Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1d9i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N PRO 145.A O no hydrogen 3.018 N/A LEU 5.A N ASP 2A.A O no hydrogen 3.220 N/A ARG 6.A N GLU 10.A OE2 no hydrogen 2.998 N/A ARG 6.A NE GLU 10.A OE2 no hydrogen 2.829 N/A ARG 6.A NH1 ASP 16.A OD1 no hydrogen 2.606 N/A ARG 6.A NH1 MET 39.A O no hydrogen 2.959 N/A ARG 6.A NH2 GLU 10.A OE1 no hydrogen 3.276 N/A ARG 6.A NH2 ASP 16.A OD1 no hydrogen 2.894 N/A PHE 9.A N ARG 6.A O no hydrogen 3.084 N/A LYS 11.A N ARG 6.A O no hydrogen 3.271 N/A LYS 11.A NZ ASP 2A.A OD1 no hydrogen 2.676 N/A SER 13.A N GLU 10.A O no hydrogen 2.788 N/A LEU 14.A N PHE 9.A O no hydrogen 2.797 N/A ASP 16.A N GLU 19C.A OE1 no hydrogen 3.019 N/A ILE 29.A N GLY 170.A O no hydrogen 3.323 N/A VAL 30.A N ASP 220.A O no hydrogen 2.983 N/A SER 33.A N VAL 183.A O no hydrogen 2.916 N/A ALA 35.A N LEU 181.A O no hydrogen 2.879 N/A MET 39.A N GLU 36.A O no hydrogen 3.180 N/A GLN 43.A N SER 40.A O no hydrogen 3.090 N/A GLN 43.A NE2 VAL 44.A O no hydrogen 3.657 N/A VAL 44.A N ALA 58.A O no hydrogen 2.956 N/A MET 45.A N ARG 90.A O no hydrogen 3.000 N/A LEU 46.A N CYS 56.A O no hydrogen 2.666 N/A PHE 47.A N LEU 88.A O no hydrogen 2.736 N/A ARG 48.A N GLU 53.A O no hydrogen 2.660 N/A LYS 49.A N ASP 86.A O no hydrogen 3.233 N/A LYS 49.A NZ ASN 85.A O no hydrogen 3.101 N/A GLU 53.A N ARG 48.A O no hydrogen 3.253 N/A LEU 55.A N LEU 46.A O no hydrogen 2.547 N/A GLY 57.A N SER 226.A O no hydrogen 2.578 N/A SER 59.A N LEU 67.A O no hydrogen 2.885 N/A LEU 60.A N TRP 42.A O no hydrogen 2.899 N/A ILE 61.A N TRP 65.A O no hydrogen 3.276 N/A SER 62.A OG ASP 63.A OD2 no hydrogen 3.261 N/A ARG 64.A NH1 GLU 110.A OE1 no hydrogen 2.803 N/A VAL 66.A N MET 131.A O no hydrogen 3.271 N/A LEU 67.A N SER 59.A O no hydrogen 2.724 N/A THR 68.A N ALA 129.A O no hydrogen 3.043 N/A THR 68.A OG1 GLY 57.A O no hydrogen 2.944 N/A HIS 71.A N ASP 127.A OD1 no hydrogen 2.865 N/A HIS 71.A ND1 ASP 127.A OD2 no hydrogen 2.726 N/A HIS 71.A NE2 SER 226.A OG no hydrogen 2.704 N/A CYS 72.A N ALA 69.A O no hydrogen 3.303 N/A CYS 72.A SG THR 68.A OG1 no hydrogen 3.649 N/A LEU 73.A N ALA 70.A O no hydrogen 2.823 N/A LEU 74.A N ALA 70.A O no hydrogen 2.969 N/A ASP 86.A N THR 83I.A O no hydrogen 3.080 N/A LEU 88.A N PHE 47.A O no hydrogen 2.688 N/A VAL 89.A N SER 107.A O no hydrogen 2.988 N/A ARG 90.A N MET 45.A O no hydrogen 2.983 N/A ARG 90.A NE GLU 104.A OE2 no hydrogen 3.252 N/A ARG 90.A NH2 ARG 98.A O no hydrogen 3.098 N/A ARG 90.A NH2 GLU 104.A OE1 no hydrogen 2.732 N/A ILE 91.A N LYS 105.A O no hydrogen 2.582 N/A LYS 93.A NZ SER 95.A O no hydrogen 3.204 N/A LYS 93.A NZ ARG 98.A O no hydrogen 2.988 N/A LYS 93.A NZ GLU 100.A