Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1thu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASN 40.A OD1 no hydrogen 3.046 N/A ALA 1.A N VAL 41.A O no hydrogen 3.019 N/A PHE 3.A N ILE 39.A O no hydrogen 3.078 N/A GLU 4.A N TYR 199.A O no hydrogen 2.955 N/A ILE 5.A N TRP 37.A O no hydrogen 3.222 N/A VAL 6.A N VAL 201.A O no hydrogen 2.617 N/A ASN 7.A N GLU 35.A O no hydrogen 2.765 N/A ASN 7.A ND2 TYR 11.A O no hydrogen 3.054 N/A ASN 7.A ND2 LEU 31.A O no hydrogen 3.472 N/A ARG 8.A N PHE 203.A O no hydrogen 2.799 N/A CYS 9.A N ASN 7.A OD1 no hydrogen 2.687 N/A CYS 9.A SG TYR 11.A OH no hydrogen 3.812 N/A THR 12.A OG1 LEU 31.A O no hydrogen 3.415 N/A VAL 13.A N LEU 31.A O no hydrogen 3.510 N/A TRP 14.A N ARG 53.A O no hydrogen 3.256 N/A ALA 16.A N TRP 51.A O no hydrogen 2.477 N/A ALA 17.A N GLY 27.A O no hydrogen 2.891 N/A SER 18.A N LYS 49.A O no hydrogen 3.126 N/A SER 18.A OG ALA 22.A O no hydrogen 2.434 N/A LYS 19.A N ALA 22.A O no hydrogen 2.823 N/A GLY 20.A N SER 18.A OG no hydrogen 3.267 N/A LEU 24.A N ALA 17.A O no hydrogen 3.067 N/A GLY 27.A N LEU 24.A O no hydrogen 3.112 N/A GLY 28.A N ALA 26.A O no hydrogen 2.870 N/A ARG 29.A N ALA 15.A O no hydrogen 3.527 N/A LEU 31.A N VAL 13.A O no hydrogen 2.727 N/A ASN 32.A ND2 THR 12.A OG1 no hydrogen 3.397 N/A GLY 34.A N ASN 7.A O no hydrogen 2.834 N/A ILE 39.A N PHE 3.A O no hydrogen 3.240 N/A VAL 41.A N ALA 1.A O no hydrogen 2.442 N/A THR 45.A N GLU 42.A O no hydrogen 2.770 N/A THR 45.A OG1 GLU 42.A O no hydrogen 2.699 N/A GLY 47.A N SER 91.A OG no hydrogen 3.317 N/A LYS 49.A N SER 18.A O no hydrogen 2.712 N/A LYS 49.A NZ GLY 47.A O no hydrogen 3.155 N/A LYS 49.A NZ GLY 48.A O no hydrogen 3.020 N/A ILE 50.A N ALA 88.A O no hydrogen 2.699 N/A TRP 51.A N ALA 16.A O no hydrogen 3.253 N/A TRP 51.A NE1 GLY 69.A O no hydrogen 2.805 N/A ARG 53.A N TRP 14.A O no hydrogen 2.896 N/A ARG 53.A NE TRP 14.A O no hydrogen 3.192 N/A THR 54.A N THR 68.A OG1 no hydrogen 2.700 N/A THR 54.A OG1 THR 68.A OG1 no hydrogen 2.395 N/A TYR 57.A N ILE 65.A O no hydrogen 2.950 N/A ASP 59.A N ASP 59.A OD1 no hydrogen 2.309 N/A SER 63.A OG ASP 59.A OD1 no hydrogen 2.263 N/A ILE 65.A N TYR 57.A O no hydrogen 3.026 N/A LYS 67.A N ASP 55.A O no hydrogen 3.149 N/A THR 68.A N THR 54.A O no hydrogen 3.337 N/A THR 68.A OG1 THR 54.A OG1 no hydrogen 2.395 N/A THR 68.A OG1 ASN 109.A OD1 no hydrogen 3.023 N/A CYS 71.A SG CYS 71.A