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
513595 2laj 17529 cing 1-original 2 XPLOR/CNS distance NOE simple


!From xeasy noes, file 1                
assign ( resid 485 and name HA ) ( resid 495 and name HA ) 4.0846 1.98815384615385 1.98815384615385   
assign ( resid 483 and name HA ) ( resid 484 and name HN ) 2.9381 1.10623076923077 1.10623076923077   
assign ( resid 483 and name HN ) ( resid 482 and name HN ) 3.3449 1.41915384615385 1.41915384615385   
assign ( resid 482 and name HA1 ) ( resid 483 and name HN ) 3.4361 1.48930769230769 1.48930769230769   
assign ( resid 482 and name HA2 ) ( resid 483 and name HN ) 3.5783 1.59869230769231 1.59869230769231   
assign ( resid 483 and name HA ) ( resid 498 and name HN ) 3.4576 1.50584615384615 1.50584615384615   
assign ( resid 497 and name HA ) ( resid 483 and name HA ) 3.5347 1.56515384615385 1.56515384615385   
assign ( resid 497 and name HA ) ( resid 484 and name HN ) 3.5973 1.61330769230769 1.61330769230769   
assign ( resid 483 and name HN ) ( resid 484 and name HN ) 3.7404 1.72338461538462 1.72338461538462   
assign ( resid 485 and name HN ) ( resid 484 and name HN ) 4.2390 2.10692307692308 2.10692307692308   
assign ( resid 484 and name HA ) ( resid 485 and name HN ) 3.1332 1.25630769230769 1.25630769230769   
assign ( resid 496 and name HN ) ( resid 484 and name HN ) 3.6327 1.64053846153846 1.64053846153846   
assign ( resid 485 and name HA ) ( resid 496 and name HN ) 3.6871 1.68238461538462 1.68238461538462   
assign ( resid 504 and name HA ) ( resid 505 and name HN ) 3.7088 1.69907692307692 1.69907692307692   
assign ( resid 490 and name HN ) ( resid 491 and name HN ) 3.6833 1.67946153846154 1.67946153846154   
assign ( resid 492 and name HN ) ( resid 491 and name HN ) 3.4951 1.53469230769231 1.53469230769231   
assign ( resid 490 and name HA ) ( resid 491 and name HN ) 3.3492 1.42246153846154 1.42246153846154   
assign ( resid 482 and name HA1 ) ( resid 483 and name HZ3 ) 3.9695 1.89961538461538 1.89961538461538   
assign ( resid 496 and name HA ) ( resid 504 and name HN ) 3.9214 1.86261538461538 1.86261538461538   
assign ( resid 503 and name HA ) ( resid 504 and name HN ) 2.8661 1.05084615384615 1.05084615384615   
assign ( resid 491 and name HA2 ) ( resid 492 and name HN ) 3.9089 1.853 1.853   
assign ( resid 491 and name HA1 ) ( resid 492 and name HN ) 3.9028 1.84830769230769 1.84830769230769   
assign ( resid 487 and name HA ) ( resid 488 and name HN ) 2.7370 0.951538461538462 0.951538461538462   
assign ( resid 492 and name HA ) ( resid 493 and name HD2 ) 3.3610 1.43153846153846 1.43153846153846   
assign ( resid 492 and name HA ) ( resid 493 and name HD1 ) 2.9837 1.14130769230769 1.14130769230769   
assign ( resid 485 and name HA ) ( resid 486 and name HN ) 2.9520 1.11692307692308 1.11692307692308   
assign ( resid 499 and name HN ) ( resid 498 and name HN ) 3.2766 1.36661538461538 1.36661538461538   
assign ( resid 483 and name HB1 ) ( resid 484 and name HN ) 3.5130 1.54846153846154 1.54846153846154   
assign ( resid 483 and name HB2 ) ( resid 484 and name HN ) 3.7388 1.72215384615385 1.72215384615385   
assign ( resid 495 and name HA ) ( resid 496 and name HN ) 2.9764 1.13569230769231 1.13569230769231   
assign ( resid 495 and name HB2 ) ( resid 496 and name HN ) 3.8758 1.82753846153846 1.82753846153846   
assign ( resid 484 and name HB2 ) ( resid 485 and name HN ) 3.7836 1.75661538461538 1.75661538461538   
assign ( resid 496 and name HA ) ( resid 497 and name HN ) 3.2312 1.33169230769231 1.33169230769231   
assign ( resid 497 and name HB1 ) ( resid 498 and name HN ) 3.9330 1.87153846153846 1.87153846153846   
assign ( resid 497 and name HA ) ( resid 498 and name HN ) 2.5992 0.845538461538461 0.845538461538461   
assign ( resid 498 and name HA ) ( resid 499 and name HN ) 3.6064 1.62030769230769 1.62030769230769   
assign ( resid 498 and name HB1 ) ( resid 499 and name HN ) 3.6077 1.62130769230769 1.62130769230769   
assign ( resid 498 and name HB2 ) ( resid 499 and name HN ) 3.6886 1.68353846153846 1.68353846153846   
assign ( resid 504 and name HG2+ ) ( resid 505 and name HN ) 4.3346 2.18046153846154 2.18046153846154   
assign ( resid 503 and name HG2+ ) ( resid 504 and name HN ) 3.6802 1.67707692307692 1.67707692307692   
assign ( resid 480 and name HD2 ) ( resid 479 and name HD1+ ) 4.1403 2.031 2.031   
assign ( resid 479 and name HA ) ( resid 480 and name HD2 ) 3.3112 1.39323076923077 1.39323076923077   
assign ( resid 478 and name HN ) ( resid 479 and name HN ) 4.1236 2.01815384615385 2.01815384615385   
assign ( resid 478 and name HB1 ) ( resid 479 and name HN ) 3.6804 1.67723076923077 1.67723076923077   
assign ( resid 478 and name HB2 ) ( resid 479 and name HN ) 3.6341 1.64161538461538 1.64161538461538   
assign ( resid 478 and name HA ) ( resid 479 and name HN ) 3.1460 1.26615384615385 1.26615384615385   
assign ( resid 479 and name HN ) ( resid 478 and name HA ) 4.3945 2.22653846153846 2.22653846153846   
