Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jt1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ASP 23.A OD1 no hydrogen 2.571 N/A ASN 5.A N ASP 22.A OD1 no hydrogen 2.870 N/A ASN 5.A ND2 ASP 22.A OD2 no hydrogen 3.028 N/A PHE 10.A N TYR 18.A O no hydrogen 3.330 N/A ARG 11.A NH1 GLY 14.A O no hydrogen 2.968 N/A ILE 12.A N LEU 16.A O no hydrogen 2.835 N/A ALA 13.A N LEU 16.A O no hydrogen 3.358 N/A ASN 15.A ND2 VAL 30.A O no hydrogen 2.908 N/A ASN 15.A ND2 THR 138.A OG1 no hydrogen 2.866 N/A LEU 16.A N ALA 13.A O no hydrogen 2.892 N/A TYR 17.A N LEU 28.A O no hydrogen 2.863 N/A TYR 18.A N PHE 10.A O no hydrogen 2.801 N/A TYR 18.A OH THR 21.A O no hydrogen 2.574 N/A VAL 19.A N SER 26.A O no hydrogen 2.950 N/A THR 21.A N LEU 24.A O no hydrogen 2.978 N/A THR 21.A OG1 LEU 24.A O no hydrogen 2.715 N/A ASP 22.A N ASN 5.A O no hydrogen 2.898 N/A ASP 23.A N THR 21.A OG1 no hydrogen 3.087 N/A ALA 25.A N SER 213.A O no hydrogen 3.071 N/A SER 26.A OG ASN 39.A O no hydrogen 2.706 N/A SER 26.A OG ASP 41.A OD2 no hydrogen 2.656 N/A TYR 27.A N ILE 38.A O no hydrogen 3.076 N/A TYR 27.A OH GLY 212.A O no hydrogen 2.731 N/A LEU 28.A N TYR 17.A O no hydrogen 2.796 N/A ILE 29.A N ILE 36.A O no hydrogen 2.830 N/A VAL 30.A N ASN 15.A O no hydrogen 3.052 N/A THR 31.A N GLY 34.A O no hydrogen 3.027 N/A THR 31.A OG1 GLY 34.A O no hydrogen 2.776 N/A ARG 33.A N THR 31.A OG1 no hydrogen 2.937 N/A GLY 34.A N THR 31.A O no hydrogen 3.070 N/A ASN 35.A N ASP 62.A O no hydrogen 2.792 N/A ILE 36.A N ILE 29.A O no hydrogen 2.866 N/A LEU 37.A N ILE 65.A O no hydrogen 2.888 N/A ILE 38.A N TYR 27.A O no hydrogen 2.935 N/A ASN 39.A N LEU 67.A O no hydrogen 2.732 N/A ASN 39.A ND2 ALA 25.A O no hydrogen 3.092 N/A ASN 39.A ND2 SER 69.A OG no hydrogen 2.958 N/A SER 40.A OG HIS 75.A O no hydrogen 3.288 N/A SER 40.A OG SER 79.A OG no hydrogen 2.853 N/A ASP 41.A N HIS 75.A O no hydrogen 3.123 N/A LEU 42.A N ASN 45.A OD1 no hydrogen 2.943 N/A ASN 45.A N LEU 42.A O no hydrogen 2.813 N/A VAL 46.A N GLU 43.A O no hydrogen 3.000 N/A ILE 49.A N ASN 45.A O no hydrogen 2.799 N/A LYS 50.A N VAL 46.A O no hydrogen 2.999 N/A ALA 51.A N PRO 47.A O no hydrogen 2.903 N/A SER 52.A N MET 48.A O no hydrogen 2.962 N/A SER 52.A OG MET 48.A O no hydrogen 3.256 N/A ILE 53.A N ILE 49.A O no hydrogen 2.934 N/A LYS 54.A N LYS 50.A O no hydrogen 2.995 N/A LYS 55.A N ALA 51.A O no hydrogen 2.819 N/A LEU 56.A N SER 52.A O no hydrogen 3.177 N/A GLY 57.A N