OE2 no hydrogen 2.803 N/A LYS 93.A NZ GLU 104.A OE1 no hydrogen 2.591 N/A HIS 94.A N GLU 100.A OE1 no hydrogen 3.254 N/A HIS 94.A N GLU 100.A OE2 no hydrogen 3.114 N/A SER 95.A N GLU 100.A OE1 no hydrogen 2.978 N/A ARG 96.A N SER 179.A O no hydrogen 2.850 N/A ARG 96.A NH1 PRO 178.A O no hydrogen 2.457 N/A GLU 100.A N GLU 104.A OE1 no hydrogen 3.375 N/A ILE 103.A N GLU 100.A O no hydrogen 3.123 N/A GLU 104.A N GLU 100.A O no hydrogen 3.067 N/A LYS 105.A N ILE 91.A O no hydrogen 2.622 N/A LYS 105.A NZ ALA 138.A O no hydrogen 3.389 N/A SER 107.A N VAL 89.A O no hydrogen 2.840 N/A GLU 110.A N LYS 132.A O no hydrogen 2.570 N/A LYS 111.A N LYS 132.A O no hydrogen 3.433 N/A TYR 113.A N LEU 130.A O no hydrogen 2.902 N/A HIS 115.A N ILE 128.A O no hydrogen 3.166 N/A ARG 117.A N HIS 115.A ND1 no hydrogen 2.816 N/A TYR 118.A N HIS 115.A O no hydrogen 2.967 N/A TYR 118.A OH LEU 74.A O no hydrogen 2.826 N/A ASN 119.A N ASP 125.A O no hydrogen 2.884 N/A ASN 119.A ND2 ASN 123.A OD1 no hydrogen 3.170 N/A ASN 119.A ND2 GLU 122A.A OE1 no hydrogen 3.545 N/A ASN 123.A ND2 ARG 201.A O no hydrogen 2.681 N/A LEU 124.A N ASN 119.A O no hydrogen 3.005 N/A ASP 125.A N ASN 123.A OD1 no hydrogen 3.361 N/A ARG 126.A NH1 ARG 117.A O no hydrogen 3.394 N/A ILE 128.A N ARG 126.A O no hydrogen 2.901 N/A ALA 129.A N THR 68.A O no hydrogen 3.351 N/A LEU 130.A N TYR 113.A O no hydrogen 3.068 N/A MET 131.A N VAL 66.A O no hydrogen 3.336 N/A LYS 132.A N LYS 111.A O no hydrogen 3.136 N/A LEU 133.A N ARG 64.A O no hydrogen 2.688 N/A LYS 134.A N MET 108.A O no hydrogen 2.617 N/A VAL 137.A N ASP 63.A O no hydrogen 3.058 N/A SER 140.A N ILE 143.A O no hydrogen 3.308 N/A ILE 143.A N SER 140.A O no hydrogen 3.275 N/A HIS 144.A N PRO 41.A O no hydrogen 2.759 N/A HIS 144.A NE2 ASP 2A.A O no hydrogen 2.810 N/A VAL 146.A N LEU 60.A O no hydrogen 3.125 N/A CYS 147.A N TRP 240.A O no hydrogen 3.027 N/A GLU 152.A N ASP 150.A OD2 no hydrogen 3.285 N/A THR 153.A N ASP 150.A O no hydrogen 2.794 N/A THR 153.A N ASP 150.A OD2 no hydrogen 3.016 N/A THR 153.A OG1 ASP 150.A OD1 no hydrogen 2.515 N/A THR 153.A OG1 ASP 150.A OD2 no hydrogen 3.291 N/A ALA 154.A N ASP 150.A O no hydrogen 2.684 N/A LEU 158.A N ALA 154.A O no hydrogen 3.418 N/A GLN 159.A N LEU 157C.A O no hydrogen 2.900 N/A GLN 159.A NE2 ALA 155A.A O no hydrogen 3.121 N/A GLY 161.A N ILE 188.A O no hydrogen 2.610 N/A TYR 162.A N GLN 159.A O no hydrogen 2.611 N/A LYS 163.A N SER 25I.A OG no hydrogen 2.531 N/A LYS 163.A NZ GLU 21E.A OE1 no hydrogen 2.711 N/A GLY 164.A N LEU 186.A O no hydrogen 2.983 N/A ARG 165.A N VAL 231.A O no hydrogen 2.751 N/A ARG 165.A NH1 ASP 16.A OD2 no hydrogen 2.960 N/A ARG 165.A NH2 THR 18B.A OG1 no hydrogen 2.507 N/A VAL 