Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mcv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N ASP 3.A OD2 no hydrogen 2.807 N/A GLU 6.A N ASP 3.A O no hydrogen 3.110 N/A ILE 7.A N VAL 73.A O no hydrogen 3.295 N/A ARG 9.A NH1 PRO 78.A O no hydrogen 2.716 N/A ARG 9.A NH2 GLU 76.A O no hydrogen 2.840 N/A SER 11.A N PRO 8.A O no hydrogen 3.265 N/A GLU 15.A N MET 28.A O no hydrogen 2.941 N/A VAL 16.A N MET 28.A O no hydrogen 3.148 N/A LYS 17.A NZ GLN 20.A OE1 no hydrogen 3.254 N/A LEU 18.A N VAL 26.A O no hydrogen 2.582 N/A GLN 20.A N GLN 20.A OE1 no hydrogen 2.686 N/A GLY 21.A N GLY 24.A O no hydrogen 2.590 N/A VAL 26.A N GLY 19.A O no hydrogen 3.151 N/A TRP 27.A N ILE 39.A O no hydrogen 2.660 N/A TRP 27.A NE1 GLU 25.A OE2 no hydrogen 2.803 N/A MET 28.A N VAL 16.A O no hydrogen 2.709 N/A GLY 29.A N VAL 37.A O no hydrogen 3.166 N/A THR 30.A N ARG 13.A O no hydrogen 3.275 N/A THR 30.A OG1 GLU 15.A OE2 no hydrogen 3.281 N/A TRP 31.A N THR 35.A O no hydrogen 2.665 N/A ASN 32.A N SER 11.A O no hydrogen 2.522 N/A THR 34.A N TRP 31.A O no hydrogen 3.309 N/A THR 34.A OG1 ASN 32.A O no hydrogen 3.406 N/A THR 35.A N TRP 31.A O no hydrogen 2.934 N/A THR 35.A OG1 TRP 31.A O no hydrogen 3.375 N/A ARG 36.A NH1 GLU 15.A OE1 no hydrogen 3.221 N/A ARG 36.A NH1 GLY 29.A O no hydrogen 3.464 N/A VAL 37.A N GLY 29.A O no hydrogen 3.051 N/A ALA 38.A N GLY 83.A O no hydrogen 3.049 N/A ILE 39.A N TRP 27.A O no hydrogen 2.593 N/A LYS 40.A N ILE 81.A O no hydrogen 2.864 N/A THR 41.A N GLU 25.A O no hydrogen 2.828 N/A THR 41.A OG1 GLU 25.A O no hydrogen 3.377 N/A LYS 43.A N PHE 23.A O no hydrogen 3.156 N/A THR 46.A OG1 LYS 43.A O no hydrogen 3.557 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.658 N/A GLN 54.A N ALA 51.A O no hydrogen 3.062 N/A ALA 56.A N LEU 53.A O no hydrogen 2.716 N/A GLN 57.A N LEU 53.A O no hydrogen 2.809 N/A LYS 60.A NZ ASP 3.A OD1 no hydrogen 2.963 N/A LYS 60.A NZ GLN 57.A OE1 no hydrogen 3.143 N/A LYS 61.A N VAL 58.A O no hydrogen 3.227 N/A ARG 63.A N TYR 121.A OH no hydrogen 2.906 N/A LYS 66.A N HIS 64.A ND1 no hydrogen 2.990 N/A LYS 66.A NZ GLN 114.A OE1 no hydrogen 2.705 N/A LEU 67.A N HIS 64.A O no hydrogen 3.028 N/A VAL 68.A N VAL 147.A O no hydrogen 3.169 N/A GLN 69.A N GLU 84.A OE1 no hydrogen 3.006 N/A GLN 69.A NE2 HIS 64.A O no hydrogen 3.659 N/A TYR 71.A N VAL 82.A O no hydrogen 2.946 N/A ALA 72.A N VAL 82.A O no hydrogen 3.161 N/A VAL 73.A N TRP 5.A O no hydrogen 3.314 N/A VAL 74.A N TYR 80.A O no hydrogen 2.975 N/A SER 75.A N GLU 6.A OE1 no hydrogen 2.742 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.641 