NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
|
|
5401 |
1hdl   |
4910 | cing | recoord | 1-original | 2 | XPLOR/CNS | distance | NOE | simple |
assign (resid 3 and name HN) (resid 3 and name HA) 0.0 0.0 3.5 ! 3 HA ( 4.220) (0.00 A) assign (resid 4 and name HN) (resid 4 and name HA) 0.0 0.0 3.5 ! 4 HA ( 4.458) (0.00 A) assign (resid 5 and name HN) (resid 5 and name HA) 0.0 0.0 3.5 ! 5 HA ( 4.102) (0.00 A) assign (resid 6 and name HN) (resid 6 and name HA) 0.0 0.0 3.5 ! 6 HA ( 4.116) (0.00 A) assign (resid 7 and name HN) (resid 7 and name HA) 0.0 0.0 3.5 ! 7 HA ( 4.353) (0.00 A) assign (resid 11 and name HN) (resid 11 and name HA) 0.0 0.0 3.5 ! 11 HA ( 4.729) (0.00 A) assign (resid 11 and name HN) (resid 11 and name HB1) 0.0 0.0 3.5 ! 11 HB1 ( 3.629) (0.00 A) assign (resid 11 and name HN) (resid 11 and name HB2) 0.0 0.0 2.7 ! 11 HB2 ( 2.719) (0.00 A) assign (resid 11 and name HN) (resid 11 and name HD*) 0.0 0.0 3.5 ! 11 HD* ( 7.105) (0.00 A) assign (resid 11 and name HN) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.577) (0.00 A) assign (resid 12 and name HE21) (resid 12 and name HE22) 0.0 0.0 2.7 ! 12 HE22 ( 6.821) (0.00 A) assign (resid 12 and name HE21) (resid 12 and name HG*) 0.0 0.0 3.5 ! 12 HG* ( 2.469) (0.00 A) assign (resid 12 and name HE22) (resid 12 and name HG*) 0.0 0.0 5.0 ! 12 HG* ( 2.469) (0.00 A) assign (resid 12 and name HN) (resid 12 and name HA) 0.0 0.0 3.5 ! 12 HA ( 3.873) (0.00 A) assign (resid 13 and name HN) (resid 13 and name HA) 0.0 0.0 3.5 ! 13 HA ( 4.108) (0.00 A) assign (resid 14 and name HN) (resid 14 and name HA) 0.0 0.0 3.5 ! 14 HA ( 4.792) (0.00 A) assign (resid 14 and name HN) (resid 14 and name HB1) 0.0 0.0 3.5 ! 14 HB1 ( 3.971) (0.00 A) assign (resid 14 and name HN) (resid 14 and name HB2) 0.0 0.0 2.7 ! 14 HB2 ( 2.961) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HA) 0.0 0.0 3.5 ! 15 HA ( 5.177) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HB1) 0.0 0.0 2.7 ! 15 HB1 ( 2.136) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HB2) 0.0 0.0 3.5 ! 15 HB2 ( 1.998) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HE*) 0.0 0.0 5.0 ! 15 HE* ( 1.767) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HG1) 0.0 0.0 3.5 ! 15 HG1 ( 2.684) (0.00 A) assign (resid 15 and name HN) (resid 15 and name HG2) 0.0 0.0 2.7 ! 15 HG2 ( 2.380) (0.00 A) assign (resid 16 and name HN) (resid 16 and name HA) 0.0 0.0 3.5 ! 16 HA ( 4.565) (0.00 A) assign (resid 17 and name HD21) (resid 17 and name HA) 0.0 0.0 5.0 ! 17 HA ( 4.407) (0.00 A) assign (resid 17 and name HD21) (resid 17 and name HB1) 0.0 0.0 5.0 ! 17 HB1 ( 3.114) (0.00 A) assign (resid 17 and name HD21) (resid 17 and name HB2) 0.0 0.0 3.5 ! 17 HB2 ( 2.842) (0.00 A) assign (resid 17 and name HD21) (resid 17 and name HD22) 0.0 0.0 2.7 ! 17 HD22 ( 6.970) (0.00 A) assign (resid 17 and name HD21) (resid 17 and name HN) 0.0 0.0 5.0 ! 17 HN ( 9.558) (0.00 A) assign (resid 17 and name HD22) (resid 17 and name HB1) 0.0 0.0 5.0 ! 17 HB1 ( 3.114) (0.00 A) assign (resid 17 and name HD22) (resid 17 and name HB2) 0.0 0.0 3.5 ! 17 HB2 ( 2.842) (0.00 A) assign (resid 17 and name HN) (resid 17 and name HA) 0.0 0.0 2.7 ! 17 HA ( 4.407) (0.00 A) assign (resid 17 and name HN) (resid 17 and name HB1) 0.0 0.0 5.0 ! 17 HB1 ( 3.114) (0.00 A) assign (resid 17 and name HN) (resid 17 and name HB2) 0.0 0.0 3.5 ! 17 HB2 ( 2.842) (0.00 A) assign (resid 18 and name HN) (resid 18 and name HA1) 0.0 0.0 3.5 ! 18 HA1 ( 4.146) (0.00 A) assign (resid 18 and name HN) (resid 18 and name HA2) 0.0 0.0 2.7 ! 18 HA2 ( 3.528) (0.00 A) assign (resid 19 and name HN) (resid 19 and name HA) 0.0 0.0 3.5 ! 19 HA ( 4.663) (0.00 A) assign (resid 19 and name HN) (resid 19 and name HB1) 0.0 0.0 2.7 ! 19 HB1 ( 1.758) (0.00 A) assign (resid 19 and name HN) (resid 19 and name HB2) 0.0 0.0 3.5 ! 19 HB2 ( 1.370) (0.00 A) assign (resid 21 and name HN) (resid 21 and name HA) 0.0 0.0 3.5 ! 21 HA ( 4.640) (0.00 A) assign (resid 21 and name HN) (resid 21 and name HD*) 0.0 0.0 3.5 ! 21 HD* ( 7.372) (0.00 A) assign (resid 22 and name HN) (resid 22 and name HA) 0.0 0.0 3.5 ! 22 HA ( 4.299) (0.00 A) assign (resid 24 and name HE21) (resid 24 and name HA) 0.0 0.0 5.0 ! 24 HA ( 4.578) (0.00 A) assign (resid 24 and name HN) (resid 24 and name HA) 0.0 0.0 3.5 ! 24 HA ( 4.578) (0.00 A) assign (resid 25 and name HN) (resid 25 and name HA) 0.0 0.0 3.5 ! 25 HA ( 4.526) (0.00 A) assign (resid 26 and name HN) (resid 26 and name HA) 0.0 0.0 3.5 ! 26 HA ( 4.159) (0.00 A) assign (resid 27 and name HN) (resid 27 and name HA) 0.0 0.0 3.5 ! 27 HA ( 4.096) (0.00 A) assign (resid 27 and name HN) (resid 27 and name HB1) 0.0 0.0 3.5 ! 27 HB1 ( 1.679) (0.00 A) assign (resid 27 and name HN) (resid 27 and name HB2) 0.0 0.0 2.7 ! 27 HB2 ( 1.539) (0.00 A) assign (resid 27 and name HN) (resid 27 and name HG1) 0.0 0.0 3.5 ! 27 HG1 ( 0.992) (0.00 A) assign (resid 27 and name HN) (resid 27 and name HG2) 0.0 0.0 5.0 ! 27 HG2 ( 0.757) (0.00 A) assign (resid 28 and name HN) (resid 28 and name HA) 0.0 0.0 3.5 ! 28 HA ( 4.227) (0.00 A) assign (resid 28 and name HN) (resid 28 and name HB1) 0.0 0.0 3.5 ! 28 HB1 ( 2.997) (0.00 A) assign (resid 28 and name HN) (resid 28 and name HB2) 0.0 0.0 2.7 ! 28 HB2 ( 2.607) (0.00 A) assign (resid 29 and name HN) (resid 29 and name HA) 0.0 0.0 3.5 ! 29 HA ( 4.566) (0.00 A) assign (resid 29 and name HN) (resid 29 and name HB1) 0.0 0.0 3.5 ! 29 HB1 ( 3.416) (0.00 A) assign (resid 29 and name HN) (resid 29 and name HB2) 0.0 0.0 2.7 ! 29 HB2 ( 2.956) (0.00 A) assign (resid 30 and name HE21) (resid 30 and name HG1) 0.0 0.0 5.0 ! 30 HG1 ( 2.475) (0.00 A) assign (resid 30 and name HE22) (resid 30 and name HG1) 0.0 0.0 3.5 ! 30 HG1 ( 2.475) (0.00 A) assign (resid 30 and name HN) (resid 30 and name HA) 0.0 0.0 3.5 ! 30 HA ( 4.402) (0.00 A) assign (resid 30 and name HN) (resid 30 and name HG1) 0.0 0.0 2.7 ! 30 HG1 ( 2.475) (0.00 A) assign (resid 30 and name HN) (resid 30 and name HG2) 0.0 0.0 3.5 ! 30 HG2 ( 2.354) (0.00 A) assign (resid 31 and name HN) (resid 31 and name HA) 0.0 0.0 3.5 ! 