NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
601762 |
5hou   |
30002 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
# Restraints file 1: p53taz1.RST # # 2002 SER H 2002 SER QB 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "968," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," rk2= "30.0," rk3= "30.0," ir6= "1," ialtd= "0," igr2= "972," "973," &end # # 1061 ASP- QB 2001 GLY H 4.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "961," r1= "1.30," r2= "1.80," r3= "4.96," r4= "5.46," igr1= "953," "954," &end # # 1061 ASP- H 2001 GLY H 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "949," "961," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," &end # # 1059 GLY QA 1061 ASP- H 5.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "5.44," r4= "5.94," igr1= "930," "931," &end # # 1061 ASP- H 1061 ASP- QB 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "949," "-1," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," igr2= "953," "954," &end # # 1060 PRO HB+ 1061 ASP- H 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr1= "942," "943," &end # # 1060 PRO HB- 1061 ASP- H 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr1= "942," "943," &end # # 1060 PRO QG 1061 ASP- H 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," igr1= "939," "940," &end # # 1057 ASP- HA 1059 GLY H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "904," "928," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1058 PRO QD 1059 GLY H 3.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "928," r1= "1.30," r2= "1.80," r3= "3.74," r4= "4.24," igr1= "915," "916," &end # # 1058 PRO HB- 1059 GLY H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "928," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," igr1= "921," "922," &end # # 1058 PRO HB+ 1059 GLY H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "928," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," igr1= "921," "922," &end # # 1059 GLY H 1059 GLY QA 2.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "928," "-1," r1= "1.30," r2= "1.80," r3= "2.83," r4= "3.33," igr2= "930," "931," &end # # 1056 GLU- HA 1057 ASP- H 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "889," "902," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," &end # # 1057 ASP- H 1058 PRO QD 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "902," "-1," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," igr2= "915," "916," &end # # 1057 ASP- H 1057 ASP- HB+ 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "902," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "906," "907," &end # # 1057 ASP- H 1057 ASP- HB- 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "902," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "906," "907," &end # # 1056 GLU- QG 1057 ASP- H 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "902," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," igr1= "894," "895," &end # # 1056 GLU- HB+ 1057 ASP- H 4.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "902," r1= "1.30," r2= "1.80," r3= "4.05," r4= "4.55," igr1= "891," "892," &end # # 1056 GLU- HB- 1057 ASP- H 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "902," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr1= "891," "892," &end # # 1055 THR QG2 1057 ASP- H 6.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "902," r1= "1.30," r2= "1.80," r3= "6.58," r4= "7.08," igr1= "879," "880," "881," &end # # 1054 PHE QD 1055 THR H 6.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "873," r1= "1.30," r2= "1.80," r3= "6.11," r4= "6.61," igr1= "861," "869," &end # # 1054 PHE HB+ 1055 THR H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "873," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr1= "857," "858," &end # # 1054 PHE HB- 1055 THR H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "873," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr1= "857," "858," &end # # 1055 THR H 1055 THR QG2 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "873," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr2= "879," "880," "881," &end # # 1055 THR H 1055 THR HB 4.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "873," "877," r1= "1.30," r2= "1.80," r3= "4.09," r4= "4.59," &end # # 1054 PHE H 1054 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "853," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "861," "869," &end # # 1051 GLU- HA 1054 PHE H 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "799," "853," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," &end # # 1052 GLN HA 1054 PHE H 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "814," "853," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," &end # # 1053 TRP QB 1054 PHE H 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "853," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," igr1= "833," "834," &end # # 1052 GLN H 1053 TRP H 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "812," "829," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," &end # # 1049 ASP- HA 1052 GLN H 4.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "768," "812," r1= "1.30," r2= "1.80," r3= "4.79," r4= "5.29," &end # # 1052 GLU- QG 1052 GLN H 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "812," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr1= "819," "820," &end # # 1052 GLN H 1052 GLN QB 3.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "812," "-1," r1= "1.30," r2= "1.80," r3= "3.22," r4= "3.72," igr2= "816," "817," &end # # 1050 ILE QG2 1052 GLN H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "812," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "784," "785," "786," &end # # 1052 GLN H 1053 TRP HD1 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "812," "837," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," &end # # 1050 ILE HA 1052 GLN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "780," "812," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1050 ILE H 1051 GLU- H 4.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "778," "797," r1= "1.30," r2= "1.80," r3= "4.10," r4= "4.60," &end # # 1049 ASP- HA 1050 ILE H 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "768," "778," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," &end # # 1050 ILE H 1050 ILE HB 3.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "778," "782," r1= "1.30," r2= "1.80," r3= "3.19," r4= "3.69," &end # # 1050 ILE H 1050 ILE HG12 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "778," "788," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," &end # # 1050 ILE H 1050 ILE HG13 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "778," "789," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," &end # # 1045 LEU QQD 1050 ILE H 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "778," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "719," "720," "721," "723," "724," "725," &end # # 1050 ILE H 1050 ILE QG2 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "778," "-1," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr2= "784," "785," "786," &end # # 1047 PRO HA 1050 ILE H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "778," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1049 ASP- H 1050 ILE H 3.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "778," r1= "1.30," r2= "1.80," r3= "3.36," r4= "3.86," &end # # 1048 ASP- H 1049 ASP- H 3.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "754," "766," r1= "1.30," r2= "1.80," r3= "3.46," r4= "3.96," &end # # 1047 PRO HA 1049 ASP- H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "766," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1049 ASP- H 1049 ASP- HB- 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "770," "771," &end # # 1048 ASP- HB- 1049 ASP- H 4.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "766," r1= "1.30," r2= "1.80," r3= "4.70," r4= "5.20," igr1= "758," "759," &end # # 1049 ASP- H 1049 ASP- HB+ 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "770," "771," &end # # 1049 ASP- H 1051 GLU- QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "804," "805," &end # # 1049 ASP- H 1047 PRO QB 5.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "-1," r1= "1.30," r2= "1.80," r3= "5.77," r4= "6.27," igr2= "747," "748," &end # # 1045 LEU QQD 1049 ASP- H 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "766," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "719," "720," "721," "723," "724," "725," &end # # 1048 ASP- HB+ 1049 ASP- H 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "766," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," igr1= "758," "759," &end # # 1047 PRO QD 1048 ASP- H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "754," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," igr1= "741," "742," &end # # 1048 ASP- H 1048 ASP- HB+ 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "754," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr2= "758," "759," &end # # 1048 ASP- H 1048 ASP- HB- 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "754," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr2= "758," "759," &end # # 1047 PRO HG- 1048 ASP- H 4.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "754," r1= "1.30," r2= "1.80," r3= "4.68," r4= "5.18," igr1= "744," "745," &end # # 1047 PRO HB- 1048 ASP- H 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "754," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "747," "748," &end # # 1045 LEU QQD 1048 ASP- H 7.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "754," r1= "1.30," r2= "1.80," r3= "7.82," r4= "8.32," igr1= "719," "720," "721," "723," "724," "725," &end # # 1044 MET HA 1045 LEU H 3.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "695," "710," r1= "1.30," r2= "1.80," r3= "3.53," r4= "4.03," &end # # 1044 MET QE 1045 LEU H 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "710," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr1= "704," "705," "706," &end # # 1045 LEU H 1045 LEU HB+ 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "710," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "714," "715," &end # # 1045 LEU H 1045 LEU QQD 5.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "710," "-1," r1= "1.30," r2= "1.80," r3= "5.82," r4= "6.32," igr2= "719," "720," "721," "723," "724," "725," &end # # 1043 LEU HA 1044 MET H 3.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "676," "693," r1= "1.30," r2= "1.80," r3= "3.36," r4= "3.86," &end # # 1044 MET H 1044 MET HB+ 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "693," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "697," "698," &end # # 1043 LEU HB- 1044 MET H 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "693," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr1= "678," "679," &end # # 1043 LEU HB+ 1044 MET H 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "693," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr1= "678," "679," &end # # 1043 LEU QQD 1044 MET H 7.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "693," r1= "1.30," r2= "1.80," r3= "7.13," r4= "7.63," igr1= "683," "684," "685," "687," "688," "689," &end # # 1044 MET H 1044 MET QG 4.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "693," "-1," r1= "1.30," r2= "1.80," r3= "4.52," r4= "5.02," igr2= "700," "701," &end # # 1044 MET H 1044 MET HB- 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "693," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "697," "698," &end # # 1042 ASP- H 1043 LEU H 3.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "662," "674," r1= "1.30," r2= "1.80," r3= "3.33," r4= "3.83," &end # # 1041 ASP- HA 1043 LEU H 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "652," "674," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," &end # # 1042 ASP- QB 1043 LEU H 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "674," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "666," "667," &end # # 1043 LEU H 1043 LEU QQD 5.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "674," "-1," r1= "1.30," r2= "1.80," r3= "5.54," r4= "6.04," igr2= "683," "684," "685," "687," "688," "689," &end # # 1043 LEU H 1043 LEU HG 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "674," "681," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 1042 ASP- H 1042 ASP- HA 2.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "662," "664," r1= "1.30," r2= "1.80," r3= "2.89," r4= "3.39," &end # # 1040 MET HA 1042 ASP- H 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "662," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," &end # # 1042 ASP- H 1042 ASP- QB 3.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "662," "-1," r1= "1.30," r2= "1.80," r3= "3.06," r4= "3.56," igr2= "666," "667," &end # # 1039 ALA QB 1042 ASP- H 7.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "662," r1= "1.30," r2= "1.80," r3= "7.63," r4= "8.13," igr1= "627," "628," "629," &end # # 1040 MET QB 1042 ASP- H 7.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "662," r1= "1.30," r2= "1.80," r3= "7.13," r4= "7.63," igr1= "637," "638," &end # # 1041 ASP- H 1043 LEU H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "650," "674," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," &end # # 1040 MET HA 1041 ASP- H 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "650," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," &end # # 1040 MET QB 1041 ASP- H 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "650," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr1= "637," "638," &end # # 1039 ALA QB 1041 ASP- H 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "650," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr1= "627," "628," "629," &end # # 1041 ASP- H 1041 ASP- HB+ 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "650," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "654," "655," &end # # 1039 ALA HA 1040 MET H 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "625," "633," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," &end # # 1040 MET H 1040 MET QE 6.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "633," "-1," r1= "1.30," r2= "1.80," r3= "6.11," r4= "6.61," igr2= "644," "645," "646," &end # # 1039 ALA QB 1040 MET H 5.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "633," r1= "1.30," r2= "1.80," r3= "5.91," r4= "6.41," igr1= "627," "628," "629," &end # # 1040 MET H 1040 MET QB 5.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "633," "-1," r1= "1.30," r2= "1.80," r3= "5.14," r4= "5.64," igr2= "637," "638," &end # # 1038 GLN HB+ 1039 ALA H 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "623," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr1= "610," "611," &end # # 1038 GLN HB- 1039 ALA H 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "623," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr1= "610," "611," &end # # 1039 ALA H 1039 ALA QB 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "623," "-1," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," igr2= "627," "628," "629," &end # # 1036 PRO QG 1037 SER H 7.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "595," r1= "1.30," r2= "1.80," r3= "7.09," r4= "7.59," igr1= "585," "586," &end # # 1035 LEU HG 1037 SER H 6.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "569," "595," r1= "1.30," r2= "1.80," r3= "6.70," r4= "7.20," &end # # 1031 VAL HA 1033 SER H 5.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "504," "537," r1= "1.30," r2= "1.80," r3= "5.89," r4= "6.39," &end # # 1032 LEU QB 1033 SER H 5.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "537," r1= "1.30," r2= "1.80," r3= "5.58," r4= "6.08," igr1= "522," "523," &end # # 1032 LEU QQD 1033 SER H 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "537," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr1= "527," "528," "529," "531," "532," "533," &end # # 1032 LEU H 1033 SER H 4.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "518," "537," r1= "1.30," r2= "1.80," r3= "4.93," r4= "5.43," &end # # 1031 VAL HA 1032 LEU H 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "504," "518," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," &end # # 1038 GLN QG 1039 ALA H 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "623," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "613," "614," &end # # 1031 VAL HB 1032 LEU H 6.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "506," "518," r1= "1.30," r2= "1.80," r3= "6.19," r4= "6.69," &end # # 1031 VAL QQG 1032 LEU H 7.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "518," r1= "1.30," r2= "1.80," r3= "7.47," r4= "7.97," igr1= "508," "509," "510," "512," "513," "514," &end # # 1032 LEU H 1032 LEU QQD 8.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "518," "-1," r1= "1.30," r2= "1.80," r3= "8.32," r4= "8.82," igr2= "527," "528," "529," "531," "532," "533," &end # # 1032 LEU H 1032 LEU QB 4.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "518," "-1," r1= "1.30," r2= "1.80," r3= "4.30," r4= "4.80," igr2= "522," "523," &end # # 1031 VAL H 1032 LEU H 4.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "502," "518," r1= "1.30," r2= "1.80," r3= "4.68," r4= "5.18," &end # # 1030 ASN HB- 1031 VAL H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "502," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "492," "493," &end # # 1031 VAL H 1031 VAL HB 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "502," "506," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," &end # # 1031 VAL H 1031 VAL QQG 6.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "502," "-1," r1= "1.30," r2= "1.80," r3= "6.56," r4= "7.06," igr2= "508," "509," "510," "512," "513," "514," &end # # 1028 GLU- HA 1029 ASN H 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "461," "474," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," &end # # 1029 ASN H 1029 ASN HB- 5.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "474," "-1," r1= "1.30," r2= "1.80," r3= "5.20," r4= "5.70," igr2= "478," "479," &end # # 1028 GLU- QG 1029 ASN H 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "474," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "466," "467," &end # # 1028 GLU- HB- 1029 ASN H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "474," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "463," "464," &end # # 1028 GLU- HB+ 1029 ASN H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "474," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "463," "464," &end # # 1027 PRO HA 1029 ASN H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "455," "474," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," &end # # 1028 GLU- H 1029 ASN H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "459," "474," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," &end # # 1027 PRO HA 1028 GLU- H 4.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "455," "459," r1= "1.30," r2= "1.80," r3= "4.48," r4= "4.98," &end # # 1028 GLU- H 1028 GLU- QG 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "459," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr2= "466," "467," &end # # 1028 GLU- H 1028 GLU- HB- 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "459," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr2= "463," "464," &end # # 1028 GLU- H 1028 GLU- HB+ 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "459," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr2= "463," "464," &end # # 1025 LEU H 1026 LEU H 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "407," "426," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," &end # # 1026 LEU H 1026 LEU QQD 6.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "426," "-1," r1= "1.30," r2= "1.80," r3= "6.63," r4= "7.13," igr2= "435," "436," "437," "439," "440," "441," &end # # 1021 ASP- HA 1025 LEU H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "407," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1022 LEU HA 1025 LEU H 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "407," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," &end # # 1024 LYS+ QG 1025 LEU H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "407," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "392," "393," &end # # 1025 LEU H 1025 LEU QQD 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "407," "-1," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr2= "416," "417," "418," "420," "421," "422," &end # # 1023 TRP H 1024 LYS+ H 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "361," "385," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," &end # # 1021 ASP- HA 1024 LYS+ H 4.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "385," r1= "1.30," r2= "1.80," r3= "4.19," r4= "4.69," &end # # 1024 LYS+ H 1023 TRP HA 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "385," "363," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," &end # # 1022 LEU HA 1024 LYS+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "385," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1023 TRP HB- 1024 LYS+ H 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "385," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr1= "365," "366," &end # # 1023 TRP HB+ 1024 LYS+ H 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "385," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr1= "365," "366," &end # # 1024 LYS+ H 1024 LYS+ QB 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "385," "-1," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," igr2= "389," "390," &end # # 1024 LYS+ H 1024 LYS+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "385," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "395," "396," &end # # 1051 GLU- HA 1053 TRP H 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "799," "829," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," &end # # 1053 TRP H 1053 TRP QB 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "829," "-1," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr2= "833," "834," &end # # 1052 GLN QB 1053 TRP H 5.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "829," r1= "1.30," r2= "1.80," r3= "5.33," r4= "5.83," igr1= "816," "817," &end # # 1021 ASP- HA 1023 TRP HE1 5.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "371," r1= "1.30," r2= "1.80," r3= "5.46," r4= "5.96," &end # # 1023 TRP HE1 3415 ILE QG2 5.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "371," "-1," r1= "1.30," r2= "1.80," r3= "5.69," r4= "6.19," igr2= "2216," "2217," "2218," &end # # 1053 TRP H 1053 TRP HE1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "829," "839," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1053 TRP QB 1053 TRP HE1 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "839," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr1= "833," "834," &end # # 1053 TRP HE1 3352 LEU HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "839," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1226," "1227," &end # # 1052 GLN QB 1053 TRP HE1 5.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "839," r1= "1.30," r2= "1.80," r3= "5.75," r4= "6.25," igr1= "816," "817," &end # # 1045 LEU HG 1053 TRP HE1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "717," "839," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1053 TRP HE1 3352 LEU HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "839," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1226," "1227," &end # # 1045 LEU HB- 1053 TRP HE1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "839," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "714," "715," &end # # 1050 ILE HG12 1053 TRP HE1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "788," "839," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1045 LEU QQD 1053 TRP HE1 6.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "839," r1= "1.30," r2= "1.80," r3= "6.05," r4= "6.55," igr1= "719," "720," "721," "723," "724," "725," &end # # 1018 THR HA 1021 ASP- H 5.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "287," "330," r1= "1.30," r2= "1.80," r3= "5.49," r4= "5.99," &end # # 1021 ASP- H 1021 ASP- QB 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "330," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr2= "334," "335," &end # # 1019 PHE H 1020 SER H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "299," "319," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1020 SER H 1021 ASP- H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "319," "330," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1018 THR HB 1019 PHE H 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "289," "299," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," &end # # 1019 PHE H 1019 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "299," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "307," "315," &end # # 1018 THR H 1018 THR QG2 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "285," "-1," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr2= "291," "292," "293," &end # # 1017 GLU- QG 1018 THR H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "285," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "277," "278," &end # # 1017 GLU- HA 1018 THR H 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "272," "285," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," &end # # 1017 GLU- H 1018 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "270," "285," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1016 GLN HA 1017 GLU- H 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "255," "270," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," &end # # 1017 GLU- H 1017 GLU- QG 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "270," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr2= "277," "278," &end # # 1016 GLN QG 1017 GLU- H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "270," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "260," "261," &end # # 1016 GLN H 1016 GLN QG 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "253," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr2= "260," "261," &end # # 1015 SER H 1015 SER HB- 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "242," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "246," "247," &end # # 1014 LEU HB- 1015 SER H 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "242," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr1= "227," "228," &end # # 1014 LEU QQD 1015 SER H 5.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "242," r1= "1.30," r2= "1.80," r3= "5.69," r4= "6.19," igr1= "232," "233," "234," "236," "237," "238," &end # # 1015 SER H 1016 GLN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "242," "253," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1015 SER H 1015 SER HB+ 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "242," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "246," "247," &end # # 1013 PRO HA 1014 LEU H 3.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "219," "223," r1= "1.30," r2= "1.80," r3= "3.40," r4= "3.90," &end # # 1038 GLN H 1038 GLN QG 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "606," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr2= "613," "614," &end # # 1014 LEU H 1014 LEU QQD 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "223," "-1," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr2= "232," "233," "234," "236," "237," "238," &end # # 1013 PRO HB- 1014 LEU H 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "223," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr1= "216," "217," &end # # 1014 LEU H 1014 LEU HG 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "223," "230," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," &end # # 1014 LEU H 1014 LEU QB 4.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "223," "-1," r1= "1.30," r2= "1.80," r3= "4.49," r4= "4.99," igr2= "227," "228," &end # # 1010 VAL H 1011 GLU- H 4.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "164," "180," r1= "1.30," r2= "1.80," r3= "4.67," r4= "5.17," &end # # 1010 VAL HA 1011 GLU- H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "166," "180," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 1011 GLU- H 1012 PRO HD+ 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "180," "-1," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr2= "196," "197," &end # # 1010 VAL HB 1011 GLU- H 4.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "168," "180," r1= "1.30," r2= "1.80," r3= "4.39," r4= "4.89," &end # # 1011 GLU- H 1011 GLU- HB- 3.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "180," "-1," r1= "1.30," r2= "1.80," r3= "3.99," r4= "4.49," igr2= "184," "185," &end # # 1011 GLU- H 1011 GLU- HB+ 3.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "180," "-1," r1= "1.30," r2= "1.80," r3= "3.99," r4= "4.49," igr2= "184," "185," &end # # 1011 GLU- H 1011 GLU- QG 3.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "180," "-1," r1= "1.30," r2= "1.80," r3= "3.86," r4= "4.36," igr2= "187," "188," &end # # 1010 VAL QQG 1011 GLU- H 4.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "180," r1= "1.30," r2= "1.80," r3= "4.87," r4= "5.37," igr1= "170," "171," "172," "174," "175," "176," &end # # 1009 SER H 1010 VAL H 4.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "153," "164," r1= "1.30," r2= "1.80," r3= "4.16," r4= "4.66," &end # # 1022 LEU H 1022 LEU QQD 6.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "342," "-1," r1= "1.30," r2= "1.80," r3= "6.53," r4= "7.03," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU H 1022 LEU HB+ 3.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "342," "-1," r1= "1.30," r2= "1.80," r3= "3.38," r4= "3.88," igr2= "346," "347," &end # # 1010 VAL H 1010 VAL HB 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "164," "168," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," &end # # 1021 ASP- QB 1022 LEU H 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "342," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr1= "334," "335," &end # # 1009 SER HA 1010 VAL H 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "155," "164," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," &end # # 1021 ASP- HA 1022 LEU H 4.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "342," r1= "1.30," r2= "1.80," r3= "4.05," r4= "4.55," &end # # 1009 SER QB 1010 VAL H 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "164," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr1= "157," "158," &end # # 1010 VAL H 1010 VAL QG1 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "164," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "170," "171," "172," &end # # 1007 ASP- HA 1009 SER H 5.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "129," "153," r1= "1.30," r2= "1.80," r3= "5.55," r4= "6.05," &end # # 1008 PRO HA 1009 SER H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "149," "153," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 1009 SER H 1009 SER QB 3.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "153," "-1," r1= "1.30," r2= "1.80," r3= "3.60," r4= "4.10," igr2= "157," "158," &end # # 1008 PRO HB+ 1009 SER H 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "153," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr1= "146," "147," &end # # 1008 PRO HB- 1009 SER H 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "153," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr1= "146," "147," &end # # 1008 PRO QG 1009 SER H 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "153," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr1= "143," "144," &end # # 1006 SER HA 1007 ASP- H 4.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "118," "127," r1= "1.30," r2= "1.80," r3= "4.15," r4= "4.65," &end # # 1006 SER QB 1007 ASP- H 4.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "127," r1= "1.30," r2= "1.80," r3= "4.52," r4= "5.02," igr1= "120," "121," &end # # 1007 ASP- H 1007 ASP- HB+ 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "127," "-1," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," igr2= "131," "132," &end # # 1007 ASP- H 1007 ASP- HB- 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "127," "-1," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," igr2= "131," "132," &end # # 1007 ASP- H 1010 VAL QG1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "127," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "170," "171," "172," &end # # 1006 SER H 1006 SER QB 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "116," "-1," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr2= "120," "121," &end # # 1005 GLN H 1005 GLN QG 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "99," "-1," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr2= "106," "107," &end # # 1002 GLU- QG 1003 GLU- H 5.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "70," r1= "1.30," r2= "1.80," r3= "5.46," r4= "5.96," igr1= "62," "63," &end # # 1003 GLU- H 1003 GLU- QG 5.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "70," "-1," r1= "1.30," r2= "1.80," r3= "5.37," r4= "5.87," igr2= "77," "78," &end # # 1002 GLU- HB+ 1003 GLU- H 4.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "70," r1= "1.30," r2= "1.80," r3= "4.84," r4= "5.34," igr1= "59," "60," &end # # 1002 GLU- HB- 1003 GLU- H 4.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "70," r1= "1.30," r2= "1.80," r3= "4.84," r4= "5.34," igr1= "59," "60," &end # # 1002 GLU- HA 1003 GLU- H 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "57," "70," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," &end # # 1002 GLU- H 1002 GLU- QG 5.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "55," "-1," r1= "1.30," r2= "1.80," r3= "5.57," r4= "6.07," igr2= "62," "63," &end # # 1022 LEU H 1022 LEU HB- 3.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "342," "-1," r1= "1.30," r2= "1.80," r3= "3.38," r4= "3.88," igr2= "346," "347," &end # # 1022 LEU H 1022 LEU QQD 5.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "342," "-1," r1= "1.30," r2= "1.80," r3= "5.69," r4= "6.19," igr2= "351," "352," "353," "355," "356," "357," &end # # 1055 THR H 1056 GLU- H 4.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "873," "887," r1= "1.30," r2= "1.80," r3= "4.72," r4= "5.22," &end # # 1034 PRO HA 1035 LEU H 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "558," "562," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," &end # # 1056 GLU- H 1056 GLU- QG 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "887," "-1," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr2= "894," "895," &end # # 1056 GLU- H 1056 GLU- HB+ 3.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "887," "-1," r1= "1.30," r2= "1.80," r3= "3.66," r4= "4.16," igr2= "891," "892," &end # # 1035 LEU H 1035 LEU HG 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "562," "569," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," &end # # 1035 LEU H 1035 LEU HB- 4.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "562," "-1," r1= "1.30," r2= "1.80," r3= "4.90," r4= "5.40," igr2= "566," "567," &end # # 1035 LEU H 1035 LEU HB+ 5.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "562," "-1," r1= "1.30," r2= "1.80," r3= "5.09," r4= "5.59," igr2= "566," "567," &end # # 1055 THR QG2 1056 GLU- H 5.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "887," r1= "1.30," r2= "1.80," r3= "5.16," r4= "5.66," igr1= "879," "880," "881," &end # # 1035 LEU H 1035 LEU QQD 5.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "562," "-1," r1= "1.30," r2= "1.80," r3= "5.93," r4= "6.43," igr2= "571," "572," "573," "575," "576," "577," &end # # 1056 GLU- H 1056 GLU- HB- 3.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "887," "-1," r1= "1.30," r2= "1.80," r3= "3.14," r4= "3.64," igr2= "891," "892," &end # # 1023 TRP H 1023 TRP HD1 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "361," "369," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," &end # # 1022 LEU HB- 1023 TRP H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "361," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "346," "347," &end # # 1022 LEU HG 1023 TRP H 5.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "349," "361," r1= "1.30," r2= "1.80," r3= "5.47," r4= "5.97," &end # # 1022 LEU HB+ 1023 TRP H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "361," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "346," "347," &end # # 1023 TRP H 1026 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "361," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr2= "435," "436," "437," "439," "440," "441," &end # # 1052 GLN HA 1052 GLN HE2- 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "814," "-1," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr2= "824," "825," &end # # 1052 GLN QB 1052 GLN HE2- 4.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.67," r4= "5.17," igr1= "816," "817," igr2= "824," "825," &end # # 1052 GLN QG 1052 GLN HE2- 3.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.20," r4= "3.70," igr1= "819," "820," igr2= "824," "825," &end # # 1052 GLN HA 1052 GLN HE2+ 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "814," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr2= "824," "825," &end # # 1052 GLN QG 1052 GLN HE2+ 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr1= "819," "820," igr2= "824," "825," &end # # 1052 GLN QB 1052 GLN HE2+ 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr1= "816," "817," igr2= "824," "825," &end # # 1005 GLN QG 1005 GLN HE2- 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "106," "107," igr2= "111," "112," &end # # 1005 GLN HB- 1005 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "103," "104," igr2= "111," "112," &end # # 1005 GLN HB+ 1005 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "103," "104," igr2= "111," "112," &end # # 1005 GLN HB- 1005 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "103," "104," igr2= "111," "112," &end # # 1005 GLN HB+ 1005 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "103," "104," igr2= "111," "112," &end # # 1035 LEU QQD 1038 GLN HE2- 7.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.86," r4= "8.36," igr1= "571," "572," "573," "575," "576," "577," igr2= "618," "619," &end # # 1038 GLN HB+ 1038 GLN HE2- 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "610," "611," igr2= "618," "619," &end # # 1038 GLN HB- 1038 GLN HE2- 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "610," "611," igr2= "618," "619," &end # # 1038 GLN QG 1038 GLN HE2- 4.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.99," r4= "5.49," igr1= "613," "614," igr2= "618," "619," &end # # 1038 GLN HA 1038 GLN HE2- 6.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "608," "-1," r1= "1.30," r2= "1.80," r3= "6.23," r4= "6.73," igr2= "618," "619," &end # # 1035 LEU QQD 1038 GLN HE2+ 8.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.76," r4= "9.26," igr1= "571," "572," "573," "575," "576," "577," igr2= "618," "619," &end # # 1005 GLN QG 1005 GLN HE2+ 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "106," "107," igr2= "111," "112," &end # # 1038 GLN QG 1038 GLN HE2+ 5.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.58," r4= "6.08," igr1= "613," "614," igr2= "618," "619," &end # # 1038 GLN HA 1038 GLN HE2+ 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "608," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr2= "618," "619," &end # # 1030 ASN HB- 1030 ASN HD2- 4.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.43," r4= "4.93," igr1= "492," "493," igr2= "497," "498," &end # # 1026 LEU QQD 1030 ASN HD2- 7.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.67," r4= "8.17," igr1= "435," "436," "437," "439," "440," "441," igr2= "497," "498," &end # # 1027 PRO QG 1030 ASN HD2- 6.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.18," r4= "6.68," igr1= "449," "450," igr2= "497," "498," &end # # 1029 ASN HB- 1029 ASN HD2- 4.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.94," r4= "5.44," igr1= "478," "479," igr2= "483," "484," &end # # 1030 ASN HB+ 1030 ASN HD2- 4.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.43," r4= "4.93," igr1= "492," "493," igr2= "497," "498," &end # # 1026 LEU QQD 1030 ASN HD2+ 7.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.94," r4= "8.44," igr1= "435," "436," "437," "439," "440," "441," igr2= "497," "498," &end # # 1030 ASN HD2+ 3365 LYS+ QD 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "497," "498," igr2= "1458," "1459," &end # # 1027 PRO QG 1030 ASN HD2+ 6.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.69," r4= "7.19," igr1= "449," "450," igr2= "497," "498," &end # # 1029 ASN HB- 1029 ASN HD2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "478," "479," igr2= "483," "484," &end # # 1029 ASN HD2+ 1031 VAL QQG 8.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.76," r4= "9.26," igr1= "483," "484," igr2= "508," "509," "510," "512," "513," "514," &end # # 1004 PRO HA 1005 GLN H 4.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "95," "99," r1= "1.30," r2= "1.80," r3= "4.08," r4= "4.58," &end # # 1061 ASP- QB 2002 SER H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "968," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "953," "954," &end # # 1051 GLU- H 1052 GLN H 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "797," "812," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," &end # # 1030 ASN HD2- 1032 LEU QB 7.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.06," r4= "7.56," igr1= "497," "498," igr2= "522," "523," &end # # 1030 ASN HB+ 1031 VAL H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "502," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "492," "493," &end # # 1021 ASP- H 1022 LEU H 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "330," "342," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," &end # # 3409 ALA H 3410 SER H 3.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "2118," "2128," r1= "1.30," r2= "1.80," r3= "3.58," r4= "4.08," &end # # 3410 SER H 3410 SER QB 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2128," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "2132," "2133," &end # # 3407 HIS HA 3410 SER H 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "2092," "2128," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," &end # # 3409 ALA QB 3410 SER H 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2128," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr1= "2122," "2123," "2124," &end # # 3387 MET H 3388 LYS+ H 3.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "1793," "1810," r1= "1.30," r2= "1.80," r3= "3.27," r4= "3.77," &end # # 3388 LYS+ H 3389 ASN H 3.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "1832," r1= "1.30," r2= "1.80," r3= "3.26," r4= "3.76," &end # # 3387 MET HG- 3388 LYS+ H 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1810," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," igr1= "1800," "1801," &end # # 3387 MET HG+ 3388 LYS+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1810," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1800," "1801," &end # # 3388 LYS+ H 3390 VAL HB 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "1850," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3388 LYS+ H 3388 LYS+ HB+ 2.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "2.86," r4= "3.36," igr2= "1814," "1815," &end # # 3388 LYS+ H 3388 LYS+ HB- 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "1814," "1815," &end # # 3388 LYS+ H 3388 LYS+ QD 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr2= "1820," "1821," &end # # 3363 ALA QB 3388 LYS+ H 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1810," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "1424," "1425," "1426," &end # # 3388 LYS+ H 3388 LYS+ HG+ 4.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "4.09," r4= "4.59," igr2= "1817," "1818," &end # # 3388 LYS+ H 3391 LEU QQD 6.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "6.52," r4= "7.02," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3362 HIS H 3363 ALA H 3.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "1420," r1= "1.30," r2= "1.80," r3= "3.73," r4= "4.23," &end # # 3363 ALA H 3364 HIS H 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "1420," "1430," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," &end # # 3362 HIS HD2 3363 ALA H 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "1420," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," &end # # 3362 HIS HB+ 3363 ALA H 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1420," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," igr1= "1407," "1408," &end # # 3362 HIS HB- 3363 ALA H 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1420," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr1= "1407," "1408," &end # # 3363 ALA H 3363 ALA QB 3.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "1420," "-1," r1= "1.30," r2= "1.80," r3= "3.64," r4= "4.14," igr2= "1424," "1425," "1426," &end # # 3359 LEU QQD 3363 ALA H 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1420," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3409 ALA HA 3412 ARG+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "2150," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3411 SER HB- 3412 ARG+ H 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2150," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," igr1= "2143," "2144," &end # # 3411 SER HB+ 3412 ARG+ H 4.