O no hydrogen 2.672 N/A CYS 71.A SG LEU 74.A O no hydrogen 3.063 N/A CYS 77.A N LEU 75.A O no hydrogen 2.944 N/A CYS 77.A SG LEU 74.A O no hydrogen 3.753 N/A CYS 77.A SG LEU 75.A O no hydrogen 3.773 N/A LYS 78.A NZ ARG 76.A O no hydrogen 2.724 N/A ARG 82.A N ASP 70.A O no hydrogen 2.945 N/A ARG 82.A NH2 LYS 67.A O no hydrogen 2.271 N/A THR 85.A N LYS 106.A O no hydrogen 2.754 N/A THR 86.A OG1 VAL 110.A O no hydrogen 2.761 N/A LEU 87.A N SER 103.A O no hydrogen 2.692 N/A ALA 88.A N ILE 50.A O no hydrogen 3.021 N/A GLU 89.A N ASP 101.A O no hydrogen 2.630 N/A PHE 90.A N GLY 48.A O no hydrogen 3.154 N/A SER 91.A N TYR 99.A O no hydrogen 3.096 N/A LEU 92.A N THR 45.A O no hydrogen 2.867 N/A ASN 93.A N ASP 98.A OD1 no hydrogen 2.931 N/A GLN 94.A N LYS 97.A O no hydrogen 2.706 N/A GLN 94.A NE2 GLY 44.A O no hydrogen 3.113 N/A GLN 94.A NE2 LEU 92.A O no hydrogen 2.429 N/A TYR 95.A N ASN 93.A O no hydrogen 2.955 N/A LYS 97.A N TYR 95.A O no hydrogen 2.700 N/A TYR 99.A N SER 91.A O no hydrogen 2.736 N/A ILE 100.A N VAL 191.A O no hydrogen 3.119 N/A SER 103.A N LEU 87.A O no hydrogen 2.449 N/A ASN 104.A N PHE 181.A O no hydrogen 2.751 N/A ASN 104.A ND2 GLY 107.A O no hydrogen 2.701 N/A ILE 105.A N SER 103.A OG no hydrogen 3.198 N/A LYS 106.A NZ GLY 81.A O no hydrogen 2.493 N/A GLY 107.A N ASN 104.A O no hydrogen 2.298 N/A PHE 108.A N CYS 145.A O no hydrogen 3.262 N/A ASN 109.A N THR 86.A OG1 no hydrogen 3.345 N/A ASP 113.A N THR 202.A O no hydrogen 2.593 N/A PHE 114.A N VAL 124.A O no hydrogen 3.370 N/A SER 115.A N ARG 200.A O no hydrogen 2.777 N/A SER 115.A OG ASP 113.A OD2 no hydrogen 2.945 N/A THR 117.A N ASN 198.A O no hydrogen 2.624 N/A VAL 124.A N PHE 114.A O no hydrogen 2.771 N/A ARG 125.A NH1 ASP 113.A OD1 no hydrogen 2.988 N/A CYS 126.A N MET 112.A O no hydrogen 3.011 N/A CYS 126.A SG ASN 104.A OD1 no hydrogen 3.443 N/A GLY 132.A N ASP 129.A OD1 no hydrogen 2.634 N/A GLN 133.A N ASP 129.A O no hydrogen 3.005 N/A GLN 133.A N ILE 130.A O no hydrogen 2.719 N/A CYS 134.A N VAL 131.A O no hydrogen 3.316 N/A CYS 134.A SG PRO 135.A O no hydrogen 3.430 N/A LYS 137.A NZ TYR 169.A OH no hydrogen 3.388 N/A LEU 138.A N PRO 135.A O no hydrogen 2.347 N/A CYS 145.A N PHE 108.A O no hydrogen 2.746 N/A CYS 145.A SG LEU 138.A O no hydrogen 4.029 N/A CYS 145.A SG ASN 146.A O no hydrogen 3.759 N/A ASN 146.A N LEU 138.A O no hydrogen 2.755 N/A ASN 146.A ND2 THR 150.A O no hydrogen 