assign ( resid 476 and name HB1 ) ( resid 477 and name HN ) 2.8860 1.06615384615385 1.06615384615385   
assign ( resid 476 and name HB2 ) ( resid 477 and name HN ) 2.7236 0.941230769230769 0.941230769230769   
assign ( resid 507 and name HN ) ( resid 506 and name HN ) 3.7474 1.72876923076923 1.72876923076923   
assign ( resid 476 and name HA ) ( resid 477 and name HN ) 2.0669 0.5 0.5   
assign ( resid 475 and name HA ) ( resid 476 and name HN ) 1.7500 0.5 0.5   
assign ( resid 487 and name HD1+ ) ( resid 488 and name HN ) 3.9643 1.89561538461538 1.89561538461538   
assign ( resid 487 and name HG2+ ) ( resid 488 and name HN ) 4.4862 2.29707692307692 2.29707692307692   
assign ( resid 487 and name HB ) ( resid 488 and name HN ) 3.5777 1.59823076923077 1.59823076923077   
assign ( resid 514 and name HA ) ( resid 515 and name HN ) 2.3918 0.686 0.686   
assign ( resid 514 and name HG1+ ) ( resid 515 and name HN ) 4.2518 2.11676923076923 2.11676923076923   
assign ( resid 514 and name HB ) ( resid 515 and name HN ) 3.4147 1.47284615384615 1.47284615384615   
assign ( resid 510 and name HA ) ( resid 511 and name HN ) 3.6389 1.64530769230769 1.64530769230769   
assign ( resid 511 and name HA ) ( resid 512 and name HN ) 3.7474 1.72876923076923 1.72876923076923   
assign ( resid 511 and name HG2 ) ( resid 512 and name HN ) 4.3223 2.171 2.171   
assign ( resid 511 and name HD2 ) ( resid 512 and name HN ) 3.7571 1.73623076923077 1.73623076923077   
assign ( resid 511 and name HB2 ) ( resid 512 and name HN ) 3.1297 1.25361538461538 1.25361538461538   
assign ( resid 511 and name HN ) ( resid 512 and name HN ) 4.2798 2.13830769230769 2.13830769230769   
assign ( resid 510 and name HN ) ( resid 512 and name HN ) 4.2630 2.12538461538462 2.12538461538462   
assign ( resid 499 and name HA ) ( resid 500 and name HN ) 3.4568 1.50523076923077 1.50523076923077   
assign ( resid 499 and name HB2 ) ( resid 500 and name HN ) 3.3983 1.46023076923077 1.46023076923077   
assign ( resid 499 and name HB1 ) ( resid 500 and name HN ) 3.3735 1.44115384615385 1.44115384615385   
assign ( resid 502 and name HN ) ( resid 501 and name HN ) 3.5209 1.55453846153846 1.55453846153846   
assign ( resid 500 and name HN ) ( resid 501 and name HN ) 3.0945 1.22653846153846 1.22653846153846   
assign ( resid 500 and name HG2+ ) ( resid 501 and name HN ) 3.9407 1.87746153846154 1.87746153846154   
assign ( resid 497 and name HB1 ) ( resid 483 and name HE3 ) 3.6679 1.66761538461538 1.66761538461538   
assign ( resid 497 and name HB1 ) ( resid 483 and name HH2 ) 3.6901 1.68469230769231 1.68469230769231   
assign ( resid 484 and name HB1 ) ( resid 496 and name HN ) 4.2215 2.09346153846154 2.09346153846154   
assign ( resid 484 and name HB2 ) ( resid 496 and name HN ) 4.1485 2.03730769230769 2.03730769230769   
assign ( resid 484 and name HG2 ) ( resid 496 and name HN ) 4.1485 2.03730769230769 2.03730769230769   
assign ( resid 483 and name HE3 ) ( resid 484 and name HN ) 4.0767 1.98207692307692 1.98207692307692   
assign ( resid 483 and name HE3 ) ( resid 496 and name HN ) 3.9100 1.85384615384615 1.85384615384615   
assign ( resid 495 and name HA ) ( resid 808 and name H?5 ) 5.2030 2.84846153846154 2.84846153846154   
assign ( resid 494 and name HA ) ( resid 505 and name HZ3 ) 3.2813 1.37023076923077 1.37023076923077   
assign ( resid 494 and name HA ) ( resid 495 and name HN ) 3.5221 1.55546153846154 1.55546153846154   
assign ( resid 483 and name HZ3 ) ( resid 484 and name HN ) 3.5444 1.57261538461538 1.57261538461538   
assign ( resid 503 and name HB ) ( resid 494 and name HD+ ) 3.6110 1.62384615384615 1.62384615384615   
assign ( resid 503 and name HB ) ( resid 504 and name HN ) 3.5052 1.54246153846154 1.54246153846154   
assign ( resid 488 and name HB+ ) ( resid 494 and name HE+ ) 4.4920 2.30153846153846 2.30153846153846   
assign ( resid 487 and name HA ) ( resid 494 and name HN ) 3.9347 1.87284615384615 1.87284615384615   
assign ( resid 503 and name HG2+ ) ( resid 494 and name HE+ ) 4.0626 1.97123076923077 1.97123076923077   
assign ( resid 496 and name HB1 ) ( resid 494 and name HE+ ) 4.3284 2.17569230769231 2.17569230769231   
assign ( resid 486 and name HB1 ) ( resid 494 and name HE+ ) 4.1266 2.02046153846154 2.02046153846154   
assign ( resid 486 and name HB1 ) ( resid 494 and name HD+ ) 3.8789 1.82992307692308 1.82992307692308   
assign ( resid 494 and name HE+ ) ( resid 487 and name HN ) 4.4808 2.29292307692308 2.29292307692308   
assign ( resid 485 and name HA ) ( resid 495 and name HD+ ) 3.3990 1.46076923076923 1.46076923076923   
assign ( resid 479 and name HD2+ ) ( resid 495 and name HD+ ) 3.6951 1.68853846153846 1.68853846153846   
assign ( resid 479 and name HD2+ ) ( resid 478 and name HD+ ) 3.7525 1.73269230769231 1.73269230769231   
assign ( resid 479 and name HD2+ ) ( resid 483 and name HN ) 4.2033 2.07946153846154 2.07946153846154   
assign ( resid 479 and name HD2+ ) ( resid 483 and name HE1 ) 4.3855 2.21961538461538 2.21961538461538   
