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NMR Restraints Grid |
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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 |
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612056 |
2n8m ![]() ![]() |
25855 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 5} (( segid "KH " and resid 59 and name HN )) (( segid "KH " and resid 59 and name HA )) 2.800 1.000 1.000 peak 5 spectrum 1 weight 0.10000E+01 volume 0.22530E-02 ppm1 8.643 ppm2 4.632 CV 1 ASSI { 6} (( segid "KH " and resid 59 and name HN )) (( segid "KH " and resid 71 and name HA )) 3.700 1.700 1.700 peak 6 spectrum 1 weight 0.10000E+01 volume 0.10051E-02 ppm1 8.643 ppm2 4.330 CV 1 ASSI { 9} (( segid "KH " and resid 59 and name HN )) ( segid "KH " and resid 58 and name HG2%) 3.900 1.900 1.900 peak 9 spectrum 1 weight 0.10000E+01 volume 0.14465E-02 ppm1 8.642 ppm2 0.769 CV 1 ASSI { 11} (( segid "KH " and resid 59 and name HN )) ( segid "KH " and resid 58 and name HD1%) 2.700 2.700 3.300 peak 11 spectrum 1 weight 0.10000E+01 volume 0.14303E-02 ppm1 8.645 ppm2 0.652 CV 1 ASSI { 13} (( segid "KH " and resid 191 and name HN )) (( segid "KH " and resid 191 and name HA )) 3.000 1.100 1.100 peak 13 spectrum 1 weight 0.10000E+01 volume 0.21560E-02 ppm1 7.905 ppm2 4.323 CV 1 ASSI { 24} (( segid "KH " and resid 113 and name HN )) (( segid "KH " and resid 112 and name HA )) 2.600 0.800 0.800 peak 24 spectrum 1 weight 0.10000E+01 volume 0.24546E-02 ppm1 9.185 ppm2 4.454 CV 1 ASSI { 25} (( segid "KH " and resid 72 and name HN )) (( segid "KH " and resid 71 and name HA )) 2.500 0.800 0.800 peak 25 spectrum 1 weight 0.10000E+01 volume 0.26922E-02 ppm1 9.247 ppm2 4.332 CV 1 ASSI { 27} (( segid "KH " and resid 72 and name HN )) (( segid "KH " and resid 72 and name HB )) 2.800 1.000 1.000 peak 27 spectrum 1 weight 0.10000E+01 volume 0.18349E-02 ppm1 9.247 ppm2 1.951 CV 1 ASSI { 32} (( segid "KH " and resid 72 and name HN )) ( segid "KH " and resid 72 and name HG2%) 2.700 0.900 0.900 peak 32 spectrum 1 weight 0.10000E+01 volume 0.24828E-02 ppm1 9.247 ppm2 0.646 CV 1 ASSI { 37} (( segid "KH " and resid 73 and name HN )) (( segid "KH " and resid 72 and name HA )) 2.900 1.100 1.100 peak 37 spectrum 1 weight 0.10000E+01 volume 0.12937E-02 ppm1 9.027 ppm2 4.522 CV 1 ASSI { 38} (( segid "KH " and resid 73 and name HN )) (( segid "KH " and resid 73 and name HB )) 2.900 1.000 1.000 peak 38 spectrum 1 weight 0.10000E+01 volume 0.14989E-02 ppm1 9.027 ppm2 2.023 CV 1 ASSI { 42} (( segid "KH " and resid 71 and name HN )) (( segid "KH " and resid 27 and name HN )) 3.000 1.100 1.100 peak 42 spectrum 1 weight 0.10000E+01 volume 0.13440E-02 ppm1 9.134 ppm2 9.292 CV 1 ASSI { 52} (( segid "KH " and resid 104 and name HN )) (( segid "KH " and resid 103 and name HA )) 2.800 1.000 1.000 peak 52 spectrum 1 weight 0.10000E+01 volume 0.19686E-02 ppm1 7.132 ppm2 2.991 CV 1 ASSI { 54} (( segid "KH " and resid 71 and name HN )) (( segid "KH " and resid 71 and name HB )) 3.300 1.400 1.400 peak 54 spectrum 1 weight 0.10000E+01 volume 0.18349E-02 ppm1 9.137 ppm2 1.975 CV 1 ASSI { 61} (( segid "KH " and resid 104 and name HN )) ( segid "KH " and resid 103 and name HG1%) 3.600 1.600 1.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.12259E-02 ppm1 7.138 ppm2 0.918 CV 1 ASSI { 62} (( segid "KH " and resid 71 and name HN )) ( segid "KH " and resid 71 and name HG1%) 2.900 1.000 1.000 peak 62 spectrum 1 weight 0.10000E+01 volume 0.22155E-02 ppm1 9.138 ppm2 0.665 CV 1 ASSI { 63} (( segid "KH " and resid 104 and name HN )) ( segid "KH " and resid 103 and name HG2%) 3.800 1.900 1.900 peak 63 spectrum 1 weight 0.10000E+01 volume 0.92172E-03 ppm1 7.132 ppm2 0.654 CV 1 ASSI { 67} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 68 and name HA )) 2.700 0.900 0.900 peak 67 spectrum 1 weight 0.10000E+01 volume 0.27842E-02 ppm1 8.418 ppm2 5.191 CV 1 ASSI { 68} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 30 and name HA )) 2.500 0.800 0.