LYS 54.A O no hydrogen 2.832 N/A PHE 58.A N ILE 53.A O no hydrogen 3.139 N/A ASP 62.A N LYS 59.A O no hydrogen 3.001 N/A THR 63.A N PHE 60.A O no hydrogen 3.058 N/A THR 63.A OG1 PHE 60.A O no hydrogen 2.764 N/A LYS 64.A N ASN 35.A O no hydrogen 2.849 N/A LEU 66.A N LYS 89.A O no hydrogen 2.800 N/A LEU 67.A N LEU 37.A O no hydrogen 2.870 N/A SER 69.A N ASN 39.A OD1 no hydrogen 2.748 N/A HIS 70.A ND1 GLY 172.A O no hydrogen 2.871 N/A ALA 71.A N ASP 96.A OD2 no hydrogen 3.033 N/A HIS 72.A N HIS 70.A O no hydrogen 3.024 N/A HIS 75.A N HIS 72.A O no hydrogen 3.023 N/A ALA 76.A N HIS 72.A O no hydrogen 3.079 N/A ALA 77.A N PHE 73.A O no hydrogen 3.002 N/A GLY 78.A N ASP 41.A O no hydrogen 2.819 N/A SER 79.A N ALA 76.A O no hydrogen 3.177 N/A SER 79.A OG SER 40.A OG no hydrogen 2.853 N/A SER 79.A OG ALA 76.A O no hydrogen 3.192 N/A SER 79.A OG TYR 90.A OH no hydrogen 2.808 N/A ILE 82.A N GLY 78.A O no hydrogen 3.079 N/A LYS 83.A N SER 79.A O no hydrogen 2.763 N/A LYS 83.A NZ THR 122.A O no hydrogen 2.890 N/A LYS 83.A NZ ASP 124.A OD2 no hydrogen 3.450 N/A GLN 84.A N GLU 80.A O no hydrogen 2.752 N/A GLN 85.A N LEU 81.A O no hydrogen 2.804 N/A THR 86.A N ILE 82.A O no hydrogen 2.878 N/A THR 86.A OG1 ILE 82.A O no hydrogen 2.633 N/A LYS 87.A N LYS 83.A O no hydrogen 2.695 N/A LYS 87.A NZ GLN 84.A O no hydrogen 3.146 N/A ALA 88.A N THR 86.A OG1 no hydrogen 3.103 N/A LYS 89.A N LYS 64.A O no hydrogen 2.888 N/A LYS 89.A NZ LYS 87.A O no hydrogen 3.393 N/A TYR 90.A N ASP 124.A OD2 no hydrogen 2.818 N/A MET 91.A N LEU 66.A O no hydrogen 3.070 N/A VAL 92.A N LYS 125.A O no hydrogen 3.262 N/A ASP 94.A N LEU 127.A O no hydrogen 2.782 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.809 N/A ASP 96.A N MET 93.A O no hydrogen 2.855 N/A VAL 97.A N ASP 94.A O no hydrogen 2.943 N/A SER 98.A OG SER 106.A OG no hydrogen 2.822 N/A ILE 100.A N ASP 96.A O no hydrogen 3.196 N/A LEU 101.A N VAL 97.A O no hydrogen 2.809 N/A SER 102.A N SER 98.A O no hydrogen 3.028 N/A SER 102.A OG SER 98.A O no hydrogen 2.883 N/A SER 102.A OG VAL 99.A O no hydrogen 3.425 N/A SER 102.A OG SER 106.A OG no hydrogen 3.155 N/A GLY 103.A N ILE 100.A O no hydrogen 3.132 N/A GLY 104.A N VAL 99.A O no hydrogen 2.944 N/A LYS 105.A N SER 102.A O no hydrogen 3.194 N/A SER 106.A N SER 102.A OG no hydrogen 3.073 N/A SER 106.A OG SER 98.A OG no hydrogen 2.822 N/A SER 106.A OG SER 102.A OG no hydrogen 3.155 N/A ASP 107.A N GLY 104.A O no hydrogen 3.143 N/A