BMRB

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
629186 6gs5 RC 34283 cing 1-original 1 XPLOR/CNS distance NOE simple


# Restraints file 1: Cycle7_1_2rr.upl
! Distance constraint file from UNIO
! UNIO version 2.0.3
! File format   : cns
! File generated: 2018 June 11th, 20:08:57

assign  ((resid    3 and name HN   )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.32
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   3.45  1.65  0.00 ! #SUP  9.95
assign  ((resid    3 and name HN   )) ((resid    5 and name HN   ))   4.99  3.19  0.00 ! #SUP  7.94
assign  ((resid    3 and name HN   )) ((resid    4 and name HA   ))   4.97  3.17  0.00 ! #SUP  6.41
assign  ((resid    3 and name HN   )) ((resid    3 and name HA   ))   3.12  1.32  0.00 ! #SUP  6.17
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   2.83  1.03  0.00 ! #SUP  8.49
assign  ((resid    3 and name HN   )) ((resid    4 and name HB2  ))   4.61  2.81  0.00 ! #SUP  8.15
assign  ((resid    3 and name HN   )) ((resid    4 and name HB1  ))   5.23  3.43  0.00 ! #SUP  7.02
assign  ((resid    3 and name HN   )) ((resid    3 and name HG*  ))   3.43  1.63  0.00 ! #SUP  8.06
assign  ((resid    3 and name HN   )) ((resid    3 and name HB*  ))   2.91  1.11  0.00 ! #SUP  8.06
assign  ((resid    2 and name HG*  )) ((resid    3 and name HN   ))   3.55  1.75  0.00 ! #SUP  8.91
assign  ((resid    9 and name HN   )) ((resid   10 and name HN   ))   3.40  1.60  0.00 ! #SUP  8.71
assign  ((resid    8 and name HN   )) ((resid    9 and name HN   ))   3.40  1.60  0.00 ! #SUP  9.57
assign  ((resid    8 and name HA   )) ((resid    9 and name HN   ))   3.94  2.14  0.00 ! #SUP  6.16
assign  ((resid    5 and name HA   )) ((resid    9 and name HN   ))   4.55  2.75  0.00 ! #SUP  2.13
assign  ((resid    6 and name HA   )) ((resid    9 and name HN   ))   3.77  1.97  0.00 ! #SUP  6.84
assign  ((resid    9 and name HN   )) ((resid    9 and name HA   ))   3.24  1.44  0.00 ! #SUP  8.66
assign  ((resid    8 and name HB2  )) ((resid    9 and name HN   ))   3.47  1.67  0.00 ! #SUP  8.18
assign  ((resid    8 and name HB1  )) ((resid    9 and name HN   ))   3.56  1.76  0.00 ! #SUP  9.19
assign  ((resid    7 and name HB*  )) ((resid    9 and name HN   ))   5.20  3.40  0.00 ! #SUP  5.11
assign  ((resid    9 and name HN   )) ((resid    9 and name HB2  ))   3.02  1.22  0.00 ! #SUP  8.13
assign  ((resid    9 and name HN   )) ((resid    9 and name HG   ))   3.53  1.73  0.00 ! #SUP  7.06
assign  ((resid    9 and name HN   )) ((resid   12 and name HG11 ))   5.50  3.70  0.00 ! #SUP  4.24
assign  ((resid    9 and name HN   )) ((resid   13 and name HD*  ))   5.42  3.62  0.00 ! #SUP  3.87
assign  ((resid    9 and name HN   )) ((resid    9 and name HD*  ))   3.79  1.99  0.00 ! #SUP  9.02
assign  ((resid    9 and name HN   )) ((resid   12 and name HD1* ))   5.50  3.70  0.00 ! #SUP  5.98
assign  ((resid    3 and name HN   )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.32
assign  ((resid    4 and name HA   )) ((resid    6 and name HN   ))   4.64  2.84  0.00 ! #SUP 10.00
assign  ((resid    6 and name HN   )) ((resid    6 and name HB*  ))   2.86  1.06  0.00 ! #SUP  5.08
assign  ((resid    5 and name HB1  )) ((resid    6 and name HN   ))   3.55  1.75  0.00 ! #SUP  8.59
assign  ((resid    3 and name HG*  )) ((resid    6 and name HN   ))   5.45  3.65  0.00 ! #SUP  7.57
assign  ((resid    3 and name HB*  )) ((resid    6 and name HN   ))   5.01  3.21  0.00 ! #SUP  9.16
assign  ((resid    6 and name HN   )) ((resid    7 and name HB*  ))   4.74  2.94  0.00 ! #SUP  4.81
assign  ((resid    6 and name HN   )) ((resid    7 and name HN   ))   3.47  1.67  0.00 ! #SUP  7.50
assign  ((resid    5 and name HN   )) ((resid    6 and name HN   ))   3.30  1.50  0.00 ! #SUP  8.55
assign  ((resid    3 and name HA   )) ((resid    6 and name HN   ))   3.72  1.92  0.00 ! #SUP  6.44
assign  ((resid    4 and name HB2  )) ((resid    6 and name HN   ))   5.14  3.34  0.00 ! #SUP  8.24
assign  ((resid    4 and name HB1  )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP 10.00
assign  ((resid    5 and name HB2  )) ((resid    6 and name HN   ))   3.86  2.06  0.00 ! #SUP  6.16
assign  ((resid    6 and name HA   )) ((resid   10 and name HN   ))   3.85  2.05  0.00 ! #SUP  7.81
assign  ((resid   10 and name HN   )) ((resid   10 and name HA1  ))   2.91  1.11  0.00 ! #SUP  4.73
assign  ((resid   10 and name HN   )) ((resid   10 and name HA2  ))   2.90  1.10  0.00 ! #SUP  4.62
assign  ((resid    7 and name HB*  )) ((resid   10 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.77
assign  ((resid    9 and name HB2  )) ((resid   10 and name HN   ))   3.55  1.75  0.00 ! #SUP  7.36
assign  ((resid    9 and name HG   )) ((resid   10 and name HN   ))   3.85  2.05  0.00 ! #SUP  7.30
assign  ((resid   10 and name HN   )) ((resid   11 and name HB*  ))   4.79  2.99  0.00 ! #SUP  3.91
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   3.10  1.30  0.00 ! #SUP 10.00
assign  ((resid   13 and name HN   )) ((resid   13 and name HA   ))   3.39  1.59  0.00 ! #SUP  8.01
assign  ((resid   11 and name HA   )) ((resid   13 and name HN   ))   4.93  3.13  0.00 ! #SUP  4.06
assign  ((resid   12 and name HA   )) ((resid   13 and name HN   ))   3.76  1.96  0.00 ! #SUP  9.51
assign  ((resid    7 and name HB*  )) ((resid   10 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.77
assign  ((resid   13 and name HN   )) ((resid   13 and name HB1  ))   2.99  1.19  0.00 ! #SUP  7.31
assign  ((resid   13 and name HN   )) ((resid   13 and name HG   ))   4.46  2.66  0.00 ! #SUP  7.25
assign  ((resid   12 and name HG11 )) ((resid   13 and name HN   ))   3.99  2.19  0.00 ! #SUP  9.10
assign  ((resid   12 and name HG12 )) ((resid   13 and name HN   ))   4.32  2.52  0.00 ! #SUP  9.92
