NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
575685 2mi2 19618 cing 1-original 1 DYANA/DIANA distance NOE simple


  2 PHE  HA  1 MET  H 4.50
  2 PHE  HB3  3 ASP  H 4.00
  2 PHE  HB2  3 ASP  H 4.00
  2 PHE  HB2     4 ILE  HG12    6.00
  2 PHE  HB3     4 ILE  HG12    6.50
#  2 PHE  HB3     4 ILE  HG13    6.50 #del_vio
  2 PHE  HB2     4 ILE  HG13    6.00
  2 PHE  HZ  4 ILE  QD1 5.50
#  4 ILE  QD1     7 SER  HB3     4.50 #comb_QB
  4 ILE  QD1     7 SER  QB      5.50
  6 PHE  HB2  9 LEU  QQD 5.00
  6 PHE  QD      7 SER  QB      6.00 #QB
  8 GLU  HB2  5 GLY  H 5.50
  8 GLU  H 12 VAL  QG2 5.50
  9 LEU  QQD 11 LEU  H 6.01
  9 LEU  HG 13 PHE  QD 6.01
#  9 LEU  HB2 13 PHE  QE 6.51 #del_vio
 10 LEU  H  7 SER  QB  6.00 #QB
 10 LEU  H  9 LEU  HG 4.50
 10 LEU  H 12 VAL  QG2 5.52
 10 LEU  HA     12 VAL  H       5.00
 10 LEU  HA 14 ILE  QG2 6.52
 10 LEU  HA 14 ILE  QD1 5.01
 10 LEU  QB 14 ILE  QG2 5.50
 10 LEU  QB 14 ILE  QD1 4.50
 11 LEU  HG 12 VAL  QG1 5.50
 11 LEU  H 12 VAL  QQG 6.00 #comb_QQG
# 11 LEU  H 12 VAL  QG2 6.00
 11 LEU  H 14 ILE  QD1 6.01
 11 LEU  HG 14 ILE  QG2 5.00
 11 LEU  HA 14 ILE  QD1 5.01
 11 LEU  QB 15 ILE  QD1 5.00
 11 LEU  HA 15 ILE  QD1 5.50
 11 LEU  QB 15 ILE  QG2 6.01
 12 VAL  HA 11 LEU  QB 5.00
 12 VAL  H 15 ILE  QD1 5.51
 13 PHE  HA 12 VAL  QG2 5.50
 13 PHE  QD 12 VAL  QG2 6.52
 13 PHE  QD 12 VAL  QG1 5.50
 13 PHE  HA 14 ILE  QD1 5.50
# 13 PHE  HB3 14 ILE  HG12 6.51 #del_vio
 13 PHE  QD 14 ILE  QG2 6.01
 13 PHE  QD 14 ILE  QD1 5.00
# 13 PHE  HB2 14 ILE  HG12 6.51 #del_vio
 13 PHE  HB2 17 LEU  QD2 6.00
 14 ILE  H 10 LEU  QB 5.50
 14 ILE  QD1 13 PHE  QE 5.00
 14 ILE  HB 15 ILE  QG2 5.50
 14 ILE  QD1 17 LEU  QB 5.00
 15 ILE  HA 11 LEU  HG 6.01
 15 ILE  HA 17 LEU  QD2 6.52
 16 GLY  H 14 ILE  QG2 5.50
 16 GLY  H 15 ILE  QG2 4.50
 16 GLY  H 15 ILE  QD1 5.50
 16 GLY  H 17 LEU  QD1 6.50
 16 GLY  H 17 LEU  QB 5.50
 16 GLY  H 17 LEU  QD2 6.50
 16 GLY  H 19 VAL  QG2 6.50
 17 LEU  QD2    13 PHE  QE      4.50
 17 LEU  QD1    13 PHE  QE      4.50
 17 LEU  H 14 ILE  QG1 6.51 #QG1
 17 LEU  H 14 ILE  HB 5.51
 17 LEU  H 15 ILE  QD1 6.01
 17 LEU  H 18 VAL  HB 6.00
 17 LEU  HA 19 VAL  QG2 6.00
 17 LEU  H 20 LEU  QD2 6.00
 18 VAL  H 14 ILE  QG2 4.50
 18 VAL  HA 14 ILE  QG2 5.00
 18 VAL  QG2 14 ILE  QG2 3.50
 18 VAL  HB 15 ILE  QD1 6.00
 18 VAL  HA 15 ILE  QD1 6.51
 18 VAL  H 15 ILE  QD1 6.00
 18 VAL  H 17 LEU  QD1 5.50
 18 VAL  H 19 VAL  QG2 5.00
 19 VAL  H 15 ILE  H 6.50
 19 VAL  H 15 ILE  QG2 4.50
 19 VAL  H 18 VAL  QG1 4.50
 19 VAL  H 20 LEU  QD2 6.01
# 20 LEU  HB2 17 LEU  QD1 6.52 #del_?
# 20 LEU  HB2 17 LEU  QD2 6.52 #del_?
 20 LEU  QD1 17 LEU  HA 6.01
# 20 LEU  H 17 LEU  QD2 5.50 #comb_QQD
 20 LEU  H 17 LEU  QQD 6.00
 19 VAL  H 17 LEU  QQD 6.00 #add_ov
 20 LEU  QD1 19 VAL  H 6.01
 21 GLY  H 20 LEU  QD2 5.50
 21 GLY  H 20 LEU  HG 5.01
 22 PRO  QG 21 GLY  QA 5.51 #QG_QA
# 23 GLN  HA     24 ARG  HG3     5.00 #comb_QG
 23 GLN  HA     24 ARG  QG      5.00
 24 ARG  HG2 27 VAL  QG1 4.50
 24 ARG  HA 27 VAL  QG1 5.50
 25 LEU  HA 26 PRO  HG2 5.51
 25 LEU  H 26 PRO  QD 3.50
 25 LEU  HA     26 PRO  QD      3.50
# 25 LEU  H 29 VAL  HB 6.51 #del_lone
 25 LEU  QD2    29 VAL  QG1     5.01
# 25 LEU  HA 30 LYS  H 6.51 #del_vio
 26 PRO  HA 30 LYS  HG3 4.50
 26 PRO  QB 30 LYS  HG3 4.50
 26 PRO  HA 30 LYS  HG2 4.50
 26 PRO  QB 30 LYS  HG2 4.50
 27 VAL  HB     24 ARG  HA      5.00
 27 VAL  HB     24 ARG  HG2     5.51
 27 VAL  H 28 ALA  QB 5.50
 27 VAL  HB 28 ALA  QB 5.00
 27 VAL  HB 28 ALA  HA 5.50
 28 ALA  H 27 VAL  QG2 4.00
 28 ALA  HA     31 THR  QG2     5.50
 29 VAL  HA     28 ALA  QB      5.50
 31 THR  QG2    28 ALA  QB      5.50
 31 THR  HA 30 LYS  HG2 6.51
 31 THR  QG2    32 VAL  QG2     4.50
 31 THR  HA 32 VAL  QG1 6.00
 32 VAL  HA     31 THR  QG2     5.00
 32 VAL  H      31 THR  QG2     4.50
 33 ALA  H 32 VAL  QG2 5.00
 33 ALA  H 32 VAL  QG1 5.00
 33 ALA  HA     36 ILE  QG2     5.00 #in_amb
 34 GLY  H      31 THR  QG2     6.00
 34 GLY  H      32 VAL  QG1     5.50
 34 GLY  HA3 38 ALA  QB 5.50
 35 TRP  HD1    31 THR  HA      6.00
 35 TRP  HD1    31 THR  QG2     4.50
 35 TRP  H      31 THR  QG2     5.50
 35 TRP  HE3 31 THR  QG2 6.51
 35 TRP  HH2 31 THR  QG2 6.01
# 35 TRP  HZ3 31 THR  QG2 6.51 #del_ov
 35 TRP  HZ2    31 THR  QG2     6.01
 35 TRP  HE1    31 THR  QG2     4.00
 35 TRP  HZ3    32 VAL  HA      6.50
 35 TRP  HD1    32 VAL  HA      6.00
 35 TRP  HE3    32 VAL  HA      6.00
# 35 TRP  HE3 32 VAL  QG2 6.51
# 35 TRP  HE3 32 VAL  QG1 5.51
 35 TRP  HE1 32 VAL  QG1 5.01
 35 TRP  HH2    32 VAL  QG1     5.00
 35 TRP  H 32 VAL  QG1 5.00
 35 TRP  HD1 32 VAL  QG1 5.51
 35 TRP  HE3 36 ILE  QG1 5.50 #comb_QG1
 35 TRP  HH2    36 ILE  HG13    5.50
 35 TRP  H 36 ILE  QD1 6.00
 35 TRP  H 36 ILE  QG2 5.50
 35 TRP  HH2    36 ILE  HA      6.50
 35 TRP  HZ3    36 ILE  HG13    6.00
 35 TRP  HD1    36 ILE  H       6.00
 35 TRP  HE3    36 ILE  H       6.00
 36 ILE  HG12   35 TRP  H       6.00
 35 TRP  HE3 38 ALA  QB 6.01
# 35 TRP  HE1 38 ALA  QB 6.51 #del_w
 35 TRP  HD1 38 ALA  QB 6.02
 35 TRP  HA     38 ALA  QB      4.50
# 36 ILE  HG13 32 VAL  QG1 5.50 #del_ov 
 36 ILE  H 32 VAL  QG2 6.01
 36 ILE  QG2    33 ALA  QB      5.50
 36 ILE  HG13 33 ALA  QB 6.01
 37 ARG  H 34 GLY  HA3 5.01
 37 ARG  H 34 GLY  HA2 5.01
 37 ARG  H      36 ILE  QG2     4.50
 37 ARG  H 38 ALA  QB 4.50
 38 ALA  H 36 ILE  QG2 5.50
 39 LEU  HB3 36 ILE  QG2 6.01
 39 LEU  QB 43 ALA  QB 5.51
# 39 LEU  HB3 43 ALA  QB 5.01 #comb_QB
 40 ARG  HD2    36 ILE  QG2     5.50
 40 ARG  HE     36 ILE  QG2     6.50
 40 ARG  H 41 SER  HA 5.50
 40 ARG  QB 43 ALA  H 5.00
 41 SER  H 38 ALA  HA 4.00
 41 SER  HA 42 LEU  HA 5.01
 41 SER  HA 42 LEU  QB 5.50
 41 SER  HA     44 THR  HB      4.50
 42 LEU  QQD 39 LEU  H 5.50
 42 LEU  QQD 39 LEU  HA 4.50
 42 LEU  QQD 39 LEU  HB3 5.01
 42 LEU  QQD 39 LEU  HB2 5.01
 42 LEU  H      39 LEU  HG      5.50
 42 LEU  H 40 ARG  HA 4.50
# 42 LEU  H      44 THR  HB      6.50 #del_vio
 42 LEU  QQD 45 THR  H 5.00
 43 ALA  HA 44 THR  QG2 6.01
# 43 ALA  HA     46 VAL  QG2     5.50 #comb_QQG
 43 ALA  HA     46 VAL  QQG     4.50
 43 ALA  QB 47 GLN  QG  5.50 #ov
 44 THR  H 41 SER  QB 5.51
 44 THR  H      42 LEU  HA      5.50
 44 THR  QG2 43 ALA  QB 5.50
 44 THR  HA 43 ALA  QB 5.50
 44 THR  HB     47 GLN  QG      6.50 #0mir
 44 THR  HA     47 GLN  QG      5.50
 44 THR  QG2 47 GLN  QG  5.52
 45 THR  H 41 SER  HA 4.50
 45 THR  HB 41 SER  HA 6.00
 45 THR  H 42 LEU  QB 5.50
 45 THR  HA 43 ALA  QB 6.50
 45 THR  HB 46 VAL  QG2 6.00
 45 THR  HA     47 GLN  H       4.50
# 45 THR  H      47 GLN  HE21    6.50 #del_w
 46 VAL  HA     49 GLU  H       6.01
 46 VAL  H      44 THR  HB      6.00
 46 VAL  QG2 43 ALA  QB 5.52
 46 VAL  HB 43 ALA  QB 6.53 #ov
 47 GLN  H      43 ALA  HA      5.50
 47 GLN  H      44 THR  HA      5.50
 47 GLN  H 44 THR  HB 6.00
 47 GLN  H 44 THR  QG2 5.50
 47 GLN  HE22 43 ALA  QB 5.50
# 47 GLN  HE22 44 THR  QG2 5.00 #comb_QE2
 47 GLN  QE2  44 THR  QG2 5.50
 47 GLN  QB 46 VAL  QG2 5.50
 47 GLN  HE21 46 VAL  QG1 6.00
 48 ASN  H      44 THR  H       6.01
 48 ASN  QB     44 THR  QG2     6.00 #QB
 48 ASN  H      44 THR  HB      5.00
 48 ASN  H      47 GLN  QE2     6.50 #modi_QE2_weak
 48 ASN  H 49 GLU  HB2 5.50
 48 ASN  HA     51 THR  H       5.50
 50 LEU  H      51 THR  HA      5.50
 51 THR  H      49 GLU  QB      5.50
 51 THR  H      50 LEU  QQD     4.50 #QQD
 53 GLU  H      52 GLN  QB      4.50
 53 GLU  H      54 LEU  QQD     5.50
# 54 LEU  HG     51 THR  HB      6.00 #del_ov
# 55 LYS  HG3    56 LEU  HB3     5.01 #comb_QG
 56 LEU  H      54 LEU  H       5.00
 56 LEU  HB2    60 GLN  HB2     6.01
# 57 GLN  HB2 56 LEU  HB2 6.50 #del_ov
 57 GLN  H 56 LEU  QD2 5.01  
 57 GLN  HA 59 PHE  QD 6.50
 57 GLN  QG 61 ASP  H 6.50
 57 GLN  H 58 GLU  QG 6.00
 58 GLU  H 55 LYS  QD 6.01
 58 GLU  H 62 SER  H 6.01
 59 PHE  HB2    63 LEU  QD1     6.50 #?
 59 PHE  QD     63 LEU  QD2     5.00
 59 PHE  QD     63 LEU  QD1     5.50
# 60 GLN  HG3 56 LEU  QD1 6.01 #comb_QG
 60 GLN  H 56 LEU  H 6.52 #ov
 60 GLN  QG  63 LEU  QQD 6.51 #QQD
# 60 GLN  HG3 63 LEU  QD2 6.51 #comb_QG
 63 LEU  H 60 GLN  QB 5.50
 63 LEU  HA     66 VAL  HB      4.50
 63 LEU  HA     66 VAL  QG1     4.00
 63 LEU  HA     66 VAL  QG2     6.00
 65 LYS  H 64 LYS  QG 4.50
 65 LYS  H 66 VAL  HB 6.00
 65 LYS  HA 67 GLU  H 5.00
 66 VAL  HB 63 LEU  QQD 6.00
# 66 VAL  HB 63 LEU  QD2 5.50 #comb_QQD
 66 VAL  HA 70 SER  H 5.50
 67 GLU  H 63 LEU  QD1 6.51
# 67 GLU  HB2 66 VAL  QG2 5.51 #del_ov
 67 GLU  QG  68 LYS  H 4.50 #QG
 67 GLU  QG 70 SER  H 6.51
# 67 GLU  HG3 70 SER  H 6.51 #comb_QG
 69 ALA  QB 66 VAL  QG2 5.50
 69 ALA  QB 66 VAL  QG1 5.50
 69 ALA  H 66 VAL  HB 5.51
 69 ALA  H 68 LYS  QD 5.00
 69 ALA  H 70 SER  HA 5.51
 69 ALA  HA 70 SER  H 3.50
 69 ALA  HA     72 THR  QG2     5.00
 69 ALA  H      72 THR  QG2     6.00
# 69 ALA  HA 74 LEU  QD2 5.50 #comb_QQD
 69 ALA  HA     74 LEU  QQD     6.00 
 70 SER  H 67 GLU  HB2 5.50
 70 SER  HA 69 ALA  QB 6.00
 70 SER  H 69 ALA  QB 4.00
 71 LEU  HA 72 THR  QG2 6.00 
 72 THR  HA     71 LEU  HB2     6.01
 72 THR  HA     71 LEU  QD1     6.50
 72 THR  HA     74 LEU  HB2     6.52 #?
 73 ASN  H 70 SER  HA 5.50
 73 ASN  H 70 SER  H 6.02 #ov
# 73 ASN  HB2 71 LEU  HA 6.50 #del_w
 73 ASN  QB     72 THR  H       6.51
# 73 ASN  HD21   71 LEU  QD1     6.50 #del_wrong
 73 ASN  H 74 LEU  HA 5.50
 73 ASN  H      74 LEU  HG      5.00
 73 ASN  H      74 LEU  QD2     5.00
 73 ASN  H      74 LEU  QD1     5.50
 73 ASN  H 75 THR  H 5.51
 74 LEU  QD1    75 THR  QG2     5.50
 75 THR  H 74 LEU  QD1 5.52
 75 THR  H 74 LEU  HG 6.01
 75 THR  H 74 LEU  H 4.00
 75 THR  H 76 PRO  HD3 5.00
 75 THR  H 76 PRO  HD2 5.00
 75 THR  H 77 GLU  HB2 6.50
 75 THR  QG2    78 LEU  QD2     5.50
# 76 PRO  HA 74 LEU  HA 6.50 #del_w
 76 PRO  HA     79 LYS  HB2     4.50
 76 PRO  HA     79 LYS  QD      4.50
# 76 PRO  HB3 80 ALA  HA 6.50 #del_vio
 78 LEU  HG 81 SER  HB2 6.01
 79 LYS  HA 78 LEU  QD1 5.50
 79 LYS  H 81 SER  H 4.50
 80 ALA  H 78 LEU  QD1 6.01
 80 ALA  H 83 ASP  H 5.01
 81 SER  H 78 LEU  QB 5.00
 82 MET  H 78 LEU  QB 5.50
 82 MET  H 79 LYS  QG 5.50
# 82 MET  HB3 81 SER  H 6.01 #comb_QB
 82 MET  QB  81 SER  H 6.51
 82 MET  HG2 81 SER  H 6.00
 82 MET  HG3 81 SER  H 6.00
 84 GLU  HA 83 ASP  H 5.51
 84 GLU  H 85 LEU  QQD 5.50
 84 GLU  HB2 85 LEU  HG 5.50
 84 GLU  H 86 ARG  H 4.00
 85 LEU  H 83 ASP  H 4.00
 85 LEU  H 86 ARG  HA 5.00
# 85 LEU  HB3 88 ALA  H 5.50 #comb_QB
 85 LEU  QB 88 ALA  H 5.50
 86 ARG  HA 85 LEU  QQD 5.00
 86 ARG  H 88 ALA  QB 5.50
 86 ARG  H 89 ALA  QB 5.50
 86 ARG  HB2 89 ALA  QB 5.50
 86 ARG  QB 89 ALA  H 5.00
 86 ARG  HA 89 ALA  H 4.50
 87 GLN  QB 90 GLU  H 5.01
 88 ALA  H 85 LEU  QQD 6.01
 88 ALA  H 85 LEU  HG 6.01
 88 ALA  H 86 ARG  H 4.50
 90 GLU  H 86 ARG  H 5.50
 90 GLU  H 88 ALA  H 4.50
 90 GLU  HG2 93 LYS  H 6.01
 90 GLU  HG3 93 LYS  H 6.00
 91 SER  H 88 ALA  QB 5.01
 91 SER  H 89 ALA  QB 5.50
 91 SER  H 92 MET  QE 6.01
 92 MET  H 89 ALA  QB 5.00 
 92 MET  HG3 91 SER  H 5.50
 93 LYS  H 89 ALA  H 6.01
 93 LYS  H 89 ALA  QB 5.01
 93 LYS  H 90 GLU  H 4.50
 93 LYS  HA 96 TYR  QD 5.50
 93 LYS  HB2 96 TYR  QE 6.50
