYR 636.A N SER 675.A O no hydrogen 3.005 N/A TYR 636.A OH LEU 673.A O no hydrogen 2.600 N/A SER 638.A OG HIS 633.A O no hydrogen 3.316 N/A VAL 639.A N GLY 635.A O no hydrogen 3.270 N/A VAL 639.A N TYR 636.A O no hydrogen 3.228 N/A LEU 640.A N VAL 637.A O no hydrogen 3.391 N/A ALA 643.A N VAL 639.A O no hydrogen 2.760 N/A LEU 644.A N LEU 640.A O no hydrogen 2.787 N/A LYS 645.A N PHE 642.A O no hydrogen 2.873 N/A LYS 645.A NZ GLU 460.A OE2 no hydrogen 2.915 N/A LYS 645.A NZ ASP 704.A OD2 no hydrogen 2.732 N/A LEU 646.A N PRO 641.A O no hydrogen 2.899 N/A SER 651.A N PRO 648.A O no hydrogen 3.054 N/A LYS 653.A N SER 651.A OG no hydrogen 3.128 N/A LEU 654.A N SER 651.A O no hydrogen 3.229 N/A GLU 655.A N GLU 655.A OE1 no hydrogen 2.738 N/A VAL 657.A N LYS 653.A O no hydrogen 3.054 N/A VAL 658.A N LEU 654.A O no hydrogen 2.930 N/A ALA 659.A N GLU 655.A O no hydrogen 2.935 N/A LEU 660.A N LYS 656.A O no hydrogen 2.888 N/A MET 661.A N VAL 657.A O no hydrogen 2.944 N/A SER 662.A N VAL 658.A O no hydrogen 2.936 N/A SER 662.A OG VAL 658.A O no hydrogen 2.677 N/A ASP 663.A N LEU 660.A O no hydrogen 3.343 N/A GLU 665.A N ASP 663.A OD1 no hydrogen 2.875 N/A LYS 666.A N ASP 663.A O no hydrogen 3.061 N/A LYS 666.A NZ GLU 634.A OE1 no hydrogen 3.102 N/A LYS 666.A NZ GLU 634.A OE2 no hydrogen 3.088 N/A PHE 668.A N ASP 663.A O no hydrogen 3.071 N/A SER 669.A N GLY 672.A O no hydrogen 3.244 N/A SER 669.A OG GLY 672.A O no hydrogen 2.708 N/A TYR 671.A N SER 669.A OG no hydrogen 2.966 N/A LEU 673.A N ASN 699.A OD1 no hydrogen 2.754 N/A LEU 674.A N ILE 667.A O no hydrogen 2.799 N/A SER 675.A N GLY 692.A O no hydrogen 3.349 N/A SER 675.A N PRO 693.A O no hydrogen 3.172 N/A SER 675.A OG PRO 693.A O no hydrogen 2.807 N/A SER 677.A N GLU 634.A O no hydrogen 2.763 N/A ARG 678.A N LYS 666.A O no hydrogen 2.960 N/A ARG 678.A NH1 PHE 668.A O no hydrogen 2.984 N/A ARG 678.A NH2 PHE 668.A O no hydrogen 3.228 N/A GLN 679.A N SER 677.A OG no hydrogen 3.088 N/A GLN 679.A NE2 GLU 665.A O no hydrogen 2.655 N/A ASP 680.A N SER 677.A O no hydrogen 3.146 N/A TYR 682.A N ASP 680.A OD1 no hydrogen 2.917 N/A PHE 683.A N ASP 680.A O no hydrogen 3.233 N/A GLY 684.A N ARG 691.A O no hydrogen 2.973 N/A LYS 685.A N TYR 682.A O no hydrogen 3.006 N/A TYR 689.A N ASP 549.A OD2 no hydrogen 3.214 N/A TRP 690.A N ASP 549.A OD1 no hydrogen 2.928 N/A ARG 691.A NE ASP 549.A O no hydrogen 2.658 N/A ARG 691.A NH2 ASP 549.A O no hydrogen 3.364 N/A GLY 692.A N SER 675.A OG no hydrogen 2.885 N/A ILE 694.A N TYR 753.A O no hydrogen 2.797 N/A TRP 695.A N TYR 636.A OH no hydrogen 3.028 N/A TRP 695.A NE1 TYR 689.A O no hydrogen 2.889 N/A ILE 698.A N ASN 697.A OD1 no hydrogen 2.865 N/A ASN 699.A N TRP 695.A O no hydrogen 3.351 N/A ASN 699.A ND2 LEU 673.A O no hydrogen 3.126 N/A ASN 699.A ND2 TRP 695.A O no hydrogen 2.854 N/A TYR 700.A N MET 696.A O no hydrogen 2.809 N/A LEU 701.A N ASN 697.A O no hydrogen 3.403 N/A CYS 702.A N ILE 698.A O no hydrogen 3.078 N/A CYS 702.A SG ILE 698.A O no hydrogen 3.415 N/A LEU 703.A N ASN 699.A O no hydrogen 3.164 N/A ASP 704.A N TYR 700.A O no hydrogen 3.033 N/A ALA 705.A N LEU 701.A O no hydrogen 2.860 N/A MET 706.A N.A CYS 702.A O no hydrogen 2.937 N/A MET 706.A N.B CYS 702.A O no hydrogen 2.959 N/A MET 706.A N.B LEU 