assign ( resid 483 and name HA ) ( resid 497 and name HA ) 3.1983 1.30638461538462 1.30638461538462   
assign ( resid 479 and name HD1+ ) ( resid 483 and name HN ) 4.3945 2.22653846153846 2.22653846153846   
assign ( resid 473 and name HA1 ) ( resid 474 and name HN ) 2.2829 0.602230769230769 0.602230769230769   
assign ( resid 480 and name HA ) ( resid 481 and name HD2 ) 3.0887 1.22207692307692 1.22207692307692   
assign ( resid 480 and name HA ) ( resid 481 and name HD1 ) 3.2298 1.33061538461538 1.33061538461538   
assign ( resid 505 and name HB1 ) ( resid 506 and name HN ) 3.8721 1.82469230769231 1.82469230769231   
assign ( resid 511 and name HB1 ) ( resid 512 and name HN ) 3.1941 1.30315384615385 1.30315384615385   
assign ( resid 487 and name HG2+ ) ( resid 491 and name HN ) 4.5697 2.36130769230769 2.36130769230769   
assign ( resid 490 and name HA ) ( resid 491 and name HN ) 3.3492 1.42246153846154 1.42246153846154   
assign ( resid 500 and name HN ) ( resid 499 and name HN ) 3.2161 1.32007692307692 1.32007692307692   
assign ( resid 501 and name HN ) ( resid 499 and name HN ) 3.4207 1.47746153846154 1.47746153846154   
assign ( resid 488 and name HA ) ( resid 489 and name HD2 ) 2.5462 0.804769230769231 0.804769230769231   
assign ( resid 488 and name HA ) ( resid 489 and name HD1 ) 2.6223 0.863307692307692 0.863307692307692   
assign ( resid 515 and name HN ) ( resid 514 and name HN ) 3.2821 1.37084615384615 1.37084615384615   
assign ( resid 506 and name HN ) ( resid 505 and name HN ) 3.6774 1.67492307692308 1.67492307692308   
assign ( resid 495 and name HE+ ) ( resid 496 and name HN ) 4.9078 2.62138461538462 2.62138461538462   
assign ( resid 486 and name HA ) ( resid 487 and name HN ) 3.8763 1.82792307692308 1.82792307692308   
assign ( resid 512 and name HA ) ( resid 513 and name HD2 ) 2.5184 0.783384615384615 0.783384615384615   
assign ( resid 486 and name HG1 ) ( resid 487 and name HN ) 4.5395 2.33807692307692 2.33807692307692   
assign ( resid 480 and name HG1 ) ( resid 483 and name HE1 ) 3.6133 1.62561538461538 1.62561538461538   
assign ( resid 480 and name HG2 ) ( resid 483 and name HE1 ) 3.8918 1.83984615384615 1.83984615384615   
assign ( resid 480 and name HB1 ) ( resid 483 and name HE1 ) 3.5666 1.58969230769231 1.58969230769231   
assign ( resid 480 and name HB2 ) ( resid 483 and name HE1 ) 3.7809 1.75453846153846 1.75453846153846   
assign ( resid 480 and name HD2 ) ( resid 483 and name HE1 ) 4.1159 2.01223076923077 2.01223076923077   
assign ( resid 506 and name HA ) ( resid 507 and name HN ) 2.2651 0.588538461538461 0.588538461538461   
assign ( resid 506 and name HG2 ) ( resid 507 and name HN ) 3.5954 1.61184615384615 1.61184615384615   
assign ( resid 506 and name HB2 ) ( resid 507 and name HN ) 3.6586 1.66046153846154 1.66046153846154   
assign ( resid 506 and name HB1 ) ( resid 507 and name HN ) 3.1575 1.275 1.275   
assign ( resid 508 and name HB2 ) ( resid 509 and name HN ) 3.8421 1.80161538461538 1.80161538461538   
assign ( resid 508 and name HB1 ) ( resid 509 and name HN ) 4.0783 1.98330769230769 1.98330769230769   
assign ( resid 508 and name HG2 ) ( resid 509 and name HN ) 2.9986 1.15276923076923 1.15276923076923   
assign ( resid 510 and name HA ) ( resid 509 and name HN ) 3.0620 1.20153846153846 1.20153846153846   
assign ( resid 510 and name HN ) ( resid 509 and name HN ) 3.1838 1.29523076923077 1.29523076923077   
assign ( resid 509 and name HA ) ( resid 510 and name HN ) 3.8622 1.81707692307692 1.81707692307692   
assign ( resid 496 and name HB1 ) ( resid 497 and name HN ) 3.7421 1.72469230769231 1.72469230769231   
assign ( resid 492 and name HN ) ( resid 488 and name HN ) 4.9761 2.67392307692308 2.67392307692308   
assign ( resid 476 and name HA ) ( resid 808 and name H?5 ) 3.9595 1.89192307692308 1.89192307692308   
assign ( resid 484 and name HB1 ) ( resid 485 and name HN ) 3.5672 1.59015384615385 1.59015384615385   
assign ( resid 337 and name H?5 ) ( resid 489 and name HG1 ) 3.4339 1.48761538461538 1.48761538461538   
assign ( resid 512 and name HA ) ( resid 513 and name HD1 ) 2.5360 0.796923076923077 0.796923076923077   
assign ( resid 505 and name HA ) ( resid 495 and name HN ) 4.0651 1.97315384615385 1.97315384615385   
assign ( resid 493 and name HA ) ( resid 488 and name HA ) 3.7849 1.75761538461538 1.75761538461538   
assign ( resid 499 and name HD21 ) ( resid 483 and name HE1 ) 4.8352 2.56553846153846 2.56553846153846   
assign ( resid 499 and name HD22 ) ( resid 483 and name HE1 ) 4.9233 2.63330769230769 2.63330769230769   
assign ( resid 504 and name HB ) ( resid 495 and name HA ) 4.7048 2.46523076923077 2.46523076923077   
assign ( resid 485 and name HG2 ) ( resid 495 and name HA ) 4.4951 2.30392307692308 2.30392307692308   
assign ( resid 487 and name HD1+ ) ( resid 495 and name HA ) 6.0000 3.46153846153846 3.46153846153846   
assign ( resid 487 and name HG2+ ) ( resid 495 and name HA ) 4.9543 2.65715384615385 2.65715384615385   