 93 LYS  HB2    96 TYR  QD      6.00
 94 ARG  H 90 GLU  QB 5.50
 95 SER  HA 94 ARG  HG2 5.00
 95 SER  QB     96 TYR  QD      5.50
# 95 SER  QB     96 TYR  QE      6.50 #del_w
 96 TYR  H 94 ARG  HA 5.00
 96 TYR  HB2 95 SER  H 5.50
 96 TYR  HB3 95 SER  H 5.50
 96 TYR  QD 97 VAL  QG2 4.50
 96 TYR  QB 98 ALA  H 5.50 #comb_QB
# 96 TYR  HB3 98 ALA  H 5.50
 97 VAL  HB     96 TYR  QD      6.00
 97 VAL  H 98 ALA  H 4.00
 97 VAL  H 98 ALA  HA 6.00
 98 ALA  HA 97 VAL  QG1 5.50
 98 ALA  H 96 TYR  QE 6.01
 99 ASN  H 97 VAL  QG2 5.51
100 ASP  H 99 ASN  HA 3.50
101 PRO  HG3   102 LEU  H 4.50
102 LEU  HB2   101 PRO  HA 6.50
103 GLU  H     101 PRO  HA 4.50
  1 MET  QE      2 PHE  HZ      5.50
  1 MET  QE      2 PHE  H       5.50
  1 MET  QE      3 ASP  H       5.50
  1 MET  HA      3 ASP  H       4.50
  1 MET  QE      4 ILE  QD1     5.50
  2 PHE  H       1 MET  HA      3.50
  2 PHE  QD      1 MET  HA      5.50
  2 PHE  QE      1 MET  QE      4.50
  2 PHE  HB3     1 MET  H       5.50
  2 PHE  HB2     2 PHE  H       4.50
  2 PHE  HB2     2 PHE  HA      4.50
  2 PHE  QD      3 ASP  H       4.50
  2 PHE  H       3 ASP  HB2     5.50
  2 PHE  HA      3 ASP  H       3.50
  2 PHE  QE      4 ILE  QD1     5.50
  2 PHE  HB2     4 ILE  HA      5.50
  2 PHE  QB      4 ILE  QD1     6.50
  2 PHE  H       4 ILE  HG12    5.50
  2 PHE  QD      4 ILE  HG12    6.00
  2 PHE  QD      4 ILE  HG13    6.00
  2 PHE  QD      4 ILE  QD1     5.50
#  2 PHE  HB3     4 ILE  QD1     5.50 #comb_QB
  2 PHE  QD      4 ILE  HB      6.00
  2 PHE  H       4 ILE  HG13    5.50
  2 PHE  H       4 ILE  H       4.50
  2 PHE  H       4 ILE  QD1     4.50
  3 ASP  H       1 MET  H       3.50
  3 ASP  HB3     3 ASP  HA      4.50
  3 ASP  HB2     4 ILE  HA      6.00
  3 ASP  HB3     4 ILE  H       4.50
  3 ASP  H       4 ILE  HB      6.00
  3 ASP  HB2     4 ILE  HB      6.00
  3 ASP  H       4 ILE  H       3.50
  3 ASP  HB2     4 ILE  H       4.50
  3 ASP  H       5 GLY  H       5.50
  3 ASP  HA      5 GLY  H       5.50
  4 ILE  QD1     1 MET  H       5.50
  4 ILE  QD1     2 PHE  HA      6.50
  4 ILE  HA      3 ASP  HA      5.50
  4 ILE  HB      3 ASP  HA      5.50
  4 ILE  HG13    3 ASP  HA      6.01
  4 ILE  HG12    3 ASP  HA      5.50
  4 ILE  QD1     3 ASP  H       6.00
  4 ILE  H       3 ASP  HA      3.50
  4 ILE  HG13    4 ILE  H       4.50
  4 ILE  HA      5 GLY  H       4.50
  4 ILE  HB      5 GLY  H       3.50
  4 ILE  HG12    5 GLY  H       5.50
  4 ILE  HG13    5 GLY  H       5.50
  4 ILE  H       5 GLY  H       4.50
  4 ILE  QD1     5 GLY  H       4.50
  4 ILE  QD1     6 PHE  H       4.50
  4 ILE  QG2     7 SER  HB2     6.00
  4 ILE  QD1     8 GLU  HB2     5.00
  5 GLY  HA2     4 ILE  QG2     5.50
  5 GLY  H       4 ILE  QG2     4.50
  6 PHE  H       4 ILE  HA      5.50
  6 PHE  QD      4 ILE  QG2     5.50
  6 PHE  QE      4 ILE  HA      6.01
  6 PHE  HB3     5 GLY  HA3     6.00
  6 PHE  H       5 GLY  HA3     4.00
  6 PHE  H       5 GLY  H       4.50
  6 PHE  H       5 GLY  HA2     3.50
  6 PHE  HB3     7 SER  H       4.50
  6 PHE  HA      7 SER  H       3.50
  6 PHE  QD      7 SER  H       4.50
  6 PHE  HB2     7 SER  H       4.50
  6 PHE  H       7 SER  H       3.50
  6 PHE  H       8 GLU  H       5.50
  6 PHE  HA      9 LEU  HB2     4.50
  6 PHE  QD      9 LEU  HB3     5.50
  6 PHE  HB3     9 LEU  HB2     5.50
  6 PHE  HB2     9 LEU  HB2     5.50
  6 PHE  HA      9 LEU  H       4.50
  6 PHE  HA      9 LEU  HG      4.50
  6 PHE  QD     10 LEU  QQD     4.50
  6 PHE  HA     10 LEU  H       4.50
  8 GLU  HB2     4 ILE  HA      5.50
  8 GLU  HB2     4 ILE  HB      5.50
  8 GLU  HB2     4 ILE  HG13    4.50
  8 GLU  HB2     4 ILE  HG12    5.50
  8 GLU  HB2     4 ILE  QG2     4.00
  8 GLU  HA      4 ILE  QG2     4.50
  8 GLU  H       4 ILE  QG2     4.00
  8 GLU  HB3     7 SER  HB2     6.00
  8 GLU  H       7 SER  QB      5.00
#  8 GLU  H       7 SER  HB3     5.50 #comb_QB
  8 GLU  H       7 SER  H       4.50
  8 GLU  HB2     7 SER  H       5.50
  8 GLU  HB2     9 LEU  QQD     4.50
  8 GLU  H       9 LEU  H       4.50
  8 GLU  H      10 LEU  H       4.50
  9 LEU  HB2     4 ILE  QG2     4.50
  9 LEU  HA     12 VAL  HA      6.00
  9 LEU  HA     12 VAL  QG1     5.00
  9 LEU  HA     12 VAL  QG2     5.00
  9 LEU  HA     12 VAL  H       4.50
 10 LEU  H       9 LEU  H       4.50
 10 LEU  HA     11 LEU  H       4.50
 10 LEU  HA     13 PHE  QD      5.50
 10 LEU  HA     13 PHE  QB      4.50 #comb_QB
# 10 LEU  HA     13 PHE  HB3     4.50
 10 LEU  HA     13 PHE  H       4.50
 11 LEU  H      10 LEU  H       4.50
 11 LEU  HA     12 VAL  H       4.50
 11 LEU  QB     12 VAL  H       4.00
 11 LEU  H      12 VAL  H       3.50
 11 LEU  HA     14 ILE  QG2     4.50
 12 VAL  HB      9 LEU  HA      4.50
# 12 VAL  HB      9 LEU  QQD     3.50 #del_ov
 12 VAL  HB     11 LEU  H       5.50
 12 VAL  HA     15 ILE  H       4.50
 13 PHE  H      11 LEU  H       5.50
 13 PHE  QB     12 VAL  HB      6.00 #QB
 13 PHE  HA     12 VAL  QG1     5.00
 13 PHE  QB     12 VAL  QG2     6.50 #QB
 13 PHE  H      12 VAL  HB      4.50
 13 PHE  H      12 VAL  QG1     4.00
 13 PHE  QB     12 VAL  HA      6.00 #QB
 13 PHE  H      12 VAL  QG2     4.00
 13 PHE  H      12 VAL  HA      4.50
 13 PHE  H      12 VAL  H       3.50
 13 PHE  HA     14 ILE  HA      5.50
 13 PHE  QB     14 ILE  HB      6.00 #QB
 13 PHE  HA     16 GLY  H       5.00
 13 PHE  QD     17 LEU  HG      6.00
 13 PHE  HZ     17 LEU  QD2     5.00
 13 PHE  HZ     17 LEU  HG      6.00
 13 PHE  HZ     17 LEU  QB      6.51 #from_amb
 13 PHE  QD     17 LEU  QD2     5.50
 13 PHE  HZ     17 LEU  QD1     5.00
 13 PHE  QE     17 LEU  HG      6.00
 14 ILE  H      11 LEU  HA      5.50
 14 ILE  HA     13 PHE  QD      5.50
 14 ILE  H      13 PHE  QD      5.00
 14 ILE  QG1    13 PHE  QD      5.50 #QG1
 14 ILE  H      13 PHE  HA      4.50
 14 ILE  H      13 PHE  HB2     4.50
 14 ILE  H      13 PHE  H       3.50
 14 ILE  H      13 PHE  HB3     4.50
 14 ILE  HB     15 ILE  H       4.00
 14 ILE  HA     17 LEU  QB      4.50
 14 ILE  HA     17 LEU  HG      5.00
 14 ILE  HA     17 LEU  QD1     4.50
 14 ILE  HA     17 LEU  QD2     4.50
 15 ILE  HG13   12 VAL  HA      4.50
 15 ILE  HB     12 VAL  HA      4.50
 15 ILE  H      14 ILE  QG2     4.50
 15 ILE  HB     16 GLY  H       4.50
 15 ILE  HA     16 GLY  H       3.50
 15 ILE  HG12   16 GLY  H       4.50
 15 ILE  HA     18 VAL  QG2     4.00
 15 ILE  HA     18 VAL  H       5.00
 15 ILE  HA     18 VAL  QG1     4.00
 15 ILE  HA     18 VAL  HB      5.50
 15 ILE  HA     19 VAL  H       5.50
 16 GLY  H      12 VAL  HA      5.50
 16 GLY  H      15 ILE  H       3.50
 16 GLY  H      17 LEU  HG      6.00
 16 GLY  H      17 LEU  HA      6.00
 16 GLY  H      18 VAL  H       5.50
 16 GLY  H      19 VAL  H       5.00
 17 LEU  H      14 ILE  QG2     4.50
 17 LEU  H      16 GLY  QA      4.00
 17 LEU  H      16 GLY  H       4.00
 17 LEU  HA     18 VAL  H       4.50
 17 LEU  H      18 VAL  QG2     5.50
 17 LEU  H      18 VAL  H       4.50
 18 VAL  H      17 LEU  QD1     4.50
 18 VAL  H      17 LEU  QD2     4.50
 18 VAL  H      17 LEU  HG      5.50
 18 VAL  H      17 LEU  QB      4.50
 18 VAL  HA     19 VAL  H       4.50
 18 VAL  HB     19 VAL  H       4.50
 19 VAL  H      16 GLY  QA      5.50
 19 VAL  H      18 VAL  H       3.50
 20 LEU  H      18 VAL  HA      5.50
 20 LEU  H      19 VAL  QG1     4.50
 20 LEU  H      19 VAL  HB      4.00
 20 LEU  H      19 VAL  QG2     4.50
 20 LEU  H      19 VAL  HA      3.50
 21 GLY  H      17 LEU  HA      5.50
 21 GLY  H      17 LEU  QD2     6.00
 21 GLY  H      19 VAL  QG1     6.00
 21 GLY  H      19 VAL  QG2     6.00
 21 GLY  HA3    20 LEU  HB3     6.00
 21 GLY  H      20 LEU  HB2     4.50
 21 GLY  H      20 LEU  H       3.50
 21 GLY  H      20 LEU  HB3     4.50
 21 GLY  H      20 LEU  HA      4.50
 21 GLY  H      23 GLN  H       5.50
 22 PRO  QD     21 GLY  QA      4.00
 22 PRO  QD     21 GLY  H       4.50
# 22 PRO  HD3    21 GLY  HA2     4.50 #comb_QD
# 22 PRO  QD     21 GLY  HA3     4.00 #comb_QA
# 22 PRO  HD3    21 GLY  HA3     5.50 #comb_QD
# 22 PRO  HD3    21 GLY  H       4.50 #comb_QD
 22 PRO  HA     23 GLN  H       5.50
 22 PRO  HD3    23 GLN  H       5.50
 22 PRO  HG2    23 GLN  H       4.50
 22 PRO  HG3    23 GLN  H       4.50
 22 PRO  HD3    24 ARG  H       6.01
 23 GLN  H      22 PRO  QB      4.50
 23 GLN  H      24 ARG  H       4.50
 23 GLN  HA     24 ARG  H       4.50
 24 ARG  H      22 PRO  QB      5.00
 24 ARG  H      23 GLN  QB      4.50
 24 ARG  H      27 VAL  QG1     6.00
 25 LEU  H      23 GLN  H       4.50
 25 LEU  HA     24 ARG  H       4.50
 25 LEU  HA     27 VAL  QG2     6.50
 25 LEU  HA     28 ALA  H       4.50
 26 PRO  HA     29 VAL  QG1     5.50
 26 PRO  HA     29 VAL  QG2     4.00
 26 PRO  HA     29 VAL  H       5.50
 27 VAL  H      25 LEU  HA      5.50
 27 VAL  H      26 PRO  HA      3.50
 27 VAL  H      26 PRO  QD      5.00
 27 VAL  HB     26 PRO  QD      5.50
 27 VAL  H      26 PRO  QB      4.50
 27 VAL  H      26 PRO  HG3     5.50
 27 VAL  HB     28 ALA  H       4.50
 27 VAL  H      28 ALA  H       4.50
 27 VAL  HA     30 LYS  QB      4.50
 28 ALA  H      27 VAL  QG1     4.50
 28 ALA  H      27 VAL  HA      5.50
 29 VAL  H      25 LEU  HA      5.50 #ov_0mir
 29 VAL  H      27 VAL  HA      5.01
 29 VAL  H      28 ALA  QB      4.01
 29 VAL  H      28 ALA  H       4.00
 29 VAL  HA     30 LYS  H       4.50
 29 VAL  HA     30 LYS  QB      5.50
 29 VAL  H      30 LYS  H       3.50
 29 VAL  H      31 THR  H       4.50
 29 VAL  HA     32 VAL  H       4.00
 29 VAL  HA     32 VAL  HB      4.50
 29 VAL  HA     33 ALA  H       5.50
 30 LYS  HG2    27 VAL  HA      5.50
 30 LYS  HG3    27 VAL  HA      5.50
 30 LYS  H      29 VAL  QG2     4.50
 30 LYS  HG2    31 THR  H       4.50
 31 THR  HB     28 ALA  QB      5.50
 31 THR  H      30 LYS  QB      4.50
 31 THR  HA     32 VAL  H       3.50
 31 THR  HA     34 GLY  H       4.00
 32 VAL  HA     33 ALA  H       4.00
 32 VAL  HB     33 ALA  H       4.00
 32 VAL  H      33 ALA  H       3.50
 32 VAL  HB     34 GLY  H       6.50
 32 VAL  HA     35 TRP  H       4.50
 33 ALA  H      30 LYS  HA      5.00
 33 ALA  H      31 THR  H       4.50
 33 ALA  H      32 VAL  QG1     4.50
 33 ALA  HA     34 GLY  H       3.50
 33 ALA  H      34 GLY  H       3.50
 33 ALA  HA     36 ILE  HA      6.01
 33 ALA  HA     36 ILE  HB      4.00
 34 GLY  H      33 ALA  QB      4.00
 35 TRP  H      32 VAL  HB      6.01
 35 TRP  H      34 GLY  HA2     4.50
 35 TRP  H      34 GLY  HA3     4.50
 35 TRP  H      34 GLY  H       3.50
 35 TRP  H      36 ILE  HA      5.50
 35 TRP  H      36 ILE  HB      5.50
 35 TRP  H      37 ARG  H       5.50
 35 TRP  HA     38 ALA  H       4.50
# 36 ILE  HG13   33 ALA  HA      5.00 #comb_QG
 36 ILE  QG1    33 ALA  HA      5.50
 36 ILE  HB     33 ALA  QB      5.01
 36 ILE  H      33 ALA  HA      4.50
 36 ILE  HB     37 ARG  H       4.50
 37 ARG  HE     33 ALA  QB      6.00
 37 ARG  QB     34 GLY  QA      5.00 #QA
 37 ARG  H      36 ILE  QD1     4.50
