Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ceq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N ASP 42.A OD2 no hydrogen 3.108 N/A VAL 2.A N ASP 42.A OD2 no hydrogen 2.656 N/A LEU 10.A N SER 6.A O no hydrogen 2.944 N/A CYS 11.A N ALA 7.A O no hydrogen 3.061 N/A CYS 11.A SG ALA 7.A O no hydrogen 3.402 N/A LYS 12.A N VAL 8.A O no hydrogen 3.003 N/A GLN 13.A N PRO 9.A O no hydrogen 3.194 N/A ALA 14.A N LEU 10.A O no hydrogen 3.192 N/A LEU 15.A N CYS 11.A O no hydrogen 2.784 N/A GLU 16.A N LYS 12.A O no hydrogen 3.212 N/A ASP 17.A N GLN 13.A O no hydrogen 2.889 N/A LEU 18.A N ALA 14.A O no hydrogen 2.998 N/A GLU 19.A N LEU 15.A O no hydrogen 2.817 N/A LYS 20.A N GLU 16.A O no hydrogen 3.172 N/A THR 21.A N ASP 17.A O no hydrogen 2.922 N/A THR 21.A OG1 ASP 17.A O no hydrogen 2.795 N/A SER 22.A N LEU 18.A O no hydrogen 2.788 N/A HIS 26.A N GLY 23.A O no hydrogen 3.387 N/A ASP 28.A N HIS 26.A ND1 no hydrogen 3.047 N/A VAL 29.A N HIS 26.A O no hydrogen 3.312 N/A ALA 30.A N PRO 27.A O no hydrogen 3.137 N/A MET 32.A N ASP 28.A O no hydrogen 3.000 N/A LEU 33.A N VAL 29.A O no hydrogen 2.995 N/A ASN 34.A N ALA 30.A O no hydrogen 2.974 N/A ILE 35.A N THR 31.A O no hydrogen 2.982 N/A LEU 36.A N MET 32.A O no hydrogen 2.994 N/A ALA 37.A N LEU 33.A O no hydrogen 2.788 N/A LEU 38.A N ASN 34.A O no hydrogen 2.912 N/A VAL 39.A N ILE 35.A O no hydrogen 2.949 N/A TYR 40.A N LEU 36.A O no hydrogen 3.031 N/A ARG 41.A N ALA 37.A O no hydrogen 3.040 N/A ASP 42.A N LEU 38.A O no hydrogen 3.016 N/A GLN 43.A N VAL 39.A O no hydrogen 3.225 N/A GLN 43.A N TYR 40.A O no hydrogen 3.127 N/A ASN 44.A N ARG 41.A O no hydrogen 2.963 N/A LYS 45.A N TYR 40.A O no hydrogen 2.863 N/A TYR 46.A N ASN 44.A O no hydrogen 2.933 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.852 N/A ALA 49.A N LYS 45.A O no hydrogen 2.934 N/A ALA 50.A N TYR 46.A O no hydrogen 2.918 N/A HIS 51.A N LYS 47.A O no hydrogen 3.136 N/A LEU 52.A N GLU 48.A O no hydrogen 3.414 N/A LEU 53.A N ALA 49.A O no hydrogen 3.310 N/A ASN 54.A N ALA 50.A O no hydrogen 3.173 N/A ASN 54.A ND2 TYR 82.A OH no hydrogen 3.259 N/A ALA 56.A N LEU 52.A O no hydrogen 2.946 N/A LEU 57.A N LEU 53.A O no hydrogen 2.594 N/A ALA 58.A N ASN 54.A O no hydrogen 3.016 N/A ILE 59.A N ASP 55.A O no hydrogen 3.241 N/A ARG 60.A N ALA 56.A O no hydrogen 2.964 N/A ARG 60.A NH1 ASN 34.A OD1 no hydrogen 3.073 N/A ARG 60.A NH2 ASN 34.A OD1 no hydrogen 2.865 N/A GLU 61.A N LEU 57.A O no hydrogen 2.890 N/A LYS 62.A N ALA 58.A O no hydrogen 3.193 N/A THR 63.A N ILE 59.A O no hydrogen 2.941 N/A THR 63.A OG1 ILE 59.A O no hydrogen 2.959 N/A GLY 65.A N ARG 60.A O no hydrogen 2.926 N/A ALA 70.A N HIS 68.A ND1 no hydrogen 3.044 N/A VAL 71.A N HIS 68.A O no hydrogen 2.800 N/A ALA 72.A N HIS 68.A O no hydrogen 3.304 N/A ALA 73.A N PRO 69.A O no hydrogen 3.182 N/A THR 74.A N ALA 70.A O no hydrogen 3.303 N/A THR 