assign  ((resid   13 and name HN   )) ((resid   13 and name HD*  ))   3.88  2.08  0.00 ! #SUP  8.58
assign  ((resid   12 and name HD1* )) ((resid   13 and name HN   ))   4.98  3.18  0.00 ! #SUP  9.46
assign  ((resid    8 and name HN   )) ((resid   10 and name HN   ))   4.13  2.33  0.00 ! #SUP 10.00
assign  ((resid    7 and name HN   )) ((resid    8 and name HN   ))   3.47  1.67  0.00 ! #SUP 10.00
assign  ((resid    8 and name HN   )) ((resid   11 and name HN   ))   5.14  3.34  0.00 ! #SUP  8.11
assign  ((resid    8 and name HN   )) ((resid    8 and name HA   ))   3.35  1.55  0.00 ! #SUP  7.19
assign  ((resid    5 and name HA   )) ((resid    8 and name HN   ))   4.10  2.30  0.00 ! #SUP  4.23
assign  ((resid    7 and name HA   )) ((resid    8 and name HN   ))   3.73  1.93  0.00 ! #SUP  6.43
assign  ((resid    6 and name HB*  )) ((resid    8 and name HN   ))   5.16  3.36  0.00 ! #SUP  6.03
assign  ((resid    8 and name HN   )) ((resid    9 and name HA   ))   4.90  3.10  0.00 ! #SUP  7.91
assign  ((resid    8 and name HN   )) ((resid   11 and name HD2  ))   5.50  3.70  0.00 ! #SUP  3.40
assign  ((resid    8 and name HN   )) ((resid    8 and name HB2  ))   3.15  1.35  0.00 ! #SUP  8.81
assign  ((resid    8 and name HN   )) ((resid    8 and name HB1  ))   3.09  1.29  0.00 ! #SUP  9.86
assign  ((resid    7 and name HB*  )) ((resid    8 and name HN   ))   3.38  1.58  0.00 ! #SUP 10.00
assign  ((resid    8 and name HN   )) ((resid    9 and name HB2  ))   4.41  2.61  0.00 ! #SUP  8.05
assign  ((resid    7 and name HG2  )) ((resid    8 and name HN   ))   4.89  3.09  0.00 ! #SUP  7.23
assign  ((resid    7 and name HG1  )) ((resid    8 and name HN   ))   5.34  3.54  0.00 ! #SUP  7.05
assign  ((resid    8 and name HN   )) ((resid    9 and name HD*  ))   5.40  3.60  0.00 ! #SUP  9.26
assign  ((resid    2 and name HN   )) ((resid    3 and name HN   ))   4.21  2.41  0.00 ! #SUP  4.75
assign  ((resid    1 and name HA   )) ((resid    2 and name HN   ))   3.63  1.83  0.00 ! #SUP  2.24
assign  ((resid    2 and name HN   )) ((resid    2 and name HA   ))   3.81  2.01  0.00 ! #SUP  5.28
assign  ((resid    1 and name HB*  )) ((resid    2 and name HN   ))   3.83  2.03  0.00 ! #SUP  3.92
assign  ((resid    2 and name HN   )) ((resid    2 and name HB   ))   3.79  1.99  0.00 ! #SUP  3.87
assign  ((resid    2 and name HN   )) ((resid    2 and name HG*  ))   3.59  1.79  0.00 ! #SUP  5.39
assign  ((resid    7 and name HN   )) ((resid    9 and name HD*  ))   5.50  3.70  0.00 ! #SUP  4.22
assign  ((resid    6 and name HN   )) ((resid    7 and name HN   ))   3.45  1.65  0.00 ! #SUP  7.50
assign  ((resid    7 and name HN   )) ((resid    8 and name HN   ))   3.43  1.63  0.00 ! #SUP 10.00
assign  ((resid    5 and name HN   )) ((resid    7 and name HN   ))   4.87  3.07  0.00 ! #SUP  4.30
assign  ((resid    4 and name HA   )) ((resid    7 and name HN   ))   4.12  2.32  0.00 ! #SUP  7.62
assign  ((resid    5 and name HA   )) ((resid    7 and name HN   ))   4.67  2.87  0.00 ! #SUP  5.94
assign  ((resid    7 and name HN   )) ((resid    7 and name HA   ))   3.22  1.42  0.00 ! #SUP  7.45
assign  ((resid    6 and name HB*  )) ((resid    7 and name HN   ))   3.57  1.77  0.00 ! #SUP  7.81
assign  ((resid    5 and name HB1  )) ((resid    7 and name HN   ))   5.31  3.51  0.00 ! #SUP  5.19
assign  ((resid    3 and name HB*  )) ((resid    7 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.18
assign  ((resid    7 and name HN   )) ((resid    7 and name HB*  ))   3.11  1.31  0.00 ! #SUP 10.00
assign  ((resid    7 and name HN   )) ((resid    7 and name HD*  ))   4.67  2.87  0.00 ! #SUP  7.43
assign  ((resid    7 and name HN   )) ((resid    7 and name HG2  ))   3.80  2.00  0.00 ! #SUP  8.18
assign  ((resid    3 and name HN   )) ((resid    4 and name HN   ))   3.60  1.80  0.00 ! #SUP  9.95
assign  ((resid    4 and name HN   )) ((resid    6 and name HN   ))   5.21  3.41  0.00 ! #SUP  9.56
assign  ((resid    4 and name HN   )) ((resid    5 and name HN   ))   3.53  1.73  0.00 ! #SUP  9.24
assign  ((resid    4 and name HN   )) ((resid    4 and name HA   ))   3.47  1.67  0.00 ! #SUP  7.18
assign  ((resid    3 and name HA   )) ((resid    4 and name HN   ))   3.60  1.80  0.00 ! #SUP  5.89
assign  ((resid    2 and name HA   )) ((resid    4 and name HN   ))   4.57  2.77  0.00 ! #SUP  9.11
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   3.41  1.61  0.00 ! #SUP  7.86
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   3.42  1.62  0.00 ! #SUP  6.96
assign  ((resid    4 and name HN   )) ((resid    5 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.28
assign  ((resid    4 and name HN   )) ((resid    5 and name HB2  ))   5.45  3.65  0.00 ! #SUP  5.29
assign  ((resid    3 and name HG*  )) ((resid    4 and name HN   ))   4.30  2.50  0.00 ! #SUP  8.72
assign  ((resid    3 and name HB*  )) ((resid    4 and name HN   ))   3.68  1.88  0.00 ! #SUP  8.72
assign  ((resid    2 and name HB   )) ((resid    4 and name HN   ))   4.68  2.88  0.00 ! #SUP  6.31
assign  ((resid    2 and name HG*  )) ((resid    4 and name HN   ))   4.13  2.33  0.00 ! #SUP 10.00
assign  ((resid   12 and name HN   )) ((resid   13 and name HN   ))   3.00  1.20  0.00 ! #SUP 10.00
assign  ((resid    6 and name HA   )) ((resid   11 and name HN   ))   5.13  3.33  0.00 ! #SUP  3.55
assign  ((resid   12 and name HN   )) ((resid   12 and name HA   ))   3.34  1.54  0.00 ! #SUP  9.04
assign  ((resid   11 and name HN   )) ((resid   11 and name HB*  ))   2.86  1.06  0.00 ! #SUP  5.92
assign  ((resid   12 and name HN   )) ((resid   12 and name HB   ))   3.13  1.33  0.00 ! #SUP  7.59
assign  ((resid   11 and name HN   )) ((resid   11 and name HG2  ))   3.63  1.83  0.00 ! #SUP  6.77
