Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1orb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N TYR 261.A OH no hydrogen 3.150 N/A ARG 7.A NH2 TYR 6.A OH no hydrogen 3.304 N/A VAL 10.A N VAL 125.A O no hydrogen 3.318 N/A THR 12.A OG1 GLU 136.A OE1 no hydrogen 3.330 N/A TRP 14.A N SER 11.A OG no hydrogen 3.406 N/A LEU 15.A N SER 11.A O no hydrogen 3.020 N/A ALA 16.A N THR 12.A O no hydrogen 2.798 N/A GLU 17.A N LYS 13.A O no hydrogen 2.874 N/A SER 18.A N TRP 14.A O no hydrogen 3.222 N/A SER 18.A OG TRP 14.A O no hydrogen 2.445 N/A VAL 19.A N LEU 15.A O no hydrogen 3.111 N/A ARG 20.A N ALA 16.A O no hydrogen 2.962 N/A ALA 21.A N GLU 17.A O no hydrogen 2.707 N/A GLY 22.A N VAL 19.A O no hydrogen 2.483 N/A LYS 23.A N SER 18.A O no hydrogen 2.432 N/A GLY 25.A N LEU 28.A O no hydrogen 2.671 N/A LEU 28.A N GLY 25.A O no hydrogen 2.662 N/A ARG 29.A NE GLY 88.A O no hydrogen 2.492 N/A ARG 29.A NH2 GLY 88.A O no hydrogen 3.478 N/A LEU 31.A N VAL 96.A O no hydrogen 2.745 N/A ASP 32.A N SER 56.A O no hydrogen 2.946 N/A ALA 33.A N TYR 98.A O no hydrogen 2.551 N/A SER 34.A N ASP 32.A OD1 no hydrogen 2.993 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.701 N/A TRP 35.A NE1 GLU 61.A OE2 no hydrogen 3.049 N/A THR 40.A N SER 37.A O no hydrogen 3.171 N/A THR 40.A OG1 SER 37.A O no hydrogen 2.451 N/A ARG 41.A NH1 GLU 46.A OE1 no hydrogen 2.370 N/A ARG 41.A NH1 GLU 46.A OE2 no hydrogen 3.358 N/A ARG 41.A NH2 GLY 100.A O no hydrogen 3.013 N/A LYS 45.A NZ GLU 49.A OE2 no hydrogen 3.433 N/A GLU 46.A N GLU 42.A O no hydrogen 2.830 N/A TYR 47.A N ALA 43.A O no hydrogen 2.807 N/A TYR 47.A OH ALA 55.A O no hydrogen 2.834 N/A LEU 48.A N ARG 44.A O no hydrogen 2.960 N/A GLU 49.A N LYS 45.A O no hydrogen 3.099 N/A ARG 50.A N GLU 46.A O no hydrogen 3.164 N/A HIS 51.A N THR 141.A O no hydrogen 3.046 N/A VAL 52.A N TYR 98.A OH no hydrogen 3.140 N/A ALA 55.A N VAL 52.A O no hydrogen 2.745 N/A SER 56.A N VAL 30.A O no hydrogen 3.041 N/A PHE 58.A N ASP 32.A O no hydrogen 2.554 N/A ASP 59.A N TYR 83.A OH no hydrogen 2.788 N/A GLU 61.A N ASP 59.A OD1 no hydrogen 2.988 N/A GLU 62.A N ASP 59.A O no hydrogen 2.734 N/A CYS 63.A N ASP 59.A O no hydrogen 2.914 N/A ARG 64.A N GLU 62.A O no hydrogen 3.009 N/A ARG 64.A NE GLU 61.A O no hydrogen 3.092 N/A ASP 65.A N MET 73.A O no hydrogen 2.715 N/A LYS 66.A NZ GLU 62.A OE2 no