74.A OG1 ALA 70.A O no hydrogen 2.761 N/A LEU 75.A N VAL 71.A O no hydrogen 2.946 N/A ASN 76.A N ALA 72.A O no hydrogen 3.109 N/A ASN 76.A ND2 GLN 116.A OE1 no hydrogen 3.195 N/A ASN 77.A N ALA 73.A O no hydrogen 2.891 N/A LEU 78.A N THR 74.A O no hydrogen 2.799 N/A ALA 79.A N LEU 75.A O no hydrogen 2.893 N/A VAL 80.A N ASN 76.A O no hydrogen 2.813 N/A LEU 81.A N ASN 77.A O no hydrogen 3.045 N/A TYR 82.A N LEU 78.A O no hydrogen 2.991 N/A GLY 83.A N ALA 79.A O no hydrogen 2.999 N/A LYS 84.A N VAL 80.A O no hydrogen 2.956 N/A GLY 86.A N GLY 83.A O no hydrogen 2.845 N/A LYS 87.A N TYR 82.A O no hydrogen 2.832 N/A ALA 91.A N TYR 88.A O no hydrogen 3.127 N/A GLU 92.A N TYR 88.A O no hydrogen 3.051 N/A CYS 95.A N ALA 91.A O no hydrogen 3.038 N/A LYS 96.A N GLU 92.A O no hydrogen 2.721 N/A ARG 97.A N PRO 93.A O no hydrogen 2.902 N/A ARG 97.A NH1 GLU 61.A OE1 no hydrogen 2.639 N/A ALA 98.A N LEU 94.A O no hydrogen 3.166 N/A LEU 99.A N CYS 95.A O no hydrogen 3.201 N/A GLU 100.A N LYS 96.A O no hydrogen 3.271 N/A ILE 101.A N ARG 97.A O no hydrogen 3.015 N/A ARG 102.A N ALA 98.A O no hydrogen 2.951 N/A GLU 103.A N LEU 99.A O no hydrogen 2.963 N/A LYS 104.A N GLU 100.A O no hydrogen 3.216 N/A VAL 105.A N ILE 101.A O no hydrogen 3.039 N/A LEU 106.A N ARG 102.A O no hydrogen 2.961 N/A GLY 107.A N GLU 103.A O no hydrogen 3.004 N/A HIS 110.A N GLY 107.A O no hydrogen 3.451 N/A ASP 112.A N HIS 110.A ND1 no hydrogen 3.106 N/A VAL 113.A N HIS 110.A O no hydrogen 2.810 N/A LYS 115.A N PRO 111.A O no hydrogen 3.252 N/A GLN 116.A N ASP 112.A O no hydrogen 3.396 N/A LEU 117.A N VAL 113.A O no hydrogen 2.876 N/A SER 118.A N ALA 114.A O no hydrogen 3.106 N/A SER 118.A OG ALA 114.A O no hydrogen 3.431 N/A ASN 119.A N LYS 115.A O no hydrogen 2.982 N/A ASN 119.A ND2 GLN 116.A OE1 no hydrogen 3.548 N/A LEU 120.A N GLN 116.A O no hydrogen 2.657 N/A ALA 121.A N LEU 117.A O no hydrogen 2.807 N/A LEU 122.A N SER 118.A O no hydrogen 2.964 N/A LEU 123.A N ASN 119.A O no hydrogen 3.238 N/A CYS 124.A N LEU 120.A O no hydrogen 3.412 N/A CYS 124.A SG GLU 92.A OE2 no hydrogen 3.361 N/A CYS 124.A SG LEU 120.A O no hydrogen 3.338 N/A CYS 124.A SG GLU 132.A OE1 no hydrogen 3.698 N/A GLN 125.A N ALA 121.A O no hydrogen 3.070 N/A ASN 126.A N LEU 122.A O no hydrogen 3.238 N/A ASN 126.A ND2 LEU 122.A O no hydrogen 2.467 N/A GLN 127.A N CYS 124.A O no hydrogen 2.910 N/A GLN 127.A NE2 GLU 92.A OE1 no hydrogen 3.152 N/A GLY 128.A N GLN 125.A O no hydrogen 3.244 N/A LYS 129.A N CYS 124.A O no hydrogen 2.995 N/A LYS 129.A NZ GLU 92.A OE1 no hydrogen 2.822 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.735 N/A VAL 133.A N LYS 129.A O no hydrogen 3.297 N/A GLU 134.A N ALA 130.A O no hydrogen 2.927 N/A TYR 135.A N GLU 131.A O no hydrogen 3.173 N/A TYR 136.A N GLU 132.A O no hydrogen 2.835 N/A TYR 137.A N VAL 133.A O no hydrogen 2.874 N/A ARG 138.A N GLU 134.A O