31 HA ( 4.769) (0.00 A) assign (resid 34 and name HN) (resid 34 and name HA1) 0.0 0.0 3.5 ! 34 HA1 ( 4.419) (0.00 A) assign (resid 34 and name HN) (resid 34 and name HA2) 0.0 0.0 3.5 ! 34 HA2 ( 3.967) (0.00 A) assign (resid 35 and name HN) (resid 35 and name HA) 0.0 0.0 3.5 ! 35 HA ( 3.615) (0.00 A) assign (resid 35 and name HN) (resid 35 and name HB) 0.0 0.0 2.7 ! 35 HB ( 1.952) (0.00 A) assign (resid 36 and name HN) (resid 36 and name HA) 0.0 0.0 3.5 ! 36 HA ( 4.253) (0.00 A) assign (resid 36 and name HN) (resid 36 and name HB1) 0.0 0.0 2.7 ! 36 HB1 ( 2.299) (0.00 A) assign (resid 36 and name HN) (resid 36 and name HB2) 0.0 0.0 3.5 ! 36 HB2 ( 2.190) (0.00 A) assign (resid 37 and name HN) (resid 37 and name HA) 0.0 0.0 3.5 ! 37 HA ( 4.402) (0.00 A) assign (resid 37 and name HN) (resid 37 and name HB1) 0.0 0.0 2.7 ! 37 HB1 ( 3.453) (0.00 A) assign (resid 37 and name HN) (resid 37 and name HB2) 0.0 0.0 3.5 ! 37 HB2 ( 3.342) (0.00 A) assign (resid 38 and name HN) (resid 38 and name HA) 0.0 0.0 3.5 ! 38 HA ( 3.491) (0.00 A) assign (resid 38 and name HN) (resid 38 and name HB) 0.0 0.0 3.5 ! 38 HB ( 1.940) (0.00 A) assign (resid 39 and name HN) (resid 39 and name HA) 0.0 0.0 3.5 ! 39 HA ( 4.450) (0.00 A) assign (resid 40 and name HN) (resid 40 and name HA) 0.0 0.0 3.5 ! 40 HA ( 3.944) (0.00 A) assign (resid 41 and name HN) (resid 41 and name HA) 0.0 0.0 3.5 ! 41 HA ( 3.516) (0.00 A) assign (resid 41 and name HN) (resid 41 and name HB1) 0.0 0.0 3.5 ! 41 HB1 ( 2.865) (0.00 A) assign (resid 41 and name HN) (resid 41 and name HB2) 0.0 0.0 2.7 ! 41 HB2 ( 2.190) (0.00 A) assign (resid 42 and name HN) (resid 42 and name HA) 0.0 0.0 3.5 ! 42 HA ( 3.841) (0.00 A) assign (resid 43 and name HN) (resid 43 and name HA) 0.0 0.0 3.5 ! 43 HA ( 3.955) (0.00 A) assign (resid 43 and name HN) (resid 43 and name HB) 0.0 0.0 2.7 ! 43 HB ( 4.263) (0.00 A) assign (resid 44 and name HN) (resid 44 and name HA) 0.0 0.0 3.5 ! 44 HA ( 4.450) (0.00 A) assign (resid 45 and name HN) (resid 45 and name HA) 0.0 0.0 3.5 ! 45 HA ( 3.767) (0.00 A) assign (resid 46 and name HN) (resid 46 and name HA) 0.0 0.0 3.5 ! 46 HA ( 4.206) (0.00 A) assign (resid 46 and name HN) (resid 46 and name HG1) 0.0 0.0 3.5 ! 46 HG1 ( 2.697) (0.00 A) assign (resid 46 and name HN) (resid 46 and name HG2) 0.0 0.0 2.7 ! 46 HG2 ( 2.609) (0.00 A) assign (resid 47 and name HN) (resid 47 and name HA) 0.0 0.0 3.5 ! 47 HA ( 3.796) (0.00 A) assign (resid 47 and name HN) (resid 47 and name HB) 0.0 0.0 2.7 ! 47 HB ( 1.977) (0.00 A) assign (resid 47 and name HN) (resid 47 and name HG11) 0.0 0.0 2.7 ! 47 HG11 ( 1.700) (0.00 A) assign (resid 47 and name HN) (resid 47 and name HG12) 0.0 0.0 3.5 ! 47 HG12 ( 1.201) (0.00 A) assign (resid 49 and name HN) (resid 49 and name HA) 0.0 0.0 3.5 ! 49 HA ( 4.117) (0.00 A) assign (resid 49 and name HN) (resid 49 and name HG1) 0.0 0.0 2.7 ! 49 HG1 ( 2.671) (0.00 A) assign (resid 49 and name HN) (resid 49 and name HG2) 0.0 0.0 3.5 ! 49 HG2 ( 2.468) (0.00 A) assign (resid 50 and name HN) (resid 50 and name HA) 0.0 0.0 3.5 ! 50 HA ( 4.214) (0.00 A) assign (resid 51 and name HN) (resid 51 and name HA) 0.0 0.0 3.5 ! 51 HA ( 4.215) (0.00 A) assign (resid 52 and name HN) (resid 52 and name HA) 0.0 0.0 3.5 ! 52 HA ( 4.238) (0.00 A) assign (resid 53 and name HN) (resid 53 and name HA) 0.0 0.0 3.5 ! 53 HA ( 4.330) (0.00 A) assign (resid 54 and name HN) (resid 54 and name HA) 0.0 0.0 3.5 ! 54 HA ( 4.463) (0.00 A) assign (resid 55 and name HN) (resid 55 and name HA) 0.0 0.0 3.5 ! 55 HA ( 4.196) (0.00 A) assign (resid 3 and name HN) (resid 2 and name HA) 0.0 0.0 2.7 ! 2 HA ( 4.698) (0.00 A) assign (resid 3 and name HN) (resid 2 and name HB1) 0.0 0.0 5.0 ! 2 HB1 ( 2.901) (0.00 A) assign (resid 3 and name HN) (resid 2 and name HB2) 0.0 0.0 5.0 ! 2 HB2 ( 2.841) (0.00 A) assign (resid 4 and name HN) (resid 3 and name HA) 0.0 0.0 3.5 ! 3 HA ( 4.220) (0.00 A) assign (resid 4 and name HN) (resid 3 and name HN) 0.0 0.0 3.5 ! 3 HN ( 8.949) (0.00 A) assign (resid 7 and name HN) (resid 6 and name HB*) 0.0 0.0 5.0 ! 6 HB* ( 2.065) (0.00 A) assign (resid 12 and name HN) (resid 11 and name HA) 0.0 0.0 5.0 ! 11 HA ( 4.729) (0.00 A) assign (resid 12 and name HN) (resid 11 and name HB1) 0.0 0.0 5.0 ! 11 HB1 ( 3.629) (0.00 A) assign (resid 12 and name HN) (resid 11 and name HB2) 0.0 0.0 5.0 ! 11 HB2 ( 2.719) (0.00 A) assign (resid 12 and name HN) (resid 11 and name HD*) 0.0 0.0 5.0 ! 11 HD* ( 7.105) (0.00 A) assign (resid 12 and name HN) (resid 13 and name HN) 0.0 0.0 3.5 ! 13 HN ( 8.022) (0.00 A) assign (resid 13 and name HN) (resid 12 and name HA) 0.0 0.0 5.0 ! 12 HA ( 3.873) (0.00 A) assign (resid 13 and name HN) (resid 12 and name HB*) 0.0 0.0 3.5 ! 12 HB* ( 2.105) (0.00 A) assign (resid 13 and name HN) (resid 12 and name HG*) 0.0 0.0 5.0 ! 12 HG* ( 2.469) (0.00 A) assign (resid 13 and name HN) (resid 12 and name HN) 0.0 0.0 3.5 ! 12 HN ( 7.563) (0.00 A) assign (resid 13 and name HN) (resid 14 and name HN) 0.0 0.0 3.5 ! 14 HN ( 7.713) (0.00 A) assign (resid 14 and name HN) (resid 13 and name HA) 0.0 0.0 5.0 ! 13 HA ( 4.108) (0.00 A) assign (resid 14 and name HN) (resid 13 and name HB*) 0.0 0.0 3.5 ! 13 HB* ( 1.029) (0.00 A) assign (resid 14 and name HN) (resid 13 and name HN) 0.0 0.0 2.7 ! 13 HN ( 8.022) (0.00 A) assign (resid 14 and name HN) (resid 15 and name HN) 0.0 0.0 2.7 ! 15 HN ( 7.450) (0.00 A) assign (resid 15 and name HN) (resid 14 and name HA) 0.0 0.0 3.5 ! 14 HA ( 4.792) (0.00 A) assign (resid 15 and name HN) (resid 14 and name HB2) 0.0 0.0 5.0 ! 14 HB2 ( 2.961) (0.00 A) assign (resid 15 and name HN) (resid 16 and name HN) 0.0 0.0 5.0 ! 16 HN ( 9.506) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HA) 0.0 0.0 2.7 ! 15 HA ( 5.177) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HB1) 0.0 0.0 5.0 ! 15 HB1 ( 2.136) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HB2) 0.0 0.0 5.0 ! 15 HB2 ( 1.998) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HG1) 0.0 0.0 5.0 ! 15 HG1 ( 2.684) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HG2) 0.0 0.0 5.0 ! 