166.A N VAL 184.A O no hydrogen 2.557 N/A THR 167.A OG1 GLN 43.A OE1 no hydrogen 2.588 N/A TRP 169.A NE1 HIS 94.A O no hydrogen 2.673 N/A ASN 171.A N GLU 223.A O no hydrogen 2.654 N/A LEU 172.A N GLY 176.A O no hydrogen 3.309 N/A GLN 177.A NE2 GLY 176.A O no hydrogen 3.130 N/A LEU 181.A N HIS 94.A O no hydrogen 2.894 N/A GLN 182.A N GLY 168.A O no hydrogen 3.211 N/A GLN 182.A NE2 ASP 34.A OD1 no hydrogen 2.979 N/A GLN 182.A NE2 VAL 180.A O no hydrogen 2.502 N/A VAL 183.A N SER 33.A O no hydrogen 2.608 N/A VAL 184.A N VAL 166.A O no hydrogen 2.847 N/A ASN 185.A ND2 GLU 21E.A OE2 no hydrogen 3.232 N/A LEU 186.A N GLY 164.A O no hydrogen 2.976 N/A ILE 188.A N TYR 162.A O no hydrogen 3.152 N/A VAL 189.A N CYS 208.A O no hydrogen 3.285 N/A ARG 191.A NH1 THR 203.A O no hydrogen 3.123 N/A ARG 191.A NH2 THR 203.A O no hydrogen 2.707 N/A CYS 194.A N GLU 190.A O no hydrogen 3.110 N/A CYS 194.A SG VAL 189.A O no hydrogen 3.545 N/A CYS 194.A SG GLU 190.A O no hydrogen 3.405 N/A LYS 195.A N ARG 191.A O no hydrogen 2.764 N/A ASP 196.A N PRO 192.A O no hydrogen 3.220 N/A SER 197.A OG VAL 193.A O no hydrogen 3.334 N/A SER 197.A OG CYS 194.A O no hydrogen 2.489 N/A THR 198.A N LYS 195.A O no hydrogen 3.530 N/A THR 198.A OG1 GLU 250.A OE1 no hydrogen 3.201 N/A ILE 200.A N THR 198.A OG1 no hydrogen 3.005 N/A ARG 201.A NH1 GLU 122A.A OE2 no hydrogen 2.996 N/A THR 203.A OG1 ASP 125.A OD2 no hydrogen 2.756 N/A ASN 205.A N THR 203.A OG1 no hydrogen 3.297 N/A ASN 205.A ND2 ASP 125.A OD2 no hydrogen 2.833 N/A PHE 207.A N TYR 261.A O no hydrogen 3.240 N/A ALA 209.A N GLY 259.A O no hydrogen 2.551 N/A GLY 210.A N PRO 187.A O no hydrogen 3.429 N/A LYS 212.A N GLU 215B.A OE2 no hydrogen 2.557 N/A ARG 218.A NH2 ASP 255.A OD2 no hydrogen 3.285 N/A GLY 219.A N ASP 253.A OD1 no hydrogen 2.913 N/A ASP 220.A N VAL 30.A O no hydrogen 3.435 N/A ALA 221.A N ASP 220.A OD2 no hydrogen 2.809 N/A CYS 222.A N ASP 225.A OD1 no hydrogen 2.843 N/A ASP 225.A N CYS 222.A O no hydrogen 3.043 N/A SER 226.A OG HIS 71.A NE2 no hydrogen 2.704 N/A GLY 227.A N VAL 246.A O no hydrogen 3.177 N/A GLY 228.A N ASP 225.A O no hydrogen 3.185 N/A PHE 230.A N GLY 244.A O no hydrogen 2.879 N/A VAL 231.A N ARG 165.A O no hydrogen 2.969 N/A MET 232.A N TYR 241.A O no hydrogen 2.934 N/A LYS 233.A NZ GLU 10.A OE1 no hydrogen 2.657 N/A LYS 233.A NZ GLU 19C.A OE2 no hydrogen 2.700 N/A SER 234.A N ARG 239.A O no hydrogen 2.965 N/A ASN 238.A ND2 ASN 237B.A O no hydrogen 3.370 N/A ARG 239.A NE CYS 3.A O no hydrogen 2.815 N/A ARG 239.A NH2 CYS 3.A O no hydrogen 3.056 N/A ARG 239.A NH2 ALA 1B.A O no hydrogen 2.854 N/A TRP 240.A N GLY 4.A O no hydrogen 3.126 N/A TRP 240.A NE1 GLU 10.A OE1 no hydrogen 2.940 N/A TYR 241.A N