no hydrogen 2.999 N/A ARG 138.A NE TYR 166.A OH no hydrogen 2.827 N/A ARG 138.A NH2 TYR 166.A OH no hydrogen 2.859 N/A ARG 139.A N TYR 135.A O no hydrogen 3.080 N/A ARG 139.A NH1 TYR 135.A OH no hydrogen 2.866 N/A ARG 139.A NH2 GLU 103.A OE2 no hydrogen 2.699 N/A ALA 140.A N TYR 136.A O no hydrogen 3.074 N/A LEU 141.A N TYR 137.A O no hydrogen 2.757 N/A GLU 142.A N ARG 138.A O no hydrogen 2.910 N/A ILE 143.A N ARG 139.A O no hydrogen 3.339 N/A TYR 144.A N ALA 140.A O no hydrogen 2.911 N/A ALA 145.A N LEU 141.A O no hydrogen 2.821 N/A THR 146.A N GLU 142.A O no hydrogen 3.333 N/A THR 146.A OG1 GLU 142.A O no hydrogen 2.657 N/A ARG 147.A N ILE 143.A O no hydrogen 2.704 N/A ARG 147.A NE PHE 109.A O no hydrogen 3.334 N/A LEU 148.A N TYR 144.A O no hydrogen 2.892 N/A ASP 152.A N GLY 149.A O no hydrogen 3.152 N/A ASN 154.A N ASP 152.A OD2 no hydrogen 3.139 N/A ASN 154.A ND2 ASP 152.A OD2 no hydrogen 2.845 N/A VAL 155.A N ASP 152.A O no hydrogen 3.126 N/A LYS 157.A N PRO 153.A O no hydrogen 2.976 N/A THR 158.A N ASN 154.A O no hydrogen 2.899 N/A THR 158.A OG1 ASN 154.A O no hydrogen 2.751 N/A LYS 159.A N VAL 155.A O no hydrogen 2.871 N/A LYS 159.A NZ GLU 181.A OE1 no hydrogen 2.798 N/A ASN 160.A N ALA 156.A O no hydrogen 2.852 N/A ASN 160.A ND2 THR 218.A O no hydrogen 3.674 N/A ASN 161.A N LYS 157.A O no hydrogen 3.044 N/A LEU 162.A N THR 158.A O no hydrogen 2.798 N/A ALA 163.A N LYS 159.A O no hydrogen 2.881 N/A SER 164.A N ASN 160.A O no hydrogen 3.002 N/A CYS 165.A N ASN 161.A O no hydrogen 3.195 N/A CYS 165.A SG ALA 130.A O no hydrogen 3.576 N/A TYR 166.A N LEU 162.A O no hydrogen 2.836 N/A LEU 167.A N ALA 163.A O no hydrogen 2.835 N/A LYS 168.A N SER 164.A O no hydrogen 2.977 N/A GLN 169.A N CYS 165.A O no hydrogen 3.327 N/A GLN 169.A N TYR 166.A O no hydrogen 3.174 N/A GLN 169.A NE2 GLU 134.A OE1 no hydrogen 3.469 N/A GLN 169.A NE2 CYS 165.A O no hydrogen 3.455 N/A GLY 170.A N LEU 167.A O no hydrogen 2.975 N/A LYS 171.A N TYR 166.A O no hydrogen 2.844 N/A LYS 171.A NZ GLU 134.A OE1 no hydrogen 2.694 N/A ALA 175.A N LYS 171.A O no hydrogen 3.307 N/A GLU 176.A N TYR 172.A O no hydrogen 2.948 N/A THR 177.A N GLN 173.A O no hydrogen 2.945 N/A THR 177.A OG1 GLN 173.A O no hydrogen 3.251 N/A LEU 178.A N ASP 174.A O no hydrogen 3.212 N/A TYR 179.A N ALA 175.A O no hydrogen 2.952 N/A LYS 180.A N GLU 176.A O no hydrogen 2.996 N/A LYS 180.A NZ GLU 176.A OE1 no hydrogen 3.229 N/A LYS 180.A NZ GLU 206.A OE2 no hydrogen 2.726 N/A GLU 181.A N THR 177.A O no hydrogen 2.984 N/A ILE 182.A N LEU 178.A O no hydrogen 3.257 N/A LEU 183.A N TYR 179.A O no hydrogen 3.165 N/A THR 184.A N LYS 180.A O no hydrogen 2.913 N/A THR 184.A OG1 LYS 180.A O no hydrogen 2.622 N/A ARG 185.A N GLU 181.A O no hydrogen 3.019 N/A ALA 186.A N ILE 182.A O no hydrogen 3.004 N/A HIS 187.A N LEU 183.A O no hydrogen 2.835 N/A HIS 187.A NE2 ASN 198.A OD1 no