15 HG2 ( 2.380) (0.00 A) assign (resid 16 and name HN) (resid 15 and name HN) 0.0 0.0 5.0 ! 15 HN ( 7.450) (0.00 A) assign (resid 17 and name HD21) (resid 16 and name HG*) 0.0 0.0 5.0 ! 16 HG* ( 1.389) (0.00 A) assign (resid 17 and name HN) (resid 16 and name HA) 0.0 0.0 2.7 ! 16 HA ( 4.565) (0.00 A) assign (resid 17 and name HN) (resid 16 and name HB*) 0.0 0.0 5.0 ! 16 HB* ( 1.844) (0.00 A) assign (resid 17 and name HN) (resid 16 and name HG*) 0.0 0.0 5.0 ! 16 HG* ( 1.389) (0.00 A) assign (resid 17 and name HN) (resid 18 and name HN) 0.0 0.0 3.5 ! 18 HN ( 8.786) (0.00 A) assign (resid 18 and name HN) (resid 17 and name HA) 0.0 0.0 2.7 ! 17 HA ( 4.407) (0.00 A) assign (resid 18 and name HN) (resid 17 and name HB1) 0.0 0.0 5.0 ! 17 HB1 ( 3.114) (0.00 A) assign (resid 18 and name HN) (resid 17 and name HB2) 0.0 0.0 5.0 ! 17 HB2 ( 2.842) (0.00 A) assign (resid 18 and name HN) (resid 19 and name HN) 0.0 0.0 3.5 ! 19 HN ( 7.713) (0.00 A) assign (resid 19 and name HN) (resid 18 and name HA1) 0.0 0.0 3.5 ! 18 HA1 ( 4.146) (0.00 A) assign (resid 19 and name HN) (resid 18 and name HA2) 0.0 0.0 3.5 ! 18 HA2 ( 3.528) (0.00 A) assign (resid 19 and name HN) (resid 18 and name HN) 0.0 0.0 3.5 ! 18 HN ( 8.786) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HA) 0.0 0.0 2.7 ! 20 HA ( 4.520) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HB1) 0.0 0.0 5.0 ! 20 HB1 ( 1.727) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HB2) 0.0 0.0 5.0 ! 20 HB2 ( 1.272) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HD1*) 0.0 0.0 2.7 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HD2*) 0.0 0.0 5.0 ! 20 HD2* ( 0.697) (0.00 A) assign (resid 21 and name HN) (resid 20 and name HG) 0.0 0.0 5.0 ! 20 HG ( 1.424) (0.00 A) assign (resid 22 and name HN) (resid 21 and name HA) 0.0 0.0 2.7 ! 21 HA ( 4.640) (0.00 A) assign (resid 22 and name HN) (resid 21 and name HB*) 0.0 0.0 5.0 ! 21 HB* ( 3.082) (0.00 A) assign (resid 22 and name HN) (resid 21 and name HD*) 0.0 0.0 5.0 ! 21 HD* ( 7.372) (0.00 A) assign (resid 24 and name HN) (resid 23 and name HA) 0.0 0.0 2.7 ! 23 HA ( 4.355) (0.00 A) assign (resid 24 and name HN) (resid 23 and name HD2) 0.0 0.0 5.0 ! 23 HD2 ( 2.981) (0.00 A) assign (resid 24 and name HN) (resid 25 and name HN) 0.0 0.0 3.5 ! 25 HN ( 7.984) (0.00 A) assign (resid 25 and name HN) (resid 24 and name HN) 0.0 0.0 3.5 ! 24 HN ( 8.514) (0.00 A) assign (resid 26 and name HN) (resid 25 and name HA) 0.0 0.0 2.7 ! 25 HA ( 4.526) (0.00 A) assign (resid 26 and name HN) (resid 25 and name HB*) 0.0 0.0 5.0 ! 25 HB* ( 2.682) (0.00 A) assign (resid 26 and name HN) (resid 25 and name HN) 0.0 0.0 5.0 ! 25 HN ( 7.984) (0.00 A) assign (resid 27 and name HN) (resid 26 and name HB*) 0.0 0.0 3.5 ! 26 HB* ( 1.890) (0.00 A) assign (resid 27 and name HN) (resid 28 and name HN) 0.0 0.0 3.5 ! 28 HN ( 7.721) (0.00 A) assign (resid 28 and name HN) (resid 27 and name HA) 0.0 0.0 5.0 ! 27 HA ( 4.096) (0.00 A) assign (resid 28 and name HN) (resid 27 and name HB1) 0.0 0.0 5.0 ! 27 HB1 ( 1.679) (0.00 A) assign (resid 28 and name HN) (resid 27 and name HB2) 0.0 0.0 5.0 ! 27 HB2 ( 1.539) (0.00 A) assign (resid 28 and name HN) (resid 27 and name HD*) 0.0 0.0 5.0 ! 27 HD* ( 1.425) (0.00 A) assign (resid 28 and name HN) (resid 27 and name HG1) 0.0 0.0 5.0 ! 27 HG1 ( 0.992) (0.00 A) assign (resid 28 and name HN) (resid 29 and name HN) 0.0 0.0 3.5 ! 29 HN ( 7.523) (0.00 A) assign (resid 29 and name HN) (resid 28 and name HA) 0.0 0.0 3.5 ! 28 HA ( 4.227) (0.00 A) assign (resid 29 and name HN) (resid 28 and name HB2) 0.0 0.0 5.0 ! 28 HB2 ( 2.607) (0.00 A) assign (resid 29 and name HN) (resid 28 and name HN) 0.0 0.0 3.5 ! 28 HN ( 7.721) (0.00 A) assign (resid 30 and name HN) (resid 29 and name HA) 0.0 0.0 3.5 ! 29 HA ( 4.566) (0.00 A) assign (resid 30 and name HN) (resid 29 and name HB1) 0.0 0.0 5.0 ! 29 HB1 ( 3.416) (0.00 A) assign (resid 30 and name HN) (resid 29 and name HB2) 0.0 0.0 5.0 ! 29 HB2 ( 2.956) (0.00 A) assign (resid 30 and name HN) (resid 31 and name HN) 0.0 0.0 2.7 ! 31 HN ( 7.719) (0.00 A) assign (resid 31 and name HN) (resid 30 and name HA) 0.0 0.0 3.5 30 HA ( 4.402) (0.00 A) assign (resid 31 and name HN) (resid 30 and name HB*) 0.0 0.0 5.0 ! 30 HB* ( 2.069) (0.00 A) assign (resid 31 and name HN) (resid 30 and name HG1) 0.0 0.0 5.0 ! 30 HG1 ( 2.475) (0.00 A) assign (resid 31 and name HN) (resid 30 and name HG2) 0.0 0.0 5.0 ! 30 HG2 ( 2.354) (0.00 A) assign (resid 31 and name HN) (resid 30 and name HN) 0.0 0.0 3.5 ! 30 HN ( 7.567) (0.00 A) assign (resid 31 and name HN) (resid 32 and name HN) 0.0 0.0 5.0 ! 32 HN ( 8.831) (0.00 A) assign (resid 33 and name HN) (resid 32 and name HA) 0.0 0.0 3.5 ! 32 HA ( 4.195) (0.00 A) assign (resid 33 and name HN) (resid 32 and name HB*) 0.0 0.0 2.7 ! 32 HB* ( 1.729) (0.00 A) assign (resid 33 and name HN) (resid 32 and name HD2*) 0.0 0.0 5.0 ! 32 HD2* ( 0.944) (0.00 A) assign (resid 33 and name HN) (resid 32 and name HN) 0.0 0.0 3.5 ! 32 HN ( 8.831) (0.00 A) assign (resid 33 and name HN) (resid 34 and name HN) 0.0 0.0 3.5 ! 34 HN ( 8.096) (0.00 A) assign (resid 34 and name HN) (resid 33 and name HB*) 0.0 0.0 2.7 ! 33 HB* ( 2.616) (0.00 A) assign (resid 34 and name HN) (resid 33 and name HN) 0.0 0.0 2.7 ! 33 HN ( 8.494) (0.00 A) assign (resid 35 and name HN) (resid 34 and name HA1) 0.0 0.0 3.5 ! 34 HA1 ( 4.419) (0.00 A) assign (resid 35 and name HN) (resid 34 and name HA2) 0.0 0.0 3.5 ! 34 HA2 ( 3.967) (0.00 A) assign (resid 36 and name HN) (resid 35 and name HA) 0.0 0.0 3.5 ! 35 HA ( 3.615) (0.00 A) assign (resid 36 and name HN) (resid 35 and name HB) 0.0 0.0 3.5 ! 35 HB ( 1.952) (0.00 A) assign (resid 36 and name HN) (resid 35 and name HG*) 0.0 0.0 5.0 ! 35 HG* ( 1.154) (0.00 A) assign (resid 36 and name HN) (resid 35 and name HN) 0.0 0.0 2.7 ! 35 HN ( 8.052) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HA) 0.0 0.0 5.0 ! 36 HA ( 4.253) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HB1) 0.0 0.0 3.5 ! 36 HB1 ( 2.299) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HB2) 0.0 0.0 3.5 ! 