assign ( resid 487 and name HB ) ( resid 495 and name HA ) 5.1780 2.82923076923077 2.82923076923077   
assign ( resid 488 and name HB+ ) ( resid 494 and name HE+ ) 4.4920 2.30153846153846 2.30153846153846   
assign ( resid 479 and name HB2 ) ( resid 495 and name HD+ ) 3.5507 1.57746153846154 1.57746153846154   
assign ( resid 479 and name HB1 ) ( resid 495 and name HD+ ) 3.9089 1.853 1.853   
assign ( resid 504 and name HG2+ ) ( resid 483 and name HZ3 ) 3.7060 1.69692307692308 1.69692307692308   
assign ( resid 504 and name HG2+ ) ( resid 483 and name HH2 ) 3.2613 1.35484615384615 1.35484615384615   
assign ( resid 504 and name HG2+ ) ( resid 483 and name HZ2 ) 3.5728 1.59446153846154 1.59446153846154   
assign ( resid 504 and name HG2+ ) ( resid 483 and name HE3 ) 3.1568 1.27446153846154 1.27446153846154   
assign ( resid 477 and name HB2 ) ( resid 478 and name HE+ ) 4.0230 1.94076923076923 1.94076923076923   
assign ( resid 495 and name HB2 ) ( resid 483 and name HE3 ) 3.3749 1.44223076923077 1.44223076923077   
assign ( resid 510 and name HN ) ( resid 511 and name HN ) 3.6199 1.63069230769231 1.63069230769231   
assign ( resid 494 and name HB1 ) ( resid 495 and name HN ) 3.9295 1.86884615384615 1.86884615384615   
assign ( resid 494 and name HB2 ) ( resid 495 and name HN ) 4.1359 2.02761538461538 2.02761538461538   
assign ( resid 494 and name HB2 ) ( resid 505 and name HE3 ) 3.6025 1.61730769230769 1.61730769230769   
assign ( resid 494 and name HB1 ) ( resid 505 and name HE3 ) 3.6515 1.655 1.655   
assign ( resid 485 and name HA ) ( resid 495 and name HZ ) 4.4010 2.23153846153846 2.23153846153846   
assign ( resid 479 and name HD1+ ) ( resid 483 and name HE3 ) 3.9457 1.88130769230769 1.88130769230769   
assign ( resid 479 and name HD2+ ) ( resid 483 and name HE3 ) 4.2054 2.08107692307692 2.08107692307692   
assign ( resid 479 and name HD1+ ) ( resid 495 and name HD+ ) 3.6331 1.64084615384615 1.64084615384615   
assign ( resid 479 and name HD2+ ) ( resid 483 and name HH2 ) 4.1645 2.04961538461538 2.04961538461538   
assign ( resid 479 and name HD1+ ) ( resid 483 and name HZ3 ) 3.9848 1.91138461538462 1.91138461538462   
assign ( resid 479 and name HD2+ ) ( resid 483 and name HZ3 ) 3.9493 1.88407692307692 1.88407692307692   
assign ( resid 497 and name HB2 ) ( resid 498 and name HN ) 4.1074 2.00569230769231 2.00569230769231   
assign ( resid 497 and name HA ) ( resid 498 and name HE1 ) 3.1723 1.28638461538462 1.28638461538462   
assign ( resid 497 and name HB2 ) ( resid 483 and name HZ2 ) 3.6424 1.648 1.648   
assign ( resid 497 and name HA ) ( resid 483 and name HZ2 ) 3.1225 1.24807692307692 1.24807692307692   
assign ( resid 497 and name HA ) ( resid 483 and name HH2 ) 4.0643 1.97253846153846 1.97253846153846   
assign ( resid 508 and name HG1 ) ( resid 483 and name HH2 ) 3.8076 1.77507692307692 1.77507692307692   
assign ( resid 508 and name HG1 ) ( resid 483 and name HZ3 ) 3.6459 1.65069230769231 1.65069230769231   
assign ( resid 487 and name HD1+ ) ( resid 491 and name HN ) 4.3576 2.19815384615385 2.19815384615385   
assign ( resid 481 and name HA ) ( resid 482 and name HN ) 2.7446 0.957384615384616 0.957384615384616   
assign ( resid 482 and name HN ) ( resid 484 and name HN ) 3.9479 1.883 1.883   
assign ( resid 504 and name HG2+ ) ( resid 496 and name HN ) 4.3182 2.16784615384615 2.16784615384615   
assign ( resid 503 and name HG2+ ) ( resid 496 and name HN ) 4.2545 2.11884615384615 2.11884615384615   
assign ( resid 495 and name HN ) ( resid 504 and name HN ) 3.8789 1.82992307692308 1.82992307692308   
assign ( resid 497 and name HB1 ) ( resid 483 and name HZ2 ) 3.5758 1.59676923076923 1.59676923076923   
assign ( resid 503 and name HG2+ ) ( resid 497 and name HN ) 4.1086 2.00661538461538 2.00661538461538   
assign ( resid 510 and name HD1+ ) ( resid 511 and name HN ) 3.9710 1.90076923076923 1.90076923076923   
assign ( resid 510 and name HD2+ ) ( resid 511 and name HN ) 4.5450 2.34230769230769 2.34230769230769   
assign ( resid 492 and name HB1 ) ( resid 490 and name HN ) 3.8956 1.84276923076923 1.84276923076923   
assign ( resid 503 and name HG2+ ) ( resid 494 and name HE+ ) 4.0626 1.97123076923077 1.97123076923077   
assign ( resid 492 and name HG1 ) ( resid 494 and name HE+ ) 2.9520 1.11692307692308 1.11692307692308   
assign ( resid 492 and name HG1 ) ( resid 494 and name HD+ ) 3.9800 1.90769230769231 1.90769230769231   
assign ( resid 496 and name HA ) ( resid 503 and name HA ) 3.9083 1.85253846153846 1.85253846153846   
assign ( resid 496 and name HB1 ) ( resid 503 and name HA ) 4.2334 2.10261538461538 2.10261538461538   
assign ( resid 503 and name HG2+ ) ( resid 494 and name HE+ ) 4.0626 1.97123076923077 1.97123076923077   
assign ( resid 481 and name HB2 ) ( resid 482 and name HN ) 3.4255 1.48115384615385 1.48115384615385   
assign ( resid 481 and name HG2 ) ( resid 482 and name HN ) 3.7143 1.70330769230769 1.70330769230769   
assign ( resid 481 and name HG1 ) ( resid 482 and name HN ) 4.1201 2.01546153846154 2.01546153846154   
