Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jlw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 25.A O no hydrogen 3.488 N/A MET 1.A N ASN 27.A OD1 no hydrogen 2.754 N/A PHE 3.A N ASN 27.A O no hydrogen 3.179 N/A TYR 4.A N THR 54.A O no hydrogen 2.920 N/A TYR 5.A N LYS 29.A O no hydrogen 3.103 N/A SER 9.A N LEU 6.A O no hydrogen 3.023 N/A CYS 12.A SG SER 9.A OG no hydrogen 3.219 N/A ARG 13.A N SER 9.A O no hydrogen 2.950 N/A ARG 13.A NE PRO 7.A O no hydrogen 3.335 N/A ARG 13.A NH1 ALA 170.A O no hydrogen 3.020 N/A ARG 13.A NH1 ASN 205.A OD1 no hydrogen 2.879 N/A ARG 13.A NH2 GLY 8.A O no hydrogen 3.091 N/A ARG 13.A NH2 THR 174.A OG1 no hydrogen 2.839 N/A ALA 14.A N ALA 10.A O no hydrogen 2.802 N/A VAL 15.A N PRO 11.A O no hydrogen 3.011 N/A GLN 16.A N CYS 12.A O no hydrogen 2.813 N/A MET 17.A N ARG 13.A O no hydrogen 2.952 N/A THR 18.A N ALA 14.A O no hydrogen 3.149 N/A THR 18.A OG1 ALA 14.A O no hydrogen 2.818 N/A THR 18.A OG1 GLN 70.A OE1 no hydrogen 3.390 N/A ALA 19.A N VAL 15.A O no hydrogen 2.886 N/A ALA 20.A N GLN 16.A O no hydrogen 3.104 N/A ALA 21.A N MET 17.A O no hydrogen 2.861 N/A VAL 22.A N THR 18.A O no hydrogen 3.006 N/A VAL 22.A N ALA 19.A O no hydrogen 3.237 N/A GLY 23.A N ALA 20.A O no hydrogen 3.199 N/A VAL 24.A N ALA 19.A O no hydrogen 2.828 N/A ASN 27.A N MET 1.A O no hydrogen 2.902 N/A LYS 29.A N PHE 3.A O no hydrogen 2.947 N/A THR 31.A N TYR 5.A O no hydrogen 2.766 N/A THR 31.A OG1 LYS 29.A O no hydrogen 3.305 N/A GLY 36.A N LEU 33.A O no hydrogen 3.360 N/A GLU 37.A N MET 34.A O no hydrogen 2.878 N/A HIS 38.A N HIS 38.A ND1 no hydrogen 2.933 N/A MET 39.A N GLY 36.A O no hydrogen 2.641 N/A LYS 40.A N GLU 37.A O no hydrogen 3.402 N/A LEU 44.A N LYS 40.A O no hydrogen 2.979 N/A LYS 45.A N PRO 41.A O no hydrogen 2.937 N/A LEU 46.A N PHE 43.A O no hydrogen 2.612 N/A ASN 47.A N PHE 43.A O no hydrogen 2.842 N/A HIS 50.A N ASN 47.A O no hydrogen 2.673 N/A HIS 50.A ND1 HIS 50.A O no hydrogen 2.738 N/A CYS 51.A N ASN 47.A OD1 no hydrogen 2.919 N/A CYS 51.A SG ASN 47.A OD1 no hydrogen 3.823 N/A THR 54.A N TYR 4.A O no hydrogen 3.136 N/A THR 54.A OG1 ASN 47.A OD1 no hydrogen 3.429 N/A LEU 55.A N LEU 63.A O no hydrogen 2.600 N/A VAL 56.A N ASP 2.A O no hydrogen 2.998 N/A ASP 57.A N PHE 61.A O no hydrogen 2.561 N/A GLY 60.A N ASP 57.A O no hydrogen 2.744 N/A LEU 63.A N LEU 55.A O no hydrogen 2.714 N/A ARG 67.A NE ASP 106.A OD2 no hydrogen 3.164 N/A ARG 67.A NH1 GLU 65.A OE2 no hydrogen 3.102 N/A ARG 67.A NH2 ASP 106.A