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.30494E-02 ppm1 8.415 ppm2 4.571 CV 1 ASSI { 69} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 31 and name HA )) 3.000 1.100 1.100 peak 69 spectrum 1 weight 0.10000E+01 volume 0.15590E-02 ppm1 8.418 ppm2 3.683 CV 1 ASSI { 71} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 68 and name HB )) 3.500 1.500 1.500 peak 71 spectrum 1 weight 0.10000E+01 volume 0.16998E-02 ppm1 8.422 ppm2 2.092 CV 1 ASSI { 74} (( segid "KH " and resid 31 and name HN )) ( segid "KH " and resid 31 and name HB% ) 2.400 0.700 0.700 peak 74 spectrum 1 weight 0.10000E+01 volume 0.54566E-02 ppm1 8.418 ppm2 1.254 CV 1 ASSI { 75} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 29 and name HG13)) 2.900 2.900 3.100 peak 75 spectrum 1 weight 0.10000E+01 volume 0.23237E-02 ppm1 8.417 ppm2 0.862 CV 1 ASSI { 86} (( segid "KH " and resid 56 and name HN )) (( segid "KH " and resid 56 and name HA )) 2.900 1.100 1.100 peak 86 spectrum 1 weight 0.10000E+01 volume 0.12435E-02 ppm1 8.329 ppm2 5.053 CV 1 ASSI { 87} (( segid "KH " and resid 74 and name HN )) (( segid "KH " and resid 73 and name HA )) 2.700 0.900 0.900 peak 87 spectrum 1 weight 0.10000E+01 volume 0.20223E-02 ppm1 9.242 ppm2 4.983 CV 1 ASSI { 88} (( segid "KH " and resid 56 and name HN )) (( segid "KH " and resid 55 and name HA )) 2.500 0.800 0.800 peak 88 spectrum 1 weight 0.10000E+01 volume 0.31181E-02 ppm1 8.325 ppm2 4.746 CV 1 ASSI { 89} (( segid "KH " and resid 28 and name HN )) (( segid "KH " and resid 27 and name HA )) 3.100 1.200 1.200 peak 89 spectrum 1 weight 0.10000E+01 volume 0.94714E-03 ppm1 8.584 ppm2 4.722 CV 1 ASSI { 94} (( segid "KH " and resid 28 and name HN )) (( segid "KH " and resid 28 and name HB3 )) 3.500 1.600 1.600 peak 94 spectrum 1 weight 0.10000E+01 volume 0.13376E-02 ppm1 8.584 ppm2 2.599 CV 1 ASSI { 95} (( segid "KH " and resid 56 and name HN )) (( segid "KH " and resid 56 and name HB )) 2.800 1.000 1.000 peak 95 spectrum 1 weight 0.10000E+01 volume 0.23123E-02 ppm1 8.329 ppm2 1.560 CV 1 ASSI { 97} (( segid "KH " and resid 74 and name HN )) ( segid "KH " and resid 74 and name HG2%) 3.900 1.900 1.900 peak 97 spectrum 1 weight 0.10000E+01 volume 0.11417E-02 ppm1 9.252 ppm2 1.117 CV 1 ASSI { 98} (( segid "KH " and resid 74 and name HN )) ( segid "KH " and resid 24 and name HG2%) 3.400 1.400 1.400 peak 98 spectrum 1 weight 0.10000E+01 volume 0.12994E-02 ppm1 9.250 ppm2 1.056 CV 1 ASSI { 99} (( segid "KH " and resid 28 and name HN )) ( segid "KH " and resid 27 and name HG1%) 3.200 1.200 1.200 peak 99 spectrum 1 weight 0.10000E+01 volume 0.13963E-02 ppm1 8.586 ppm2 0.818 CV 1 ASSI { 100} (( segid "KH " and resid 74 and name HN )) ( segid "KH " and resid 73 and name HD1%) 3.700 1.700 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.24828E-02 ppm1 9.246 ppm2 0.613 CV 1 ASSI { 119} (( segid "KH " and resid 139 and name HN )) (( segid "KH " and resid 139 and name HB )) 2.800 1.000 1.000 peak 119 spectrum 1 weight 0.10000E+01 volume 0.22388E-02 ppm1 9.172 ppm2 1.847 CV 1 ASSI { 126} (( segid "KH " and resid 138 and name HN )) ( segid "KH " and resid 138 and name HG1%) 4.500 2.500 1.500 peak 126 spectrum 1 weight 0.10000E+01 volume 0.54255E-03 ppm1 8.306 ppm2 0.689 CV 1 ASSI { 129} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 72 and name HN )) 2.900 1.000 1.000 peak 129 spectrum 1 weight 0.10000E+01 volume 0.13079E-02 ppm1 8.692 ppm2 9.242 CV 1 ASSI { 132} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 56 and name HA )) 2.400 0.700 0.700 peak 132 spectrum 1 weight 0.10000E+01 volume 0.33388E-02 ppm1 8.692 ppm2 5.075 CV 1 ASSI { 134} (( segid "KH " and resid 106 and name HN )) (( segid "KH " and resid 105 and name HA )) 3.100 1.200 1.200 peak 134 spectrum 1 weight 0.10000E+01 volume 0.10370E-02 ppm1 8.831 ppm2 5.000 CV 1 ASSI { 135} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 57 and name HA )) 2.900 1.100 1.100 peak 135 spectrum 1 weight 0.10000E+01 volume 0.14826E-02 ppm1 8.692 ppm2 4.654 CV 1 ASSI { 136} (( segid "KH " and resid 106 and name HN )) (( segid "KH " and resid 106 and name HB2 )) 3.500 1.600 1.600 peak 136 spectrum 1 weight 0.10000E+01 volume 0.67341E-03 ppm1 8.826 ppm2 2.039 CV 1 OR { 136} (( segid "KH " and resid 106 and name HN )) (( segid "KH " and resid 106 and name HB3 )) ASSI { 140} (( segid "KH " and resid 106 and name HN )) (( segid "KH " and resid 105 and name HB2 )) 4.600 2.600 1.400 peak 140 spectrum 1 weight 0.10000E+01 volume 0.45837E-03 ppm1 8.824 ppm2 1.512 CV 1 ASSI { 144} (( segid "KH " and resid 57 and name HN )) ( segid "KH " and resid 73 and name HD1%) 3.300 1.300 1.300 peak 144 spectrum 1 weight 0.10000E+01 volume 0.38813E-02 ppm1 8.691 ppm2 0.614 CV 1 ASSI { 149} (( segid "KH " and resid 155 and name HN )) (( segid "KH " and resid 155 and name HB3 )) 3.400 1.400 1.400 peak 149 spectrum 1 weight 0.10000E+01 volume 0.11558E-02 ppm1 9.131 ppm2 1.559 CV 1 ASSI { 152} (( segid "KH " and resid 12 and name HN )) ( segid "KH " and resid 12 and