hydrogen 2.798 N/A ALA 67.A N ASP 65.A OD1 no hydrogen 3.021 N/A SER 68.A N ASP 65.A O no hydrogen 2.915 N/A LEU 74.A N ASP 272.A OD2 no hydrogen 2.999 N/A GLY 79.A N SER 76.A OG no hydrogen 2.891 N/A PHE 80.A N SER 76.A O no hydrogen 2.773 N/A ALA 81.A N GLU 77.A O no hydrogen 2.741 N/A ASP 82.A N ALA 78.A O no hydrogen 2.899 N/A TYR 83.A N GLY 79.A O no hydrogen 3.100 N/A VAL 84.A N PHE 80.A O no hydrogen 3.019 N/A GLY 85.A N ALA 81.A O no hydrogen 2.897 N/A SER 86.A N ASP 82.A O no hydrogen 2.990 N/A SER 86.A OG TYR 83.A O no hydrogen 2.983 N/A LEU 87.A N VAL 84.A O no hydrogen 3.012 N/A GLY 88.A N GLY 85.A O no hydrogen 2.755 N/A ILE 89.A N VAL 84.A O no hydrogen 3.251 N/A ASN 91.A ND2 ILE 151.A O no hydrogen 3.436 N/A ASP 92.A N SER 90.A OG no hydrogen 3.261 N/A THR 93.A N SER 90.A O no hydrogen 2.841 N/A HIS 94.A N GLY 27.A O no hydrogen 2.698 N/A HIS 94.A NE2 SER 124.A OG no hydrogen 2.742 N/A VAL 95.A N THR 122.A O no hydrogen 2.959 N/A VAL 96.A N ARG 29.A O no hydrogen 3.016 N/A VAL 97.A N SER 124.A O no hydrogen 2.751 N/A TYR 98.A N LEU 31.A O no hydrogen 2.763 N/A GLY 100.A N SER 34.A OG no hydrogen 2.554 N/A ASP 101.A N ASP 99.A OD1 no hydrogen 3.050 N/A LEU 103.A N ASP 101.A OD2 no hydrogen 2.843 N/A GLY 104.A N ASP 101.A O no hydrogen 3.067 N/A PHE 106.A N ASP 99.A OD2 no hydrogen 2.802 N/A ALA 108.A N ASP 99.A OD2 no hydrogen 2.768 N/A ARG 110.A N TYR 107.A O no hydrogen 3.034 N/A ARG 110.A NE GLY 250.A O no hydrogen 2.948 N/A ARG 110.A NH2 GLY 250.A O no hydrogen 2.807 N/A ARG 110.A NH2 ASP 272.A OD1 no hydrogen 2.411 N/A VAL 111.A N TYR 107.A O no hydrogen 3.375 N/A TRP 112.A N ALA 108.A O no hydrogen 2.911 N/A TRP 113.A N PRO 109.A O no hydrogen 2.713 N/A TRP 113.A NE1 LEU 160.A O no hydrogen 3.229 N/A MET 114.A N ARG 110.A O no hydrogen 2.835 N/A PHE 115.A N VAL 111.A O no hydrogen 2.949 N/A ARG 116.A N TRP 112.A O no hydrogen 3.377 N/A ARG 116.A NH2 PRO 266.A O no hydrogen 3.001 N/A VAL 117.A N TRP 113.A O no hydrogen 2.997 N/A PHE 118.A N PHE 115.A O no hydrogen 2.898 N/A GLY 119.A N ARG 116.A O no hydrogen 3.004 N/A HIS 120.A N PHE 115.A O no hydrogen 3.130 N/A HIS 120.A NE2 THR 93.A O no hydrogen 2.665 N/A THR 122.A OG1 THR 93.A O no hydrogen 3.284 N/A THR 122.A OG1 HIS 120.A NE2 no hydrogen 3.126 N/A SER 124.A N VAL 95.A O no hydrogen 2.617 N/A SER 124.A OG ARG 7.A O no hydrogen 