OD2 no hydrogen 2.754 N/A ALA 68.A N GLU 65.A O no hydrogen 2.972 N/A ALA 68.A N GLU 65.A OE1 no hydrogen 2.809 N/A ILE 69.A N GLU 65.A O no hydrogen 3.099 N/A GLN 70.A N SER 66.A O no hydrogen 2.748 N/A ILE 71.A N ARG 67.A O no hydrogen 3.218 N/A TYR 72.A N ALA 68.A O no hydrogen 3.019 N/A TYR 72.A OH ASP 57.A OD1 no hydrogen 2.308 N/A LEU 73.A N ILE 69.A O no hydrogen 2.752 N/A VAL 74.A N GLN 70.A O no hydrogen 3.186 N/A GLU 75.A N ILE 71.A O no hydrogen 2.822 N/A LYS 76.A N TYR 72.A O no hydrogen 2.785 N/A LYS 76.A NZ ASP 57.A OD1 no hydrogen 3.011 N/A LYS 76.A NZ TYR 72.A OH no hydrogen 3.370 N/A TYR 77.A N LEU 73.A O no hydrogen 2.805 N/A TYR 77.A OH ASP 57.A OD1 no hydrogen 3.018 N/A TYR 77.A OH GLU 58.A OE2 no hydrogen 2.893 N/A GLY 78.A N LEU 73.A O no hydrogen 2.950 N/A GLY 78.A N VAL 74.A O no hydrogen 2.940 N/A ALA 79.A N VAL 74.A O no hydrogen 2.981 N/A ASP 81.A N GLY 78.A O no hydrogen 2.920 N/A ASP 83.A N ASP 81.A OD2 no hydrogen 3.036 N/A LEU 84.A N ASP 81.A O no hydrogen 2.635 N/A LEU 84.A N ASP 81.A OD2 no hydrogen 3.222 N/A ALA 85.A N ASP 81.A O no hydrogen 3.185 N/A GLU 86.A N ALA 82.A O no hydrogen 3.202 N/A ARG 87.A N ASP 83.A O no hydrogen 3.095 N/A LEU 88.A N LEU 84.A O no hydrogen 2.827 N/A TYR 89.A N ALA 85.A O no hydrogen 2.610 N/A TYR 89.A OH HIS 100.A NE2 no hydrogen 2.770 N/A SER 91.A N GLU 86.A OE1 no hydrogen 3.264 N/A SER 91.A N GLU 86.A OE2 no hydrogen 3.083 N/A SER 91.A OG GLU 86.A OE1 no hydrogen 3.433 N/A SER 91.A OG GLU 86.A OE2 no hydrogen 2.560 N/A ARG 95.A N ASP 92.A OD2 no hydrogen 3.302 N/A ARG 96.A N ASP 92.A O no hydrogen 2.752 N/A ARG 96.A NE PRO 90.A O no hydrogen 2.748 N/A ARG 96.A NH2 TYR 89.A O no hydrogen 2.742 N/A ARG 96.A NH2 PRO 90.A O no hydrogen 3.291 N/A ALA 97.A N PRO 93.A O no hydrogen 2.916 N/A VAL 98.A N ARG 94.A O no hydrogen 3.337 N/A VAL 99.A N ARG 95.A O no hydrogen 3.162 N/A HIS 100.A N ARG 96.A O no hydrogen 2.793 N/A HIS 100.A NE2 TYR 89.A OH no hydrogen 2.770 N/A GLN 101.A N ALA 97.A O no hydrogen 2.727 N/A ARG 102.A N VAL 98.A O no hydrogen 2.952 N/A ARG 102.A NE VAL 155.A O no hydrogen 2.586 N/A ARG 102.A NH2 VAL 155.A O no hydrogen 3.318 N/A LEU 103.A N VAL 99.A O no hydrogen 2.908 N/A PHE 104.A N HIS 100.A O no hydrogen 2.904 N/A PHE 105.A N GLN 101.A O no hydrogen 2.803 N/A ASP 106.A N ARG 102.A O no hydrogen 2.781 N/A VAL 107.A N LEU 103.A O no hydrogen 3.201 N/A ALA 108.A N PHE 104.A O no hydrogen 2.962 N/A VAL 109.A N PHE 105.A O no hydrogen 2.817 N/A LEU 110.A N PHE 