36 HB2 ( 2.190) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HG1) 0.0 0.0 5.0 ! 36 HG1 ( 2.819) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HG2) 0.0 0.0 5.0 ! 36 HG2 ( 2.667) (0.00 A) assign (resid 37 and name HN) (resid 36 and name HN) 0.0 0.0 3.5 ! 36 HN ( 8.358) (0.00 A) assign (resid 38 and name HN) (resid 37 and name HA) 0.0 0.0 5.0 ! 37 HA ( 4.402) (0.00 A) assign (resid 38 and name HN) (resid 37 and name HB2) 0.0 0.0 5.0 ! 37 HB2 ( 3.342) (0.00 A) assign (resid 38 and name HN) (resid 37 and name HN) 0.0 0.0 3.5 ! 37 HN ( 8.014) (0.00 A) assign (resid 38 and name HN) (resid 37 and name HZ) 0.0 0.0 5.0 ! 37 HZ ( 7.082) (0.00 A) assign (resid 38 and name HN) (resid 39 and name HN) 0.0 0.0 3.5 ! 39 HN ( 8.449) (0.00 A) assign (resid 39 and name HN) (resid 38 and name HA) 0.0 0.0 3.5 ! 38 HA ( 3.491) (0.00 A) assign (resid 39 and name HN) (resid 38 and name HB) 0.0 0.0 3.5 ! 38 HB ( 1.940) (0.00 A) assign (resid 39 and name HN) (resid 38 and name HG11) 0.0 0.0 5.0 ! 38 HG11 ( 1.408) (0.00 A) assign (resid 39 and name HN) (resid 38 and name HG12) 0.0 0.0 5.0 ! 38 HG12 ( 1.185) (0.00 A) assign (resid 39 and name HN) (resid 38 and name HG2*) 0.0 0.0 5.0 ! 38 HG2* ( 0.829) (0.00 A) assign (resid 40 and name HN) (resid 39 and name HA) 0.0 0.0 3.5 ! 39 HA ( 4.450) (0.00 A) assign (resid 40 and name HN) (resid 39 and name HD21) 0.0 0.0 5.0 ! 39 HD21 ( 7.486) (0.00 A) assign (resid 40 and name HN) (resid 41 and name HN) 0.0 0.0 3.5 ! 41 HN ( 8.010) (0.00 A) assign (resid 41 and name HN) (resid 40 and name HA) 0.0 0.0 5.0 ! 40 HA ( 3.944) (0.00 A) assign (resid 41 and name HN) (resid 40 and name HB2) 0.0 0.0 3.5 ! 40 HB2 ( 1.933) (0.00 A) assign (resid 41 and name HN) (resid 40 and name HG*) 0.0 0.0 5.0 ! 40 HG* ( 1.595) (0.00 A) assign (resid 41 and name HN) (resid 40 and name HN) 0.0 0.0 3.5 ! 40 HN ( 8.401) (0.00 A) assign (resid 41 and name HN) (resid 42 and name HN) 0.0 0.0 3.5 ! 42 HN ( 7.675) (0.00 A) assign (resid 42 and name HN) (resid 41 and name HA) 0.0 0.0 5.0 ! 41 HA ( 3.516) (0.00 A) assign (resid 42 and name HN) (resid 41 and name HB1) 0.0 0.0 3.5 ! 41 HB1 ( 2.865) (0.00 A) assign (resid 42 and name HN) (resid 41 and name HB2) 0.0 0.0 3.5 ! 41 HB2 ( 2.190) (0.00 A) assign (resid 42 and name HN) (resid 43 and name HN) 0.0 0.0 3.5 ! 43 HN ( 7.834) (0.00 A) assign (resid 43 and name HN) (resid 42 and name HA) 0.0 0.0 5.0 ! 42 HA ( 3.841) (0.00 A) assign (resid 43 and name HN) (resid 42 and name HB*) 0.0 0.0 2.7 ! 42 HB* ( 1.471) (0.00 A) assign (resid 43 and name HN) (resid 44 and name HN) 0.0 0.0 3.5 ! 44 HN ( 8.165) (0.00 A) assign (resid 44 and name HN) (resid 43 and name HA) 0.0 0.0 5.0 ! 43 HA ( 3.955) (0.00 A) assign (resid 44 and name HN) (resid 43 and name HB) 0.0 0.0 3.5 ! 43 HB ( 4.263) (0.00 A) assign (resid 44 and name HN) (resid 43 and name HG*) 0.0 0.0 5.0 ! 43 HG* ( 1.225) (0.00 A) assign (resid 45 and name HN) (resid 44 and name HA) 0.0 0.0 5.0 ! 44 HA ( 4.450) (0.00 A) assign (resid 46 and name HN) (resid 45 and name HA) 0.0 0.0 5.0 ! 45 HA ( 3.767) (0.00 A) assign (resid 46 and name HN) (resid 45 and name HB*) 0.0 0.0 3.5 ! 45 HB* ( 1.942) (0.00 A) assign (resid 46 and name HN) (resid 45 and name HD*) 0.0 0.0 3.5 ! 45 HD* ( 1.703) (0.00 A) assign (resid 46 and name HN) (resid 45 and name HG*) 0.0 0.0 3.5 ! 45 HG* ( 1.208) (0.00 A) assign (resid 46 and name HN) (resid 45 and name HN) 0.0 0.0 3.5 ! 45 HN ( 8.244) (0.00 A) assign (resid 47 and name HN) (resid 46 and name HA) 0.0 0.0 5.0 ! 46 HA ( 4.206) (0.00 A) assign (resid 47 and name HN) (resid 46 and name HB*) 0.0 0.0 3.5 ! 46 HB* ( 2.190) (0.00 A) assign (resid 47 and name HN) (resid 46 and name HG2) 0.0 0.0 5.0 ! 46 HG2 ( 2.609) (0.00 A) assign (resid 47 and name HN) (resid 48 and name HN) 0.0 0.0 3.5 ! 48 HN ( 8.621) (0.00 A) assign (resid 49 and name HN) (resid 48 and name HB*) 0.0 0.0 3.5 ! 48 HB* ( 1.817) (0.00 A) assign (resid 49 and name HN) (resid 48 and name HD2*) 0.0 0.0 5.0 ! 48 HD2* ( 0.882) (0.00 A) assign (resid 49 and name HN) (resid 48 and name HG) 0.0 0.0 5.0 ! 48 HG ( 1.655) (0.00 A) assign (resid 49 and name HN) (resid 48 and name HN) 0.0 0.0 3.5 ! 48 HN ( 8.621) (0.00 A) assign (resid 49 and name HN) (resid 50 and name HN) 0.0 0.0 3.5 ! 50 HN ( 7.569) (0.00 A) assign (resid 50 and name HN) (resid 49 and name HA) 0.0 0.0 3.5 ! 49 HA ( 4.117) (0.00 A) assign (resid 50 and name HN) (resid 49 and name HB*) 0.0 0.0 3.5 ! 49 HB* ( 2.098) (0.00 A) assign (resid 50 and name HN) (resid 49 and name HG1) 0.0 0.0 5.0 ! 49 HG1 ( 2.671) (0.00 A) assign (resid 50 and name HN) (resid 49 and name HG2) 0.0 0.0 5.0 ! 49 HG2 ( 2.468) (0.00 A) assign (resid 51 and name HN) (resid 50 and name HN) 0.0 0.0 3.5 ! 50 HN ( 7.569) (0.00 A) assign (resid 54 and name HN) (resid 53 and name HB*) 0.0 0.0 5.0 ! 53 HB* ( 1.841) (0.00 A) assign (resid 54 and name HN) (resid 53 and name HG*) 0.0 0.0 5.0 ! 53 HG* ( 1.457) (0.00 A) assign (resid 54 and name HN) (resid 53 and name HN) 0.0 0.0 3.5 ! 53 HN ( 8.001) (0.00 A) assign (resid 55 and name HN) (resid 54 and name HA) 0.0 0.0 3.5 ! 54 HA ( 4.463) (0.00 A) assign (resid 55 and name HN) (resid 54 and name HN) 0.0 0.0 5.0 ! 54 HN ( 8.255) (0.00 A) assign (resid 4 and name HN) (resid 2 and name HB1) 0.0 0.0 5.0 ! 2 HB1 ( 2.901) (0.00 A) assign (resid 6 and name HN) (resid 4 and name HA) 0.0 0.0 5.0 ! 4 HA ( 4.458) (0.00 A) assign (resid 6 and name HN) (resid 4 and name HB*) 0.0 0.0 5.0 ! 4 HB* ( 2.686) (0.00 A) assign (resid 14 and name HN) (resid 11 and name HB2) 0.0 0.0 5.0 ! 11 HB2 ( 2.719) (0.00 A) assign (resid 15 and name HN) (resid 12 and name HA) 0.0 0.0 5.0 ! 12 HA ( 3.873) (0.00 A) assign (resid 15 and name HN) (resid 13 and name HA) 0.0 0.0 5.0 ! 13 HA ( 4.108) (0.00 A) assign (resid 15 and name HN) (resid 13 and name HB*) 0.0 0.0 5.0 ! 13 HB* ( 1.029) (0.00 A) assign (resid 15 and name HN) (resid 13 and name HN) 0.0 0.0 5.0 ! 13 HN ( 8.022) (0.00 A) assign (resid 15 and name HN) (resid 20 and name HA) 0.0 0.0 5.0 ! 20 HA ( 4.520) (0.00 A) assign (resid 15 and name HN) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 16 and name HN) (resid 18 and name HN) 0.0 0.0 5.0 ! 