MET 232.A O no hydrogen 2.786 N/A TYR 241.A OH ASN 237B.A OD1 no hydrogen 2.633 N/A GLN 242.A N CYS 147.A O no hydrogen 2.847 N/A GLN 242.A NE2 SER 59.A OG no hydrogen 2.497 N/A MET 243.A N PHE 230.A O no hydrogen 2.767 N/A GLY 244.A N PHE 230.A O no hydrogen 3.116 N/A ILE 245.A N THR 262.A O no hydrogen 3.182 N/A VAL 246.A N GLY 228.A O no hydrogen 3.138 N/A SER 247.A N PHE 260.A O no hydrogen 3.071 N/A SER 247.A OG ASP 127.A OD2 no hydrogen 2.577 N/A TRP 248.A N PHE 260.A O no hydrogen 3.086 N/A CYS 252.A N GLU 174.A OE2 no hydrogen 2.841 N/A CYS 252.A SG GLY 251.A O no hydrogen 3.032 N/A ASP 253.A N ASP 220.A OD1 no hydrogen 2.966 N/A LYS 257.A NZ GLU 250.A OE2 no hydrogen 3.064 N/A GLY 259.A N ALA 209.A O no hydrogen 2.704 N/A PHE 260.A N TRP 248.A O no hydrogen 2.967 N/A TYR 261.A N PHE 207.A O no hydrogen 3.111 N/A THR 262.A N ILE 245.A O no hydrogen 2.747 N/A THR 262.A OG1 ASP 127.A O no hydrogen 3.097 N/A THR 262.A OG1 ILE 245.A O no hydrogen 3.386 N/A HIS 263.A N ASN 205.A O no hydrogen 3.130 N/A VAL 264.A N MET 243.A O no hydrogen 3.046 N/A ARG 266.A N HIS 263.A ND1 no hydrogen 3.075 N/A LEU 267.A N HIS 263.A O no hydrogen 3.389 N/A LEU 267.A N VAL 264.A O no hydrogen 3.026 N/A LYS 268.A N PHE 265.A O no hydrogen 3.009 N/A ILE 271.A N LEU 267.A O no hydrogen 3.231 N/A GLN 272.A N LYS 268.A O no hydrogen 2.842 N/A LYS 273.A N LYS 269.A O no hydrogen 2.681 N/A VAL 274.A N TRP 270.A O no hydrogen 2.830 N/A ILE 275.A N ILE 271.A O no hydrogen 3.215 N/A ILE 275.A N GLN 272.A O no hydrogen 2.688 N/A ASP 276.A N GLN 272.A O no hydrogen 3.153 N/A LYS 17A.A N GLU 36.A OE2 no hydrogen 2.837 N/A TYR 75A.A N LYS 80F.A O no hydrogen 2.661 N/A GLU 122A.A N ASN 119.A O no hydrogen 3.283 N/A ALA 155A.A N ARG 151.A O no hydrogen 3.267 N/A TYR 211A.A OH GLU 21E.A OE1 no hydrogen 3.377 N/A PHE 236A.A N SER 234.A OG no hydrogen 2.776 N/A SER 156B.A N GLU 152.A O no hydrogen 3.176 N/A SER 156B.A OG GLU 152.A O no hydrogen 3.091 N/A GLU 215B.A N LYS 212.A O no hydrogen 3.141 N/A ASN 237B.A N SER 234.A OG no hydrogen 3.064 N/A GLU 19C.A N ASP 16.A OD2 no hydrogen 2.977 N/A LEU 157C.A N THR 153.A O no hydrogen 3.294 N/A TRP 78D.A N TYR 75A.A O no hydrogen 3.043 N/A ASP 79E.A N PRO 76B.A O no hydrogen 2.765 N/A LEU 22F.A N THR 18B.A O no hydrogen 3.452 N/A LYS 80F.A N TYR 75A.A O no hydrogen 2.797 N/A LYS 80F.A NZ HIS 71.A O no hydrogen 2.619 N/A LEU 23G.A N GLU 19C.A O no hydrogen 2.982 N/A GLU 24H.A N ARG 20D.A O no hydrogen 2.624 N/A PHE 82H.A N LEU 73.A O no hydrogen 2.499 N/A SER 25I.A N LEU 22F.A O no hydrogen 3.012 N/A SER 25I.A OG LEU 22F.A O no hydrogen 2.927 N/A THR 83I.A N ASP 86.A OD1 no hydrogen 3.353 N/A TYR 26J.A OH LYS 163.A O no hydrogen 2.624 N/A