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2150," r1= "1.30," r2= "1.80," r3= "4.87," r4= "5.37," igr1= "2143," "2144," &end # # 3412 ARG+ H 3412 ARG+ HB- 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "2150," "-1," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," igr2= "2154," "2155," &end # # 3412 ARG+ H 3412 ARG+ HB+ 3.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "2150," "-1," r1= "1.30," r2= "1.80," r3= "3.41," r4= "3.91," igr2= "2154," "2155," &end # # 3438 LYS+ HA 3439 ARG+ H 3.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "2588," r1= "1.30," r2= "1.80," r3= "3.49," r4= "3.99," &end # # 3439 ARG+ H 3439 ARG+ QD 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "2588," "-1," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr2= "2598," "2599," &end # # 3438 LYS+ HG- 3439 ARG+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2588," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2573," "2574," &end # # 3438 LYS+ HG+ 3439 ARG+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2588," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2573," "2574," &end # # 3439 ARG+ H 3439 ARG+ QG 4.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "2588," "-1," r1= "1.30," r2= "1.80," r3= "4.76," r4= "5.26," igr2= "2595," "2596," &end # # 3438 LYS+ HB+ 3439 ARG+ H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2588," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr1= "2570," "2571," &end # # 3437 ASP- HB- 3438 LYS+ H 5.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2566," r1= "1.30," r2= "1.80," r3= "5.23," r4= "5.73," igr1= "2558," "2559," &end # # 3437 ASP- HB+ 3438 LYS+ H 5.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2566," r1= "1.30," r2= "1.80," r3= "5.23," r4= "5.73," igr1= "2558," "2559," &end # # 3438 LYS+ H 3438 LYS+ HB+ 3.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "3.73," r4= "4.23," igr2= "2570," "2571," &end # # 3438 LYS+ H 3438 LYS+ HB- 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "2570," "2571," &end # # 3438 LYS+ H 3438 LYS+ HG- 4.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "4.33," r4= "4.83," igr2= "2573," "2574," &end # # 3438 LYS+ H 3438 LYS+ HG+ 4.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "4.33," r4= "4.83," igr2= "2573," "2574," &end # # 3438 LYS+ H 3438 LYS+ QD 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr2= "2576," "2577," &end # # 3437 ASP- H 3438 LYS+ H 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "2554," "2566," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," &end # # 3416 SER H 3416 SER HB- 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2229," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "2233," "2234," &end # # 3435 ALA QB 3436 SER H 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2543," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr1= "2537," "2538," "2539," &end # # 3415 ILE H 3416 SER H 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "2210," "2229," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," &end # # 3388 LYS+ H 3390 VAL H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "1846," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3390 VAL H 3392 ASN H 4.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "1846," "1881," r1= "1.30," r2= "1.80," r3= "4.43," r4= "4.93," &end # # 3387 MET HA 3390 VAL H 3.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "1846," r1= "1.30," r2= "1.80," r3= "3.65," r4= "4.15," &end # # 3386 THR HA 3390 VAL H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "1846," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3388 LYS+ HA 3390 VAL H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "1846," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3389 ASN HB+ 3390 VAL H 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1846," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr1= "1836," "1837," &end # # 3389 ASN HB- 3390 VAL H 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1846," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr1= "1836," "1837," &end # # 3434 ASN HB- 3435 ALA H 5.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2533," r1= "1.30," r2= "1.80," r3= "5.33," r4= "5.83," igr1= "2523," "2524," &end # # 3390 VAL H 3390 VAL HB 2.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "1846," "1850," r1= "1.30," r2= "1.80," r3= "2.89," r4= "3.39," &end # # 3435 ALA H 3435 ALA QB 3.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "2533," "-1," r1= "1.30," r2= "1.80," r3= "3.99," r4= "4.49," igr2= "2537," "2538," "2539," &end # # 3390 VAL H 3390 VAL QG2 3.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "1846," "-1," r1= "1.30," r2= "1.80," r3= "3.41," r4= "3.91," igr2= "1856," "1857," "1858," &end # # 3390 VAL H 3390 VAL QG1 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "1846," "-1," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr2= "1852," "1853," "1854," &end # # 3434 ASN H 3435 ALA H 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "2519," "2533," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," &end # # 3433 LYS+ H 3434 ASN H 3.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "2497," "2519," r1= "1.30," r2= "1.80," r3= "3.74," r4= "4.24," &end # # 3431 PRO HA 3434 ASN H 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "2474," "2519," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," &end # # 3430 LEU HA 3434 ASN H 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "2519," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," &end # # 3434 ASN H 3434 ASN HB+ 3.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "2519," "-1," r1= "1.30," r2= "1.80," r3= "3.82," r4= "4.32," igr2= "2523," "2524," &end # # 3434 ASN H 3434 ASN HB- 3.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "2519," "-1," r1= "1.30," r2= "1.80," r3= "3.51," r4= "4.01," igr2= "2523," "2524," &end # # 3433 LYS+ QB 3434 ASN H 4.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2519," r1= "1.30," r2= "1.80," r3= "4.11," r4= "4.61," igr1= "2501," "2502," &end # # 3433 LYS+ HG+ 3434 ASN H 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2519," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr1= "2504," "2505," &end # # 3433 LYS+ HG- 3434 ASN H 4.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2519," r1= "1.30," r2= "1.80," r3= "4.70," r4= "5.20," igr1= "2504," "2505," &end # # 3430 LEU QQD 3434 ASN H 6.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2519," r1= "1.30," r2= "1.80," r3= "6.07," r4= "6.57," igr1= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3429 CYSZ HA 3432 LEU H 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2437," "2478," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," &end # # 3432 LEU H 3432 LEU HB- 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "2482," "2483," &end # # 3432 LEU H 3432 LEU HB+ 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "2482," "2483," &end # # 3432 LEU H 3432 LEU QQD 5.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "-1," r1= "1.30," r2= "1.80," r3= "5.92," r4= "6.42," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3432 LEU H 3432 LEU QQD 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3428 VAL HB 3429 CYSZ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2423," "2435," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3428 VAL QG1 3429 CYSZ H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2435," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2425," "2426," "2427," &end # # 3427 PRO QD 3428 VAL H 4.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2419," r1= "1.30," r2= "1.80," r3= "4.01," r4= "4.51," igr1= "2406," "2407," &end # # 3428 VAL H 3428 VAL HB 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "2419," "2423," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," &end # # 3426 CYS- HB+ 3428 VAL H 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2419," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr1= "2400," "2399," &end # # 3428 VAL H 3428 VAL QG1 4.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "2419," "-1," r1= "1.30," r2= "1.80," r3= "4.79," r4= "5.29," igr2= "2425," "2426," "2427," &end # # 3428 VAL H 3428 VAL QG2 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "2419," "-1," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr2= "2429," "2430," "2431," &end # # 3428 VAL H 3430 LEU H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "2419," "2445," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," &end # # 3426 CYS- H 3429 CYSZ H 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "2435," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," &end # # 3425 ASP- H 3426 CYS- H 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "2383," "2395," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," &end # # 3426 CYS- H 3430 LEU H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "2445," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3425 ASP- HA 3426 CYS- H 3.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "2395," r1= "1.30," r2= "1.80," r3= "3.23," r4= "3.73," &end # # 3426 CYS- H 3427 PRO QD 5.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "-1," r1= "1.30," r2= "1.80," r3= "5.94," r4= "6.44," igr2= "2406," "2407," &end # # 3426 CYS- H 3426 CYS- HB- 2.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "-1," r1= "1.30," r2= "1.80," r3= "2.87," r4= "3.37," igr2= "2400," "2399," &end # # 3426 CYS- H 3426 CYS- HB+ 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "-1," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr2= "2400," "2399," &end # # 3426 CYS- H 3430 LEU HG 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "2452," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," &end # # 3426 CYS- H 3430 LEU QQD 5.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "2395," "-1," r1= "1.30," r2= "1.80," r3= "5.57," r4= "6.07," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3424 HIS QB 3425 ASP- H 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2383," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr1= "2369," "2370," &end # # 3425 ASP- H 3430 LEU HG 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2383," "2452," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3425 ASP- H 3430 LEU QQD 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "2383," "-1," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3422 THR H 3423 ARG+ H 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "2327," "2341," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," &end # # 3421 CYS- HA 3422 THR H 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "2319," "2327," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," &end # # 3421 CYS- HB+ 3422 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2327," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2322," "2321," &end # # 3421 CYS- HB- 3422 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2327," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2322," "2321," &end # # 3422 THR H 3422 THR QG2 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "2327," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr2= "2333," "2334," "2335," &end # # 3420 ASN H 3421 CYS- H 3.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "2303," "2317," r1= "1.30," r2= "1.80," r3= "3.12," r4= "3.62," &end # # 3418 TRP HA 3421 CYS- H 4.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2259," "2317," r1= "1.30," r2= "1.80," r3= "4.87," r4= "5.37," &end # # 3421 CYS- H 3421 CYS- HB+ 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "2317," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr2= "2322," "2321," &end # # 3421 CYS- H 3421 CYS- HB- 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "2317," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr2= "2322," "2321," &end # # 3421 CYS- H 3422 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2317," "2327," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3419 LYS+ H 3420 ASN H 3.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "2281," "2303," r1= "1.30," r2= "1.80," r3= "3.45," r4= "3.95," &end # # 3418 TRP HA 3420 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2259," "2303," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3416 SER HA 3420 ASN H 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "2231," "2303," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," &end # # 3420 ASN H 3420 ASN HB+ 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "2303," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "2307," "2308," &end # # 3420 ASN H 3420 ASN HB- 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "2303," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "2307," "2308," &end # # 3419 LYS+ QB 3420 ASN H 3.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2303," r1= "1.30," r2= "1.80," r3= "3.69," r4= "4.19," igr1= "2285," "2286," &end # # 3418 TRP H 3419 LYS+ H 4.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2257," "2281," r1= "1.30," r2= "1.80," r3= "4.24," r4= "4.74," &end # # 3418 TRP H 3418 TRP HE3 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2257," "2276," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3416 SER HA 3418 TRP H 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "2231," "2257," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," &end # # 3415 ILE HA 3418 TRP H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "2212," "2257," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," &end # # 3357 LEU QQD 3418 TRP H 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2257," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3415 ILE QG2 3418 TRP H 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2257," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "2216," "2217," "2218," &end # # 3418 TRP H 3418 TRP QB 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "2257," "-1," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," igr2= "2261," "2262," &end # # 3432 LEU H 3433 LYS+ H 3.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "2497," r1= "1.30," r2= "1.80," r3= "3.01," r4= "3.51," &end # # 3418 TRP HH2 3433 LYS+ H 4.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "2497," r1= "1.30," r2= "1.80," r3= "4.49," r4= "4.99," &end # # 3433 LYS+ H 3433 LYS+ QB 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "2497," "-1," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," igr2= "2501," "2502," &end # # 3433 LYS+ H 3433 LYS+ HG- 2.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "2497," "-1," r1= "1.30," r2= "1.80," r3= "2.85," r4= "3.35," igr2= "2504," "2505," &end # # 3433 LYS+ H 3433 LYS+ HG+ 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "2497," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr2= "2504," "2505," &end # # 3432 LEU QQD 3433 LYS+ H 6.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2497," r1= "1.30," r2= "1.80," r3= "6.55," r4= "7.05," igr1= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3433 LYS+ H 3433 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2497," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2510," "2511," &end # # 3416 SER H 3417 HIS H 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "2229," "2240," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," &end # # 3416 SER H 3416 SER HB+ 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2229," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "2233," "2234," &end # # 3412 ARG+ HA 3416 SER H 4.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "2229," r1= "1.30," r2= "1.80," r3= "4.20," r4= "4.70," &end # # 3416 SER H 3419 LYS+ QB 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "2229," "-1," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," igr2= "2285," "2286," &end # # 3415 ILE HB 3416 SER H 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "2214," "2229," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," &end # # 3415 ILE QG2 3416 SER H 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2229," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "2216," "2217," "2218," &end # # 3415 ILE QD1 3416 SER H 6.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2229," r1= "1.30," r2= "1.80," r3= "6.21," r4= "6.71," igr1= "2223," "2224," "2225," &end # # 3412 ARG+ H 3413 GLN H 4.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "2150," "2174," r1= "1.30," r2= "1.80," r3= "4.31," r4= "4.81," &end # # 3413 GLN H 3414 ILE H 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "2174," "2191," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," &end # # 3410 SER HA 3413 GLN H 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2130," "2174," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," &end # # 3413 GLN H 3413 GLN HG+ 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "2174," "-1," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr2= "2181," "2182," &end # # 3413 GLN H 3413 GLN HB- 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "2174," "-1," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," igr2= "2178," "2179," &end # # 3413 GLN H 3413 GLN HB+ 3.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "2174," "-1," r1= "1.30," r2= "1.80," r3= "3.57," r4= "4.07," igr2= "2178," "2179," &end # # 3412 ARG+ HB+ 3413 GLN H 3.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2174," r1= "1.30," r2= "1.80," r3= "3.60," r4= "4.10," igr1= "2154," "2155," &end # # 1050 ILE QG2 3413 GLN H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2174," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "784," "785," "786," &end # # 3413 GLN H 3413 GLN HG- 4.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "2174," "-1," r1= "1.30," r2= "1.80," r3= "4.34," r4= "4.84," igr2= "2181," "2182," &end # # 3405 VAL H 3409 ALA H 5.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "2118," r1= "1.30," r2= "1.80," r3= "5.09," r4= "5.59," &end # # 3408 CYSZ H 3409 ALA H 3.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "2108," "2118," r1= "1.30," r2= "1.80," r3= "3.45," r4= "3.95," &end # # 3409 ALA H 3411 SER H 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "2118," "2139," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," &end # # 3407 HIS HA 3409 ALA H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2092," "2118," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3406 ALA HA 3409 ALA H 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "2082," "2118," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," &end # # 3408 CYSZ HB- 3409 ALA H 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2118," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr1= "2113," "2112," &end # # 3403 CYS- QB 3409 ALA H 5.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2118," r1= "1.30," r2= "1.80," r3= "5.71," r4= "6.21," igr1= "2042," "2041," &end # # 3408 CYSZ HB+ 3409 ALA H 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2118," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr1= "2113," "2112," &end # # 3409 ALA H 3409 ALA QB 2.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "2118," "-1," r1= "1.30," r2= "1.80," r3= "2.97," r4= "3.47," igr2= "2122," "2123," "2124," &end # # 3405 VAL QG1 3409 ALA H 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2118," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "2070," "2071," "2072," &end # # 3405 VAL H 3408 CYSZ H 5.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "2108," r1= "1.30," r2= "1.80," r3= "5.06," r4= "5.56," &end # # 3408 CYSZ H 3410 SER H 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "2108," "2128," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," &end # # 3406 ALA H 3408 CYSZ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2080," "2108," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3407 HIS H 3408 CYSZ H 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2090," "2108," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," &end # # 3393 HIS HD2 3408 CYSZ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "2108," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3406 ALA HA 3408 CYSZ H 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "2082," "2108," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," &end # # 3407 HIS HB- 3408 CYSZ H 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2108," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr1= "2094," "2095," &end # # 3408 CYSZ H 3408 CYSZ HB- 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2108," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr2= "2113," "2112," &end # # 3407 HIS HB+ 3408 CYSZ H 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2108," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr1= "2094," "2095," &end # # 3408 CYSZ H 3408 CYSZ HB+ 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2108," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr2= "2113," "2112," &end # # 3405 VAL HB 3408 CYSZ H 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "2068," "2108," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," &end # # 3390 VAL QG2 3408 CYSZ H 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2108," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr1= "1856," "1857," "1858," &end # # 3390 VAL QG1 3408 CYSZ H 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2108," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr1= "1852," "1853," "1854," &end # # 3405 VAL QG1 3408 CYSZ H 5.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2108," r1= "1.30," r2= "1.80," r3= "5.16," r4= "5.66," igr1= "2070," "2071," "2072," &end # # 3405 VAL H 3406 ALA H 4.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "2080," r1= "1.30," r2= "1.80," r3= "4.70," r4= "5.20," &end # # 3404 GLN HA 3405 VAL H 3.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "2064," r1= "1.30," r2= "1.80," r3= "3.45," r4= "3.95," &end # # 3403 CYS- HA 3405 VAL H 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "2064," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," &end # # 3405 VAL H 3408 CYSZ HB- 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "2113," "2112," &end # # 3403 CYS- QB 3405 VAL H 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2064," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr1= "2042," "2041," &end # # 3405 VAL H 3408 CYSZ HB+ 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "2113," "2112," &end # # 3404 GLN HB+ 3405 VAL H 5.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2064," r1= "1.30," r2= "1.80," r3= "5.27," r4= "5.77," igr1= "2051," "2052," &end # # 3404 GLN HG- 3405 VAL H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2064," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2054," "2055," &end # # 3405 VAL H 3405 VAL HB 3 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "2068," r1= "1.30," r2= "1.80," r3= "3.00," r4= "3.50," &end # # 3405 VAL H 3409 ALA QB 5.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "5.64," r4= "6.14," igr2= "2122," "2123," "2124," &end # # 3405 VAL H 3405 VAL QG2 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr2= "2074," "2075," "2076," &end # # 3405 VAL H 3405 VAL QG1 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr2= "2070," "2071," "2072," &end # # 3404 GLN H 3405 VAL H 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "2064," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," &end # # 3404 GLN H 3404 GLN HE2- 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," igr2= "2059," "2060," &end # # 3403 CYS- HA 3404 GLN H 3.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "2047," r1= "1.30," r2= "1.80," r3= "3.06," r4= "3.56," &end # # 3403 CYS- QB 3404 GLN H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2047," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr1= "2042," "2041," &end # # 3404 GLN H 3404 GLN HB- 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "2051," "2052," &end # # 3409 ALA QB 3404 GLN H 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2047," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "2122," "2123," "2124," &end # # 3404 GLN H 3399 ALA QB 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr2= "1992," "1993," "1994," &end # # 3404 GLN H 3405 VAL QG2 6.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "6.16," r4= "6.66," igr2= "2074," "2075," "2076," &end # # 3404 GLN H 3404 GLN HG- 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr2= "2054," "2055," &end # # 3404 GLN H 3404 GLN HG+ 3.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "3.60," r4= "4.10," igr2= "2054," "2055," &end # # 3403 CYS- H 3404 GLN H 4.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "2037," "2047," r1= "1.30," r2= "1.80," r3= "4.67," r4= "5.17," &end # # 3399 ALA H 3403 CYS- H 5.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "2037," r1= "1.30," r2= "1.80," r3= "5.20," r4= "5.70," &end # # 3402 ALA HA 3403 CYS- H 3.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "2029," "2037," r1= "1.30," r2= "1.80," r3= "3.53," r4= "4.03," &end # # 3401 LYS+ HA 3403 CYS- H 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2007," "2037," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," &end # # 3403 CYS- H 3403 CYS- QB 2.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "2037," "-1," r1= "1.30," r2= "1.80," r3= "2.73," r4= "3.23," igr2= "2042," "2041," &end # # 3403 CYS- H 3404 GLN HG- 6.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "2037," "-1," r1= "1.30," r2= "1.80," r3= "6.37," r4= "6.87," igr2= "2054," "2055," &end # # 3401 LYS+ QB 3403 CYS- H 5.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2037," r1= "1.30," r2= "1.80," r3= "5.38," r4= "5.88," igr1= "2009," "2010," &end # # 3399 ALA QB 3403 CYS- H 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2037," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," igr1= "1992," "1993," "1994," &end # # 3402 ALA H 3403 CYS- H 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "2027," "2037," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," &end # # 3400 GLY HA- 3402 ALA H 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2027," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr1= "2000," "2001," &end # # 3365 LYS+ HA 3368 ARG+ H 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "1497," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," &end # # 3400 GLY HA+ 3402 ALA H 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2027," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr1= "2000," "2001," &end # # 3402 ALA H 3403 CYS- QB 4.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "2027," "-1," r1= "1.30," r2= "1.80," r3= "4.93," r4= "5.43," igr2= "2042," "2041," &end # # 3402 ALA H 3402 ALA QB 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "2027," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr2= "2031," "2032," "2033," &end # # 3401 LYS+ H 3402 ALA H 5.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "2005," "2027," r1= "1.30," r2= "1.80," r3= "5.16," r4= "5.66," &end # # 3399 ALA H 3402 ALA H 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "2027," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," &end # # 3400 GLY H 3402 ALA H 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1998," "2027," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," &end # # 3397 CYS- HA 3400 GLY H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1963," "1998," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3400 GLY H 3403 CYS- QB 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1998," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr2= "2042," "2041," &end # # 3398 GLN HB- 3400 GLY H 5.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1998," r1= "1.30," r2= "1.80," r3= "5.60," r4= "6.10," igr1= "1975," "1976," &end # # 3398 GLN HB+ 3400 GLY H 5.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1998," r1= "1.30," r2= "1.80," r3= "5.60," r4= "6.10," igr1= "1975," "1976," &end # # 3399 ALA QB 3400 GLY H 3.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1998," r1= "1.30," r2= "1.80," r3= "3.77," r4= "4.27," igr1= "1992," "1993," "1994," &end # # 3398 GLN H 3399 ALA H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "1971," "1988," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," &end # # 3399 ALA H 3400 GLY H 3.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "1998," r1= "1.30," r2= "1.80," r3= "3.20," r4= "3.70," &end # # 3397 CYS- HA 3399 ALA H 4.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "1963," "1988," r1= "1.30," r2= "1.80," r3= "4.22," r4= "4.72," &end # # 3399 ALA H 3403 CYS- HA 4.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "2039," r1= "1.30," r2= "1.80," r3= "4.84," r4= "5.34," &end # # 3399 ALA H 3403 CYS- QB 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr2= "2042," "2041," &end # # 3398 GLN HB- 3399 ALA H 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1988," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr1= "1975," "1976," &end # # 3398 GLN HB+ 3399 ALA H 4.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1988," r1= "1.30," r2= "1.80," r3= "4.10," r4= "4.60," igr1= "1975," "1976," &end # # 3399 ALA H 3399 ALA QB 3.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "-1," r1= "1.30," r2= "1.80," r3= "3.07," r4= "3.57," igr2= "1992," "1993," "1994," &end # # 3397 CYS- H 3398 GLN H 4.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "1961," "1971," r1= "1.30," r2= "1.80," r3= "4.69," r4= "5.19," &end # # 3395 THR H 3397 CYS- H 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "1929," "1961," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," &end # # 3396 HIS HA 3397 CYS- H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1945," "1961," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 3393 HIS HA 3397 CYS- H 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1897," "1961," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," &end # # 3395 THR HA 3397 CYS- H 4.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "1931," "1961," r1= "1.30," r2= "1.80," r3= "4.64," r4= "5.14," &end # # 3394 MET HA 3397 CYS- H 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "1961," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," &end # # 3396 HIS HB+ 3397 CYS- H 4.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1961," r1= "1.30," r2= "1.80," r3= "4.68," r4= "5.18," igr1= "1947," "1948," &end # # 3396 HIS HB- 3397 CYS- H 4.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1961," r1= "1.30," r2= "1.80," r3= "4.68," r4= "5.18," igr1= "1947," "1948," &end # # 3397 CYS- H 3397 CYS- HB- 3.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1961," "-1," r1= "1.30," r2= "1.80," r3= "3.08," r4= "3.58," igr2= "1966," "1965," &end # # 3397 CYS- H 3397 CYS- HB+ 2.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "1961," "-1," r1= "1.30," r2= "1.80," r3= "2.77," r4= "3.27," igr2= "1966," "1965," &end # # 3395 THR QG2 3397 CYS- H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1961," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1935," "1936," "1937," &end # # 3394 MET H 3396 HIS H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1912," "1943," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3395 THR H 3396 HIS H 3.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "1929," "1943," r1= "1.30," r2= "1.80," r3= "3.55," r4= "4.05," &end # # 3393 HIS HA 3396 HIS H 5.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "1897," "1943," r1= "1.30," r2= "1.80," r3= "5.33," r4= "5.83," &end # # 3395 THR HB 3396 HIS H 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1933," "1943," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," &end # # 3394 MET HA 3396 HIS H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "1943," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 3396 HIS H 3396 HIS HB+ 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1943," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "1947," "1948," &end # # 3396 HIS H 3396 HIS HB- 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1943," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "1947," "1948," &end # # 3396 HIS H 3397 CYS- HB- 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1943," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr2= "1966," "1965," &end # # 3396 HIS H 3397 CYS- HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1943," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1966," "1965," &end # # 3395 THR QG2 3396 HIS H 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1943," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr1= "1935," "1936," "1937," &end # # 3394 MET H 3395 THR H 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1912," "1929," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," &end # # 3392 ASN HA 3395 THR H 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "1883," "1929," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," &end # # 3393 HIS HA 3395 THR H 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1897," "1929," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," &end # # 3395 THR H 3395 THR HB 3.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "1929," "1933," r1= "1.30," r2= "1.80," r3= "3.65," r4= "4.15," &end # # 3394 MET QG 3395 THR H 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1929," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr1= "1919," "1920," &end # # 3394 MET HB+ 3395 THR H 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1929," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr1= "1916," "1917," &end # # 3394 MET HB- 3395 THR H 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1929," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr1= "1916," "1917," &end # # 3394 MET QE 3395 THR H 6.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1929," r1= "1.30," r2= "1.80," r3= "6.39," r4= "6.89," igr1= "1923," "1924," "1925," &end # # 3395 THR H 3395 THR QG2 3.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1929," "-1," r1= "1.30," r2= "1.80," r3= "3.76," r4= "4.26," igr2= "1935," "1936," "1937," &end # # 3391 LEU QQD 3395 THR H 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1929," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3393 HIS H 3394 MET H 3.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1895," "1912," r1= "1.30," r2= "1.80," r3= "3.17," r4= "3.67," &end # # 3392 ASN H 3394 MET H 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "1912," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," &end # # 3393 HIS HD2 3394 MET H 3.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "1912," r1= "1.30," r2= "1.80," r3= "3.73," r4= "4.23," &end # # 3391 LEU HA 3394 MET H 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "1912," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," &end # # 3393 HIS HB+ 3394 MET H 3.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1912," r1= "1.30," r2= "1.80," r3= "3.05," r4= "3.55," igr1= "1899," "1900," &end # # 3393 HIS HB- 3394 MET H 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1912," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr1= "1899," "1900," &end # # 3394 MET H 3394 MET HB+ 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1912," "-1," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," igr2= "1916," "1917," &end # # 3394 MET H 3394 MET HB- 3.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1912," "-1," r1= "1.30," r2= "1.80," r3= "3.46," r4= "3.96," igr2= "1916," "1917," &end # # 3390 VAL QG1 3394 MET H 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1912," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1852," "1853," "1854," &end # # 3391 LEU QQD 3394 MET H 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1912," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr1= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3369 ARG+ H 3370 GLU- H 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1521," "1545," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," &end # # 3393 HIS H 3393 HIS HD2 4.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1895," "1908," r1= "1.30," r2= "1.80," r3= "4.96," r4= "5.46," &end # # 3366 CYS- HA 3369 ARG+ H 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1472," "1521," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," &end # # 3390 VAL HA 3393 HIS H 4.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "1895," r1= "1.30," r2= "1.80," r3= "4.18," r4= "4.68," &end # # 3393 HIS H 3393 HIS HB+ 2.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1895," "-1," r1= "1.30," r2= "1.80," r3= "2.97," r4= "3.47," igr2= "1899," "1900," &end # # 3393 HIS H 3393 HIS HB- 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1895," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr2= "1899," "1900," &end # # 3392 ASN QB 3393 HIS H 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1895," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," igr1= "1885," "1886," &end # # 3390 VAL QG2 3393 HIS H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1895," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1856," "1857," "1858," &end # # 3392 ASN H 3393 HIS H 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "1895," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," &end # # 3392 ASN H 3392 ASN HA 2.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "1883," r1= "1.30," r2= "1.80," r3= "2.91," r4= "3.41," &end # # 3388 LYS+ HA 3392 ASN H 4.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "1881," r1= "1.30," r2= "1.80," r3= "4.51," r4= "5.01," &end # # 3390 VAL HA 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3392 ASN H 3392 ASN QB 3.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "-1," r1= "1.30," r2= "1.80," r3= "3.12," r4= "3.62," igr2= "1885," "1886," &end # # 3390 VAL HB 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1850," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3391 LEU HB+ 3392 ASN H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr1= "1866," "1867," &end # # 3388 LYS+ HB- 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1814," "1815," &end # # 3391 LEU HG 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1869," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3391 LEU HB- 3392 ASN H 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr1= "1866," "1867," &end # # 3391 LEU QQD 3392 ASN H 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3391 LEU H 3392 ASN H 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "1881," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," &end # # 3390 VAL H 3391 LEU H 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1846," "1862," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," &end # # 3387 MET HA 3391 LEU H 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "1862," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," &end # # 3389 ASN HA 3391 LEU H 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1834," "1862," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," &end # # 3388 LYS+ HA 3391 LEU H 4.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "1862," r1= "1.30," r2= "1.80," r3= "4.05," r4= "4.55," &end # # 3391 LEU H 3392 ASN QB 5.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "-1," r1= "1.30," r2= "1.80," r3= "5.38," r4= "5.88," igr2= "1885," "1886," &end # # 3390 VAL HB 3391 LEU H 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1850," "1862," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," &end # # 3391 LEU H 3391 LEU HB+ 3.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "-1," r1= "1.30," r2= "1.80," r3= "3.77," r4= "4.27," igr2= "1866," "1867," &end # # 3391 LEU H 3391 LEU HB- 3.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "-1," r1= "1.30," r2= "1.80," r3= "3.27," r4= "3.77," igr2= "1866," "1867," &end # # 3390 VAL QG2 3391 LEU H 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1862," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "1856," "1857," "1858," &end # # 3390 VAL QG1 3391 LEU H 4.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1862," r1= "1.30," r2= "1.80," r3= "4.28," r4= "4.78," igr1= "1852," "1853," "1854," &end # # 3391 LEU H 3391 LEU QQD 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3389 ASN H 3391 LEU H 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "1862," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," &end # # 3389 ASN H 3390 VAL H 3.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "1846," r1= "1.30," r2= "1.80," r3= "3.13," r4= "3.63," &end # # 3386 THR HA 3389 ASN H 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "1832," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," &end # # 3389 ASN H 3389 ASN HB+ 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr2= "1836," "1837," &end # # 3389 ASN H 3389 ASN HB- 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr2= "1836," "1837," &end # # 3389 ASN H 3390 VAL HB 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "1850," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," &end # # 3388 LYS+ HG- 3389 ASN H 3.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "3.20," r4= "3.70," igr1= "1817," "1818," &end # # 3388 LYS+ HB- 3389 ASN H 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," igr1= "1814," "1815," &end # # 3385 ARG+ QG 3389 ASN H 6.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "6.14," r4= "6.64," igr1= "1762," "1763," &end # # 3388 LYS+ QD 3389 ASN H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1820," "1821," &end # # 3363 ALA QB 3389 ASN H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1424," "1425," "1426," &end # # 3388 LYS+ HG+ 3389 ASN H 3.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1832," r1= "1.30," r2= "1.80," r3= "3.76," r4= "4.26," igr1= "1817," "1818," &end # # 3386 THR H 3388 LYS+ H 4.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1779," "1810," r1= "1.30," r2= "1.80," r3= "4.94," r4= "5.44," &end # # 3385 ARG+ H 3386 THR H 3.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "1755," "1779," r1= "1.30," r2= "1.80," r3= "3.49," r4= "3.99," &end # # 3386 THR H 3387 MET H 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1779," "1793," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," &end # # 3383 HIS HA 3386 THR H 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1729," "1779," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," &end # # 3386 THR H 3386 THR HB 3.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "1779," "1783," r1= "1.30," r2= "1.80," r3= "3.43," r4= "3.93," &end # # 3385 ARG+ HB+ 3386 THR H 3.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1779," r1= "1.30," r2= "1.80," r3= "3.41," r4= "3.91," igr1= "1759," "1760," &end # # 3385 ARG+ QG 3386 THR H 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1779," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr1= "1762," "1763," &end # # 3386 THR H 3386 THR QG2 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "1779," "-1," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," igr2= "1785," "1786," "1787," &end # # 3381 LEU H 3381 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1694," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3378 ALA HA 3379 CYS- H 3.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "1665," "1673," r1= "1.30," r2= "1.80," r3= "3.09," r4= "3.59," &end # # 3379 CYS- H 3379 CYS- QB 3.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "1673," "-1," r1= "1.30," r2= "1.80," r3= "3.74," r4= "4.24," igr2= "1678," "1677," &end # # 3378 ALA QB 3379 CYS- H 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1673," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr1= "1667," "1668," "1669," &end # # 3377 ARG+ HB- 3378 ALA H 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1663," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," igr1= "1643," "1644," &end # # 3377 ARG+ QG 3378 ALA H 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1663," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," igr1= "1646," "1647," &end # # 3378 ALA H 3378 ALA QB 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1663," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "1667," "1668," "1669," &end # # 3376 VAL QG2 3378 ALA H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1663," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1633," "1634," "1635," &end # # 3377 ARG+ QD 3378 ALA H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1663," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1649," "1650," &end # # 3377 ARG+ HA 3378 ALA H 3.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1641," "1663," r1= "1.30," r2= "1.80," r3= "3.21," r4= "3.71," &end # # 3376 VAL H 3377 ARG+ H 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "1623," "1639," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," &end # # 3376 VAL HA 3377 ARG+ H 3.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "1639," r1= "1.30," r2= "1.80," r3= "3.13," r4= "3.63," &end # # 3377 ARG+ H 3377 ARG+ QD 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1639," "-1," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr2= "1649," "1650," &end # # 3376 VAL HB 3377 ARG+ H 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1627," "1639," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," &end # # 3377 ARG+ H 3377 ARG+ HB- 3.