assign  ((resid   11 and name HN   )) ((resid   11 and name HG1  ))   4.99  3.19  0.00 ! #SUP  6.07
assign  ((resid   12 and name HN   )) ((resid   12 and name HG11 ))   3.52  1.72  0.00 ! #SUP  8.52
assign  ((resid   12 and name HN   )) ((resid   12 and name HG12 ))   3.42  1.62  0.00 ! #SUP 10.00
assign  ((resid   12 and name HN   )) ((resid   13 and name HD*  ))   5.07  3.27  0.00 ! #SUP  7.50
assign  ((resid   12 and name HN   )) ((resid   12 and name HG2* ))   3.80  2.00  0.00 ! #SUP  8.70
assign  ((resid   12 and name HN   )) ((resid   12 and name HD1* ))   4.32  2.52  0.00 ! #SUP  9.06
assign  ((resid    8 and name HA   )) ((resid   11 and name HN   ))   4.23  2.43  0.00 ! #SUP  5.57
assign  ((resid   11 and name HN   )) ((resid   11 and name HA   ))   3.10  1.30  0.00 ! #SUP  5.18
assign  ((resid    4 and name HA   )) ((resid    5 and name HN   ))   3.93  2.13  0.00 ! #SUP  8.05
assign  ((resid    3 and name HG*  )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.34
assign  ((resid    3 and name HN   )) ((resid    5 and name HN   ))   5.08  3.28  0.00 ! #SUP  7.94
assign  ((resid    5 and name HN   )) ((resid    6 and name HN   ))   3.35  1.55  0.00 ! #SUP  8.55
assign  ((resid    4 and name HN   )) ((resid    5 and name HN   ))   3.48  1.68  0.00 ! #SUP  9.24
assign  ((resid    4 and name HB2  )) ((resid    5 and name HN   ))   4.08  2.28  0.00 ! #SUP  8.58
assign  ((resid    4 and name HB1  )) ((resid    5 and name HN   ))   3.95  2.15  0.00 ! #SUP  8.37
assign  ((resid    5 and name HN   )) ((resid    5 and name HB1  ))   3.46  1.66  0.00 ! #SUP  6.14
assign  ((resid    5 and name HN   )) ((resid    5 and name HB2  ))   3.40  1.60  0.00 ! #SUP  5.85
assign  ((resid    3 and name HB*  )) ((resid    5 and name HN   ))   5.24  3.44  0.00 ! #SUP  7.76
assign  ((resid    2 and name HG*  )) ((resid    5 and name HN   ))   4.09  2.29  0.00 ! #SUP  7.78
assign  ((resid    1 and name HA   )) ((resid    2 and name HN   ))   5.31  3.51  0.00 ! #SUP  2.24
assign  ((resid    1 and name HA   )) ((resid    1 and name HB*  ))   3.91  2.11  0.00 ! #SUP  1.61
assign  ((resid    4 and name HN   )) ((resid    4 and name HA   ))   4.56  2.76  0.00 ! #SUP  7.18
assign  ((resid    4 and name HA   )) ((resid    5 and name HN   ))   4.88  3.08  0.00 ! #SUP  8.05
assign  ((resid    4 and name HA   )) ((resid    4 and name HB2  ))   3.98  2.18  0.00 ! #SUP  6.23
assign  ((resid    4 and name HA   )) ((resid    4 and name HB1  ))   3.95  2.15  0.00 ! #SUP  5.24
assign  ((resid    4 and name HA   )) ((resid    7 and name HB*  ))   4.85  3.05  0.00 ! #SUP  5.62
assign  ((resid    8 and name HA   )) ((resid    9 and name HN   ))   5.18  3.38  0.00 ! #SUP  6.16
assign  ((resid    8 and name HN   )) ((resid    8 and name HA   ))   4.56  2.76  0.00 ! #SUP  7.19
assign  ((resid    8 and name HA   )) ((resid    8 and name HB2  ))   4.23  2.43  0.00 ! #SUP  5.21
assign  ((resid    8 and name HA   )) ((resid    8 and name HB1  ))   4.03  2.23  0.00 ! #SUP  5.64
assign  ((resid    8 and name HA   )) ((resid   11 and name HB*  ))   5.07  3.27  0.00 ! #SUP  5.61
assign  ((resid   13 and name HN   )) ((resid   13 and name HA   ))   4.65  2.85  0.00 ! #SUP  8.01
assign  ((resid   13 and name HA   )) ((resid   13 and name HB2  ))   4.28  2.48  0.00 ! #SUP  4.79
assign  ((resid   13 and name HA   )) ((resid   13 and name HG   ))   4.36  2.56  0.00 ! #SUP  4.95
assign  ((resid   13 and name HA   )) ((resid   13 and name HD*  ))   4.07  2.27  0.00 ! #SUP  6.16
assign  ((resid    3 and name HN   )) ((resid    3 and name HA   ))   4.19  2.39  0.00 ! #SUP  6.17
assign  ((resid    3 and name HA   )) ((resid    6 and name HN   ))   5.12  3.32  0.00 ! #SUP  6.44
assign  ((resid    3 and name HA   )) ((resid    4 and name HN   ))   4.73  2.93  0.00 ! #SUP  5.89
assign  ((resid    3 and name HA   )) ((resid    3 and name HG*  ))   4.34  2.54  0.00 ! #SUP  5.05
assign  ((resid    3 and name HA   )) ((resid    3 and name HB*  ))   3.78  1.98  0.00 ! #SUP  4.98
assign  ((resid    2 and name HG*  )) ((resid    3 and name HA   ))   5.50  3.70  0.00 ! #SUP  5.61
assign  ((resid    5 and name HA   )) ((resid    8 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.23
assign  ((resid    5 and name HA   )) ((resid    5 and name HB1  ))   4.93  3.13  0.00 ! #SUP  4.63
assign  ((resid    5 and name HA   )) ((resid    5 and name HB2  ))   4.75  2.95  0.00 ! #SUP  3.96
assign  ((resid    5 and name HA   )) ((resid    7 and name HN   ))   5.50  3.70  0.00 ! #SUP  5.94
assign  ((resid   11 and name HN   )) ((resid   11 and name HA   ))   3.87  2.07  0.00 ! #SUP  5.18
assign  ((resid   11 and name HA   )) ((resid   11 and name HD2  ))   4.85  3.05  0.00 ! #SUP  4.82
assign  ((resid    4 and name HB1  )) ((resid    5 and name HA   ))   5.34  3.54  0.00 ! #SUP  4.65
assign  ((resid   11 and name HA   )) ((resid   11 and name HG2  ))   4.79  2.99  0.00 ! #SUP  7.58
assign  ((resid   11 and name HA   )) ((resid   11 and name HG1  ))   4.76  2.96  0.00 ! #SUP  6.81
assign  ((resid   11 and name HA   )) ((resid   11 and name HB*  ))   3.75  1.95  0.00 ! #SUP  6.90
assign  ((resid    6 and name HA   )) ((resid   10 and name HN   ))   5.06  3.26  0.00 ! #SUP  7.81
assign  ((resid    7 and name HA   )) ((resid    8 and name HN   ))   4.77  2.97  0.00 ! #SUP  6.43
assign  ((resid    7 and name HN   )) ((resid    7 and name HA   ))   3.93  2.13  0.00 ! #SUP  7.45
assign  ((resid    6 and name HA   )) ((resid   10 and name HA1  ))   5.50  3.70  0.00 ! #SUP  5.72
assign  ((resid    6 and name HA   )) ((resid   10 and name HA2  ))   5.50  3.70  0.00 ! #SUP  5.68
assign  ((resid    7 and name HA   )) ((resid    7 and name HB*  ))   3.53  1.73  0.00 ! #SUP  7.49
assign  ((resid    7 and name HA   )) ((resid    7 and name HG2  ))   4.57  2.77  0.00 ! #SUP  5.81