703.A O no hydrogen 3.136 N/A ARG 707.A N LEU 703.A O no hydrogen 3.328 N/A ARG 707.A NH1 TYR 728.A OH no hydrogen 3.454 N/A TYR 708.A N ASP 704.A O no hydrogen 3.328 N/A TYR 709.A N ALA 705.A O no hydrogen 2.911 N/A TYR 709.A OH ILE 647.A O no hydrogen 2.616 N/A TYR 710.A N MET 706.A O.A no hydrogen 2.665 N/A TYR 710.A N MET 706.A O.B no hydrogen 2.918 N/A VAL 713.A N TYR 710.A O no hydrogen 3.003 N/A ILE 714.A N PRO 711.A O no hydrogen 3.497 N/A LEU 715.A N GLU 712.A O no hydrogen 3.219 N/A LYS 725.A N SER 722.A OG no hydrogen 3.240 N/A LYS 726.A N SER 722.A O no hydrogen 2.987 N/A LEU 727.A N ASN 723.A O no hydrogen 3.176 N/A TYR 728.A N ALA 724.A O no hydrogen 2.922 N/A GLN 729.A N LYS 725.A O no hydrogen 2.842 N/A SER 730.A N LYS 726.A O no hydrogen 3.131 N/A SER 730.A OG LYS 726.A O no hydrogen 2.878 N/A SER 730.A OG LEU 727.A O no hydrogen 3.135 N/A LEU 731.A N LEU 727.A O no hydrogen 2.911 N/A LYS 732.A N TYR 728.A O no hydrogen 3.106 N/A LYS 732.A NZ ILE 776.A O no hydrogen 3.381 N/A ILE 733.A N GLN 729.A O no hydrogen 2.980 N/A ASN 734.A N SER 730.A O no hydrogen 2.802 N/A ASN 734.A ND2 SER 669.A O no hydrogen 3.333 N/A LEU 735.A N LEU 731.A O no hydrogen 2.932 N/A SER 736.A N LYS 732.A O no hydrogen 3.123 N/A SER 736.A OG LYS 732.A O no hydrogen 2.795 N/A ASN 737.A N ILE 733.A O no hydrogen 2.888 N/A ASN 738.A N ASN 734.A O no hydrogen 3.018 N/A ASN 738.A ND2 GLY 758.A O no hydrogen 2.789 N/A ILE 739.A N LEU 735.A O no hydrogen 2.960 N/A TYR 740.A N SER 736.A O no hydrogen 3.193 N/A LYS 741.A N ASN 737.A O no hydrogen 2.957 N/A VAL 742.A N ASN 738.A O no hydrogen 2.904 N/A TRP 743.A N ILE 739.A O no hydrogen 2.998 N/A GLU 744.A N TYR 740.A O no hydrogen 2.653 N/A GLU 745.A N LYS 741.A O no hydrogen 2.758 N/A GLN 746.A NE2 GLY 760.A O no hydrogen 3.356 N/A GLY 747.A N VAL 742.A O no hydrogen 3.227 N/A TYR 750.A N TYR 753.A OH no hydrogen 3.056 N/A GLU 751.A N ALA 763.A O no hydrogen 2.927 N/A ASN 752.A N THR 761.A O no hydrogen 3.142 N/A TYR 753.A N ILE 694.A O no hydrogen 2.872 N/A SER 754.A N HIS 759.A O no hydrogen 2.897 N/A ILE 756.A N SER 754.A OG no hydrogen 2.997 N/A GLY 758.A N SER 754.A O no hydrogen 2.868 N/A HIS 759.A N ASP 757.A OD1 no hydrogen 3.452 N/A HIS 759.A ND1 ASP 757.A OD1 no hydrogen 2.505 N/A GLY 760.A N GLN 746.A OE1 no hydrogen 3.102 N/A THR 761.A N ASN 752.A O no hydrogen 2.840 N/A THR 761.A OG1 ASN 752.A O no hydrogen 3.138 N/A THR 761.A OG1 ASN 752.A OD1 no hydrogen 2.517 N/A ALA 763.A N GLU 751.A OE1 no hydrogen 3.025 N/A PHE 766.A N CYS 749.A O no hydrogen 2.885 N/A THR 767.A N HIS 765.A O no hydrogen 3.136 N/A THR 767.A OG1 THR 767.A O no hydrogen 2.666 N/A THR 770.A OG1 TYR 750.A O no hydrogen 2.594 N/A ALA 771.A N GLY 768.A O no hydrogen 3.118 N/A LEU 772.A N TRP 769.A O no hydrogen 3.064 N/A VAL 773.A N THR 770.A O no hydrogen 3.194 N/A VAL 774.A N ALA 771.A O no hydrogen 3.082 N/A ASN 775.A N GLN 396.A OE1 no hydrogen 3.079 N/A ASN 775.A ND2 LEU 395.A O no hydrogen 3.248 N/A ASN 775.A ND2 TYR 700.A OH no hydrogen 2.982 N/A ILE 776.A N LEU 772.A O no hydrogen 3.357 N/A LEU 777.A N VAL 773.A O no hydrogen 3.051 N/A GLY 778.A N VAL 774.A O no hydrogen 2.858 N/A ARG 779.A N ASN 775.A O no hydrogen 2.840 N/A HIS 784.A N GLU 467.A OE1 no hydrogen 3.267 N/A