18 HN ( 8.786) (0.00 A) assign (resid 16 and name HN) (resid 19 and name HN) 0.0 0.0 3.5 ! 19 HN ( 7.713) (0.00 A) assign (resid 16 and name HN) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 18 and name HN) (resid 15 and name HA) 0.0 0.0 5.0 ! 15 HA ( 5.177) (0.00 A) assign (resid 18 and name HN) (resid 15 and name HB1) 0.0 0.0 5.0 ! 15 HB1 ( 2.136) (0.00 A) assign (resid 18 and name HN) (resid 15 and name HB2) 0.0 0.0 5.0 ! 15 HB2 ( 1.998) (0.00 A) assign (resid 18 and name HN) (resid 15 and name HE*) 0.0 0.0 5.0 ! 15 HE* ( 1.767) (0.00 A) assign (resid 18 and name HN) (resid 16 and name HA) 0.0 0.0 5.0 ! 16 HA ( 4.565) (0.00 A) assign (resid 19 and name HN) (resid 15 and name HA) 0.0 0.0 5.0 ! 15 HA ( 5.177) (0.00 A) assign (resid 19 and name HN) (resid 15 and name HB2) 0.0 0.0 5.0 ! 15 HB2 ( 1.998) (0.00 A) assign (resid 19 and name HN) (resid 15 and name HG1) 0.0 0.0 5.0 ! 15 HG1 ( 2.684) (0.00 A) assign (resid 19 and name HN) (resid 16 and name HN) 0.0 0.0 3.5 ! 16 HN ( 9.506) (0.00 A) assign (resid 19 and name HN) (resid 17 and name HA) 0.0 0.0 5.0 ! 17 HA ( 4.407) (0.00 A) assign (resid 19 and name HN) (resid 17 and name HB1) 0.0 0.0 5.0 ! 17 HB1 ( 3.114) (0.00 A) assign (resid 19 and name HN) (resid 17 and name HB2) 0.0 0.0 5.0 ! 17 HB2 ( 2.842) (0.00 A) assign (resid 21 and name HN) (resid 16 and name HN) 0.0 0.0 5.0 ! 16 HN ( 9.506) (0.00 A) assign (resid 22 and name HN) (resid 19 and name HD*) 0.0 0.0 5.0 ! 19 HD* ( 1.615) (0.00 A) assign (resid 22 and name HN) (resid 20 and name HA) 0.0 0.0 5.0 ! 20 HA ( 4.520) (0.00 A) assign (resid 22 and name HN) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 22 and name HN) (resid 20 and name HD2*) 0.0 0.0 5.0 ! 20 HD2* ( 0.697) (0.00 A) assign (resid 22 and name HN) (resid 20 and name HG) 0.0 0.0 5.0 ! 20 HG ( 1.424) (0.00 A) assign (resid 24 and name HE21) (resid 28 and name HD*) 0.0 0.0 5.0 ! 28 HD* ( 7.330) (0.00 A) assign (resid 25 and name HN) (resid 28 and name HE*) 0.0 0.0 5.0 ! 28 HE* ( 7.257) (0.00 A) assign (resid 26 and name HN) (resid 23 and name HA) 0.0 0.0 5.0 ! 23 HA ( 4.355) (0.00 A) assign (resid 26 and name HN) (resid 28 and name HD*) 0.0 0.0 5.0 ! 28 HD* ( 7.330) (0.00 A) assign (resid 27 and name HN) (resid 29 and name HN) 0.0 0.0 5.0 ! 29 HN ( 7.523) (0.00 A) assign (resid 28 and name HN) (resid 26 and name HB*) 0.0 0.0 5.0 ! 26 HB* ( 1.890) (0.00 A) assign (resid 29 and name HN) (resid 27 and name HN) 0.0 0.0 5.0 ! 27 HN ( 8.710) (0.00 A) assign (resid 30 and name HN) (resid 28 and name HA) 0.0 0.0 5.0 ! 28 HA ( 4.227) (0.00 A) assign (resid 31 and name HN) (resid 29 and name HA) 0.0 0.0 5.0 ! 29 HA ( 4.566) (0.00 A) assign (resid 31 and name HN) (resid 35 and name HD1*) 0.0 0.0 5.0 ! 35 HD1* ( 0.915) (0.00 A) assign (resid 31 and name HN) (resid 35 and name HG*) 0.0 0.0 5.0 ! 35 HG* ( 1.154) (0.00 A) assign (resid 31 and name HN) (resid 35 and name HN) 0.0 0.0 3.5 ! 35 HN ( 8.052) (0.00 A) assign (resid 33 and name HN) (resid 31 and name HA) 0.0 0.0 5.0 ! 31 HA ( 4.769) (0.00 A) assign (resid 33 and name HN) (resid 31 and name HB2) 0.0 0.0 5.0 ! 31 HB2 ( 3.929) (0.00 A) assign (resid 34 and name HN) (resid 31 and name HA) 0.0 0.0 5.0 ! 31 HA ( 4.769) (0.00 A) assign (resid 34 and name HN) (resid 31 and name HB1) 0.0 0.0 3.5 ! 31 HB1 ( 4.193) (0.00 A) assign (resid 34 and name HN) (resid 31 and name HN) 0.0 0.0 5.0 ! 31 HN ( 7.719) (0.00 A) assign (resid 34 and name HN) (resid 32 and name HB*) 0.0 0.0 5.0 ! 32 HB* ( 1.729) (0.00 A) assign (resid 34 and name HN) (resid 32 and name HD2*) 0.0 0.0 5.0 ! 32 HD2* ( 0.944) (0.00 A) assign (resid 34 and name HN) (resid 32 and name HN) 0.0 0.0 5.0 ! 32 HN ( 8.831) (0.00 A) assign (resid 35 and name HN) (resid 32 and name HA) 0.0 0.0 5.0 ! 32 HA ( 4.195) (0.00 A) assign (resid 35 and name HN) (resid 32 and name HN) 0.0 0.0 5.0 ! 32 HN ( 8.831) (0.00 A) assign (resid 35 and name HN) (resid 33 and name HN) 0.0 0.0 5.0 ! 33 HN ( 8.494) (0.00 A) assign (resid 36 and name HN) (resid 32 and name HB*) 0.0 0.0 5.0 ! 32 HB* ( 1.729) (0.00 A) assign (resid 36 and name HN) (resid 32 and name HD2*) 0.0 0.0 3.5 ! 32 HD2* ( 0.944) (0.00 A) assign (resid 36 and name HN) (resid 33 and name HA) 0.0 0.0 3.5 ! 33 HA ( 4.440) (0.00 A) assign (resid 36 and name HN) (resid 34 and name HA2) 0.0 0.0 5.0 ! 34 HA2 ( 3.967) (0.00 A) assign (resid 37 and name HN) (resid 34 and name HA2) 0.0 0.0 5.0 ! 34 HA2 ( 3.967) (0.00 A) assign (resid 39 and name HN) (resid 35 and name HD1*) 0.0 0.0 5.0 ! 35 HD1* ( 0.915) (0.00 A) assign (resid 39 and name HN) (resid 36 and name HA) 0.0 0.0 5.0 ! 36 HA ( 4.253) (0.00 A) assign (resid 39 and name HN) (resid 36 and name HB2) 0.0 0.0 5.0 ! 36 HB2 ( 2.190) (0.00 A) assign (resid 39 and name HN) (resid 41 and name HN) 0.0 0.0 5.0 ! 41 HN ( 8.010) (0.00 A) assign (resid 40 and name HN) (resid 36 and name HB2) 0.0 0.0 5.0 ! 36 HB2 ( 2.190) (0.00 A) assign (resid 40 and name HN) (resid 38 and name HA) 0.0 0.0 5.0 ! 38 HA ( 3.491) (0.00 A) assign (resid 40 and name HN) (resid 42 and name HN) 0.0 0.0 5.0 ! 42 HN ( 7.675) (0.00 A) assign (resid 40 and name HN) (resid 43 and name HB) 0.0 0.0 5.0 ! 43 HB ( 4.263) (0.00 A) assign (resid 40 and name HN) (resid 43 and name HN) 0.0 0.0 5.0 ! 43 HN ( 7.834) (0.00 A) assign (resid 41 and name HN) (resid 39 and name HA) 0.0 0.0 5.0 ! 39 HA ( 4.450) (0.00 A) assign (resid 42 and name HN) (resid 38 and name HG2*) 0.0 0.0 5.0 ! 38 HG2* ( 0.829) (0.00 A) assign (resid 42 and name HN) (resid 39 and name HA) 0.0 0.0 5.0 ! 39 HA ( 4.450) (0.00 A) assign (resid 42 and name HN) (resid 40 and name HN) 0.0 0.0 5.0 ! 40 HN ( 8.401) (0.00 A) assign (resid 42 and name HN) (resid 44 and name HN) 0.0 0.0 5.0 ! 44 HN ( 8.165) (0.00 A) assign (resid 43 and name HN) (resid 39 and name HA) 0.0 0.0 5.0 ! 39 HA ( 4.450) (0.00 A) assign (resid 43 and name HN) (resid 40 and name HN) 0.0 0.0 5.0 ! 40 HN ( 8.401) (0.00 A) assign (resid 44 and name HN) (resid 40 and name HG*) 0.0 0.0 5.0 ! 