3.055 N/A VAL 125.A N ALA 8.A O no hydrogen 3.107 N/A LEU 126.A N VAL 97.A O no hydrogen 2.962 N/A ASN 127.A N VAL 10.A O no hydrogen 2.942 N/A GLY 129.A N LEU 126.A O no hydrogen 3.318 N/A PHE 130.A N ASP 99.A O no hydrogen 3.106 N/A ARG 131.A NH1 ASP 102.A O no hydrogen 2.874 N/A ARG 131.A NH1 GLU 218.A O no hydrogen 3.467 N/A ARG 131.A NH2 GLU 218.A O no hydrogen 3.325 N/A ASN 132.A N GLY 128.A O no hydrogen 2.707 N/A TRP 133.A N GLY 129.A O no hydrogen 2.939 N/A TRP 133.A NE1 PRO 139.A O no hydrogen 2.797 N/A LEU 134.A N PHE 130.A O no hydrogen 2.834 N/A LYS 135.A N ARG 131.A O no hydrogen 2.883 N/A GLU 136.A N ASN 132.A O no hydrogen 2.952 N/A GLU 136.A N TRP 133.A O no hydrogen 3.179 N/A GLY 137.A N LEU 134.A O no hydrogen 2.816 N/A HIS 138.A N TRP 133.A O no hydrogen 3.285 N/A THR 141.A N HIS 51.A O no hydrogen 3.230 N/A SER 145.A OG ALA 55.A O no hydrogen 2.605 N/A ARG 146.A NE SER 145.A O no hydrogen 3.279 N/A ALA 150.A N GLY 85.A O no hydrogen 3.048 N/A LYS 153.A N ASN 91.A OD1 no hydrogen 2.619 N/A THR 155.A N PHE 118.A O no hydrogen 2.304 N/A LEU 156.A N GLU 77.A OE2 no hydrogen 2.612 N/A ASN 157.A N VAL 117.A O no hydrogen 2.768 N/A ARG 158.A NH1 ARG 158.A O no hydrogen 3.538 N/A LEU 160.A N ASN 157.A O no hydrogen 2.844 N/A LYS 162.A N ILE 270.A O no hydrogen 3.114 N/A GLN 166.A NE2 LEU 161.A O no hydrogen 3.367 N/A VAL 167.A N THR 163.A O no hydrogen 2.744 N/A LEU 168.A N TYR 164.A O no hydrogen 2.712 N/A GLU 169.A N GLU 165.A O no hydrogen 2.897 N/A ASN 170.A N GLN 166.A O no hydrogen 3.172 N/A ASN 170.A ND2 PHE 176.A O no hydrogen 3.675 N/A LEU 171.A N LEU 168.A O no hydrogen 2.632 N/A GLU 172.A N GLU 169.A O no hydrogen 2.721 N/A SER 173.A N GLU 169.A O no hydrogen 2.808 N/A LYS 174.A N ASN 170.A O no hydrogen 2.874 N/A ARG 175.A N SER 173.A OG no hydrogen 3.176 N/A GLN 177.A N PRO 242.A O no hydrogen 2.621 N/A GLN 177.A NE2 ASP 238.A O no hydrogen 3.319 N/A GLN 177.A NE2 PRO 242.A O no hydrogen 3.031 N/A VAL 179.A N ILE 244.A O no hydrogen 2.828 N/A ASP 180.A N VAL 208.A O no hydrogen 2.574 N/A SER 181.A N THR 246.A O no hydrogen 3.068 N/A SER 181.A OG THR 252.A O no hydrogen 2.772 N/A SER 181.A OG THR 252.A OG1 no hydrogen 3.104 N/A ARG 182.A N ASP 180.A OD1 no hydrogen 3.080 N/A ARG 182.A NE ASP 180.A OD1 no hydrogen 3.018 N/A ARG 182.A NH1 GLU 193.A OE2 no hydrogen 2.733 N/A ARG 