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1639," "-1," r1= "1.30," r2= "1.80," r3= "3.35," r4= "3.85," igr2= "1643," "1644," &end # # 3376 VAL QG2 3377 ARG+ H 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1639," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr1= "1633," "1634," "1635," &end # # 3377 ARG+ H 3377 ARG+ HB+ 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "1639," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "1643," "1644," &end # # 3377 ARG+ H 3377 ARG+ QG 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "1639," "-1," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr2= "1646," "1647," &end # # 3375 GLU- HB- 3376 VAL H 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1623," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr1= "1612," "1613," &end # # 3376 VAL H 3376 VAL QQG 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1623," "-1," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr2= "1629," "1630," "1631," "1633," "1634," "1635," &end # # 3373 ASN HB- 3375 GLU- H 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1608," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr1= "1591," "1592," &end # # 3387 MET H 3387 MET HG+ 4.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1793," "-1," r1= "1.30," r2= "1.80," r3= "4.75," r4= "5.25," igr2= "1800," "1801," &end # # 3375 GLU- H 3375 GLU- HB- 2.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1608," "-1," r1= "1.30," r2= "1.80," r3= "2.91," r4= "3.41," igr2= "1612," "1613," &end # # 3359 LEU QQD 3387 MET H 6.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1793," r1= "1.30," r2= "1.80," r3= "6.80," r4= "7.30," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3375 GLU- H 3375 GLU- HB+ 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1608," "-1," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," igr2= "1612," "1613," &end # # 3373 ASN H 3374 GLY H 4.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "1587," "1601," r1= "1.30," r2= "1.80," r3= "4.64," r4= "5.14," &end # # 3374 GLY H 3375 GLU- H 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1601," "1608," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," &end # # 3373 ASN HB- 3374 GLY H 4.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1601," r1= "1.30," r2= "1.80," r3= "4.96," r4= "5.46," igr1= "1591," "1592," &end # # 3370 GLU- HA 3373 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1547," "1587," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3373 ASN H 3373 ASN HB- 3.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1587," "-1," r1= "1.30," r2= "1.80," r3= "3.76," r4= "4.26," igr2= "1591," "1592," &end # # 3372 ALA QB 3373 ASN H 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1587," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," igr1= "1581," "1582," "1583," &end # # 3371 GLN H 3372 ALA H 5.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1560," "1577," r1= "1.30," r2= "1.80," r3= "5.21," r4= "5.71," &end # # 3372 ALA H 3373 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1577," "1587," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3371 GLN HG- 3372 ALA H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1577," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1567," "1568," &end # # 3371 GLN HB+ 3372 ALA H 4.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1577," r1= "1.30," r2= "1.80," r3= "4.45," r4= "4.95," igr1= "1564," "1565," &end # # 3372 ALA H 3372 ALA QB 4.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1577," "-1," r1= "1.30," r2= "1.80," r3= "4.19," r4= "4.69," igr2= "1581," "1582," "1583," &end # # 3371 GLN H 3371 GLN HB- 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "1560," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr2= "1564," "1565," &end # # 3371 GLN H 3372 ALA QB 6.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1560," "-1," r1= "1.30," r2= "1.80," r3= "6.46," r4= "6.96," igr2= "1581," "1582," "1583," &end # # 3370 GLU- QB 3371 GLN H 3.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1560," r1= "1.30," r2= "1.80," r3= "3.49," r4= "3.99," igr1= "1549," "1550," &end # # 3371 GLN H 3371 GLN HB+ 3.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "1560," "-1," r1= "1.30," r2= "1.80," r3= "3.32," r4= "3.82," igr2= "1564," "1565," &end # # 3371 GLN H 3371 GLN HG- 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1560," "-1," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr2= "1567," "1568," &end # # 3358 VAL H 3359 LEU H 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1330," "1346," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," &end # # 3356 GLN HA 3359 LEU H 4.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1296," "1346," r1= "1.30," r2= "1.80," r3= "4.91," r4= "5.41," &end # # 3355 GLN HA 3359 LEU H 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "1346," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," &end # # 3358 VAL HB 3359 LEU H 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "1334," "1346," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," &end # # 3359 LEU H 3359 LEU HB- 3.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "1346," "-1," r1= "1.30," r2= "1.80," r3= "3.41," r4= "3.91," igr2= "1350," "1351," &end # # 3359 LEU H 3359 LEU HB+ 3.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "1346," "-1," r1= "1.30," r2= "1.80," r3= "3.43," r4= "3.93," igr2= "1350," "1351," &end # # 3358 VAL QG1 3359 LEU H 5.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1346," r1= "1.30," r2= "1.80," r3= "5.27," r4= "5.77," igr1= "1336," "1337," "1338," &end # # 3359 LEU H 3359 LEU QQD 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1346," "-1," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3365 LYS+ QB 3366 CYS- H 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1470," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "1452," "1453," &end # # 3365 LYS+ H 3366 CYS- H 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "1470," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," &end # # 3364 HIS H 3365 LYS+ H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "1448," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 3362 HIS HA 3365 LYS+ H 4.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1405," "1448," r1= "1.30," r2= "1.80," r3= "4.20," r4= "4.70," &end # # 3364 HIS QB 3365 LYS+ H 3.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1448," r1= "1.30," r2= "1.80," r3= "3.97," r4= "4.47," igr1= "1434," "1435," &end # # 3365 LYS+ H 3365 LYS+ QB 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr2= "1452," "1453," &end # # 3365 LYS+ H 3365 LYS+ QD 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "-1," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr2= "1458," "1459," &end # # 3365 LYS+ H 3365 LYS+ HG+ 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr2= "1455," "1456," &end # # 1026 LEU QQD 3365 LYS+ H 6.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1448," r1= "1.30," r2= "1.80," r3= "6.90," r4= "7.40," igr1= "435," "436," "437," "439," "440," "441," &end # # 3365 LYS+ H 3365 LYS+ HG- 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr2= "1455," "1456," &end # # 3362 HIS H 3364 HIS H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "1430," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3364 HIS H 3364 HIS HD2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "1444," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3361 LEU HA 3364 HIS H 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "1430," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," &end # # 3364 HIS H 3364 HIS QB 3.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "-1," r1= "1.30," r2= "1.80," r3= "3.06," r4= "3.56," igr2= "1434," "1435," &end # # 3364 HIS H 3366 CYS- HB- 6.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "-1," r1= "1.30," r2= "1.80," r3= "6.20," r4= "6.70," igr2= "1475," "1474," &end # # 3364 HIS H 3365 LYS+ QB 6.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "-1," r1= "1.30," r2= "1.80," r3= "6.02," r4= "6.52," igr2= "1452," "1453," &end # # 3363 ALA QB 3364 HIS H 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1430," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr1= "1424," "1425," "1426," &end # # 3364 HIS H 3391 LEU QQD 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1430," "-1," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3360 LEU H 3361 LEU H 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1365," "1384," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," &end # # 3359 LEU H 3360 LEU H 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1346," "1365," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," &end # # 3358 VAL HA 3360 LEU H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "1365," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3360 LEU H 3360 LEU QB 3.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "1365," "-1," r1= "1.30," r2= "1.80," r3= "3.56," r4= "4.06," igr2= "1369," "1370," &end # # 3359 LEU HB- 3360 LEU H 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1365," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr1= "1350," "1351," &end # # 3359 LEU HB+ 3360 LEU H 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1365," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," igr1= "1350," "1351," &end # # 3359 LEU QQD 3360 LEU H 6.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1365," r1= "1.30," r2= "1.80," r3= "6.31," r4= "6.81," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3360 LEU H 3360 LEU QQD 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "1365," "-1," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 2007 THR H 2007 THR HB 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1030," "1034," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," &end # # 2007 THR H 2007 THR QG2 4.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "1030," "-1," r1= "1.30," r2= "1.80," r3= "4.56," r4= "5.06," igr2= "1036," "1037," "1038," &end # # 3340 ALA H 3340 ALA QB 3.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1044," "-1," r1= "1.30," r2= "1.80," r3= "3.76," r4= "4.26," igr2= "1048," "1049," "1050," &end # # 2007 THR QG2 3340 ALA H 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1044," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr1= "1036," "1037," "1038," &end # # 3340 ALA QB 3341 THR H 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1054," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr1= "1048," "1049," "1050," &end # # 3341 THR H 3341 THR QG2 5.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "1054," "-1," r1= "1.30," r2= "1.80," r3= "5.30," r4= "5.80," igr2= "1060," "1061," "1062," &end # # 3340 ALA H 3341 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1044," "1054," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3341 THR HB 3342 GLY H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1058," "1068," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 3340 ALA QB 3342 GLY H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1068," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1048," "1049," "1050," &end # # 3341 THR QG2 3342 GLY H 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1068," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," igr1= "1060," "1061," "1062," &end # # 3343 PRO QG 3344 THR H 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1089," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr1= "1079," "1080," &end # # 3344 THR H 3344 THR QG2 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "1089," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr2= "1095," "1096," "1097," &end # # 3344 THR H 3345 ALA H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1089," "1103," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," &end # # 3344 THR HA 3345 ALA H 3.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "1091," "1103," r1= "1.30," r2= "1.80," r3= "3.47," r4= "3.97," &end # # 3345 ALA H 3345 ALA QB 3.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "1103," "-1," r1= "1.30," r2= "1.80," r3= "3.77," r4= "4.27," igr2= "1107," "1108," "1109," &end # # 3345 ALA H 3346 ASP- H 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1103," "1113," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," &end # # 3345 ALA HA 3346 ASP- H 3.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "1105," "1113," r1= "1.30," r2= "1.80," r3= "3.51," r4= "4.01," &end # # 3346 ASP- H 3347 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1113," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1126," "1127," &end # # 3346 ASP- H 3347 PRO HD+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1113," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1126," "1127," &end # # 3346 ASP- H 3346 ASP- HB+ 4.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1113," "-1," r1= "1.30," r2= "1.80," r3= "4.17," r4= "4.67," igr2= "1117," "1118," &end # # 3346 ASP- H 3346 ASP- HB- 3.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "1113," "-1," r1= "1.30," r2= "1.80," r3= "3.90," r4= "4.40," igr2= "1117," "1118," &end # # 3346 ASP- H 3349 LYS+ HB- 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "1113," "-1," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr2= "1158," "1159," &end # # 3345 ALA QB 3346 ASP- H 5.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1113," r1= "1.30," r2= "1.80," r3= "5.49," r4= "5.99," igr1= "1107," "1108," "1109," &end # # 3348 GLU- H 3349 LYS+ H 3.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1139," "1154," r1= "1.30," r2= "1.80," r3= "3.19," r4= "3.69," &end # # 3346 ASP- HA 3348 GLU- H 4.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "1139," r1= "1.30," r2= "1.80," r3= "4.96," r4= "5.46," &end # # 3347 PRO HB- 3348 GLU- H 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1139," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr1= "1132," "1133," &end # # 3348 GLU- H 3348 GLU- QB 3.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1139," "-1," r1= "1.30," r2= "1.80," r3= "3.08," r4= "3.58," igr2= "1143," "1144," &end # # 3347 PRO HA 3349 LYS+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1135," "1154," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3346 ASP- HB+ 3349 LYS+ H 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1154," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "1117," "1118," &end # # 3348 GLU- QB 3349 LYS+ H 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1154," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr1= "1143," "1144," &end # # 3349 LYS+ H 3349 LYS+ HB- 3.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "-1," r1= "1.30," r2= "1.80," r3= "3.44," r4= "3.94," igr2= "1158," "1159," &end # # 3349 LYS+ H 3349 LYS+ HG+ 4.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "-1," r1= "1.30," r2= "1.80," r3= "4.81," r4= "5.31," igr2= "1161," "1162," &end # # 3349 LYS+ H 3352 LEU HG 5.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "1229," r1= "1.30," r2= "1.80," r3= "5.21," r4= "5.71," &end # # 3349 LYS+ H 3349 LYS+ HG- 4.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "-1," r1= "1.30," r2= "1.80," r3= "4.81," r4= "5.31," igr2= "1161," "1162," &end # # 3351 LYS+ QB 3352 LEU H 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1222," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr1= "1204," "1205," &end # # 3352 LEU H 3352 LEU HB- 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "1226," "1227," &end # # 3352 LEU H 3352 LEU HG 2.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "1229," r1= "1.30," r2= "1.80," r3= "2.99," r4= "3.49," &end # # 3352 LEU H 3352 LEU HB+ 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "1226," "1227," &end # # 3352 LEU H 3352 LEU QQD 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "-1," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3354 GLN H 3355 GLN H 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "1277," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," &end # # 3353 ILE H 3355 GLN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "1277," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3351 LYS+ HA 3355 GLN H 4.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "1277," r1= "1.30," r2= "1.80," r3= "4.01," r4= "4.51," &end # # 3352 LEU HA 3355 GLN H 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "1277," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," &end # # 3355 GLN H 3355 GLN HG- 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1277," "-1," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr2= "1284," "1285," &end # # 3355 GLN H 3355 GLN HB+ 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "1277," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr2= "1281," "1282," &end # # 1043 LEU QQD 3355 GLN H 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1277," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "683," "684," "685," "687," "688," "689," &end # # 3355 GLN H 3355 GLN HG+ 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1277," "-1," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr2= "1284," "1285," &end # # 3356 GLN H 3357 LEU H 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "1294," "1311," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," &end # # 3366 CYS- H 3367 GLN H 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1470," "1480," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," &end # # 3363 ALA HA 3367 GLN H 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "1480," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," &end # # 3366 CYS- HB+ 3367 GLN H 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1480," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr1= "1475," "1474," &end # # 3367 GLN H 3367 GLN QG 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1480," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr2= "1487," "1488," &end # # 3356 GLN QG 3357 LEU H 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1311," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr1= "1301," "1302," &end # # 3356 GLN QB 3357 LEU H 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1311," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr1= "1298," "1299," &end # # 3357 LEU H 3357 LEU HB+ 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1311," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "1315," "1316," &end # # 3357 LEU H 3357 LEU QQD 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1311," "-1," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3406 ALA H 3407 HIS H 4.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "2080," "2090," r1= "1.30," r2= "1.80," r3= "4.69," r4= "5.19," &end # # 3404 GLN HA 3406 ALA H 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "2080," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," &end # # 3405 VAL HA 3406 ALA H 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "2066," "2080," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," &end # # 3405 VAL HB 3406 ALA H 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "2068," "2080," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," &end # # 3406 ALA H 3406 ALA QB 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "2080," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr2= "2084," "2085," "2086," &end # # 3405 VAL QG2 3406 ALA H 6.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2080," r1= "1.30," r2= "1.80," r3= "6.09," r4= "6.59," igr1= "2074," "2075," "2076," &end # # 3405 VAL QG1 3406 ALA H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2080," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," igr1= "2070," "2071," "2072," &end # # 3350 ARG+ HA 3354 GLN H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1178," "1260," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 3351 LYS+ HA 3354 GLN H 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "1260," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," &end # # 3354 GLN H 3354 GLN HB+ 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr2= "1264," "1265," &end # # 3354 GLN H 3354 GLN HB- 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr2= "1264," "1265," &end # # 3351 LYS+ QB 3354 GLN H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1260," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1204," "1205," &end # # 3353 ILE HB 3354 GLN H 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1245," "1260," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," &end # # 3353 ILE QG1 3354 GLN H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1260," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1251," "1252," &end # # 3354 GLN H 3428 VAL QG1 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr2= "2425," "2426," "2427," &end # # 3353 ILE QG2 3354 GLN H 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1260," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr1= "1247," "1248," "1249," &end # # 3354 GLN H 3354 GLN HG+ 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," igr2= "1267," "1268," &end # # 3354 GLN H 3354 GLN HG- 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," igr2= "1267," "1268," &end # # 3361 LEU H 3362 HIS H 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "1384," "1403," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," &end # # 3362 HIS H 3362 HIS HD2 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "1416," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," &end # # 3362 HIS H 3365 LYS+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "1448," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3362 HIS H 3362 HIS HB+ 3.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "-1," r1= "1.30," r2= "1.80," r3= "3.55," r4= "4.05," igr2= "1407," "1408," &end # # 3362 HIS H 3362 HIS HB- 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "-1," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," igr2= "1407," "1408," &end # # 3361 LEU HB- 3362 HIS H 4.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1403," r1= "1.30," r2= "1.80," r3= "4.31," r4= "4.81," igr1= "1388," "1389," &end # # 3361 LEU HG 3362 HIS H 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1391," "1403," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," &end # # 3362 HIS H 3363 ALA QB 6.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "-1," r1= "1.30," r2= "1.80," r3= "6.52," r4= "7.02," igr2= "1424," "1425," "1426," &end # # 3361 LEU HB+ 3362 HIS H 4.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1403," r1= "1.30," r2= "1.80," r3= "4.31," r4= "4.81," igr1= "1388," "1389," &end # # 3411 SER HA 3414 ILE H 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "2141," "2191," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," &end # # 3413 GLN HB- 3414 ILE H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2191," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2178," "2179," &end # # 3414 ILE H 3414 ILE HG12 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "2201," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3414 ILE H 3414 ILE HB 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "2195," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," &end # # 3414 ILE H 3414 ILE HG13 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "2202," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3414 ILE H 3414 ILE QD1 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "-1," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr2= "2204," "2205," "2206," &end # # 3352 LEU H 3353 ILE H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "1241," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 3353 ILE H 3354 GLN H 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "1260," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," &end # # 3350 ARG+ HA 3353 ILE H 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "1178," "1241," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," &end # # 3352 LEU HB- 3353 ILE H 4.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1241," r1= "1.30," r2= "1.80," r3= "4.08," r4= "4.58," igr1= "1226," "1227," &end # # 3353 ILE H 3353 ILE HB 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "1245," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," &end # # 3352 LEU HB+ 3353 ILE H 4.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1241," r1= "1.30," r2= "1.80," r3= "4.08," r4= "4.58," igr1= "1226," "1227," &end # # 3353 ILE H 3353 ILE QG1 5.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "-1," r1= "1.30," r2= "1.80," r3= "5.04," r4= "5.54," igr2= "1251," "1252," &end # # 3353 ILE H 3353 ILE QG2 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr2= "1247," "1248," "1249," &end # # 3353 ILE H 3353 ILE QD1 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1241," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr2= "1254," "1255," "1256," &end # # 3349 LYS+ H 3351 LYS+ H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "1200," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3348 GLU- HA 3351 LYS+ H 4.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "1200," r1= "1.30," r2= "1.80," r3= "4.29," r4= "4.79," &end # # 3351 LYS+ H 3351 LYS+ QB 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "1200," "-1," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," igr2= "1204," "1205," &end # # 3351 LYS+ H 3351 LYS+ HG- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1200," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1207," "1208," &end # # 3350 ARG+ QG 3351 LYS+ H 6.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1200," r1= "1.30," r2= "1.80," r3= "6.01," r4= "6.51," igr1= "1183," "1184," &end # # 3351 LYS+ H 3351 LYS+ HG+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1200," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1207," "1208," &end # # 3341 THR H 3342 GLY H 4.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1054," "1068," r1= "1.30," r2= "1.80," r3= "4.76," r4= "5.26," &end # # 3341 THR HA 3342 GLY H 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "1056," "1068," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," &end # # 3406 ALA QB 3407 HIS H 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2090," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," igr1= "2084," "2085," "2086," &end # # 3405 VAL QG1 3407 HIS H 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2090," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2070," "2071," "2072," &end # # 3407 HIS H 3407 HIS HD2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2090," "2104," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3407 HIS H 3409 ALA H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2090," "2118," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3407 HIS H 3410 SER H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2090," "2128," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3410 SER H 3411 SER H 3.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2128," "2139," r1= "1.30," r2= "1.80," r3= "3.60," r4= "4.10," &end # # 3411 SER H 3412 ARG+ H 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "2150," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," &end # # 3411 SER H 3411 SER HB- 3.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "-1," r1= "1.30," r2= "1.80," r3= "3.23," r4= "3.73," igr2= "2143," "2144," &end # # 3410 SER QB 3411 SER H 4.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2139," r1= "1.30," r2= "1.80," r3= "4.34," r4= "4.84," igr1= "2132," "2133," &end # # 3411 SER H 3411 SER HB+ 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "2143," "2144," &end # # 3411 SER H 3407 HIS QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2094," "2095," &end # # 3390 VAL QG1 3411 SER H 6.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2139," r1= "1.30," r2= "1.80," r3= "6.03," r4= "6.53," igr1= "1852," "1853," "1854," &end # # 3411 SER H 3414 ILE QD1 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "-1," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr2= "2204," "2205," "2206," &end # # 3394 MET QE 3411 SER H 6.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2139," r1= "1.30," r2= "1.80," r3= "6.26," r4= "6.76," igr1= "1923," "1924," "1925," &end # # 3418 TRP HE1 3429 CYSZ HA 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "2267," "2437," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," &end # # 3357 LEU QQD 3418 TRP HE1 6.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2267," r1= "1.30," r2= "1.80," r3= "6.41," r4= "6.91," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3418 TRP HE1 3428 VAL QG1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2267," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2425," "2426," "2427," &end # # 3417 HIS H 3418 TRP H 4.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "2240," "2257," r1= "1.30," r2= "1.80," r3= "4.10," r4= "4.60," &end # # 3417 HIS H 3417 HIS QB 3.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "2240," "-1," r1= "1.30," r2= "1.80," r3= "3.85," r4= "4.35," igr2= "2244," "2245," &end # # 3430 LEU QQD 3433 LYS+ H 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2497," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HA 3433 LYS+ H 3.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "2497," r1= "1.30," r2= "1.80," r3= "3.73," r4= "4.23," &end # # 3368 ARG+ HB+ 3369 ARG+ H 4.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1521," r1= "1.30," r2= "1.80," r3= "4.23," r4= "4.73," igr1= "1501," "1502," &end # # 3369 ARG+ H 3369 ARG+ QB 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1521," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr2= "1525," "1526," &end # # 3369 ARG+ H 3369 ARG+ QD 4.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1521," "-1," r1= "1.30," r2= "1.80," r3= "4.75," r4= "5.25," igr2= "1531," "1532," &end # # 3368 ARG+ H 3369 ARG+ H 3.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1497," "1521," r1= "1.30," r2= "1.80," r3= "3.95," r4= "4.45," &end # # 3369 ARG+ HG+ 3370 GLU- H 4.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1545," r1= "1.30," r2= "1.80," r3= "4.93," r4= "5.43," igr1= "1528," "1529," &end # # 3369 ARG+ QB 3370 GLU- H 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1545," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "1525," "1526," &end # # 3370 GLU- H 3370 GLU- QB 3.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "1545," "-1," r1= "1.30," r2= "1.80," r3= "3.58," r4= "4.08," igr2= "1549," "1550," &end # # 2003 CYS- QB 2004 PHE H 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "989," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr1= "984," "983," &end # # 3429 CYSZ H 3430 LEU H 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "2435," "2445," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," &end # # 3426 CYS- HB- 3430 LEU H 4.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2445," r1= "1.30," r2= "1.80," r3= "4.68," r4= "5.18," igr1= "2400," "2399," &end # # 3429 CYSZ HB- 3430 LEU H 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2445," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr1= "2440," "2439," &end # # 3426 CYS- HB+ 3430 LEU H 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2445," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "2400," "2399," &end # # 3430 LEU H 3430 LEU HB- 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2445," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "2449," "2450," &end # # 3430 LEU H 3430 LEU HB+ 3.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "2445," "-1," r1= "1.30," r2= "1.80," r3= "3.35," r4= "3.85," igr2= "2449," "2450," &end # # 3430 LEU H 3430 LEU QQD 7.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "2445," "-1," r1= "1.30," r2= "1.80," r3= "7.09," r4= "7.59," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3355 GLN HE2- 3359 LEU QQD 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1289," "1290," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3355 GLN HE2+ 3359 LEU QQD 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1289," "1290," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1043 LEU HG 3355 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "681," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1289," "1290," &end # # 1043 LEU HG 3355 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "681," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1289," "1290," &end # # 3404 GLN H 3404 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2047," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2059," "2060," &end # # 3402 ALA HA 3404 GLN HE2- 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2029," "-1," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr2= "2059," "2060," &end # # 3402 ALA HA 3404 GLN HE2+ 5.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "2029," "-1," r1= "1.30," r2= "1.80," r3= "5.46," r4= "5.96," igr2= "2059," "2060," &end # # 3404 GLN HG- 3404 GLN HE2- 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," igr1= "2054," "2055," igr2= "2059," "2060," &end # # 3404 GLN HG- 3404 GLN HE2+ 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr1= "2054," "2055," igr2= "2059," "2060," &end # # 3404 GLN HB- 3404 GLN HE2+ 4.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.90," r4= "5.40," igr1= "2051," "2052," igr2= "2059," "2060," &end # # 3404 GLN HB- 3404 GLN HE2- 4.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.52," r4= "5.02," igr1= "2051," "2052," igr2= "2059," "2060," &end # # 3402 ALA QB 3404 GLN HE2- 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," igr1= "2031," "2032," "2033," igr2= "2059," "2060," &end # # 3402 ALA QB 3404 GLN HE2+ 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "2031," "2032," "2033," igr2= "2059," "2060," &end # # 1050 ILE QG2 3413 GLN HE2- 5.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.79," r4= "6.29," igr1= "784," "785," "786," igr2= "2186," "2187," &end # # 3409 ALA QB 3413 GLN HE2- 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr1= "2122," "2123," "2124," igr2= "2186," "2187," &end # # 3409 ALA QB 3413 GLN HE2+ 5.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.84," r4= "6.34," igr1= "2122," "2123," "2124," igr2= "2186," "2187," &end # # 1050 ILE QG2 3413 GLN HE2+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "784," "785," "786," igr2= "2186," "2187," &end # # 3413 GLN HG- 3413 GLN HE2+ 3.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.85," r4= "4.35," igr1= "2181," "2182," igr2= "2186," "2187," &end # # 3413 GLN HB- 3413 GLN HE2+ 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr1= "2178," "2179," igr2= "2186," "2187," &end # # 3413 GLN HB- 3413 GLN HE2- 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr1= "2178," "2179," igr2= "2186," "2187," &end # # 3410 SER HA 3413 GLN HE2- 5.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "2130," "-1," r1= "1.30," r2= "1.80," r3= "5.43," r4= "5.93," igr2= "2186," "2187," &end # # 3409 ALA HA 3413 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2186," "2187," &end # # 3410 SER HA 3413 GLN HE2+ 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "2130," "-1," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr2= "2186," "2187," &end # # 3413 GLN HA 3413 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2176," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2186," "2187," &end # # 3367 GLN HE2+ 3391 LEU QQD 5.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.94," r4= "6.44," igr1= "1492," "1493," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3367 GLN HE2+ 3391 LEU HB- 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr1= "1492," "1493," igr2= "1866," "1867," &end # # 3367 GLN HE2+ 3391 LEU HG 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1869," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1492," "1493," &end # # 3367 GLN QB 3367 GLN HE2+ 4.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.34," r4= "4.84," igr1= "1484," "1485," igr2= "1492," "1493," &end # # 3367 GLN QG 3367 GLN HE2+ 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "1487," "1488," igr2= "1492," "1493," &end # # 3367 GLN HE2+ 3392 ASN QB 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr1= "1492," "1493," igr2= "1885," "1886," &end # # 3367 GLN HE2+ 3388 LYS+ HA 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1812," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr1= "1492," "1493," &end # # 3364 HIS HA 3367 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1432," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1492," "1493," &end # # 3367 GLN HE2+ 3392 ASN HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1883," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1492," "1493," &end # # 3367 GLN HE2+ 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1492," "1493," &end # # 3367 GLN HE2- 3392 ASN H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1881," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1492," "1493," &end # # 3367 GLN HE2- 3392 ASN HA 5.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1883," r1= "1.30," r2= "1.80," r3= "5.33," r4= "5.83," igr1= "1492," "1493," &end # # 3367 GLN HA 3367 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1482," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1492," "1493," &end # # 3367 GLN HE2- 3388 LYS+ HA 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1812," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr1= "1492," "1493," &end # # 3367 GLN QG 3367 GLN HE2- 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr1= "1487," "1488," igr2= "1492," "1493," &end # # 3367 GLN QB 3367 GLN HE2- 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr1= "1484," "1485," igr2= "1492," "1493," &end # # 3367 GLN HE2- 3388 LYS+ HB- 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr1= "1492," "1493," igr2= "1814," "1815," &end # # 3367 GLN HE2- 3391 LEU HB- 4.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.32," r4= "4.82," igr1= "1492," "1493," igr2= "1866," "1867," &end # # 3367 GLN HE2- 3391 LEU QQD 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1492," "1493," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3367 GLN HE2- 3388 LYS+ HG+ 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr1= "1492," "1493," igr2= "1817," "1818," &end # # 3398 GLN HB- 3398 GLN HE2+ 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3398 GLN HB+ 3398 GLN HE2- 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3398 GLN HB- 3398 GLN HE2- 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3398 GLN HB+ 3398 GLN HE2+ 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3385 ARG+ QG 3389 ASN HD2+ 4.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.28," r4= "4.78," igr1= "1762," "1763," igr2= "1841," "1842," &end # # 3389 ASN HB- 3389 ASN HD2+ 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3389 ASN HB+ 3389 ASN HD2+ 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3386 THR HA 3389 ASN HD2+ 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr2= "1841," "1842," &end # # 3389 ASN H 3389 ASN HD2+ 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr2= "1841," "1842," &end # # 3386 THR HA 3389 ASN HD2- 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "1841," "1842," &end # # 3389 ASN HB+ 3389 ASN HD2- 3.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.40," r4= "3.90," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3385 ARG+ QG 3389 ASN HD2- 4.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.39," r4= "4.89," igr1= "1762," "1763," igr2= "1841," "1842," &end # # 3389 ASN H 3389 ASN HD2- 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr2= "1841," "1842," &end # # 3389 ASN HB- 3389 ASN HD2- 3.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.40," r4= "3.90," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3392 ASN QB 3392 ASN HD2- 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," igr1= "1885," "1886," igr2= "1890," "1891," &end # # 3389 ASN HA 3392 ASN HD2- 4.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "1834," "-1," r1= "1.30," r2= "1.80," r3= "4.99," r4= "5.49," igr2= "1890," "1891," &end # # 3392 ASN H 3392 ASN HD2- 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "-1," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr2= "1890," "1891," &end # # 3392 ASN QB 3392 ASN HD2+ 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," igr1= "1885," "1886," igr2= "1890," "1891," &end # # 3389 ASN HA 3392 ASN HD2+ 4.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "1834," "-1," r1= "1.30," r2= "1.80," r3= "4.99," r4= "5.49," igr2= "1890," "1891," &end # # 3392 ASN H 3392 ASN HD2+ 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "1881," "-1," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr2= "1890," "1891," &end # # 3367 GLN QB 3392 ASN HD2+ 6.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.13," r4= "6.63," igr1= "1484," "1485," igr2= "1890," "1891," &end # # 3388 LYS+ HB- 3392 ASN HD2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1814," "1815," igr2= "1890," "1891," &end # # 3388 LYS+ HB- 3392 ASN HD2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1814," "1815," igr2= "1890," "1891," &end # # 3367 GLN QB 3392 ASN HD2- 6.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.13," r4= "6.63," igr1= "1484," "1485," igr2= "1890," "1891," &end # # 3371 GLN HB+ 3371 GLN HE2+ 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," igr1= "1564," "1565," igr2= "1572," "1573," &end # # 3371 GLN HA 3371 GLN HE2+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1572," "1573," &end # # 3371 GLN HA 3371 GLN HE2- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1572," "1573," &end # # 3371 GLN HB+ 3371 GLN HE2- 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," igr1= "1564," "1565," igr2= "1572," "1573," &end # # 3373 ASN HD2- 3376 VAL QQG 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr1= "1596," "1597," igr2= "1629," "1630," "1631," "1633," "1634," "1635," &end # # 3373 ASN HD2+ 3376 VAL QQG 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr1= "1596," "1597," igr2= "1629," "1630," "1631," "1633," "1634," "1635," &end # # 3365 LYS+ H 3366 CYS- HB- 4.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1448," "-1," r1= "1.30," r2= "1.80," r3= "4.91," r4= "5.41," igr2= "1475," "1474," &end # # 3367 GLN H 3368 ARG+ H 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "1480," "1497," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," &end # # 3367 GLN QB 3368 ARG+ H 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1497," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr1= "1484," "1485," &end # # 3368 ARG+ H 3368 ARG+ HB- 3.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "1497," "-1," r1= "1.30," r2= "1.80," r3= "3.36," r4= "3.86," igr2= "1501," "1502," &end # # 3368 ARG+ H 3368 ARG+ QG 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "1497," "-1," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr2= "1504," "1505," &end # # 3353 ILE HA 3356 GLN H 4.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "1243," "1294," r1= "1.30," r2= "1.80," r3= "4.44," r4= "4.94," &end # # 3355 GLN HB+ 3356 GLN H 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1294," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr1= "1281," "1282," &end # # 3356 GLN H 3356 GLN QG 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "1294," "-1," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," igr2= "1301," "1302," &end # # 3355 GLN H 3356 GLN H 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "1277," "1294," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," &end # # 3386 THR QG2 3387 MET H 4.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1793," r1= "1.30," r2= "1.80," r3= "4.86," r4= "5.36," igr1= "1785," "1786," "1787," &end # # 3353 ILE QG1 3356 GLN H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1294," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1251," "1252," &end # # 3414 ILE H 3415 ILE H 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "2210," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," &end # # 3411 SER HA 3415 ILE H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2141," "2210," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3413 GLN HA 3415 ILE H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2176," "2210," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3415 ILE H 3415 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2210," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2223," "2224," "2225," &end # # 3415 ILE H 3415 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2210," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2216," "2217," "2218," &end # # 1050 ILE HB 1050 ILE QD1 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "782," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "791," "792," "793," &end # # 1047 PRO HB- 1050 ILE QD1 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr1= "747," "748," igr2= "791," "792," "793," &end # # 1047 PRO HB+ 1050 ILE QD1 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "747," "748," igr2= "791," "792," "793," &end # # 1050 ILE HA 1050 ILE QD1 4.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "780," "-1," r1= "1.30," r2= "1.80," r3= "4.64," r4= "5.14," igr2= "791," "792," "793," &end # # 1050 ILE QD1 3410 SER QB 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "791," "792," "793," igr2= "2132," "2133," &end # # 1050 ILE QD1 3411 SER HA 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2141," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "791," "792," "793," &end # # 1050 ILE QD1 3407 HIS HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2092," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "791," "792," "793," &end # # 1050 ILE QD1 1053 TRP HH2 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "844," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "791," "792," "793," &end # # 1050 ILE QD1 1053 TRP HZ2 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "842," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr1= "791," "792," "793," &end # # 1050 ILE QG2 3353 ILE QD1 7.