40 HG* ( 1.595) (0.00 A) assign (resid 44 and name HN) (resid 42 and name HA) 0.0 0.0 5.0 ! 42 HA ( 3.841) (0.00 A) assign (resid 44 and name HN) (resid 42 and name HB*) 0.0 0.0 5.0 ! 42 HB* ( 1.471) (0.00 A) assign (resid 44 and name HN) (resid 42 and name HN) 0.0 0.0 5.0 ! 42 HN ( 7.675) (0.00 A) assign (resid 44 and name HN) (resid 46 and name HN) 0.0 0.0 5.0 ! 46 HN ( 7.471) (0.00 A) assign (resid 44 and name HN) (resid 47 and name HD1*) 0.0 0.0 5.0 ! 47 HD1* ( 0.881) (0.00 A) assign (resid 45 and name HN) (resid 42 and name HB*) 0.0 0.0 5.0 ! 42 HB* ( 1.471) (0.00 A) assign (resid 45 and name HN) (resid 42 and name HN) 0.0 0.0 5.0 ! 42 HN ( 7.675) (0.00 A) assign (resid 45 and name HN) (resid 43 and name HN) 0.0 0.0 5.0 ! 43 HN ( 7.834) (0.00 A) assign (resid 46 and name HN) (resid 43 and name HA) 0.0 0.0 5.0 ! 43 HA ( 3.955) (0.00 A) assign (resid 46 and name HN) (resid 43 and name HN) 0.0 0.0 5.0 ! 43 HN ( 7.834) (0.00 A) assign (resid 46 and name HN) (resid 44 and name HA) 0.0 0.0 5.0 ! 44 HA ( 4.450) (0.00 A) assign (resid 46 and name HN) (resid 49 and name HN) 0.0 0.0 5.0 ! 49 HN ( 8.013) (0.00 A) assign (resid 47 and name HN) (resid 44 and name HA) 0.0 0.0 3.5 ! 44 HA ( 4.450) (0.00 A) assign (resid 47 and name HN) (resid 45 and name HN) 0.0 0.0 5.0 ! 45 HN ( 8.244) (0.00 A) assign (resid 47 and name HN) (resid 49 and name HN) 0.0 0.0 5.0 ! 49 HN ( 8.013) (0.00 A) assign (resid 49 and name HN) (resid 45 and name HA) 0.0 0.0 5.0 ! 45 HA ( 3.767) (0.00 A) assign (resid 49 and name HN) (resid 47 and name HN) 0.0 0.0 5.0 ! 47 HN ( 7.413) (0.00 A) assign (resid 50 and name HN) (resid 47 and name HA) 0.0 0.0 5.0 ! 47 HA ( 3.796) (0.00 A) assign (resid 50 and name HN) (resid 47 and name HG2*) 0.0 0.0 5.0 ! 47 HG2* ( 0.863) (0.00 A) assign (resid 50 and name HN) (resid 48 and name HN) 0.0 0.0 5.0 ! 48 HN ( 8.621) (0.00 A) assign (resid 51 and name HN) (resid 48 and name HD2*) 0.0 0.0 5.0 ! 48 HD2* ( 0.882) (0.00 A) assign (resid 52 and name HN) (resid 54 and name HN) 0.0 0.0 5.0 ! 54 HN ( 8.255) (0.00 A) assign (resid 54 and name HN) (resid 52 and name HA) 0.0 0.0 5.0 ! 52 HA ( 4.238) (0.00 A) assign (resid 7 and name HN) (resid 47 and name HD1*) 0.0 0.0 5.0 ! 47 HD1* ( 0.881) (0.00 A) assign (resid 14 and name HN) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 21 and name HN) (resid 14 and name HA) 0.0 0.0 5.0 ! 14 HA ( 4.792) (0.00 A) assign (resid 21 and name HN) (resid 14 and name HB1) 0.0 0.0 5.0 ! 14 HB1 ( 3.971) (0.00 A) assign (resid 21 and name HN) (resid 15 and name HA) 0.0 0.0 3.5 ! 15 HA ( 5.177) (0.00 A) assign (resid 24 and name HE21) (resid 14 and name HE*) 0.0 0.0 5.0 ! 14 HE* ( 7.561) (0.00 A) assign (resid 34 and name HN) (resid 28 and name HB1) 0.0 0.0 5.0 ! 28 HB1 ( 2.997) (0.00 A) assign (resid 35 and name HN) (resid 29 and name HA) 0.0 0.0 5.0 ! 29 HA ( 4.566) (0.00 A) assign (resid 40 and name HN) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.577) (0.00 A) assign (resid 40 and name HN) (resid 11 and name HZ) 0.0 0.0 5.0 ! 11 HZ ( 6.784) (0.00 A) assign (resid 41 and name HN) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.577) (0.00 A) assign (resid 41 and name HN) (resid 11 and name HZ) 0.0 0.0 5.0 ! 11 HZ ( 6.784) (0.00 A) assign (resid 42 and name HN) (resid 22 and name HB*) 0.0 0.0 5.0 ! 22 HB* ( 2.641) (0.00 A) assign (resid 44 and name HN) (resid 20 and name HD2*) 0.0 0.0 5.0 ! 20 HD2* ( 0.697) (0.00 A) assign (resid 45 and name HN) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.914) (0.00 A) assign (resid 45 and name HN) (resid 20 and name HD2*) 0.0 0.0 3.5 ! 20 HD2* ( 0.697) (0.00 A) assign (resid 4 and name HB*) (resid 5 and name HB1) 0.0 0.0 5.0 ! 5 HB1 ( 2.118) (0.00 A) assign (resid 4 and name HN) (resid 3 and name HB1) 0.0 0.0 5.0 ! 3 HB1 ( 2.082) (0.00 A) assign (resid 4 and name HN) (resid 5 and name HN) 0.0 0.0 3.5 ! 5 HN ( 8.189) (0.00 A) assign (resid 5 and name HN) (resid 4 and name HA) 0.0 0.0 3.5 ! 4 HA ( 4.468) (0.00 A) assign (resid 5 and name HN) (resid 4 and name HB*) 0.0 0.0 5.0 ! 4 HB* ( 2.709) (0.00 A) assign (resid 6 and name HG*) (resid 5 and name HB1) 0.0 0.0 5.0 ! 5 HB1 ( 2.118) (0.00 A) assign (resid 6 and name HN) (resid 5 and name HA) 0.0 0.0 3.5 ! 5 HA ( 4.115) (0.00 A) assign (resid 6 and name HN) (resid 5 and name HB1) 0.0 0.0 5.0 ! 5 HB1 ( 2.118) (0.00 A) assign (resid 6 and name HN) (resid 5 and name HB2) 0.0 0.0 5.0 ! 5 HB2 ( 2.027) (0.00 A) assign (resid 6 and name HN) (resid 5 and name HN) 0.0 0.0 5.0 ! 5 HN ( 8.189) (0.00 A) assign (resid 7 and name HN) (resid 6 and name HA) 0.0 0.0 3.5 ! 6 HA ( 4.139) (0.00 A) assign (resid 7 and name HN) (resid 6 and name HN) 0.0 0.0 5.0 ! 6 HN ( 8.268) (0.00 A) assign (resid 14 and name HD*) (resid 13 and name HA) 0.0 0.0 5.0 ! 13 HA ( 4.110) (0.00 A) assign (resid 14 and name HD*) (resid 13 and name HB*) 0.0 0.0 5.0 ! 13 HB* ( 1.036) (0.00 A) assign (resid 14 and name HE*) (resid 13 and name HB*) 0.0 0.0 5.0 ! 13 HB* ( 1.036) (0.00 A) assign (resid 17 and name HB1) (resid 16 and name HD*) 0.0 0.0 5.0 ! 16 HD* ( 1.573) (0.00 A) assign (resid 21 and name HD*) (resid 20 and name HA) 0.0 0.0 5.0 ! 20 HA ( 4.529) (0.00 A) assign (resid 21 and name HN) (resid 22 and name HA) 0.0 0.0 5.0 ! 22 HA ( 4.305) (0.00 A) assign (resid 22 and name HN) (resid 21 and name HN) 0.0 0.0 5.0 ! 21 HN ( 8.188) (0.00 A) assign (resid 23 and name HD1) (resid 22 and name HB*) 0.0 0.0 5.0 ! 22 HB* ( 2.651) (0.00 A) assign (resid 24 and name HN) (resid 23 and name HB1) 0.0 0.0 5.0 ! 23 HB1 ( 2.329) (0.00 A) assign (resid 25 and name HB*) (resid 24 and name HG1) 0.0 0.0 3.5 ! 24 HG1 ( 2.388) (0.00 A) assign (resid 25 and name HN) (resid 24 and name HA) 0.0 0.0 3.5 ! 24 HA ( 4.589) (0.00 A) assign (resid 27 and name HN) (resid 26 and name HN) 0.0 0.0 5.0 ! 26 HN ( 8.624) (0.00 A) assign (resid 28 and name HA) (resid 27 and name HB2) 0.0 0.0 5.0 ! 27 HB2 ( 1.547) (0.00 A) assign (resid 32 and name HN) (resid 31 and name HA) 0.0 0.0 2.7 ! 31 HA ( 4.792) (0.00 A) assign (resid 32 and name HN) (resid 31 and name HB2) 0.0 0.0 5.0 ! 