105.A O no hydrogen 2.879 N/A TYR 111.A N ASP 106.A O no hydrogen 2.791 N/A TYR 111.A OH TYR 119.A OH no hydrogen 2.841 N/A ARG 113.A N VAL 109.A O no hydrogen 2.915 N/A ARG 113.A NH1 SER 137.A O no hydrogen 2.972 N/A ALA 115.A N TYR 111.A O no hydrogen 2.877 N/A GLU 116.A N GLN 112.A O no hydrogen 2.893 N/A TYR 117.A N ARG 113.A O no hydrogen 3.275 N/A TYR 117.A N PHE 114.A O no hydrogen 3.254 N/A TYR 118.A N PHE 114.A O no hydrogen 3.009 N/A TYR 119.A N ALA 115.A O no hydrogen 2.692 N/A TYR 119.A OH TYR 111.A OH no hydrogen 2.841 N/A GLN 121.A N TYR 118.A O no hydrogen 2.688 N/A GLN 121.A NE2 TYR 117.A O no hydrogen 2.839 N/A ILE 122.A N TYR 118.A O no hydrogen 3.036 N/A PHE 123.A N TYR 119.A O no hydrogen 2.886 N/A LYS 126.A N PHE 123.A O no hydrogen 2.753 N/A VAL 127.A N PRO 120.A O no hydrogen 2.809 N/A GLY 133.A N ASP 131.A OD2 no hydrogen 3.277 N/A LEU 135.A N ASP 131.A O no hydrogen 3.152 N/A ARG 136.A N PRO 132.A O no hydrogen 2.993 N/A SER 137.A N GLY 133.A O no hydrogen 3.022 N/A MET 138.A N ARG 134.A O no hydrogen 2.927 N/A GLU 139.A N LEU 135.A O no hydrogen 2.812 N/A GLN 140.A N ARG 136.A O no hydrogen 2.738 N/A ALA 141.A N SER 137.A O no hydrogen 3.292 N/A LEU 142.A N MET 138.A O no hydrogen 3.317 N/A GLU 143.A N GLU 139.A O no hydrogen 2.909 N/A PHE 144.A N GLN 140.A O no hydrogen 2.952 N/A LEU 145.A N ALA 141.A O no hydrogen 3.040 N/A ASN 146.A N LEU 142.A O no hydrogen 2.788 N/A ASN 146.A ND2 GLU 186.A OE2 no hydrogen 3.415 N/A THR 147.A N GLU 143.A O no hydrogen 2.904 N/A THR 147.A OG1 GLU 143.A O no hydrogen 2.924 N/A PHE 148.A N PHE 144.A O no hydrogen 2.836 N/A LEU 149.A N LEU 145.A O no hydrogen 3.062 N/A GLU 150.A N THR 147.A O no hydrogen 2.939 N/A GLU 152.A N LEU 149.A O no hydrogen 2.891 N/A VAL 155.A N ASP 165.A OD1 no hydrogen 3.040 N/A GLY 157.A N TYR 154.A O no hydrogen 2.679 N/A THR 162.A N ASP 165.A OD2 no hydrogen 2.753 N/A THR 162.A OG1 ASP 165.A OD2 no hydrogen 3.383 N/A ILE 163.A N LEU 88.A O no hydrogen 2.857 N/A ALA 164.A N THR 162.A OG1 no hydrogen 3.114 N/A ASP 165.A N THR 162.A O no hydrogen 2.875 N/A LEU 166.A N THR 162.A O no hydrogen 3.347 N/A SER 167.A N ILE 163.A O no hydrogen 3.072 N/A SER 167.A OG ASP 106.A OD2 no hydrogen 2.592 N/A ILE 168.A N ALA 164.A O no hydrogen 2.964 N/A LEU 169.A N ASP 165.A O no hydrogen 2.658 N/A ALA 170.A N LEU 166.A O no hydrogen 3.051 N/A ALA 170.A N SER 167.A O no hydrogen 3.044 N/A THR 171.A N SER 167.A O no hydrogen 3.162 N/A THR 171.A OG1 ASP 106.A OD1 no hydrogen 