 37 ARG  QB     38 ALA  H       4.50
 37 ARG  H      38 ALA  H       4.50
 37 ARG  HA     38 ALA  H       3.50
 37 ARG  HA     41 SER  H       5.00
 38 ALA  H      34 GLY  HA2     5.50
 38 ALA  H      36 ILE  HA      5.50
 38 ALA  H      37 ARG  QG      4.50 #QG
 38 ALA  H      39 LEU  QQD     4.50
 39 LEU  HB2    36 ILE  HA      5.50
 39 LEU  HB3    36 ILE  HA      4.50
 39 LEU  H      36 ILE  HA      5.50
 39 LEU  H      38 ALA  QB      4.50
 40 ARG  H      37 ARG  QD      5.00
 40 ARG  H      39 LEU  QQD     4.50
 40 ARG  H      41 SER  H       4.50
 40 ARG  H      42 LEU  H       4.50
 40 ARG  HA     43 ALA  QB      4.50
 40 ARG  HG3    44 THR  HB      6.00
 41 SER  H      40 ARG  HA      3.50
 41 SER  HA     42 LEU  H       3.50
 41 SER  QB     44 THR  QG2     5.50
 42 LEU  H      39 LEU  HB2     5.50
 42 LEU  H      39 LEU  HA      4.50
 42 LEU  H      41 SER  H       3.50
 42 LEU  H      41 SER  QB      4.50
 42 LEU  QQD    43 ALA  H       4.50
 42 LEU  H      43 ALA  QB      5.50
 42 LEU  H      44 THR  H       4.50
 42 LEU  QQD    45 THR  HB      5.50
 42 LEU  HA     45 THR  QG2     4.50
 43 ALA  H      40 ARG  HA      4.50
 43 ALA  H      41 SER  HA      4.50
 43 ALA  H      41 SER  H       4.50
 43 ALA  H      42 LEU  QB      4.50
 43 ALA  H      42 LEU  H       4.50
 43 ALA  H      42 LEU  HA      4.50
 43 ALA  HA     44 THR  H       4.00
 43 ALA  H      44 THR  H       3.50
 43 ALA  HA     46 VAL  HB      5.01
 44 THR  H      40 ARG  HA      5.01
 44 THR  HB     43 ALA  QB      5.50
 44 THR  H      43 ALA  QB      4.00
 44 THR  H      46 VAL  QG1     5.50
 45 THR  H      42 LEU  H       5.01
 45 THR  H      42 LEU  HA      4.50
 45 THR  H      44 THR  HB      4.00
 45 THR  H      44 THR  HA      4.50
 45 THR  HB     46 VAL  H       5.00
 45 THR  HA     46 VAL  H       4.00
 45 THR  HA     46 VAL  QG2     6.00
 45 THR  H      46 VAL  H       4.50
 45 THR  H      46 VAL  QG2     5.50
 45 THR  H      47 GLN  H       4.50
 45 THR  HB     48 ASN  H       6.00
 45 THR  HA     48 ASN  H       5.00
 45 THR  H      48 ASN  H       5.50
 46 VAL  H      43 ALA  HA      5.00
 46 VAL  HA     45 THR  HB      6.00
 46 VAL  H      45 THR  QG2     4.50
 46 VAL  HA     45 THR  QG2     5.50
 46 VAL  HA     47 GLN  H       4.00
 46 VAL  H      47 GLN  H       4.00
 46 VAL  HA     48 ASN  H       6.00
 46 VAL  H      48 ASN  H       4.50
 47 GLN  HA     46 VAL  QQG     5.51
# 47 GLN  HA     46 VAL  QG2     5.52 comb_QQG
 47 GLN  H      46 VAL  QG2     4.50
 47 GLN  HA     46 VAL  HB      6.01
 47 GLN  H      46 VAL  QG1     4.50
 47 GLN  QB     48 ASN  H       4.00 #pull
 47 GLN  HA     48 ASN  H       4.00
 47 GLN  QG     48 ASN  H       4.50
 48 ASN  HA     47 GLN  HG2     6.51
# 48 ASN  H      47 GLN  HG2     4.50 #com_QG
 48 ASN  HA     49 GLU  HB2     6.00
 48 ASN  HB3    49 GLU  H       4.50
 48 ASN  HB2    49 GLU  H       4.50
 48 ASN  HA     51 THR  QG2     4.50
 48 ASN  HA     52 GLN  HE21    5.50
 49 GLU  H      48 ASN  HA      4.50
 50 LEU  H      49 GLU  QB      3.50 #comb_QB
 50 LEU  H      51 THR  H       3.50
 50 LEU  HA     51 THR  H       4.00
 51 THR  HB     48 ASN  HA      5.50
 51 THR  HA     50 LEU  HA      5.50
 51 THR  H      50 LEU  QB      4.50
 51 THR  HA     52 GLN  H       4.50
 51 THR  HA     52 GLN  QG      6.00 #QG
 51 THR  HB     52 GLN  QG      5.50 #QG
 51 THR  HB     52 GLN  H       4.50
 51 THR  HA     53 GLU  H       5.50
 73 ASN  H      71 LEU  H       4.50
 52 GLN  HA     51 THR  QG2     5.50
 52 GLN  QG     51 THR  QG2     5.50 #QG
 52 GLN  H      51 THR  H       4.50
 52 GLN  H      51 THR  QG2     4.50
 52 GLN  HE21   51 THR  QG2     5.50
 52 GLN  H      53 GLU  QG      5.50 
 52 GLN  H      53 GLU  H       3.50
 52 GLN  H      53 GLU  QB      4.50
 52 GLN  HA     53 GLU  H       3.50
 55 LYS  H      54 LEU  QB      4.50 #QB
 53 GLU  H      52 GLN  QG      5.00 #QG
 53 GLU  H      54 LEU  H       3.50
 54 LEU  H      52 GLN  QB      5.50
 54 LEU  H      53 GLU  QG      5.50
 54 LEU  H      53 GLU  QB      4.50
 54 LEU  HG     55 LYS  H       6.01
 55 LYS  H      53 GLU  QG      5.50
 55 LYS  H      54 LEU  HA      3.50
 55 LYS  H      54 LEU  QQD     4.50
 55 LYS  HA     54 LEU  H       5.50
 55 LYS  H      54 LEU  H       3.50
 55 LYS  H      54 LEU  HB2     4.50
 55 LYS  H      56 LEU  H       3.50
# 55 LYS  HG3    56 LEU  H       5.00 #comb_QG
 55 LYS  QG     56 LEU  H       4.50
 56 LEU  H      55 LYS  HA      3.50
 56 LEU  HA     57 GLN  H       3.50
 56 LEU  HB2    60 GLN  HE21    6.50
 57 GLN  H      55 LYS  HG3     6.00
 57 GLN  H      56 LEU  HG      4.50
 60 GLN  HE22   56 LEU  HB2     6.50
 60 GLN  HE21   56 LEU  QD1     6.50
 60 GLN  HA     59 PHE  QD      6.01
 60 GLN  H      59 PHE  QD      4.50
 60 GLN  QG     61 ASP  H       5.50
# 60 GLN  HG3    61 ASP  H       5.50 #comb_QG
 60 GLN  HA     61 ASP  H       4.50
 60 GLN  H      61 ASP  H       3.50
 60 GLN  HA     63 LEU  QD2     5.51
 60 GLN  H      63 LEU  QD1     6.01
 60 GLN  HA     63 LEU  QD1     5.00
 60 GLN  QE2    63 LEU  QD1     6.00 
# 60 GLN  HE22   63 LEU  QD1     6.00 #comb_QE2
# 61 ASP  HB3    58 GLU  HA      5.50 #comb_QB
 61 ASP  QB     58 GLU  HA      4.50
 61 ASP  H      58 GLU  QG      5.50
 61 ASP  HB2    60 GLN  HA      6.00
 61 ASP  H      60 GLN  HB2     4.50
 60 GLN  HB3    61 ASP  H       0.00
 61 ASP  HB2    62 SER  HA      6.00
 61 ASP  HA     62 SER  H       5.50
 61 ASP  H      62 SER  HB3     6.00
 61 ASP  HB2    62 SER  H       4.50
 61 ASP  HB3    62 SER  H       4.50
 61 ASP  HA     64 LYS  H       4.50
 61 ASP  HA     64 LYS  QG      4.50
 62 SER  H      60 GLN  HA      5.50
 62 SER  H      60 GLN  H       4.50
 62 SER  H      61 ASP  H       3.50
 62 SER  H      63 LEU  QD1     6.00
 62 SER  HA     63 LEU  HB2     6.00 #ov
# 63 LEU  HB3    59 PHE  QD      6.00 #comb_QB
 63 LEU  QB     59 PHE  QD      6.00
 63 LEU  HG     59 PHE  QD      5.50
 63 LEU  H      59 PHE  QD      6.00
 63 LEU  H      60 GLN  HA      4.50
 63 LEU  HG     60 GLN  HA      5.01 
 63 LEU  H      61 ASP  H       5.00
 63 LEU  HB2    62 SER  HB2     6.00
 63 LEU  HG     62 SER  HB3     5.50
 63 LEU  H      62 SER  HA      3.50
 63 LEU  H      62 SER  HB2     4.50
 63 LEU  HG     66 VAL  QG1     5.01
 63 LEU  QD2    66 VAL  QG1     5.00
 63 LEU  H      66 VAL  HB      6.00
 63 LEU  H      66 VAL  QG1     6.00
 63 LEU  HA     66 VAL  H       4.50
 64 LYS  H      60 GLN  HA      5.50
 64 LYS  H      61 ASP  H       5.50
 64 LYS  H      62 SER  HA      6.00
 64 LYS  H      62 SER  H       4.50
 64 LYS  H      63 LEU  HA      3.50
 64 LYS  H      63 LEU  HB2     4.50
 64 LYS  H      63 LEU  HB3     5.50
 64 LYS  H      63 LEU  HG      5.00
 64 LYS  H      63 LEU  QD2     5.01
 64 LYS  H      63 LEU  QD1     5.50
 64 LYS  H      63 LEU  H       3.50
 64 LYS  HA     66 VAL  H       4.50
 64 LYS  H      67 GLU  H       5.50
 65 LYS  H      61 ASP  HA      5.50
# 65 LYS  HB3    62 SER  HA      5.00 #comb_QB
 65 LYS  QB     62 SER  HA      5.00
 65 LYS  H      62 SER  HB2     5.50
 65 LYS  H      62 SER  HA      4.50
 65 LYS  H      63 LEU  H       5.00
 65 LYS  H      63 LEU  QD2     6.50
 65 LYS  H      63 LEU  HA      5.00
 65 LYS  H      64 LYS  QG      5.50
 65 LYS  H      64 LYS  QE      5.50
 65 LYS  H      64 LYS  QD      4.50
 65 LYS  H      64 LYS  H       4.50
 65 LYS  H      64 LYS  HA      4.50
 65 LYS  HA     66 VAL  H       4.00
 65 LYS  H      66 VAL  H       3.50
 65 LYS  H      66 VAL  QG2     6.01
 65 LYS  H      66 VAL  QG1     5.01
 65 LYS  H      67 GLU  H       5.50
 65 LYS  HA     68 LYS  QG     5.01
# 65 LYS  HA     68 LYS  HG3     5.01 #comb_QG
 65 LYS  HA     68 LYS  H       4.50
 65 LYS  H      68 LYS  H       5.01
 65 LYS  HA     69 ALA  QB      4.50
 66 VAL  H      65 LYS  QE      4.50
 66 VAL  HA     67 GLU  H       3.50
 66 VAL  HA     69 ALA  H       4.50
 66 VAL  HA     69 ALA  HA      5.50
 66 VAL  HB     69 ALA  QB      6.00
 66 VAL  HA     69 ALA  QB      4.50
 67 GLU  HG3    63 LEU  QD1     5.50
 67 GLU  HG2    63 LEU  QD2     5.50
 67 GLU  H      63 LEU  HA      5.50
# 67 GLU  HG3    66 VAL  QG2     5.50 #comb_QG
 67 GLU  H      66 VAL  HB      4.00
 67 GLU  HA     66 VAL  QG2     4.50
 67 GLU  QG     66 VAL  QG2     5.50
 67 GLU  QG     66 VAL  H       6.00 #QG
 67 GLU  H      66 VAL  H       3.50
# 67 GLU  H      66 VAL  QG2     4.50 #comb_QQG
 67 GLU  H      66 VAL  QQG     4.00
 67 GLU  HA     68 LYS  H       3.50
 67 GLU  QG     68 LYS  H       5.00 #QG
 67 GLU  HG3    70 SER  HB2     6.00
 67 GLU  HA     71 LEU  QD2     5.01
 67 GLU  HG3    71 LEU  QD1     6.01
 68 LYS  H      65 LYS  QE      5.51
 68 LYS  H      66 VAL  HA      4.50
 68 LYS  HG3    67 GLU  HB2     5.50
 68 LYS  H      67 GLU  HB2     4.50
 68 LYS  H      67 GLU  H       3.50
 68 LYS  HG2    69 ALA  H       4.50
 68 LYS  HA     69 ALA  H       3.50
 68 LYS  QB     69 ALA  H       4.01
 68 LYS  HA     71 LEU  H       4.50
 69 ALA  H      65 LYS  QE      5.50
 69 ALA  H      66 VAL  H       5.00
# 69 ALA  H      70 SER  HB3     6.00 #del_ov
 69 ALA  H      70 SER  H       2.80
 69 ALA  HA     72 THR  H       5.00
 69 ALA  HA     73 ASN  QD2     6.00 #QD2
 70 SER  H      68 LYS  QB      6.00
# 70 SER  HB3    69 ALA  QB      5.50 #comb_QB
 70 SER  QB     69 ALA  QB      5.50 
 70 SER  HA     72 THR  QG2     6.00
 70 SER  H      72 THR  QG2     5.50
 70 SER  HA     72 THR  H       4.50
 70 SER  H      72 THR  H       5.50
# 70 SER  HB3    74 LEU  HG      5.50 #comb_QB
# 70 SER  HB3    74 LEU  QD2     5.50 #comb_QB
 70 SER  QB     74 LEU  HG      5.00
 70 SER  HB3    74 LEU  QD1     4.50
 70 SER  QB     74 LEU  QD2     5.50
 70 SER  HA     74 LEU  HG      5.00
 71 LEU  H      67 GLU  HB2     6.01
 71 LEU  H      69 ALA  HA      6.00
 71 LEU  H      70 SER  HB3     4.50
 71 LEU  H      70 SER  HB2     4.50
 71 LEU  H      70 SER  HA      3.50
 71 LEU  H      70 SER  H       3.50
 71 LEU  H      72 THR  HB      6.51
 71 LEU  H      72 THR  HA      6.00
 71 LEU  H      72 THR  QG2     5.50
 71 LEU  H      72 THR  H       3.50
 71 LEU  HB3    72 THR  H       4.50
 71 LEU  QD2    72 THR  H       5.51
 72 THR  H      69 ALA  QB      5.50
 72 THR  H      71 LEU  QD1     5.50
 72 THR  H      74 LEU  QD2     5.01
 73 ASN  QD2    69 ALA  HA      6.50 #QD2_ov72hb
 73 ASN  QD2    69 ALA  QB      6.50
# 73 ASN  HD22   69 ALA  QB      6.50 #comb_QD2
 73 ASN  H      71 LEU  HA      5.50
 73 ASN  H      71 LEU  QD1     6.51
 73 ASN  H      72 THR  HB      4.50
 73 ASN  QD2    72 THR  HB      5.50 #QD2_ov
 73 ASN  QB     72 THR  HB      6.00
 73 ASN  QB     72 THR  QG2     6.50
 73 ASN  H      72 THR  HA      4.50
 73 ASN  H      72 THR  QG2     4.50
 73 ASN  HA     72 THR  QG2     5.50
 73 ASN  HA     72 THR  HA      6.00
 73 ASN  H      72 THR  H       3.50
# 73 ASN  HD22   72 THR  QG2     6.01 #comb_QD2
 73 ASN  QD2    72 THR  QG2     6.50 
 73 ASN  HA     72 THR  H       5.50
 73 ASN  QB     74 LEU  HA      6.00
 73 ASN  HB3    74 LEU  H       5.00