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.77," r4= "8.27," igr1= "784," "785," "786," igr2= "1254," "1255," "1256," &end # # 1050 ILE QG2 1050 ILE HG12 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "788," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "784," "785," "786," &end # # 1050 ILE QG2 3413 GLN HG- 6.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.47," r4= "6.97," igr1= "784," "785," "786," igr2= "2181," "2182," &end # # 1050 ILE QG2 1053 TRP QB 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "784," "785," "786," igr2= "833," "834," &end # # 1050 ILE HA 1050 ILE QG2 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "780," "-1," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr2= "784," "785," "786," &end # # 1047 PRO HA 1050 ILE QG2 5.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "-1," r1= "1.30," r2= "1.80," r3= "5.84," r4= "6.34," igr2= "784," "785," "786," &end # # 1050 ILE QG2 1054 PHE QD 6.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.01," r4= "6.51," igr1= "784," "785," "786," igr2= "861," "869," &end # # 1050 ILE QG2 1053 TRP HH2 5.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "844," r1= "1.30," r2= "1.80," r3= "5.14," r4= "5.64," igr1= "784," "785," "786," &end # # 1050 ILE QG2 1050 ILE HG13 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "789," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr1= "784," "785," "786," &end # # 1047 PRO HA 1050 ILE HB 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "782," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," &end # # 1050 ILE HB 3410 SER HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "782," "2130," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1058 PRO HG- 2001 GLY HA+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "918," "919," igr2= "963," "964," &end # # 1058 PRO HG+ 2001 GLY HA+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "918," "919," igr2= "963," "964," &end # # 1058 PRO HG- 2001 GLY HA- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "918," "919," igr2= "963," "964," &end # # 1058 PRO HG+ 2001 GLY HA- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "918," "919," igr2= "963," "964," &end # # 1061 ASP- HA 1061 ASP- QB 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "951," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr2= "953," "954," &end # # 1059 GLY QA 1060 PRO HD- 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr1= "930," "931," igr2= "936," "937," &end # # 1017 GLU- QB 1020 SER HB+ 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "274," "275," igr2= "323," "324," &end # # 1044 MET HA 1044 MET QE 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "695," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr2= "704," "705," "706," &end # # 1044 MET QE 3381 LEU QQD 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "704," "705," "706," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1044 MET QE 3359 LEU QQD 5.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.38," r4= "5.88," igr1= "704," "705," "706," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1044 MET QE 3359 LEU QQD 5.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.55," r4= "6.05," igr1= "704," "705," "706," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1044 MET QE 3363 ALA QB 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "704," "705," "706," igr2= "1424," "1425," "1426," &end # # 1044 MET QE 3383 HIS QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "704," "705," "706," igr2= "1731," "1732," &end # # 1044 MET QE 3359 LEU HA 6.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1348," r1= "1.30," r2= "1.80," r3= "6.26," r4= "6.76," igr1= "704," "705," "706," &end # # 1044 MET QE 3383 HIS HE1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1737," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "704," "705," "706," &end # # 1044 MET HG- 1044 MET QE 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr1= "700," "701," igr2= "704," "705," "706," &end # # 1044 MET HG+ 1044 MET QE 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr1= "700," "701," igr2= "704," "705," "706," &end # # 1039 ALA HA 1041 ASP- HB+ 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "625," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr2= "654," "655," &end # # 1039 ALA HA 3359 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "625," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1039 ALA QB 3359 LEU QQD 7.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.79," r4= "8.29," igr1= "627," "628," "629," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1036 PRO QG 1039 ALA QB 7.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.98," r4= "8.48," igr1= "585," "586," igr2= "627," "628," "629," &end # # 1036 PRO QB 1039 ALA QB 6.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.98," r4= "7.48," igr1= "588," "589," igr2= "627," "628," "629," &end # # 1039 ALA QB 1041 ASP- HB+ 7.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.05," r4= "7.55," igr1= "627," "628," "629," igr2= "654," "655," &end # # 1036 PRO HD- 1039 ALA QB 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "582," "583," igr2= "627," "628," "629," &end # # 1036 PRO HD+ 1039 ALA QB 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "582," "583," igr2= "627," "628," "629," &end # # 1035 LEU HB- 1035 LEU QQD 6.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.32," r4= "6.82," igr1= "566," "567," igr2= "571," "572," "573," "575," "576," "577," &end # # 1035 LEU HB+ 1035 LEU QQD 5.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.89," r4= "6.39," igr1= "566," "567," igr2= "571," "572," "573," "575," "576," "577," &end # # 1035 LEU HA 1035 LEU HG 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "564," "569," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," &end # # 1032 LEU QQD 1033 SER HA 7.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "539," r1= "1.30," r2= "1.80," r3= "7.55," r4= "8.05," igr1= "527," "528," "529," "531," "532," "533," &end # # 1033 SER HA 1034 PRO HD+ 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "539," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr2= "549," "550," &end # # 1033 SER HA 1034 PRO HD- 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "539," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr2= "549," "550," &end # # 1017 GLU- QB 1020 SER HB- 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "274," "275," igr2= "323," "324," &end # # 1031 VAL HA 1031 VAL QG2 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "504," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr2= "512," "513," "514," &end # # 1010 VAL HA 1010 VAL HB 2.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "166," "168," r1= "1.30," r2= "1.80," r3= "2.84," r4= "3.34," &end # # 1031 VAL HA 1031 VAL HB 4.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "504," "506," r1= "1.30," r2= "1.80," r3= "4.01," r4= "4.51," &end # # 1010 VAL QG1 1012 PRO HD+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "170," "171," "172," igr2= "196," "197," &end # # 1031 VAL HA 1031 VAL QG1 5.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "504," "-1," r1= "1.30," r2= "1.80," r3= "5.91," r4= "6.41," igr2= "508," "509," "510," &end # # 1010 VAL QG2 1012 PRO HD+ 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "174," "175," "176," igr2= "196," "197," &end # # 1028 GLU- HA 1028 GLU- HB- 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "461," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "463," "464," &end # # 1026 LEU QQD 1028 GLU- HA 7.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "461," r1= "1.30," r2= "1.80," r3= "7.87," r4= "8.37," igr1= "435," "436," "437," "439," "440," "441," &end # # 1028 GLU- HA 1028 GLU- QG 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "461," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr2= "466," "467," &end # # 1028 GLU- HA 1028 GLU- HB+ 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "461," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "463," "464," &end # # 1024 LYS+ HA 1024 LYS+ HB- 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "387," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr2= "389," "390," &end # # 1023 TRP HZ2 1024 LYS+ QE 6.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "374," "-1," r1= "1.30," r2= "1.80," r3= "6.15," r4= "6.65," igr2= "398," "399," &end # # 1023 TRP HH2 1024 LYS+ QE 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "376," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr2= "398," "399," &end # # 1021 ASP- HA 1024 LYS+ QE 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "398," "399," &end # # 1024 LYS+ HA 1024 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "387," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "398," "399," &end # # 1024 LYS+ HB+ 1024 LYS+ QE 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "389," "390," igr2= "398," "399," &end # # 1024 LYS+ QD 1024 LYS+ QE 3.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.55," r4= "4.05," igr1= "395," "396," igr2= "398," "399," &end # # 1024 LYS+ QD 1025 LEU QQD 8.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.44," r4= "8.94," igr1= "395," "396," igr2= "416," "417," "418," "420," "421," "422," &end # # 1021 ASP- QB 1024 LYS+ QD 6.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.12," r4= "6.62," igr1= "334," "335," igr2= "395," "396," &end # # 1024 LYS+ HA 1024 LYS+ QD 4.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "387," "-1," r1= "1.30," r2= "1.80," r3= "4.94," r4= "5.44," igr2= "395," "396," &end # # 1021 ASP- HA 1024 LYS+ QD 5.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "-1," r1= "1.30," r2= "1.80," r3= "5.25," r4= "5.75," igr2= "395," "396," &end # # 1024 LYS+ HB+ 1024 LYS+ QD 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr1= "389," "390," igr2= "395," "396," &end # # 1024 LYS+ HB- 1024 LYS+ QD 3.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.36," r4= "3.86," igr1= "389," "390," igr2= "395," "396," &end # # 1024 LYS+ HB- 1024 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "389," "390," igr2= "398," "399," &end # # 1022 LEU HA 1026 LEU HB+ 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "-1," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," igr2= "430," "431," &end # # 1022 LEU HA 1026 LEU QQD 6.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "-1," r1= "1.30," r2= "1.80," r3= "6.54," r4= "7.04," igr2= "435," "436," "437," "439," "440," "441," &end # # 1022 LEU HA 1022 LEU QQD 6.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "-1," r1= "1.30," r2= "1.80," r3= "6.52," r4= "7.02," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU HA 1022 LEU QQD 6.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "-1," r1= "1.30," r2= "1.80," r3= "6.65," r4= "7.15," igr2= "351," "352," "353," "355," "356," "357," &end # # 1019 PHE QD 1022 LEU QQD 5.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.43," r4= "5.93," igr1= "307," "315," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3361 LEU HA 6.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1386," r1= "1.30," r2= "1.80," r3= "6.08," r4= "6.58," igr1= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3364 HIS QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "351," "352," "353," "355," "356," "357," igr2= "1434," "1435," &end # # 1022 LEU QQD 3360 LEU QB 6.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.71," r4= "7.21," igr1= "351," "352," "353," "355," "356," "357," igr2= "1369," "1370," &end # # 1022 LEU QQD 3394 MET QE 8.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.98," r4= "9.48," igr1= "351," "352," "353," "355," "356," "357," igr2= "1923," "1924," "1925," &end # # 1022 LEU QQD 3391 LEU HG 6.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1869," r1= "1.30," r2= "1.80," r3= "6.31," r4= "6.81," igr1= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3391 LEU HG 6.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1869," r1= "1.30," r2= "1.80," r3= "6.71," r4= "7.21," igr1= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3360 LEU QB 7.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.09," r4= "7.59," igr1= "351," "352," "353," "355," "356," "357," igr2= "1369," "1370," &end # # 1022 LEU QQD 3364 HIS QB 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "351," "352," "353," "355," "356," "357," igr2= "1434," "1435," &end # # 1022 LEU QQD 3361 LEU HA 6.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1386," r1= "1.30," r2= "1.80," r3= "6.08," r4= "6.58," igr1= "351," "352," "353," "355," "356," "357," &end # # 1019 PHE HA 1022 LEU QQD 5.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "-1," r1= "1.30," r2= "1.80," r3= "5.51," r4= "6.01," igr2= "351," "352," "353," "355," "356," "357," &end # # 1019 PHE HA 1022 LEU QQD 5.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "-1," r1= "1.30," r2= "1.80," r3= "5.56," r4= "6.06," igr2= "351," "352," "353," "355," "356," "357," &end # # 1019 PHE QD 1022 LEU HG 6.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "349," r1= "1.30," r2= "1.80," r3= "6.45," r4= "6.95," igr1= "307," "315," &end # # 1022 LEU HB+ 1022 LEU QQD 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr1= "346," "347," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU HB- 1022 LEU QQD 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr1= "346," "347," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU HB+ 1022 LEU QQD 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr1= "346," "347," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU HB- 1022 LEU QQD 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr1= "346," "347," igr2= "351," "352," "353," "355," "356," "357," &end # # 1018 THR HA 1021 ASP- QB 6.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "287," "-1," r1= "1.30," r2= "1.80," r3= "6.12," r4= "6.62," igr2= "334," "335," &end # # 1014 LEU QB 1018 THR HB 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "289," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "227," "228," &end # # 1018 THR HA 1018 THR QG2 3.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "287," "-1," r1= "1.30," r2= "1.80," r3= "3.95," r4= "4.45," igr2= "291," "292," "293," &end # # 1018 THR QG2 1021 ASP- QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "291," "292," "293," igr2= "334," "335," &end # # 1014 LEU QB 1018 THR QG2 6.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.12," r4= "6.62," igr1= "227," "228," igr2= "291," "292," "293," &end # # 1017 GLU- HA 1017 GLU- QG 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "272," "-1," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr2= "277," "278," &end # # 1017 GLU- QG 1020 SER HB+ 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "277," "278," igr2= "323," "324," &end # # 1017 GLU- QG 1020 SER HB- 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "277," "278," igr2= "323," "324," &end # # 1017 GLU- HB+ 1017 GLU- QG 3.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.18," r4= "3.68," igr1= "274," "275," igr2= "277," "278," &end # # 1017 GLU- HB- 1017 GLU- QG 3.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.18," r4= "3.68," igr1= "274," "275," igr2= "277," "278," &end # # 1016 GLN HA 1016 GLN QG 3.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "255," "-1," r1= "1.30," r2= "1.80," r3= "3.95," r4= "4.45," igr2= "260," "261," &end # # 1035 LEU HB- 1038 GLN QG 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "566," "567," igr2= "613," "614," &end # # 1005 GLN HB+ 1005 GLN QG 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr1= "103," "104," igr2= "106," "107," &end # # 1005 GLN HB- 1005 GLN QG 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr1= "103," "104," igr2= "106," "107," &end # # 1019 PHE HA 1019 PHE QD 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "-1," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," igr2= "307," "315," &end # # 1011 GLU- HA 1012 PRO HD+ 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "182," "-1," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr2= "196," "197," &end # # 1011 GLU- HA 1012 PRO HD- 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "182," "-1," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr2= "196," "197," &end # # 1010 VAL HA 1010 VAL QG2 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "166," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "174," "175," "176," &end # # 1009 SER HA 1009 SER QB 3.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "155," "-1," r1= "1.30," r2= "1.80," r3= "3.09," r4= "3.59," igr2= "157," "158," &end # # 1007 ASP- HA 1008 PRO HD+ 3.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "129," "-1," r1= "1.30," r2= "1.80," r3= "3.05," r4= "3.55," igr2= "140," "141," &end # # 1007 ASP- HA 1008 PRO QG 4.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "129," "-1," r1= "1.30," r2= "1.80," r3= "4.83," r4= "5.33," igr2= "143," "144," &end # # 1007 ASP- HB+ 1008 PRO HD+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "131," "132," igr2= "140," "141," &end # # 1006 SER HA 1006 SER QB 3.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "118," "-1," r1= "1.30," r2= "1.80," r3= "3.08," r4= "3.58," igr2= "120," "121," &end # # 1040 MET QE 1043 LEU QB 8.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.14," r4= "8.64," igr1= "644," "645," "646," igr2= "678," "679," &end # # 1040 MET HG+ 1040 MET QE 5.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.58," r4= "6.08," igr1= "640," "641," igr2= "644," "645," "646," &end # # 1040 MET HG- 1040 MET QE 5.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.58," r4= "6.08," igr1= "640," "641," igr2= "644," "645," "646," &end # # 1040 MET HA 1040 MET QE 7.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "-1," r1= "1.30," r2= "1.80," r3= "7.52," r4= "8.02," igr2= "644," "645," "646," &end # # 1055 THR HA 1055 THR QG2 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "875," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr2= "879," "880," "881," &end # # 1055 THR HA 1055 THR HB 3.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "875," "877," r1= "1.30," r2= "1.80," r3= "3.06," r4= "3.56," &end # # 1032 LEU QQD 1030 ASN HB- 7.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.89," r4= "8.39," igr1= "527," "528," "529," "531," "532," "533," igr2= "492," "493," &end # # 1032 LEU QQD 1030 ASN HB+ 7.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.89," r4= "8.39," igr1= "527," "528," "529," "531," "532," "533," igr2= "492," "493," &end # # 1030 ASN HB- 1032 LEU QB 6.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.29," r4= "6.79," igr1= "492," "493," igr2= "522," "523," &end # # 1030 ASN HB+ 1032 LEU QB 6.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.29," r4= "6.79," igr1= "492," "493," igr2= "522," "523," &end # # 1045 LEU QQD 1053 TRP HH2 6.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "844," r1= "1.30," r2= "1.80," r3= "6.45," r4= "6.95," igr1= "719," "720," "721," "723," "724," "725," &end # # 1050 ILE HB 1053 TRP HH2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "782," "844," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1053 TRP HH2 3356 GLN QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "844," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1301," "1302," &end # # 1023 TRP HZ3 3415 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "378," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2216," "2217," "2218," &end # # 1050 ILE QG2 1053 TRP HZ3 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "846," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "784," "785," "786," &end # # 1053 TRP HZ3 3414 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "846," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2204," "2205," "2206," &end # # 1053 TRP HA 1053 TRP HD1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "831," "837," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1019 PHE QD 3357 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "307," "315," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 1019 PHE QE 3357 LEU QQD 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "309," "313," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 1019 PHE HA 1019 PHE QE 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "-1," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr2= "309," "313," &end # # 1050 ILE QG2 1054 PHE QD 6.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.09," r4= "6.59," igr1= "784," "785," "786," igr2= "861," "869," &end # # 1056 GLU- HA 1056 GLU- QG 4.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "889," "-1," r1= "1.30," r2= "1.80," r3= "4.28," r4= "4.78," igr2= "894," "895," &end # # 1056 GLU- HA 1056 GLU- HB+ 2.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "889," "-1," r1= "1.30," r2= "1.80," r3= "2.97," r4= "3.47," igr2= "891," "892," &end # # 1054 PHE HA 1054 PHE QD 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "855," "-1," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr2= "861," "869," &end # # 1052 GLN QG 3352 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "819," "820," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 1052 GLN QB 1052 GLN QG 3.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.49," r4= "3.99," igr1= "816," "817," igr2= "819," "820," &end # # 1052 GLN HA 1052 GLN QG 3.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "814," "-1," r1= "1.30," r2= "1.80," r3= "3.68," r4= "4.18," igr2= "819," "820," &end # # 1049 ASP- HA 1052 GLN QG 5.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "768," "-1," r1= "1.30," r2= "1.80," r3= "5.65," r4= "6.15," igr2= "819," "820," &end # # 1052 GLN QG 1053 TRP HA 5.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "831," r1= "1.30," r2= "1.80," r3= "5.65," r4= "6.15," igr1= "819," "820," &end # # 1011 GLU- HB- 1013 PRO HD- 4.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.30," r4= "4.80," igr1= "184," "185," igr2= "210," "211," &end # # 1052 GLN QB 3352 LEU QQD 7.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.17," r4= "7.67," igr1= "816," "817," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 1047 PRO HA 1050 ILE QD1 4.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "-1," r1= "1.30," r2= "1.80," r3= "4.86," r4= "5.36," igr2= "791," "792," "793," &end # # 1047 PRO HA 1050 ILE HG13 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "789," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1047 PRO HA 1050 ILE HG12 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "750," "788," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," &end # # 1045 LEU QQD 3356 GLN QB 6.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.07," r4= "6.57," igr1= "719," "720," "721," "723," "724," "725," igr2= "1298," "1299," &end # # 1043 LEU QQD 3355 GLN HB+ 5.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.79," r4= "6.29," igr1= "683," "684," "685," "687," "688," "689," igr2= "1281," "1282," &end # # 1043 LEU QQD 3351 LYS+ QE 6.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.25," r4= "6.75," igr1= "683," "684," "685," "687," "688," "689," igr2= "1213," "1214," &end # # 1045 LEU QQD 3356 GLN HA 6.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1296," r1= "1.30," r2= "1.80," r3= "6.87," r4= "7.37," igr1= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 3352 LEU HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1224," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "719," "720," "721," "723," "724," "725," &end # # 1043 LEU HA 1043 LEU QQD 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "676," "-1," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," igr2= "683," "684," "685," "687," "688," "689," &end # # 1045 LEU HA 1045 LEU QQD 6.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "712," "-1," r1= "1.30," r2= "1.80," r3= "6.04," r4= "6.54," igr2= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 1053 TRP HD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "837," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 1053 TRP HH2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "844," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU HA 1045 LEU QQD 5.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "712," "-1," r1= "1.30," r2= "1.80," r3= "5.15," r4= "5.65," igr2= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 3356 GLN HA 7.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1296," r1= "1.30," r2= "1.80," r3= "7.08," r4= "7.58," igr1= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 3352 LEU HA 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1224," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU QQD 3356 GLN QG 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "719," "720," "721," "723," "724," "725," igr2= "1301," "1302," &end # # 1045 LEU HB- 1045 LEU QQD 4.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.83," r4= "5.33," igr1= "714," "715," igr2= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU HB+ 1045 LEU QQD 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "714," "715," igr2= "719," "720," "721," "723," "724," "725," &end # # 1045 LEU HB+ 3352 LEU QQD 6.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.19," r4= "6.69," igr1= "714," "715," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 1014 LEU HA 1014 LEU HB- 2.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "225," "-1," r1= "1.30," r2= "1.80," r3= "2.98," r4= "3.48," igr2= "227," "228," &end # # 1014 LEU HA 1014 LEU HB+ 2.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "225," "-1," r1= "1.30," r2= "1.80," r3= "2.91," r4= "3.41," igr2= "227," "228," &end # # 1041 ASP- HA 1041 ASP- HB+ 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "652," "-1," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," igr2= "654," "655," &end # # 1042 ASP- HA 1042 ASP- QB 3.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "664," "-1," r1= "1.30," r2= "1.80," r3= "3.41," r4= "3.91," igr2= "666," "667," &end # # 1041 ASP- HA 1041 ASP- HB- 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "652," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "654," "655," &end # # 1041 ASP- HB- 3359 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "654," "655," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1039 ALA QB 1041 ASP- HB- 7.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.05," r4= "7.55," igr1= "627," "628," "629," igr2= "654," "655," &end # # 1014 LEU HB+ 1014 LEU QQD 3.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.23," r4= "3.73," igr1= "227," "228," igr2= "232," "233," "234," "236," "237," "238," &end # # 1035 LEU QQD 1038 GLN QG 8.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.76," r4= "9.26," igr1= "571," "572," "573," "575," "576," "577," igr2= "613," "614," &end # # 1026 LEU QQD 3365 LYS+ QE 7.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.05," r4= "7.55," igr1= "435," "436," "437," "439," "440," "441," igr2= "1461," "1462," &end # # 1026 LEU QQD 1027 PRO HD- 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr1= "435," "436," "437," "439," "440," "441," igr2= "446," "447," &end # # 1014 LEU HA 1014 LEU QQD 5.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "225," "-1," r1= "1.30," r2= "1.80," r3= "5.09," r4= "5.59," igr2= "232," "233," "234," "236," "237," "238," &end # # 1014 LEU QQD 3418 TRP HZ3 6.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2274," r1= "1.30," r2= "1.80," r3= "6.30," r4= "6.80," igr1= "232," "233," "234," "236," "237," "238," &end # # 1014 LEU QQD 1019 PHE QD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "232," "233," "234," "236," "237," "238," igr2= "307," "315," &end # # 1014 LEU QQD 3418 TRP HZ2 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2270," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "232," "233," "234," "236," "237," "238," &end # # 1014 LEU QQD 3418 TRP HZ3 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2274," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "232," "233," "234," "236," "237," "238," &end # # 1014 LEU QQD 3418 TRP HE3 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2276," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "232," "233," "234," "236," "237," "238," &end # # 1014 LEU QQD 3418 TRP HZ2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2270," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "232," "233," "234," "236," "237," "238," &end # # 1024 LYS+ HA 1025 LEU QQD 7.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "387," "-1," r1= "1.30," r2= "1.80," r3= "7.01," r4= "7.51," igr2= "416," "417," "418," "420," "421," "422," &end # # 1032 LEU HA 1032 LEU QB 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "520," "-1," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr2= "522," "523," &end # # 1032 LEU HA 1032 LEU QQD 6.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "520," "-1," r1= "1.30," r2= "1.80," r3= "6.83," r4= "7.33," igr2= "527," "528," "529," "531," "532," "533," &end # # 1027 PRO QG 1030 ASN HA 7.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "490," r1= "1.30," r2= "1.80," r3= "7.07," r4= "7.57," igr1= "449," "450," &end # # 1029 ASN HA 1029 ASN HB- 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "476," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr2= "478," "479," &end # # 1023 TRP HA 1026 LEU QQD 6.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "363," "-1," r1= "1.30," r2= "1.80," r3= "6.15," r4= "6.65," igr2= "435," "436," "437," "439," "440," "441," &end # # 1023 TRP HA 1023 TRP HD1 5.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "363," "369," r1= "1.30," r2= "1.80," r3= "5.14," r4= "5.64," &end # # 1023 TRP HA 1023 TRP HE3 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "363," "380," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," &end # # 1023 TRP HB- 1026 LEU QQD 7.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.55," r4= "8.05," igr1= "365," "366," igr2= "435," "436," "437," "439," "440," "441," &end # # 1023 TRP HB+ 1026 LEU QQD 7.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.55," r4= "8.05," igr1= "365," "366," igr2= "435," "436," "437," "439," "440," "441," &end # # 1014 LEU HA 1014 LEU HG 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "225," "230," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," &end # # 1032 LEU QB 1032 LEU QQD 5.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.06," r4= "5.56," igr1= "522," "523," igr2= "527," "528," "529," "531," "532," "533," &end # # 1026 LEU HA 1026 LEU QQD 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "428," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "435," "436," "437," "439," "440," "441," &end # # 1014 LEU HA 1014 LEU QQD 5.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "225," "-1," r1= "1.30," r2= "1.80," r3= "5.37," r4= "5.87," igr2= "232," "233," "234," "236," "237," "238," &end # # 1032 LEU HA 1032 LEU QQD 6.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "520," "-1," r1= "1.30," r2= "1.80," r3= "6.85," r4= "7.35," igr2= "527," "528," "529," "531," "532," "533," &end # # 1032 LEU QQD 3436 SER HB+ 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "527," "528," "529," "531," "532," "533," igr2= "2547," "2548," &end # # 1011 GLU- HA 1011 GLU- QG 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "182," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "187," "188," &end # # 1011 GLU- QG 1012 PRO HD+ 5.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.47," r4= "5.97," igr1= "187," "188," igr2= "196," "197," &end # # 1011 GLU- QG 1013 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "187," "188," igr2= "210," "211," &end # # 1011 GLU- HB+ 1012 PRO HD+ 5.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.46," r4= "5.96," igr1= "184," "185," igr2= "196," "197," &end # # 1011 GLU- HB+ 1013 PRO HD- 4.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.30," r4= "4.80," igr1= "184," "185," igr2= "210," "211," &end # # 1049 ASP- HA 1052 GLN QB 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "768," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr2= "816," "817," &end # # 1011 GLU- HB- 1012 PRO HD+ 5.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.46," r4= "5.96," igr1= "184," "185," igr2= "196," "197," &end # # 1025 LEU HA 1025 LEU QQD 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "409," "-1," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr2= "416," "417," "418," "420," "421," "422," &end # # 1025 LEU HA 1025 LEU HG 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "409," "414," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," &end # # 1043 LEU HA 1043 LEU QQD 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "676," "-1," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr2= "683," "684," "685," "687," "688," "689," &end # # 1032 LEU QB 1032 LEU QQD 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "522," "523," igr2= "527," "528," "529," "531," "532," "533," &end # # 1040 MET QB 1043 LEU QQD 6.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.83," r4= "7.33," igr1= "637," "638," igr2= "683," "684," "685," "687," "688," "689," &end # # 1052 GLN HA 1052 GLN QB 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "814," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr2= "816," "817," &end # # 1021 ASP- HA 1024 LYS+ HG- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "392," "393," &end # # 1035 LEU QQD 1038 GLN QG 7.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.70," r4= "8.20," igr1= "571," "572," "573," "575," "576," "577," igr2= "613," "614," &end # # 1038 GLN HA 1038 GLN QG 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "608," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr2= "613," "614," &end # # 1014 LEU HB- 1014 LEU QQD 3.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.21," r4= "3.71," igr1= "227," "228," igr2= "232," "233," "234," "236," "237," "238," &end # # 1007 ASP- HB+ 1008 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "131," "132," igr2= "140," "141," &end # # 1026 LEU QQD 3365 LYS+ QE 6.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.09," r4= "6.59," igr1= "435," "436," "437," "439," "440," "441," igr2= "1461," "1462," &end # # 1026 LEU HA 1026 LEU QQD 5.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "428," "-1," r1= "1.30," r2= "1.80," r3= "5.79," r4= "6.29," igr2= "435," "436," "437," "439," "440," "441," &end # # 1040 MET HA 1043 LEU QQD 7.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "-1," r1= "1.30," r2= "1.80," r3= "7.02," r4= "7.52," igr2= "683," "684," "685," "687," "688," "689," &end # # 1040 MET HA 1040 MET QB 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr2= "637," "638," &end # # 1005 GLN HA 1005 GLN QG 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "101," "-1," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," igr2= "106," "107," &end # # 1041 ASP- HB+ 1044 MET QE 7.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.55," r4= "8.05," igr1= "654," "655," igr2= "704," "705," "706," &end # # 1045 LEU QQD 1049 ASP- HB- 5.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.98," r4= "6.48," igr1= "719," "720," "721," "723," "724," "725," igr2= "770," "771," &end # # 1045 LEU HG 1049 ASP- HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "717," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "770," "771," &end # # 1045 LEU HB- 1049 ASP- HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "714," "715," igr2= "770," "771," &end # # 1045 LEU HB- 1049 ASP- HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "714," "715," igr2= "770," "771," &end # # 1045 LEU HG 1049 ASP- HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "717," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "770," "771," &end # # 1051 GLU- HA 1051 GLU- QG 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "799," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "804," "805," &end # # 1050 ILE QG2 1051 GLU- HA 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "799," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr1= "784," "785," "786," &end # # 1051 GLU- HA 1054 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "799," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "861," "869," &end # # 1051 GLU- QB 1051 GLU- QG 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr1= "801," "802," igr2= "804," "805," &end # # 1019 PHE QE 3357 LEU HB+ 6.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.11," r4= "6.61," igr1= "309," "313," igr2= "1315," "1316," &end # # 1045 LEU QQD 1046 SER HA 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "731," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "719," "720," "721," "723," "724," "725," &end # # 1039 ALA QB 1041 ASP- HA 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "652," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "627," "628," "629," &end # # 1044 MET HA 3383 HIS HE1 5.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "695," "1737," r1= "1.30," r2= "1.80," r3= "5.55," r4= "6.05," &end # # 1013 PRO QG 1015 SER HA 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "244," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "213," "214," &end # # 1035 LEU HB- 1037 SER HA 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "597," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "566," "567," &end # # 1026 LEU HG 1028 GLU- HA 6.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "433," "461," r1= "1.30," r2= "1.80," r3= "6.80," r4= "7.30," &end # # 1058 PRO HA 1059 GLY QA 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "924," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "930," "931," &end # # 1021 ASP- HA 1024 LYS+ HG+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "392," "393," &end # # 1040 MET HG- 1043 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "640," "641," igr2= "683," "684," "685," "687," "688," "689," &end # # 1043 LEU QQD 3351 LYS+ QD 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "683," "684," "685," "687," "688," "689," igr2= "1210," "1211," &end # # 1040 MET HG- 1043 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "640," "641," igr2= "683," "684," "685," "687," "688," "689," &end # # 1040 MET HG+ 1043 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "640," "641," igr2= "683," "684," "685," "687," "688," "689," &end # # 1045 LEU QQD 1049 ASP- HB+ 5.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.98," r4= "6.48," igr1= "719," "720," "721," "723," "724," "725," igr2= "770," "771," &end # # 1019 PHE QB 1022 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "303," "304," igr2= "351," "352," "353," "355," "356," "357," &end # # 1020 SER HB- 1023 TRP HD1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "369," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "323," "324," &end # # 1020 SER HB+ 1023 TRP HD1 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "369," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "323," "324," &end # # 1060 PRO QG 1061 ASP- QB 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "939," "940," igr2= "953," "954," &end # # 1059 GLY QA 1060 PRO QG 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "930," "931," igr2= "939," "940," &end # # 1051 GLU- QB 1048 ASP- HA 6.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "756," r1= "1.30," r2= "1.80," r3= "6.13," r4= "6.63," igr1= "801," "802," &end # # 1060 PRO HA 1061 ASP- HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "945," "951," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1036 PRO HA 1039 ALA QB 7.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "591," "-1," r1= "1.30," r2= "1.80," r3= "7.39," r4= "7.89," igr2= "627," "628," "629," &end # # 1036 PRO QB 3381 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "588," "589," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1036 PRO QB 3381 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "588," "589," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1035 LEU QB 1036 PRO HD- 5.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.71," r4= "6.21," igr1= "566," "567," igr2= "582," "583," &end # # 1026 LEU HA 1027 PRO HD- 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "428," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "446," "447," &end # # 1026 LEU QQD 1027 PRO HD+ 5.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.04," r4= "5.54," igr1= "435," "436," "437," "439," "440," "441," igr2= "446," "447," &end # # 1035 LEU QB 1036 PRO HD+ 5.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.49," r4= "5.99," igr1= "566," "567," igr2= "582," "583," &end # # 1057 ASP- HB+ 1058 PRO QD 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "906," "907," igr2= "915," "916," &end # # 1026 LEU HA 1027 PRO HD+ 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "428," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "446," "447," &end # # 1057 ASP- HA 1058 PRO QD 4.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "904," "-1," r1= "1.30," r2= "1.80," r3= "4.24," r4= "4.74," igr2= "915," "916," &end # # 1019 PHE HA 1022 LEU HG 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "349," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1007 ASP- HB- 1008 PRO HD+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "131," "132," igr2= "140," "141," &end # # 1007 ASP- HB- 1008 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "131," "132," igr2= "140," "141," &end # # 1007 ASP- HA 1008 PRO HD- 3.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "129," "-1," r1= "1.30," r2= "1.80," r3= "3.05," r4= "3.55," igr2= "140," "141," &end # # 1057 ASP- HB- 1058 PRO QD 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "906," "907," igr2= "915," "916," &end # # 1059 GLY QA 1060 PRO HD+ 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr1= "930," "931," igr2= "936," "937," &end # # 1040 MET HG+ 1043 LEU QQD 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "640," "641," igr2= "683," "684," "685," "687," "688," "689," &end # # 2001 GLY HA- 2002 SER HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "970," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "963," "964," &end # # 2001 GLY HA+ 2002 SER HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "970," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "963," "964," &end # # 1023 TRP HD1 3415 ILE QG2 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "369," "-1," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr2= "2216," "2217," "2218," &end # # 1020 SER HA 1023 TRP HD1 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "321," "369," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," &end # # 1021 ASP- HA 1023 TRP HD1 4.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "332," "369," r1= "1.30," r2= "1.80," r3= "4.86," r4= "5.36," &end # # 1023 TRP HZ2 3415 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "374," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2216," "2217," "2218," &end # # 1050 ILE HB 1053 TRP HZ2 5.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "782," "842," r1= "1.30," r2= "1.80," r3= "5.38," r4= "5.88," &end # # 1050 ILE HG12 1053 TRP HZ2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "788," "842," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1045 LEU QQD 1053 TRP HZ2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "842," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "719," "720," "721," "723," "724," "725," &end # # 1023 TRP HH2 3415 ILE QG2 6.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "376," "-1," r1= "1.30," r2= "1.80," r3= "6.05," r4= "6.55," igr2= "2216," "2217," "2218," &end # # 1050 ILE QG2 1053 TRP HE3 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "848," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "784," "785," "786," &end # # 1053 TRP HE3 3353 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "848," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1247," "1248," "1249," &end # # 1019 PHE HZ 3357 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 1019 PHE HZ 3361 LEU HG 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "1391," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1019 PHE HZ 3432 LEU HG 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "2485," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1039 ALA QB 3381 LEU QQD 9.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "9.37," r4= "9.87," igr1= "627," "628," "629," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1027 PRO QG 1029 ASN HB- 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "449," "450," igr2= "478," "479," &end # # 1027 PRO QG 1029 ASN HB+ 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "449," "450," igr2= "478," "479," &end # # 1019 PHE HA 1022 LEU HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "344," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1022 LEU QQD 3364 HIS HD2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1444," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 3415 ILE QG2 3415 ILE QD1 6.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.35," r4= "6.85," igr1= "2216," "2217," "2218," igr2= "2223," "2224," "2225," &end # # 1022 LEU HB- 3415 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "346," "347," igr2= "2223," "2224," "2225," &end # # 3360 LEU HA 3415 ILE QD1 6.