3.346 N/A THR 150.A N ASP 147.A OD1 no hydrogen 3.106 N/A THR 150.A OG1 ASP 147.A OD2 no hydrogen 2.248 N/A VAL 151.A N ALA 148.A O no hydrogen 2.669 N/A PHE 152.A N CYS 149.A O no hydrogen 3.173 N/A GLN 153.A N CYS 149.A O no hydrogen 2.757 N/A CYS 158.A N THR 154.A O no hydrogen 2.782 N/A CYS 158.A N SER 155.A O no hydrogen 2.465 N/A CYS 158.A SG THR 154.A O no hydrogen 3.267 N/A CYS 159.A N GLU 156.A O no hydrogen 2.984 N/A THR 160.A N SER 155.A O no hydrogen 3.297 N/A THR 160.A OG1 THR 154.A O no hydrogen 3.527 N/A THR 160.A OG1 SER 155.A O no hydrogen 2.680 N/A THR 161.A N CYS 159.A O no hydrogen 2.510 N/A THR 161.A OG1 LYS 163.A O no hydrogen 2.520 N/A LYS 163.A NZ CYS 164.A O no hydrogen 2.462 N/A CYS 164.A SG LYS 163.A O no hydrogen 3.683 N/A THR 167.A N SER 170.A OG no hydrogen 2.785 N/A THR 167.A OG1 SER 170.A OG no hydrogen 3.087 N/A SER 170.A N THR 167.A OG1 no hydrogen 2.892 N/A SER 170.A OG THR 167.A O no hydrogen 3.112 N/A SER 170.A OG THR 167.A OG1 no hydrogen 3.087 N/A ARG 171.A N THR 167.A O no hydrogen 3.226 N/A PHE 172.A N TYR 169.A O no hydrogen 2.621 N/A LYS 174.A N SER 170.A O no hydrogen 3.143 N/A LYS 174.A NZ ASP 186.A OD1 no hydrogen 3.524 N/A ARG 175.A N ARG 171.A O no hydrogen 2.730 N/A LEU 176.A N PHE 172.A O no hydrogen 2.869 N/A CYS 177.A N PHE 173.A O no hydrogen 2.185 N/A ALA 180.A N CYS 177.A O no hydrogen 3.351 N/A PHE 181.A N ILE 102.A O no hydrogen 3.094 N/A SER 182.A N ASP 186.A OD2 no hydrogen 2.666 N/A SER 182.A OG ASP 186.A OD2 no hydrogen 2.187 N/A VAL 191.A N ILE 100.A O no hydrogen 3.102 N/A CYS 193.A N ASP 98.A O no hydrogen 3.060 N/A CYS 193.A SG VAL 191.A O no hydrogen 4.011 N/A SER 196.A OG ASN 93.A OD1 no hydrogen 3.151 N/A SER 197.A N ASP 98.A OD2 no hydrogen 3.232 N/A SER 197.A N PRO 194.A O no hydrogen 3.406 N/A SER 197.A OG ASP 98.A OD2 no hydrogen 2.866 N/A SER 197.A OG PRO 194.A O no hydrogen 2.634 N/A SER 197.A OG TYR 199.A OH no hydrogen 3.006 N/A ASN 198.A N THR 118.A OG1 no hydrogen 2.875 N/A TYR 199.A N THR 2.A O no hydrogen 3.010 N/A TYR 199.A OH ASP 98.A OD2 no hydrogen 2.694 N/A ARG 200.A N SER 115.A O no hydrogen 2.529 N/A ARG 200.A NE GLU 4.A OE1 no hydrogen 2.597 N/A ARG 200.A NH2 GLU 4.A OE1 no hydrogen 3.338 N/A VAL 201.A N GLU 4.A O no hydrogen 2.671 N/A THR 202.A N ASP 113.A O no hydrogen 2.303 N/A PHE 203.A N VAL 6.A O no hydrogen 2.961 N/A CYS 204.A N PRO 111.A O no hydrogen 2.828 N/A