 73 ASN  HB2    74 LEU  H       4.50
 73 ASN  QB     74 LEU  QQD     4.50
 73 ASN  H      74 LEU  HB2     5.50
 73 ASN  H      74 LEU  HB3     6.00
 73 ASN  H      74 LEU  H       3.50
 73 ASN  HA     74 LEU  H       3.50
 73 ASN  HD21   74 LEU  QD1     6.50
 73 ASN  HA     75 THR  H       5.50
 74 LEU  H      71 LEU  HA      4.50
 74 LEU  H      72 THR  QG2     5.50
 74 LEU  HA     75 THR  H       3.50
 74 LEU  HB2    75 THR  H       4.50
 74 LEU  HB3    75 THR  H       4.50
 74 LEU  H      75 THR  QG2     5.50
 74 LEU  HA     75 THR  QG2     5.01
 75 THR  H      71 LEU  HA      5.50
 75 THR  H      74 LEU  QD2     5.50
 75 THR  H      78 LEU  QD2     5.01
 75 THR  H      78 LEU  H       5.50
 75 THR  H      79 LYS  QG      6.00
# 76 PRO  HD3    75 THR  HA      4.50 #comb_QD
 76 PRO  QD     75 THR  QG2     4.00
# 76 PRO  HD3    75 THR  HB      5.00 #comb_QD
# 76 PRO  HG3    75 THR  HA      5.50 #comb_QG
# 76 PRO  HD3    75 THR  QG2     4.50 #comb_QD
 76 PRO  QD     75 THR  HB      5.00 
 76 PRO  QG     75 THR  HA      4.50
 76 PRO  QD     75 THR  HA      4.00
 76 PRO  HA     77 GLU  H       4.50
 76 PRO  HB2    77 GLU  H       4.50
 76 PRO  HB3    77 GLU  H       4.50
 76 PRO  HA     79 LYS  H       5.50
 76 PRO  HA     79 LYS  QG      5.50
 76 PRO  HA     79 LYS  HB3     4.50
 76 PRO  HA     80 ALA  H       6.00
 77 GLU  H      75 THR  QG2     5.50
 77 GLU  H      75 THR  HA      5.50
 77 GLU  H      76 PRO  QD      4.50 
 77 GLU  HA     76 PRO  HB2     4.50
# 77 GLU  H      76 PRO  HD3     4.50 #comb_QD
 77 GLU  HG2    78 LEU  H       5.50
 77 GLU  HA     78 LEU  H       5.50
 77 GLU  HG3    78 LEU  H       5.50
 77 GLU  H      78 LEU  H       4.50
 77 GLU  HA     79 LYS  H       5.50
 77 GLU  HA     80 ALA  H       5.50
 77 GLU  HG2    80 ALA  QB      5.50
 77 GLU  HA     80 ALA  QB      4.50
 78 LEU  H      75 THR  QG2     5.50
 78 LEU  HG     75 THR  QG2     6.01
 78 LEU  H      77 GLU  HB3     4.50
 78 LEU  HA     79 LYS  H       3.50
 78 LEU  HA     79 LYS  HA      5.50
 78 LEU  HA     81 SER  HB3     5.50
 78 LEU  HA     81 SER  H       4.00
 78 LEU  QD1    82 MET  QE      5.50
 79 LYS  H      75 THR  H       5.50
 79 LYS  H      77 GLU  H       5.50
 79 LYS  HA     78 LEU  QD2     6.00
 79 LYS  H      78 LEU  QD1     4.50
 79 LYS  H      78 LEU  QD2     4.50
 79 LYS  H      78 LEU  HG      5.50
 79 LYS  H      78 LEU  H       3.50
 79 LYS  H      78 LEU  QB      4.00
 79 LYS  H      80 ALA  HA      5.50
 79 LYS  QB     80 ALA  H       4.00 #comb_QB
 79 LYS  H      80 ALA  H       3.50
# 79 LYS  HB3    80 ALA  H       4.50
 79 LYS  HA     81 SER  H       5.50
 79 LYS  H      82 MET  QG      6.01
# 79 LYS  H      82 MET  HG3     6.01 #comb_QG
 80 ALA  H      79 LYS  HA      3.50
 80 ALA  H      79 LYS  QD      6.00
 80 ALA  H      79 LYS  QG      5.50
 80 ALA  HA     81 SER  H       4.50
 80 ALA  H      81 SER  H       3.50
 81 SER  HA     78 LEU  QD1     6.00
 81 SER  HB3    78 LEU  QD1     5.50
 81 SER  H      78 LEU  QD1     6.00
 81 SER  HA     80 ALA  QB      5.50
 81 SER  H      80 ALA  QB      4.50
 81 SER  HA     82 MET  H       4.00
 81 SER  H      82 MET  QE      6.00
 81 SER  HA     82 MET  QE      6.50
 81 SER  HB3    82 MET  H       4.50
 81 SER  HB2    82 MET  H       4.50
 81 SER  HA     84 GLU  HG3     5.50
 81 SER  HA     84 GLU  HG2     5.50
 82 MET  QG     78 LEU  QD1     4.50 #comb_QG
# 82 MET  HG3    78 LEU  QD1     4.50
 82 MET  HG3    78 LEU  QD2     6.00
 82 MET  H      78 LEU  QD1     4.50
 82 MET  QG     79 LYS  HA      5.00
# 82 MET  HG3    79 LYS  HA      5.50 #comb_QG
 82 MET  HB3    79 LYS  HA      5.50
 82 MET  H      79 LYS  HA      4.50
 82 MET  H      81 SER  H       3.50
 82 MET  HG3    83 ASP  H       5.50
 82 MET  HA     83 ASP  H       4.50
 82 MET  H      83 ASP  HB2     5.50
 82 MET  HA     85 LEU  HB3     4.50
 82 MET  HA     85 LEU  QQD     4.50
 82 MET  HG3    85 LEU  QQD     5.50
 82 MET  HG2    85 LEU  QQD     4.50
 82 MET  HA     86 ARG  H       4.50
 83 ASP  H      79 LYS  HA      5.50
 83 ASP  QB     80 ALA  HA      4.50
# 83 ASP  HB3    80 ALA  HA      5.50 #comb_QB
 83 ASP  H      80 ALA  HA      4.50
 83 ASP  QB     80 ALA  QB      6.00
# 83 ASP  HB3    80 ALA  QB      5.50 #comb_QB
 83 ASP  H      80 ALA  QB      5.00
 83 ASP  H      82 MET  HB3     4.50
 83 ASP  H      82 MET  HB2     4.50
 83 ASP  HA     82 MET  H       5.50
 83 ASP  HA     85 LEU  H       4.50
 83 ASP  HA     86 ARG  HA      6.00
 83 ASP  HA     86 ARG  HG3     6.00
 83 ASP  HA     86 ARG  HG2     5.50
 83 ASP  H      86 ARG  QD      5.50
 83 ASP  HA     86 ARG  HE      5.50
 83 ASP  HA     86 ARG  H       4.50
 83 ASP  HA     87 GLN  H       5.50
 84 GLU  HG3    80 ALA  QB      5.50
 84 GLU  HG2    80 ALA  QB      5.50
 84 GLU  H      80 ALA  QB      5.01
 84 GLU  HB2    81 SER  HA      5.00
 84 GLU  HB3    81 SER  HA      5.00
 84 GLU  HB2    81 SER  HB3     6.00
 84 GLU  H      81 SER  HA      4.50
 84 GLU  H      82 MET  QE      6.52
 84 GLU  H      83 ASP  HB2     4.50
 84 GLU  HA     83 ASP  HB3     5.50
 84 GLU  HG3    83 ASP  H       5.50
 84 GLU  HG2    83 ASP  H       6.00
 84 GLU  H      83 ASP  H       3.50
 84 GLU  H      83 ASP  HB3     4.50
 84 GLU  HB2    85 LEU  H       5.00
 84 GLU  HG3    85 LEU  QQD     5.50
 84 GLU  HA     85 LEU  H       4.50
 84 GLU  HG2    85 LEU  QQD     5.50
 84 GLU  H      85 LEU  H       3.50
 84 GLU  H      85 LEU  HB2     4.50
 84 GLU  HA     86 ARG  H       5.50
 84 GLU  HA     87 GLN  HE21    6.00
 84 GLU  HA     87 GLN  H       4.50
 85 LEU  H      82 MET  HB2     5.50
 85 LEU  H      84 GLU  HG3     5.50
 85 LEU  H      84 GLU  HG2     5.50
 85 LEU  HA     86 ARG  H       4.50
 85 LEU  HB2    86 ARG  H       4.50
 85 LEU  H      86 ARG  H       3.50
 85 LEU  HB3    86 ARG  H       4.50
 85 LEU  HA     88 ALA  QB      4.50
 85 LEU  HB3    89 ALA  H       5.50
 86 ARG  HB2    83 ASP  HA      4.50
 86 ARG  QB     83 ASP  HB2     5.50
# 86 ARG  HB2    83 ASP  HB3     5.50 #comb_QB
 86 ARG  HB3    83 ASP  HA      4.50
 86 ARG  H      85 LEU  QQD     4.50
 86 ARG  HG3    86 ARG  H       5.50
 86 ARG  HG3    87 GLN  H       5.50
 86 ARG  HG2    87 GLN  H       5.50
 86 ARG  HA     87 GLN  H       4.50
 86 ARG  HA     88 ALA  H       4.50
 86 ARG  HA     89 ALA  QB      4.50
 86 ARG  HG2    90 GLU  HG3     5.50
 86 ARG  HG3    90 GLU  HG3     5.50
 86 ARG  HG3    90 GLU  HG2     5.50
 86 ARG  HA     90 GLU  HG2     5.50
 86 ARG  HA     90 GLU  HG3     5.50
 86 ARG  HA     90 GLU  H       4.50
 86 ARG  HG3    90 GLU  H       4.50
 87 GLN  HE21   83 ASP  HB3     5.50
 87 GLN  HG2    84 GLU  HA      5.01
 87 GLN  H      86 ARG  QD      5.50
 87 GLN  HG2    86 ARG  H       5.50
 87 GLN  HG3    86 ARG  H       5.50
 87 GLN  H      86 ARG  H       3.50
 87 GLN  HG2    88 ALA  H       4.50
 87 GLN  HG3    88 ALA  H       4.50
 87 GLN  QB     88 ALA  H       4.50
 87 GLN  H      88 ALA  QB      4.50
 87 GLN  HA     88 ALA  H       3.50
 87 GLN  HA     90 GLU  H       3.50
 87 GLN  HA     91 SER  H       3.50
 89 ALA  H      88 ALA  QB      4.50
 89 ALA  H      88 ALA  HA      4.50
 89 ALA  H      88 ALA  H       3.50
 89 ALA  HA     90 GLU  H       4.50
 89 ALA  HA     91 SER  H       5.50
 89 ALA  H      91 SER  H       4.50
# 89 ALA  HA     92 MET  HG3     6.50 #comb_QG
 89 ALA  HA     92 MET  QE      4.50
 89 ALA  H      92 MET  QE      5.50
 89 ALA  HA     92 MET  QG      6.50
 90 GLU  H      87 GLN  H       4.50
 90 GLU  HA     89 ALA  QB      4.50
 90 GLU  HG3    89 ALA  QB      5.00
 90 GLU  HG2    89 ALA  QB      5.00
 90 GLU  H      89 ALA  QB      4.50
 90 GLU  H      89 ALA  H       3.50
 90 GLU  HG3    91 SER  H       5.00
 90 GLU  HG2    91 SER  H       5.00
 90 GLU  QB     91 SER  H       4.50
 90 GLU  H      91 SER  H       3.50
 91 SER  QB     87 GLN  HG2     6.00
 91 SER  H      88 ALA  HA      4.00
 91 SER  HA     90 GLU  QB      5.50
 91 SER  QB     92 MET  HG3     6.00
 91 SER  HA     92 MET  HB3     6.50
 91 SER  HA     93 LYS  H       4.50
# 92 MET  HG3    89 ALA  QB      6.01 #comb_QG
 92 MET  QG     89 ALA  QB      6.52
 92 MET  HB2    89 ALA  HA      5.00
 92 MET  HB3    89 ALA  HA      5.50
 92 MET  HA     93 LYS  H       3.50
 92 MET  HB2    93 LYS  H       4.50
 92 MET  HA     95 SER  QB      5.50 #QB
 92 MET  HA     95 SER  H       3.50
# 93 LYS  HB3    90 GLU  HA      4.50 #comb_QB
 93 LYS  QB     90 GLU  HA      4.50
 93 LYS  H      92 MET  QE      5.50
 93 LYS  HA     94 ARG  H       4.00
 93 LYS  HA     95 SER  H       4.50
 93 LYS  H      95 SER  H       4.50
# 93 LYS  HA     96 TYR  HB3     5.50 #comb_QB
 93 LYS  HA     96 TYR  QB      4.50
 93 LYS  HG3    97 VAL  HB      5.50
 93 LYS  HG3    97 VAL  QG2     4.51
 94 ARG  QB     91 SER  HA      4.50
 94 ARG  H      91 SER  HA      5.50
 94 ARG  H      92 MET  HA      4.50
# 94 ARG  H      93 LYS  HB3     4.00 #comb_QB
 94 ARG  H      93 LYS  HG2     5.50
 94 ARG  H      93 LYS  QE      5.50
 94 ARG  H      93 LYS  QB      4.00
 94 ARG  H      93 LYS  H       3.50
 94 ARG  QB     95 SER  QB      6.00 #comb_QB
 94 ARG  HG2    95 SER  H       5.50
 94 ARG  QB     95 SER  H       4.50
 94 ARG  HA     95 SER  H       3.50
 94 ARG  H      95 SER  H       3.50
 94 ARG  HG3    95 SER  H       4.50
# 94 ARG  HA     97 VAL  QG2     4.50 #comb_QG
 94 ARG  HA     97 VAL  QQG     5.00
 94 ARG  HA     97 VAL  HB      5.50
 94 ARG  H      97 VAL  QG2     4.50
# 95 SER  HB3    96 TYR  QD      6.00 #comb_QB
 95 SER  QB     96 TYR  QD      5.50
 95 SER  QB     98 ALA  QB      6.50 #QB
 95 SER  HA     98 ALA  QB      5.00
 96 TYR  QD     92 MET  QE      5.50
 96 TYR  HB2    95 SER  QB      6.00 #comb_QB
 96 TYR  H      95 SER  HA      4.50
 96 TYR  H      95 SER  HB2     4.50
 96 TYR  H      95 SER  HB3     4.50
 96 TYR  HA     95 SER  H       5.50
 96 TYR  QE     97 VAL  QG2     6.00
 96 TYR  QE     97 VAL  QG1     6.00
 96 TYR  HB3    97 VAL  HA      6.00
 96 TYR  HB2    97 VAL  HA      6.00
 96 TYR  HA     97 VAL  QG2     6.50
# 96 TYR  HB3    97 VAL  QG2     6.50 #QB_QQG
 96 TYR  QB     97 VAL  QQG     5.00
 96 TYR  QD     97 VAL  QG1     5.00
 96 TYR  HB3    97 VAL  H       4.50
 96 TYR  H      97 VAL  QG1     5.50
 96 TYR  HB2    97 VAL  H       4.50
 96 TYR  HA     97 VAL  H       3.50
 96 TYR  H      97 VAL  H       3.50
# 96 TYR  QE     98 ALA  QB      6.51 #del_w_ov_99.ne
 96 TYR  HA     98 ALA  H       6.00
# 96 TYR  HA     99 ASN  HB3     5.50 #comb_QB
 96 TYR  HA     99 ASN  QB      6.00 
 96 TYR  HA    100 ASP  H       5.50
 96 TYR  H     100 ASP  H       6.50
 96 TYR  H     102 LEU  QD1     6.01
 96 TYR  QD    102 LEU  QD1     6.00
 97 VAL  H      94 ARG  HA      4.50
 97 VAL  H      96 TYR  QD      4.50
 97 VAL  HA     96 TYR  QE      6.00
 97 VAL  H      96 TYR  QE      6.00
 97 VAL  HA     96 TYR  QD      4.50
 97 VAL  H      98 ALA  QB      5.50
 97 VAL  HA     98 ALA  QB      5.00
 97 VAL  HB     98 ALA  QB      5.50
 97 VAL  QG2    98 ALA  QB      5.50