HIS 109.A N ASP 107.A OD1 no hydrogen 2.810 N/A TYR 110.A N ASP 107.A OD1 no hydrogen 2.770 N/A ASP 113.A N TYR 110.A O no hydrogen 2.947 N/A SER 115.A N ASP 113.A OD1 no hydrogen 3.054 N/A SER 115.A OG ASP 113.A OD1 no hydrogen 2.639 N/A SER 115.A OG ASP 113.A OD2 no hydrogen 3.476 N/A THR 116.A N ASP 113.A O no hydrogen 2.960 N/A THR 116.A OG1 TYR 110.A O no hydrogen 3.524 N/A THR 116.A OG1 ASP 113.A O no hydrogen 2.699 N/A TYR 117.A N SER 114.A O no hydrogen 3.221 N/A TYR 117.A OH ALA 111.A O no hydrogen 2.555 N/A PHE 118.A N GLY 103.A O no hydrogen 2.836 N/A THR 119.A OG1 GLU 43.A OE1 no hydrogen 3.162 N/A GLN 120.A NE2 LEU 101.A O no hydrogen 3.045 N/A SER 121.A OG GLU 80.A OE1 no hydrogen 3.109 N/A ASP 124.A N TYR 90.A O no hydrogen 2.740 N/A LYS 125.A N TYR 90.A O no hydrogen 3.218 N/A LEU 127.A N VAL 92.A O no hydrogen 2.805 N/A HIS 128.A N GLU 131.A OE2 no hydrogen 2.805 N/A HIS 128.A ND1 GLU 131.A OE2 no hydrogen 2.973 N/A GLY 130.A N ALA 142.A O no hydrogen 2.680 N/A GLU 131.A N HIS 128.A O no hydrogen 2.935 N/A VAL 133.A N LEU 140.A O no hydrogen 2.858 N/A LEU 135.A N THR 138.A O no hydrogen 3.000 N/A THR 138.A N LEU 135.A O no hydrogen 2.841 N/A LEU 140.A N VAL 133.A O no hydrogen 2.880 N/A THR 141.A N THR 156.A O no hydrogen 2.829 N/A ALA 142.A N GLU 131.A O no hydrogen 2.886 N/A HIS 143.A N THR 154.A O no hydrogen 3.006 N/A HIS 143.A NE2 THR 156.A OG1 no hydrogen 2.792 N/A LEU 144.A N ASP 129.A OD2 no hydrogen 2.841 N/A THR 145.A N CYS 152.A O no hydrogen 2.914 N/A THR 145.A OG1 CYS 152.A O no hydrogen 3.516 N/A THR 145.A OG1 THR 154.A OG1 no hydrogen 2.891 N/A GLY 147.A N THR 149.A O no hydrogen 2.973 N/A HIS 148.A ND1 GLY 175.A O no hydrogen 2.880 N/A THR 149.A OG1 ASP 96.A OD1 no hydrogen 3.251 N/A THR 149.A OG1 ASP 96.A OD2 no hydrogen 2.738 N/A ARG 150.A NH2 THR 187.A O no hydrogen 2.752 N/A GLY 151.A N ASP 96.A OD1 no hydrogen 2.913 N/A CYS 152.A N THR 149.A O no hydrogen 3.480 N/A CYS 152.A SG SER 69.A O no hydrogen 3.884 N/A CYS 152.A SG SER 173.A O no hydrogen 3.407 N/A THR 153.A N SER 69.A O no hydrogen 2.791 N/A THR 153.A OG1 GLY 151.A O no hydrogen 3.011 N/A THR 154.A N HIS 143.A O no hydrogen 2.843 N/A THR 154.A OG1 THR 145.A OG1 no hydrogen 2.891 N/A TRP 155.A N ILE 170.A O no hydrogen 3.167 N/A TRP 155.A NE1 ILE 68.A O no hydrogen 2.974 N/A THR 156.A N THR 141.A O no hydrogen 3.088 N/A THR 156.A OG1 HIS 143.A NE2 no hydrogen 2.792 N/A MET 157.A N ALA 168.A O no hydrogen 