N/A ILE 81.A N LYS 40.A O no hydrogen 3.118 N/A VAL 82.A N ALA 72.A O no hydrogen 2.812 N/A GLU 84.A N GLN 69.A O no hydrogen 2.736 N/A SER 87.A OG GLU 141.A OE2 no hydrogen 2.864 N/A LYS 88.A N VAL 139.A O no hydrogen 3.053 N/A GLY 89.A N MET 86.A O no hydrogen 3.386 N/A SER 90.A OG ALA 134.A O no hydrogen 3.551 N/A SER 90.A OG ALA 135.A O no hydrogen 3.251 N/A LEU 91.A N ILE 137.A O no hydrogen 2.639 N/A LEU 92.A N SER 90.A OG no hydrogen 3.365 N/A LEU 92.A N ALA 134.A O no hydrogen 3.273 N/A PHE 94.A N SER 90.A O no hydrogen 2.933 N/A LEU 95.A N LEU 91.A O no hydrogen 2.772 N/A LYS 96.A N LEU 92.A O no hydrogen 2.929 N/A GLY 97.A N PHE 94.A O no hydrogen 3.313 N/A LYS 101.A N GLU 98.A O no hydrogen 3.181 N/A TYR 102.A N MET 99.A O no hydrogen 3.059 N/A ARG 104.A N GLN 107.A OE1 no hydrogen 2.833 N/A ARG 104.A NH1 LYS 101.A O no hydrogen 3.290 N/A ARG 104.A NH1 LEU 103.A O no hydrogen 2.868 N/A LEU 108.A N ARG 104.A O no hydrogen 3.064 N/A VAL 109.A N LEU 105.A O no hydrogen 2.852 N/A ASP 110.A N PRO 106.A O no hydrogen 3.230 N/A MET 111.A N GLN 107.A O no hydrogen 3.033 N/A ALA 112.A N LEU 108.A O no hydrogen 3.109 N/A ALA 113.A N VAL 109.A O no hydrogen 2.955 N/A GLN 114.A N ASP 110.A O no hydrogen 3.259 N/A GLN 114.A NE2 ASP 110.A O no hydrogen 3.640 N/A GLN 114.A NE2 ASP 110.A OD2 no hydrogen 3.237 N/A GLN 114.A NE2 LEU 143.A O no hydrogen 2.961 N/A ILE 115.A N MET 111.A O no hydrogen 3.271 N/A ALA 116.A N ALA 112.A O no hydrogen 2.817 N/A SER 117.A N ALA 113.A O no hydrogen 2.687 N/A GLY 118.A N GLN 114.A O no hydrogen 2.739 N/A MET 119.A N ILE 115.A O no hydrogen 2.758 N/A ALA 120.A N ALA 116.A O no hydrogen 2.856 N/A TYR 121.A N SER 117.A O no hydrogen 3.278 N/A VAL 122.A N GLY 118.A O no hydrogen 3.248 N/A GLU 123.A N MET 119.A O no hydrogen 2.844 N/A ARG 124.A N ALA 120.A O no hydrogen 3.041 N/A MET 125.A N TYR 121.A O no hydrogen 3.065 N/A ASN 126.A N GLU 123.A O no hydrogen 3.197 N/A TYR 127.A N VAL 122.A O no hydrogen 3.079 N/A VAL 128.A N ARG 154.A O no hydrogen 3.000 N/A HIS 129.A N ASP 178.A OD2 no hydrogen 2.893 N/A HIS 129.A NE2 ALA 148.A O no hydrogen 2.871 N/A ARG 130.A N ASP 178.A OD1 no hydrogen 3.182 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.297 N/A ARG 133.A NE ASP 131.A OD1 no hydrogen 2.826 N/A ALA 134.A N GLU 188.A OE1 no hydrogen 3.261 N/A ASN 136.A N ARG 133.A O no hydrogen 2.800 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.481 N/A ASN 136.A ND2 ASP 131.A OD2 no hydrogen 2.814 N/A ILE 137.A N ALA 134.A O no hydrogen 3.335 N/A LEU 138.A N LYS 146.A O no hydrogen 3.078 N/A VAL 