 97 VAL  HA    100 ASP  H       5.50
 97 VAL  H     100 ASP  H       6.50
# 98 ALA  HA     96 TYR  QD      6.50 #del_w
# 98 ALA  HA     96 TYR  QE      6.50 #del_w
 98 ALA  HA     97 VAL  HB      6.00
 98 ALA  H      97 VAL  HB      4.50
 98 ALA  H      97 VAL  QG1     4.50
 98 ALA  H      97 VAL  HA      3.50
 98 ALA  H      99 ASN  HA      5.50
 98 ALA  HA    100 ASP  H       5.50
 99 ASN  H      96 TYR  QD      5.50
 99 ASN  H      97 VAL  H       5.50
 99 ASN  HB3    98 ALA  QB      5.50
 99 ASN  HB2    98 ALA  QB      6.00
 99 ASN  HA     98 ALA  QB      5.50
 99 ASN  H      98 ALA  QB      4.50
 99 ASN  H      98 ALA  H       3.50
 99 ASN  H      98 ALA  HA      3.50
 99 ASN  HB3   100 ASP  H       5.50
 99 ASN  HB2   100 ASP  H       5.50
100 ASP  H      98 ALA  QB      5.50
101 PRO  QD     98 ALA  QB      6.00
101 PRO  QD     98 ALA  H       6.00
101 PRO  QD     99 ASN  HB3     6.00
101 PRO  QD     99 ASN  HB2     6.00
101 PRO  QD    100 ASP  HA      3.50
101 PRO  QG    100 ASP  HA      5.50 #QG
#101 PRO  HG3   100 ASP  HA      5.50
101 PRO  QD    100 ASP  H       4.50
101 PRO  QD    102 LEU  H       4.50
101 PRO  HG2   102 LEU  H       5.00
101 PRO  HG2   102 LEU  HG      5.50
101 PRO  HA    102 LEU  HG      6.00
101 PRO  HB2   102 LEU  H       4.50
101 PRO  QD    103 GLU  H       6.00
102 LEU  H     100 ASP  HA      4.50
102 LEU  H     101 PRO  HA      3.50
102 LEU  HA    103 GLU  QB      5.50
102 LEU  H     103 GLU  HA      5.50
#103 GLU  H      93 LYS  QE      5.50 #del
#103 GLU  H      96 TYR  QD      5.50 #del_NOmir
103 GLU  H     100 ASP  QB      5.50
103 GLU  H     100 ASP  H       5.50
103 GLU  H     102 LEU  HA      4.50
103 GLU  QB    102 LEU  HG      4.50
103 GLU  HG3   102 LEU  HA      5.50
103 GLU  H     102 LEU  HB3     5.50
103 GLU  H     102 LEU  QD1     4.50
103 GLU  H     102 LEU  HB2     4.50
103 GLU  H     102 LEU  H       3.50
103 GLU  H     102 LEU  QD2     4.50
 20 LEU  QD2    25 LEU  QB      5.00
 48 ASN  HB2    47 GLN  QB      5.50
 79 LYS  HA     78 LEU  QB      5.50
 90 GLU  HG2    94 ARG  QD      6.01
 98 ALA  H      95 SER  HA      5.50
 94 ARG  H      95 SER  HA      0.00
 25 LEU  QD1    26 PRO  QD      4.50
 61 ASP  H      60 GLN  HB2     4.50
 57 GLN  HB3    61 ASP  H       0.00
 60 GLN  HB3    61 ASP  H       0.00
 40 ARG  QB     39 LEU  QQD     5.01
 26 PRO  QD     25 LEU  QB      4.00
# 10 LEU  QB     13 PHE  QE      6.51 #del_vio
 87 GLN  QB     88 ALA  QB      4.50
 94 ARG  QB     91 SER  QB      6.00
 33 ALA  HA     36 ILE  QD1     5.50
 11 LEU  QB     14 ILE  QG2     0.00
  9 LEU  QQD     6 PHE  HA      5.50
  6 PHE  HA     10 LEU  QQD     0.00
 38 ALA  HA     39 LEU  QQD     5.50
 33 ALA  HA     36 ILE  QG2     5.50
 33 ALA  HA     32 VAL  QG1     0.00
 93 LYS  QE     97 VAL  QG1     4.50
 50 LEU  H      52 GLN  H       4.50
 49 GLU  H      52 GLN  H       0.00
 61 ASP  HA     60 GLN  QB      5.50
 59 PHE  HA     60 GLN  QB      0.00
 49 GLU  H      48 ASN  H       3.50
 50 LEU  H      48 ASN  H       0.00
# 24 ARG  QD     23 GLN  HE21    5.50 #del_ARGsc_ov
 22 PRO  QB     17 LEU  QD1     4.00
 22 PRO  QB     17 LEU  QD2     4.00
 37 ARG  QD     38 ALA  H       5.50
 39 LEU  H      37 ARG  H       4.50
 39 LEU  H      42 LEU  H       0.00
 16 GLY  QA     19 VAL  HB      5.00
 65 LYS  HB2    68 LYS  H       4.50
 68 LYS  H      68 LYS  QB      0.00
 35 TRP  HB3    39 LEU  QQD     5.50
 71 LEU  HB2    70 SER  H       4.50
 71 LEU  HG     70 SER  H       0.00
 76 PRO  HA     79 LYS  QD      5.50
 63 LEU  H      62 SER  HB3     2.80
 63 LEU  H      63 LEU  HA      0.00
 39 LEU  H      39 LEU  HA      4.50
 40 ARG  H      39 LEU  HA      0.00
 73 ASN  HA     74 LEU  H       4.50
 73 ASN  HA     72 THR  H       0.00
 24 ARG  H      23 GLN  QB      4.50
 25 LEU  H      23 GLN  QB      0.00
 58 GLU  QB     59 PHE  HB2     6.00
 49 GLU  H      54 LEU  QQD     6.01
 50 LEU  H      54 LEU  QQD     0.00
 90 GLU  HA     93 LYS  HG3     4.50
 90 GLU  HA     93 LYS  QD      0.00
 55 LYS  H      52 GLN  QG      6.50 #ov 
 57 GLN  QG     55 LYS  H       0.00
 78 LEU  H      78 LEU  QD1     5.50
 81 SER  H      78 LEU  QD1     0.00
 37 ARG  QD     33 ALA  QB      4.50
 74 LEU  H      70 SER  HA      4.50
 70 SER  HA     72 THR  H       0.00
 42 LEU  QQD    43 ALA  QB      4.50
 46 VAL  QG1    43 ALA  QB      0.00
 71 LEU  HG     72 THR  H       4.50
 71 LEU  HB2    72 THR  H       0.00
# 57 GLN  HE22   60 GLN  QB      6.51 #del_ov
# 60 GLN  HB3    57 GLN  HE22    0.00 #QB
103 GLU  H     102 LEU  H       2.80
103 GLU  H     104 HIS  H       0.00
 39 LEU  H      38 ALA  H       4.50
 39 LEU  H      41 SER  H       0.00
 58 GLU  QB     55 LYS  QD      6.50
 17 LEU  HA     16 GLY  QA      5.50
 65 LYS  HA     64 LYS  QE      5.01
 74 LEU  H      70 SER  HB3     6.00
 70 SER  HB3    72 THR  H       0.00
 50 LEU  H      44 THR  QG2     5.50
 49 GLU  H      44 THR  QG2     0.00
 49 GLU  H      45 THR  QG2     0.00
 50 LEU  H      45 THR  QG2     0.00
 93 LYS  QE     97 VAL  QG2     5.50
 48 ASN  HB3    49 GLU  H       4.50
# 48 ASN  HB3    50 LEU  H       0.00 #del_amb
 39 LEU  H      39 LEU  QQD     4.50
 39 LEU  H      36 ILE  QG2     0.00
 35 TRP  HB2    39 LEU  QQD     5.50
# 72 THR  H      71 LEU  QD1     5.50 #del_ov
# 74 LEU  H      71 LEU  QD1     0.00 #del_ov
 52 GLN  QB     50 LEU  QD2     5.01
 49 GLU  HB2    50 LEU  QD2     0.00
101 PRO  QD    100 ASP  QB      4.50
 40 ARG  H      37 ARG  HA      4.50
 39 LEU  H      37 ARG  HA      0.00
 39 LEU  H      38 ALA  H       4.50
 40 ARG  H      38 ALA  H       0.00
 47 GLN  HA     49 GLU  H       5.50
 47 GLN  HA     50 LEU  H       0.00
 61 ASP  HA     64 LYS  QE      4.50
  6 PHE  QD      9 LEU  QQD     4.50
  6 PHE  QD     10 LEU  QQD     0.00
 17 LEU  H      18 VAL  H       3.50
 14 ILE  H      18 VAL  H       0.00
 73 ASN  H      74 LEU  H       3.50
 73 ASN  H      72 THR  H       0.00
 93 LYS  HA     93 LYS  HB2     4.50
 93 LYS  HB2    90 GLU  HA      0.00
 14 ILE  HA     10 LEU  QB      6.51
 10 LEU  HA     13 PHE  H       4.50
 13 PHE  H       9 LEU  HA      0.00
 48 ASN  H      51 THR  QG2     5.50
 48 ASN  H      44 THR  QG2     0.00
 20 LEU  QD1    24 ARG  QD      4.50
 29 VAL  HA     30 LYS  HG2     5.50
 29 VAL  HA     28 ALA  QB      0.00
 42 LEU  QQD    45 THR  H       4.50
 45 THR  H      46 VAL  QG1     0.00
 43 ALA  H      44 THR  H       4.50
 43 ALA  H      41 SER  H       0.00
  9 LEU  QQD    13 PHE  QE      5.50
 10 LEU  QQD    13 PHE  QE      0.00
 22 PRO  HA     20 LEU  QD1     5.50
 22 PRO  HA     25 LEU  QD1     0.00
 58 GLU  QG     54 LEU  QQD     5.01
 15 ILE  HA     18 VAL  QG2     4.50
 14 ILE  HA     18 VAL  QG2     0.00
 37 ARG  QD     36 ILE  QD1     6.00
 26 PRO  QB     25 LEU  QD2     5.50
 35 TRP  HE3    39 LEU  QQD     5.01
 24 ARG  H      20 LEU  QD2     5.00
 24 ARG  H      25 LEU  QD2     0.00
 72 THR  H      72 THR  QG2     4.50
 74 LEU  H      72 THR  QG2     0.00
 82 MET  HA     82 MET  QE      4.50
 78 LEU  HA     82 MET  QE      0.00
 57 GLN  QG     54 LEU  QQD     6.01
  6 PHE  QD     10 LEU  QB      5.00
 61 ASP  HA     64 LYS  QD      5.50
 25 LEU  QD2    26 PRO  QD      5.00
 93 LYS  HB3    90 GLU  HA      0.00
  2 PHE  HB2     4 ILE  QD1     5.50
  4 ILE  QD1     6 PHE  HB3     0.00
 13 PHE  QE     25 LEU  QD1     5.50
 10 LEU  QQD    13 PHE  QE      0.00
  9 LEU  QQD    13 PHE  QE      0.00
 45 THR  HA     46 VAL  QG1     6.00
 45 THR  HA     42 LEU  QQD     0.00
 17 LEU  H      16 GLY  QA      3.50
 17 LEU  H      14 ILE  HA      0.00
 17 LEU  H      15 ILE  HA      0.00
 40 ARG  H      41 SER  H       4.50
 40 ARG  H      44 THR  H       0.00
 49 GLU  HA     49 GLU  H       4.50
 49 GLU  HA     50 LEU  H       0.00
 50 LEU  H      54 LEU  QB      6.51 #QB_w_ov
 49 GLU  H      54 LEU  QB      0.00
 52 GLN  QB     51 THR  QG2     5.50
 39 LEU  H      36 ILE  HA      5.00
 40 ARG  H      36 ILE  HA      0.00
 94 ARG  QB     95 SER  HB2     6.00
 47 GLN  QB     44 THR  HA      4.50
 73 ASN  HB2    74 LEU  HG      6.51
 74 LEU  HB2    73 ASN  HB2     0.00
 42 LEU  QQD    45 THR  QG2     4.50
 45 THR  QG2    46 VAL  QG1     0.00
 62 SER  HA     65 LYS  QD      5.50
 65 LYS  HG2    62 SER  HA      0.00
 39 LEU  H      39 LEU  HB2     4.00
 40 ARG  H      39 LEU  HB2     0.00
 10 LEU  QQD    13 PHE  QD      4.50
  9 LEU  QQD    13 PHE  QD      0.00
 68 LYS  H      66 VAL  H       4.50
 63 LEU  H      66 VAL  H       0.00
 25 LEU  H      17 LEU  QD2     6.50
 24 ARG  H      17 LEU  QD2     0.00
 29 VAL  HA     29 VAL  QG2     4.50
 29 VAL  HA     32 VAL  QG1     0.00
 61 ASP  HA     62 SER  H       4.50
 59 PHE  HA     62 SER  H       0.00
 16 GLY  QA     20 LEU  QQD     6.00 #QQD
 93 LYS  HA     96 TYR  H       4.50
 96 TYR  H      97 VAL  HA      0.00
 23 GLN  H      24 ARG  H       3.50
 25 LEU  H      23 GLN  H       0.00
 58 GLU  QB     59 PHE  HB3     6.00
#102 LEU  HB3    93 LYS  QE      5.50 #intra
 10 LEU  QB     14 ILE  QD1     5.00
 11 LEU  QB     14 ILE  QD1     0.00
 71 LEU  HB2    72 THR  HB      6.51
 72 THR  HB     74 LEU  HG      0.00
 75 THR  H      74 LEU  H       3.50
 75 THR  H      72 THR  H       0.00
 52 GLN  QB     56 LEU  QD1     6.00
 47 GLN  QB     51 THR  QG2     4.50
 93 LYS  HG3    97 VAL  QG1     4.50
 93 LYS  QD     97 VAL  QG1     0.00
  6 PHE  QE      4 ILE  QG2     5.50
  2 PHE  QE      4 ILE  QG2     0.00
 70 SER  H      72 THR  H       5.50
 74 LEU  H      70 SER  H       0.00
# 26 PRO  QD     25 LEU  QD2     3.50
#  8 GLU  HA     12 VAL  QG2     0.00
 93 LYS  HA     94 ARG  H       4.00
 94 ARG  H      90 GLU  HA      0.00
 65 LYS  HA     68 LYS  QE      6.00
 74 LEU  QD2    75 THR  QG2     4.50
 75 THR  QG2    78 LEU  QD1     0.00
 71 LEU  QD2    75 THR  QG2     0.00
 61 ASP  HA     64 LYS  QB      4.50
 85 LEU  QQD    82 MET  QE      5.01
 39 LEU  H      36 ILE  QG2     5.50
 40 ARG  H      36 ILE  QG2     0.00
 78 LEU  HG     78 LEU  H       4.50
 78 LEU  HG     81 SER  H       0.00
 91 SER  QB     88 ALA  QB      5.50
 90 GLU  HA     93 LYS  H       4.50
 93 LYS  HA     93 LYS  H       0.00
 48 ASN  HB2    49 GLU  H       4.50
 48 ASN  HB2    50 LEU  H       0.00
 59 PHE  HA     58 GLU  QG      5.50
 91 SER  HA     87 GLN  QB      6.01
# 57 GLN  H      54 LEU  HA      5.50 #linker
# 57 GLN  H      53 GLU  HA      0.00 #del_0mir
 50 LEU  H      51 THR  HB      5.50
 49 GLU  H      51 THR  HB      0.00
 24 ARG  QD     20 LEU  QD2     5.00
 63 LEU  HG     60 GLN  QB      6.01
101 PRO  QD    102 LEU  HG      5.50
  8 GLU  H       8 GLU  HA      3.50
  7 SER  HA      8 GLU  H       0.00
 94 ARG  QB     95 SER  HA      6.00
 41 SER  HA     37 ARG  QD      6.52
 50 LEU  H      51 THR  H       4.50
 49 GLU  H      51 THR  H       0.00
 72 THR  HA     74 LEU  QQD     6.00
 72 THR  HA     71 LEU  QQD     0.00
 32 VAL  QG1    33 ALA  QB      4.50
 36 ILE  QG2    33 ALA  QB      0.00
 39 LEU  H      39 LEU  QQD     4.50
 40 ARG  H      39 LEU  QQD     0.00