assign  ((resid    7 and name HA   )) ((resid    7 and name HG1  ))   4.33  2.53  0.00 ! #SUP  5.84
assign  ((resid    6 and name HN   )) ((resid    6 and name HA   ))   3.78  1.98  0.00 ! #SUP  4.44
assign  ((resid    6 and name HA   )) ((resid    9 and name HB2  ))   4.17  2.37  0.00 ! #SUP  7.66
assign  ((resid    6 and name HA   )) ((resid    9 and name HG   ))   4.75  2.95  0.00 ! #SUP  4.37
assign  ((resid    6 and name HA   )) ((resid    9 and name HD*  ))   4.57  2.77  0.00 ! #SUP  6.37
assign  ((resid    6 and name HN   )) ((resid    6 and name HB*  ))   3.35  1.55  0.00 ! #SUP  5.08
assign  ((resid    6 and name HB*  )) ((resid    7 and name HN   ))   4.08  2.28  0.00 ! #SUP  7.81
assign  ((resid    3 and name HA   )) ((resid    6 and name HB*  ))   4.46  2.66  0.00 ! #SUP  2.76
assign  ((resid    6 and name HB*  )) ((resid   10 and name HA1  ))   4.40  2.60  0.00 ! #SUP  2.47
assign  ((resid    3 and name HB*  )) ((resid    6 and name HB*  ))   5.09  3.29  0.00 ! #SUP  3.44
assign  ((resid   12 and name HA   )) ((resid   13 and name HN   ))   4.36  2.56  0.00 ! #SUP  9.51
assign  ((resid   12 and name HN   )) ((resid   12 and name HA   ))   3.78  1.98  0.00 ! #SUP  9.04
assign  ((resid   12 and name HA   )) ((resid   12 and name HB   ))   3.56  1.76  0.00 ! #SUP  7.31
assign  ((resid   12 and name HA   )) ((resid   12 and name HG11 ))   4.54  2.74  0.00 ! #SUP  8.14
assign  ((resid   12 and name HA   )) ((resid   12 and name HG12 ))   4.20  2.40  0.00 ! #SUP  9.82
assign  ((resid   12 and name HA   )) ((resid   13 and name HD*  ))   5.50  3.70  0.00 ! #SUP  7.25
assign  ((resid   12 and name HA   )) ((resid   12 and name HD1* ))   4.47  2.67  0.00 ! #SUP  8.76
assign  ((resid    2 and name HN   )) ((resid    2 and name HA   ))   4.12  2.32  0.00 ! #SUP  5.28
assign  ((resid    2 and name HA   )) ((resid    5 and name HB1  ))   4.88  3.08  0.00 ! #SUP  4.66
assign  ((resid    2 and name HA   )) ((resid    5 and name HB2  ))   5.37  3.57  0.00 ! #SUP  4.92
assign  ((resid    2 and name HA   )) ((resid    2 and name HB   ))   3.62  1.82  0.00 ! #SUP  4.16
assign  ((resid    2 and name HA   )) ((resid    2 and name HG*  ))   3.47  1.67  0.00 ! #SUP  6.31
assign  ((resid    2 and name HA   )) ((resid    3 and name HN   ))   3.35  1.55  0.00 ! #SUP  8.49
assign  ((resid    2 and name HA   )) ((resid    4 and name HN   ))   5.35  3.55  0.00 ! #SUP  9.11
assign  ((resid    1 and name HB*  )) ((resid    2 and name HA   ))   5.45  3.65  0.00 ! #SUP  3.74
assign  ((resid    2 and name HA   )) ((resid    3 and name HG*  ))   5.49  3.69  0.00 ! #SUP  6.17
assign  ((resid    2 and name HA   )) ((resid    3 and name HB*  ))   4.79  2.99  0.00 ! #SUP  6.60
assign  ((resid   10 and name HA1  )) ((resid   13 and name HD*  ))   5.50  3.70  0.00 ! #SUP  4.77
assign  ((resid    9 and name HN   )) ((resid   10 and name HA1  ))   5.47  3.67  0.00 ! #SUP  3.28
assign  ((resid   10 and name HN   )) ((resid   10 and name HA1  ))   3.41  1.61  0.00 ! #SUP  4.73
assign  ((resid   10 and name HA1  )) ((resid   11 and name HN   ))   4.17  2.37  0.00 ! #SUP  3.98
assign  ((resid   10 and name HA2  )) ((resid   10 and name HA1  ))   2.86  1.06  0.00 ! #SUP  2.88
assign  ((resid   10 and name HA1  )) ((resid   13 and name HB1  ))   5.30  3.50  0.00 ! #SUP  2.92
assign  ((resid    8 and name HB1  )) ((resid    9 and name HA   ))   5.50  3.70  0.00 ! #SUP  7.47
assign  ((resid    9 and name HN   )) ((resid    9 and name HA   ))   3.81  2.01  0.00 ! #SUP  8.66
assign  ((resid   10 and name HN   )) ((resid   10 and name HA2  ))   3.31  1.51  0.00 ! #SUP  4.62
assign  ((resid    9 and name HA   )) ((resid   12 and name HB   ))   4.21  2.41  0.00 ! #SUP  4.55
assign  ((resid   10 and name HA2  )) ((resid   13 and name HB1  ))   4.39  2.59  0.00 ! #SUP  3.14
assign  ((resid    9 and name HA   )) ((resid    9 and name HB2  ))   3.72  1.92  0.00 ! #SUP  7.28
assign  ((resid    9 and name HA   )) ((resid    9 and name HG   ))   3.74  1.94  0.00 ! #SUP  6.23
assign  ((resid    9 and name HA   )) ((resid   12 and name HG11 ))   4.64  2.84  0.00 ! #SUP  8.57
assign  ((resid    9 and name HA   )) ((resid   12 and name HG12 ))   4.31  2.51  0.00 ! #SUP  5.94
assign  ((resid    9 and name HA   )) ((resid   13 and name HD*  ))   4.79  2.99  0.00 ! #SUP  7.41
assign  ((resid    9 and name HA   )) ((resid    9 and name HD*  ))   3.47  1.67  0.00 ! #SUP  7.89
assign  ((resid    9 and name HA   )) ((resid   12 and name HD1* ))   4.73  2.93  0.00 ! #SUP 10.00
assign  ((resid    3 and name HB*  )) ((resid    4 and name HB2  ))   5.05  3.25  0.00 ! #SUP  7.25
assign  ((resid    1 and name HB*  )) ((resid    2 and name HN   ))   3.90  2.10  0.00 ! #SUP  3.92
assign  ((resid    4 and name HN   )) ((resid    4 and name HB2  ))   3.62  1.82  0.00 ! #SUP  7.86
assign  ((resid    4 and name HB2  )) ((resid    5 and name HN   ))   4.44  2.64  0.00 ! #SUP  8.58
assign  ((resid    1 and name HA   )) ((resid    1 and name HB*  ))   3.24  1.44  0.00 ! #SUP  1.61
assign  ((resid    1 and name HB*  )) ((resid    2 and name HA   ))   4.78  2.98  0.00 ! #SUP  3.74
assign  ((resid    1 and name HB*  )) ((resid    2 and name HG*  ))   4.27  2.47  0.00 ! #SUP  3.74
assign  ((resid    3 and name HN   )) ((resid    4 and name HB2  ))   4.84  3.04  0.00 ! #SUP  8.15
assign  ((resid    4 and name HB2  )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP  8.24
assign  ((resid    4 and name HA   )) ((resid    4 and name HB2  ))   3.29  1.49  0.00 ! #SUP  6.23
assign  ((resid    4 and name HB2  )) ((resid    5 and name HB2  ))   5.50  3.70  0.00 ! #SUP  4.64
assign  ((resid    3 and name HG*  )) ((resid    4 and name HB2  ))   5.50  3.70  0.00 ! #SUP  7.26