182.A NH1 GLY 202.A O no hydrogen 3.266 N/A ARG 182.A NH2 ASP 180.A OD2 no hydrogen 3.063 N/A ARG 182.A NH2 GLY 202.A O no hydrogen 2.555 N/A ARG 186.A NE GLU 193.A OE2 no hydrogen 2.634 N/A ARG 186.A NH2 GLU 193.A OE1 no hydrogen 2.544 N/A TYR 187.A N ALA 183.A O no hydrogen 2.901 N/A TYR 187.A OH SER 207.A O no hydrogen 3.187 N/A LEU 188.A N GLN 184.A O no hydrogen 2.669 N/A GLY 189.A N GLY 185.A O no hydrogen 2.995 N/A GLN 191.A N GLY 185.A O no hydrogen 3.356 N/A SER 201.A N ASP 200.A OD1 no hydrogen 3.081 N/A SER 201.A OG GLN 191.A O no hydrogen 2.338 N/A GLY 202.A N ARG 186.A O no hydrogen 3.067 N/A HIS 203.A N VAL 288.A O no hydrogen 3.103 N/A HIS 203.A ND1 TYR 187.A O no hydrogen 2.651 N/A ARG 205.A N THR 286.A O no hydrogen 2.818 N/A SER 207.A OG ILE 204.A O no hydrogen 2.682 N/A VAL 208.A N LEU 178.A O no hydrogen 2.566 N/A MET 210.A N ASP 180.A O no hydrogen 2.543 N/A PHE 212.A N SER 181.A O no hydrogen 3.045 N/A ASN 214.A N PRO 211.A O no hydrogen 2.742 N/A PHE 215.A N PHE 212.A O no hydrogen 3.017 N/A LEU 216.A N MET 213.A O no hydrogen 3.370 N/A THR 217.A N PHE 221.A O no hydrogen 2.861 N/A THR 217.A OG1 PHE 221.A O no hydrogen 3.363 N/A GLY 220.A N THR 217.A O no hydrogen 2.464 N/A GLU 222.A N ASN 127.A OD1 no hydrogen 2.678 N/A LYS 223.A N PHE 215.A O no hydrogen 3.031 N/A LYS 223.A NZ ASN 214.A O no hydrogen 2.912 N/A SER 224.A N GLU 227.A OE2 no hydrogen 3.261 N/A SER 224.A OG GLU 226.A OE1 no hydrogen 2.651 N/A LEU 228.A N SER 224.A O no hydrogen 2.870 N/A ARG 229.A N PRO 225.A O no hydrogen 2.800 N/A ARG 229.A NH1 CYS 263.A O no hydrogen 3.221 N/A ALA 230.A N GLU 226.A O no hydrogen 3.180 N/A MET 231.A N GLU 227.A O no hydrogen 3.124 N/A PHE 232.A N LEU 228.A O no hydrogen 2.968 N/A GLU 233.A N ARG 229.A O no hydrogen 3.103 N/A ALA 234.A N ALA 230.A O no hydrogen 2.723 N/A LYS 235.A N MET 231.A O no hydrogen 3.172 N/A LYS 235.A NZ ASN 209.A O no hydrogen 2.835 N/A LYS 236.A N GLU 233.A O no hydrogen 2.729 N/A VAL 237.A N PHE 232.A O no hydrogen 2.833 N/A ASP 238.A N GLN 177.A OE1 no hydrogen 2.602 N/A THR 240.A N ASP 238.A OD1 no hydrogen 2.818 N/A LYS 241.A N ASP 238.A O no hydrogen 2.840 N/A ILE 244.A N GLN 177.A O no hydrogen 2.647 N/A ALA 245.A N ALA 269.A O no hydrogen 3.001 N/A THR 246.A N VAL 179.A O no hydrogen 3.018 N/A CYS 247.A N SER 274.A OG no hydrogen 3.143 N/A CYS 247.A