  2 PHE  QE      1 MET  H       5.00
  2 PHE  QD      1 MET  H       0.00
 25 LEU  H      17 LEU  QD1     6.50
 24 ARG  H      17 LEU  QD1     0.00
 18 VAL  H      15 ILE  H       5.50
 15 ILE  H      12 VAL  H       0.00
100 ASP  QB    103 GLU  QB      5.50
 59 PHE  HA     63 LEU  H       4.50
 61 ASP  HA     63 LEU  H       0.00
 61 ASP  HB2    64 LYS  QE      6.00
 13 PHE  QE     17 LEU  HG      5.50
  9 LEU  HB3    13 PHE  QE      0.00
 71 LEU  HA     72 THR  H       4.50
 74 LEU  H      71 LEU  HA      0.00
  6 PHE  H       9 LEU  H       5.50
  6 PHE  H       4 ILE  H       0.00
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HA     50 LEU  QD1     0.00
 91 SER  QB     94 ARG  QD      6.00
 11 LEU  H       9 LEU  HA      4.50
 10 LEU  HA     11 LEU  H       0.00
 93 LYS  QE     90 GLU  HA      5.50
 76 PRO  HA     79 LYS  QE      6.00
  6 PHE  QE     10 LEU  QQD     4.50
  6 PHE  QE      9 LEU  QQD     0.00
 94 ARG  HA     94 ARG  QD      5.50
 46 VAL  HB     50 LEU  QD1     6.00
 49 GLU  HB2    50 LEU  QD1     0.00
 39 LEU  H      37 ARG  H       4.50
 40 ARG  H      37 ARG  H       0.00
 74 LEU  HB2    73 ASN  HB3     6.51
 73 ASN  HB3    74 LEU  HG      0.00
 93 LYS  HB2    93 LYS  H       4.50
 93 LYS  H      92 MET  QE      0.00
 65 LYS  HA     68 LYS  QB      4.50
 10 LEU  QB      6 PHE  HA      5.50
 49 GLU  H      48 ASN  HA      5.50
 50 LEU  H      48 ASN  HA      0.00
 46 VAL  H      51 THR  QG2     0.00
 39 LEU  QQD    38 ALA  QB      5.00
 42 LEU  QQD    38 ALA  QB      0.00
 41 SER  HA     45 THR  QG2     5.50
 41 SER  HA     44 THR  QG2     0.00
 13 PHE  QE     25 LEU  QD2     5.00
 13 PHE  HZ     25 LEU  QD2     5.50
# 13 PHE  HZ     25 LEU  QD1     5.00 #del_ov
 13 PHE  QD     25 LEU  QD2     5.50
 13 PHE  QE     29 VAL  QG1     6.50
 17 LEU  H      22 PRO  HA      6.50
 17 LEU  HA     24 ARG  HE      6.50
 17 LEU  H      25 LEU  QD2     5.00
 17 LEU  HA     25 LEU  QD2     5.00
 18 VAL  H      25 LEU  QD2     6.50
 20 LEU  QD1    24 ARG  H       5.50
 20 LEU  H      25 LEU  QD2     6.00
 20 LEU  HA     25 LEU  QD2     6.50
 20 LEU  QD1    28 ALA  QB      5.50 #add
 20 LEU  QD2    28 ALA  QB      4.00
 21 GLY  HA2    17 LEU  QQD     6.50 #w_0mir
 21 GLY  H      17 LEU  QQD     6.00
# 21 GLY  HA2    17 LEU  QD2     6.00 #QQD
# 21 GLY  H      17 LEU  QD2     6.00 #comb_QQD
 21 GLY  H      24 ARG  H       6.00
 21 GLY  H      25 LEU  QD2     6.50
 22 PRO  HA     17 LEU  QD1     4.50
 22 PRO  HA     17 LEU  QD2     4.50
 22 PRO  HA     25 LEU  QD2     5.50
 22 PRO  QG     17 LEU  QD1     6.00
# 22 PRO  HG3    17 LEU  QD1     6.00 #comb_QG
 22 PRO  QG     17 LEU  QD2     6.00 
# 22 PRO  HG3    17 LEU  QD2     6.00 #comb_QG
 22 PRO  QG     24 ARG  H       6.01 #comb_QG
# 22 PRO  HD3    17 LEU  QD2     6.00 #comb_QD
# 22 PRO  HD3    17 LEU  QD1     6.00 #comb_QD
 22 PRO  QD     17 LEU  QD2     6.00
 22 PRO  QD     17 LEU  QD1     6.00 
 23 GLN  H      24 ARG  HG3     5.01
 23 GLN  QB     26 PRO  QD      6.00
 24 ARG  HB2    20 LEU  QD1     6.50
 24 ARG  HG3    20 LEU  QD2     5.50
 24 ARG  HB3    20 LEU  QD2     6.50
 25 LEU  QD2    17 LEU  QB      4.50 #from_amb
 25 LEU  HA     20 LEU  QD2     5.00
 25 LEU  H      20 LEU  QD2     6.01
 27 VAL  H      24 ARG  QD      4.50
 45 THR  HB     47 GLN  QG      6.50 #QG
 45 THR  QG2    47 GLN  QG      6.52 #comb_QG
# 47 GLN  HG3    45 THR  QG2     5.50 #comb_QG
 45 THR  HA     48 ASN  HD22    6.51
 45 THR  HA     48 ASN  HD21    6.51
 45 THR  HA     48 ASN  QB      5.00 #comb_QB
# 45 THR  HA     48 ASN  HB3     6.00
 45 THR  HA     49 GLU  H       5.50
 45 THR  HA     50 LEU  H       6.00
# 45 THR  HA     51 THR  HB      6.52 #del_ov
 45 THR  H      50 LEU  QD2     6.52 
# 45 THR  H      51 THR  H       6.51 #del_vio
 47 GLN  HA     50 LEU  QD2     5.00
 47 GLN  HA     51 THR  H       5.00
 48 ASN  QB     45 THR  QG2     6.50 #QB
 48 ASN  QB     47 GLN  QG      6.50
 48 ASN  QB     47 GLN  QB      5.50    #comb_QB
# 48 ASN  HB3    47 GLN  HG3     6.00   #comb_QGQB
 48 ASN  QB     49 GLU  QB      5.50    #add
# 48 ASN  HB3    51 THR  QG2     5.50 #comb_QB
 48 ASN  QB     51 THR  QG2     5.50
 48 ASN  H      50 LEU  QQD     6.00
# 48 ASN  H      54 LEU  QQD     6.50 #del_vio
# 48 ASN  H      56 LEU  QQD     6.50 #del_vio
 48 ASN  HD22   51 THR  QG2     5.52
 48 ASN  HD22   44 THR  QG2     4.50
 48 ASN  HD21   51 THR  QG2     5.01
 48 ASN  HD21   44 THR  QG2     4.50
 49 GLU  H      44 THR  HA      6.01
 49 GLU  HA     47 GLN  H       6.00
 49 GLU  HA     51 THR  QG2     6.01
 49 GLU  H      51 THR  HA      5.50
 49 GLU  HA     52 GLN  QG      5.50
 49 GLU  HA     53 GLU  H       6.01
 49 GLU  HA     53 GLU  QB      5.00
 49 GLU  HA     54 LEU  H       6.53
 50 LEU  QD2    47 GLN  HG2     6.01
 50 LEU  H      53 GLU  H       5.50
 50 LEU  H      54 LEU  HB3     6.00
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     50 LEU  QQD     5.50
# 51 THR  HB     50 LEU  QD2     5.50 #comb_QQD
 51 THR  HA     54 LEU  QB      6.01    
# 51 THR  HA    54 LEU  HB3     6.01    #comb_QB
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HB     54 LEU  H       6.01
 52 GLN  H      48 ASN  HA      6.50
 52 GLN  H      50 LEU  QD2     6.00
 52 GLN  H      54 LEU  QQD     6.50
 52 GLN  H      56 LEU  QD2     6.51
 53 GLU  H      50 LEU  QQD     6.01 #QQD
 53 GLU  QB     50 LEU  QD2     5.50
 53 GLU  H      51 THR  H       5.00
 54 LEU  H      50 LEU  QD2     5.50 
 55 LYS  H      52 GLN  QG      6.01 #QG
 55 LYS  QG     54 LEU  H       5.50 #modi_QG
 55 LYS  QG     56 LEU  HB3     5.52 #ov
 56 LEU  HB3    51 THR  H       6.01
 56 LEU  QD1    52 GLN  QG      6.50
 56 LEU  HA     59 PHE  QD      6.00
# 56 LEU  HA     59 PHE  HB3     5.50 #comb_QB
 56 LEU  HA     59 PHE  QB      5.00
# 56 LEU  HB3    59 PHE  QD      6.00   #comb_QB
 56 LEU  QB     59 PHE  QD      6.00
 57 GLN  QE2    51 THR  QG2     6.51 #n_w
 57 GLN  H      54 LEU  HA      5.50 #from_amb
 57 GLN  HE21   54 LEU  QQD     6.00
 57 GLN  QG     54 LEU  QQD     6.00
 57 GLN  HE22   54 LEU  QQD     6.00
 57 GLN  HE21   55 LYS  HA      6.00
 58 GLU  H      56 LEU  HA      6.00
 59 PHE  QD     50 LEU  QD2     6.00
 59 PHE  QD     54 LEU  QQD     6.00
 59 PHE  H      54 LEU  QQD     6.00
 59 PHE  QD     56 LEU  QQD     6.51
# 59 PHE  QD     56 LEU  QD2     6.51 #comb_QQD
 59 PHE  H      56 LEU  QD1     6.00
 59 PHE  H 56 LEU  QB 6.01 #comb_QB
 59 PHE  H 60 GLN  QG  6.51
# 59 PHE  H 60 GLN  HG3 6.51 #comb_QG
# 60 GLN  QG     45 THR  QG2      6.00 #merit0_vio_del
# 60 GLN  QG     47 GLN  QE2      6.50 #60.qg-59.qd_del
 60 GLN  QG     59 PHE  QD      6.51 #QG_OV_test
 60 GLN  QG 56 LEU  QQD 6.01 #QQD
 67 GLU  HA     78 LEU  QD2     6.01
 68 LYS  QD     78 LEU  QD1     5.00
 70 SER  H      74 LEU  QD1     5.50
 70 SER  H      78 LEU  QQD     6.01
# 70 SER  H      78 LEU  QD2     6.01 #comb_QQD
 71 LEU  H      68 LYS  HG2     6.01
 71 LEU  HG     72 THR  QG2     6.51
 71 LEU  HA     74 LEU  QD2     4.50
 71 LEU  HA     74 LEU  QD1     5.00
 71 LEU  HB3    75 THR  H       5.50
 71 LEU  HA     75 THR  QG2     5.50
 71 LEU  H      78 LEU  QD1     5.00
# 72 THR  HB     74 LEU  QD2     5.00 #QQD_ov
 72 THR  HB     74 LEU  QQD      6.00
# 72 THR  HA     74 LEU  QD2     5.50 #m2amb
# 72 THR  HA     74 LEU  QD1     6.00 #m2amb
 72 THR  QG2    78 LEU  QQD     5.50 #add
 72 THR  HB     78 LEU  QD1     6.51    #?
 72 THR  HA     79 LYS  HA      6.50
 72 THR  QG2    82 MET  QE      4.50
 73 ASN  H      71 LEU  H       4.50
 74 LEU  QD1    69 ALA  QB      6.01
 74 LEU  HB2    71 LEU  QD1     5.00
 74 LEU  HA     71 LEU  QD1     6.01
 74 LEU  HA     78 LEU  QD2     6.52
 78 LEU  QB     72 THR  QG2     6.00
 78 LEU  HG     72 THR  QG2     5.01
 78 LEU  QB     75 THR  QG2     6.00
 79 LYS  QG     74 LEU  QD2     6.50
 79 LYS  H      75 THR  QG2     6.50
 79 LYS  QE     75 THR  QG2     6.00
 13 PHE  QE     25 LEU  QD2     5.00
 13 PHE  HZ     25 LEU  QD2     5.50
# 13 PHE  HZ     25 LEU  QD1     5.00 #del_ov
 13 PHE  QD     25 LEU  QD2     5.50
 13 PHE  QE     29 VAL  QG1     6.50
 17 LEU  H      22 PRO  HA      6.50
 17 LEU  HA     24 ARG  HE      6.50
 17 LEU  H      25 LEU  QD2     5.00
 17 LEU  HA     25 LEU  QD2     5.00
 18 VAL  H      25 LEU  QD2     6.50
 20 LEU  QD1    24 ARG  H       5.50
 20 LEU  H      25 LEU  QD2     6.00
 20 LEU  HA     25 LEU  QD2     6.50
 20 LEU  QD1    28 ALA  QB      5.50 #add
 20 LEU  QD2    28 ALA  QB      4.00
 21 GLY  HA2    17 LEU  QQD     6.50 #w_0mir
 21 GLY  H      17 LEU  QQD     6.00
# 21 GLY  HA2    17 LEU  QD2     6.00 #QQD
# 21 GLY  H      17 LEU  QD2     6.00 #comb_QQD
 21 GLY  H      24 ARG  H       6.00
 21 GLY  H      25 LEU  QD2     6.50
 22 PRO  HA     17 LEU  QD1     4.50
 22 PRO  HA     17 LEU  QD2     4.50
 22 PRO  HA     25 LEU  QD2     5.50
 22 PRO  QG     17 LEU  QD1     6.00
# 22 PRO  HG3    17 LEU  QD1     6.00 #comb_QG
 22 PRO  QG     17 LEU  QD2     6.00 
# 22 PRO  HG3    17 LEU  QD2     6.00 #comb_QG
 22 PRO  QG     24 ARG  H       6.01 #comb_QG
# 22 PRO  HD3    17 LEU  QD2     6.00 #comb_QD
# 22 PRO  HD3    17 LEU  QD1     6.00 #comb_QD
 22 PRO  QD     17 LEU  QD2     6.00
 22 PRO  QD     17 LEU  QD1     6.00 
 23 GLN  H      24 ARG  HG3     5.01
 23 GLN  QB     26 PRO  QD      6.00
 24 ARG  HB2    20 LEU  QD1     6.50
 24 ARG  HG3    20 LEU  QD2     5.50
 24 ARG  HB3    20 LEU  QD2     6.50
 25 LEU  QD2    17 LEU  QB      4.50 #from_amb
 25 LEU  HA     20 LEU  QD2     5.00
 25 LEU  H      20 LEU  QD2     6.01
 27 VAL  H      24 ARG  QD      4.50
 45 THR  HB     47 GLN  QG      6.50 #QG
 45 THR  QG2    47 GLN  QG      6.52 #comb_QG
# 47 GLN  HG3    45 THR  QG2     5.50 #comb_QG
 45 THR  HA     48 ASN  HD22    6.51
 45 THR  HA     48 ASN  HD21    6.51
 45 THR  HA     48 ASN  QB      5.00 #comb_QB
# 45 THR  HA     48 ASN  HB3     6.00
 45 THR  HA     49 GLU  H       5.50
 45 THR  HA     50 LEU  H       6.00
# 45 THR  HA     51 THR  HB      6.52 #del_ov
 45 THR  H      50 LEU  QD2     6.52 
# 45 THR  H      51 THR  H       6.51 #del_vio
 47 GLN  HA     50 LEU  QD2     5.00
 47 GLN  HA     51 THR  H       5.00
 48 ASN  QB     45 THR  QG2     6.50 #QB
 48 ASN  QB     47 GLN  QG      6.50
 48 ASN  QB     47 GLN  QB      5.50    #comb_QB
# 48 ASN  HB3    47 GLN  HG3     6.00   #comb_QGQB
 48 ASN  QB     49 GLU  QB      5.50    #add
# 48 ASN  HB3    51 THR  QG2     5.50 #comb_QB
 48 ASN  QB     51 THR  QG2     5.50
 48 ASN  H      50 LEU  QQD     6.00
# 48 ASN  H      54 LEU  QQD     6.50 #del_vio
# 48 ASN  H      56 LEU  QQD     6.50 #del_vio
 48 ASN  HD22   51 THR  QG2     5.52
 48 ASN  HD22   44 THR  QG2     4.50
 48 ASN  HD21   51 THR  QG2     5.01
 48 ASN  HD21   44 THR  QG2     4.50
 49 GLU  H      44 THR  HA      6.01
 49 GLU  HA     47 GLN  H       6.00
 49 GLU  HA     51 THR  QG2     6.01
 49 GLU  H      51 THR  HA      5.50
 49 GLU  HA     52 GLN  QG      5.50
 49 GLU  HA     53 GLU  H       6.01
 49 GLU  HA     53 GLU  QB      5.00
 49 GLU  HA     54 LEU  H       6.53