assign ( resid 481 and name HB1 ) ( resid 482 and name HN ) 3.8664 1.82030769230769 1.82030769230769   
assign ( resid 479 and name HA ) ( resid 480 and name HD1 ) 3.3088 1.39138461538462 1.39138461538462   
assign ( resid 484 and name HG1 ) ( resid 485 and name HN ) 3.9583 1.891 1.891   
assign ( resid 484 and name HG2 ) ( resid 485 and name HN ) 3.9583 1.891 1.891   
assign ( resid 486 and name HN ) ( resid 487 and name HN ) 3.7588 1.73753846153846 1.73753846153846   
assign ( resid 486 and name HN ) ( resid 494 and name HN ) 2.5929 0.840692307692308 0.840692307692308   
assign ( resid 493 and name HA ) ( resid 494 and name HN ) 4.0934 1.99492307692308 1.99492307692308   
assign ( resid 493 and name HD2 ) ( resid 492 and name HN ) 4.2204 2.09261538461538 2.09261538461538   
assign ( resid 501 and name HA ) ( resid 502 and name HN ) 3.3129 1.39453846153846 1.39453846153846   
assign ( resid 502 and name HB ) ( resid 503 and name HN ) 3.2132 1.31784615384615 1.31784615384615   
assign ( resid 502 and name HA ) ( resid 503 and name HN ) 2.5653 0.819461538461539 0.819461538461539   
assign ( resid 502 and name HG2+ ) ( resid 503 and name HN ) 3.4625 1.50961538461538 1.50961538461538   
assign ( resid 504 and name HB ) ( resid 505 and name HN ) 3.6912 1.68553846153846 1.68553846153846   
assign ( resid 495 and name HA ) ( resid 486 and name HN ) 3.6600 1.66153846153846 1.66153846153846   
assign ( resid 475 and name HG1+ ) ( resid 476 and name HN ) 3.4139 1.47223076923077 1.47223076923077   
assign ( resid 474 and name HA ) ( resid 475 and name HN ) 4.1885 2.06807692307692 2.06807692307692   
assign ( resid 476 and name HN ) ( resid 475 and name HN ) 3.0744 1.21107692307692 1.21107692307692   
assign ( resid 507 and name HA ) ( resid 508 and name HG1 ) 3.5611 1.58546153846154 1.58546153846154   
assign ( resid 507 and name HA ) ( resid 508 and name HG2 ) 4.3897 2.22284615384615 2.22284615384615   
assign ( resid 508 and name HD2 ) ( resid 507 and name HA ) 3.4663 1.51253846153846 1.51253846153846   
assign ( resid 508 and name HA ) ( resid 509 and name HN ) 3.1818 1.29369230769231 1.29369230769231   
assign ( resid 509 and name HN ) ( resid 510 and name HN ) 3.0703 1.20792307692308 1.20792307692308   
assign ( resid 511 and name HN ) ( resid 510 and name HN ) 3.6529 1.65607692307692 1.65607692307692   
assign ( resid 493 and name HD1 ) ( resid 492 and name HN ) 3.7943 1.76484615384615 1.76484615384615   
assign ( resid 493 and name HB2 ) ( resid 494 and name HN ) 4.0463 1.95869230769231 1.95869230769231   
assign ( resid 493 and name HB1 ) ( resid 494 and name HN ) 3.9842 1.91092307692308 1.91092307692308   
assign ( resid 490 and name HB1 ) ( resid 491 and name HN ) 4.0354 1.95030769230769 1.95030769230769   
assign ( resid 490 and name HB2 ) ( resid 491 and name HN ) 4.1540 2.04153846153846 2.04153846153846   
assign ( resid 494 and name HA ) ( resid 505 and name HE3 ) 3.3540 1.42615384615385 1.42615384615385   
assign ( resid 495 and name HB2 ) ( resid 483 and name HE3 ) 3.3406 1.41584615384615 1.41584615384615   
assign ( resid 511 and name HD1 ) ( resid 512 and name HN ) 3.8386 1.79892307692308 1.79892307692308   
assign ( resid 496 and name HB2 ) ( resid 503 and name HG2+ ) 3.8176 1.78276923076923 1.78276923076923   
assign ( resid 496 and name HA ) ( resid 503 and name HG2+ ) 4.1309 2.02376923076923 2.02376923076923   
assign ( resid 510 and name HA ) ( resid 512 and name HN ) 3.2597 1.35361538461538 1.35361538461538   
assign ( resid 511 and name HA ) ( resid 514 and name HN ) 3.6871 1.68238461538462 1.68238461538462   
assign ( resid 477 and name HB1 ) ( resid 478 and name HN ) 3.1811 1.29315384615385 1.29315384615385   
assign ( resid 477 and name HB2 ) ( resid 478 and name HN ) 2.9323 1.10176923076923 1.10176923076923   
assign ( resid 477 and name HA ) ( resid 478 and name HN ) 3.6266 1.63584615384615 1.63584615384615   
assign ( resid 478 and name HN ) ( resid 477 and name HN ) 3.7984 1.768 1.768   
assign ( resid 493 and name HA ) ( resid 487 and name HG11 ) 3.7371 1.72084615384615 1.72084615384615   
assign ( resid 493 and name HA ) ( resid 487 and name HD1+ ) 3.5288 1.56061538461538 1.56061538461538   
assign ( resid 493 and name HB2 ) ( resid 487 and name HD1+ ) 3.5711 1.59315384615385 1.59315384615385   
assign ( resid 493 and name HG1 ) ( resid 487 and name HD1+ ) 3.1706 1.28507692307692 1.28507692307692   
assign ( resid 493 and name HG2 ) ( resid 487 and name HD1+ ) 3.6951 1.68853846153846 1.68853846153846   
assign ( resid 477 and name HA ) ( resid 479 and name HN ) 3.4568 1.50523076923077 1.50523076923077   
assign ( resid 484 and name HG2 ) ( resid 498 and name HE1 ) 3.7371 1.72084615384615 1.72084615384615   
assign ( resid 484 and name HB2 ) ( resid 498 and name HE1 ) 3.3287 1.40669230769231 1.40669230769231   
assign ( resid 484 and name HB1 ) ( resid 498 and name HE1 ) 3.2790 1.36846153846154 1.36846153846154   