name HB% ) 2.600 0.900 0.900 peak 152 spectrum 1 weight 0.10000E+01 volume 0.51192E-02 ppm1 8.150 ppm2 1.288 CV 1 ASSI { 161} (( segid "KH " and resid 27 and name HN )) (( segid "KH " and resid 26 and name HA )) 2.800 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.20195E-02 ppm1 9.300 ppm2 5.718 CV 1 ASSI { 163} (( segid "KH " and resid 107 and name HN )) (( segid "KH " and resid 106 and name HA )) 3.200 1.200 1.200 peak 163 spectrum 1 weight 0.10000E+01 volume 0.80213E-03 ppm1 9.333 ppm2 4.957 CV 1 ASSI { 167} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 61 and name HA )) 2.700 0.900 0.900 peak 167 spectrum 1 weight 0.10000E+01 volume 0.36825E-02 ppm1 8.913 ppm2 4.503 CV 1 ASSI { 169} (( segid "KH " and resid 103 and name HN )) (( segid "KH " and resid 102 and name HA )) 2.300 0.700 0.700 peak 169 spectrum 1 weight 0.10000E+01 volume 0.56738E-02 ppm1 8.564 ppm2 4.307 CV 1 ASSI { 170} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 62 and name HA )) 2.700 0.900 0.900 peak 170 spectrum 1 weight 0.10000E+01 volume 0.32992E-02 ppm1 8.912 ppm2 4.041 CV 1 ASSI { 171} (( segid "KH " and resid 107 and name HN )) (( segid "KH " and resid 107 and name HB )) 3.100 1.200 1.200 peak 171 spectrum 1 weight 0.10000E+01 volume 0.10978E-02 ppm1 9.333 ppm2 3.957 CV 1 ASSI { 172} (( segid "KH " and resid 36 and name HN )) (( segid "KH " and resid 35 and name HA2 )) 2.800 1.000 1.000 peak 172 spectrum 1 weight 0.10000E+01 volume 0.21107E-02 ppm1 7.673 ppm2 3.686 CV 1 ASSI { 174} (( segid "KH " and resid 103 and name HN )) (( segid "KH " and resid 103 and name HA )) 3.000 1.100 1.100 peak 174 spectrum 1 weight 0.10000E+01 volume 0.12132E-02 ppm1 8.559 ppm2 3.006 CV 1 ASSI { 176} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 62 and name HB2 )) 2.400 0.700 0.700 peak 176 spectrum 1 weight 0.10000E+01 volume 0.72289E-02 ppm1 8.910 ppm2 2.111 CV 1 OR { 176} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 62 and name HB3 )) ASSI { 177} (( segid "KH " and resid 103 and name HN )) (( segid "KH " and resid 103 and name HB )) 2.900 1.100 1.100 peak 177 spectrum 1 weight 0.10000E+01 volume 0.26519E-02 ppm1 8.562 ppm2 2.110 CV 1 ASSI { 178} (( segid "KH " and resid 27 and name HN )) (( segid "KH " and resid 71 and name HB )) 3.800 1.800 1.800 peak 178 spectrum 1 weight 0.10000E+01 volume 0.13221E-02 ppm1 9.298 ppm2 1.956 CV 1 ASSI { 179} (( segid "KH " and resid 18 and name HN )) (( segid "KH " and resid 18 and name HB2 )) 2.900 1.000 1.000 peak 179 spectrum 1 weight 0.10000E+01 volume 0.28407E-02 ppm1 8.013 ppm2 1.933 CV 1 ASSI { 182} (( segid "KH " and resid 27 and name HN )) (( segid "KH " and resid 27 and name HB )) 3.000 1.100 1.100 peak 182 spectrum 1 weight 0.10000E+01 volume 0.15909E-02 ppm1 9.298 ppm2 1.689 CV 1 ASSI { 184} (( segid "KH " and resid 103 and name HN )) ( segid "KH " and resid 103 and name HG1%) 2.600 0.800 0.800 peak 184 spectrum 1 weight 0.10000E+01 volume 0.41544E-02 ppm1 8.562 ppm2 0.920 CV 1 ASSI { 185} (( segid "KH " and resid 103 and name HN )) ( segid "KH " and resid 103 and name HG2%) 2.900 1.000 1.000 peak 185 spectrum 1 weight 0.10000E+01 volume 0.17217E-02 ppm1 8.561 ppm2 0.651 CV 1 ASSI { 194} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 91 and name HN )) 2.900 1.000 1.000 peak 194 spectrum 1 weight 0.10000E+01 volume 0.18632E-02 ppm1 8.366 ppm2 7.571 CV 1 ASSI { 195} (( segid "KH " and resid 36 and name HN )) (( segid "KH " and resid 37 and name HN )) 2.500 0.800 0.800 peak 195 spectrum 1 weight 0.10000E+01 volume 0.32185E-02 ppm1 7.676 ppm2 7.430 CV 1 ASSI { 199} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 69 and name HA )) 2.800 1.000 1.000 peak 199 spectrum 1 weight 0.10000E+01 volume 0.16595E-02 ppm1 8.850 ppm2 4.722 CV 1 ASSI { 201} (( segid "KH " and resid 26 and name HN )) (( segid "KH " and resid 25 and name HA )) 2.800 1.000 1.000 peak 201 spectrum 1 weight 0.10000E+01 volume 0.17868E-02 ppm1 8.282 ppm2 4.459 CV 1 ASSI { 202} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 90 and name HA )) 3.000 1.100 1.100 peak 202 spectrum 1 weight 0.10000E+01 volume 0.16312E-02 ppm1 8.368 ppm2 4.208 CV 1 ASSI { 203} (( segid "KH " and resid 36 and name HN )) (( segid "KH " and resid 36 and name HA )) 2.700 0.900 0.900 peak 203 spectrum 1 weight 0.10000E+01 volume 0.36090E-02 ppm1 7.676 ppm2 4.159 CV 1 ASSI { 204} (( segid "KH " and resid 46 and name HN )) (( segid "KH " and resid 46 and name HA )) 3.000 1.100 1.100 peak 204 spectrum 1 weight 0.10000E+01 