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "6.85," r4= "7.35," igr2= "2223," "2224," "2225," &end # # 3391 LEU HA 3415 ILE QD1 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr2= "2223," "2224," "2225," &end # # 3411 SER HA 3415 ILE QD1 6.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "2141," "-1," r1= "1.30," r2= "1.80," r3= "6.67," r4= "7.17," igr2= "2223," "2224," "2225," &end # # 1023 TRP HZ3 3415 ILE QD1 6.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "378," "-1," r1= "1.30," r2= "1.80," r3= "6.67," r4= "7.17," igr2= "2223," "2224," "2225," &end # # 1019 PHE QD 3415 ILE QD1 6.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.48," r4= "6.98," igr1= "307," "315," igr2= "2223," "2224," "2225," &end # # 1023 TRP HE3 3415 ILE QD1 6.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "380," "-1," r1= "1.30," r2= "1.80," r3= "6.49," r4= "6.99," igr2= "2223," "2224," "2225," &end # # 1023 TRP HZ2 3415 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "374," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2223," "2224," "2225," &end # # 3353 ILE QG1 3414 ILE QD1 6.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.94," r4= "7.44," igr1= "1251," "1252," igr2= "2204," "2205," "2206," &end # # 3357 LEU HB+ 3414 ILE QD1 6.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.59," r4= "7.09," igr1= "1315," "1316," igr2= "2204," "2205," "2206," &end # # 3414 ILE HB 3414 ILE QD1 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "2195," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "2204," "2205," "2206," &end # # 3356 GLN QG 3414 ILE QD1 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr1= "1301," "1302," igr2= "2204," "2205," "2206," &end # # 3414 ILE HA 3414 ILE QD1 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "2193," "-1," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr2= "2204," "2205," "2206," &end # # 3410 SER QB 3414 ILE QD1 5.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.54," r4= "6.04," igr1= "2132," "2133," igr2= "2204," "2205," "2206," &end # # 1053 TRP HH2 3414 ILE QD1 5.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "844," "-1," r1= "1.30," r2= "1.80," r3= "5.63," r4= "6.13," igr2= "2204," "2205," "2206," &end # # 1054 PHE QE 3414 ILE QD1 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "863," "867," igr2= "2204," "2205," "2206," &end # # 3342 GLY QA 3343 PRO HD+ 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr1= "1070," "1071," igr2= "1076," "1077," &end # # 3342 GLY QA 3343 PRO QG 5.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.15," r4= "5.65," igr1= "1070," "1071," igr2= "1079," "1080," &end # # 3341 THR QG2 3342 GLY QA 7.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.02," r4= "7.52," igr1= "1060," "1061," "1062," igr2= "1070," "1071," &end # # 3341 THR HA 3342 GLY QA 5.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1056," "-1," r1= "1.30," r2= "1.80," r3= "5.53," r4= "6.03," igr2= "1070," "1071," &end # # 3340 ALA QB 3341 THR HA 6.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1056," r1= "1.30," r2= "1.80," r3= "6.39," r4= "6.89," igr1= "1048," "1049," "1050," &end # # 3341 THR HA 3341 THR QG2 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1056," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "1060," "1061," "1062," &end # # 2007 THR HA 2007 THR HB 3 (# ) &rst ixpk= "0," nxpk= "0," iat= "1032," "1034," r1= "1.30," r2= "1.80," r3= "3.00," r4= "3.50," &end # # 2004 PHE QD 2007 THR QG2 5.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.94," r4= "6.44," igr1= "997," "1005," igr2= "1036," "1037," "1038," &end # # 2006 GLY HA- 2007 THR QG2 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1025," "1026," igr2= "1036," "1037," "1038," &end # # 2007 THR HA 2007 THR QG2 3.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1032," "-1," r1= "1.30," r2= "1.80," r3= "3.96," r4= "4.46," igr2= "1036," "1037," "1038," &end # # 2006 GLY HA+ 2007 THR QG2 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1025," "1026," igr2= "1036," "1037," "1038," &end # # 3433 LYS+ HA 3434 ASN HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "2521," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 2005 ASN HA 2005 ASN HB- 2.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1011," "-1," r1= "1.30," r2= "1.80," r3= "2.93," r4= "3.43," igr2= "1013," "1014," &end # # 3433 LYS+ QB 3434 ASN HA 6.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2521," r1= "1.30," r2= "1.80," r3= "6.12," r4= "6.62," igr1= "2501," "2502," &end # # 3373 ASN HB+ 3376 VAL QG2 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr1= "1591," "1592," igr2= "1633," "1634," "1635," &end # # 3431 PRO HA 3434 ASN HB- 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2474," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "2523," "2524," &end # # 3373 ASN HB- 3376 VAL QG1 5.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.86," r4= "6.36," igr1= "1591," "1592," igr2= "1629," "1630," "1631," &end # # 3430 LEU HG 3434 ASN HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2452," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2523," "2524," &end # # 2004 PHE HA 2004 PHE QD 4.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "991," "-1," r1= "1.30," r2= "1.80," r3= "4.27," r4= "4.77," igr2= "997," "1005," &end # # 2003 CYS- QB 2004 PHE HA 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "991," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "984," "983," &end # # 3344 THR HA 3344 THR QG2 4.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "1091," "-1," r1= "1.30," r2= "1.80," r3= "4.30," r4= "4.80," igr2= "1095," "1096," "1097," &end # # 3346 ASP- HA 3347 PRO HD- 3.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "3.69," r4= "4.19," igr2= "1126," "1127," &end # # 3346 ASP- HA 3347 PRO HD+ 3.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "3.69," r4= "4.19," igr2= "1126," "1127," &end # # 3346 ASP- HA 3347 PRO HG- 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr2= "1129," "1130," &end # # 3346 ASP- HB- 3349 LYS+ HB- 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr1= "1117," "1118," igr2= "1158," "1159," &end # # 3347 PRO HA 3350 ARG+ QB 4.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1135," "-1," r1= "1.30," r2= "1.80," r3= "4.31," r4= "4.81," igr2= "1180," "1181," &end # # 3346 ASP- HA 3347 PRO HG+ 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr2= "1129," "1130," &end # # 3385 ARG+ HA 3388 LYS+ HG- 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," igr2= "1817," "1818," &end # # 3342 GLY QA 3343 PRO HD- 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr1= "1070," "1071," igr2= "1076," "1077," &end # # 3439 ARG+ HB+ 3439 ARG+ QG 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "2592," "2593," igr2= "2595," "2596," &end # # 3439 ARG+ HB- 3439 ARG+ QG 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "2592," "2593," igr2= "2595," "2596," &end # # 3439 ARG+ QG 3439 ARG+ QD 3.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.23," r4= "3.73," igr1= "2595," "2596," igr2= "2598," "2599," &end # # 3439 ARG+ HA 3439 ARG+ QG 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2590," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr2= "2595," "2596," &end # # 3439 ARG+ HA 3439 ARG+ QD 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "2590," "-1," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr2= "2598," "2599," &end # # 3377 ARG+ HB- 3377 ARG+ QD 3.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.49," r4= "3.99," igr1= "1643," "1644," igr2= "1649," "1650," &end # # 3438 LYS+ HA 3438 LYS+ HG+ 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "-1," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr2= "2573," "2574," &end # # 3438 LYS+ HB+ 3438 LYS+ QE 4.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.83," r4= "5.33," igr1= "2570," "2571," igr2= "2579," "2580," &end # # 3438 LYS+ HA 3438 LYS+ HG- 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "-1," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr2= "2573," "2574," &end # # 3375 GLU- HA 3375 GLU- HB- 2.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "1610," "-1," r1= "1.30," r2= "1.80," r3= "2.77," r4= "3.27," igr2= "1612," "1613," &end # # 3375 GLU- HA 3375 GLU- HG+ 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1610," "-1," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," igr2= "1615," "1616," &end # # 3438 LYS+ HA 3438 LYS+ QE 6.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "-1," r1= "1.30," r2= "1.80," r3= "6.94," r4= "7.44," igr2= "2579," "2580," &end # # 3438 LYS+ HA 3438 LYS+ HB+ 2.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "-1," r1= "1.30," r2= "1.80," r3= "2.82," r4= "3.32," igr2= "2570," "2571," &end # # 1032 LEU QQD 3436 SER HA 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2545," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "527," "528," "529," "531," "532," "533," &end # # 1032 LEU QQD 3436 SER HB- 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "527," "528," "529," "531," "532," "533," igr2= "2547," "2548," &end # # 3436 SER HB- 3438 LYS+ QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2547," "2548," igr2= "2573," "2574," &end # # 3436 SER HB+ 3438 LYS+ QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2547," "2548," igr2= "2573," "2574," &end # # 3436 SER HB- 3438 LYS+ HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2547," "2548," igr2= "2570," "2571," &end # # 3436 SER HB+ 3438 LYS+ HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2547," "2548," igr2= "2570," "2571," &end # # 1032 LEU QQD 3435 ALA HA 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2535," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "527," "528," "529," "531," "532," "533," &end # # 3399 ALA HA 3403 CYS- HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1990," "2039," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3434 ASN HA 3435 ALA HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2521," "2535," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3401 LYS+ QB 3402 ALA QB 5.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.54," r4= "6.04," igr1= "2009," "2010," igr2= "2031," "2032," "2033," &end # # 3408 CYSZ HA 3409 ALA HA 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "2110," "2120," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," &end # # 3409 ALA HA 3410 SER HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "2130," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3409 ALA HA 3412 ARG+ HB- 4.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "-1," r1= "1.30," r2= "1.80," r3= "4.23," r4= "4.73," igr2= "2154," "2155," &end # # 3409 ALA HA 3412 ARG+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2160," "2161," &end # # 3432 LEU HA 3432 LEU QQD 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2480," "-1," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3428 VAL QG1 3431 PRO QG 6.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.08," r4= "6.58," igr1= "2425," "2426," "2427," igr2= "2468," "2469," &end # # 3430 LEU HB+ 3431 PRO HD- 3.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.66," r4= "4.16," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3430 LEU HB+ 3431 PRO HD+ 3.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.66," r4= "4.16," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3430 LEU HA 3430 LEU QQD 4.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "-1," r1= "1.30," r2= "1.80," r3= "4.22," r4= "4.72," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HB- 3430 LEU HG 2.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2452," r1= "1.30," r2= "1.80," r3= "2.95," r4= "3.45," igr1= "2449," "2450," &end # # 3430 LEU HA 3430 LEU HG 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "2452," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," &end # # 3366 CYS- HA 3369 ARG+ HG+ 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "1472," "-1," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr2= "1528," "1529," &end # # 3430 LEU HB+ 3430 LEU QQD 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr1= "2449," "2450," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HB- 3430 LEU QQD 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "2449," "2450," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU QQD 3434 ASN HB- 5.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.15," r4= "5.65," igr1= "2454," "2455," "2456," "2458," "2459," "2460," igr2= "2523," "2524," &end # # 3425 ASP- HA 3430 LEU QQD 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "-1," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HB- 3431 PRO HD+ 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3430 LEU HB- 3431 PRO HD- 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3427 PRO HA 3430 LEU HB- 4.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2415," "-1," r1= "1.30," r2= "1.80," r3= "4.83," r4= "5.33," igr2= "2449," "2450," &end # # 3427 PRO HA 3430 LEU HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2415," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2449," "2450," &end # # 3430 LEU HB+ 3431 PRO HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2474," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2449," "2450," &end # # 3429 CYSZ HA 3432 LEU QQD 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "2437," "-1," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3418 TRP HH2 3429 CYSZ HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "2437," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3429 CYSZ HB+ 3433 LYS+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2440," "2439," igr2= "2507," "2508," &end # # 3426 CYS- HB+ 3429 CYSZ HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2400," "2399," igr2= "2440," "2439," &end # # 3429 CYSZ HB- 3433 LYS+ QD 5.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.63," r4= "6.13," igr1= "2440," "2439," igr2= "2507," "2508," &end # # 3426 CYS- HB+ 3429 CYSZ HB- 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," igr1= "2400," "2399," igr2= "2440," "2439," &end # # 3354 GLN HG+ 3428 VAL HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2421," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1267," "1268," &end # # 3354 GLN HG- 3428 VAL HA 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2421," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," igr1= "1267," "1268," &end # # 3428 VAL HA 3431 PRO HG- 4.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "2421," "-1," r1= "1.30," r2= "1.80," r3= "4.64," r4= "5.14," igr2= "2468," "2469," &end # # 3428 VAL HA 3428 VAL QG2 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "2421," "-1," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," igr2= "2429," "2430," "2431," &end # # 3428 VAL HA 3428 VAL QG1 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "2421," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "2425," "2426," "2427," &end # # 3418 TRP HD1 3428 VAL QG1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2265," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2425," "2426," "2427," &end # # 3353 ILE QG2 3428 VAL QG1 4.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.79," r4= "5.29," igr1= "1247," "1248," "1249," igr2= "2425," "2426," "2427," &end # # 3427 PRO HA 3430 LEU QQD 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2415," "-1," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3426 CYS- HA 3430 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2397," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3433 LYS+ HA 3433 LYS+ HG- 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "2504," "2505," &end # # 3425 ASP- HA 3430 LEU HB- 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "-1," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr2= "2449," "2450," &end # # 3425 ASP- HA 3430 LEU HG 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "2452," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," &end # # 3413 GLN HA 3413 GLN HB+ 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2176," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr2= "2178," "2179," &end # # 3351 LYS+ HA 3351 LYS+ QB 3.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "-1," r1= "1.30," r2= "1.80," r3= "3.14," r4= "3.64," igr2= "1204," "1205," &end # # 3413 GLN HA 3413 GLN HB- 2.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "2176," "-1," r1= "1.30," r2= "1.80," r3= "2.97," r4= "3.47," igr2= "2178," "2179," &end # # 3424 HIS HA 3424 HIS QB 3.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "-1," r1= "1.30," r2= "1.80," r3= "3.08," r4= "3.58," igr2= "2369," "2370," &end # # 3424 HIS HA 3426 CYS- HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2400," "2399," &end # # 3423 ARG+ HB+ 3424 HIS HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2367," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2345," "2346," &end # # 3424 HIS HA 3433 LYS+ QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2501," "2502," &end # # 3424 HIS HA 3433 LYS+ QD 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "-1," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr2= "2507," "2508," &end # # 3423 ARG+ HB- 3424 HIS HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2367," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2345," "2346," &end # # 3424 HIS QB 3433 LYS+ QE 5.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.83," r4= "6.33," igr1= "2369," "2370," igr2= "2510," "2511," &end # # 3423 ARG+ HA 3423 ARG HD+ 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2343," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "2351," "2352," &end # # 3423 ARG+ HA 3423 ARG+ HD- 5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2343," "-1," r1= "1.30," r2= "1.80," r3= "5.00," r4= "5.50," igr2= "2351," "2352," &end # # 3423 ARG+ HA 3423 ARG+ HG+ 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "2343," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr2= "2348," "2349," &end # # 3422 THR HA 3422 THR QG2 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "2329," "-1," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr2= "2333," "2334," "2335," &end # # 3418 TRP HA 3421 CYS- HA 5.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2259," "2319," r1= "1.30," r2= "1.80," r3= "5.60," r4= "6.10," &end # # 3362 HIS HD2 3384 CYSZ HB- 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr2= "1750," "1749," &end # # 3362 HIS HA 3365 LYS+ QB 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "1405," "-1," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," igr2= "1452," "1453," &end # # 3416 SER HA 3419 LYS+ QB 5.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "2231," "-1," r1= "1.30," r2= "1.80," r3= "5.21," r4= "5.71," igr2= "2285," "2286," &end # # 3415 ILE QG2 3416 SER HA 5.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2231," r1= "1.30," r2= "1.80," r3= "5.68," r4= "6.18," igr1= "2216," "2217," "2218," &end # # 3360 LEU QQD 3414 ILE QD1 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2204," "2205," "2206," &end # # 3398 GLN HA 3399 ALA QB 6.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "-1," r1= "1.30," r2= "1.80," r3= "6.35," r4= "6.85," igr2= "1992," "1993," "1994," &end # # 3398 GLN HA 3398 GLN HG+ 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "1978," "1979," &end # # 3397 CYS- HA 3398 GLN HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1963," "1973," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3398 GLN HA 3399 ALA HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "1990," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3398 GLN HA 3398 GLN HB+ 2.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "-1," r1= "1.30," r2= "1.80," r3= "2.98," r4= "3.48," igr2= "1975," "1976," &end # # 3398 GLN HB+ 3398 GLN HG- 2.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.74," r4= "3.24," igr1= "1975," "1976," igr2= "1978," "1979," &end # # 3371 GLN HA 3371 GLN HG+ 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," igr2= "1567," "1568," &end # # 3398 GLN HB+ 3398 GLN HG+ 2.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.74," r4= "3.24," igr1= "1975," "1976," igr2= "1978," "1979," &end # # 3404 GLN HA 3404 GLN HG- 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "-1," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," igr2= "2054," "2055," &end # # 3399 ALA QB 3400 GLY HA+ 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "1992," "1993," "1994," igr2= "2000," "2001," &end # # 3399 ALA QB 3400 GLY HA- 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "1992," "1993," "1994," igr2= "2000," "2001," &end # # 3401 LYS+ QB 3402 ALA HA 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2029," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2009," "2010," &end # # 3402 ALA QB 3403 CYS- HA 5.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2039," r1= "1.30," r2= "1.80," r3= "5.13," r4= "5.63," igr1= "2031," "2032," "2033," &end # # 3403 CYS- HA 3405 VAL QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2074," "2075," "2076," &end # # 3399 ALA QB 3403 CYS- HA 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2039," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr1= "1992," "1993," "1994," &end # # 3403 CYS- HA 3404 GLN HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2051," "2052," &end # # 3403 CYS- HA 3403 CYS- QB 3.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "3.21," r4= "3.71," igr2= "2042," "2041," &end # # 3404 GLN HA 3404 GLN HB+ 2.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "-1," r1= "1.30," r2= "1.80," r3= "2.66," r4= "3.16," igr2= "2051," "2052," &end # # 3404 GLN HA 3409 ALA QB 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2122," "2123," "2124," &end # # 3403 CYS- HA 3404 GLN HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2051," "2052," &end # # 3404 GLN HB- 3404 GLN HG+ 3.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.05," r4= "3.55," igr1= "2051," "2052," igr2= "2054," "2055," &end # # 3404 GLN HA 3404 GLN HG+ 4.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "-1," r1= "1.30," r2= "1.80," r3= "4.92," r4= "5.42," igr2= "2054," "2055," &end # # 3371 GLN HA 3371 GLN HG- 3.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "3.55," r4= "4.05," igr2= "1567," "1568," &end # # 3371 GLN HB+ 3371 GLN HG- 2.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.60," r4= "3.10," igr1= "1564," "1565," igr2= "1567," "1568," &end # # 3403 CYS- HA 3404 GLN HG+ 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr2= "2054," "2055," &end # # 3404 GLN HA 3405 VAL HA 5.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "2049," "2066," r1= "1.30," r2= "1.80," r3= "5.37," r4= "5.87," &end # # 3405 VAL HA 3406 ALA QB 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "2066," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2084," "2085," "2086," &end # # 3405 VAL HA 3405 VAL QG1 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "2066," "-1," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," igr2= "2070," "2071," "2072," &end # # 3405 VAL QG2 3408 CYSZ HB- 5.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.36," r4= "5.86," igr1= "2074," "2075," "2076," igr2= "2113," "2112," &end # # 3405 VAL HA 3405 VAL QG2 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2066," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr2= "2074," "2075," "2076," &end # # 3405 VAL QG2 3408 CYSZ HB+ 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "2074," "2075," "2076," igr2= "2113," "2112," &end # # 3405 VAL QG2 3408 CYSZ HA 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr1= "2074," "2075," "2076," &end # # 3405 VAL QG1 3408 CYSZ HA 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr1= "2070," "2071," "2072," &end # # 3405 VAL QG1 3408 CYSZ HB- 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr1= "2070," "2071," "2072," igr2= "2113," "2112," &end # # 3405 VAL QG1 3408 CYSZ HB+ 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr1= "2070," "2071," "2072," igr2= "2113," "2112," &end # # 3405 VAL QG1 3406 ALA QB 6.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.49," r4= "6.99," igr1= "2070," "2071," "2072," igr2= "2084," "2085," "2086," &end # # 3405 VAL QG1 3406 ALA HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2082," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2070," "2071," "2072," &end # # 3406 ALA HA 3407 HIS HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2082," "2092," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1048 ASP- HA 3406 ALA QB 6.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "756," "-1," r1= "1.30," r2= "1.80," r3= "6.43," r4= "6.93," igr2= "2084," "2085," "2086," &end # # 1047 PRO HB- 3406 ALA QB 6.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.41," r4= "6.91," igr1= "747," "748," igr2= "2084," "2085," "2086," &end # # 3360 LEU HG 3411 SER HA 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1372," "2141," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," &end # # 3394 MET QG 3408 CYSZ HA 5.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "5.72," r4= "6.22," igr1= "1919," "1920," &end # # 3393 HIS HD2 3408 CYSZ HA 5.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "2110," r1= "1.30," r2= "1.80," r3= "5.36," r4= "5.86," &end # # 3406 ALA HA 3409 ALA QB 4.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2082," "-1," r1= "1.30," r2= "1.80," r3= "4.70," r4= "5.20," igr2= "2122," "2123," "2124," &end # # 3408 CYSZ HB- 3409 ALA QB 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2113," "2112," igr2= "2122," "2123," "2124," &end # # 3409 ALA QB 3412 ARG+ HB- 6.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.65," r4= "7.15," igr1= "2122," "2123," "2124," igr2= "2154," "2155," &end # # 3409 ALA QB 3412 ARG+ HB+ 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr1= "2122," "2123," "2124," igr2= "2154," "2155," &end # # 3393 HIS HD2 3408 CYSZ HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2113," "2112," &end # # 3393 HIS HD2 3397 CYS- HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1966," "1965," &end # # 3391 LEU HA 3391 LEU QQD 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3349 LYS+ HG+ 3349 LYS+ QE 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr1= "1161," "1162," igr2= "1167," "1168," &end # # 3401 LYS+ QB 3401 LYS+ QG 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr1= "2009," "2010," igr2= "2012," "2013," &end # # 3401 LYS+ QG 3401 LYS+ QD 4.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.09," r4= "4.59," igr1= "2012," "2013," igr2= "2015," "2016," &end # # 3349 LYS+ QD 3349 LYS+ QE 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr1= "1164," "1165," igr2= "1167," "1168," &end # # 3401 LYS+ QD 3401 LYS+ QE 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr1= "2015," "2016," igr2= "2018," "2019," &end # # 3359 LEU HB- 3359 LEU QQD 4.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.40," r4= "4.90," igr1= "1350," "1351," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3366 CYS- HB+ 3388 LYS+ HE+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1475," "1474," igr2= "1823," "1824," &end # # 3394 MET QG 3397 CYS- HB- 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1919," "1920," igr2= "1966," "1965," &end # # 3362 HIS HE1 3366 CYS- HB+ 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr2= "1475," "1474," &end # # 3393 HIS HD2 3408 CYSZ HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2113," "2112," &end # # 3393 HIS HE1 3397 CYS- HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1905," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1966," "1965," &end # # 3393 HIS HE1 3397 CYS- HA 4.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1905," "1963," r1= "1.30," r2= "1.80," r3= "4.46," r4= "4.96," &end # # 3415 ILE QD1 3418 TRP QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "2223," "2224," "2225," igr2= "2261," "2262," &end # # 3392 ASN HA 3395 THR HB 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "1883," "1933," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," &end # # 3395 THR HA 3395 THR HB 2.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1931," "1933," r1= "1.30," r2= "1.80," r3= "2.73," r4= "3.23," &end # # 3392 ASN QB 3395 THR QG2 6.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.94," r4= "7.44," igr1= "1885," "1886," igr2= "1935," "1936," "1937," &end # # 3395 THR HA 3395 THR QG2 4.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "1931," "-1," r1= "1.30," r2= "1.80," r3= "4.24," r4= "4.74," igr2= "1935," "1936," "1937," &end # # 1023 TRP HE3 3395 THR QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "380," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1935," "1936," "1937," &end # # 3395 THR QG2 1023 TRP HZ3 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "378," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "1935," "1936," "1937," &end # # 3394 MET HA 3397 CYS- HA 4.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "1963," r1= "1.30," r2= "1.80," r3= "4.93," r4= "5.43," &end # # 3394 MET HA 3397 CYS- HB- 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "-1," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr2= "1966," "1965," &end # # 3394 MET HA 3397 CYS- HB+ 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr2= "1966," "1965," &end # # 3394 MET QE 3415 ILE QD1 5.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.75," r4= "6.25," igr1= "1923," "1924," "1925," igr2= "2223," "2224," "2225," &end # # 3391 LEU QQD 3394 MET QE 4.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.18," r4= "4.68," igr1= "1871," "1872," "1873," "1875," "1876," "1877," igr2= "1923," "1924," "1925," &end # # 3390 VAL QG1 3394 MET QE 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr1= "1852," "1853," "1854," igr2= "1923," "1924," "1925," &end # # 3390 VAL QG2 3394 MET QE 7.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.40," r4= "7.90," igr1= "1856," "1857," "1858," igr2= "1923," "1924," "1925," &end # # 3394 MET QG 3394 MET QE 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "1919," "1920," igr2= "1923," "1924," "1925," &end # # 3394 MET QE 3412 ARG+ HA 5.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2152," r1= "1.30," r2= "1.80," r3= "5.37," r4= "5.87," igr1= "1923," "1924," "1925," &end # # 3391 LEU HA 3394 MET QE 3.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "3.53," r4= "4.03," igr2= "1923," "1924," "1925," &end # # 3394 MET QE 3411 SER HB- 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr1= "1923," "1924," "1925," igr2= "2143," "2144," &end # # 3394 MET QE 3411 SER HB+ 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," igr1= "1923," "1924," "1925," igr2= "2143," "2144," &end # # 3390 VAL QG1 3394 MET QG 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr1= "1852," "1853," "1854," igr2= "1919," "1920," &end # # 3394 MET QG 3415 ILE QG2 7.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.10," r4= "7.60," igr1= "1919," "1920," igr2= "2216," "2217," "2218," &end # # 3394 MET HA 3394 MET QG 3.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "1914," "-1," r1= "1.30," r2= "1.80," r3= "3.86," r4= "4.36," igr2= "1919," "1920," &end # # 3391 LEU HA 3394 MET QG 5.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "5.75," r4= "6.25," igr2= "1919," "1920," &end # # 3393 HIS HD2 3394 MET QG 5.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "-1," r1= "1.30," r2= "1.80," r3= "5.20," r4= "5.70," igr2= "1919," "1920," &end # # 3394 MET HB- 3394 MET QE 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr1= "1916," "1917," igr2= "1923," "1924," "1925," &end # # 3391 LEU QQD 3394 MET HB- 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "1871," "1872," "1873," "1875," "1876," "1877," igr2= "1916," "1917," &end # # 3391 LEU HA 3394 MET HB- 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," igr2= "1916," "1917," &end # # 3394 MET HB- 3408 CYSZ HA 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr1= "1916," "1917," &end # # 3391 LEU HA 3394 MET HB+ 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr2= "1916," "1917," &end # # 3391 LEU QQD 3394 MET HB+ 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," igr1= "1871," "1872," "1873," "1875," "1876," "1877," igr2= "1916," "1917," &end # # 3394 MET HB+ 3394 MET QE 2.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.88," r4= "3.38," igr1= "1916," "1917," igr2= "1923," "1924," "1925," &end # # 3391 LEU HB+ 3392 ASN HA 4.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1883," r1= "1.30," r2= "1.80," r3= "4.75," r4= "5.25," igr1= "1866," "1867," &end # # 3392 ASN HA 3392 ASN QB 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "1883," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr2= "1885," "1886," &end # # 3391 LEU HB+ 3392 ASN QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1866," "1867," igr2= "1885," "1886," &end # # 3386 THR HA 3387 MET HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "1795," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3386 THR HA 3389 ASN HA 6.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "1834," r1= "1.30," r2= "1.80," r3= "6.10," r4= "6.60," &end # # 3386 THR HA 3389 ASN HB- 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "-1," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," igr2= "1836," "1837," &end # # 3386 THR HA 3386 THR QG2 4.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "-1," r1= "1.30," r2= "1.80," r3= "4.19," r4= "4.69," igr2= "1785," "1786," "1787," &end # # 3383 HIS HA 3386 THR HB 3.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "1729," "1783," r1= "1.30," r2= "1.80," r3= "3.66," r4= "4.16," &end # # 3386 THR QG2 3407 HIS HD2 5.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2104," r1= "1.30," r2= "1.80," r3= "5.85," r4= "6.35," igr1= "1785," "1786," "1787," &end # # 3386 THR QG2 3387 MET HA 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1795," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr1= "1785," "1786," "1787," &end # # 3386 THR QG2 3390 VAL HB 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1850," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1785," "1786," "1787," &end # # 1044 MET QE 3386 THR QG2 7.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.12," r4= "7.62," igr1= "704," "705," "706," igr2= "1785," "1786," "1787," &end # # 3386 THR QG2 3390 VAL QG1 6.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.84," r4= "7.34," igr1= "1785," "1786," "1787," igr2= "1852," "1853," "1854," &end # # 3362 HIS HE1 3379 CYS- QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1678," "1677," &end # # 3379 CYS- HA 3379 CYS- QB 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "1675," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr2= "1678," "1677," &end # # 3370 GLU- QB 3378 ALA QB 6.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.11," r4= "6.61," igr1= "1549," "1550," igr2= "1667," "1668," "1669," &end # # 3369 ARG+ QD 3378 ALA QB 7.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.10," r4= "7.60," igr1= "1531," "1532," igr2= "1667," "1668," "1669," &end # # 3370 GLU- QB 3378 ALA HA 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1665," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr1= "1549," "1550," &end # # 3376 VAL QG2 3378 ALA HA 6.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1665," r1= "1.30," r2= "1.80," r3= "6.59," r4= "7.09," igr1= "1633," "1634," "1635," &end # # 3377 ARG+ HA 3377 ARG+ QD 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1641," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr2= "1649," "1650," &end # # 3377 ARG+ HA 3377 ARG+ HB+ 2.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "1641," "-1," r1= "1.30," r2= "1.80," r3= "2.87," r4= "3.37," igr2= "1643," "1644," &end # # 3377 ARG+ HB- 3377 ARG+ QG 2.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.99," r4= "3.49," igr1= "1643," "1644," igr2= "1646," "1647," &end # # 3377 ARG+ HB+ 3377 ARG+ QG 3.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.08," r4= "3.58," igr1= "1643," "1644," igr2= "1646," "1647," &end # # 3377 ARG+ HA 3377 ARG+ QG 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1641," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "1646," "1647," &end # # 3377 ARG+ QG 3377 ARG+ QD 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr1= "1646," "1647," igr2= "1649," "1650," &end # # 3369 ARG+ QD 3370 GLU- HA 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1547," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr1= "1531," "1532," &end # # 3376 VAL HA 3377 ARG+ HA 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "1641," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," &end # # 3376 VAL HA 3376 VAL HB 2.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "1627," r1= "1.30," r2= "1.80," r3= "2.93," r4= "3.43," &end # # 3376 VAL HA 3377 ARG+ HB- 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr2= "1643," "1644," &end # # 3376 VAL QG2 3377 ARG+ HA 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1641," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," igr1= "1633," "1634," "1635," &end # # 3376 VAL HA 3376 VAL QG1 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "1629," "1630," "1631," &end # # 3372 ALA QB 3376 VAL QQG 8.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.90," r4= "9.40," igr1= "1581," "1582," "1583," igr2= "1629," "1630," "1631," "1633," "1634," "1635," &end # # 3370 GLU- HG- 3376 VAL QG2 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "1552," "1553," igr2= "1633," "1634," "1635," &end # # 3369 ARG+ HG+ 3376 VAL QG2 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr1= "1528," "1529," igr2= "1633," "1634," "1635," &end # # 3373 ASN HB- 3376 VAL QG2 5.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.02," r4= "5.52," igr1= "1591," "1592," igr2= "1633," "1634," "1635," &end # # 3376 VAL HA 3376 VAL QG2 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr2= "1633," "1634," "1635," &end # # 3371 GLN HG+ 3372 ALA HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1579," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1567," "1568," &end # # 3371 GLN HG- 3372 ALA HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1579," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1567," "1568," &end # # 3369 ARG+ QB 3372 ALA QB 6.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.39," r4= "6.89," igr1= "1525," "1526," igr2= "1581," "1582," "1583," &end # # 3369 ARG+ QD 3372 ALA QB 7.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.48," r4= "7.98," igr1= "1531," "1532," igr2= "1581," "1582," "1583," &end # # 3368 ARG+ HA 3371 GLN HB+ 3.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "1499," "-1," r1= "1.30," r2= "1.80," r3= "3.27," r4= "3.77," igr2= "1564," "1565," &end # # 3371 GLN HA 3371 GLN HB- 2.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "2.76," r4= "3.26," igr2= "1564," "1565," &end # # 1050 ILE QG2 3413 GLN HB+ 5.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.60," r4= "6.10," igr1= "784," "785," "786," igr2= "2178," "2179," &end # # 3363 ALA HA 3366 CYS- HA 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "1472," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," &end # # 3366 CYS- HA 3369 ARG+ QB 3.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "1472," "-1," r1= "1.30," r2= "1.80," r3= "3.69," r4= "4.19," igr2= "1525," "1526," &end # # 3362 HIS HE1 3366 CYS- HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "1472," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3366 CYS- HB+ 3379 CYS- QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1475," "1474," igr2= "1678," "1677," &end # # 3366 CYS- HB+ 3388 LYS+ HE- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1475," "1474," igr2= "1823," "1824," &end # # 3363 ALA HA 3366 CYS- HB+ 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "1475," "1474," &end # # 3362 HIS HD2 3366 CYS- HB+ 4.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "4.81," r4= "5.31," igr2= "1475," "1474," &end # # 3363 ALA QB 3366 CYS- HB+ 6.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.26," r4= "6.76," igr1= "1424," "1425," "1426," igr2= "1475," "1474," &end # # 3370 GLU- HA 3370 GLU- QB 3.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1547," "-1," r1= "1.30," r2= "1.80," r3= "3.20," r4= "3.70," igr2= "1549," "1550," &end # # 3366 CYS- HB- 3379 CYS- QB 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr1= "1475," "1474," igr2= "1678," "1677," &end # # 3363 ALA HA 3391 LEU QQD 7.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "-1," r1= "1.30," r2= "1.80," r3= "7.08," r4= "7.58," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3363 ALA HA 3366 CYS- HB- 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "-1," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr2= "1475," "1474," &end # # 3362 HIS HD2 3363 ALA HA 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "1422," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," &end # # 3363 ALA QB 3386 THR QG2 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "1424," "1425," "1426," igr2= "1785," "1786," "1787," &end # # 3363 ALA QB 3388 LYS+ HG+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1424," "1425," "1426," igr2= "1817," "1818," &end # # 3363 ALA QB 3388 LYS+ HB+ 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr1= "1424," "1425," "1426," igr2= "1814," "1815," &end # # 3363 ALA QB 3387 MET HG+ 5.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.54," r4= "6.04," igr1= "1424," "1425," "1426," igr2= "1800," "1801," &end # # 3363 ALA QB 3384 CYSZ HB- 5.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.91," r4= "6.41," igr1= "1424," "1425," "1426," igr2= "1750," "1749," &end # # 3363 ALA QB 3387 MET HG- 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1424," "1425," "1426," igr2= "1800," "1801," &end # # 3363 ALA QB 3387 MET HA 5.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1795," r1= "1.30," r2= "1.80," r3= "5.64," r4= "6.14," igr1= "1424," "1425," "1426," &end # # 3362 HIS HD2 3363 ALA QB 4.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "4.31," r4= "4.81," igr2= "1424," "1425," "1426," &end # # 3362 HIS HA 3362 HIS HD2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1405," "1416," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1050 ILE QG2 3410 SER HA 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2130," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr1= "784," "785," "786," &end # # 3410 SER HA 3413 GLN HB+ 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2130," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr2= "2178," "2179," &end # # 3359 LEU QQD 3362 HIS HB- 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1407," "1408," &end # # 3359 LEU QQD 3362 HIS HB+ 4.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.90," r4= "5.40," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1407," "1408," &end # # 3359 LEU HA 3362 HIS HB+ 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1348," "-1," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr2= "1407," "1408," &end # # 3355 GLN HA 3358 VAL HB 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "1334," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 1019 PHE QE 3358 VAL QG1 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "309," "313," igr2= "1336," "1337," "1338," &end # # 1019 PHE HZ 3358 VAL QG1 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr2= "1336," "1337," "1338," &end # # 3355 GLN HA 3358 VAL QG1 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "-1," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr2= "1336," "1337," "1338," &end # # 3358 VAL HA 3358 VAL QG1 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "1336," "1337," "1338," &end # # 3358 VAL QQG 3432 LEU HG 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2485," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1336," "1337," "1338," "1340," "1341," "1342," &end # # 3358 VAL HA 3358 VAL QG2 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr2= "1340," "1341," "1342," &end # # 3345 ALA HA 3346 ASP- HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1105," "1115," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 2005 ASN HA 2005 ASN HB+ 2.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1011," "-1," r1= "1.30," r2= "1.80," r3= "2.93," r4= "3.43," igr2= "1013," "1014," &end # # 3434 ASN HA 3434 ASN HB- 2.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "2521," "-1," r1= "1.30," r2= "1.80," r3= "2.95," r4= "3.45," igr2= "2523," "2524," &end # # 3430 LEU HG 3434 ASN HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2452," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2523," "2524," &end # # 3364 HIS QB 3365 LYS+ HA 6.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1450," r1= "1.30," r2= "1.80," r3= "6.05," r4= "6.55," igr1= "1434," "1435," &end # # 1026 LEU QQD 3365 LYS+ HA 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1450," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr1= "435," "436," "437," "439," "440," "441," &end # # 3365 LYS+ HA 3365 LYS+ QE 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr2= "1461," "1462," &end # # 3357 LEU QQD 3414 ILE HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2193," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3415 ILE HA 3418 TRP QB 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "2212," "-1," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," igr2= "2261," "2262," &end # # 3415 ILE HA 3415 ILE QD1 4.