assign  ((resid   11 and name HD1  )) ((resid   11 and name HD2  ))   2.72  0.92  0.00 ! #SUP  4.37
assign  ((resid   11 and name HG1  )) ((resid   11 and name HD2  ))   4.09  2.29  0.00 ! #SUP  5.64
assign  ((resid   11 and name HA   )) ((resid   11 and name HD2  ))   4.26  2.46  0.00 ! #SUP  4.82
assign  ((resid   11 and name HB*  )) ((resid   11 and name HD2  ))   4.20  2.40  0.00 ! #SUP  5.55
assign  ((resid   11 and name HG2  )) ((resid   11 and name HD2  ))   4.11  2.31  0.00 ! #SUP  6.25
assign  ((resid    3 and name HN   )) ((resid    4 and name HB1  ))   5.50  3.70  0.00 ! #SUP  7.02
assign  ((resid    4 and name HN   )) ((resid    4 and name HB1  ))   3.58  1.78  0.00 ! #SUP  6.96
assign  ((resid    4 and name HB1  )) ((resid    5 and name HN   ))   4.17  2.37  0.00 ! #SUP  8.37
assign  ((resid    4 and name HA   )) ((resid    4 and name HB1  ))   3.24  1.44  0.00 ! #SUP  5.24
assign  ((resid   11 and name HD2  )) ((resid   11 and name HD1  ))   2.62  0.82  0.00 ! #SUP  4.37
assign  ((resid   11 and name HG2  )) ((resid   11 and name HD1  ))   4.11  2.31  0.00 ! #SUP  6.72
assign  ((resid   11 and name HG1  )) ((resid   11 and name HD1  ))   4.03  2.23  0.00 ! #SUP  5.98
assign  ((resid    2 and name HG*  )) ((resid    4 and name HB1  ))   5.06  3.26  0.00 ! #SUP  5.87
assign  ((resid    4 and name HB1  )) ((resid    5 and name HA   ))   4.31  2.51  0.00 ! #SUP  4.65
assign  ((resid   11 and name HB*  )) ((resid   11 and name HD1  ))   4.19  2.39  0.00 ! #SUP  5.95
assign  ((resid    8 and name HB2  )) ((resid    9 and name HA   ))   5.33  3.53  0.00 ! #SUP  6.55
assign  ((resid    8 and name HB2  )) ((resid    9 and name HN   ))   3.73  1.93  0.00 ! #SUP  8.18
assign  ((resid    8 and name HN   )) ((resid    8 and name HB2  ))   3.36  1.56  0.00 ! #SUP  8.81
assign  ((resid    7 and name HN   )) ((resid    8 and name HB2  ))   5.25  3.45  0.00 ! #SUP  6.06
assign  ((resid    8 and name HA   )) ((resid    8 and name HB2  ))   3.51  1.71  0.00 ! #SUP  5.21
assign  ((resid    5 and name HA   )) ((resid    8 and name HB2  ))   4.06  2.26  0.00 ! #SUP  2.25
assign  ((resid    8 and name HB1  )) ((resid    8 and name HB2  ))   2.83  1.03  0.00 ! #SUP  7.20
assign  ((resid    7 and name HB*  )) ((resid    8 and name HB2  ))   5.50  3.70  0.00 ! #SUP  6.74
assign  ((resid    8 and name HB2  )) ((resid    9 and name HD*  ))   5.50  3.70  0.00 ! #SUP  7.34
assign  ((resid    8 and name HB2  )) ((resid   10 and name HN   ))   5.50  3.70  0.00 ! #SUP  6.37
assign  ((resid    5 and name HB2  )) ((resid    5 and name HB1  ))   2.95  1.15  0.00 ! #SUP  4.86
assign  ((resid    4 and name HN   )) ((resid    5 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.28
assign  ((resid    5 and name HN   )) ((resid    5 and name HB1  ))   3.68  1.88  0.00 ! #SUP  6.14
assign  ((resid    5 and name HA   )) ((resid    5 and name HB1  ))   3.59  1.79  0.00 ! #SUP  4.63
assign  ((resid    2 and name HA   )) ((resid    5 and name HB1  ))   4.52  2.72  0.00 ! #SUP  4.66
assign  ((resid    8 and name HB1  )) ((resid    9 and name HA   ))   5.50  3.70  0.00 ! #SUP  7.47
assign  ((resid    2 and name HB   )) ((resid    5 and name HB1  ))   5.15  3.35  0.00 ! #SUP  4.74
assign  ((resid    2 and name HG*  )) ((resid    5 and name HB1  ))   4.41  2.61  0.00 ! #SUP  6.41
assign  ((resid    8 and name HB1  )) ((resid    9 and name HN   ))   3.60  1.80  0.00 ! #SUP  9.19
assign  ((resid    8 and name HB1  )) ((resid   10 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.42
assign  ((resid    8 and name HN   )) ((resid    8 and name HB1  ))   3.27  1.47  0.00 ! #SUP  9.86
assign  ((resid    5 and name HB1  )) ((resid    7 and name HN   ))   5.09  3.29  0.00 ! #SUP  5.19
assign  ((resid    8 and name HA   )) ((resid    8 and name HB1  ))   3.30  1.50  0.00 ! #SUP  5.64
assign  ((resid    5 and name HB1  )) ((resid    6 and name HA   ))   4.93  3.13  0.00 ! #SUP  3.22
assign  ((resid    4 and name HB1  )) ((resid    5 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.25
assign  ((resid    7 and name HB*  )) ((resid    8 and name HB1  ))   5.44  3.64  0.00 ! #SUP  6.90
assign  ((resid    8 and name HB1  )) ((resid    9 and name HB2  ))   4.94  3.14  0.00 ! #SUP  7.16
assign  ((resid    8 and name HB1  )) ((resid   12 and name HG11 ))   5.50  3.70  0.00 ! #SUP  3.88
assign  ((resid    8 and name HB1  )) ((resid   12 and name HD1* ))   5.50  3.70  0.00 ! #SUP  5.51
assign  ((resid    7 and name HN   )) ((resid    7 and name HE*  ))   5.50  3.70  0.00 ! #SUP  7.17
assign  ((resid    7 and name HA   )) ((resid    7 and name HE*  ))   5.50  3.70  0.00 ! #SUP  5.12
assign  ((resid    7 and name HB*  )) ((resid    7 and name HE*  ))   5.25  3.45  0.00 ! #SUP  7.16
assign  ((resid    7 and name HD*  )) ((resid    7 and name HE*  ))   3.65  1.85  0.00 ! #SUP  4.84
assign  ((resid    7 and name HG2  )) ((resid    7 and name HE*  ))   4.56  2.76  0.00 ! #SUP  5.73
assign  ((resid    7 and name HG1  )) ((resid    7 and name HE*  ))   4.50  2.70  0.00 ! #SUP  5.41
assign  ((resid    5 and name HB1  )) ((resid    5 and name HB2  ))   3.00  1.20  0.00 ! #SUP  4.86
assign  ((resid    5 and name HB2  )) ((resid    6 and name HN   ))   4.27  2.47  0.00 ! #SUP  6.16
assign  ((resid    5 and name HN   )) ((resid    5 and name HB2  ))   3.71  1.91  0.00 ! #SUP  5.85
assign  ((resid    5 and name HA   )) ((resid    5 and name HB2  ))   3.87  2.07  0.00 ! #SUP  3.96
assign  ((resid    2 and name HG*  )) ((resid    5 and name HB2  ))   4.84  3.04  0.00 ! #SUP  5.94
assign  ((resid    2 and name HA   )) ((resid    5 and name HB2  ))   5.01  3.21  0.00 ! #SUP  4.92
assign  ((resid    2 and name HB   )) ((resid    5 and name HB2  ))   5.50  3.70  0.00 ! #SUP  4.27