31 HB2 ( 3.938) (0.00 A) assign (resid 33 and name HN) (resid 32 and name HG) 0.0 0.0 5.0 ! 32 HG ( 1.705) (0.00 A) assign (resid 36 and name HN) (resid 35 and name HG2*) 0.0 0.0 3.5 ! 35 HG2* ( 0.949) (0.00 A) assign (resid 37 and name HE*) (resid 38 and name HD1*) 0.0 0.0 5.0 ! 38 HD1* ( 0.432) (0.00 A) assign (resid 37 and name HZ) (resid 38 and name HA) 0.0 0.0 5.0 ! 38 HA ( 3.529) (0.00 A) assign (resid 37 and name HZ) (resid 38 and name HD1*) 0.0 0.0 5.0 ! 38 HD1* ( 0.432) (0.00 A) assign (resid 37 and name HZ) (resid 38 and name HG11) 0.0 0.0 5.0 ! 38 HG11 ( 1.413) (0.00 A) assign (resid 37 and name HZ) (resid 38 and name HG2*) 0.0 0.0 5.0 ! 38 HG2* ( 0.834) (0.00 A) assign (resid 38 and name HN) (resid 37 and name HB1) 0.0 0.0 3.5 ! 37 HB1 ( 3.467) (0.00 A) assign (resid 40 and name HN) (resid 39 and name HB1) 0.0 0.0 5.0 ! 39 HB1 ( 2.902) (0.00 A) assign (resid 40 and name HN) (resid 39 and name HB2) 0.0 0.0 5.0 ! 39 HB2 ( 2.801) (0.00 A) assign (resid 40 and name HN) (resid 39 and name HN) 0.0 0.0 5.0 ! 39 HN ( 8.463) (0.00 A) assign (resid 41 and name HN) (resid 40 and name HB1) 0.0 0.0 5.0 ! 40 HB1 ( 2.022) (0.00 A) assign (resid 42 and name HN) (resid 41 and name HB1) 0.0 0.0 3.5 ! 41 HB1 ( 2.877) (0.00 A) assign (resid 42 and name HN) (resid 41 and name HB2) 0.0 0.0 3.5 ! 41 HB2 ( 2.188) (0.00 A) assign (resid 44 and name HN) (resid 45 and name HN) 0.0 0.0 5.0 ! 45 HN ( 8.243) (0.00 A) assign (resid 46 and name HA) (resid 45 and name HG*) 0.0 0.0 3.5 ! 45 HG* ( 1.203) (0.00 A) assign (resid 46 and name HG1) (resid 47 and name HB) 0.0 0.0 5.0 ! 47 HB ( 1.994) (0.00 A) assign (resid 46 and name HN) (resid 47 and name HN) 0.0 0.0 3.5 ! 47 HN ( 7.438) (0.00 A) assign (resid 48 and name HN) (resid 47 and name HA) 0.0 0.0 5.0 ! 47 HA ( 3.779) (0.00 A) assign (resid 48 and name HN) (resid 47 and name HB) 0.0 0.0 3.5 ! 47 HB ( 1.994) (0.00 A) assign (resid 49 and name HG1) (resid 48 and name HD1*) 0.0 0.0 5.0 ! 48 HD1* ( 0.960) (0.00 A) assign (resid 52 and name HA) (resid 51 and name HB*) 0.0 0.0 5.0 ! 51 HB* ( 2.071) (0.00 A) assign (resid 52 and name HN) (resid 51 and name HA) 0.0 0.0 3.5 ! 51 HA ( 4.230) (0.00 A) assign (resid 52 and name HN) (resid 51 and name HB*) 0.0 0.0 5.0 ! 51 HB* ( 2.071) (0.00 A) assign (resid 52 and name HN) (resid 53 and name HN) 0.0 0.0 5.0 ! 53 HN ( 7.974) (0.00 A) assign (resid 53 and name HN) (resid 52 and name HA) 0.0 0.0 3.5 ! 52 HA ( 4.316) (0.00 A) assign (resid 5 and name HN) (resid 7 and name HA) 0.0 0.0 5.0 ! 7 HA ( 4.355) (0.00 A) assign (resid 12 and name HA) (resid 15 and name HG1) 0.0 0.0 5.0 ! 15 HG1 ( 2.689) (0.00 A) assign (resid 12 and name HA) (resid 15 and name HG2) 0.0 0.0 5.0 ! 15 HG2 ( 2.382) (0.00 A) assign (resid 12 and name HG*) (resid 15 and name HG2) 0.0 0.0 3.5 ! 15 HG2 ( 2.382) (0.00 A) assign (resid 13 and name HN) (resid 15 and name HN) 0.0 0.0 5.0 ! 15 HN ( 7.453) (0.00 A) assign (resid 14 and name HD*) (resid 11 and name HA) 0.0 0.0 3.5 ! 11 HA ( 4.745) (0.00 A) assign (resid 14 and name HD*) (resid 11 and name HB1) 0.0 0.0 5.0 ! 11 HB1 ( 3.646) (0.00 A) assign (resid 14 and name HD*) (resid 11 and name HD*) 0.0 0.0 3.5 ! 11 HD* ( 7.121) (0.00 A) assign (resid 14 and name HE*) (resid 11 and name HD*) 0.0 0.0 3.5 ! 11 HD* ( 7.121) (0.00 A) assign (resid 14 and name HN) (resid 12 and name HA) 0.0 0.0 5.0 ! 12 HA ( 3.887) (0.00 A) assign (resid 15 and name HA) (resid 20 and name HA) 0.0 0.0 3.5 ! 20 HA ( 4.529) (0.00 A) assign (resid 15 and name HA) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 15 and name HB2) (resid 20 and name HB1) 0.0 0.0 5.0 ! 20 HB1 ( 1.723) (0.00 A) assign (resid 16 and name HB*) (resid 19 and name HD*) 0.0 0.0 3.5 ! 19 HD* ( 1.604) (0.00 A) assign (resid 16 and name HN) (resid 19 and name HB*) 0.0 0.0 5.0 ! 19 HB* ( 1.761) (0.00 A) assign (resid 16 and name HN) (resid 20 and name HA) 0.0 0.0 5.0 ! 20 HA ( 4.529) (0.00 A) assign (resid 16 and name HN) (resid 21 and name HD*) 0.0 0.0 5.0 ! 21 HD* ( 7.372) (0.00 A) assign (resid 21 and name HD*) (resid 16 and name HB*) 0.0 0.0 3.5 ! 16 HB* ( 1.856) (0.00 A) assign (resid 21 and name HD*) (resid 16 and name HG2) 0.0 0.0 5.0 ! 16 HG2 ( 1.390) (0.00 A) assign (resid 21 and name HD*) (resid 19 and name HB*) 0.0 0.0 5.0 ! 19 HB* ( 1.761) (0.00 A) assign (resid 21 and name HE*) (resid 16 and name HB*) 0.0 0.0 5.0 ! 16 HB* ( 1.856) (0.00 A) assign (resid 21 and name HE*) (resid 19 and name HB*) 0.0 0.0 5.0 ! 19 HB* ( 1.761) (0.00 A) assign (resid 25 and name HN) (resid 28 and name HZ) 0.0 0.0 5.0 ! 28 HZ ( 7.368) (0.00 A) assign (resid 27 and name HA) (resid 30 and name HB*) 0.0 0.0 5.0 ! 30 HB* ( 2.078) (0.00 A) assign (resid 28 and name HE*) (resid 24 and name HG2) 0.0 0.0 5.0 ! 24 HG2 ( 2.326) (0.00 A) assign (resid 28 and name HE*) (resid 25 and name HB*) 0.0 0.0 3.5 ! 25 HB* ( 2.701) (0.00 A) assign (resid 28 and name HZ) (resid 25 and name HB*) 0.0 0.0 3.5 ! 25 HB* ( 2.701) (0.00 A) assign (resid 29 and name HD*) (resid 26 and name HB*) 0.0 0.0 5.0 ! 26 HB* ( 1.817) (0.00 A) assign (resid 31 and name HN) (resid 29 and name HA) 0.0 0.0 5.0 ! 29 HA ( 4.574) (0.00 A) assign (resid 34 and name HA1) (resid 37 and name HB1) 0.0 0.0 5.0 ! 37 HB1 ( 3.467) (0.00 A) assign (resid 34 and name HA1) (resid 37 and name HB2) 0.0 0.0 5.0 ! 37 HB2 ( 3.351) (0.00 A) assign (resid 34 and name HA2) (resid 37 and name HB1) 0.0 0.0 5.0 ! 37 HB1 ( 3.467) (0.00 A) assign (resid 35 and name HA) (resid 38 and name HG11) 0.0 0.0 5.0 ! 38 HG11 ( 1.413) (0.00 A) assign (resid 35 and name HA) (resid 38 and name HG2*) 0.0 0.0 5.0 ! 38 HG2* ( 0.834) (0.00 A) assign (resid 36 and name HA) (resid 39 and name HB1) 0.0 0.0 5.0 ! 39 HB1 ( 2.902) (0.00 A) assign (resid 36 and name HA) (resid 39 and name HB2) 0.0 0.0 5.0 ! 39 HB2 ( 2.801) (0.00 A) assign (resid 36 and name HN) (resid 32 and name HA) 0.0 0.0 5.0 ! 32 HA ( 4.217) (0.00 A) assign (resid 36 and name HN) (resid 33 and name HA) 0.0 0.0 3.5 ! 33 HA ( 4.466) (0.00 A) assign (resid 37 and name HA) (resid 40 and name HB2) 0.0 0.0 5.0 ! 