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "2212," "-1," r1= "1.30," r2= "1.80," r3= "4.65," r4= "5.15," igr2= "2223," "2224," "2225," &end # # 3415 ILE HA 3419 LYS+ QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2212," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2285," "2286," &end # # 3415 ILE HB 3415 ILE QD1 4.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2214," "-1," r1= "1.30," r2= "1.80," r3= "4.01," r4= "4.51," igr2= "2223," "2224," "2225," &end # # 3410 SER QB 3413 GLN HB- 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr1= "2132," "2133," igr2= "2178," "2179," &end # # 3410 SER HA 3413 GLN HB- 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "2130," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "2178," "2179," &end # # 1050 ILE QG2 3413 GLN HB- 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "784," "785," "786," igr2= "2178," "2179," &end # # 3352 LEU HA 3355 GLN HG- 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "1284," "1285," &end # # 1043 LEU QQD 3355 GLN HG- 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "683," "684," "685," "687," "688," "689," igr2= "1284," "1285," &end # # 3412 ARG+ HA 3412 ARG+ QD 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "-1," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr2= "2160," "2161," &end # # 3412 ARG+ HA 3412 ARG+ HB- 2.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "-1," r1= "1.30," r2= "1.80," r3= "2.86," r4= "3.36," igr2= "2154," "2155," &end # # 3412 ARG+ HA 3415 ILE QG2 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "-1," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," igr2= "2216," "2217," "2218," &end # # 3412 ARG+ HA 3415 ILE HB 3.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "2214," r1= "1.30," r2= "1.80," r3= "3.16," r4= "3.66," &end # # 1050 ILE QG2 3410 SER QB 5.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.89," r4= "6.39," igr1= "784," "785," "786," igr2= "2132," "2133," &end # # 1050 ILE HG12 3410 SER QB 5.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "788," "-1," r1= "1.30," r2= "1.80," r3= "5.21," r4= "5.71," igr2= "2132," "2133," &end # # 3406 ALA QB 3407 HIS HA 6.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2092," r1= "1.30," r2= "1.80," r3= "6.05," r4= "6.55," igr1= "2084," "2085," "2086," &end # # 3407 HIS HA 3410 SER QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2092," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2132," "2133," &end # # 3434 ASN HB+ 3435 ALA HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2535," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2523," "2524," &end # # 3399 ALA QB 3403 CYS- QB 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," igr1= "1992," "1993," "1994," igr2= "2042," "2041," &end # # 3398 GLN HB+ 3399 ALA QB 5.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.49," r4= "5.99," igr1= "1975," "1976," igr2= "1992," "1993," "1994," &end # # 3418 TRP HA 3418 TRP HE3 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "2259," "2276," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," &end # # 3392 ASN QB 3393 HIS HA 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1897," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "1885," "1886," &end # # 3348 GLU- HA 3348 GLU- HG+ 3.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "3.13," r4= "3.63," igr2= "1146," "1147," &end # # 3423 ARG+ HA 3423 ARG+ HG- 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "2343," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr2= "2348," "2349," &end # # 3391 LEU HA 3391 LEU HG 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "1869," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," &end # # 3360 LEU HA 3391 LEU HG 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "1869," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," &end # # 3388 LYS+ HA 3391 LEU HG 5.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "1869," r1= "1.30," r2= "1.80," r3= "5.06," r4= "5.56," &end # # 3391 LEU HB- 3391 LEU QQD 4.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.52," r4= "5.02," igr1= "1866," "1867," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3360 LEU HG 3391 LEU QQD 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "1372," "-1," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3360 LEU HA 3391 LEU QQD 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3391 LEU QQD 3394 MET QG 6.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.87," r4= "7.37," igr1= "1871," "1872," "1873," "1875," "1876," "1877," igr2= "1919," "1920," &end # # 3394 MET QG 3391 LEU QQD 6.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.96," r4= "7.46," igr1= "1919," "1920," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3388 LYS+ HA 3391 LEU HB+ 4.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "4.76," r4= "5.26," igr2= "1866," "1867," &end # # 3391 LEU HB+ 3391 LEU QQD 3.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.51," r4= "4.01," igr1= "1866," "1867," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3388 LYS+ HA 3391 LEU HB- 3.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "3.58," r4= "4.08," igr2= "1866," "1867," &end # # 3391 LEU HB- 3391 LEU QQD 3.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.19," r4= "3.69," igr1= "1866," "1867," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3363 ALA QB 3391 LEU QQD 3.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.95," r4= "4.45," igr1= "1424," "1425," "1426," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3391 LEU HB+ 3391 LEU QQD 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr1= "1866," "1867," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3364 HIS QB 3391 LEU QQD 5.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.06," r4= "5.56," igr1= "1434," "1435," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3388 LYS+ HA 3391 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3391 LEU HA 3391 LEU QQD 4.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "1864," "-1," r1= "1.30," r2= "1.80," r3= "4.20," r4= "4.70," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 1053 TRP HD1 3352 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "837," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 1053 TRP HZ2 3352 LEU QQD 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "842," "-1," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3390 VAL HA 3393 HIS HB- 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "-1," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," igr2= "1899," "1900," &end # # 3390 VAL HA 3394 MET QE 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "-1," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr2= "1923," "1924," "1925," &end # # 3390 VAL HA 3393 HIS HD2 4.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "1908," r1= "1.30," r2= "1.80," r3= "4.94," r4= "5.44," &end # # 3387 MET HA 3390 VAL HB 4.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "1850," r1= "1.30," r2= "1.80," r3= "4.10," r4= "4.60," &end # # 3387 MET QE 3390 VAL HB 5.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1850," r1= "1.30," r2= "1.80," r3= "5.27," r4= "5.77," igr1= "1804," "1805," "1806," &end # # 3390 VAL QG2 3393 HIS HD2 6.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1908," r1= "1.30," r2= "1.80," r3= "6.28," r4= "6.78," igr1= "1856," "1857," "1858," &end # # 3390 VAL QG2 3407 HIS HD2 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2104," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," igr1= "1856," "1857," "1858," &end # # 3387 MET HA 3390 VAL QG2 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr2= "1856," "1857," "1858," &end # # 3390 VAL QG2 3408 CYSZ HA 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr1= "1856," "1857," "1858," &end # # 3390 VAL HA 3390 VAL QG2 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr2= "1856," "1857," "1858," &end # # 3390 VAL QG2 3394 MET HB- 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1856," "1857," "1858," igr2= "1916," "1917," &end # # 3387 MET QE 3390 VAL QG2 5.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.09," r4= "5.59," igr1= "1804," "1805," "1806," igr2= "1856," "1857," "1858," &end # # 3390 VAL QG1 3393 HIS HD2 5.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1908," r1= "1.30," r2= "1.80," r3= "5.86," r4= "6.36," igr1= "1852," "1853," "1854," &end # # 3387 MET HA 3390 VAL QG1 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr2= "1852," "1853," "1854," &end # # 3390 VAL QG1 3411 SER HB- 4.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.55," r4= "5.05," igr1= "1852," "1853," "1854," igr2= "2143," "2144," &end # # 3390 VAL QG1 3408 CYSZ HA 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr1= "1852," "1853," "1854," &end # # 3390 VAL HA 3390 VAL QG1 3.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "-1," r1= "1.30," r2= "1.80," r3= "3.33," r4= "3.83," igr2= "1852," "1853," "1854," &end # # 3390 VAL QG1 3394 MET HB- 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1852," "1853," "1854," igr2= "1916," "1917," &end # # 3387 MET QE 3390 VAL QG1 5.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.84," r4= "6.34," igr1= "1804," "1805," "1806," igr2= "1852," "1853," "1854," &end # # 3389 ASN HA 3392 ASN QB 3.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "1834," "-1," r1= "1.30," r2= "1.80," r3= "3.27," r4= "3.77," igr2= "1885," "1886," &end # # 3386 THR HA 3389 ASN HB+ 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1781," "-1," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," igr2= "1836," "1837," &end # # 3389 ASN HB+ 3390 VAL QG2 5.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.51," r4= "6.01," igr1= "1836," "1837," igr2= "1856," "1857," "1858," &end # # 3389 ASN HB- 3390 VAL QG2 5.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.51," r4= "6.01," igr1= "1836," "1837," igr2= "1856," "1857," "1858," &end # # 3363 ALA QB 3388 LYS+ HA 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1812," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," igr1= "1424," "1425," "1426," &end # # 3385 ARG+ HA 3388 LYS+ HE- 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr2= "1823," "1824," &end # # 3388 LYS+ HB+ 3388 LYS+ HE- 3.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.90," r4= "4.40," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3385 ARG+ HA 3388 LYS+ HE+ 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr2= "1823," "1824," &end # # 3388 LYS+ HB+ 3388 LYS+ HE+ 3.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.90," r4= "4.40," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3367 GLN HA 3388 LYS+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1482," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1820," "1821," &end # # 3388 LYS+ HB- 3388 LYS+ HE- 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3388 LYS+ HB- 3388 LYS+ HE+ 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3429 CYSZ HB- 3433 LYS+ QB 6.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.14," r4= "6.64," igr1= "2440," "2439," igr2= "2501," "2502," &end # # 3367 GLN QG 3388 LYS+ HB- 4.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.62," r4= "5.12," igr1= "1487," "1488," igr2= "1814," "1815," &end # # 3360 LEU QQD 3387 MET HA 6.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1795," r1= "1.30," r2= "1.80," r3= "6.32," r4= "6.82," igr1= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3387 MET QE 3407 HIS HD2 7.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2104," r1= "1.30," r2= "1.80," r3= "7.31," r4= "7.81," igr1= "1804," "1805," "1806," &end # # 1053 TRP HH2 3387 MET QE 6.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "844," "-1," r1= "1.30," r2= "1.80," r3= "6.36," r4= "6.86," igr2= "1804," "1805," "1806," &end # # 3387 MET HA 3387 MET QE 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "-1," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr2= "1804," "1805," "1806," &end # # 3387 MET QE 3407 HIS HA 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2092," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "1804," "1805," "1806," &end # # 3387 MET QE 3411 SER HB- 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1804," "1805," "1806," igr2= "2143," "2144," &end # # 3387 MET HG- 3387 MET QE 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr1= "1800," "1801," igr2= "1804," "1805," "1806," &end # # 3387 MET HG+ 3387 MET QE 4.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.10," r4= "4.60," igr1= "1800," "1801," igr2= "1804," "1805," "1806," &end # # 3356 GLN QG 3387 MET QE 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr1= "1301," "1302," igr2= "1804," "1805," "1806," &end # # 3363 ALA QB 3387 MET QE 8.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.61," r4= "9.11," igr1= "1424," "1425," "1426," igr2= "1804," "1805," "1806," &end # # 3360 LEU QQD 3387 MET QE 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1804," "1805," "1806," &end # # 3360 LEU QQD 3387 MET HB- 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1797," "1798," &end # # 3360 LEU QQD 3387 MET HB+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1797," "1798," &end # # 3359 LEU HB+ 3387 MET HG- 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," igr1= "1350," "1351," igr2= "1800," "1801," &end # # 3386 THR QG2 3387 MET HG- 6.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.18," r4= "6.68," igr1= "1785," "1786," "1787," igr2= "1800," "1801," &end # # 3359 LEU QQD 3387 MET HG- 4.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.48," r4= "4.98," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1800," "1801," &end # # 3360 LEU HA 3387 MET HG+ 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," igr2= "1800," "1801," &end # # 3384 CYSZ HA 3387 MET HG+ 5.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "1747," "-1," r1= "1.30," r2= "1.80," r3= "5.45," r4= "5.95," igr2= "1800," "1801," &end # # 3359 LEU HB+ 3387 MET HG+ 4.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.14," r4= "4.64," igr1= "1350," "1351," igr2= "1800," "1801," &end # # 3359 LEU QQD 3387 MET HG+ 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1800," "1801," &end # # 3385 ARG+ HA 3385 ARG+ HB- 2.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "2.95," r4= "3.45," igr2= "1759," "1760," &end # # 3385 ARG+ HA 3388 LYS+ QD 3.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "3.81," r4= "4.31," igr2= "1820," "1821," &end # # 3385 ARG+ HB+ 3385 ARG+ HD- 4.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.27," r4= "4.77," igr1= "1759," "1760," igr2= "1765," "1766," &end # # 3385 ARG+ HB+ 3385 ARG HD+ 4.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.27," r4= "4.77," igr1= "1759," "1760," igr2= "1765," "1766," &end # # 3385 ARG+ HB+ 3385 ARG+ QG 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "1759," "1760," igr2= "1762," "1763," &end # # 3385 ARG+ HA 3385 ARG+ QG 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "1762," "1763," &end # # 3385 ARG+ HB- 3385 ARG+ QG 3.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.47," r4= "3.97," igr1= "1759," "1760," igr2= "1762," "1763," &end # # 3385 ARG+ QG 3388 LYS+ HG+ 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1762," "1763," igr2= "1817," "1818," &end # # 3385 ARG+ QG 3385 ARG HD+ 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," igr1= "1762," "1763," igr2= "1765," "1766," &end # # 3385 ARG+ QG 3385 ARG+ HD- 3.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.31," r4= "3.81," igr1= "1762," "1763," igr2= "1765," "1766," &end # # 3385 ARG+ HB- 3385 ARG+ HD- 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr1= "1759," "1760," igr2= "1765," "1766," &end # # 3385 ARG+ HB- 3385 ARG HD+ 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr1= "1759," "1760," igr2= "1765," "1766," &end # # 3362 HIS HD2 3384 CYSZ HA 4.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "1747," r1= "1.30," r2= "1.80," r3= "4.14," r4= "4.64," &end # # 3384 CYSZ HA 3388 LYS+ HB+ 5.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "1747," "-1," r1= "1.30," r2= "1.80," r3= "5.27," r4= "5.77," igr2= "1814," "1815," &end # # 3363 ALA QB 3384 CYSZ HA 5.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1747," r1= "1.30," r2= "1.80," r3= "5.08," r4= "5.58," igr1= "1424," "1425," "1426," &end # # 3359 LEU QQD 3384 CYSZ HA 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1747," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3381 LEU QQD 3384 CYSZ HA 6.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1747," r1= "1.30," r2= "1.80," r3= "6.32," r4= "6.82," igr1= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3384 CYSZ HA 3387 MET HA 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1747," "1795," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," &end # # 3381 LEU HB+ 3384 CYSZ HB+ 4.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.40," r4= "4.90," igr1= "1698," "1699," igr2= "1750," "1749," &end # # 3381 LEU HB- 3384 CYSZ HB+ 4.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.40," r4= "4.90," igr1= "1698," "1699," igr2= "1750," "1749," &end # # 3381 LEU HB- 3382 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1698," "1699," igr2= "1714," "1715," &end # # 3381 LEU HB+ 3382 PRO HD- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1698," "1699," igr2= "1714," "1715," &end # # 3381 LEU HA 3382 PRO HD+ 3.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "1696," "-1," r1= "1.30," r2= "1.80," r3= "3.57," r4= "4.07," igr2= "1714," "1715," &end # # 3381 LEU HA 3381 LEU QQD 4.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "1696," "-1," r1= "1.30," r2= "1.80," r3= "4.28," r4= "4.78," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU HA 3381 LEU QQD 4.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "1696," "-1," r1= "1.30," r2= "1.80," r3= "4.64," r4= "5.14," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU HA 3381 LEU HG 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1696," "1701," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," &end # # 3381 LEU HG 3382 PRO HD+ 4.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "1701," "-1," r1= "1.30," r2= "1.80," r3= "4.90," r4= "5.40," igr2= "1714," "1715," &end # # 3381 LEU HG 3382 PRO HD- 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "1701," "-1," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr2= "1714," "1715," &end # # 3381 LEU HG 3384 CYSZ HB+ 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1701," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr2= "1750," "1749," &end # # 3357 LEU QQD 3361 LEU HG 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1391," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3362 HIS HE1 3381 LEU QQD 5.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "-1," r1= "1.30," r2= "1.80," r3= "5.94," r4= "6.44," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3362 HIS HD2 3381 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU QQD 3382 PRO HD+ 4.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.72," r4= "5.22," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1714," "1715," &end # # 3381 LEU QQD 3382 PRO HD- 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1714," "1715," &end # # 3381 LEU QQD 3384 CYSZ HB+ 6.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.12," r4= "6.62," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1750," "1749," &end # # 1036 PRO QG 3381 LEU QQD 7.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.16," r4= "7.66," igr1= "585," "586," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3362 HIS HD2 3381 LEU QQD 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1036 PRO HA 3381 LEU QQD 7.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "591," "-1," r1= "1.30," r2= "1.80," r3= "7.34," r4= "7.84," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU QQD 3382 PRO HD+ 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1714," "1715," &end # # 3381 LEU QQD 3382 PRO HD- 4.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.74," r4= "5.24," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1714," "1715," &end # # 3381 LEU QQD 3384 CYSZ HB+ 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1750," "1749," &end # # 3381 LEU QQD 3384 CYSZ HB- 6.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.14," r4= "6.64," igr1= "1703," "1704," "1705," "1707," "1708," "1709," igr2= "1750," "1749," &end # # 3381 LEU HB- 3381 LEU QQD 3.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.65," r4= "4.15," igr1= "1698," "1699," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU HB+ 3381 LEU QQD 3.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.65," r4= "4.15," igr1= "1698," "1699," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3359 LEU QQD 3381 LEU QQD 4.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.72," r4= "5.22," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3375 GLU- HB+ 3375 GLU- HG- 2.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.73," r4= "3.23," igr1= "1612," "1613," igr2= "1615," "1616," &end # # 3375 GLU- HB+ 3375 GLU- HG+ 2.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.73," r4= "3.23," igr1= "1612," "1613," igr2= "1615," "1616," &end # # 3375 GLU- HA 3375 GLU- HG- 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1610," "-1," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," igr2= "1615," "1616," &end # # 3409 ALA HA 3412 ARG+ HB+ 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "2120," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr2= "2154," "2155," &end # # 3412 ARG+ HB+ 3412 ARG+ HG+ 2.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.74," r4= "3.24," igr1= "2154," "2155," igr2= "2157," "2158," &end # # 3370 GLU- QB 3370 GLU- HG- 2.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.94," r4= "3.44," igr1= "1549," "1550," igr2= "1552," "1553," &end # # 3370 GLU- QB 3376 VAL QG2 5.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.92," r4= "6.42," igr1= "1549," "1550," igr2= "1633," "1634," "1635," &end # # 3369 ARG+ QD 3370 GLU- QB 5.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.49," r4= "5.99," igr1= "1531," "1532," igr2= "1549," "1550," &end # # 3370 GLU- HA 3373 ASN HB- 4.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "1547," "-1," r1= "1.30," r2= "1.80," r3= "4.22," r4= "4.72," igr2= "1591," "1592," &end # # 3369 ARG+ HA 3369 ARG+ QB 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "1523," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr2= "1525," "1526," &end # # 3369 ARG+ HA 3369 ARG+ HG- 3.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1523," "-1," r1= "1.30," r2= "1.80," r3= "3.85," r4= "4.35," igr2= "1528," "1529," &end # # 3369 ARG+ HA 3369 ARG+ HG+ 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "1523," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr2= "1528," "1529," &end # # 3369 ARG+ HA 3372 ALA QB 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1523," "-1," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr2= "1581," "1582," "1583," &end # # 3370 GLU- HA 3376 VAL QG2 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "1547," "-1," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr2= "1633," "1634," "1635," &end # # 3361 LEU HA 3361 LEU QQD 6.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "6.35," r4= "6.85," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3361 LEU QQD 3432 LEU QQD 6.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.98," r4= "7.48," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3361 LEU HA 3364 HIS QB 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr2= "1434," "1435," &end # # 3357 LEU QQD 3361 LEU HA 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1386," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3361 LEU HA 3391 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3361 LEU HA 3391 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3361 LEU HA 3361 LEU QQD 6.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "6.35," r4= "6.85," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1053 TRP HH2 3360 LEU QQD 6.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "844," "-1," r1= "1.30," r2= "1.80," r3= "6.49," r4= "6.99," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU QQD 3411 SER HB- 5.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.63," r4= "6.13," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2143," "2144," &end # # 3360 LEU QQD 3411 SER HB+ 5.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.15," r4= "5.65," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2143," "2144," &end # # 3360 LEU QQD 3387 MET HG- 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1800," "1801," &end # # 3360 LEU QQD 3387 MET HG+ 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1800," "1801," &end # # 3356 GLN QG 3360 LEU QQD 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "1301," "1302," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU QB 3360 LEU QQD 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr1= "1369," "1370," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU QQD 3363 ALA QB 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1424," "1425," "1426," &end # # 3360 LEU QQD 3415 ILE QD1 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2223," "2224," "2225," &end # # 3360 LEU QQD 3411 SER HB- 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2143," "2144," &end # # 3360 LEU QQD 3411 SER HA 4.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2141," r1= "1.30," r2= "1.80," r3= "4.58," r4= "5.08," igr1= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU HA 3360 LEU QQD 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU QB 3360 LEU QQD 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr1= "1369," "1370," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU QB 3361 LEU HG 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1391," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr1= "1369," "1370," &end # # 3360 LEU QB 3363 ALA QB 6.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.77," r4= "7.27," igr1= "1369," "1370," igr2= "1424," "1425," "1426," &end # # 3360 LEU HA 3391 LEU QQD 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3360 LEU HA 3360 LEU QQD 3.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "3.79," r4= "4.29," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3360 LEU HA 3363 ALA QB 3.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "-1," r1= "1.30," r2= "1.80," r3= "3.53," r4= "4.03," igr2= "1424," "1425," "1426," &end # # 3360 LEU HA 3360 LEU HG 2.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "1367," "1372," r1= "1.30," r2= "1.80," r3= "2.90," r4= "3.40," &end # # 3357 LEU HB+ 3357 LEU QQD 3.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.69," r4= "4.19," igr1= "1315," "1316," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3352 LEU HA 3352 LEU QQD 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3357 LEU HA 3357 LEU QQD 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1313," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3401 LYS+ HA 3401 LYS+ QB 2.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2007," "-1," r1= "1.30," r2= "1.80," r3= "2.87," r4= "3.37," igr2= "2009," "2010," &end # # 3401 LYS+ HA 3401 LYS+ QG 3.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "2007," "-1," r1= "1.30," r2= "1.80," r3= "3.68," r4= "4.18," igr2= "2012," "2013," &end # # 3356 GLN HA 3356 GLN QG 3.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "1296," "-1," r1= "1.30," r2= "1.80," r3= "3.72," r4= "4.22," igr2= "1301," "1302," &end # # 3354 GLN HA 3428 VAL QG1 3.64 (# ) &rst ixpk= "0," nxpk= "0," iat= "1262," "-1," r1= "1.30," r2= "1.80," r3= "3.64," r4= "4.14," igr2= "2425," "2426," "2427," &end # # 3356 GLN HA 3359 LEU HB+ 4.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "1296," "-1," r1= "1.30," r2= "1.80," r3= "4.40," r4= "4.90," igr2= "1350," "1351," &end # # 1043 LEU QQD 3355 GLN HB+ 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," igr1= "683," "684," "685," "687," "688," "689," igr2= "1281," "1282," &end # # 3352 LEU HA 3355 GLN HB+ 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr2= "1281," "1282," &end # # 3355 GLN HA 3355 GLN HB- 2.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "-1," r1= "1.30," r2= "1.80," r3= "2.90," r4= "3.40," igr2= "1281," "1282," &end # # 1043 LEU QQD 3355 GLN HG+ 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "683," "684," "685," "687," "688," "689," igr2= "1284," "1285," &end # # 3355 GLN HA 3355 GLN HB+ 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr2= "1281," "1282," &end # # 3354 GLN HG+ 3428 VAL QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1267," "1268," igr2= "2429," "2430," "2431," &end # # 3354 GLN HG- 3428 VAL QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1267," "1268," igr2= "2429," "2430," "2431," &end # # 3353 ILE QG2 3353 ILE QD1 4.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.66," r4= "5.16," igr1= "1247," "1248," "1249," igr2= "1254," "1255," "1256," &end # # 3353 ILE QG2 3353 ILE QG1 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "1247," "1248," "1249," igr2= "1251," "1252," &end # # 3353 ILE HA 3353 ILE QG2 4.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "1243," "-1," r1= "1.30," r2= "1.80," r3= "4.08," r4= "4.58," igr2= "1247," "1248," "1249," &end # # 3348 GLU- QB 3348 GLU- HG- 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr1= "1143," "1144," igr2= "1146," "1147," &end # # 3348 GLU- HG- 3351 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1146," "1147," igr2= "1213," "1214," &end # # 3348 GLU- HA 3348 GLU- HG- 3.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "3.13," r4= "3.63," igr2= "1146," "1147," &end # # 3370 GLU- QB 3370 GLU- HG+ 2.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.94," r4= "3.44," igr1= "1549," "1550," igr2= "1552," "1553," &end # # 3370 GLU- HG+ 3376 VAL QG2 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "1552," "1553," igr2= "1633," "1634," "1635," &end # # 3348 GLU- HA 3348 GLU- QB 3.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "3.04," r4= "3.54," igr2= "1143," "1144," &end # # 3348 GLU- QB 3348 GLU- HG+ 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr1= "1143," "1144," igr2= "1146," "1147," &end # # 3360 LEU QQD 3411 SER HB+ 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2143," "2144," &end # # 3390 VAL QG1 3411 SER HB+ 4.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.98," r4= "5.48," igr1= "1852," "1853," "1854," igr2= "2143," "2144," &end # # 3390 VAL HB 3411 SER HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1850," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2143," "2144," &end # # 3408 CYSZ HA 3411 SER HB- 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "2110," "-1," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr2= "2143," "2144," &end # # 3411 SER HA 3414 ILE QD1 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "2141," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr2= "2204," "2205," "2206," &end # # 3412 ARG+ QD 3415 ILE QG2 6.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.20," r4= "6.70," igr1= "2160," "2161," igr2= "2216," "2217," "2218," &end # # 3412 ARG+ HB+ 3412 ARG+ QD 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr1= "2154," "2155," igr2= "2160," "2161," &end # # 3412 ARG+ HA 3412 ARG+ HG- 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "-1," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr2= "2157," "2158," &end # # 3412 ARG+ HG- 3415 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2157," "2158," igr2= "2216," "2217," "2218," &end # # 1014 LEU QQD 3418 TRP HH2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2272," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "232," "233," "234," "236," "237," "238," &end # # 3418 TRP HH2 3433 LYS+ HA 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "2499," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," &end # # 3418 TRP HZ2 3432 LEU QQD 4.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "2270," "-1," r1= "1.30," r2= "1.80," r3= "4.70," r4= "5.20," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3418 TRP HZ2 3433 LYS+ HG- 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "2270," "-1," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr2= "2504," "2505," &end # # 3418 TRP HZ2 3433 LYS+ QD 6.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "2270," "-1," r1= "1.30," r2= "1.80," r3= "6.14," r4= "6.64," igr2= "2507," "2508," &end # # 3393 HIS HD2 3397 CYS- HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "1963," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3396 HIS HA 3396 HIS HD2 4.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "1945," "1957," r1= "1.30," r2= "1.80," r3= "4.87," r4= "5.37," &end # # 3424 HIS QB 3424 HIS HD2 4.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2379," r1= "1.30," r2= "1.80," r3= "4.37," r4= "4.87," igr1= "2369," "2370," &end # # 3424 HIS HA 3424 HIS HD2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "2379," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1022 LEU QQD 3364 HIS HE1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1440," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 1026 LEU QQD 3364 HIS HE1 6.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1440," r1= "1.30," r2= "1.80," r3= "6.15," r4= "6.65," igr1= "435," "436," "437," "439," "440," "441," &end # # 3364 HIS HE1 3368 ARG+ QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1440," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1504," "1505," &end # # 3401 LYS+ QG 3401 LYS+ QE 3.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.25," r4= "3.75," igr1= "2012," "2013," igr2= "2018," "2019," &end # # 3351 LYS+ QD 3351 LYS+ QE 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr1= "1210," "1211," igr2= "1213," "1214," &end # # 3357 LEU QQD 3414 ILE HB 5.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2195," r1= "1.30," r2= "1.80," r3= "5.94," r4= "6.44," igr1= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3357 LEU HA 3414 ILE HB 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1313," "2195," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3433 LYS+ HA 3435 ALA QB 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "-1," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr2= "2537," "2538," "2539," &end # # 1053 TRP HD1 3349 LYS+ QE 5.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "837," "-1," r1= "1.30," r2= "1.80," r3= "5.04," r4= "5.54," igr2= "1167," "1168," &end # # 3433 LYS+ HA 3433 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2510," "2511," &end # # 3433 LYS+ QB 3433 LYS+ QE 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr1= "2501," "2502," igr2= "2510," "2511," &end # # 3433 LYS+ QB 3433 LYS+ QD 4.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.07," r4= "4.57," igr1= "2501," "2502," igr2= "2507," "2508," &end # # 3433 LYS+ HA 3433 LYS+ QD 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr2= "2507," "2508," &end # # 3418 TRP HH2 3433 LYS+ QD 4.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "4.40," r4= "4.90," igr2= "2507," "2508," &end # # 2003 CYS- HA 2003 CYS- QB 3 (# ) &rst ixpk= "0," nxpk= "0," iat= "981," "-1," r1= "1.30," r2= "1.80," r3= "3.00," r4= "3.50," igr2= "984," "983," &end # # 3433 LYS+ HG+ 3433 LYS+ QE 4.27 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.27," r4= "4.77," igr1= "2504," "2505," igr2= "2510," "2511," &end # # 3433 LYS+ HG- 3433 LYS+ QE 4.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.39," r4= "4.89," igr1= "2504," "2505," igr2= "2510," "2511," &end # # 3433 LYS+ QB 3433 LYS+ HG+ 3.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.11," r4= "3.61," igr1= "2501," "2502," igr2= "2504," "2505," &end # # 3433 LYS+ HA 3433 LYS+ HG+ 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "2499," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr2= "2504," "2505," &end # # 3418 TRP HH2 3433 LYS+ HG+ 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr2= "2504," "2505," &end # # 3418 TRP HH2 3433 LYS+ HG- 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," igr2= "2504," "2505," &end # # 3426 CYS- HB- 3427 PRO QD 5.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.38," r4= "5.88," igr1= "2400," "2399," igr2= "2406," "2407," &end # # 3371 GLN HB- 3371 GLN HG+ 2.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.70," r4= "3.20," igr1= "1564," "1565," igr2= "1567," "1568," &end # # 3361 LEU HA 3361 LEU HG 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "1391," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," &end # # 3365 LYS+ HA 3365 LYS+ HG- 4.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "4.15," r4= "4.65," igr2= "1455," "1456," &end # # 3365 LYS+ HA 3365 LYS+ QD 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr2= "1458," "1459," &end # # 3362 HIS HA 3365 LYS+ QD 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1405," "-1," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr2= "1458," "1459," &end # # 1026 LEU QQD 3365 LYS+ QD 6.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.21," r4= "6.71," igr1= "435," "436," "437," "439," "440," "441," igr2= "1458," "1459," &end # # 3365 LYS+ HG- 3365 LYS+ QD 3.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.12," r4= "3.62," igr1= "1455," "1456," igr2= "1458," "1459," &end # # 3365 LYS+ QD 3365 LYS+ QE 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr1= "1458," "1459," igr2= "1461," "1462," &end # # 3351 LYS+ HA 3351 LYS+ QE 5.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "-1," r1= "1.30," r2= "1.80," r3= "5.57," r4= "6.07," igr2= "1213," "1214," &end # # 1043 LEU QQD 3351 LYS+ QE 6.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.39," r4= "6.89," igr1= "683," "684," "685," "687," "688," "689," igr2= "1213," "1214," &end # # 3365 LYS+ QB 3365 LYS+ QE 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "1452," "1453," igr2= "1461," "1462," &end # # 3365 LYS+ QB 3365 LYS+ QD 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr1= "1452," "1453," igr2= "1458," "1459," &end # # 3351 LYS+ QB 3351 LYS+ HG+ 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr1= "1204," "1205," igr2= "1207," "1208," &end # # 3351 LYS+ HG+ 3351 LYS+ QD 2.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.99," r4= "3.49," igr1= "1207," "1208," igr2= "1210," "1211," &end # # 3365 LYS+ HA 3365 LYS+ HG+ 4.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "4.15," r4= "4.65," igr2= "1455," "1456," &end # # 3351 LYS+ HG- 3351 LYS+ QD 2.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.99," r4= "3.49," igr1= "1207," "1208," igr2= "1210," "1211," &end # # 3365 LYS+ HG+ 3365 LYS+ QD 3.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.12," r4= "3.62," igr1= "1455," "1456," igr2= "1458," "1459," &end # # 3359 LEU HB- 3359 LEU HG 2.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1353," r1= "1.30," r2= "1.80," r3= "2.84," r4= "3.34," igr1= "1350," "1351," &end # # 3366 CYS- HA 3369 ARG+ HG- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1472," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1528," "1529," &end # # 3357 LEU HB- 3357 LEU QQD 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," igr1= "1315," "1316," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 1026 LEU QQD 3368 ARG+ QD 7.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.66," r4= "8.16," igr1= "435," "436," "437," "439," "440," "441," igr2= "1507," "1508," &end # # 3365 LYS+ HA 3368 ARG+ QD 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr2= "1507," "1508," &end # # 3368 ARG+ HB+ 3368 ARG+ QD 3.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.26," r4= "3.76," igr1= "1501," "1502," igr2= "1507," "1508," &end # # 3350 ARG+ QB 3350 ARG+ QD 3.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.68," r4= "4.18," igr1= "1180," "1181," igr2= "1186," "1187," &end # # 3368 ARG+ HB- 3368 ARG+ QD 3.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.57," r4= "4.07," igr1= "1501," "1502," igr2= "1507," "1508," &end # # 3350 ARG+ QG 3350 ARG+ QD 3.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.24," r4= "3.74," igr1= "1183," "1184," igr2= "1186," "1187," &end # # 3368 ARG+ QG 3368 ARG+ QD 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr1= "1504," "1505," igr2= "1507," "1508," &end # # 3352 LEU HA 3352 LEU QQD 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3368 ARG+ HA 3368 ARG+ QG 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1499," "-1," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr2= "1504," "1505," &end # # 3368 ARG+ HA 3371 GLN HB- 3.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "1499," "-1," r1= "1.30," r2= "1.80," r3= "3.16," r4= "3.66," igr2= "1564," "1565," &end # # 3367 GLN QG 3368 ARG+ HA 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1499," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1487," "1488," &end # # 3352 LEU HA 3355 GLN HG+ 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "1284," "1285," &end # # 3368 ARG+ HA 3368 ARG+ QD 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "1499," "-1," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr2= "1507," "1508," &end # # 3351 LYS+ QB 3351 LYS+ QE 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "1204," "1205," igr2= "1213," "1214," &end # # 3349 LYS+ HA 3349 LYS+ QE 5.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1156," "-1," r1= "1.30," r2= "1.80," r3= "5.03," r4= "5.53," igr2= "1167," "1168," &end # # 1053 TRP HA 3349 LYS+ QE 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "831," "-1," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr2= "1167," "1168," &end # # 3351 LYS+ QB 3351 LYS+ QD 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr1= "1204," "1205," igr2= "1210," "1211," &end # # 3401 LYS+ QB 3401 LYS+ QD 3.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.43," r4= "3.93," igr1= "2009," "2010," igr2= "2015," "2016," &end # # 3418 TRP HA 3418 TRP HZ3 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2259," "2274," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3418 TRP HZ3 3433 LYS+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2274," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2507," "2508," &end # # 3432 LEU HB+ 3432 LEU QQD 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "2482," "2483," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3365 LYS+ HA 3368 ARG+ HB- 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr2= "1501," "1502," &end # # 3368 ARG+ HB+ 3368 ARG+ QG 3.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.12," r4= "3.62," igr1= "1501," "1502," igr2= "1504," "1505," &end # # 3369 ARG+ HG- 3369 ARG+ QD 2.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.81," r4= "3.31," igr1= "1528," "1529," igr2= "1531," "1532," &end # # 3377 ARG+ HB+ 3377 ARG+ QD 3.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.15," r4= "3.65," igr1= "1643," "1644," igr2= "1649," "1650," &end # # 3369 ARG+ QB 3369 ARG+ QD 3.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.28," r4= "3.78," igr1= "1525," "1526," igr2= "1531," "1532," &end # # 3430 LEU HB+ 3430 LEU QQD 3.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.06," r4= "3.56," igr1= "2449," "2450," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HB- 3430 LEU QQD 3.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.35," r4= "3.85," igr1= "2449," "2450," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3425 ASP- HB- 3430 LEU QQD 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "2387," "2388," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3425 ASP- HB+ 3430 LEU QQD 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," igr1= "2387," "2388," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3430 LEU HA 3430 LEU QQD 4.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "-1," r1= "1.30," r2= "1.80," r3= "4.67," r4= "5.17," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3425 ASP- HA 3430 LEU QQD 4.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "-1," r1= "1.30," r2= "1.80," r3= "4.02," r4= "4.52," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3424 HIS HD2 3430 LEU QQD 5.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "2379," "-1," r1= "1.30," r2= "1.80," r3= "5.36," r4= "5.86," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3350 ARG+ HA 3350 ARG+ QD 4.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "1178," "-1," r1= "1.30," r2= "1.80," r3= "4.74," r4= "5.24," igr2= "1186," "1187," &end # # 3364 HIS HA 3391 LEU QQD 5.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "1432," "-1," r1= "1.30," r2= "1.80," r3= "5.11," r4= "5.61," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3350 ARG+ HA 3350 ARG+ QG 4.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "1178," "-1," r1= "1.30," r2= "1.80," r3= "4.23," r4= "4.73," igr2= "1183," "1184," &end # # 3348 GLU- HA 3351 LYS+ QB 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr2= "1204," "1205," &end # # 3351 LYS+ QB 3351 LYS+ HG- 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr1= "1204," "1205," igr2= "1207," "1208," &end # # 3351 LYS+ HA 3351 LYS+ QD 4.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "-1," r1= "1.30," r2= "1.80," r3= "4.93," r4= "5.43," igr2= "1210," "1211," &end # # 1043 LEU QQD 3351 LYS+ QD 5.