2.589 N/A THR 171.A OG1 ASP 106.A OD2 no hydrogen 3.404 N/A THR 171.A OG1 SER 167.A O no hydrogen 3.453 N/A ILE 172.A N ILE 168.A O no hydrogen 2.805 N/A ALA 173.A N LEU 169.A O no hydrogen 3.095 N/A THR 174.A N ALA 170.A O no hydrogen 3.292 N/A THR 174.A N THR 171.A O no hydrogen 2.872 N/A THR 174.A OG1 ALA 170.A O no hydrogen 2.887 N/A TYR 175.A N THR 171.A O no hydrogen 3.092 N/A TYR 175.A OH LEU 110.A O no hydrogen 2.626 N/A GLU 176.A N ILE 172.A O no hydrogen 3.020 N/A VAL 177.A N ALA 173.A O no hydrogen 3.278 N/A ALA 178.A N THR 174.A O no hydrogen 3.053 N/A GLY 179.A N GLU 176.A O no hydrogen 2.659 N/A TYR 180.A N TYR 175.A O no hydrogen 3.324 N/A TYR 180.A OH GLU 139.A OE2 no hydrogen 3.295 N/A ARG 184.A N ASP 181.A O no hydrogen 3.225 N/A TYR 185.A N LEU 182.A O no hydrogen 2.922 N/A ASN 187.A N GLU 186.A OE2 no hydrogen 3.259 N/A ASN 187.A ND2 ASN 146.A O no hydrogen 2.791 N/A VAL 188.A N ASN 146.A OD1 no hydrogen 3.232 N/A GLN 189.A N TYR 185.A O no hydrogen 2.902 N/A ARG 190.A N GLU 186.A O no hydrogen 2.758 N/A ARG 190.A NH1 GLN 153.A O no hydrogen 3.274 N/A ARG 190.A NH2 GLN 153.A O no hydrogen 2.662 N/A TRP 191.A N ASN 187.A O no hydrogen 2.760 N/A TRP 191.A NE1 ASP 165.A OD1 no hydrogen 2.841 N/A TYR 192.A N VAL 188.A O no hydrogen 2.735 N/A TYR 192.A OH GLU 176.A OE1 no hydrogen 2.824 N/A GLU 193.A N GLN 189.A O no hydrogen 3.108 N/A ARG 194.A N ARG 190.A O no hydrogen 3.062 N/A THR 195.A N TRP 191.A O no hydrogen 2.765 N/A THR 195.A OG1 TRP 191.A O no hydrogen 2.651 N/A SER 196.A N TYR 192.A O no hydrogen 2.884 N/A SER 196.A OG TYR 192.A O no hydrogen 2.430 N/A ALA 197.A N ARG 194.A O no hydrogen 2.873 N/A ILE 198.A N THR 195.A O no hydrogen 3.083 N/A VAL 199.A N THR 195.A O no hydrogen 3.115 N/A ALA 202.A N VAL 199.A O no hydrogen 3.236 N/A LYS 204.A N GLY 201.A O no hydrogen 2.745 N/A ASN 205.A N GLY 201.A O no hydrogen 3.130 N/A ASN 205.A ND2 LEU 169.A O no hydrogen 3.396 N/A VAL 206.A N ALA 202.A O no hydrogen 2.921 N/A GLU 207.A N ASP 203.A O no hydrogen 3.075 N/A GLY 208.A N LYS 204.A O no hydrogen 2.790 N/A ALA 209.A N ASN 205.A O no hydrogen 2.746 N/A LYS 210.A N VAL 206.A O no hydrogen 2.883 N/A VAL 211.A N GLU 207.A O no hydrogen 3.158 N/A PHE 212.A N GLY 208.A O no hydrogen 3.058 N/A GLY 213.A N ALA 209.A O no hydrogen 3.033 N/A ARG 214.A N VAL 211.A O no hydrogen 2.852 N/A TYR 215.A N PHE 212.A O no hydrogen 2.904 N/A PHE 216.A N GLY 213.A O no hydrogen 2.685 N/A THR 217.A OG1 ARG 214.A O no hydrogen 3.249 N/A