assign  ((resid    3 and name HN   )) ((resid    3 and name HG*  ))   3.64  1.84  0.00 ! #SUP  8.06
assign  ((resid    3 and name HG*  )) ((resid    4 and name HN   ))   4.35  2.55  0.00 ! #SUP  8.72
assign  ((resid    3 and name HG*  )) ((resid    5 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.34
assign  ((resid    3 and name HA   )) ((resid    3 and name HG*  ))   3.42  1.62  0.00 ! #SUP  5.05
assign  ((resid    2 and name HA   )) ((resid    3 and name HG*  ))   4.59  2.79  0.00 ! #SUP  6.17
assign  ((resid    3 and name HB*  )) ((resid    3 and name HG*  ))   2.85  1.05  0.00 ! #SUP  6.93
assign  ((resid    3 and name HG*  )) ((resid    7 and name HD*  ))   5.50  3.70  0.00 ! #SUP  1.90
assign  ((resid    2 and name HG*  )) ((resid    3 and name HG*  ))   5.01  3.21  0.00 ! #SUP  6.64
assign  ((resid    3 and name HG*  )) ((resid    4 and name HA   ))   5.04  3.24  0.00 ! #SUP  5.78
assign  ((resid    3 and name HG*  )) ((resid    7 and name HE*  ))   5.50  3.70  0.00 ! #SUP  0.99
assign  ((resid    3 and name HN   )) ((resid    3 and name HB*  ))   3.36  1.56  0.00 ! #SUP  8.06
assign  ((resid    3 and name HB*  )) ((resid    4 and name HN   ))   4.09  2.29  0.00 ! #SUP  8.72
assign  ((resid    3 and name HB*  )) ((resid    4 and name HA   ))   5.50  3.70  0.00 ! #SUP  5.78
assign  ((resid    3 and name HA   )) ((resid    3 and name HB*  ))   3.20  1.40  0.00 ! #SUP  4.98
assign  ((resid    2 and name HA   )) ((resid    3 and name HB*  ))   4.60  2.80  0.00 ! #SUP  6.60
assign  ((resid    3 and name HB*  )) ((resid    3 and name HG*  ))   3.08  1.28  0.00 ! #SUP  6.93
assign  ((resid    3 and name HB*  )) ((resid    6 and name HN   ))   5.50  3.70  0.00 ! #SUP  9.16
assign  ((resid    2 and name HG*  )) ((resid    3 and name HB*  ))   5.50  3.70  0.00 ! #SUP  6.97
assign  ((resid    2 and name HB   )) ((resid    3 and name HN   ))   3.90  2.10  0.00 ! #SUP  5.45
assign  ((resid   10 and name HN   )) ((resid   11 and name HB*  ))   5.06  3.26  0.00 ! #SUP  3.91
assign  ((resid    2 and name HN   )) ((resid    2 and name HB   ))   3.78  1.98  0.00 ! #SUP  3.87
assign  ((resid    2 and name HA   )) ((resid    2 and name HB   ))   3.32  1.52  0.00 ! #SUP  4.16
assign  ((resid   11 and name HB*  )) ((resid   11 and name HG2  ))   3.79  1.99  0.00 ! #SUP  8.72
assign  ((resid   11 and name HB*  )) ((resid   13 and name HD*  ))   5.17  3.37  0.00 ! #SUP  4.31
assign  ((resid    2 and name HG*  )) ((resid    2 and name HB   ))   3.07  1.27  0.00 ! #SUP  4.18
assign  ((resid   11 and name HN   )) ((resid   11 and name HB*  ))   3.20  1.40  0.00 ! #SUP  5.92
assign  ((resid    8 and name HA   )) ((resid   11 and name HB*  ))   4.13  2.33  0.00 ! #SUP  5.61
assign  ((resid   11 and name HA   )) ((resid   11 and name HB*  ))   3.32  1.52  0.00 ! #SUP  6.90
assign  ((resid   11 and name HB*  )) ((resid   11 and name HD1  ))   4.10  2.30  0.00 ! #SUP  5.95
assign  ((resid   11 and name HB*  )) ((resid   12 and name HG11 ))   5.12  3.32  0.00 ! #SUP  7.84
assign  ((resid    2 and name HB   )) ((resid    6 and name HA   ))   4.93  3.13  0.00 ! #SUP  1.78
assign  ((resid    8 and name HN   )) ((resid   11 and name HB*  ))   5.50  3.70  0.00 ! #SUP  6.52
assign  ((resid   11 and name HB*  )) ((resid   11 and name HG1  ))   3.63  1.83  0.00 ! #SUP  7.71
assign  ((resid    4 and name HB1  )) ((resid    7 and name HB*  ))   5.17  3.37  0.00 ! #SUP  3.74
assign  ((resid    7 and name HB*  )) ((resid    8 and name HB2  ))   5.10  3.30  0.00 ! #SUP  6.74
assign  ((resid    6 and name HN   )) ((resid    7 and name HB*  ))   5.25  3.45  0.00 ! #SUP  4.81
assign  ((resid    7 and name HN   )) ((resid    7 and name HB*  ))   3.45  1.65  0.00 ! #SUP 10.00
assign  ((resid    4 and name HA   )) ((resid    7 and name HB*  ))   3.95  2.15  0.00 ! #SUP  5.62
assign  ((resid    6 and name HB*  )) ((resid    7 and name HB*  ))   5.39  3.59  0.00 ! #SUP  6.15
assign  ((resid    7 and name HB*  )) ((resid    7 and name HG2  ))   3.75  1.95  0.00 ! #SUP  8.30
assign  ((resid    7 and name HB*  )) ((resid    8 and name HN   ))   3.85  2.05  0.00 ! #SUP 10.00
assign  ((resid    7 and name HB*  )) ((resid    8 and name HB1  ))   5.04  3.24  0.00 ! #SUP  6.90
assign  ((resid    7 and name HB*  )) ((resid    7 and name HE*  ))   4.76  2.96  0.00 ! #SUP  7.16
assign  ((resid    7 and name HB*  )) ((resid    7 and name HD*  ))   3.96  2.16  0.00 ! #SUP  7.38
assign  ((resid    7 and name HB*  )) ((resid   10 and name HN   ))   5.50  3.70  0.00 ! #SUP  4.77
assign  ((resid    7 and name HA   )) ((resid    7 and name HB*  ))   3.24  1.44  0.00 ! #SUP  7.49
assign  ((resid    7 and name HB*  )) ((resid    7 and name HG1  ))   4.02  2.22  0.00 ! #SUP  7.80
assign  ((resid   12 and name HB   )) ((resid   12 and name HG12 ))   4.01  2.21  0.00 ! #SUP  7.74
assign  ((resid   12 and name HN   )) ((resid   12 and name HB   ))   3.34  1.54  0.00 ! #SUP  7.59
assign  ((resid   12 and name HA   )) ((resid   12 and name HB   ))   3.30  1.50  0.00 ! #SUP  7.31
assign  ((resid    9 and name HA   )) ((resid   12 and name HB   ))   3.92  2.12  0.00 ! #SUP  4.55
assign  ((resid   12 and name HB   )) ((resid   12 and name HG11 ))   3.72  1.92  0.00 ! #SUP  6.72
assign  ((resid   12 and name HG2* )) ((resid   12 and name HB   ))   3.42  1.62  0.00 ! #SUP  6.81
assign  ((resid   12 and name HB   )) ((resid   12 and name HD1* ))   3.83  2.03  0.00 ! #SUP  7.27
assign  ((resid   12 and name HB   )) ((resid   13 and name HN   ))   3.43  1.63  0.00 ! #SUP  8.52
assign  ((resid   13 and name HN   )) ((resid   13 and name HB1  ))   3.35  1.55  0.00 ! #SUP  7.31
assign  ((resid   13 and name HA   )) ((resid   13 and name HB2  ))   3.53  1.73  0.00 ! #SUP  4.79