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.72," r4= "6.22," igr1= "683," "684," "685," "687," "688," "689," igr2= "1210," "1211," &end # # 3393 HIS HE1 3397 CYS- HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1905," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1966," "1965," &end # # 3362 HIS HE1 3366 CYS- HB- 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "-1," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr2= "1475," "1474," &end # # 3373 ASN HA 3374 GLY HA- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1589," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1603," "1604," &end # # 3373 ASN HA 3374 GLY HA+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1589," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1603," "1604," &end # # 3359 LEU QQD 3383 HIS HA 6.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1729," r1= "1.30," r2= "1.80," r3= "6.38," r4= "6.88," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 2004 PHE QD 2007 THR HB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1034," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "997," "1005," &end # # 3347 PRO HA 3350 ARG+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1135," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1186," "1187," &end # # 3364 HIS HA 3364 HIS HD2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1432," "1444," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 3355 GLN HA 3358 VAL QG2 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "-1," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr2= "1340," "1341," "1342," &end # # 3364 HIS HE1 3368 ARG+ QD 5.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "1440," "-1," r1= "1.30," r2= "1.80," r3= "5.67," r4= "6.17," igr2= "1507," "1508," &end # # 3430 LEU HA 3434 ASN HB+ 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "2447," "-1," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr2= "2523," "2524," &end # # 3431 PRO HA 3434 ASN HB+ 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2474," "-1," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr2= "2523," "2524," &end # # 3418 TRP HH2 3433 LYS+ QE 6.08 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "6.08," r4= "6.58," igr2= "2510," "2511," &end # # 3348 GLU- HG+ 3351 LYS+ QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1146," "1147," igr2= "1213," "1214," &end # # 3403 CYS- HA 3404 GLN HG- 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "2039," "-1," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr2= "2054," "2055," &end # # 3394 MET QG 3397 CYS- HB+ 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr1= "1919," "1920," igr2= "1966," "1965," &end # # 1019 PHE QE 3433 LYS+ QB 7.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.31," r4= "7.81," igr1= "309," "313," igr2= "2501," "2502," &end # # 3397 CYS- HA 3398 GLN HB+ 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1963," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1975," "1976," &end # # 3365 LYS+ HA 3368 ARG+ HB+ 4.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "4.86," r4= "5.36," igr2= "1501," "1502," &end # # 1019 PHE HZ 3435 ALA QB 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr2= "2537," "2538," "2539," &end # # 1032 LEU QQD 3435 ALA QB 8.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.48," r4= "8.98," igr1= "527," "528," "529," "531," "532," "533," igr2= "2537," "2538," "2539," &end # # 3402 ALA QB 3404 GLN HG- 6.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.97," r4= "7.47," igr1= "2031," "2032," "2033," igr2= "2054," "2055," &end # # 1052 GLN QG 2007 THR QG2 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "819," "820," igr2= "1036," "1037," "1038," &end # # 1019 PHE QD 3360 LEU QQD 8.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.32," r4= "8.82," igr1= "307," "315," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3359 LEU QQD 3362 HIS HD2 5.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1416," r1= "1.30," r2= "1.80," r3= "5.30," r4= "5.80," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU HA 3359 LEU QQD 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1348," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU QQD 3383 HIS QB 6.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.90," r4= "7.40," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1731," "1732," &end # # 3359 LEU QQD 3387 MET HG+ 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1800," "1801," &end # # 3359 LEU HB+ 3359 LEU QQD 3.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.87," r4= "4.37," igr1= "1350," "1351," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU QQD 3381 LEU QQD 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3359 LEU QQD 3383 HIS HD2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1741," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU QQD 3362 HIS HD2 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1416," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU HA 3359 LEU QQD 3.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1348," "-1," r1= "1.30," r2= "1.80," r3= "3.61," r4= "4.11," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3359 LEU QQD 3383 HIS QB 5.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.55," r4= "6.05," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1731," "1732," &end # # 3359 LEU QQD 3384 CYSZ HB- 6.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.10," r4= "6.60," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1750," "1749," &end # # 3359 LEU QQD 3387 MET HB- 5.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.06," r4= "5.56," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1797," "1798," &end # # 3359 LEU HB+ 3359 LEU QQD 3.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.71," r4= "4.21," igr1= "1350," "1351," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3418 TRP HH2 3432 LEU QQD 6.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "6.10," r4= "6.60," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3354 GLN HA 3432 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1262," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3358 VAL HA 3432 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3432 LEU HB- 3432 LEU QQD 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr1= "2482," "2483," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3432 LEU HA 3432 LEU QQD 4.47 (# ) &rst ixpk= "0," nxpk= "0," iat= "2480," "-1," r1= "1.30," r2= "1.80," r3= "4.47," r4= "4.97," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 1053 TRP HE3 3353 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "848," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1254," "1255," "1256," &end # # 3346 ASP- HB+ 3349 LYS+ QD 5.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.53," r4= "6.03," igr1= "1117," "1118," igr2= "1164," "1165," &end # # 1054 PHE QD 3413 GLN HG- 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr1= "861," "869," igr2= "2181," "2182," &end # # 1023 TRP HZ2 3394 MET QE 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "374," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1923," "1924," "1925," &end # # 1023 TRP HZ3 3394 MET QE 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "378," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr2= "1923," "1924," "1925," &end # # 1023 TRP HH2 3394 MET QE 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "376," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr2= "1923," "1924," "1925," &end # # 3358 VAL QG1 3361 LEU QQD 7.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.49," r4= "7.99," igr1= "1336," "1337," "1338," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1053 TRP HH2 3353 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "844," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1254," "1255," "1256," &end # # 3365 LYS+ HA 3368 ARG+ QG 5.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "5.16," r4= "5.66," igr2= "1504," "1505," &end # # 3361 LEU QQD 3418 TRP HZ2 6.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2270," r1= "1.30," r2= "1.80," r3= "6.85," r4= "7.35," igr1= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3362 HIS HD2 3384 CYSZ HB+ 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1416," "-1," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," igr2= "1750," "1749," &end # # 3390 VAL QG2 3407 HIS HA 6.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2092," r1= "1.30," r2= "1.80," r3= "6.35," r4= "6.85," igr1= "1856," "1857," "1858," &end # # 3390 VAL QG2 3411 SER HB- 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "1856," "1857," "1858," igr2= "2143," "2144," &end # # 3349 LYS+ HG- 3349 LYS+ QE 3.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.89," r4= "4.39," igr1= "1161," "1162," igr2= "1167," "1168," &end # # 3411 SER HB- 3415 ILE QD1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2143," "2144," igr2= "2223," "2224," "2225," &end # # 3350 ARG+ HA 3353 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1178," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1247," "1248," "1249," &end # # 3387 MET QE 3411 SER HA 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2141," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr1= "1804," "1805," "1806," &end # # 1019 PHE QE 3432 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "309," "313," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 1019 PHE HZ 3432 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3361 LEU QQD 3432 LEU QQD 6.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.98," r4= "7.48," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3359 LEU QQD 3387 MET HB+ 6.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.26," r4= "6.76," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1797," "1798," &end # # 1044 MET QE 3383 HIS HD2 6.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1741," r1= "1.30," r2= "1.80," r3= "6.44," r4= "6.94," igr1= "704," "705," "706," &end # # 3359 LEU QQD 3383 HIS HD2 6.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1741," r1= "1.30," r2= "1.80," r3= "6.06," r4= "6.56," igr1= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3426 CYS- HB+ 3429 CYSZ HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2437," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2400," "2399," &end # # 3429 CYSZ HA 3433 LYS+ QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2437," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2501," "2502," &end # # 3418 TRP HH2 3429 CYSZ HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2272," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "2440," "2439," &end # # 3361 LEU QQD 3418 TRP HZ2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2270," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3353 ILE QD1 3414 ILE QD1 7.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.11," r4= "7.61," igr1= "1254," "1255," "1256," igr2= "2204," "2205," "2206," &end # # 3360 LEU QQD 3415 ILE QD1 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2223," "2224," "2225," &end # # 3358 VAL QG1 3432 LEU QQD 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr1= "1336," "1337," "1338," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 1019 PHE HZ 3432 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3358 VAL HA 1032 LEU QQD 8.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "-1," r1= "1.30," r2= "1.80," r3= "8.76," r4= "9.26," igr2= "527," "528," "529," "531," "532," "533," &end # # 3362 HIS HE1 3381 LEU QQD 5.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "1413," "-1," r1= "1.30," r2= "1.80," r3= "5.82," r4= "6.32," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 2001 GLY HA+ 2003 CYS- QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "963," "964," igr2= "984," "983," &end # # 2001 GLY HA- 2003 CYS- QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "963," "964," igr2= "984," "983," &end # # 3364 HIS HD2 3391 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1444," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3364 HIS QB 3391 LEU QQD 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "1434," "1435," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3358 VAL QG1 3361 LEU QQD 7.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.49," r4= "7.99," igr1= "1336," "1337," "1338," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3398 GLN HA 3398 GLN HG- 3.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "-1," r1= "1.30," r2= "1.80," r3= "3.59," r4= "4.09," igr2= "1978," "1979," &end # # 1002 GLU- QB 1003 GLU- H 4.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "70," r1= "1.30," r2= "1.80," r3= "4.43," r4= "4.93," igr1= "59," "60," &end # # 1004 PRO QD 1005 GLN H 5.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "99," r1= "1.30," r2= "1.80," r3= "5.63," r4= "6.13," igr1= "86," "87," &end # # 1005 GLN H 1005 GLN QB 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "99," "-1," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr2= "103," "104," &end # # 1005 GLN HA 1005 GLN QE2 5.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "101," "-1," r1= "1.30," r2= "1.80," r3= "5.43," r4= "5.93," igr2= "111," "112," &end # # 1005 GLN QB 1005 GLN QE2 5.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.24," r4= "5.74," igr1= "103," "104," igr2= "111," "112," &end # # 1007 ASP- H 1007 ASP- QB 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "127," "-1," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," igr2= "131," "132," &end # # 1007 ASP- H 1008 PRO QD 4.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "127," "-1," r1= "1.30," r2= "1.80," r3= "4.98," r4= "5.48," igr2= "140," "141," &end # # 1007 ASP- QB 1008 PRO QD 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr1= "131," "132," igr2= "140," "141," &end # # 1007 ASP- QB 1009 SER H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "153," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "131," "132," &end # # 1007 ASP- QB 1010 VAL H 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "164," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "131," "132," &end # # 1007 ASP- QB 1010 VAL HB 5.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "168," r1= "1.30," r2= "1.80," r3= "5.53," r4= "6.03," igr1= "131," "132," &end # # 1007 ASP- QB 1010 VAL QG1 5.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.12," r4= "5.62," igr1= "131," "132," igr2= "170," "171," "172," &end # # 1007 ASP- QB 1010 VAL QG2 6.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.58," r4= "7.08," igr1= "131," "132," igr2= "174," "175," "176," &end # # 1008 PRO QB 1009 SER QB 6.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.69," r4= "7.19," igr1= "146," "147," igr2= "157," "158," &end # # 1011 GLU- H 1011 GLU- QB 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "180," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr2= "184," "185," &end # # 1011 GLU- QB 1012 PRO HD+ 6.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.43," r4= "6.93," igr1= "184," "185," igr2= "196," "197," &end # # 1011 GLU- QB 1013 PRO HD- 6.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.39," r4= "6.89," igr1= "184," "185," igr2= "210," "211," &end # # 1013 PRO QB 1015 SER H 6.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "242," r1= "1.30," r2= "1.80," r3= "6.40," r4= "6.90," igr1= "216," "217," &end # # 1015 SER H 1015 SER QB 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "242," "-1," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr2= "246," "247," &end # # 1016 GLN QB 1017 GLU- H 4.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "270," r1= "1.30," r2= "1.80," r3= "4.73," r4= "5.23," igr1= "257," "258," &end # # 1017 GLN QB 1018 THR H 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "285," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "274," "275," &end # # 1017 GLU- QB 1020 SER QB 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr1= "274," "275," igr2= "323," "324," &end # # 1019 PHE HA 1022 LEU QB 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "301," "-1," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr2= "346," "347," &end # # 1019 PHE QD 3361 LEU QQD 8.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.02," r4= "8.52," igr1= "307," "315," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1019 PHE QE 3361 LEU QQD 7.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.37," r4= "7.87," igr1= "309," "313," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1019 PHE HZ 3361 LEU QQD 7.33 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "7.33," r4= "7.83," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1019 PHE HZ 3432 LEU QB 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr2= "2482," "2483," &end # # 1020 SER QB 1023 TRP HD1 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "369," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "323," "324," &end # # 1020 SER QB 1023 TRP HE1 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "371," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "323," "324," &end # # 1021 ASP- QB 1024 LYS+ QG 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr1= "334," "335," igr2= "392," "393," &end # # 1022 LEU H 1022 LEU QB 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "342," "-1," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," igr2= "346," "347," &end # # 1022 LEU HA 1026 LEU QB 5.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "344," "-1," r1= "1.30," r2= "1.80," r3= "5.61," r4= "6.11," igr2= "430," "431," &end # # 1022 LEU QB 1022 LEU QQD 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "346," "347," igr2= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QB 1023 TRP H 4.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "361," r1= "1.30," r2= "1.80," r3= "4.91," r4= "5.41," igr1= "346," "347," &end # # 1022 LEU QB 1024 LYS+ H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "385," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "346," "347," &end # # 1022 LEU QB 1026 LEU QQD 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "346," "347," igr2= "435," "436," "437," "439," "440," "441," &end # # 1022 LEU QQD 3361 LEU QQD 7.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.85," r4= "8.35," igr1= "351," "352," "353," "355," "356," "357," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1022 LEU QQD 3361 LEU QQD 7.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.83," r4= "8.33," igr1= "351," "352," "353," "355," "356," "357," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1023 TRP H 1023 TRP QB 4.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "361," "-1," r1= "1.30," r2= "1.80," r3= "4.09," r4= "4.59," igr2= "365," "366," &end # # 1023 TRP QB 1023 TRP HD1 3.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "369," r1= "1.30," r2= "1.80," r3= "3.77," r4= "4.27," igr1= "365," "366," &end # # 1024 LYS+ H 1024 LYS+ QG 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "385," "-1," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr2= "392," "393," &end # # 1024 LYS+ HA 1024 LYS+ QG 4.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "387," "-1," r1= "1.30," r2= "1.80," r3= "4.49," r4= "4.99," igr2= "392," "393," &end # # 1024 LYS+ QG 1024 LYS+ QE 3.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.62," r4= "4.12," igr1= "392," "393," igr2= "398," "399," &end # # 1025 LEU H 1025 LEU QB 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "407," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr2= "411," "412," &end # # 1026 LEU H 1026 LEU QB 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "426," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "430," "431," &end # # 1026 LEU QB 1026 LEU QQD 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr1= "430," "431," igr2= "435," "436," "437," "439," "440," "441," &end # # 1026 LEU QB 1027 PRO QD 6.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.53," r4= "7.03," igr1= "430," "431," igr2= "446," "447," &end # # 1026 LEU HG 1027 PRO QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "433," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "446," "447," &end # # 1026 LEU QQD 1027 PRO QD 5.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.66," r4= "6.16," igr1= "435," "436," "437," "439," "440," "441," igr2= "446," "447," &end # # 1026 LEU QQD 1028 GLU- QB 8.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.75," r4= "9.25," igr1= "435," "436," "437," "439," "440," "441," igr2= "463," "464," &end # # 1032 LEU QQD 1030 ASN QB 8.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.22," r4= "8.72," igr1= "527," "528," "529," "531," "532," "533," igr2= "492," "493," &end # # 1027 PRO QB 1029 ASN H 7.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "474," r1= "1.30," r2= "1.80," r3= "7.12," r4= "7.62," igr1= "452," "453," &end # # 1027 PRO QB 1029 ASN HB- 7.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.12," r4= "7.62," igr1= "452," "453," igr2= "478," "479," &end # # 1027 PRO QB 1029 ASN HB+ 7.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.12," r4= "7.62," igr1= "452," "453," igr2= "478," "479," &end # # 1027 PRO QB 1030 ASN HD2- 7.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.12," r4= "7.62," igr1= "452," "453," igr2= "497," "498," &end # # 1027 PRO QG 1030 ASN QB 7.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.99," r4= "8.49," igr1= "449," "450," igr2= "492," "493," &end # # 1027 PRO QD 1030 ASN QB 7.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.79," r4= "8.29," igr1= "446," "447," igr2= "492," "493," &end # # 1028 GLU- QB 1028 GLU- QG 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr1= "463," "464," igr2= "466," "467," &end # # 1030 ASN H 1030 ASN QB 5.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "488," "-1," r1= "1.30," r2= "1.80," r3= "5.20," r4= "5.70," igr2= "492," "493," &end # # 1030 ASN QB 1031 VAL H 5.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "502," r1= "1.30," r2= "1.80," r3= "5.48," r4= "5.98," igr1= "492," "493," &end # # 1030 ASN QB 1032 LEU H 6.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "518," r1= "1.30," r2= "1.80," r3= "6.66," r4= "7.16," igr1= "492," "493," &end # # 1030 ASN QB 1032 LEU QB 6.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.30," r4= "6.80," igr1= "492," "493," igr2= "522," "523," &end # # 1030 ASN QB 1032 LEU QQD 8.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.43," r4= "8.93," igr1= "492," "493," igr2= "527," "528," "529," "531," "532," "533," &end # # 1030 ASN QB 1033 SER QB 8.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.19," r4= "8.69," igr1= "492," "493," igr2= "541," "542," &end # # 1032 LEU QQD 3436 SER QB 6.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.28," r4= "6.78," igr1= "527," "528," "529," "531," "532," "533," igr2= "2547," "2548," &end # # 1032 LEU QQD 3436 SER QB 7.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.62," r4= "8.12," igr1= "527," "528," "529," "531," "532," "533," igr2= "2547," "2548," &end # # 1033 SER H 1033 SER QB 4.69 (# ) &rst ixpk= "0," nxpk= "0," iat= "537," "-1," r1= "1.30," r2= "1.80," r3= "4.69," r4= "5.19," igr2= "541," "542," &end # # 1034 PRO QD 1035 LEU H 6.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "562," r1= "1.30," r2= "1.80," r3= "6.71," r4= "7.21," igr1= "549," "550," &end # # 1035 LEU H 1036 PRO QD 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "562," "-1," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr2= "582," "583," &end # # 1035 LEU HA 1036 PRO QD 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "564," "-1," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr2= "582," "583," &end # # 1035 LEU QQD 1036 PRO QD 7.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.87," r4= "8.37," igr1= "571," "572," "573," "575," "576," "577," igr2= "582," "583," &end # # 1035 LEU QQD 1037 SER QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "571," "572," "573," "575," "576," "577," igr2= "599," "600," &end # # 1035 LEU QQD 1038 GLN QB 7.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.49," r4= "7.99," igr1= "571," "572," "573," "575," "576," "577," igr2= "610," "611," &end # # 1037 SER QB 1038 GLN H 6.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "606," r1= "1.30," r2= "1.80," r3= "6.02," r4= "6.52," igr1= "599," "600," &end # # 1040 MET H 1040 MET QG 5.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "633," "-1," r1= "1.30," r2= "1.80," r3= "5.97," r4= "6.47," igr2= "640," "641," &end # # 1040 MET HA 1040 MET QG 5.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "635," "-1," r1= "1.30," r2= "1.80," r3= "5.14," r4= "5.64," igr2= "640," "641," &end # # 1040 MET QG 1040 MET QE 5.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.57," r4= "6.07," igr1= "640," "641," igr2= "644," "645," "646," &end # # 1040 MET QG 1041 ASP- H 6.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "650," r1= "1.30," r2= "1.80," r3= "6.59," r4= "7.09," igr1= "640," "641," &end # # 1040 MET QG 3359 LEU QQD 8.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.55," r4= "9.05," igr1= "640," "641," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1043 LEU QB 1043 LEU QQD 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr1= "678," "679," igr2= "683," "684," "685," "687," "688," "689," &end # # 1043 LEU QB 1043 LEU QQD 3.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.57," r4= "4.07," igr1= "678," "679," igr2= "683," "684," "685," "687," "688," "689," &end # # 1043 LEU QB 1044 MET H 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "693," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr1= "678," "679," &end # # 1043 LEU QQD 3355 GLN QG 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "683," "684," "685," "687," "688," "689," igr2= "1284," "1285," &end # # 1044 MET H 1044 MET QB 3.37 (# ) &rst ixpk= "0," nxpk= "0," iat= "693," "-1," r1= "1.30," r2= "1.80," r3= "3.37," r4= "3.87," igr2= "697," "698," &end # # 1044 MET HA 1044 MET QG 3.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "695," "-1," r1= "1.30," r2= "1.80," r3= "3.40," r4= "3.90," igr2= "700," "701," &end # # 1044 MET QG 1044 MET QE 4.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.30," r4= "4.80," igr1= "700," "701," igr2= "704," "705," "706," &end # # 1044 MET QG 3359 LEU QQD 6.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.28," r4= "6.78," igr1= "700," "701," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1045 LEU HB+ 1049 ASP- QB 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "714," "715," igr2= "770," "771," &end # # 1045 LEU QQD 1049 ASP- QB 5.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.88," r4= "6.38," igr1= "719," "720," "721," "723," "724," "725," igr2= "770," "771," &end # # 1045 LEU QQD 3352 LEU QB 6.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.36," r4= "6.86," igr1= "719," "720," "721," "723," "724," "725," igr2= "1226," "1227," &end # # 1045 LEU QQD 3355 GLN QG 6.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.70," r4= "7.20," igr1= "719," "720," "721," "723," "724," "725," igr2= "1284," "1285," &end # # 1045 LEU QQD 1049 ASP- QB 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr1= "719," "720," "721," "723," "724," "725," igr2= "770," "771," &end # # 1046 SER QB 1048 ASP- H 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "754," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "733," "734," &end # # 1046 SER QB 1049 ASP- H 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "766," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr1= "733," "734," &end # # 1048 ASP- H 1048 ASP- QB 3.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "754," "-1," r1= "1.30," r2= "1.80," r3= "3.45," r4= "3.95," igr2= "758," "759," &end # # 1049 ASP- H 1049 ASP- QB 3.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "766," "-1," r1= "1.30," r2= "1.80," r3= "3.46," r4= "3.96," igr2= "770," "771," &end # # 1049 ASP- QB 1050 ILE H 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "778," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," igr1= "770," "771," &end # # 1051 GLU- HA 1054 PHE QB 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "799," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr2= "857," "858," &end # # 1057 ASP- H 1057 ASP- QB 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "902," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr2= "906," "907," &end # # 1057 ASP- QB 1058 PRO QD 5.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.29," r4= "5.79," igr1= "906," "907," igr2= "915," "916," &end # # 1057 ASP- QB 1059 GLY H 4.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "928," r1= "1.30," r2= "1.80," r3= "4.96," r4= "5.46," igr1= "906," "907," &end # # 1058 PRO QB 2001 GLY QA 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "921," "922," igr2= "963," "964," &end # # 1058 PRO QG 1059 GLY H 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "928," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr1= "918," "919," &end # # 1058 PRO QG 2001 GLY QA 5.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.10," r4= "5.60," igr1= "918," "919," igr2= "963," "964," &end # # 1059 GLY H 1060 PRO QD 4.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "928," "-1," r1= "1.30," r2= "1.80," r3= "4.94," r4= "5.44," igr2= "936," "937," &end # # 1059 GLY QA 1060 PRO QD 3.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.40," r4= "3.90," igr1= "930," "931," igr2= "936," "937," &end # # 1060 PRO QB 1061 ASP- H 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr1= "942," "943," &end # # 1060 PRO QB 1061 ASP- QB 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "942," "943," igr2= "953," "954," &end # # 1060 PRO QD 1061 ASP- H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "949," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr1= "936," "937," &end # # 1061 ASP- QB 2001 GLY QA 6.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.30," r4= "6.80," igr1= "953," "954," igr2= "963," "964," &end # # 2001 GLY QA 2002 SER HA 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "970," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr1= "963," "964," &end # # 2004 PHE H 2004 PHE QB 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "989," "-1," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr2= "993," "994," &end # # 2004 PHE QB 2007 THR QG2 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "993," "994," igr2= "1036," "1037," "1038," &end # # 2005 ASN QB 2005 ASN HD2- 3.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.03," r4= "3.53," igr1= "1013," "1014," igr2= "1018," "1019," &end # # 2005 ASN QB 2005 ASN HD2+ 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr1= "1013," "1014," igr2= "1018," "1019," &end # # 2006 GLY QA 2007 THR HA 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1032," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr1= "1025," "1026," &end # # 3342 GLY QA 3343 PRO QB 5.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.95," r4= "6.45," igr1= "1070," "1071," igr2= "1082," "1083," &end # # 3342 GLY QA 3343 PRO QD 3.02 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.02," r4= "3.52," igr1= "1070," "1071," igr2= "1076," "1077," &end # # 3343 PRO QB 3345 ALA H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1103," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1082," "1083," &end # # 3343 PRO QD 3344 THR H 5.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1089," r1= "1.30," r2= "1.80," r3= "5.65," r4= "6.15," igr1= "1076," "1077," &end # # 3346 ASP- HA 3347 PRO QG 4.67 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "4.67," r4= "5.17," igr2= "1129," "1130," &end # # 3346 ASP- HA 3347 PRO QD 3.46 (# ) &rst ixpk= "0," nxpk= "0," iat= "1115," "-1," r1= "1.30," r2= "1.80," r3= "3.46," r4= "3.96," igr2= "1126," "1127," &end # # 3346 ASP- HB- 3347 PRO QD 5.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.43," r4= "5.93," igr1= "1117," "1118," igr2= "1126," "1127," &end # # 3346 ASP- HB- 3349 LYS+ QG 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1117," "1118," igr2= "1161," "1162," &end # # 3346 ASP- HB+ 3347 PRO QD 4.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.74," r4= "5.24," igr1= "1117," "1118," igr2= "1126," "1127," &end # # 3346 ASP- HB+ 3349 LYS+ QG 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr1= "1117," "1118," igr2= "1161," "1162," &end # # 3347 PRO QD 3348 GLU- H 4.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1139," r1= "1.30," r2= "1.80," r3= "4.22," r4= "4.72," igr1= "1126," "1127," &end # # 3348 GLU- H 3348 GLU- QG 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "1139," "-1," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr2= "1146," "1147," &end # # 3348 GLU- H 3351 LYS+ QG 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "1139," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr2= "1207," "1208," &end # # 3348 GLU- HA 3348 GLU- QG 3.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "3.32," r4= "3.82," igr2= "1146," "1147," &end # # 3348 GLU- HA 3351 LYS+ QG 4.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "1141," "-1," r1= "1.30," r2= "1.80," r3= "4.15," r4= "4.65," igr2= "1207," "1208," &end # # 3348 GLU- QG 3349 LYS+ H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1154," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1146," "1147," &end # # 3349 LYS+ H 3349 LYS+ QG 4.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "1154," "-1," r1= "1.30," r2= "1.80," r3= "4.44," r4= "4.94," igr2= "1161," "1162," &end # # 3349 LYS+ HA 3349 LYS+ QG 3.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "1156," "-1," r1= "1.30," r2= "1.80," r3= "3.93," r4= "4.43," igr2= "1161," "1162," &end # # 3349 LYS+ QG 3349 LYS+ QE 3.63 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.63," r4= "4.13," igr1= "1161," "1162," igr2= "1167," "1168," &end # # 3351 LYS+ H 3351 LYS+ QG 5.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "1200," "-1," r1= "1.30," r2= "1.80," r3= "5.35," r4= "5.85," igr2= "1207," "1208," &end # # 3351 LYS+ HA 3351 LYS+ QG 4.16 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "-1," r1= "1.30," r2= "1.80," r3= "4.16," r4= "4.66," igr2= "1207," "1208," &end # # 3351 LYS+ HA 3354 GLN QB 4.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "1202," "-1," r1= "1.30," r2= "1.80," r3= "4.91," r4= "5.41," igr2= "1264," "1265," &end # # 3351 LYS+ QB 3351 LYS+ QG 2.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.95," r4= "3.45," igr1= "1204," "1205," igr2= "1207," "1208," &end # # 3351 LYS+ QG 3351 LYS+ QD 2.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.90," r4= "3.40," igr1= "1207," "1208," igr2= "1210," "1211," &end # # 3351 LYS+ QG 3351 LYS+ QE 4.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.42," r4= "4.92," igr1= "1207," "1208," igr2= "1213," "1214," &end # # 3351 LYS+ QG 3352 LEU H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1222," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1207," "1208," &end # # 3352 LEU H 3352 LEU QB 3.55 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "-1," r1= "1.30," r2= "1.80," r3= "3.55," r4= "4.05," igr2= "1226," "1227," &end # # 3352 LEU HA 3352 LEU QB 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "1224," "-1," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," igr2= "1226," "1227," &end # # 3352 LEU QB 3352 LEU QQD 3.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.86," r4= "4.36," igr1= "1226," "1227," igr2= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3352 LEU QB 3353 ILE H 3.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1241," r1= "1.30," r2= "1.80," r3= "3.70," r4= "4.20," igr1= "1226," "1227," &end # # 3352 LEU QB 3354 GLN H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1260," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1226," "1227," &end # # 3352 LEU QB 3356 GLN H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1294," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1226," "1227," &end # # 3352 LEU QQD 3355 GLN HG- 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," igr1= "1231," "1232," "1233," "1235," "1236," "1237," igr2= "1284," "1285," &end # # 3353 ILE QG2 3354 GLN QB 6.59 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.59," r4= "7.09," igr1= "1247," "1248," "1249," igr2= "1264," "1265," &end # # 3353 ILE QG2 3354 GLN QG 6.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.19," r4= "6.69," igr1= "1247," "1248," "1249," igr2= "1267," "1268," &end # # 3354 GLN H 3354 GLN QB 3.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "3.68," r4= "4.18," igr2= "1264," "1265," &end # # 3354 GLN H 3354 GLN QG 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "1260," "-1," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr2= "1267," "1268," &end # # 3354 GLN QB 3354 GLN QE2 5.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.83," r4= "6.33," igr1= "1264," "1265," igr2= "1272," "1273," &end # # 3354 GLN QB 3355 GLN H 4.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1277," r1= "1.30," r2= "1.80," r3= "4.24," r4= "4.74," igr1= "1264," "1265," &end # # 3354 GLN QB 3428 VAL QG1 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr1= "1264," "1265," igr2= "2425," "2426," "2427," &end # # 3354 GLN QB 3428 VAL QG2 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "1264," "1265," igr2= "2429," "2430," "2431," &end # # 3354 GLN QG 3354 GLN QE2 3.98 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.98," r4= "4.48," igr1= "1267," "1268," igr2= "1272," "1273," &end # # 3354 GLN QG 3428 VAL HA 5.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2421," r1= "1.30," r2= "1.80," r3= "5.13," r4= "5.63," igr1= "1267," "1268," &end # # 3354 GLN QG 3428 VAL QG1 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr1= "1267," "1268," igr2= "2425," "2426," "2427," &end # # 3354 GLN QG 3428 VAL QG2 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr1= "1267," "1268," igr2= "2429," "2430," "2431," &end # # 3354 GLN QE2 3428 VAL QG1 6.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.32," r4= "6.82," igr1= "1272," "1273," igr2= "2425," "2426," "2427," &end # # 3354 GLN QE2 3428 VAL QG2 6.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.43," r4= "6.93," igr1= "1272," "1273," igr2= "2429," "2430," "2431," &end # # 3354 GLN QE2 3431 PRO QB 6.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.53," r4= "7.03," igr1= "1272," "1273," igr2= "2471," "2472," &end # # 3354 GLN QE2 3431 PRO HG- 4.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.32," r4= "4.82," igr1= "1272," "1273," igr2= "2468," "2469," &end # # 3354 GLN QE2 3431 PRO QD 6.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.45," r4= "6.95," igr1= "1272," "1273," igr2= "2465," "2466," &end # # 3355 GLN H 3355 GLN QG 3.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "1277," "-1," r1= "1.30," r2= "1.80," r3= "3.43," r4= "3.93," igr2= "1284," "1285," &end # # 3355 GLN HA 3355 GLN QG 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1279," "-1," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr2= "1284," "1285," &end # # 3355 GLN HB- 3355 GLN QE2 4.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.95," r4= "5.45," igr1= "1281," "1282," igr2= "1289," "1290," &end # # 3355 GLN HB+ 3355 GLN QG 2.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.93," r4= "3.43," igr1= "1281," "1282," igr2= "1284," "1285," &end # # 3355 GLN QG 3355 GLN QE2 4.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.11," r4= "4.61," igr1= "1284," "1285," igr2= "1289," "1290," &end # # 3355 GLN QG 3356 GLN H 4.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1294," r1= "1.30," r2= "1.80," r3= "4.91," r4= "5.41," igr1= "1284," "1285," &end # # 3358 VAL QG2 3354 GLN HG+ 6.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.36," r4= "6.86," igr1= "1340," "1341," "1342," igr2= "1267," "1268," &end # # 3355 GLN QE2 1043 LEU HG 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "681," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "1289," "1290," &end # # 3358 VAL QG1 3361 LEU QQD 7.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.32," r4= "7.82," igr1= "1336," "1337," "1338," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3359 LEU HB+ 3387 MET QB 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "1350," "1351," igr2= "1797," "1798," &end # # 3359 LEU QQD 3383 HIS QB 4.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.84," r4= "5.34," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1731," "1732," &end # # 3359 LEU QQD 3387 MET QB 4.97 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.97," r4= "5.47," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1797," "1798," &end # # 3359 LEU QQD 3383 HIS QB 5.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.90," r4= "6.40," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1731," "1732," &end # # 3359 LEU QQD 3387 MET QB 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1797," "1798," &end # # 3360 LEU QQD 3387 MET QB 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "1797," "1798," &end # # 3360 LEU QQD 3415 ILE QG1 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "1374," "1375," "1376," "1378," "1379," "1380," igr2= "2220," "2221," &end # # 3361 LEU HA 3361 LEU QQD 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1386," "-1," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3361 LEU QQD 3415 ILE QD1 8.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.81," r4= "9.31," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2223," "2224," "2225," &end # # 3361 LEU QQD 3418 TRP HE1 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2267," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr1= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3361 LEU QQD 3432 LEU QB 7.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.99," r4= "8.49," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2482," "2483," &end # # 3361 LEU QQD 3432 LEU QQD 5.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.75," r4= "6.25," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3361 LEU QQD 3432 LEU QQD 7.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.93," r4= "8.43," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3363 ALA HA 3388 LYS+ QE 5.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "1422," "-1," r1= "1.30," r2= "1.80," r3= "5.31," r4= "5.81," igr2= "1823," "1824," &end # # 3363 ALA QB 3387 MET QB 4.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.18," r4= "4.68," igr1= "1424," "1425," "1426," igr2= "1797," "1798," &end # # 3363 ALA QB 3388 LYS+ QE 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "1424," "1425," "1426," igr2= "1823," "1824," &end # # 3365 LYS+ HA 3365 LYS+ QG 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr2= "1455," "1456," &end # # 3365 LYS+ QB 3365 LYS+ QG 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr1= "1452," "1453," igr2= "1455," "1456," &end # # 3365 LYS+ QG 3365 LYS+ QD 2.86 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.86," r4= "3.36," igr1= "1455," "1456," igr2= "1458," "1459," &end # # 3365 LYS+ QG 3365 LYS+ QE 3.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.04," r4= "3.54," igr1= "1455," "1456," igr2= "1461," "1462," &end # # 3366 CYS- HB+ 3388 LYS+ QE 5.22 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.22," r4= "5.72," igr1= "1475," "1474," igr2= "1823," "1824," &end # # 3367 GLN HA 3388 LYS+ QE 5.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "1482," "-1," r1= "1.30," r2= "1.80," r3= "5.51," r4= "6.01," igr2= "1823," "1824," &end # # 3367 GLN QB 3392 ASN QD2 5.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.87," r4= "6.37," igr1= "1484," "1485," igr2= "1890," "1891," &end # # 3370 GLU- H 3370 GLU- QG 4.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "1545," "-1," r1= "1.30," r2= "1.80," r3= "4.82," r4= "5.32," igr2= "1552," "1553," &end # # 3370 GLU- HA 3370 GLU- QG 2.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1547," "-1," r1= "1.30," r2= "1.80," r3= "2.85," r4= "3.35," igr2= "1552," "1553," &end # # 3370 GLU- QB 3370 GLU- QG 2.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.80," r4= "3.30," igr1= "1549," "1550," igr2= "1552," "1553," &end # # 3370 GLU- QG 3377 ARG+ H 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1639," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1552," "1553," &end # # 3370 GLU- QG 3378 ALA HA 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1665," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1552," "1553," &end # # 3370 GLU- QG 3378 ALA QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1552," "1553," igr2= "1667," "1668," "1669," &end # # 3371 GLN HA 3371 GLN QE2 5.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "1562," "-1," r1= "1.30," r2= "1.80," r3= "5.23," r4= "5.73," igr2= "1572," "1573," &end # # 3371 GLN HB- 3371 GLN QE2 5.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.42," r4= "5.92," igr1= "1564," "1565," igr2= "1572," "1573," &end # # 3371 GLN HB+ 3371 GLN QE2 4.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.20," r4= "4.70," igr1= "1564," "1565," igr2= "1572," "1573," &end # # 3371 GLN HG- 3371 GLN QE2 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr1= "1567," "1568," igr2= "1572," "1573," &end # # 3373 ASN HB- 3373 ASN QD2 3.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.36," r4= "3.86," igr1= "1591," "1592," igr2= "1596," "1597," &end # # 3373 ASN QD2 3376 VAL HB 6.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1627," r1= "1.30," r2= "1.80," r3= "6.26," r4= "6.76," igr1= "1596," "1597," &end # # 3374 GLY QA 3375 GLU- HA 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1610," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "1603," "1604," &end # # 3375 GLU- HA 3375 GLU- QG 3.