SG SER 181.A OG no hydrogen 3.247 N/A CYS 247.A SG THR 252.A OG1 no hydrogen 3.261 N/A ARG 248.A NE GLU 193.A OE1 no hydrogen 3.316 N/A ARG 248.A NH1 GLU 71.A OE1 no hydrogen 3.330 N/A ARG 248.A NH1 GLU 71.A OE2 no hydrogen 2.653 N/A ARG 248.A NH2 GLU 193.A OE1 no hydrogen 3.241 N/A ARG 248.A NH2 PRO 194.A O no hydrogen 2.300 N/A THR 252.A OG1 SER 181.A OG no hydrogen 3.104 N/A CYS 254.A N VAL 251.A O no hydrogen 3.120 N/A CYS 254.A SG GLY 250.A O no hydrogen 3.826 N/A HIS 255.A N THR 252.A O no hydrogen 3.082 N/A HIS 255.A NE2 SER 105.A O no hydrogen 3.039 N/A ILE 256.A N ALA 253.A O no hydrogen 2.711 N/A ALA 257.A N ALA 253.A O no hydrogen 3.381 N/A LEU 258.A N CYS 254.A O no hydrogen 3.158 N/A ALA 259.A N HIS 255.A O no hydrogen 3.171 N/A ALA 260.A N ILE 256.A O no hydrogen 2.937 N/A TYR 261.A N ALA 257.A O no hydrogen 3.050 N/A LEU 262.A N LEU 258.A O no hydrogen 3.139 N/A CYS 263.A N ALA 260.A O no hydrogen 2.713 N/A CYS 263.A SG PRO 225.A O no hydrogen 3.779 N/A CYS 263.A SG ALA 259.A O no hydrogen 3.682 N/A GLY 264.A N TYR 261.A O no hydrogen 2.946 N/A LYS 265.A N ALA 260.A O no hydrogen 2.863 N/A LYS 265.A NZ ASP 267.A OD1 no hydrogen 2.581 N/A LYS 265.A NZ ASP 267.A OD2 no hydrogen 3.540 N/A ALA 269.A N LEU 243.A O no hydrogen 3.026 N/A ILE 270.A N LEU 160.A O no hydrogen 2.898 N/A TYR 271.A N ALA 245.A O no hydrogen 2.809 N/A TYR 271.A OH GLU 277.A OE1 no hydrogen 2.435 N/A SER 274.A OG TYR 271.A O no hydrogen 3.004 N/A TRP 275.A N CYS 247.A O no hydrogen 3.167 N/A TRP 275.A NE1 ASP 200.A O no hydrogen 2.868 N/A PHE 276.A N ARG 248.A O no hydrogen 3.042 N/A GLU 277.A N GLY 273.A O no hydrogen 3.303 N/A TRP 278.A N SER 274.A O no hydrogen 3.068 N/A TRP 278.A NE1 THR 286.A OG1 no hydrogen 3.080 N/A PHE 279.A N TRP 275.A O no hydrogen 2.763 N/A HIS 280.A N PHE 276.A O no hydrogen 3.398 N/A HIS 280.A ND1 PHE 276.A O no hydrogen 2.771 N/A ARG 281.A N GLU 277.A O no hydrogen 2.777 N/A ARG 281.A N TRP 278.A O no hydrogen 2.830 N/A ARG 281.A NH1 GLU 277.A OE2 no hydrogen 3.223 N/A ALA 282.A N TRP 278.A O no hydrogen 2.735 N/A GLU 285.A N GLU 285.A OE1 no hydrogen 2.601 N/A THR 286.A N PRO 283.A O no hydrogen 3.085 N/A THR 286.A OG1 PRO 283.A O no hydrogen 2.736 N/A TRP 287.A N PRO 284.A O no hydrogen 3.126 N/A VAL 288.A N HIS 203.A O no hydrogen 3.141 N/A SER 289.A OG SER 201.A O no hydrogen 2.523 N/A