assign ( resid 496 and name HE+ ) ( resid 498 and name HE1 ) 3.8483 1.80638461538462 1.80638461538462   
assign ( resid 505 and name HA ) ( resid 506 and name HN ) 3.8945 1.84192307692308 1.84192307692308   
assign ( resid 487 and name HG12 ) ( resid 491 and name HN ) 3.0669 1.20530769230769 1.20530769230769   
assign ( resid 487 and name HA ) ( resid 493 and name HA ) 3.5209 1.55453846153846 1.55453846153846   
assign ( resid 487 and name HA ) ( resid 493 and name HG2 ) 3.1217 1.24746153846154 1.24746153846154   
assign ( resid 487 and name HA ) ( resid 493 and name HG1 ) 3.1723 1.28638461538462 1.28638461538462   
assign ( resid 495 and name HB1 ) ( resid 496 and name HN ) 3.8628 1.81753846153846 1.81753846153846   
assign ( resid 495 and name HB1 ) ( resid 483 and name HZ3 ) 3.2088 1.31446153846154 1.31446153846154   
assign ( resid 509 and name HG1 ) ( resid 495 and name HD+ ) 4.2916 2.14738461538462 2.14738461538462   
assign ( resid 509 and name HG2 ) ( resid 495 and name HD+ ) 4.0081 1.92930769230769 1.92930769230769   
assign ( resid 485 and name HG2 ) ( resid 495 and name HD+ ) 3.6723 1.671 1.671   
assign ( resid 485 and name HB2 ) ( resid 495 and name HD+ ) 3.7772 1.75169230769231 1.75169230769231   
assign ( resid 485 and name HB1 ) ( resid 495 and name HD+ ) 3.6090 1.62230769230769 1.62230769230769   
assign ( resid 485 and name HB1 ) ( resid 478 and name HE+ ) 3.4782 1.52169230769231 1.52169230769231   
assign ( resid 485 and name HG2 ) ( resid 478 and name HZ ) 3.4724 1.51723076923077 1.51723076923077   
assign ( resid 485 and name HB2 ) ( resid 478 and name HZ ) 3.5100 1.54615384615385 1.54615384615385   
assign ( resid 485 and name HB1 ) ( resid 478 and name HZ ) 3.3749 1.44223076923077 1.44223076923077   
assign ( resid 485 and name HG1 ) ( resid 478 and name HZ ) 2.9779 1.13684615384615 1.13684615384615   
assign ( resid 485 and name HG1 ) ( resid 495 and name HD+ ) 3.5028 1.54061538461538 1.54061538461538   
assign ( resid 485 and name HE+ ) ( resid 478 and name HZ ) 3.6353 1.64253846153846 1.64253846153846   
assign ( resid 485 and name HE+ ) ( resid 495 and name HD+ ) 4.2304 2.10030769230769 2.10030769230769   
assign ( resid 485 and name HE+ ) ( resid 478 and name HE+ ) 4.2304 2.10030769230769 2.10030769230769   
assign ( resid 475 and name HG1+ ) ( resid 476 and name HE21 ) 4.1802 2.06169230769231 2.06169230769231   
assign ( resid 503 and name HG2+ ) ( resid 496 and name HD+ ) 3.5991 1.61469230769231 1.61469230769231   
assign ( resid 503 and name HG2+ ) ( resid 496 and name HE+ ) 4.0646 1.97276923076923 1.97276923076923   
assign ( resid 484 and name HB2 ) ( resid 498 and name HD2 ) 3.5272 1.55938461538462 1.55938461538462   
assign ( resid 501 and name HB2 ) ( resid 496 and name HD+ ) 3.9368 1.87446153846154 1.87446153846154   
assign ( resid 501 and name HB2 ) ( resid 496 and name HE+ ) 3.9555 1.88884615384615 1.88884615384615   
assign ( resid 484 and name HG2 ) ( resid 498 and name HD2 ) 3.9022 1.84784615384615 1.84784615384615   
assign ( resid 501 and name HA ) ( resid 500 and name HN ) 3.4319 1.48607692307692 1.48607692307692   
assign ( resid 501 and name HA ) ( resid 496 and name HE+ ) 3.5154 1.55030769230769 1.55030769230769   
assign ( resid 501 and name HA ) ( resid 496 and name HD+ ) 4.1919 2.07069230769231 2.07069230769231   
assign ( resid 498 and name HB1 ) ( resid 496 and name HE+ ) 3.8800 1.83076923076923 1.83076923076923   
assign ( resid 498 and name HB2 ) ( resid 496 and name HE+ ) 3.9617 1.89361538461538 1.89361538461538   
assign ( resid 501 and name HB1 ) ( resid 496 and name HE+ ) 4.2062 2.08169230769231 2.08169230769231   
assign ( resid 501 and name HG2 ) ( resid 496 and name HE+ ) 3.9911 1.91623076923077 1.91623076923077   
assign ( resid 501 and name HG1 ) ( resid 496 and name HE+ ) 4.0372 1.95169230769231 1.95169230769231   
assign ( resid 480 and name HB2 ) ( resid 483 and name HD1 ) 2.8346 1.02661538461538 1.02661538461538   
assign ( resid 480 and name HB1 ) ( resid 483 and name HD1 ) 2.4227 0.709769230769231 0.709769230769231   
assign ( resid 480 and name HG1 ) ( resid 483 and name HD1 ) 2.9663 1.12792307692308 1.12792307692308   
assign ( resid 480 and name HG2 ) ( resid 483 and name HD1 ) 3.0038 1.15676923076923 1.15676923076923   
assign ( resid 504 and name HG2+ ) ( resid 495 and name HD+ ) 3.7111 1.70084615384615 1.70084615384615   
assign ( resid 507 and name HB2 ) ( resid 495 and name HD+ ) 3.6394 1.64569230769231 1.64569230769231   
assign ( resid 486 and name HB2 ) ( resid 494 and name HD+ ) 3.6650 1.66538461538462 1.66538461538462   
assign ( resid 492 and name HB2 ) ( resid 494 and name HD+ ) 3.7375 1.72115384615385 1.72115384615385   
assign ( resid 492 and name HB1 ) ( resid 494 and name HD+ ) 3.1441 1.26469230769231 1.26469230769231   
assign ( resid 503 and name HG2+ ) ( resid 494 and name HD+ ) 3.3199 1.39992307692308 1.39992307692308   
assign ( resid 509 and name HG2 ) ( resid 510 and name HN ) 3.2620 1.35538461538462 1.35538461538462   