hydrogen 2.827 N/A GLU 188.A N THR 184.A O no hydrogen 3.023 N/A LYS 189.A N ALA 186.A O no hydrogen 3.380 N/A PHE 191.A N HIS 187.A O no hydrogen 3.235 N/A GLY 196.A N ASN 195.A OD1 no hydrogen 2.629 N/A ASN 198.A N ASN 195.A O no hydrogen 2.810 N/A LYS 199.A NZ GLU 207.A OE1 no hydrogen 3.042 N/A LYS 199.A NZ GLU 207.A OE2 no hydrogen 3.239 N/A TRP 202.A NE1 THR 184.A OG1 no hydrogen 2.896 N/A MET 203.A N PRO 200.A O no hydrogen 2.936 N/A HIS 204.A N PRO 200.A O no hydrogen 3.450 N/A ALA 205.A N ILE 201.A O no hydrogen 2.943 N/A GLU 206.A N TRP 202.A O no hydrogen 3.096 N/A GLU 207.A N MET 203.A O no hydrogen 2.801 N/A ARG 208.A N HIS 204.A O no hydrogen 2.866 N/A GLU 209.A N ALA 205.A O no hydrogen 3.274 N/A GLU 210.A N GLU 206.A O no hydrogen 3.356 N/A GLU 210.A N GLU 207.A O no hydrogen 3.219 N/A SER 211.A OG ARG 208.A O no hydrogen 2.730 N/A THR 218.A N SER 216.A OG no hydrogen 3.335 N/A ASN 220.A N SER 216.A O no hydrogen 3.111 N/A THR 221.A N PRO 217.A O no hydrogen 3.280 N/A THR 221.A OG1 PRO 217.A O no hydrogen 3.009 N/A THR 222.A N THR 218.A O no hydrogen 3.006 N/A THR 222.A OG1 ASN 160.A OD1 no hydrogen 2.986 N/A THR 222.A OG1 THR 218.A O no hydrogen 3.183 N/A LEU 223.A N VAL 219.A O no hydrogen 2.797 N/A ARG 224.A N ASN 220.A O no hydrogen 3.018 N/A SER 225.A N THR 221.A O no hydrogen 2.828 N/A SER 225.A OG THR 221.A O no hydrogen 2.959 N/A LEU 226.A N THR 222.A O no hydrogen 2.874 N/A GLY 227.A N LEU 223.A O no hydrogen 2.976 N/A ALA 228.A N ARG 224.A O no hydrogen 3.084 N/A ALA 228.A N SER 225.A O no hydrogen 3.024 N/A LEU 229.A N SER 225.A O no hydrogen 3.288 N/A TYR 230.A N LEU 226.A O no hydrogen 3.060 N/A TYR 230.A OH GLU 206.A OE2 no hydrogen 2.712 N/A ARG 231.A N GLY 227.A O no hydrogen 3.090 N/A ARG 231.A NE GLU 243.A OE2 no hydrogen 2.892 N/A ARG 231.A NH2 GLU 243.A OE1 no hydrogen 3.044 N/A ARG 232.A N ALA 228.A O no hydrogen 3.042 N/A GLN 233.A N LEU 229.A O no hydrogen 3.007 N/A GLN 233.A NE2 GLU 176.A OE2 no hydrogen 3.132 N/A GLY 234.A N ARG 231.A O no hydrogen 3.185 N/A LYS 235.A N TYR 230.A O no hydrogen 2.808 N/A GLU 237.A N GLU 209.A OE2 no hydrogen 2.937 N/A ALA 239.A N LYS 235.A O no hydrogen 3.125 N/A HIS 240.A N LEU 236.A O no hydrogen 3.007 N/A THR 241.A N GLU 237.A O no hydrogen 3.226 N/A THR 241.A OG1 GLU 237.A O no hydrogen 2.762 N/A THR 241.A OG1 ALA 238.A O no hydrogen 3.528 N/A LEU 242.A N ALA 238.A O no hydrogen 3.371 N/A GLU 243.A N ALA 239.A O no hydrogen 2.934 N/A ASP 244.A N HIS 240.A O no hydrogen 2.715 N/A CYS 245.A N THR 241.A O no hydrogen 3.200 N/A ALA 246.A N LEU 242.A O no hydrogen 3.104 N/A SER 247.A N GLU 243.A O no hydrogen 3.012 N/A SER 247.A OG GLU 243.A O no hydrogen 3.120 N/A ARG 248.A N CYS 245.A O no hydrogen 3.381 N/A ASN 249.A N CYS 245.A O no hydrogen 3.187 N/A ASN 249.A N ALA 246.A O no hydrogen 3.155 N/A ASN 249.A ND2 CYS 214.A O no hydrogen 3.565 N/A