3.099 N/A LEU 159.A N TYR 166.A O no hydrogen 2.950 N/A ASP 161.A N LYS 164.A O no hydrogen 2.706 N/A LYS 164.A N ASP 161.A O no hydrogen 2.826 N/A TYR 166.A N LEU 159.A O no hydrogen 2.798 N/A GLN 167.A N ASP 208.A OD2 no hydrogen 2.696 N/A GLN 167.A NE2 ARG 206.A O no hydrogen 2.836 N/A ALA 168.A N MET 157.A O no hydrogen 2.730 N/A VAL 169.A N ILE 209.A O no hydrogen 2.898 N/A ILE 170.A N TRP 155.A O no hydrogen 2.864 N/A ILE 171.A N LEU 211.A O no hydrogen 2.983 N/A GLY 172.A N THR 154.A OG1 no hydrogen 3.106 N/A GLY 175.A N SER 173.A OG no hydrogen 3.146 N/A ASN 177.A ND2 TYR 110.A OH no hydrogen 2.791 N/A TYR 180.A N ASN 177.A O no hydrogen 3.005 N/A TYR 180.A OH HIS 148.A O no hydrogen 2.708 N/A LEU 182.A N GLN 259.A OE1 no hydrogen 2.719 N/A ASN 185.A ND2 LYS 181.A O no hydrogen 2.862 N/A THR 187.A N ASN 185.A OD1 no hydrogen 3.073 N/A THR 187.A OG1 PHE 108.A O no hydrogen 2.754 N/A THR 187.A OG1 ASN 185.A OD1 no hydrogen 3.231 N/A TYR 188.A N ASN 185.A OD1 no hydrogen 2.783 N/A TYR 188.A OH ASP 194.A OD2 no hydrogen 2.638 N/A ILE 191.A N TYR 188.A O no hydrogen 3.111 N/A ASP 194.A N LYS 190.A O no hydrogen 2.757 N/A TYR 195.A N ILE 191.A O no hydrogen 3.021 N/A TYR 195.A OH GLY 175.A O no hydrogen 2.758 N/A LYS 196.A N ALA 192.A O no hydrogen 2.992 N/A LYS 196.A NZ GLU 193.A OE2 no hydrogen 3.042 N/A HIS 197.A N GLU 193.A O no hydrogen 2.878 N/A SER 198.A N ASP 194.A O no hydrogen 2.874 N/A SER 198.A OG PRO 146.A O no hydrogen 2.762 N/A SER 198.A OG ASP 194.A O no hydrogen 3.306 N/A ILE 199.A N TYR 195.A O no hydrogen 2.860 N/A LYS 200.A N LYS 196.A O no hydrogen 3.039 N/A VAL 201.A N HIS 197.A O no hydrogen 2.927 N/A LEU 202.A N SER 198.A O no hydrogen 2.906 N/A GLU 203.A N ILE 199.A O no hydrogen 2.829 N/A SER 204.A N VAL 201.A O no hydrogen 3.358 N/A SER 204.A OG LYS 200.A O no hydrogen 3.108 N/A SER 204.A OG VAL 201.A O no hydrogen 3.261 N/A MET 205.A N LEU 202.A O no hydrogen 3.201 N/A ARG 206.A NE ASP 208.A OD2 no hydrogen 2.851 N/A ARG 206.A NH2 ASP 208.A OD2 no hydrogen 3.123 N/A ASP 208.A N GLN 167.A O no hydrogen 2.907 N/A ILE 209.A N GLN 167.A O no hydrogen 3.002 N/A PHE 210.A N PHE 235.A O no hydrogen 3.370 N/A LEU 211.A N VAL 169.A O no hydrogen 2.863 N/A GLY 212.A N TYR 27.A OH no hydrogen 3.359 N/A SER 213.A N ILE 171.A O no hydrogen 3.164 N/A SER 213.A OG GLY 172.A O no hydrogen 2.837 N/A HIS 214.A ND1 ASP 23.A OD2 no hydrogen 2.857 N/A ALA 215.A N ASP 23.A O no hydrogen 