volume 0.13319E-02 ppm1 7.762 ppm2 4.156 CV 1 ASSI { 205} (( segid "KH " and resid 36 and name HN )) (( segid "KH " and resid 33 and name HA )) 2.900 1.100 1.100 peak 205 spectrum 1 weight 0.10000E+01 volume 0.19743E-02 ppm1 7.674 ppm2 4.079 CV 1 ASSI { 207} (( segid "KH " and resid 36 and name HN )) (( segid "KH " and resid 35 and name HA1 )) 3.300 1.400 1.400 peak 207 spectrum 1 weight 0.10000E+01 volume 0.20570E-02 ppm1 7.673 ppm2 3.838 CV 1 ASSI { 208} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 89 and name HA2 )) 3.500 1.600 1.600 peak 208 spectrum 1 weight 0.10000E+01 volume 0.71728E-03 ppm1 8.368 ppm2 3.848 CV 1 OR { 208} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 89 and name HA1 )) ASSI { 215} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 90 and name HB3 )) 2.700 0.900 0.900 peak 215 spectrum 1 weight 0.10000E+01 volume 0.27686E-02 ppm1 8.366 ppm2 1.953 CV 1 OR { 215} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 90 and name HB2 )) ASSI { 216} (( segid "KH " and resid 46 and name HN )) (( segid "KH " and resid 46 and name HB3 )) 2.800 1.000 1.000 peak 216 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 7.765 ppm2 1.883 CV 1 OR { 216} (( segid "KH " and resid 46 and name HN )) (( segid "KH " and resid 46 and name HB2 )) ASSI { 217} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 70 and name HB2 )) 3.000 1.100 1.100 peak 217 spectrum 1 weight 0.10000E+01 volume 0.37052E-02 ppm1 8.846 ppm2 1.759 CV 1 ASSI { 219} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 69 and name HB2 )) 3.800 1.800 1.800 peak 219 spectrum 1 weight 0.10000E+01 volume 0.11813E-02 ppm1 8.849 ppm2 1.562 CV 1 ASSI { 220} (( segid "KH " and resid 156 and name HN )) (( segid "KH " and resid 156 and name HG12)) 3.200 1.300 1.300 peak 220 spectrum 1 weight 0.10000E+01 volume 0.13079E-02 ppm1 9.569 ppm2 1.499 CV 1 OR { 220} (( segid "KH " and resid 156 and name HN )) (( segid "KH " and resid 156 and name HG13)) ASSI { 221} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 70 and name HB3 )) 2.900 1.100 1.100 peak 221 spectrum 1 weight 0.10000E+01 volume 0.23209E-02 ppm1 8.848 ppm2 1.428 CV 1 ASSI { 222} (( segid "KH " and resid 36 and name HN )) ( segid "KH " and resid 36 and name HB% ) 2.300 0.600 0.600 peak 222 spectrum 1 weight 0.10000E+01 volume 0.82619E-02 ppm1 7.677 ppm2 1.389 CV 1 ASSI { 228} (( segid "KH " and resid 156 and name HN )) ( segid "KH " and resid 156 and name HD1%) 3.700 1.700 1.700 peak 228 spectrum 1 weight 0.10000E+01 volume 0.19544E-02 ppm1 9.567 ppm2 0.667 CV 1 ASSI { 234} (( segid "KH " and resid 79 and name HN )) (( segid "KH " and resid 80 and name HN )) 3.000 1.100 1.100 peak 234 spectrum 1 weight 0.10000E+01 volume 0.16715E-02 ppm1 7.043 ppm2 8.142 CV 1 ASSI { 244} (( segid "KH " and resid 102 and name HN )) (( segid "KH " and resid 101 and name HA )) 2.100 0.600 0.600 peak 244 spectrum 1 weight 0.10000E+01 volume 0.12053E-01 ppm1 8.456 ppm2 4.402 CV 1 ASSI { 245} (( segid "KH " and resid 79 and name HN )) (( segid "KH " and resid 79 and name HA )) 3.300 1.300 1.300 peak 245 spectrum 1 weight 0.10000E+01 volume 0.10653E-02 ppm1 7.042 ppm2 4.311 CV 1 ASSI { 246} (( segid "KH " and resid 142 and name HN )) (( segid "KH " and resid 142 and name HA )) 2.500 0.800 0.800 peak 246 spectrum 1 weight 0.10000E+01 volume 0.52316E-02 ppm1 8.302 ppm2 4.288 CV 1 ASSI { 262} (( segid "KH " and resid 156 and name HN )) (( segid "KH " and resid 156 and name HB )) 3.000 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.13037E-02 ppm1 9.565 ppm2 1.684 CV 1 ASSI { 263} (( segid "KH " and resid 110 and name HN )) (( segid "KH " and resid 110 and name HB2 )) 2.900 1.100 1.100 peak 263 spectrum 1 weight 0.10000E+01 volume 0.13079E-02 ppm1 8.595 ppm2 1.667 CV 1 ASSI { 265} (( segid "KH " and resid 79 and name HN )) ( segid "KH " and resid 79 and name HB% ) 2.700 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.31343E-02 ppm1 7.041 ppm2 1.425 CV 1 ASSI { 267} (( segid "KH " and resid 162 and name HN )) ( segid "KH " and resid 162 and name HB% ) 3.100 1.200 1.200 peak 267 spectrum 1 weight 0.10000E+01 volume 0.12633E-02 ppm1 7.498 ppm2 0.988 CV 1 ASSI { 268} (( segid "KH " and resid 156 and name HN )) ( segid "KH " and resid 156 and name HG2%) 3.500 1.600 1.600 peak 268 spectrum 1 weight 0.10000E+01 volume 0.17727E-02 ppm1 9.567 ppm2 0.798 CV 1 ASSI { 271} (( segid "KH " and resid 58 and name HN )) (( segid "KH " and resid 58 and name HB )) 2.800 1.000 1.000 peak 271 