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "1610," "-1," r1= "1.30," r2= "1.80," r3= "3.78," r4= "4.28," igr2= "1615," "1616," &end # # 3375 GLU- HB- 3375 GLU- QG 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr1= "1612," "1613," igr2= "1615," "1616," &end # # 3375 GLU- HB+ 3375 GLU- QG 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr1= "1612," "1613," igr2= "1615," "1616," &end # # 3375 GLU- QG 3376 VAL H 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1623," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr1= "1615," "1616," &end # # 3381 LEU H 3381 LEU QB 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "1694," "-1," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr2= "1698," "1699," &end # # 3381 LEU HA 3382 PRO QG 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "1696," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr2= "1717," "1718," &end # # 3381 LEU QB 3381 LEU QQD 4.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.23," r4= "4.73," igr1= "1698," "1699," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU QB 3381 LEU QQD 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr1= "1698," "1699," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3381 LEU QB 3382 PRO HD+ 5.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.74," r4= "6.24," igr1= "1698," "1699," igr2= "1714," "1715," &end # # 3381 LEU QB 3384 CYSZ HA 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1747," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1698," "1699," &end # # 3381 LEU QB 3384 CYSZ HB- 5.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.44," r4= "5.94," igr1= "1698," "1699," igr2= "1750," "1749," &end # # 3381 LEU QB 3384 CYSZ HB+ 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "1698," "1699," igr2= "1750," "1749," &end # # 3383 HIS QB 3386 THR H 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1779," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "1731," "1732," &end # # 3383 HIS QB 3386 THR QG2 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr1= "1731," "1732," igr2= "1785," "1786," "1787," &end # # 3383 HIS QB 3387 MET H 5.43 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1793," r1= "1.30," r2= "1.80," r3= "5.43," r4= "5.93," igr1= "1731," "1732," &end # # 3384 CYSZ HA 3387 MET QB 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "1747," "-1," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr2= "1797," "1798," &end # # 3385 ARG+ HA 3385 ARG+ QD 4.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "4.61," r4= "5.11," igr2= "1765," "1766," &end # # 3385 ARG+ HA 3388 LYS+ QE 4.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "1757," "-1," r1= "1.30," r2= "1.80," r3= "4.84," r4= "5.34," igr2= "1823," "1824," &end # # 3385 ARG+ HB+ 3385 ARG+ QD 4.13 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.13," r4= "4.63," igr1= "1759," "1760," igr2= "1765," "1766," &end # # 3385 ARG+ QG 3385 ARG+ QD 3.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.10," r4= "3.60," igr1= "1762," "1763," igr2= "1765," "1766," &end # # 3386 THR QG2 3407 HIS QB 6.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.07," r4= "6.57," igr1= "1785," "1786," "1787," igr2= "2094," "2095," &end # # 3387 MET H 3387 MET QB 3.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "1793," "-1," r1= "1.30," r2= "1.80," r3= "3.29," r4= "3.79," igr2= "1797," "1798," &end # # 3387 MET QB 3387 MET QE 5.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.54," r4= "6.04," igr1= "1797," "1798," igr2= "1804," "1805," "1806," &end # # 3387 MET QB 3388 LYS+ H 4.25 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1810," r1= "1.30," r2= "1.80," r3= "4.25," r4= "4.75," igr1= "1797," "1798," &end # # 3387 MET QB 3390 VAL QG2 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "1797," "1798," igr2= "1856," "1857," "1858," &end # # 3387 MET QB 3391 LEU QQD 5.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.72," r4= "6.22," igr1= "1797," "1798," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3387 MET QE 3407 HIS QB 5.58 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.58," r4= "6.08," igr1= "1804," "1805," "1806," igr2= "2094," "2095," &end # # 3388 LYS+ H 3388 LYS+ QE 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "1810," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr2= "1823," "1824," &end # # 3388 LYS+ HA 3388 LYS+ QE 5.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "5.95," r4= "6.45," igr2= "1823," "1824," &end # # 3388 LYS+ HB- 3388 LYS+ QE 4.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.44," r4= "4.94," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3388 LYS+ HB+ 3388 LYS+ QE 3.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.83," r4= "4.33," igr1= "1814," "1815," igr2= "1823," "1824," &end # # 3388 LYS+ HG- 3388 LYS+ QE 4.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.21," r4= "4.71," igr1= "1817," "1818," igr2= "1823," "1824," &end # # 3388 LYS+ HG+ 3392 ASN QD2 5.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.23," r4= "5.73," igr1= "1817," "1818," igr2= "1890," "1891," &end # # 3389 ASN H 3389 ASN QB 3.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "1832," "-1," r1= "1.30," r2= "1.80," r3= "3.42," r4= "3.92," igr2= "1836," "1837," &end # # 3389 ASN HA 3392 ASN QD2 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1834," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr2= "1890," "1891," &end # # 3389 ASN QB 3389 ASN HD2- 3.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.34," r4= "3.84," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3389 ASN QB 3389 ASN HD2+ 3.91 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.91," r4= "4.41," igr1= "1836," "1837," igr2= "1841," "1842," &end # # 3389 ASN QB 3390 VAL H 3.52 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1846," r1= "1.30," r2= "1.80," r3= "3.52," r4= "4.02," igr1= "1836," "1837," &end # # 3389 ASN QB 3390 VAL HA 5.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1848," r1= "1.30," r2= "1.80," r3= "5.80," r4= "6.30," igr1= "1836," "1837," &end # # 3389 ASN QB 3390 VAL QG2 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "1836," "1837," igr2= "1856," "1857," "1858," &end # # 3389 ASN QB 3392 ASN QB 6.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.68," r4= "7.18," igr1= "1836," "1837," igr2= "1885," "1886," &end # # 3390 VAL HA 3407 HIS QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1848," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2094," "2095," &end # # 3390 VAL QG1 3407 HIS QB 4.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.89," r4= "5.39," igr1= "1852," "1853," "1854," igr2= "2094," "2095," &end # # 3390 VAL QG1 3408 CYSZ QB 6.31 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.31," r4= "6.81," igr1= "1852," "1853," "1854," igr2= "2113," "2112," &end # # 3390 VAL QG2 3407 HIS QB 4.45 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.45," r4= "4.95," igr1= "1856," "1857," "1858," igr2= "2094," "2095," &end # # 3392 ASN QB 3392 ASN QD2 3.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.88," r4= "4.38," igr1= "1885," "1886," igr2= "1890," "1891," &end # # 3393 HIS HD2 3408 CYSZ QB 5.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "1908," "-1," r1= "1.30," r2= "1.80," r3= "5.32," r4= "5.82," igr2= "2113," "2112," &end # # 3394 MET QE 3415 ILE QG1 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr1= "1923," "1924," "1925," igr2= "2220," "2221," &end # # 3396 HIS H 3396 HIS QB 3.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "1943," "-1," r1= "1.30," r2= "1.80," r3= "3.56," r4= "4.06," igr2= "1947," "1948," &end # # 3396 HIS QB 3397 CYS- H 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1961," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr1= "1947," "1948," &end # # 3398 GLN HA 3398 GLN QG 3.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "1973," "-1," r1= "1.30," r2= "1.80," r3= "3.65," r4= "4.15," igr2= "1978," "1979," &end # # 3398 GLN HB- 3398 GLN QG 3.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.17," r4= "3.67," igr1= "1975," "1976," igr2= "1978," "1979," &end # # 3398 GLN HB- 3398 GLN QE2 4.53 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.53," r4= "5.03," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3398 GLN HB+ 3398 GLN QE2 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," igr1= "1975," "1976," igr2= "1983," "1984," &end # # 3399 ALA H 3400 GLY QA 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1988," "-1," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr2= "2000," "2001," &end # # 3399 ALA QB 3400 GLY QA 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr1= "1992," "1993," "1994," igr2= "2000," "2001," &end # # 3400 GLY QA 3402 ALA H 4.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2027," r1= "1.30," r2= "1.80," r3= "4.83," r4= "5.33," igr1= "2000," "2001," &end # # 3400 GLY QA 3403 CYS- H 5.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2037," r1= "1.30," r2= "1.80," r3= "5.85," r4= "6.35," igr1= "2000," "2001," &end # # 3403 CYS- QB 3408 CYSZ QB 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "2042," "2041," igr2= "2113," "2112," &end # # 3405 VAL H 3408 CYSZ QB 4.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "2064," "-1," r1= "1.30," r2= "1.80," r3= "4.78," r4= "5.28," igr2= "2113," "2112," &end # # 3405 VAL HB 3408 CYSZ QB 4.77 (# ) &rst ixpk= "0," nxpk= "0," iat= "2068," "-1," r1= "1.30," r2= "1.80," r3= "4.77," r4= "5.27," igr2= "2113," "2112," &end # # 3405 VAL QG2 3408 CYSZ QB 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," igr1= "2074," "2075," "2076," igr2= "2113," "2112," &end # # 3405 VAL QG1 3407 HIS QB 7.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.39," r4= "7.89," igr1= "2070," "2071," "2072," igr2= "2094," "2095," &end # # 3407 HIS H 3407 HIS QB 4.12 (# ) &rst ixpk= "0," nxpk= "0," iat= "2090," "-1," r1= "1.30," r2= "1.80," r3= "4.12," r4= "4.62," igr2= "2094," "2095," &end # # 3407 HIS QB 3408 CYSZ HA 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2110," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2094," "2095," &end # # 3408 CYSZ H 3408 CYSZ QB 3.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "2108," "-1," r1= "1.30," r2= "1.80," r3= "3.18," r4= "3.68," igr2= "2113," "2112," &end # # 3408 CYSZ QB 3409 ALA H 3.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2118," r1= "1.30," r2= "1.80," r3= "3.39," r4= "3.89," igr1= "2113," "2112," &end # # 3408 CYSZ QB 3409 ALA HA 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2120," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2113," "2112," &end # # 3411 SER H 3414 ILE QG1 5.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "2139," "-1," r1= "1.30," r2= "1.80," r3= "5.88," r4= "6.38," igr2= "2201," "2202," &end # # 3411 SER HA 3414 ILE QG1 4.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "2141," "-1," r1= "1.30," r2= "1.80," r3= "4.06," r4= "4.56," igr2= "2201," "2202," &end # # 3412 ARG+ HA 3415 ILE QG1 5.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "2152," "-1," r1= "1.30," r2= "1.80," r3= "5.14," r4= "5.64," igr2= "2220," "2221," &end # # 3414 ILE H 3414 ILE QG1 5.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "2191," "-1," r1= "1.30," r2= "1.80," r3= "5.41," r4= "5.91," igr2= "2201," "2202," &end # # 3415 ILE HA 3415 ILE QG1 4.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "2212," "-1," r1= "1.30," r2= "1.80," r3= "4.04," r4= "4.54," igr2= "2220," "2221," &end # # 3415 ILE QG1 3416 SER H 5.78 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2229," r1= "1.30," r2= "1.80," r3= "5.78," r4= "6.28," igr1= "2220," "2221," &end # # 3416 SER H 3416 SER QB 3.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "2229," "-1," r1= "1.30," r2= "1.80," r3= "3.50," r4= "4.00," igr2= "2233," "2234," &end # # 3416 SER HA 3420 ASN QD2 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "2231," "-1," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr2= "2312," "2313," &end # # 3416 SER QB 3419 LYS+ QB 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "2233," "2234," igr2= "2285," "2286," &end # # 3418 TRP HZ2 3432 LEU QB 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "2270," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr2= "2482," "2483," &end # # 3419 LYS+ QB 3420 ASN QD2 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "2285," "2286," igr2= "2312," "2313," &end # # 3420 ASN H 3420 ASN QB 3.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "2303," "-1," r1= "1.30," r2= "1.80," r3= "3.21," r4= "3.71," igr2= "2307," "2308," &end # # 3420 ASN H 3420 ASN QD2 3.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "2303," "-1," r1= "1.30," r2= "1.80," r3= "3.75," r4= "4.25," igr2= "2312," "2313," &end # # 3420 ASN HA 3420 ASN QD2 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2305," "-1," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr2= "2312," "2313," &end # # 3420 ASN QB 3420 ASN QD2 3.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.94," r4= "4.44," igr1= "2307," "2308," igr2= "2312," "2313," &end # # 3420 ASN QB 3421 CYS- H 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2317," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," igr1= "2307," "2308," &end # # 3421 CYS- H 3421 CYS- QB 3.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2317," "-1," r1= "1.30," r2= "1.80," r3= "3.01," r4= "3.51," igr2= "2322," "2321," &end # # 3421 CYS- HA 3421 CYS- QB 2.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "2319," "-1," r1= "1.30," r2= "1.80," r3= "2.96," r4= "3.46," igr2= "2322," "2321," &end # # 3421 CYS- QB 3422 THR H 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2327," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "2322," "2321," &end # # 3423 ARG+ HA 3423 ARG+ QG 3.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "2343," "-1," r1= "1.30," r2= "1.80," r3= "3.76," r4= "4.26," igr2= "2348," "2349," &end # # 3423 ARG+ QB 3423 ARG+ QD 3.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.92," r4= "4.42," igr1= "2345," "2346," igr2= "2351," "2352," &end # # 3423 ARG+ QB 3425 ASP- H 5.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2383," r1= "1.30," r2= "1.80," r3= "5.30," r4= "5.80," igr1= "2345," "2346," &end # # 3423 ARG+ QB 3426 CYS- HB- 5.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.01," r4= "5.51," igr1= "2345," "2346," igr2= "2400," "2399," &end # # 3423 ARG+ QG 3423 ARG+ QD 3.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.01," r4= "3.51," igr1= "2348," "2349," igr2= "2351," "2352," &end # # 3423 ARG+ QG 3425 ASP- H 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2383," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2348," "2349," &end # # 3423 ARG+ QG 3426 CYS- HB- 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2348," "2349," igr2= "2400," "2399," &end # # 3423 ARG+ QD 3426 CYS- HB- 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2351," "2352," igr2= "2400," "2399," &end # # 3423 ARG+ QD 3427 PRO QD 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "2351," "2352," igr2= "2406," "2407," &end # # 3425 ASP- HA 3425 ASP- QB 3 (# ) &rst ixpk= "0," nxpk= "0," iat= "2385," "-1," r1= "1.30," r2= "1.80," r3= "3.00," r4= "3.50," igr2= "2387," "2388," &end # # 3425 ASP- QB 3426 CYS- H 5.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2395," r1= "1.30," r2= "1.80," r3= "5.71," r4= "6.21," igr1= "2387," "2388," &end # # 3427 PRO QB 3428 VAL HA 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2421," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr1= "2412," "2413," &end # # 3427 PRO QB 3428 VAL QG2 7.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.20," r4= "7.70," igr1= "2412," "2413," igr2= "2429," "2430," "2431," &end # # 3427 PRO QG 3428 VAL H 4.03 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2419," r1= "1.30," r2= "1.80," r3= "4.03," r4= "4.53," igr1= "2409," "2410," &end # # 3427 PRO QG 3429 CYSZ H 5.75 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2435," r1= "1.30," r2= "1.80," r3= "5.75," r4= "6.25," igr1= "2409," "2410," &end # # 3428 VAL QG1 3431 PRO QB 7.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.60," r4= "8.10," igr1= "2425," "2426," "2427," igr2= "2471," "2472," &end # # 3428 VAL QG1 3431 PRO QD 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr1= "2425," "2426," "2427," igr2= "2465," "2466," &end # # 3429 CYSZ HA 3432 LEU QB 5.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "2437," "-1," r1= "1.30," r2= "1.80," r3= "5.79," r4= "6.29," igr2= "2482," "2483," &end # # 3430 LEU H 3431 PRO QD 4.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "2445," "-1," r1= "1.30," r2= "1.80," r3= "4.24," r4= "4.74," igr2= "2465," "2466," &end # # 3430 LEU HB- 3431 PRO QD 4.57 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.57," r4= "5.07," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3430 LEU HB+ 3431 PRO QD 3.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "3.54," r4= "4.04," igr1= "2449," "2450," igr2= "2465," "2466," &end # # 3430 LEU QQD 3431 PRO QD 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "2454," "2455," "2456," "2458," "2459," "2460," igr2= "2465," "2466," &end # # 3430 LEU QQD 3431 PRO QD 6.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.04," r4= "6.54," igr1= "2454," "2455," "2456," "2458," "2459," "2460," igr2= "2465," "2466," &end # # 3431 PRO QB 3434 ASN HD2- 5.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.88," r4= "6.38," igr1= "2471," "2472," igr2= "2528," "2529," &end # # 3431 PRO QB 3434 ASN HD2+ 5.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.07," r4= "5.57," igr1= "2471," "2472," igr2= "2528," "2529," &end # # 3431 PRO QD 3432 LEU H 5.23 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2478," r1= "1.30," r2= "1.80," r3= "5.23," r4= "5.73," igr1= "2465," "2466," &end # # 3432 LEU H 3432 LEU QB 3.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "2478," "-1," r1= "1.30," r2= "1.80," r3= "3.48," r4= "3.98," igr2= "2482," "2483," &end # # 3432 LEU QB 3432 LEU QQD 4.35 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.35," r4= "4.85," igr1= "2482," "2483," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3436 SER H 3436 SER QB 3.66 (# ) &rst ixpk= "0," nxpk= "0," iat= "2543," "-1," r1= "1.30," r2= "1.80," r3= "3.66," r4= "4.16," igr2= "2547," "2548," &end # # 3436 SER HA 3436 SER QB 2.92 (# ) &rst ixpk= "0," nxpk= "0," iat= "2545," "-1," r1= "1.30," r2= "1.80," r3= "2.92," r4= "3.42," igr2= "2547," "2548," &end # # 3436 SER QB 3437 ASP- H 4.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2554," r1= "1.30," r2= "1.80," r3= "4.74," r4= "5.24," igr1= "2547," "2548," &end # # 3436 SER QB 3438 LYS+ H 5.19 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2566," r1= "1.30," r2= "1.80," r3= "5.19," r4= "5.69," igr1= "2547," "2548," &end # # 3436 SER QB 3438 LYS+ QG 6.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.93," r4= "7.43," igr1= "2547," "2548," igr2= "2573," "2574," &end # # 3437 ASP- H 3437 ASP- QB 3.95 (# ) &rst ixpk= "0," nxpk= "0," iat= "2554," "-1," r1= "1.30," r2= "1.80," r3= "3.95," r4= "4.45," igr2= "2558," "2559," &end # # 3437 ASP- QB 3438 LYS+ H 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2566," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr1= "2558," "2559," &end # # 3437 ASP- QB 3438 LYS+ HA 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2568," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "2558," "2559," &end # # 3437 ASP- QB 3439 ARG+ H 5.65 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2588," r1= "1.30," r2= "1.80," r3= "5.65," r4= "6.15," igr1= "2558," "2559," &end # # 3438 LYS+ H 3438 LYS+ QG 4.36 (# ) &rst ixpk= "0," nxpk= "0," iat= "2566," "-1," r1= "1.30," r2= "1.80," r3= "4.36," r4= "4.86," igr2= "2573," "2574," &end # # 3438 LYS+ HA 3438 LYS+ QG 3.84 (# ) &rst ixpk= "0," nxpk= "0," iat= "2568," "-1," r1= "1.30," r2= "1.80," r3= "3.84," r4= "4.34," igr2= "2573," "2574," &end # # 3439 ARG+ H 3439 ARG+ QB 3.82 (# ) &rst ixpk= "0," nxpk= "0," iat= "2588," "-1," r1= "1.30," r2= "1.80," r3= "3.82," r4= "4.32," igr2= "2592," "2593," &end # # 3439 ARG+ QB 3439 ARG+ QD 4.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.41," r4= "4.91," igr1= "2592," "2593," igr2= "2598," "2599," &end # # 3365 LYS+ QE 1019 PHE QE 6.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.87," r4= "7.37," igr1= "1461," "1462," igr2= "309," "313," &end # # 3387 MET QE 1053 TRP HZ2 6.49 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "842," r1= "1.30," r2= "1.80," r3= "6.49," r4= "6.99," igr1= "1804," "1805," "1806," &end # # 1040 MET QE 3359 LEU HA 8.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1348," r1= "1.30," r2= "1.80," r3= "8.41," r4= "8.91," igr1= "644," "645," "646," &end # # 1040 MET QE 3359 LEU QQD 9.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "9.71," r4= "10.21," igr1= "644," "645," "646," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3358 VAL QQG 3435 ALA QB 8.9 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.90," r4= "9.40," igr1= "1336," "1337," "1338," "1340," "1341," "1342," igr2= "2537," "2538," "2539," &end # # 1041 ASP- H 3359 LEU QQD 8.2 (# ) &rst ixpk= "0," nxpk= "0," iat= "650," "-1," r1= "1.30," r2= "1.80," r3= "8.20," r4= "8.70," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3427 PRO HA 3430 LEU QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "2415," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "2449," "2450," &end # # 1030 ASN HD2+ 1030 ASN HB- 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "497," "498," igr2= "492," "493," &end # # 3419 LYS+ H 3420 ASN H 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2281," "2303," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," &end # # 3419 LYS+ H 3418 TRP H 4.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "2281," "2257," r1= "1.30," r2= "1.80," r3= "4.44," r4= "4.94," &end # # 3419 LYS+ H 3419 LYS+ HA 4.01 (# ) &rst ixpk= "0," nxpk= "0," iat= "2281," "2283," r1= "1.30," r2= "1.80," r3= "4.01," r4= "4.51," &end # # 3419 LYS+ H 3419 LYS+ QB 5.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "2281," "-1," r1= "1.30," r2= "1.80," r3= "5.05," r4= "5.55," igr2= "2285," "2286," &end # # 3391 LEU H 3391 LEU HG 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1862," "1869," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 3376 VAL H 3376 VAL HB 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1623," "1627," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," &end # # 3352 LEU H 3349 LYS+ HA 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1222," "1156," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," &end # # 1044 MET QE 3356 GLN HA 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1296," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "704," "705," "706," &end # # 3388 LYS+ HA 3388 LYS+ HG- 3.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "3.80," r4= "4.30," igr2= "1817," "1818," &end # # 1040 MET HG- 3359 LEU QQD 8.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.09," r4= "8.59," igr1= "640," "641," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3409 ALA QB 3403 CYS- QB 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "2122," "2123," "2124," igr2= "2042," "2041," &end # # 3386 THR HB 3383 HIS QB 4.71 (# ) &rst ixpk= "0," nxpk= "0," iat= "1783," "-1," r1= "1.30," r2= "1.80," r3= "4.71," r4= "5.21," igr2= "1731," "1732," &end # # 3386 THR HB 3359 LEU QQD 8.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "1783," "-1," r1= "1.30," r2= "1.80," r3= "8.09," r4= "8.59," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 3366 CYS- HA 3362 HIS HD2 5.7 (# ) &rst ixpk= "0," nxpk= "0," iat= "1472," "1416," r1= "1.30," r2= "1.80," r3= "5.70," r4= "6.20," &end # # 3358 VAL QG2 1019 PHE HZ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "311," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1340," "1341," "1342," &end # # 3390 VAL QG1 3407 HIS HD2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "2104," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1852," "1853," "1854," &end # # 3387 MET QE 3360 LEU HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1367," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1804," "1805," "1806," &end # # 3381 LEU QQD 3362 HIS HE1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1413," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 3361 LEU QQD 3415 ILE QD1 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr1= "1393," "1394," "1395," "1397," "1398," "1399," igr2= "2223," "2224," "2225," &end # # 3352 LEU QQD 3355 GLN HB+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1231," "1232," "1233," "1235," "1236," "1237," igr2= "1281," "1282," &end # # 3359 LEU QQD 3387 MET QE 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1804," "1805," "1806," &end # # 3359 LEU QQD 3387 MET HB- 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1797," "1798," &end # # 3365 LYS+ QE 3361 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1461," "1462," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 1050 ILE QG2 3356 GLN QG 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "784," "785," "786," igr2= "1301," "1302," &end # # 1044 MET QE 1053 TRP HZ2 6.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "842," r1= "1.30," r2= "1.80," r3= "6.73," r4= "7.23," igr1= "704," "705," "706," &end # # 1022 LEU QQD 1019 PHE QD 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "351," "352," "353," "355," "356," "357," igr2= "307," "315," &end # # 1018 THR QG2 1015 SER HB- 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "291," "292," "293," igr2= "246," "247," &end # # 1041 ASP- HB- 1044 MET QE 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "654," "655," igr2= "704," "705," "706," &end # # 3359 LEU QQD 3384 CYSZ HB- 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," igr1= "1355," "1356," "1357," "1359," "1360," "1361," igr2= "1750," "1749," &end # # 3395 THR HB 1025 LEU QQD 6.04 (# ) &rst ixpk= "0," nxpk= "0," iat= "1933," "-1," r1= "1.30," r2= "1.80," r3= "6.04," r4= "6.54," igr2= "416," "417," "418," "420," "421," "422," &end # # 3395 THR HA 1025 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "1931," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr2= "416," "417," "418," "420," "421," "422," &end # # 3395 THR QG2 1025 LEU QQD 7.48 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.48," r4= "7.98," igr1= "1935," "1936," "1937," igr2= "416," "417," "418," "420," "421," "422," &end # # 3395 THR QG2 1025 LEU HG 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "414," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "1935," "1936," "1937," &end # # 3395 THR QG2 1025 LEU HA 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "409," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "1935," "1936," "1937," &end # # 1026 LEU QQD 3368 ARG+ QG 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "435," "436," "437," "439," "440," "441," igr2= "1504," "1505," &end # # 1026 LEU QQD 3368 ARG+ QG 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "435," "436," "437," "439," "440," "441," igr2= "1504," "1505," &end # # 1030 ASN HD2- 3438 LYS+ QD 7.3 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.30," r4= "7.80," igr1= "497," "498," igr2= "2576," "2577," &end # # 3388 LYS+ HA 3388 LYS+ HG+ 4.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "4.38," r4= "4.88," igr2= "1817," "1818," &end # # 3388 LYS+ HA 3391 LEU QQD 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "1812," "-1," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3387 MET QE 3411 SER HB+ 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr1= "1804," "1805," "1806," igr2= "2143," "2144," &end # # 3395 THR H 3396 HIS H 3.73 (# ) &rst ixpk= "0," nxpk= "0," iat= "1929," "1943," r1= "1.30," r2= "1.80," r3= "3.73," r4= "4.23," &end # # 1033 SER H 1032 LEU QQD 6.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "537," "-1," r1= "1.30," r2= "1.80," r3= "6.81," r4= "7.31," igr2= "527," "528," "529," "531," "532," "533," &end # # 3409 ALA H 3405 VAL HB 4.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "2118," "2068," r1= "1.30," r2= "1.80," r3= "4.09," r4= "4.59," &end # # 1038 GLN HE2+ 1035 LEU HB- 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "618," "619," igr2= "566," "567," &end # # 1038 GLN HE2- 1035 LEU HB- 6.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.50," r4= "7.00," igr1= "618," "619," igr2= "566," "567," &end # # 3418 TRP H 3418 TRP HD1 5.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "2257," "2265," r1= "1.30," r2= "1.80," r3= "5.34," r4= "5.84," &end # # 3403 CYS- H 3408 CYSZ HB+ 6.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "2037," "-1," r1= "1.30," r2= "1.80," r3= "6.60," r4= "7.10," igr2= "2113," "2112," &end # # 3397 CYS- H 3393 HIS H 6.1 (# ) &rst ixpk= "0," nxpk= "0," iat= "1961," "1895," r1= "1.30," r2= "1.80," r3= "6.10," r4= "6.60," &end # # 3397 CYS- H 3394 MET HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1961," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr2= "1916," "1917," &end # # 3362 HIS H 3358 VAL QQG 6.34 (# ) &rst ixpk= "0," nxpk= "0," iat= "1403," "-1," r1= "1.30," r2= "1.80," r3= "6.34," r4= "6.84," igr2= "1336," "1337," "1338," "1340," "1341," "1342," &end # # 3413 GLN HE2- 1051 GLU- QB 5.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.28," r4= "5.78," igr1= "2186," "2187," igr2= "801," "802," &end # # 3373 ASN HD2- 3375 GLU- HB- 4.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.50," r4= "5.00," igr1= "1596," "1597," igr2= "1612," "1613," &end # # 3373 ASN HD2- 3375 GLU- QG 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "1596," "1597," igr2= "1615," "1616," &end # # 1022 LEU QQD 3391 LEU QB 8.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.17," r4= "8.67," igr1= "351," "352," "353," "355," "356," "357," igr2= "1866," "1867," &end # # 1040 MET QE 3356 GLN HA 7.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1296," r1= "1.30," r2= "1.80," r3= "7.17," r4= "7.67," igr1= "644," "645," "646," &end # # 1040 MET QE 3355 GLN HA 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1279," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "644," "645," "646," &end # # 1016 GLN HA 1019 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "255," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "307," "315," &end # # 1045 LEU QQD 3353 ILE HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1243," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "719," "720," "721," "723," "724," "725," &end # # 3427 PRO HB+ 3428 VAL QQG 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "2412," "2413," igr2= "2425," "2426," "2427," "2429," "2430," "2431," &end # # 3428 VAL QQG 3357 LEU HB- 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "2425," "2426," "2427," "2429," "2430," "2431," igr2= "1315," "1316," &end # # 3394 MET HB- 3393 HIS HD2 4 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1908," r1= "1.30," r2= "1.80," r3= "4.00," r4= "4.50," igr1= "1916," "1917," &end # # 3376 VAL HA 3370 GLU- HG- 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "1625," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr2= "1552," "1553," &end # # 3391 LEU QQD 1023 TRP HE3 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "380," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 1053 TRP HZ2 3360 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "842," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr2= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3340 ALA QB 2004 PHE QD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1048," "1049," "1050," igr2= "997," "1005," &end # # 3340 ALA QB 3343 PRO QG 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "1048," "1049," "1050," igr2= "1079," "1080," &end # # 3340 ALA QB 2005 ASN QB 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "1048," "1049," "1050," igr2= "1013," "1014," &end # # 2007 THR QG2 2003 CYS- QB 6.38 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.38," r4= "6.88," igr1= "1036," "1037," "1038," igr2= "984," "983," &end # # 3436 SER HB+ 3361 LEU QQD 7.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.21," r4= "7.71," igr1= "2547," "2548," igr2= "1393," "1394," "1395," "1397," "1398," "1399," &end # # 3361 LEU HB+ 1026 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "1388," "1389," igr2= "435," "436," "437," "439," "440," "441," &end # # 3391 LEU QQD 1022 LEU QQD 7.28 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.28," r4= "7.78," igr1= "1871," "1872," "1873," "1875," "1876," "1877," igr2= "351," "352," "353," "355," "356," "357," &end # # 3424 HIS HA 3430 LEU QQD 6.87 (# ) &rst ixpk= "0," nxpk= "0," iat= "2367," "-1," r1= "1.30," r2= "1.80," r3= "6.87," r4= "7.37," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 1022 LEU QQD 3364 HIS HD2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1444," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 3391 LEU QQD 1023 TRP HE3 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "380," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3436 SER HB- 1019 PHE QE 6.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.51," r4= "7.01," igr1= "2547," "2548," igr2= "309," "313," &end # # 3436 SER HB+ 1019 PHE QE 6.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.51," r4= "7.01," igr1= "2547," "2548," igr2= "309," "313," &end # # 1026 LEU QQD 1030 ASN HB- 7.42 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.42," r4= "7.92," igr1= "435," "436," "437," "439," "440," "441," igr2= "492," "493," &end # # 3433 LYS+ QE 3430 LEU QQD 8.32 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.32," r4= "8.82," igr1= "2510," "2511," igr2= "2454," "2455," "2456," "2458," "2459," "2460," &end # # 3406 ALA QB 1048 ASP- HB+ 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "2084," "2085," "2086," igr2= "758," "759," &end # # 3356 GLN QG 1050 ILE QD1 5.39 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.39," r4= "5.89," igr1= "1301," "1302," igr2= "791," "792," "793," &end # # 1052 GLN QG 1055 THR QG2 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "819," "820," igr2= "879," "880," "881," &end # # 1022 LEU QQD 3364 HIS HE1 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1440," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 3394 MET QE 3412 ARG+ QD 5.18 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.18," r4= "5.68," igr1= "1923," "1924," "1925," igr2= "2160," "2161," &end # # 1023 TRP HA 1026 LEU QQD 6.15 (# ) &rst ixpk= "0," nxpk= "0," iat= "363," "-1," r1= "1.30," r2= "1.80," r3= "6.15," r4= "6.65," igr2= "435," "436," "437," "439," "440," "441," &end # # 3365 LYS+ HA 1026 LEU QQD 5.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "1450," "-1," r1= "1.30," r2= "1.80," r3= "5.81," r4= "6.31," igr2= "435," "436," "437," "439," "440," "441," &end # # 3365 LYS+ QD 1026 LEU QQD 6.21 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.21," r4= "6.71," igr1= "1458," "1459," igr2= "435," "436," "437," "439," "440," "441," &end # # 1018 THR QG2 3365 LYS+ QE 7.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.68," r4= "8.18," igr1= "291," "292," "293," igr2= "1461," "1462," &end # # 1022 LEU QQD 3365 LYS+ QD 7.11 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.11," r4= "7.61," igr1= "351," "352," "353," "355," "356," "357," igr2= "1458," "1459," &end # # 1023 TRP HZ3 3391 LEU QQD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "378," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 1044 MET QE 3386 THR HB 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1783," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "704," "705," "706," &end # # 1053 TRP HE3 3414 ILE QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "848," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "2197," "2198," "2199," &end # # 3413 GLN HB- 1054 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2178," "2179," igr2= "861," "869," &end # # 3413 GLN HB+ 1054 PHE QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2178," "2179," igr2= "861," "869," &end # # 3413 GLN HB- 1054 PHE QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2178," "2179," igr2= "863," "867," &end # # 3413 GLN HB+ 1054 PHE QE 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2178," "2179," igr2= "863," "867," &end # # 1054 PHE QD 3414 ILE QG2 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "861," "869," igr2= "2197," "2198," "2199," &end # # 1019 PHE QB 1022 LEU QQD 6.05 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.05," r4= "6.55," igr1= "303," "304," igr2= "351," "352," "353," "355," "356," "357," &end # # 3416 SER HA 3419 ARG+ QD 5.68 (# ) &rst ixpk= "0," nxpk= "0," iat= "2231," "-1," r1= "1.30," r2= "1.80," r3= "5.68," r4= "6.18," igr2= "2291," "2292," &end # # 3409 ALA QB 1051 GLU- QG 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "2122," "2123," "2124," igr2= "804," "805," &end # # 3351 LYS+ QD 3348 GLU- QG 4.54 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "4.54," r4= "5.04," igr1= "1210," "1211," igr2= "1146," "1147," &end # # 3416 SER HB- 3413 GLN HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2233," "2234," igr2= "2178," "2179," &end # # 3416 SER HB- 3419 ARG+ QD 6.29 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.29," r4= "6.79," igr1= "2233," "2234," igr2= "2291," "2292," &end # # 3416 SER HB- 3419 ARG+ QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2233," "2234," igr2= "2285," "2286," &end # # 2007 THR HB 2003 CYS- QB 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1034," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "984," "983," &end # # 3344 THR HB 3350 ARG+ QD 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "1093," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr2= "1186," "1187," &end # # 3367 GLN QG 1026 LEU QQD 7.94 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.94," r4= "8.44," igr1= "1487," "1488," igr2= "435," "436," "437," "439," "440," "441," &end # # 3436 SER HB+ 3432 LEU HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2547," "2548," igr2= "2482," "2483," &end # # 3436 SER HB- 3432 LEU HB- 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," igr1= "2547," "2548," igr2= "2482," "2483," &end # # 3427 PRO HG+ 3428 VAL QG2 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr1= "2409," "2410," igr2= "2429," "2430," "2431," &end # # 2001 GLY QA 2004 PHE QE 6.93 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.93," r4= "7.43," igr1= "963," "964," igr2= "999," "1003," &end # # 1015 SER HB- 1018 THR QG2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "246," "247," igr2= "291," "292," "293," &end # # 3428 VAL QG2 1054 PHE QE 5.26 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.26," r4= "5.76," igr1= "2429," "2430," "2431," igr2= "863," "867," &end # # 3428 VAL QG2 1054 PHE HZ 4.88 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "865," r1= "1.30," r2= "1.80," r3= "4.88," r4= "5.38," igr1= "2429," "2430," "2431," &end # # 3428 VAL QG1 1054 PHE QE 6.56 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.56," r4= "7.06," igr1= "2425," "2426," "2427," igr2= "863," "867," &end # # 3415 ILE QD1 3419 LYS+ QD 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "2223," "2224," "2225," igr2= "2291," "2292," &end # # 1058 PRO HA 1055 THR QG2 6.89 (# ) &rst ixpk= "0," nxpk= "0," iat= "924," "-1," r1= "1.30," r2= "1.80," r3= "6.89," r4= "7.39," igr2= "879," "880," "881," &end # # 1036 PRO QG 3381 LEU QQD 7.83 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.83," r4= "8.33," igr1= "585," "586," igr2= "1703," "1704," "1705," "1707," "1708," "1709," &end # # 1019 PHE HZ 3436 SER HB+ 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "311," "-1," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr2= "2547," "2548," &end # # 1035 LEU QQD 3362 HIS HE1 7.81 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1413," r1= "1.30," r2= "1.80," r3= "7.81," r4= "8.31," igr1= "571," "572," "573," "575," "576," "577," &end # # 1035 LEU QQD 3362 HIS HE1 7.51 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1413," r1= "1.30," r2= "1.80," r3= "7.51," r4= "8.01," igr1= "571," "572," "573," "575," "576," "577," &end # # 1026 LEU QQD 3364 HIS HD2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1444," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "435," "436," "437," "439," "440," "441," &end # # 3387 MET HA 3390 VAL QG1 4.85 (# ) &rst ixpk= "0," nxpk= "0," iat= "1795," "-1," r1= "1.30," r2= "1.80," r3= "4.85," r4= "5.35," igr2= "1852," "1853," "1854," &end # # 1052 GLN H 1052 GLN QG 4.6 (# ) &rst ixpk= "0," nxpk= "0," iat= "812," "-1," r1= "1.30," r2= "1.80," r3= "4.60," r4= "5.10," igr2= "819," "820," &end # # 3387 MET HG- 3360 LEU HA 4.44 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1367," r1= "1.30," r2= "1.80," r3= "4.44," r4= "4.94," igr1= "1800," "1801," &end # # 3428 VAL QG1 3432 LEU HB+ 6.17 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.17," r4= "6.67," igr1= "2425," "2426," "2427," igr2= "2482," "2483," &end # # 1032 LEU H 1031 VAL H 4.8 (# ) &rst ixpk= "0," nxpk= "0," iat= "518," "502," r1= "1.30," r2= "1.80," r3= "4.80," r4= "5.30," &end # # 1023 TRP HZ3 3391 LEU QQD 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "378," "-1," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr2= "1871," "1872," "1873," "1875," "1876," "1877," &end # # 3360 LEU QQD 1053 TRP HH2 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "844," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "1374," "1375," "1376," "1378," "1379," "1380," &end # # 3418 TRP HD1 3432 LEU QQD 5.4 (# ) &rst ixpk= "0," nxpk= "0," iat= "2265," "-1," r1= "1.30," r2= "1.80," r3= "5.40," r4= "5.90," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 1032 LEU QQD 1019 PHE HZ 5.99 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "311," r1= "1.30," r2= "1.80," r3= "5.99," r4= "6.49," igr1= "527," "528," "529," "531," "532," "533," &end # # 3352 LEU QQD 1044 MET HA 5.79 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "695," r1= "1.30," r2= "1.80," r3= "5.79," r4= "6.29," igr1= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3353 ILE QG2 1054 PHE HZ 4.72 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "865," r1= "1.30," r2= "1.80," r3= "4.72," r4= "5.22," igr1= "1247," "1248," "1249," &end # # 3353 ILE QG2 1054 PHE QE 6.09 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.09," r4= "6.59," igr1= "1247," "1248," "1249," igr2= "863," "867," &end # # 3387 MET QE 1050 ILE QG2 6.24 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.24," r4= "6.74," igr1= "1804," "1805," "1806," igr2= "784," "785," "786," &end # # 3387 MET QE 1050 ILE QD1 5.96 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "5.96," r4= "6.46," igr1= "1804," "1805," "1806," igr2= "791," "792," "793," &end # # 3432 LEU QQD 3435 ALA QB 6.14 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.14," r4= "6.64," igr1= "2487," "2488," "2489," "2491," "2492," "2493," igr2= "2537," "2538," "2539," &end # # 3354 GLN HA 3357 LEU QQD 6.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "1262," "-1," r1= "1.30," r2= "1.80," r3= "6.07," r4= "6.57," igr2= "1320," "1321," "1322," "1324," "1325," "1326," &end # # 3418 TRP HE1 3432 LEU QQD 6.07 (# ) &rst ixpk= "0," nxpk= "0," iat= "2267," "-1," r1= "1.30," r2= "1.80," r3= "6.07," r4= "6.57," igr2= "2487," "2488," "2489," "2491," "2492," "2493," &end # # 3352 LEU QQD 1045 LEU HG 6 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "717," r1= "1.30," r2= "1.80," r3= "6.00," r4= "6.50," igr1= "1231," "1232," "1233," "1235," "1236," "1237," &end # # 3395 THR HB 1023 TRP HH2 5.5 (# ) &rst ixpk= "0," nxpk= "0," iat= "1933," "376," r1= "1.30," r2= "1.80," r3= "5.50," r4= "6.00," &end # # 1026 LEU QQD 3361 LEU HA 5.76 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1386," r1= "1.30," r2= "1.80," r3= "5.76," r4= "6.26," igr1= "435," "436," "437," "439," "440," "441," &end # # 3358 VAL HA 1032 LEU QQD 7.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1332," "-1," r1= "1.30," r2= "1.80," r3= "7.06," r4= "7.56," igr2= "527," "528," "529," "531," "532," "533," &end # # 1026 LEU QQD 3365 LYS+ QB 6.74 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "6.74," r4= "7.24," igr1= "435," "436," "437," "439," "440," "441," igr2= "1452," "1453," &end # # 1036 PRO QG 3359 LEU QQD 8.62 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "8.62," r4= "9.12," igr1= "585," "586," igr2= "1355," "1356," "1357," "1359," "1360," "1361," &end # # 1022 LEU QQD 3364 HIS HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1432," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3364 HIS HA 6.61 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "1432," r1= "1.30," r2= "1.80," r3= "6.61," r4= "7.11," igr1= "351," "352," "353," "355," "356," "357," &end # # 1022 LEU QQD 3365 LYS+ QD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "351," "352," "353," "355," "356," "357," igr2= "1458," "1459," &end # # 1022 LEU QQD 3365 LYS+ QD 7.41 (# ) &rst ixpk= "0," nxpk= "0," iat= "-1," "-1," r1= "1.30," r2= "1.80," r3= "7.41," r4= "7.91," igr1= "351," "352," "353," "355," "356," "357," igr2= "1458," "1459," &end # # 3368 ARG+ HA 1026 LEU QQD 7.06 (# ) &rst ixpk= "0," nxpk= "0," iat= "1499," "-1," r1= "1.30," r2= "1.80," r3= "7.06," r4= "7.56," igr2= "435," "436," "437," "439," "440," "441," &end
Contact the webmaster for help, if required. Saturday, April 27, 2024 6:29:39 PM GMT (wattos1)