assign ( resid 508 and name HB2 ) ( resid 510 and name HN ) 3.7470 1.72846153846154 1.72846153846154   
assign ( resid 508 and name HG1 ) ( resid 510 and name HN ) 3.8880 1.83692307692308 1.83692307692308   
assign ( resid 514 and name HG1+ ) ( resid 515 and name HD1 ) 4.3527 2.19438461538462 2.19438461538462   
assign ( resid 514 and name HG2+ ) ( resid 515 and name HN ) 4.1518 2.03984615384615 2.03984615384615   
assign ( resid 514 and name HG2+ ) ( resid 515 and name HD1 ) 4.3690 2.20692307692308 2.20692307692308   
assign ( resid 514 and name HB ) ( resid 515 and name HD1 ) 4.0515 1.96269230769231 1.96269230769231   
assign ( resid 514 and name HB ) ( resid 515 and name HE1 ) 3.8372 1.79784615384615 1.79784615384615   
assign ( resid 514 and name HG1+ ) ( resid 515 and name HE1 ) 4.3151 2.16546153846154 2.16546153846154   
assign ( resid 504 and name HG2+ ) ( resid 506 and name HN ) 3.7257 1.71207692307692 1.71207692307692   
assign ( resid 492 and name HB2 ) ( resid 505 and name HE3 ) 3.7282 1.714 1.714   
assign ( resid 492 and name HB1 ) ( resid 505 and name HE3 ) 3.3621 1.43238461538462 1.43238461538462   
assign ( resid 492 and name HG1 ) ( resid 505 and name HE3 ) 4.3264 2.17415384615385 2.17415384615385   
assign ( resid 492 and name HG2 ) ( resid 505 and name HE3 ) 3.7483 1.72946153846154 1.72946153846154   
assign ( resid 476 and name HG2 ) ( resid 477 and name HN ) 3.2597 1.35361538461538 1.35361538461538   
assign ( resid 474 and name HG ) ( resid 475 and name HN ) 3.3516 1.42430769230769 1.42430769230769   
assign ( resid 502 and name HG2+ ) ( resid 483 and name HZ2 ) 3.9295 1.86884615384615 1.86884615384615   
assign ( resid 510 and name HD1+ ) ( resid 483 and name HZ2 ) 3.8549 1.81146153846154 1.81146153846154   
assign ( resid 510 and name HD2+ ) ( resid 483 and name HZ2 ) 4.1036 2.00276923076923 2.00276923076923   
assign ( resid 508 and name HB2 ) ( resid 483 and name HZ2 ) 4.0456 1.95815384615385 1.95815384615385   
assign ( resid 488 and name HA ) ( resid 494 and name HD+ ) 3.6436 1.64892307692308 1.64892307692308   
assign ( resid 486 and name HG1 ) ( resid 494 and name HD+ ) 3.8633 1.81792307692308 1.81792307692308   
assign ( resid 486 and name HG2 ) ( resid 494 and name HD+ ) 3.6912 1.68553846153846 1.68553846153846   
assign ( resid 486 and name HD2 ) ( resid 494 and name HD+ ) 3.8648 1.81907692307692 1.81907692307692   
assign ( resid 507 and name HA ) ( resid 508 and name HB2 ) 3.6886 1.68353846153846 1.68353846153846   
assign ( resid 486 and name HN ) ( resid 496 and name HN ) 4.0143 1.93407692307692 1.93407692307692   
assign ( resid 494 and name HD+ ) ( resid 495 and name HN ) 3.9179 1.85992307692308 1.85992307692308   
assign ( resid 494 and name HD+ ) ( resid 487 and name HN ) 3.5525 1.57884615384615 1.57884615384615   
assign ( resid 495 and name HD+ ) ( resid 496 and name HN ) 3.8418 1.80138461538462 1.80138461538462   
assign ( resid 474 and name HN ) ( resid 473 and name HN ) 3.2805 1.36961538461538 1.36961538461538   
assign ( resid 503 and name HA ) ( resid 497 and name HN ) 3.5672 1.59015384615385 1.59015384615385   
assign ( resid 479 and name HD1+ ) ( resid 485 and name HN ) 3.7874 1.75953846153846 1.75953846153846   
assign ( resid 479 and name HD2+ ) ( resid 485 and name HN ) 4.3903 2.22330769230769 2.22330769230769   
assign ( resid 479 and name HD1+ ) ( resid 478 and name HE+ ) 3.6331 1.64084615384615 1.64084615384615   
assign ( resid 479 and name HD1+ ) ( resid 478 and name HZ ) 3.7664 1.74338461538462 1.74338461538462   
assign ( resid 479 and name HD1+ ) ( resid 478 and name HZ ) 3.5835 1.60269230769231 1.60269230769231   
assign ( resid 479 and name HD1+ ) ( resid 478 and name HD+ ) 3.7633 1.741 1.741   
assign ( resid 475 and name HG1+ ) ( resid 512 and name HD+ ) 4.1193 2.01484615384615 2.01484615384615   
assign ( resid 509 and name HB1 ) ( resid 512 and name HD+ ) 3.6211 1.63161538461538 1.63161538461538   
assign ( resid 513 and name HD1 ) ( resid 512 and name HA ) 3.4111 1.47007692307692 1.47007692307692   
assign ( resid 513 and name HD1 ) ( resid 512 and name HA ) 3.4354 1.48876923076923 1.48876923076923   
assign ( resid 486 and name HB2 ) ( resid 494 and name HE+ ) 4.0628 1.97138461538462 1.97138461538462   
assign ( resid 486 and name HG2 ) ( resid 494 and name HE+ ) 4.2263 2.09715384615385 2.09715384615385   
assign ( resid 508 and name HB2 ) ( resid 483 and name HH2 ) 3.9185 1.86038461538462 1.86038461538462   
assign ( resid 508 and name HG1 ) ( resid 509 and name HN ) 3.9888 1.91446153846154 1.91446153846154   
assign ( resid 508 and name HB2 ) ( resid 495 and name HD+ ) 4.0605 1.96961538461538 1.96961538461538   
assign ( resid 508 and name HG1 ) ( resid 495 and name HD+ ) 4.0209 1.93915384615385 1.93915384615385   
assign ( resid 503 and name HA ) ( resid 496 and name HD+ ) 3.6387 1.64515384615385 1.64515384615385   
assign ( resid 487 and name HA ) ( resid 494 and name HD+ ) 3.6492 1.65323076923077 1.65323076923077   
assign ( resid 483 and name HA ) ( resid 498 and name HE1 ) 3.5130 1.54846153846154 1.54846153846154   