spectrum 1 weight 0.10000E+01 volume 0.47110E-02 ppm1 8.668 ppm2 1.733 CV 1 ASSI { 274} (( segid "KH " and resid 58 and name HN )) (( segid "KH " and resid 58 and name HG13)) 3.400 1.500 1.500 peak 274 spectrum 1 weight 0.10000E+01 volume 0.18519E-02 ppm1 8.669 ppm2 1.126 CV 1 ASSI { 283} (( segid "KH " and resid 116 and name HN )) (( segid "KH " and resid 115 and name HA )) 3.000 1.100 1.100 peak 283 spectrum 1 weight 0.10000E+01 volume 0.20513E-02 ppm1 7.210 ppm2 4.448 CV 1 ASSI { 298} (( segid "KH " and resid 48 and name HN )) (( segid "KH " and resid 48 and name HB2 )) 2.600 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.24546E-02 ppm1 8.318 ppm2 1.614 CV 1 ASSI { 300} (( segid "KH " and resid 116 and name HN )) ( segid "KH " and resid 116 and name HB% ) 2.200 0.600 0.600 peak 300 spectrum 1 weight 0.10000E+01 volume 0.99176E-02 ppm1 7.210 ppm2 1.193 CV 1 ASSI { 308} (( segid "KH " and resid 116 and name HN )) ( segid "KH " and resid 152 and name HG2%) 3.700 1.700 1.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.16007E-02 ppm1 7.203 ppm2 0.592 CV 1 ASSI { 322} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 147 and name HA )) 3.200 1.300 1.300 peak 322 spectrum 1 weight 0.10000E+01 volume 0.11990E-02 ppm1 8.537 ppm2 4.580 CV 1 ASSI { 325} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HA )) 2.400 0.700 0.700 peak 325 spectrum 1 weight 0.10000E+01 volume 0.41487E-02 ppm1 8.536 ppm2 4.348 CV 1 ASSI { 326} (( segid "KH " and resid 175 and name HN )) (( segid "KH " and resid 175 and name HA )) 2.700 0.900 0.900 peak 326 spectrum 1 weight 0.10000E+01 volume 0.30982E-02 ppm1 7.922 ppm2 4.154 CV 1 ASSI { 331} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 87 and name HA )) 2.900 1.000 1.000 peak 331 spectrum 1 weight 0.10000E+01 volume 0.19912E-02 ppm1 7.624 ppm2 3.537 CV 1 ASSI { 333} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 147 and name HB2 )) 3.100 1.200 1.200 peak 333 spectrum 1 weight 0.10000E+01 volume 0.11601E-02 ppm1 8.536 ppm2 3.315 CV 1 ASSI { 335} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 147 and name HB3 )) 3.300 1.300 1.300 peak 335 spectrum 1 weight 0.10000E+01 volume 0.16248E-02 ppm1 8.536 ppm2 2.770 CV 1 ASSI { 343} (( segid "KH " and resid 175 and name HN )) ( segid "KH " and resid 175 and name HB% ) 2.400 0.700 0.700 peak 343 spectrum 1 weight 0.10000E+01 volume 0.64936E-02 ppm1 7.919 ppm2 1.528 CV 1 ASSI { 345} (( segid "KH " and resid 136 and name HN )) ( segid "KH " and resid 136 and name HB% ) 2.400 0.700 0.700 peak 345 spectrum 1 weight 0.10000E+01 volume 0.55372E-02 ppm1 8.078 ppm2 0.961 CV 1 ASSI { 346} (( segid "KH " and resid 137 and name HN )) (( segid "KH " and resid 157 and name HN )) 3.100 1.200 1.200 peak 346 spectrum 1 weight 0.10000E+01 volume 0.97830E-03 ppm1 8.542 ppm2 9.536 CV 1 ASSI { 347} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 88 and name HN )) 2.900 1.100 1.100 peak 347 spectrum 1 weight 0.10000E+01 volume 0.16814E-02 ppm1 7.618 ppm2 7.990 CV 1 ASSI { 350} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 92 and name HN )) 2.500 0.800 0.800 peak 350 spectrum 1 weight 0.10000E+01 volume 0.36712E-02 ppm1 8.446 ppm2 7.646 CV 1 ASSI { 351} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 86 and name HN )) 3.000 1.100 1.100 peak 351 spectrum 1 weight 0.10000E+01 volume 0.14346E-02 ppm1 7.623 ppm2 7.450 CV 1 ASSI { 353} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 50 and name HA )) 2.900 1.100 1.100 peak 353 spectrum 1 weight 0.10000E+01 volume 0.18462E-02 ppm1 7.786 ppm2 4.176 CV 1 ASSI { 357} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 177 and name HA )) 2.800 1.000 1.000 peak 357 spectrum 1 weight 0.10000E+01 volume 0.31704E-02 ppm1 7.895 ppm2 3.824 CV 1 ASSI { 360} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 93 and name HG3 )) 2.800 1.000 1.000 peak 360 spectrum 1 weight 0.10000E+01 volume 0.27806E-02 ppm1 8.446 ppm2 2.349 CV 1 OR { 360} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 93 and name HG2 )) ASSI { 361} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 93 and name HB2 )) 3.300 1.400 1.400 peak 361 spectrum 1 weight 0.10000E+01 volume 0.40065E-02 ppm1 8.443 ppm2 2.209 CV 1 ASSI { 362} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 177 and name HB )) 2.400 0.700 0.700 peak 362 spectrum 1 weight 0.10000E+01 volume 0.38078E-02 ppm1 7.895 ppm2 2.149 CV 1 ASSI { 365} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 178 and name HB3 )) 2.300 0.700 0.700 