139.A N GLY 89.A O no hydrogen 2.891 N/A GLY 140.A N VAL 144.A O no hydrogen 2.956 N/A VAL 144.A N GLU 141.A O no hydrogen 3.311 N/A CYS 145.A N GLN 114.A OE1 no hydrogen 2.953 N/A CYS 145.A SG LEU 143.A O no hydrogen 3.948 N/A LYS 146.A N LEU 138.A O no hydrogen 2.871 N/A LYS 146.A NZ GLU 65.A O no hydrogen 3.318 N/A LYS 146.A NZ GLU 84.A OE1 no hydrogen 3.130 N/A LYS 146.A NZ GLU 84.A OE2 no hydrogen 2.419 N/A VAL 147.A N LYS 66.A O no hydrogen 2.892 N/A ALA 148.A N ASN 136.A O no hydrogen 3.166 N/A PHE 150.A N GLU 55.A OE2 no hydrogen 2.996 N/A ILE 160.A N PHE 158.A O no hydrogen 2.760 N/A LYS 161.A NZ MET 200.A O no hydrogen 3.033 N/A TRP 162.A N PRO 159.A O no hydrogen 3.206 N/A TRP 162.A NE1 GLU 188.A OE2 no hydrogen 2.858 N/A THR 163.A N ILE 160.A O no hydrogen 3.107 N/A THR 163.A OG1 PRO 159.A O no hydrogen 2.296 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.723 N/A ALA 167.A N ALA 164.A O no hydrogen 2.987 N/A ALA 168.A N ALA 164.A O no hydrogen 2.985 N/A ALA 168.A N PRO 165.A O no hydrogen 3.157 N/A LEU 169.A N PRO 165.A O no hydrogen 2.814 N/A TYR 170.A N GLU 166.A O no hydrogen 3.253 N/A ARG 172.A N GLU 166.A O no hydrogen 2.920 N/A THR 174.A N SER 177.A OG no hydrogen 2.709 N/A LYS 176.A NZ ARG 240.A O no hydrogen 2.433 N/A SER 177.A N THR 174.A O no hydrogen 3.070 N/A SER 177.A OG THR 174.A O no hydrogen 2.377 N/A ASP 178.A N THR 174.A O no hydrogen 3.273 N/A VAL 179.A N ILE 175.A O no hydrogen 3.258 N/A SER 181.A OG TRP 162.A O no hydrogen 2.528 N/A SER 181.A OG SER 177.A O no hydrogen 3.545 N/A PHE 182.A N ASP 178.A O no hydrogen 2.916 N/A GLY 183.A N VAL 179.A O no hydrogen 3.035 N/A ILE 184.A N TRP 180.A O no hydrogen 3.194 N/A LEU 185.A N SER 181.A O no hydrogen 2.801 N/A LEU 186.A N PHE 182.A O no hydrogen 2.924 N/A THR 187.A N ILE 184.A O no hydrogen 3.055 N/A THR 187.A OG1 ILE 184.A O no hydrogen 2.324 N/A GLU 188.A N ILE 184.A O no hydrogen 3.232 N/A LEU 189.A N LEU 185.A O no hydrogen 3.074 N/A THR 190.A N LEU 186.A O no hydrogen 3.239 N/A THR 190.A OG1 LEU 186.A O no hydrogen 2.916 N/A THR 190.A OG1 THR 187.A O no hydrogen 3.277 N/A THR 191.A OG1 THR 187.A O no hydrogen 2.697 N/A LYS 192.A NZ GLY 100.A O no hydrogen 3.509 N/A LYS 192.A NZ LEU 103.A O no hydrogen 3.225 N/A LYS 192.A NZ ASN 266.A O no hydrogen 2.779 N/A GLY 193.A N GLU 188.A O no hydrogen 2.781 N/A VAL 201.A N GLU 204.A OE2 no hydrogen 3.143 N/A VAL 205.A N VAL 201.A O no hydrogen 3.100 N/A LEU 206.A N ASN 202.A O no hydrogen 3.330 N/A ASP 207.A N ARG 203.A O no hydrogen 3.381 N/A GLN 208.A N GLU 204.A O no hydrogen 2.997 N/A VAL 209.A