assign  ((resid   13 and name HB2  )) ((resid   13 and name HG   ))   2.83  1.03  0.00 ! #SUP  4.32
assign  ((resid   13 and name HN   )) ((resid   13 and name HB1  ))   3.30  1.50  0.00 ! #SUP  7.31
assign  ((resid    8 and name HN   )) ((resid   11 and name HG2  ))   5.50  3.70  0.00 ! #SUP  6.26
assign  ((resid   13 and name HA   )) ((resid   13 and name HB2  ))   3.56  1.76  0.00 ! #SUP  4.79
assign  ((resid   13 and name HB1  )) ((resid   13 and name HD*  ))   3.15  1.35  0.00 ! #SUP  5.96
assign  ((resid   11 and name HN   )) ((resid   11 and name HG2  ))   3.96  2.16  0.00 ! #SUP  6.77
assign  ((resid   11 and name HA   )) ((resid   11 and name HG2  ))   4.05  2.25  0.00 ! #SUP  7.58
assign  ((resid   11 and name HG2  )) ((resid   12 and name HG12 ))   5.17  3.37  0.00 ! #SUP  9.10
assign  ((resid   11 and name HG2  )) ((resid   11 and name HD2  ))   4.00  2.20  0.00 ! #SUP  6.25
assign  ((resid   11 and name HG2  )) ((resid   11 and name HD1  ))   4.01  2.21  0.00 ! #SUP  6.72
assign  ((resid   11 and name HB*  )) ((resid   11 and name HG2  ))   3.54  1.74  0.00 ! #SUP  8.72
assign  ((resid   11 and name HG2  )) ((resid   12 and name HG11 ))   4.64  2.84  0.00 ! #SUP  7.95
assign  ((resid   11 and name HG2  )) ((resid   12 and name HD1* ))   5.30  3.50  0.00 ! #SUP  8.89
assign  ((resid   10 and name HA2  )) ((resid   13 and name HB1  ))   4.35  2.55  0.00 ! #SUP  3.14
assign  ((resid    7 and name HN   )) ((resid    7 and name HD*  ))   5.23  3.43  0.00 ! #SUP  7.43
assign  ((resid    7 and name HD*  )) ((resid    7 and name HE*  ))   3.81  2.01  0.00 ! #SUP  4.84
assign  ((resid    7 and name HB*  )) ((resid    7 and name HD*  ))   3.98  2.18  0.00 ! #SUP  7.38
assign  ((resid    7 and name HG1  )) ((resid    7 and name HD*  ))   3.89  2.09  0.00 ! #SUP  4.43
assign  ((resid    9 and name HN   )) ((resid    9 and name HB2  ))   3.41  1.61  0.00 ! #SUP  8.13
assign  ((resid    9 and name HB2  )) ((resid   10 and name HN   ))   3.88  2.08  0.00 ! #SUP  7.36
assign  ((resid    8 and name HN   )) ((resid    9 and name HB2  ))   4.98  3.18  0.00 ! #SUP  8.05
assign  ((resid   11 and name HN   )) ((resid   11 and name HG1  ))   4.11  2.31  0.00 ! #SUP  6.07
assign  ((resid   11 and name HA   )) ((resid   11 and name HG1  ))   4.08  2.28  0.00 ! #SUP  6.81
assign  ((resid    6 and name HA   )) ((resid    9 and name HB2  ))   3.93  2.13  0.00 ! #SUP  7.66
assign  ((resid   11 and name HG1  )) ((resid   11 and name HD2  ))   4.04  2.24  0.00 ! #SUP  5.64
assign  ((resid   11 and name HG1  )) ((resid   11 and name HD1  ))   3.96  2.16  0.00 ! #SUP  5.98
assign  ((resid   11 and name HB*  )) ((resid   11 and name HG1  ))   3.60  1.80  0.00 ! #SUP  7.71
assign  ((resid    9 and name HB2  )) ((resid    9 and name HG   ))   2.88  1.08  0.00 ! #SUP  5.03
assign  ((resid    9 and name HA   )) ((resid    9 and name HB2  ))   3.48  1.68  0.00 ! #SUP  7.28
assign  ((resid   11 and name HG1  )) ((resid   12 and name HG12 ))   5.50  3.70  0.00 ! #SUP  7.53
assign  ((resid    9 and name HB2  )) ((resid    9 and name HD*  ))   3.48  1.68  0.00 ! #SUP  7.41
assign  ((resid    8 and name HB1  )) ((resid    9 and name HB2  ))   5.23  3.43  0.00 ! #SUP  7.16
assign  ((resid    9 and name HN   )) ((resid    9 and name HB1  ))   3.54  1.74  0.00 ! #SUP  7.55
assign  ((resid    8 and name HN   )) ((resid    9 and name HB1  ))   5.50  3.70  0.00 ! #SUP  6.32
assign  ((resid    8 and name HB1  )) ((resid    9 and name HB1  ))   5.50  3.70  0.00 ! #SUP  5.98
assign  ((resid    9 and name HB1  )) ((resid    9 and name HD*  ))   3.52  1.72  0.00 ! #SUP  6.61
assign  ((resid   13 and name HN   )) ((resid   13 and name HG   ))   3.77  1.97  0.00 ! #SUP  7.25
assign  ((resid   13 and name HA   )) ((resid   13 and name HG   ))   3.42  1.62  0.00 ! #SUP  4.95
assign  ((resid    9 and name HA   )) ((resid    9 and name HB1  ))   3.81  2.01  0.00 ! #SUP  6.65
assign  ((resid   13 and name HB2  )) ((resid   13 and name HG   ))   2.83  1.03  0.00 ! #SUP  4.32
assign  ((resid   13 and name HD*  )) ((resid   13 and name HG   ))   3.38  1.58  0.00 ! #SUP  5.56
assign  ((resid    9 and name HN   )) ((resid    9 and name HG   ))   3.87  2.07  0.00 ! #SUP  7.06
assign  ((resid    9 and name HG   )) ((resid   10 and name HN   ))   4.19  2.39  0.00 ! #SUP  7.30
assign  ((resid    9 and name HG   )) ((resid   11 and name HN   ))   5.50  3.70  0.00 ! #SUP  3.68
assign  ((resid    6 and name HA   )) ((resid    9 and name HG   ))   4.34  2.54  0.00 ! #SUP  4.37
assign  ((resid    9 and name HA   )) ((resid    9 and name HG   ))   3.53  1.73  0.00 ! #SUP  6.23
assign  ((resid    9 and name HB2  )) ((resid    9 and name HG   ))   2.83  1.03  0.00 ! #SUP  5.03
assign  ((resid    9 and name HD*  )) ((resid    9 and name HG   ))   3.79  1.99  0.00 ! #SUP  6.40
assign  ((resid    7 and name HG2  )) ((resid    8 and name HN   ))   5.50  3.70  0.00 ! #SUP  7.23
assign  ((resid    7 and name HN   )) ((resid    7 and name HG2  ))   4.21  2.41  0.00 ! #SUP  8.18
assign  ((resid    7 and name HA   )) ((resid    7 and name HG2  ))   4.12  2.32  0.00 ! #SUP  5.81
assign  ((resid    7 and name HG2  )) ((resid    7 and name HE*  ))   4.46  2.66  0.00 ! #SUP  5.73
assign  ((resid    4 and name HA   )) ((resid    7 and name HG2  ))   5.50  3.70  0.00 ! #SUP  2.92
assign  ((resid    6 and name HB*  )) ((resid    7 and name HG2  ))   5.50  3.70  0.00 ! #SUP  5.19
assign  ((resid    7 and name HB*  )) ((resid    7 and name HG2  ))   3.87  2.07  0.00 ! #SUP  8.30
assign  ((resid    7 and name HG1  )) ((resid    7 and name HE*  ))   4.38  2.58  0.00 ! #SUP  5.41
assign  ((resid   12 and name HG11 )) ((resid   13 and name HN   ))   4.46  2.66  0.00 ! #SUP  9.10
assign  ((resid    7 and name HN   )) ((resid    7 and name HG1  ))   4.38  2.58  0.00 ! #SUP  7.85