peak 365 spectrum 1 weight 0.10000E+01 volume 0.71938E-02 ppm1 7.897 ppm2 1.822 CV 1 OR { 365} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 178 and name HB2 )) ASSI { 366} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 87 and name HG12)) 3.400 1.400 1.400 peak 366 spectrum 1 weight 0.10000E+01 volume 0.22671E-02 ppm1 7.622 ppm2 1.783 CV 1 ASSI { 369} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 178 and name HG2 )) 3.600 1.600 1.600 peak 369 spectrum 1 weight 0.10000E+01 volume 0.22013E-02 ppm1 7.898 ppm2 1.520 CV 1 ASSI { 372} (( segid "KH " and resid 178 and name HN )) (( segid "KH " and resid 178 and name HG3 )) 2.400 0.700 0.700 peak 372 spectrum 1 weight 0.10000E+01 volume 0.21928E-02 ppm1 7.898 ppm2 1.455 CV 1 ASSI { 374} (( segid "KH " and resid 137 and name HN )) ( segid "KH " and resid 136 and name HB% ) 2.800 1.000 1.000 peak 374 spectrum 1 weight 0.10000E+01 volume 0.29214E-02 ppm1 8.542 ppm2 0.963 CV 1 ASSI { 375} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 87 and name HG13)) 2.700 0.900 0.900 peak 375 spectrum 1 weight 0.10000E+01 volume 0.22359E-02 ppm1 7.623 ppm2 0.946 CV 1 ASSI { 376} (( segid "KH " and resid 178 and name HN )) ( segid "KH " and resid 177 and name HG2%) 3.300 1.400 1.400 peak 376 spectrum 1 weight 0.10000E+01 volume 0.30014E-02 ppm1 7.892 ppm2 0.863 CV 1 ASSI { 380} (( segid "KH " and resid 87 and name HN )) ( segid "KH " and resid 87 and name HG2%) 3.400 1.500 1.500 peak 380 spectrum 1 weight 0.10000E+01 volume 0.19205E-02 ppm1 7.619 ppm2 0.669 CV 1 ASSI { 381} (( segid "KH " and resid 87 and name HN )) ( segid "KH " and resid 87 and name HD1%) 3.700 1.700 1.700 peak 381 spectrum 1 weight 0.10000E+01 volume 0.15788E-02 ppm1 7.622 ppm2 0.596 CV 1 ASSI { 393} (( segid "KH " and resid 69 and name HN )) (( segid "KH " and resid 68 and name HA )) 2.600 0.900 0.900 peak 393 spectrum 1 weight 0.10000E+01 volume 0.30339E-02 ppm1 9.106 ppm2 5.191 CV 1 ASSI { 397} (( segid "KH " and resid 172 and name HN )) (( segid "KH " and resid 172 and name HA )) 2.600 0.800 0.800 peak 397 spectrum 1 weight 0.10000E+01 volume 0.41883E-02 ppm1 8.018 ppm2 4.478 CV 1 ASSI { 403} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 51 and name HB2 )) 2.800 1.000 1.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.20513E-02 ppm1 8.376 ppm2 3.296 CV 1 ASSI { 405} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 51 and name HB3 )) 2.900 1.000 1.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.20167E-02 ppm1 8.381 ppm2 3.093 CV 1 ASSI { 415} (( segid "KH " and resid 86 and name HN )) (( segid "KH " and resid 86 and name HB2 )) 3.100 1.200 1.200 peak 415 spectrum 1 weight 0.10000E+01 volume 0.12492E-02 ppm1 7.431 ppm2 1.900 CV 1 OR { 415} (( segid "KH " and resid 86 and name HN )) (( segid "KH " and resid 86 and name HB3 )) ASSI { 418} (( segid "KH " and resid 69 and name HN )) (( segid "KH " and resid 69 and name HB2 )) 3.200 1.300 1.300 peak 418 spectrum 1 weight 0.10000E+01 volume 0.91036E-03 ppm1 9.105 ppm2 1.590 CV 1 ASSI { 419} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 100 and name HG2 )) 2.700 2.700 3.300 peak 419 spectrum 1 weight 0.10000E+01 volume 0.14926E-02 ppm1 7.590 ppm2 1.403 CV 1 OR { 419} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 100 and name HG3 )) ASSI { 434} (( segid "KH " and resid 33 and name HN )) (( segid "KH " and resid 34 and name HN )) 2.400 0.700 0.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.44896E-02 ppm1 7.667 ppm2 7.078 CV 1 ASSI { 438} (( segid "KH " and resid 153 and name HN )) (( segid "KH " and resid 152 and name HA )) 2.900 1.000 1.000 peak 438 spectrum 1 weight 0.10000E+01 volume 0.20825E-02 ppm1 9.137 ppm2 4.629 CV 1 ASSI { 440} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 115 and name HA )) 3.000 1.100 1.100 peak 440 spectrum 1 weight 0.10000E+01 volume 0.15569E-02 ppm1 7.356 ppm2 4.441 CV 1 ASSI { 441} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 101 and name HA )) 2.300 0.700 0.700 peak 441 spectrum 1 weight 0.10000E+01 volume 0.71235E-02 ppm1 7.590 ppm2 4.404 CV 1 ASSI { 443} (( segid "KH " and resid 33 and name HN )) (( segid "KH " and resid 32 and name HA )) 3.000 1.100 1.100 peak 443 spectrum 1 weight 0.10000E+01 volume 0.21419E-02 ppm1 7.669 ppm2 4.222 CV 1 ASSI { 445} (( segid "KH " and resid 47 and name HN )) (( segid "KH " and resid 47 and name HA )) 3.200 1.300 1.300 peak 445 spectrum 1 weight 0.10000E+01 volume 0.12357E-02 ppm1 7.870 ppm2 4.129 CV 1 ASSI { 447} (( segid "KH " and resid 33 and name HN )) (( segid "KH " and resid 33 and name HA )) 2.700 0.900 0.900 peak 447 spectrum 1 weight 0.10000E+01 volume 0.30176E-02 ppm1 7.669 ppm2 4.082 CV 1 ASSI { 457} (( segid "KH " and resid 131 and name HN )) (( segid "KH " and resid 131 and name HG3 )) 4.400 2.400 1.600 peak 457 spectrum 1 weight 0.10000E+01 volume 0.70383E-03 ppm1 8.225 ppm2 2.511 CV 1 ASSI { 461} (( segid "KH " and resid 33 and name HN )) (( segid "KH " and resid 32 and name HB3 )) 3.100 1.200 1.200 peak 461 spectrum 1 weight 0.10000E+01 volume 0.14741E-02 ppm1 7.668 ppm2 2.087 CV 1 ASSI { 462} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 101 and name HB2 )) 2.700 0.900 0.900 peak 462 spectrum 1 weight 0.10000E+01 volume 0.46262E-02 ppm1 7.591 ppm2 2.096 CV 1 ASSI { 464} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 101 and name HB3 )) 2.300 0.700 0.700 peak 464 spectrum 1 weight 0.10000E+01 volume 0.81910E-02 ppm1 7.590 ppm2 1.975 CV 1 ASSI { 482} (( segid "KH " and resid 83 and name HN )) ( segid "KH " and resid 83 and name HB% ) 2.700 0.900 0.900 peak 482 spectrum 1 weight 0.10000E+01 volume 0.31464E-02 ppm1 8.867 ppm2 1.272 CV 1 ASSI { 486} (( segid "KH " and resid 33 and name HN )) ( segid "KH " and resid 33 and name HB% ) 2.300 0.700 0.700 peak 486 spectrum 1 weight 0.10000E+01 volume 0.66945E-02 ppm1 7.667 ppm2 0.570 CV 1 ASSI { 497} (( segid "KH " and resid 145 and name HN )) (( segid "KH " and resid 145 and name HA )) 5.500 3.800 0.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.45271E-04 ppm1 8.769 ppm2 4.650 CV 1 ASSI { 499} (( segid "KH " and resid 145 and name HN )) (( segid "KH " and resid 144 and name HA )) 4.800 2.900 1.200 peak 499 spectrum 1 weight 0.10000E+01 volume 0.85594E-04 ppm1 8.769 ppm2 4.433 CV 1 ASSI { 500} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 92 and name HA )) 2.900 1.100 1.100 peak 500 spectrum 1 weight 0.10000E+01 volume 0.18207E-02 ppm1 7.638 ppm2 4.283 CV 1 ASSI { 508} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 170 and name HA )) 3.000 1.100 1.100 peak 508 spectrum 1 weight 0.10000E+01 volume 0.14621E-02 ppm1 8.298 ppm2 3.519 CV 1 ASSI { 514} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 92 and name HB2 )) 2.300 0.700 0.700 peak 514 spectrum 1 weight 0.10000E+01 volume 0.43644E-02 ppm1 7.640 ppm2 2.188 CV 1 ASSI { 516} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 92 and name HB3 )) 3.100 1.200 1.200 peak 516 spectrum 1 weight 0.10000E+01 volume 0.33833E-02 ppm1 7.638 ppm2 1.954 CV 1 ASSI { 519} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 170 and name HB )) 3.000 1.200 1.200 peak 519 spectrum 1 weight 0.10000E+01 volume 0.30580E-02 ppm1 8.296 ppm2 1.771 CV 1 ASSI { 522} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 92 and name HG2 )) 2.800 1.000 1.000 peak 522 spectrum 1 weight 0.10000E+01 volume 0.26838E-02 ppm1 7.642 ppm2 1.523 CV 1 OR { 522} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 92 and name HG3 )) ASSI { 527} (( segid "KH " and resid 92 and name HN )) ( segid "KH " and resid 103 and name HG1%) 3.100 1.200 1.200 peak 527 spectrum 1 weight 0.10000E+01 volume 0.16616E-02 ppm1 7.642 ppm2 0.922 CV 1 ASSI { 539} (( segid "KH " and resid 109 and name HN )) (( segid "KH " and resid 108 and name HA )) 2.700 0.900 0.900 peak 539 spectrum 1 weight 0.10000E+01 volume 0.20365E-02 ppm1 8.812 ppm2 6.182 CV 1 ASSI { 544} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 21 and name HA )) 2.300 0.700 0.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.78448E-02 ppm1 8.136 ppm2 4.196 CV 1 ASSI { 546} (( segid "KH " and resid 81 and name HN )) (( segid "KH " and resid 81 and name HA )) 3.100 1.200 1.200 peak 546 spectrum 1 weight 0.10000E+01 volume 0.13977E-02 ppm1 7.917 ppm2 4.144 CV 1 ASSI { 548} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 22 and name HA )) 2.800 1.000 1.000 peak 548 spectrum 1 weight 0.10000E+01 volume 0.25472E-02 ppm1 8.138 ppm2 3.964 CV 1 ASSI { 549} (( segid "KH " and resid 24 and name HN )) (( segid "KH " and resid 24 and name HB )) 2.700 0.900 0.900 peak 549 spectrum 1 weight 0.10000E+01 volume 0.29412E-02 ppm1 8.559 ppm2 3.776 CV 1 ASSI { 558} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 22 and name HG2 )) 3.000 1.100 1.100 peak 558 spectrum 1 weight 0.10000E+01 volume 0.31542E-02 ppm1 8.136 ppm2 2.269 CV 1 ASSI { 560} (( segid "KH " and resid 24 and name HN )) (( segid "KH " and resid 23 and name HG3 )) 3.400 1.500 1.500 peak 560 spectrum 1 weight 