 50 LEU  QD2    47 GLN  HG2     6.01
 50 LEU  H      53 GLU  H       5.50
 50 LEU  H      54 LEU  HB3     6.00
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     50 LEU  QQD     5.50
# 51 THR  HB     50 LEU  QD2     5.50 #comb_QQD
 51 THR  HA     54 LEU  QB      6.01    
# 51 THR  HA    54 LEU  HB3     6.01    #comb_QB
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HB     54 LEU  H       6.01
 52 GLN  H      48 ASN  HA      6.50
 52 GLN  H      50 LEU  QD2     6.00
 52 GLN  H      54 LEU  QQD     6.50
 52 GLN  H      56 LEU  QD2     6.51
 53 GLU  H      50 LEU  QQD     6.01 #QQD
 53 GLU  QB     50 LEU  QD2     5.50
 53 GLU  H      51 THR  H       5.00
 54 LEU  H      50 LEU  QD2     5.50 
 55 LYS  H      52 GLN  QG      6.01 #QG
 55 LYS  QG     54 LEU  H       5.50 #modi_QG
 55 LYS  QG     56 LEU  HB3     5.52 #ov
 56 LEU  HB3    51 THR  H       6.01
 56 LEU  QD1    52 GLN  QG      6.50
 56 LEU  HA     59 PHE  QD      6.00
# 56 LEU  HA     59 PHE  HB3     5.50 #comb_QB
 56 LEU  HA     59 PHE  QB      5.00
# 56 LEU  HB3    59 PHE  QD      6.00   #comb_QB
 56 LEU  QB     59 PHE  QD      6.00
 57 GLN  QE2    51 THR  QG2     6.51 #n_w
 57 GLN  H      54 LEU  HA      5.50 #from_amb
 57 GLN  HE21   54 LEU  QQD     6.00
 57 GLN  QG     54 LEU  QQD     6.00
 57 GLN  HE22   54 LEU  QQD     6.00
 57 GLN  HE21   55 LYS  HA      6.00
 58 GLU  H      56 LEU  HA      6.00
 59 PHE  QD     50 LEU  QD2     6.00
 59 PHE  QD     54 LEU  QQD     6.00
 59 PHE  H      54 LEU  QQD     6.00
 59 PHE  QD     56 LEU  QQD     6.51
# 59 PHE  QD     56 LEU  QD2     6.51 #comb_QQD
 59 PHE  H      56 LEU  QD1     6.00
 59 PHE  H 56 LEU  QB 6.01 #comb_QB
 59 PHE  H 60 GLN  QG  6.51
# 59 PHE  H 60 GLN  HG3 6.51 #comb_QG
# 60 GLN  QG     45 THR  QG2      6.00 #merit0_vio_del
# 60 GLN  QG     47 GLN  QE2      6.50 #60.qg-59.qd_del
 60 GLN  QG     59 PHE  QD      6.51 #QG_OV_test
 60 GLN  QG 56 LEU  QQD 6.01 #QQD
 67 GLU  HA     78 LEU  QD2     6.01
 68 LYS  QD     78 LEU  QD1     5.00
 70 SER  H      74 LEU  QD1     5.50
 70 SER  H      78 LEU  QQD     6.01
# 70 SER  H      78 LEU  QD2     6.01 #comb_QQD
 71 LEU  H      68 LYS  HG2     6.01
 71 LEU  HG     72 THR  QG2     6.51
 71 LEU  HA     74 LEU  QD2     4.50
 71 LEU  HA     74 LEU  QD1     5.00
 71 LEU  HB3    75 THR  H       5.50
 71 LEU  HA     75 THR  QG2     5.50
 71 LEU  H      78 LEU  QD1     5.00
# 72 THR  HB     74 LEU  QD2     5.00 #QQD_ov
 72 THR  HB     74 LEU  QQD      6.00
# 72 THR  HA     74 LEU  QD2     5.50 #m2amb
# 72 THR  HA     74 LEU  QD1     6.00 #m2amb
 72 THR  QG2    78 LEU  QQD     5.50 #add
 72 THR  HB     78 LEU  QD1     6.51    #?
 72 THR  HA     79 LYS  HA      6.50
 72 THR  QG2    82 MET  QE      4.50
 73 ASN  H      71 LEU  H       4.50
 74 LEU  QD1    69 ALA  QB      6.01
 74 LEU  HB2    71 LEU  QD1     5.00
 74 LEU  HA     71 LEU  QD1     6.01
 74 LEU  HA     78 LEU  QD2     6.52
 78 LEU  QB     72 THR  QG2     6.00
 78 LEU  HG     72 THR  QG2     5.01
 78 LEU  QB     75 THR  QG2     6.00
 79 LYS  QG     74 LEU  QD2     6.50
 79 LYS  H      75 THR  QG2     6.50
 79 LYS  QE     75 THR  QG2     6.00
 13 PHE  QE     25 LEU  QD2     5.00
 13 PHE  HZ     25 LEU  QD2     5.50
# 13 PHE  HZ     25 LEU  QD1     5.00 #del_ov
 13 PHE  QD     25 LEU  QD2     5.50
 13 PHE  QE     29 VAL  QG1     6.50
 17 LEU  H      22 PRO  HA      6.50
 17 LEU  HA     24 ARG  HE      6.50
 17 LEU  H      25 LEU  QD2     5.00
 17 LEU  HA     25 LEU  QD2     5.00
 18 VAL  H      25 LEU  QD2     6.50
 20 LEU  QD1    24 ARG  H       5.50
 20 LEU  H      25 LEU  QD2     6.00
 20 LEU  HA     25 LEU  QD2     6.50
 20 LEU  QD1    28 ALA  QB      5.50 #add
 20 LEU  QD2    28 ALA  QB      4.00
 21 GLY  HA2    17 LEU  QQD     6.50 #w_0mir
 21 GLY  H      17 LEU  QQD     6.00
# 21 GLY  HA2    17 LEU  QD2     6.00 #QQD
# 21 GLY  H      17 LEU  QD2     6.00 #comb_QQD
 21 GLY  H      24 ARG  H       6.00
 21 GLY  H      25 LEU  QD2     6.50
 22 PRO  HA     17 LEU  QD1     4.50
 22 PRO  HA     17 LEU  QD2     4.50
 22 PRO  HA     25 LEU  QD2     5.50
 22 PRO  QG     17 LEU  QD1     6.00
# 22 PRO  HG3    17 LEU  QD1     6.00 #comb_QG
 22 PRO  QG     17 LEU  QD2     6.00 
# 22 PRO  HG3    17 LEU  QD2     6.00 #comb_QG
 22 PRO  QG     24 ARG  H       6.01 #comb_QG
# 22 PRO  HD3    17 LEU  QD2     6.00 #comb_QD
# 22 PRO  HD3    17 LEU  QD1     6.00 #comb_QD
 22 PRO  QD     17 LEU  QD2     6.00
 22 PRO  QD     17 LEU  QD1     6.00 
 23 GLN  H      24 ARG  HG3     5.01
 23 GLN  QB     26 PRO  QD      6.00
 24 ARG  HB2    20 LEU  QD1     6.50
 24 ARG  HG3    20 LEU  QD2     5.50
 24 ARG  HB3    20 LEU  QD2     6.50
 25 LEU  QD2    17 LEU  QB      4.50 #from_amb
 25 LEU  HA     20 LEU  QD2     5.00
 25 LEU  H      20 LEU  QD2     6.01
 27 VAL  H      24 ARG  QD      4.50
 45 THR  HB     47 GLN  QG      6.50 #QG
 45 THR  QG2    47 GLN  QG      6.52 #comb_QG
# 47 GLN  HG3    45 THR  QG2     5.50 #comb_QG
 45 THR  HA     48 ASN  HD22    6.51
 45 THR  HA     48 ASN  HD21    6.51
 45 THR  HA     48 ASN  QB      5.00 #comb_QB
# 45 THR  HA     48 ASN  HB3     6.00
 45 THR  HA     49 GLU  H       5.50
 45 THR  HA     50 LEU  H       6.00
# 45 THR  HA     51 THR  HB      6.52 #del_ov
 45 THR  H      50 LEU  QD2     6.52 
# 45 THR  H      51 THR  H       6.51 #del_vio
 47 GLN  HA     50 LEU  QD2     5.00
 47 GLN  HA     51 THR  H       5.00
 48 ASN  QB     45 THR  QG2     6.50 #QB
 48 ASN  QB     47 GLN  QG      6.50
 48 ASN  QB     47 GLN  QB      5.50    #comb_QB
# 48 ASN  HB3    47 GLN  HG3     6.00   #comb_QGQB
 48 ASN  QB     49 GLU  QB      5.50    #add
# 48 ASN  HB3    51 THR  QG2     5.50 #comb_QB
 48 ASN  QB     51 THR  QG2     5.50
 48 ASN  H      50 LEU  QQD     6.00
# 48 ASN  H      54 LEU  QQD     6.50 #del_vio
# 48 ASN  H      56 LEU  QQD     6.50 #del_vio
 48 ASN  HD22   51 THR  QG2     5.52
 48 ASN  HD22   44 THR  QG2     4.50
 48 ASN  HD21   51 THR  QG2     5.01
 48 ASN  HD21   44 THR  QG2     4.50
 49 GLU  H      44 THR  HA      6.01
 49 GLU  HA     47 GLN  H       6.00
 49 GLU  HA     51 THR  QG2     6.01
 49 GLU  H      51 THR  HA      5.50
 49 GLU  HA     52 GLN  QG      5.50
 49 GLU  HA     53 GLU  H       6.01
 49 GLU  HA     53 GLU  QB      5.00
 49 GLU  HA     54 LEU  H       6.53
 50 LEU  QD2    47 GLN  HG2     6.01
 50 LEU  H      53 GLU  H       5.50
 50 LEU  H      54 LEU  HB3     6.00
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     50 LEU  QQD     5.50
# 51 THR  HB     50 LEU  QD2     5.50 #comb_QQD
 51 THR  HA     54 LEU  QB      6.01    
# 51 THR  HA    54 LEU  HB3     6.01    #comb_QB
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HB     54 LEU  H       6.01
 52 GLN  H      48 ASN  HA      6.50
 52 GLN  H      50 LEU  QD2     6.00
 52 GLN  H      54 LEU  QQD     6.50
 52 GLN  H      56 LEU  QD2     6.51
 53 GLU  H      50 LEU  QQD     6.01 #QQD
 53 GLU  QB     50 LEU  QD2     5.50
 53 GLU  H      51 THR  H       5.00
 54 LEU  H      50 LEU  QD2     5.50 
 55 LYS  H      52 GLN  QG      6.01 #QG
 55 LYS  QG     54 LEU  H       5.50 #modi_QG
 55 LYS  QG     56 LEU  HB3     5.52 #ov
 56 LEU  HB3    51 THR  H       6.01
 56 LEU  QD1    52 GLN  QG      6.50
 56 LEU  HA     59 PHE  QD      6.00
# 56 LEU  HA     59 PHE  HB3     5.50 #comb_QB
 56 LEU  HA     59 PHE  QB      5.00
# 56 LEU  HB3    59 PHE  QD      6.00   #comb_QB
 56 LEU  QB     59 PHE  QD      6.00
 57 GLN  QE2    51 THR  QG2     6.51 #n_w
 57 GLN  H      54 LEU  HA      5.50 #from_amb
 57 GLN  HE21   54 LEU  QQD     6.00
 57 GLN  QG     54 LEU  QQD     6.00
 57 GLN  HE22   54 LEU  QQD     6.00
 57 GLN  HE21   55 LYS  HA      6.00
 58 GLU  H      56 LEU  HA      6.00
 59 PHE  QD     50 LEU  QD2     6.00
 59 PHE  QD     54 LEU  QQD     6.00
 59 PHE  H      54 LEU  QQD     6.00
 59 PHE  QD     56 LEU  QQD     6.51
# 59 PHE  QD     56 LEU  QD2     6.51 #comb_QQD
 59 PHE  H      56 LEU  QD1     6.00
 59 PHE  H 56 LEU  QB 6.01 #comb_QB
 59 PHE  H 60 GLN  QG  6.51
# 59 PHE  H 60 GLN  HG3 6.51 #comb_QG
# 60 GLN  QG     45 THR  QG2      6.00 #merit0_vio_del
# 60 GLN  QG     47 GLN  QE2      6.50 #60.qg-59.qd_del
 60 GLN  QG     59 PHE  QD      6.51 #QG_OV_test
 60 GLN  QG 56 LEU  QQD 6.01 #QQD
 67 GLU  HA     78 LEU  QD2     6.01
 68 LYS  QD     78 LEU  QD1     5.00
 70 SER  H      74 LEU  QD1     5.50
 70 SER  H      78 LEU  QQD     6.01
# 70 SER  H      78 LEU  QD2     6.01 #comb_QQD
 71 LEU  H      68 LYS  HG2     6.01
 71 LEU  HG     72 THR  QG2     6.51
 71 LEU  HA     74 LEU  QD2     4.50
 71 LEU  HA     74 LEU  QD1     5.00
 71 LEU  HB3    75 THR  H       5.50
 71 LEU  HA     75 THR  QG2     5.50
 71 LEU  H      78 LEU  QD1     5.00
# 72 THR  HB     74 LEU  QD2     5.00 #QQD_ov
 72 THR  HB     74 LEU  QQD      6.00
# 72 THR  HA     74 LEU  QD2     5.50 #m2amb
# 72 THR  HA     74 LEU  QD1     6.00 #m2amb
 72 THR  QG2    78 LEU  QQD     5.50 #add
 72 THR  HB     78 LEU  QD1     6.51    #?
 72 THR  HA     79 LYS  HA      6.50
 72 THR  QG2    82 MET  QE      4.50
 73 ASN  H      71 LEU  H       4.50
 74 LEU  QD1    69 ALA  QB      6.01
 74 LEU  HB2    71 LEU  QD1     5.00
 74 LEU  HA     71 LEU  QD1     6.01
 74 LEU  HA     78 LEU  QD2     6.52
 78 LEU  QB     72 THR  QG2     6.00
 78 LEU  HG     72 THR  QG2     5.01
 78 LEU  QB     75 THR  QG2     6.00
 79 LYS  QG     74 LEU  QD2     6.50
 79 LYS  H      75 THR  QG2     6.50
 79 LYS  QE     75 THR  QG2     6.00
 13 PHE  QE     25 LEU  QD2     5.00
 13 PHE  HZ     25 LEU  QD2     5.50
# 13 PHE  HZ     25 LEU  QD1     5.00 #del_ov
 13 PHE  QD     25 LEU  QD2     5.50
 13 PHE  QE     29 VAL  QG1     6.50
 17 LEU  H      22 PRO  HA      6.50
 17 LEU  HA     24 ARG  HE      6.50
 17 LEU  H      25 LEU  QD2     5.00
 17 LEU  HA     25 LEU  QD2     5.00
 18 VAL  H      25 LEU  QD2     6.50
 20 LEU  QD1    24 ARG  H       5.50
 20 LEU  H      25 LEU  QD2     6.00
 20 LEU  HA     25 LEU  QD2     6.50
 20 LEU  QD1    28 ALA  QB      5.50 #add
 20 LEU  QD2    28 ALA  QB      4.00
 21 GLY  HA2    17 LEU  QQD     6.50 #w_0mir
 21 GLY  H      17 LEU  QQD     6.00
# 21 GLY  HA2    17 LEU  QD2     6.00 #QQD
# 21 GLY  H      17 LEU  QD2     6.00 #comb_QQD
 21 GLY  H      24 ARG  H       6.00
 21 GLY  H      25 LEU  QD2     6.50
 22 PRO  HA     17 LEU  QD1     4.50
 22 PRO  HA     17 LEU  QD2     4.50
 22 PRO  HA     25 LEU  QD2     5.50
 22 PRO  QG     17 LEU  QD1     6.00
# 22 PRO  HG3    17 LEU  QD1     6.00 #comb_QG
 22 PRO  QG     17 LEU  QD2     6.00 
# 22 PRO  HG3    17 LEU  QD2     6.00 #comb_QG
 22 PRO  QG     24 ARG  H       6.01 #comb_QG
# 22 PRO  HD3    17 LEU  QD2     6.00 #comb_QD
# 22 PRO  HD3    17 LEU  QD1     6.00 #comb_QD
 22 PRO  QD     17 LEU  QD2     6.00
 22 PRO  QD     17 LEU  QD1     6.00 
 23 GLN  H      24 ARG  HG3     5.01
 23 GLN  QB     26 PRO  QD      6.00
 24 ARG  HB2    20 LEU  QD1     6.50
 24 ARG  HG3    20 LEU  QD2     5.50
 24 ARG  HB3    20 LEU  QD2     6.50
 25 LEU  QD2    17 LEU  QB      4.50 #from_amb
 25 LEU  HA     20 LEU  QD2     5.00
 25 LEU  H      20 LEU  QD2     6.01