2.669 N/A MET 217.A N HIS 214.A O no hydrogen 2.978 N/A PHE 218.A N ALA 215.A O no hydrogen 3.220 N/A LEU 220.A N ALA 215.A O no hydrogen 3.270 N/A ASN 222.A ND2 ASP 219.A OD2 no hydrogen 2.795 N/A LYS 223.A N ASP 219.A O no hydrogen 3.030 N/A LYS 223.A NZ PHE 218.A O no hydrogen 2.814 N/A LYS 223.A NZ ASP 237.A OD2 no hydrogen 2.821 N/A TYR 224.A N LEU 220.A O no hydrogen 2.749 N/A VAL 225.A N LYS 221.A O no hydrogen 3.049 N/A LEU 226.A N ASN 222.A O no hydrogen 3.245 N/A LEU 227.A N LYS 223.A O no hydrogen 2.899 N/A SER 228.A N TYR 224.A O no hydrogen 2.925 N/A SER 228.A OG TYR 224.A O no hydrogen 3.249 N/A LYS 229.A N VAL 225.A O no hydrogen 3.110 N/A LYS 229.A N LEU 226.A O no hydrogen 3.131 N/A GLY 230.A N LEU 227.A O no hydrogen 2.818 N/A GLN 231.A N LEU 226.A O no hydrogen 2.981 N/A ASN 232.A N GLN 231.A OE1 no hydrogen 2.919 N/A ASN 233.A ND2 ILE 12.A O no hydrogen 2.838 N/A ASN 233.A ND2 ASP 161.A OD2 no hydrogen 2.819 N/A PHE 235.A N ASN 233.A OD1 no hydrogen 2.862 N/A VAL 236.A N ASN 233.A O no hydrogen 3.081 N/A ASP 237.A N ASP 208.A O no hydrogen 2.781 N/A GLY 240.A N ASP 237.A OD1 no hydrogen 2.839 N/A CYS 241.A N ASP 237.A O no hydrogen 2.986 N/A LYS 242.A N PRO 238.A O no hydrogen 2.964 N/A ASN 243.A N THR 239.A O no hydrogen 2.857 N/A TYR 244.A N GLY 240.A O no hydrogen 2.834 N/A ILE 245.A N CYS 241.A O no hydrogen 2.978 N/A GLU 246.A N LYS 242.A O no hydrogen 3.041 N/A GLN 247.A N ASN 243.A O no hydrogen 2.863 N/A GLN 247.A NE2 ASP 251.A OD1 no hydrogen 2.819 N/A LYS 248.A N TYR 244.A O no hydrogen 2.921 N/A LYS 248.A NZ ASP 251.A OD2 no hydrogen 3.123 N/A ALA 249.A N ILE 245.A O no hydrogen 2.872 N/A ASN 250.A N GLU 246.A O no hydrogen 2.910 N/A ASP 251.A N GLN 247.A O no hydrogen 2.734 N/A PHE 252.A N LYS 248.A O no hydrogen 2.927 N/A TYR 253.A N ALA 249.A O no hydrogen 3.146 N/A THR 254.A N ASN 250.A O no hydrogen 2.821 N/A THR 254.A OG1 ASN 250.A O no hydrogen 3.091 N/A GLU 255.A N ASP 251.A O no hydrogen 2.973 N/A LEU 256.A N PHE 252.A O no hydrogen 2.827 N/A LYS 257.A N TYR 253.A O no hydrogen 2.872 N/A LYS 258.A N THR 254.A O no hydrogen 2.989 N/A GLN 259.A N GLU 255.A O no hydrogen 2.979 N/A GLN 259.A NE2 TYR 180.A O no hydrogen 2.869 N/A GLN 259.A NE2 GLU 255.A OE1 no hydrogen 2.764 N/A GLU 260.A N LEU 256.A O no hydrogen 2.814 N/A THR 261.A N LYS 257.A O no hydrogen 2.842 N/A THR 261.A OG1 LYS 257.A O no hydrogen 2.799 N/A GLY 262.A N LYS 258.A O no hydrogen 2.874 N/A