assign ( resid 497 and name HA ) ( resid 483 and name HD1 ) 3.4454 1.49646153846154 1.49646153846154   
assign ( resid 510 and name HA ) ( resid 512 and name HD+ ) 3.6492 1.65323076923077 1.65323076923077   
assign ( resid 513 and name HD2 ) ( resid 512 and name HD+ ) 3.6752 1.67323076923077 1.67323076923077   
assign ( resid 513 and name HD1 ) ( resid 512 and name HD+ ) 3.6103 1.62330769230769 1.62330769230769   
assign ( resid 508 and name HA ) ( resid 512 and name HD+ ) 3.7754 1.75030769230769 1.75030769230769   
assign ( resid 495 and name HB2 ) ( resid 483 and name HZ3 ) 3.0348 1.18061538461538 1.18061538461538   
assign ( resid 485 and name HG2 ) ( resid 478 and name HD+ ) 3.5935 1.61038461538462 1.61038461538462   
assign ( resid 485 and name HG1 ) ( resid 478 and name HD+ ) 3.2534 1.34876923076923 1.34876923076923   
assign ( resid 485 and name HB2 ) ( resid 478 and name HD+ ) 3.6077 1.62130769230769 1.62130769230769   
assign ( resid 485 and name HB1 ) ( resid 478 and name HD+ ) 3.5036 1.54123076923077 1.54123076923077   
assign ( resid 479 and name HB1 ) ( resid 478 and name HD+ ) 3.6025 1.61730769230769 1.61730769230769   
assign ( resid 479 and name HB1 ) ( resid 478 and name HZ ) 3.3162 1.39707692307692 1.39707692307692   
assign ( resid 509 and name HG1 ) ( resid 512 and name HD+ ) 3.8758 1.82753846153846 1.82753846153846   
assign ( resid 509 and name HG1 ) ( resid 512 and name HE+ ) 3.1654 1.28107692307692 1.28107692307692   
assign ( resid 509 and name HG2 ) ( resid 512 and name HE+ ) 3.2231 1.32546153846154 1.32546153846154   
assign ( resid 509 and name HB1 ) ( resid 512 and name HE+ ) 2.9641 1.12623076923077 1.12623076923077   
assign ( resid 509 and name HB2 ) ( resid 512 and name HD+ ) 3.6012 1.61630769230769 1.61630769230769   
assign ( resid 509 and name HB2 ) ( resid 512 and name HE+ ) 2.9749 1.13453846153846 1.13453846153846   
assign ( resid 485 and name HA ) ( resid 478 and name HD+ ) 3.7565 1.73576923076923 1.73576923076923   
assign ( resid 495 and name HA ) ( resid 478 and name HD+ ) 3.9911 1.91623076923077 1.91623076923077   
assign ( resid 495 and name HA ) ( resid 483 and name HZ3 ) 3.5295 1.56115384615385 1.56115384615385   
assign ( resid 495 and name HB1 ) ( resid 478 and name HD+ ) 3.9434 1.87953846153846 1.87953846153846   
assign ( resid 509 and name HD1 ) ( resid 478 and name HD+ ) 3.5802 1.60015384615385 1.60015384615385   
assign ( resid 509 and name HD2 ) ( resid 478 and name HD+ ) 3.5646 1.58815384615385 1.58815384615385   
assign ( resid 511 and name HD2 ) ( resid 512 and name HD+ ) 3.9806 1.90815384615385 1.90815384615385   
assign ( resid 511 and name HD2 ) ( resid 512 and name HE+ ) 3.4105 1.46961538461538 1.46961538461538   
assign ( resid 511 and name HD1 ) ( resid 512 and name HE+ ) 3.5365 1.56653846153846 1.56653846153846   
assign ( resid 511 and name HD1 ) ( resid 512 and name HD+ ) 4.0639 1.97223076923077 1.97223076923077   
assign ( resid 475 and name HG2+ ) ( resid 512 and name HD+ ) 4.0470 1.95923076923077 1.95923076923077   
assign ( resid 509 and name HG2 ) ( resid 483 and name HD1 ) 3.8304 1.79261538461538 1.79261538461538   
assign ( resid 514 and name HG1+ ) ( resid 483 and name HD1 ) 3.8735 1.82576923076923 1.82576923076923   
assign ( resid 508 and name HB1 ) ( resid 483 and name HD1 ) 4.0934 1.99492307692308 1.99492307692308   
assign ( resid 503 and name HB ) ( resid 494 and name HE+ ) 3.9730 1.90230769230769 1.90230769230769   
assign ( resid 485 and name HG1 ) ( resid 495 and name HZ ) 3.2393 1.33792307692308 1.33792307692308   
assign ( resid 479 and name HD1+ ) ( resid 483 and name HD1 ) 3.9481 1.88315384615385 1.88315384615385   
assign ( resid 492 and name HG2 ) ( resid 494 and name HD+ ) 3.9452 1.88092307692308 1.88092307692308   
assign ( resid 485 and name HG2 ) ( resid 495 and name HZ ) 3.9509 1.88530769230769 1.88530769230769   
assign ( resid 480 and name HB1 ) ( resid 483 and name HZ2 ) 3.6459 1.65069230769231 1.65069230769231   
assign ( resid 501 and name HD2 ) ( resid 496 and name HE+ ) 4.0354 1.95030769230769 1.95030769230769   
assign ( resid 501 and name HG1 ) ( resid 502 and name HN ) 4.1016 2.00123076923077 2.00123076923077   
assign ( resid 501 and name HB1 ) ( resid 502 and name HN ) 4.0376 1.952 1.952   
assign ( resid 501 and name HB2 ) ( resid 502 and name HN ) 3.9980 1.92153846153846 1.92153846153846   
assign ( resid 475 and name HG1+ ) ( resid 478 and name HZ ) 3.7809 1.75453846153846 1.75453846153846   
assign ( resid 475 and name HG1+ ) ( resid 478 and name HD+ ) 4.2648 2.12676923076923 2.12676923076923   
assign ( resid 492 and name HB2 ) ( resid 505 and name HH2 ) 3.5044 1.54184615384615 1.54184615384615   
assign ( resid 492 and name HB1 ) ( resid 505 and name HH2 ) 2.9845 1.14192307692308 1.14192307692308   
assign ( resid 492 and name HG2 ) ( resid 505 and name HH2 ) 3.7116 1.70123076923077 1.70123076923077   


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