 27 VAL  H      24 ARG  QD      4.50
 45 THR  HB     47 GLN  QG      6.50 #QG
 45 THR  QG2    47 GLN  QG      6.52 #comb_QG
# 47 GLN  HG3    45 THR  QG2     5.50 #comb_QG
 45 THR  HA     48 ASN  HD22    6.51
 45 THR  HA     48 ASN  HD21    6.51
 45 THR  HA     48 ASN  QB      5.00 #comb_QB
# 45 THR  HA     48 ASN  HB3     6.00
 45 THR  HA     49 GLU  H       5.50
 45 THR  HA     50 LEU  H       6.00
# 45 THR  HA     51 THR  HB      6.52 #del_ov
 45 THR  H      50 LEU  QD2     6.52 
# 45 THR  H      51 THR  H       6.51 #del_vio
 47 GLN  HA     50 LEU  QD2     5.00
 47 GLN  HA     51 THR  H       5.00
 48 ASN  QB     45 THR  QG2     6.50 #QB
 48 ASN  QB     47 GLN  QG      6.50
 48 ASN  QB     47 GLN  QB      5.50    #comb_QB
# 48 ASN  HB3    47 GLN  HG3     6.00   #comb_QGQB
 48 ASN  QB     49 GLU  QB      5.50    #add
# 48 ASN  HB3    51 THR  QG2     5.50 #comb_QB
 48 ASN  QB     51 THR  QG2     5.50
 48 ASN  H      50 LEU  QQD     6.00
# 48 ASN  H      54 LEU  QQD     6.50 #del_vio
# 48 ASN  H      56 LEU  QQD     6.50 #del_vio
 48 ASN  HD22   51 THR  QG2     5.52
 48 ASN  HD22   44 THR  QG2     4.50
 48 ASN  HD21   51 THR  QG2     5.01
 48 ASN  HD21   44 THR  QG2     4.50
 49 GLU  H      44 THR  HA      6.01
 49 GLU  HA     47 GLN  H       6.00
 49 GLU  HA     51 THR  QG2     6.01
 49 GLU  H      51 THR  HA      5.50
 49 GLU  HA     52 GLN  QG      5.50
 49 GLU  HA     53 GLU  H       6.01
 49 GLU  HA     53 GLU  QB      5.00
 49 GLU  HA     54 LEU  H       6.53
 50 LEU  QD2    47 GLN  HG2     6.01
 50 LEU  H      53 GLU  H       5.50
 50 LEU  H      54 LEU  HB3     6.00
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     50 LEU  QQD     5.50
# 51 THR  HB     50 LEU  QD2     5.50 #comb_QQD
 51 THR  HA     54 LEU  QB      6.01    
# 51 THR  HA    54 LEU  HB3     6.01    #comb_QB
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HB     54 LEU  H       6.01
 52 GLN  H      48 ASN  HA      6.50
 52 GLN  H      50 LEU  QD2     6.00
 52 GLN  H      54 LEU  QQD     6.50
 52 GLN  H      56 LEU  QD2     6.51
 53 GLU  H      50 LEU  QQD     6.01 #QQD
 53 GLU  QB     50 LEU  QD2     5.50
 53 GLU  H      51 THR  H       5.00
 54 LEU  H      50 LEU  QD2     5.50 
 55 LYS  H      52 GLN  QG      6.01 #QG
 55 LYS  QG     54 LEU  H       5.50 #modi_QG
 55 LYS  QG     56 LEU  HB3     5.52 #ov
 56 LEU  HB3    51 THR  H       6.01
 56 LEU  QD1    52 GLN  QG      6.50
 56 LEU  HA     59 PHE  QD      6.00
# 56 LEU  HA     59 PHE  HB3     5.50 #comb_QB
 56 LEU  HA     59 PHE  QB      5.00
# 56 LEU  HB3    59 PHE  QD      6.00   #comb_QB
 56 LEU  QB     59 PHE  QD      6.00
 57 GLN  QE2    51 THR  QG2     6.51 #n_w
 57 GLN  H      54 LEU  HA      5.50 #from_amb
 57 GLN  HE21   54 LEU  QQD     6.00
 57 GLN  QG     54 LEU  QQD     6.00
 57 GLN  HE22   54 LEU  QQD     6.00
 57 GLN  HE21   55 LYS  HA      6.00
 58 GLU  H      56 LEU  HA      6.00
 59 PHE  QD     50 LEU  QD2     6.00
 59 PHE  QD     54 LEU  QQD     6.00
 59 PHE  H      54 LEU  QQD     6.00
 59 PHE  QD     56 LEU  QQD     6.51
# 59 PHE  QD     56 LEU  QD2     6.51 #comb_QQD
 59 PHE  H      56 LEU  QD1     6.00
 59 PHE  H 56 LEU  QB 6.01 #comb_QB
 59 PHE  H 60 GLN  QG  6.51
# 59 PHE  H 60 GLN  HG3 6.51 #comb_QG
# 60 GLN  QG     45 THR  QG2      6.00 #merit0_vio_del
# 60 GLN  QG     47 GLN  QE2      6.50 #60.qg-59.qd_del
 60 GLN  QG     59 PHE  QD      6.51 #QG_OV_test
 60 GLN  QG 56 LEU  QQD 6.01 #QQD
 67 GLU  HA     78 LEU  QD2     6.01
 68 LYS  QD     78 LEU  QD1     5.00
 70 SER  H      74 LEU  QD1     5.50
 70 SER  H      78 LEU  QQD     6.01
# 70 SER  H      78 LEU  QD2     6.01 #comb_QQD
 71 LEU  H      68 LYS  HG2     6.01
 71 LEU  HG     72 THR  QG2     6.51
 71 LEU  HA     74 LEU  QD2     4.50
 71 LEU  HA     74 LEU  QD1     5.00
 71 LEU  HB3    75 THR  H       5.50
 71 LEU  HA     75 THR  QG2     5.50
 71 LEU  H      78 LEU  QD1     5.00
# 72 THR  HB     74 LEU  QD2     5.00 #QQD_ov
 72 THR  HB     74 LEU  QQD      6.00
# 72 THR  HA     74 LEU  QD2     5.50 #m2amb
# 72 THR  HA     74 LEU  QD1     6.00 #m2amb
 72 THR  QG2    78 LEU  QQD     5.50 #add
 72 THR  HB     78 LEU  QD1     6.51    #?
 72 THR  HA     79 LYS  HA      6.50
 72 THR  QG2    82 MET  QE      4.50
 73 ASN  H      71 LEU  H       4.50
 74 LEU  QD1    69 ALA  QB      6.01
 74 LEU  HB2    71 LEU  QD1     5.00
 74 LEU  HA     71 LEU  QD1     6.01
 74 LEU  HA     78 LEU  QD2     6.52
 78 LEU  QB     72 THR  QG2     6.00
 78 LEU  HG     72 THR  QG2     5.01
 78 LEU  QB     75 THR  QG2     6.00
 79 LYS  QG     74 LEU  QD2     6.50
 79 LYS  H      75 THR  QG2     6.50
 79 LYS  QE     75 THR  QG2     6.00
 13 PHE  QE     25 LEU  QD2     5.00
 13 PHE  HZ     25 LEU  QD2     5.50
# 13 PHE  HZ     25 LEU  QD1     5.00 #del_ov
 13 PHE  QD     25 LEU  QD2     5.50
 13 PHE  QE     29 VAL  QG1     6.50
 17 LEU  H      22 PRO  HA      6.50
 17 LEU  HA     24 ARG  HE      6.50
 17 LEU  H      25 LEU  QD2     5.00
 17 LEU  HA     25 LEU  QD2     5.00
 18 VAL  H      25 LEU  QD2     6.50
 20 LEU  QD1    24 ARG  H       5.50
 20 LEU  H      25 LEU  QD2     6.00
 20 LEU  HA     25 LEU  QD2     6.50
 20 LEU  QD1    28 ALA  QB      5.50 #add
 20 LEU  QD2    28 ALA  QB      4.00
 21 GLY  HA2    17 LEU  QQD     6.50 #w_0mir
 21 GLY  H      17 LEU  QQD     6.00
# 21 GLY  HA2    17 LEU  QD2     6.00 #QQD
# 21 GLY  H      17 LEU  QD2     6.00 #comb_QQD
 21 GLY  H      24 ARG  H       6.00
 21 GLY  H      25 LEU  QD2     6.50
 22 PRO  HA     17 LEU  QD1     4.50
 22 PRO  HA     17 LEU  QD2     4.50
 22 PRO  HA     25 LEU  QD2     5.50
 22 PRO  QG     17 LEU  QD1     6.00
# 22 PRO  HG3    17 LEU  QD1     6.00 #comb_QG
 22 PRO  QG     17 LEU  QD2     6.00 
# 22 PRO  HG3    17 LEU  QD2     6.00 #comb_QG
 22 PRO  QG     24 ARG  H       6.01 #comb_QG
# 22 PRO  HD3    17 LEU  QD2     6.00 #comb_QD
# 22 PRO  HD3    17 LEU  QD1     6.00 #comb_QD
 22 PRO  QD     17 LEU  QD2     6.00
 22 PRO  QD     17 LEU  QD1     6.00 
 23 GLN  H      24 ARG  HG3     5.01
 23 GLN  QB     26 PRO  QD      6.00
 24 ARG  HB2    20 LEU  QD1     6.50
 24 ARG  HG3    20 LEU  QD2     5.50
 24 ARG  HB3    20 LEU  QD2     6.50
 25 LEU  QD2    17 LEU  QB      4.50 #from_amb
 25 LEU  HA     20 LEU  QD2     5.00
 25 LEU  H      20 LEU  QD2     6.01
 27 VAL  H      24 ARG  QD      4.50
 45 THR  HB     47 GLN  QG      6.50 #QG
 45 THR  QG2    47 GLN  QG      6.52 #comb_QG
# 47 GLN  HG3    45 THR  QG2     5.50 #comb_QG
 45 THR  HA     48 ASN  HD22    6.51
 45 THR  HA     48 ASN  HD21    6.51
 45 THR  HA     48 ASN  QB      5.00 #comb_QB
# 45 THR  HA     48 ASN  HB3     6.00
 45 THR  HA     49 GLU  H       5.50
 45 THR  HA     50 LEU  H       6.00
# 45 THR  HA     51 THR  HB      6.52 #del_ov
 45 THR  H      50 LEU  QD2     6.52 
# 45 THR  H      51 THR  H       6.51 #del_vio
 47 GLN  HA     50 LEU  QD2     5.00
 47 GLN  HA     51 THR  H       5.00
 48 ASN  QB     45 THR  QG2     6.50 #QB
 48 ASN  QB     47 GLN  QG      6.50
 48 ASN  QB     47 GLN  QB      5.50    #comb_QB
# 48 ASN  HB3    47 GLN  HG3     6.00   #comb_QGQB
 48 ASN  QB     49 GLU  QB      5.50    #add
# 48 ASN  HB3    51 THR  QG2     5.50 #comb_QB
 48 ASN  QB     51 THR  QG2     5.50
 48 ASN  H      50 LEU  QQD     6.00
# 48 ASN  H      54 LEU  QQD     6.50 #del_vio
# 48 ASN  H      56 LEU  QQD     6.50 #del_vio
 48 ASN  HD22   51 THR  QG2     5.52
 48 ASN  HD22   44 THR  QG2     4.50
 48 ASN  HD21   51 THR  QG2     5.01
 48 ASN  HD21   44 THR  QG2     4.50
 49 GLU  H      44 THR  HA      6.01
 49 GLU  HA     47 GLN  H       6.00
 49 GLU  HA     51 THR  QG2     6.01
 49 GLU  H      51 THR  HA      5.50
 49 GLU  HA     52 GLN  QG      5.50
 49 GLU  HA     53 GLU  H       6.01
 49 GLU  HA     53 GLU  QB      5.00
 49 GLU  HA     54 LEU  H       6.53
 50 LEU  QD2    47 GLN  HG2     6.01
 50 LEU  H      53 GLU  H       5.50
 50 LEU  H      54 LEU  HB3     6.00
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     44 THR  HA      6.52
 51 THR  HB     50 LEU  QQD     5.50
# 51 THR  HB     50 LEU  QD2     5.50 #comb_QQD
 51 THR  HA     54 LEU  QB      6.01    
# 51 THR  HA    54 LEU  HB3     6.01    #comb_QB
 51 THR  HA     54 LEU  QQD     6.01
 51 THR  HB     54 LEU  H       6.01
 52 GLN  H      48 ASN  HA      6.50
 52 GLN  H      50 LEU  QD2     6.00
 52 GLN  H      54 LEU  QQD     6.50
 52 GLN  H      56 LEU  QD2     6.51
 53 GLU  H      50 LEU  QQD     6.01 #QQD
 53 GLU  QB     50 LEU  QD2     5.50
 53 GLU  H      51 THR  H       5.00
 54 LEU  H      50 LEU  QD2     5.50 
 55 LYS  H      52 GLN  QG      6.01 #QG
 55 LYS  QG     54 LEU  H       5.50 #modi_QG
 55 LYS  QG     56 LEU  HB3     5.52 #ov
 56 LEU  HB3    51 THR  H       6.01
 56 LEU  QD1    52 GLN  QG      6.50
 56 LEU  HA     59 PHE  QD      6.00
# 56 LEU  HA     59 PHE  HB3     5.50 #comb_QB
 56 LEU  HA     59 PHE  QB      5.00
# 56 LEU  HB3    59 PHE  QD      6.00   #comb_QB
 56 LEU  QB     59 PHE  QD      6.00
 57 GLN  QE2    51 THR  QG2     6.51 #n_w
 57 GLN  H      54 LEU  HA      5.50 #from_amb
 57 GLN  HE21   54 LEU  QQD     6.00
 57 GLN  QG     54 LEU  QQD     6.00
 57 GLN  HE22   54 LEU  QQD     6.00
 57 GLN  HE21   55 LYS  HA      6.00
 58 GLU  H      56 LEU  HA      6.00
 59 PHE  QD     50 LEU  QD2     6.00
 59 PHE  QD     54 LEU  QQD     6.00
 59 PHE  H      54 LEU  QQD     6.00
 59 PHE  QD     56 LEU  QQD     6.51
# 59 PHE  QD     56 LEU  QD2     6.51 #comb_QQD
 59 PHE  H      56 LEU  QD1     6.00
 59 PHE  H 56 LEU  QB 6.01 #comb_QB
 59 PHE  H 60 GLN  QG  6.51
# 59 PHE  H 60 GLN  HG3 6.51 #comb_QG
# 60 GLN  QG     45 THR  QG2      6.00 #merit0_vio_del
# 60 GLN  QG     47 GLN  QE2      6.50 #60.qg-59.qd_del
 60 GLN  QG     59 PHE  QD      6.51 #QG_OV_test
 60 GLN  QG 56 LEU  QQD 6.01 #QQD
 67 GLU  HA     78 LEU  QD2     6.01
 68 LYS  QD     78 LEU  QD1     5.00
 70 SER  H      74 LEU  QD1     5.50
 70 SER  H      78 LEU  QQD     6.01
# 70 SER  H      78 LEU  QD2     6.01 #comb_QQD
 71 LEU  H      68 LYS  HG2     6.01
 71 LEU  HG     72 THR  QG2     6.51
 71 LEU  HA     74 LEU  QD2     4.50
 71 LEU  HA     74 LEU  QD1     5.00
 71 LEU  HB3    75 THR  H       5.50
 71 LEU  HA     75 THR  QG2     5.50
 71 LEU  H      78 LEU  QD1     5.00
# 72 THR  HB     74 LEU  QD2     5.00 #QQD_ov
 72 THR  HB     74 LEU  QQD      6.00
# 72 THR  HA     74 LEU  QD2     5.50 #m2amb
# 72 THR  HA     74 LEU  QD1     6.00 #m2amb
 72 THR  QG2    78 LEU  QQD     5.50 #add
 72 THR  HB     78 LEU  QD1     6.51    #?
 72 THR  HA     79 LYS  HA      6.50
 72 THR  QG2    82 MET  QE      4.50
 73 ASN  H      71 LEU  H       4.50
 74 LEU  QD1    69 ALA  QB      6.01
 74 LEU  HB2    71 LEU  QD1     5.00
 74 LEU  HA     71 LEU  QD1     6.01
 74 LEU  HA     78 LEU  QD2     6.52
 78 LEU  QB     72 THR  QG2     6.00
 78 LEU  HG     72 THR  QG2     5.01
 78 LEU  QB     75 THR  QG2     6.00
 79 LYS  QG     74 LEU  QD2     6.50
 79 LYS  H      75 THR  QG2     6.50
 79 LYS  QE     75 THR  QG2     6.00


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