N VAL 205.A O no hydrogen 2.643 N/A GLU 210.A N LEU 206.A O no hydrogen 3.147 N/A ARG 211.A N ASP 207.A O no hydrogen 3.183 N/A GLY 212.A N VAL 209.A O no hydrogen 2.868 N/A TYR 213.A N GLN 208.A O no hydrogen 3.045 N/A ARG 214.A NE TRP 233.A O no hydrogen 2.862 N/A ARG 214.A NH1 VAL 209.A O no hydrogen 3.071 N/A ARG 214.A NH1 TYR 213.A O no hydrogen 2.810 N/A ARG 214.A NH2 TRP 233.A O no hydrogen 3.148 N/A CYS 217.A SG PRO 218.A O no hydrogen 3.661 N/A CYS 217.A SG CYS 221.A O no hydrogen 3.173 N/A CYS 221.A N PRO 218.A O no hydrogen 3.154 N/A CYS 221.A SG PRO 222.A O no hydrogen 3.477 N/A SER 224.A OG TYR 253.A OH no hydrogen 2.738 N/A SER 224.A OG GLU 258.A OE2 no hydrogen 2.761 N/A HIS 226.A N PRO 222.A O no hydrogen 3.298 N/A ASP 227.A N GLU 223.A O no hydrogen 2.879 N/A MET 229.A N LEU 225.A O no hydrogen 3.274 N/A CYS 230.A N HIS 226.A O no hydrogen 3.076 N/A CYS 230.A SG HIS 226.A NE2 no hydrogen 3.504 N/A CYS 230.A SG HIS 226.A O no hydrogen 3.470 N/A GLN 231.A N ASP 227.A O no hydrogen 2.958 N/A GLN 231.A NE2 ASP 227.A O no hydrogen 3.697 N/A CYS 232.A N LEU 228.A O no hydrogen 3.152 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.216 N/A TRP 233.A N CYS 230.A O no hydrogen 2.930 N/A ARG 234.A N GLN 231.A O no hydrogen 3.490 N/A ARG 234.A NH1 GLU 239.A O no hydrogen 2.657 N/A GLU 239.A N ASP 236.A O no hydrogen 2.922 N/A ARG 240.A N PRO 237.A O no hydrogen 3.335 N/A ARG 240.A NE LYS 176.A O no hydrogen 3.147 N/A ARG 240.A NH1 ARG 234.A O no hydrogen 2.449 N/A ARG 240.A NH2 LYS 176.A O no hydrogen 3.165 N/A PHE 243.A N GLU 123.A OE2 no hydrogen 3.350 N/A TYR 245.A N THR 242.A OG1 no hydrogen 3.010 N/A LEU 246.A N THR 242.A O no hydrogen 3.013 N/A GLN 247.A N PHE 243.A O no hydrogen 2.736 N/A GLN 247.A NE2 GLU 251.A OE2 no hydrogen 3.044 N/A ALA 248.A N GLU 244.A O no hydrogen 3.285 N/A PHE 249.A N TYR 245.A O no hydrogen 2.845 N/A LEU 250.A N LEU 246.A O no hydrogen 3.128 N/A GLU 251.A N GLN 247.A O no hydrogen 3.022 N/A ASP 252.A N ALA 248.A O no hydrogen 3.228 N/A TYR 253.A N LEU 250.A O no hydrogen 3.237 N/A TYR 253.A OH SER 224.A OG no hydrogen 2.738 N/A THR 255.A N ASP 252.A O no hydrogen 3.388 N/A SER 256.A N ASP 252.A O no hydrogen 3.020 N/A SER 256.A OG ASP 252.A O no hydrogen 2.519 N/A THR 257.A N TYR 253.A O no hydrogen 2.983 N/A GLU 258.A N TYR 253.A O no hydrogen 2.960 N/A TYR 261.A OH LEU 267.A OXT no hydrogen 2.293 N/A GLY 264.A N LEU 267.A O no hydrogen 2.469 N/A GLU 265.A N GLU 220.A OE2 no hydrogen 3.053 N/A ASN 266.A N GLU 220.A OE1 no hydrogen 2.897 N/A LEU 267.A N GLU 220.A OE1 no hydrogen 2.528 N/A