assign  ((resid   12 and name HN   )) ((resid   12 and name HG11 ))   3.84  2.04  0.00 ! #SUP  8.52
assign  ((resid    4 and name HA   )) ((resid    7 and name HG1  ))   4.88  3.08  0.00 ! #SUP  3.09
assign  ((resid    7 and name HA   )) ((resid    7 and name HG1  ))   4.05  2.25  0.00 ! #SUP  5.84
assign  ((resid   12 and name HA   )) ((resid   12 and name HG11 ))   4.33  2.53  0.00 ! #SUP  8.14
assign  ((resid    9 and name HA   )) ((resid   12 and name HG11 ))   4.31  2.51  0.00 ! #SUP  8.57
assign  ((resid    7 and name HG1  )) ((resid    7 and name HD*  ))   3.81  2.01  0.00 ! #SUP  4.43
assign  ((resid   12 and name HG12 )) ((resid   12 and name HG11 ))   3.08  1.28  0.00 ! #SUP  9.17
assign  ((resid   12 and name HD1* )) ((resid   12 and name HG11 ))   4.11  2.31  0.00 ! #SUP  8.18
assign  ((resid   12 and name HD1* )) ((resid   12 and name HG12 ))   4.29  2.49  0.00 ! #SUP  9.43
assign  ((resid   11 and name HG1  )) ((resid   12 and name HG12 ))   5.50  3.70  0.00 ! #SUP  7.53
assign  ((resid   12 and name HG12 )) ((resid   13 and name HN   ))   4.68  2.88  0.00 ! #SUP  9.92
assign  ((resid   12 and name HN   )) ((resid   12 and name HG12 ))   3.76  1.96  0.00 ! #SUP 10.00
assign  ((resid   12 and name HA   )) ((resid   12 and name HG12 ))   4.08  2.28  0.00 ! #SUP  9.82
assign  ((resid    9 and name HA   )) ((resid   12 and name HG12 ))   4.15  2.35  0.00 ! #SUP  5.94
assign  ((resid   11 and name HB*  )) ((resid   12 and name HG12 ))   5.37  3.57  0.00 ! #SUP  9.10
assign  ((resid   11 and name HG2  )) ((resid   12 and name HG12 ))   5.21  3.41  0.00 ! #SUP  9.10
assign  ((resid   12 and name HG11 )) ((resid   12 and name HG12 ))   3.22  1.42  0.00 ! #SUP  9.17
assign  ((resid    8 and name HA   )) ((resid   12 and name HG12 ))   5.50  3.70  0.00 ! #SUP  4.34
assign  ((resid   11 and name HB*  )) ((resid   13 and name HD*  ))   5.50  3.70  0.00 ! #SUP  4.31
assign  ((resid    9 and name HA   )) ((resid   13 and name HD*  ))   4.54  2.74  0.00 ! #SUP  7.41
assign  ((resid   13 and name HB1  )) ((resid   13 and name HD*  ))   3.13  1.33  0.00 ! #SUP  5.96
assign  ((resid   13 and name HG   )) ((resid   13 and name HD*  ))   3.39  1.59  0.00 ! #SUP  5.56
assign  ((resid   12 and name HG12 )) ((resid   13 and name HD*  ))   4.23  2.43  0.00 ! #SUP  7.69
assign  ((resid   13 and name HB1  )) ((resid   13 and name HD*  ))   3.10  1.30  0.00 ! #SUP  5.96
assign  ((resid   13 and name HN   )) ((resid   13 and name HD*  ))   4.19  2.39  0.00 ! #SUP  8.58
assign  ((resid   12 and name HN   )) ((resid   13 and name HD*  ))   5.23  3.43  0.00 ! #SUP  7.50
assign  ((resid   13 and name HA   )) ((resid   13 and name HD*  ))   2.99  1.19  0.00 ! #SUP  6.16
assign  ((resid   12 and name HA   )) ((resid   13 and name HD*  ))   5.24  3.44  0.00 ! #SUP  7.25
assign  ((resid    9 and name HD*  )) ((resid   13 and name HD*  ))   3.01  1.21  0.00 ! #SUP  6.88
assign  ((resid    2 and name HG*  )) ((resid    3 and name HN   ))   4.11  2.31  0.00 ! #SUP  8.91
assign  ((resid    2 and name HN   )) ((resid    2 and name HG*  ))   4.13  2.33  0.00 ! #SUP  5.39
assign  ((resid    2 and name HG*  )) ((resid    5 and name HB1  ))   3.48  1.68  0.00 ! #SUP  6.41
assign  ((resid    2 and name HB   )) ((resid    2 and name HG*  ))   3.09  1.29  0.00 ! #SUP  4.18
assign  ((resid    9 and name HN   )) ((resid    9 and name HD*  ))   4.41  2.61  0.00 ! #SUP  9.02
assign  ((resid    6 and name HA   )) ((resid    9 and name HD*  ))   4.12  2.32  0.00 ! #SUP  6.37
assign  ((resid    9 and name HA   )) ((resid    9 and name HD*  ))   3.23  1.43  0.00 ! #SUP  7.89
assign  ((resid    9 and name HG   )) ((resid    9 and name HD*  ))   3.43  1.63  0.00 ! #SUP  6.40
assign  ((resid    9 and name HD*  )) ((resid   13 and name HD*  ))   2.70  0.90  0.00 ! #SUP  6.88
assign  ((resid    2 and name HG*  )) ((resid    4 and name HB1  ))   5.17  3.37  0.00 ! #SUP  5.87
assign  ((resid    9 and name HB1  )) ((resid    9 and name HD*  ))   3.31  1.51  0.00 ! #SUP  6.61
assign  ((resid    2 and name HG*  )) ((resid    4 and name HN   ))   4.58  2.78  0.00 ! #SUP 10.00
assign  ((resid   12 and name HA   )) ((resid   12 and name HG2* ))   3.08  1.28  0.00 ! #SUP  8.44
assign  ((resid   12 and name HG2* )) ((resid   12 and name HG12 ))   4.02  2.22  0.00 ! #SUP  9.04
assign  ((resid   12 and name HG2* )) ((resid   12 and name HD1* ))   3.32  1.52  0.00 ! #SUP  8.47
assign  ((resid   12 and name HN   )) ((resid   12 and name HG2* ))   3.73  1.93  0.00 ! #SUP  8.70
assign  ((resid   12 and name HB   )) ((resid   12 and name HG2* ))   3.32  1.52  0.00 ! #SUP  6.81
assign  ((resid   12 and name HG2* )) ((resid   12 and name HG11 ))   4.07  2.27  0.00 ! #SUP  7.92
assign  ((resid   12 and name HD1* )) ((resid   13 and name HN   ))   5.21  3.41  0.00 ! #SUP  9.46
assign  ((resid   12 and name HN   )) ((resid   12 and name HD1* ))   4.55  2.75  0.00 ! #SUP  9.06
assign  ((resid    8 and name HA   )) ((resid   12 and name HD1* ))   5.48  3.68  0.00 ! #SUP  6.48
assign  ((resid   12 and name HA   )) ((resid   12 and name HD1* ))   4.11  2.31  0.00 ! #SUP  8.76
assign  ((resid    9 and name HA   )) ((resid   12 and name HD1* ))   4.33  2.53  0.00 ! #SUP 10.00
assign  ((resid   12 and name HB   )) ((resid   12 and name HD1* ))   3.89  2.09  0.00 ! #SUP  7.27
assign  ((resid   12 and name HG11 )) ((resid   12 and name HD1* ))   3.68  1.88  0.00 ! #SUP  8.18
assign  ((resid   12 and name HG12 )) ((resid   12 and name HD1* ))   3.71  1.91  0.00 ! #SUP  9.43
assign  ((resid   12 and name HG2* )) ((resid   12 and name HD1* ))   3.55  1.75  0.00 ! #SUP  8.47
assign  ((resid   12 and name HD1* )) ((resid   13 and name HG   ))   5.50  3.70  0.00 ! #SUP  5.39