40 HB2 ( 1.933) (0.00 A) assign (resid 38 and name HN) (resid 35 and name HA) 0.0 0.0 5.0 ! 35 HA ( 3.631) (0.00 A) assign (resid 38 and name HN) (resid 36 and name HA) 0.0 0.0 5.0 ! 36 HA ( 4.271) (0.00 A) assign (resid 39 and name HA) (resid 42 and name HB*) 0.0 0.0 5.0 ! 42 HB* ( 1.477) (0.00 A) assign (resid 39 and name HD21) (resid 35 and name HG2*) 0.0 0.0 5.0 ! 35 HG2* ( 0.949) (0.00 A) assign (resid 39 and name HD21) (resid 36 and name HA) 0.0 0.0 5.0 ! 36 HA ( 4.271) (0.00 A) assign (resid 39 and name HD22) (resid 35 and name HG2*) 0.0 0.0 3.5 ! 35 HG2* ( 0.949) (0.00 A) assign (resid 39 and name HN) (resid 41 and name HN) 0.0 0.0 5.0 ! 41 HN ( 8.018) (0.00 A) assign (resid 40 and name HN) (resid 36 and name HA) 0.0 0.0 5.0 ! 36 HA ( 4.271) (0.00 A) assign (resid 42 and name HA) (resid 45 and name HB*) 0.0 0.0 5.0 ! 45 HB* ( 1.958) (0.00 A) assign (resid 42 and name HA) (resid 45 and name HD*) 0.0 0.0 5.0 ! 45 HD* ( 1.714) (0.00 A) assign (resid 42 and name HB*) (resid 45 and name HD*) 0.0 0.0 5.0 ! 45 HD* ( 1.714) (0.00 A) assign (resid 43 and name HA) (resid 46 and name HB*) 0.0 0.0 5.0 ! 46 HB* ( 2.202) (0.00 A) assign (resid 44 and name HA) (resid 47 and name HB) 0.0 0.0 5.0 ! 47 HB ( 1.994) (0.00 A) assign (resid 45 and name HN) (resid 42 and name HA) 0.0 0.0 5.0 ! 42 HA ( 3.848) (0.00 A) assign (resid 46 and name HA) (resid 49 and name HB1) 0.0 0.0 5.0 ! 49 HB1 ( 2.133) (0.00 A) assign (resid 46 and name HG1) (resid 48 and name HD1*) 0.0 0.0 5.0 ! 48 HD1* ( 0.960) (0.00 A) assign (resid 47 and name HA) (resid 50 and name HB*) 0.0 0.0 5.0 ! 50 HB* ( 1.962) (0.00 A) assign (resid 48 and name HA) (resid 51 and name HB*) 0.0 0.0 5.0 ! 51 HB* ( 2.071) (0.00 A) assign (resid 48 and name HN) (resid 45 and name HA) 0.0 0.0 5.0 ! 45 HA ( 3.776) (0.00 A) assign (resid 49 and name HA) (resid 52 and name HB*) 0.0 0.0 5.0 ! 52 HB* ( 1.451) (0.00 A) assign (resid 49 and name HN) (resid 47 and name HA) 0.0 0.0 5.0 ! 47 HA ( 3.779) (0.00 A) assign (resid 50 and name HG*) (resid 47 and name HD1*) 0.0 0.0 3.5 ! 47 HD1* ( 0.862) (0.00 A) assign (resid 52 and name HN) (resid 49 and name HA) 0.0 0.0 5.0 ! 49 HA ( 4.110) (0.00 A) assign (resid 55 and name HN) (resid 53 and name HA) 0.0 0.0 5.0 ! 53 HA ( 4.374) (0.00 A) assign (resid 11 and name HB2) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 11 and name HB2) (resid 48 and name HD1*) 0.0 0.0 5.0 ! 48 HD1* ( 0.960) (0.00 A) assign (resid 11 and name HD*) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 11 and name HD*) (resid 20 and name HD2*) 0.0 0.0 5.0 ! 20 HD2* ( 0.715) (0.00 A) assign (resid 11 and name HD*) (resid 37 and name HB2) 0.0 0.0 5.0 ! 37 HB2 ( 3.351) (0.00 A) assign (resid 11 and name HD*) (resid 41 and name HB2) 0.0 0.0 5.0 ! 41 HB2 ( 2.188) (0.00 A) assign (resid 11 and name HE*) (resid 26 and name HG*) 0.0 0.0 5.0 ! 26 HG* ( 1.539) (0.00 A) assign (resid 11 and name HE*) (resid 40 and name HB2) 0.0 0.0 5.0 ! 40 HB2 ( 1.933) (0.00 A) assign (resid 11 and name HE*) (resid 40 and name HD*) 0.0 0.0 5.0 ! 40 HD* ( 1.823) (0.00 A) assign (resid 11 and name HE*) (resid 40 and name HE*) 0.0 0.0 5.0 ! 40 HE* ( 3.040) (0.00 A) assign (resid 11 and name HE*) (resid 41 and name HB1) 0.0 0.0 5.0 ! 41 HB1 ( 2.877) (0.00 A) assign (resid 11 and name HE*) (resid 41 and name HB2) 0.0 0.0 5.0 ! 41 HB2 ( 2.188) (0.00 A) assign (resid 11 and name HZ) (resid 37 and name HA) 0.0 0.0 5.0 ! 37 HA ( 4.398) (0.00 A) assign (resid 11 and name HZ) (resid 40 and name HB1) 0.0 0.0 5.0 ! 40 HB1 ( 2.022) (0.00 A) assign (resid 11 and name HZ) (resid 40 and name HB2) 0.0 0.0 5.0 ! 40 HB2 ( 1.933) (0.00 A) assign (resid 11 and name HZ) (resid 40 and name HD*) 0.0 0.0 5.0 ! 40 HD* ( 1.823) (0.00 A) assign (resid 11 and name HZ) (resid 41 and name HB2) 0.0 0.0 5.0 ! 41 HB2 ( 2.188) (0.00 A) assign (resid 12 and name HA) (resid 48 and name HD1*) 0.0 0.0 5.0 ! 48 HD1* ( 0.960) (0.00 A) assign (resid 14 and name HB1) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 14 and name HB2) (resid 20 and name HD1*) 0.0 0.0 3.5 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 14 and name HD*) (resid 20 and name HD1*) 0.0 0.0 5.0 ! 20 HD1* ( 0.919) (0.00 A) assign (resid 14 and name HD*) (resid 37 and name HD*) 0.0 0.0 5.0 ! 37 HD* ( 7.209) (0.00 A) assign (resid 14 and name HE*) (resid 37 and name HD*) 0.0 0.0 5.0 ! 37 HD* ( 7.209) (0.00 A) assign (resid 14 and name HE*) (resid 37 and name HE*) 0.0 0.0 5.0 ! 37 HE* ( 7.032) (0.00 A) assign (resid 21 and name HZ) (resid 14 and name HA) 0.0 0.0 5.0 ! 14 HA ( 4.795) (0.00 A) assign (resid 28 and name HD*) (resid 34 and name HA1) 0.0 0.0 5.0 ! 34 HA1 ( 4.422) (0.00 A) assign (resid 29 and name HD*) (resid 35 and name HD1*) 0.0 0.0 3.5 ! 35 HD1* ( 0.915) (0.00 A) assign (resid 29 and name HD*) (resid 35 and name HG1*) 0.0 0.0 5.0 ! 35 HG1* ( 1.161) (0.00 A) assign (resid 29 and name HD*) (resid 35 and name HG2*) 0.0 0.0 5.0 ! 35 HG2* ( 0.949) (0.00 A) assign (resid 29 and name HD*) (resid 38 and name HD1*) 0.0 0.0 3.5 ! 38 HD1* ( 0.432) (0.00 A) assign (resid 29 and name HD*) (resid 38 and name HG2*) 0.0 0.0 3.5 ! 38 HG2* ( 0.834) (0.00 A) assign (resid 34 and name HN) (resid 28 and name HA) 0.0 0.0 5.0 ! 28 HA ( 4.231) (0.00 A) assign (resid 37 and name HD*) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.602) (0.00 A) assign (resid 37 and name HE*) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.602) (0.00 A) assign (resid 37 and name HZ) (resid 11 and name HE*) 0.0 0.0 5.0 ! 11 HE* ( 6.602) (0.00 A) assign (resid 37 and name HZ) (resid 11 and name HZ) 0.0 0.0 5.0 ! 11 HZ ( 6.784) (0.00 A) assign (resid 41 and name HB1) (resid 22 and name HB*) 0.0 0.0 5.0 ! 22 HB* ( 2.651) (0.00 A) assign (resid 45 and name HA) (resid 20 and name HD2*) 0.0 0.0 3.5 ! 20 HD2* ( 0.715) (0.00 A) assign (resid 45 and name HE*) (resid 20 and name HD2*) 0.0 0.0 5.0 ! 20 HD2* ( 0.715) (0.00 A) assign (resid 48 and name HD1*) (resid 20 and name HD2*) 0.0 0.0 2.7 ! 20 HD2* ( 0.715) (0.00 A)
Contact the webmaster for help, if required. Friday, May 3, 2024 7:36:04 PM GMT (wattos1)