0.10000E+01 volume 0.13157E-02 ppm1 8.560 ppm2 2.244 CV 1 OR { 560} (( segid "KH " and resid 24 and name HN )) (( segid "KH " and resid 23 and name HG2 )) ASSI { 562} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 21 and name HB2 )) 3.100 3.100 2.900 peak 562 spectrum 1 weight 0.10000E+01 volume 0.31619E-02 ppm1 8.136 ppm2 2.018 CV 1 ASSI { 563} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 179 and name HB3 )) 2.500 0.800 0.800 peak 563 spectrum 1 weight 0.10000E+01 volume 0.52076E-02 ppm1 7.973 ppm2 2.019 CV 1 OR { 563} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 179 and name HB2 )) ASSI { 564} (( segid "KH " and resid 24 and name HN )) (( segid "KH " and resid 23 and name HB2 )) 3.500 1.500 1.500 peak 564 spectrum 1 weight 0.10000E+01 volume 0.26922E-02 ppm1 8.560 ppm2 1.985 CV 1 OR { 564} (( segid "KH " and resid 24 and name HN )) (( segid "KH " and resid 23 and name HB3 )) ASSI { 567} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 178 and name HB3 )) 2.700 0.900 0.900 peak 567 spectrum 1 weight 0.10000E+01 volume 0.25189E-02 ppm1 7.973 ppm2 1.841 CV 1 OR { 567} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 178 and name HB2 )) ASSI { 568} (( segid "KH " and resid 38 and name HN )) (( segid "KH " and resid 38 and name HG12)) 2.300 0.700 0.700 peak 568 spectrum 1 weight 0.10000E+01 volume 0.29490E-02 ppm1 8.188 ppm2 1.645 CV 1 ASSI { 569} (( segid "KH " and resid 165 and name HN )) (( segid "KH " and resid 164 and name HB2 )) 3.600 1.600 1.600 peak 569 spectrum 1 weight 0.10000E+01 volume 0.10540E-02 ppm1 8.122 ppm2 1.649 CV 1 ASSI { 574} (( segid "KH " and resid 109 and name HN )) (( segid "KH " and resid 109 and name HG12)) 3.200 1.300 1.300 peak 574 spectrum 1 weight 0.10000E+01 volume 0.67767E-03 ppm1 8.810 ppm2 1.255 CV 1 ASSI { 577} (( segid "KH " and resid 109 and name HN )) (( segid "KH " and resid 109 and name HG13)) 3.600 1.700 1.700 peak 577 spectrum 1 weight 0.10000E+01 volume 0.11671E-02 ppm1 8.811 ppm2 0.981 CV 1 ASSI { 578} (( segid "KH " and resid 24 and name HN )) ( segid "KH " and resid 24 and name HG2%) 3.500 1.600 1.600 peak 578 spectrum 1 weight 0.10000E+01 volume 0.13440E-02 ppm1 8.559 ppm2 1.072 CV 1 ASSI { 584} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HN )) 3.000 1.100 1.100 peak 584 spectrum 1 weight 0.10000E+01 volume 0.15470E-02 ppm1 8.384 ppm2 9.259 CV 1 ASSI { 591} (( segid "KH " and resid 177 and name HN )) (( segid "KH " and resid 176 and name HN )) 2.400 0.700 0.700 peak 591 spectrum 1 weight 0.10000E+01 volume 0.45066E-02 ppm1 7.758 ppm2 7.696 CV 1 ASSI { 595} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 149 and name HA )) 2.700 0.900 0.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.32829E-02 ppm1 8.385 ppm2 4.970 CV 1 ASSI { 596} (( segid "KH " and resid 54 and name HN )) (( segid "KH " and resid 54 and name HA )) 3.200 1.300 1.300 peak 596 spectrum 1 weight 0.10000E+01 volume 0.12075E-02 ppm1 7.722 ppm2 4.897 CV 1 ASSI { 600} (( segid "KH " and resid 177 and name HN )) (( segid "KH " and resid 176 and name HA )) 2.800 1.000 1.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.29052E-02 ppm1 7.757 ppm2 4.128 CV 1 ASSI { 601} (( segid "KH " and resid 34 and name HN )) (( segid "KH " and resid 33 and name HA )) 3.100 1.200 1.200 peak 601 spectrum 1 weight 0.10000E+01 volume 0.13758E-02 ppm1 7.083 ppm2 4.085 CV 1 ASSI { 602} (( segid "KH " and resid 54 and name HN )) (( segid "KH " and resid 53 and name HA )) 2.800 1.000 1.000 peak 602 spectrum 1 weight 0.10000E+01 volume 0.32383E-02 ppm1 7.722 ppm2 4.057 CV 1 ASSI { 604} (( segid "KH " and resid 177 and name HN )) (( segid "KH " and resid 177 and name HA )) 2.500 0.800 0.800 peak 604 spectrum 1 weight 0.10000E+01 volume 0.41883E-02 ppm1 7.759 ppm2 3.825 CV 1 ASSI { 605} (( segid "KH " and resid 34 and name HN )) (( segid "KH " and resid 31 and name HA )) 3.400 1.400 1.400 peak 605 spectrum 1 weight 0.10000E+01 volume 0.12973E-02 ppm1 7.085 ppm2 3.673 CV 1 ASSI { 608} (( segid "KH " and resid 34 and name HN )) (( segid "KH " and resid 34 and name HA )) 2.500 0.800 0.800 peak 608 spectrum 1 weight 0.10000E+01 volume 0.34838E-02 ppm1 7.085 ppm2 3.223 CV 1 ASSI { 610} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 149 and name HB2 )) 2.600 0.900 0.900 peak 610 spectrum 1 weight 0.10000E+01 volume 0.25713E-02 ppm1 8.388 ppm2 2.955 CV 1 ASSI { 614} (( segid "KH " and resid 177 and name HN )) (( segid "KH " and resid 177 and name HB )) 2.200 0.600 0.600 peak 614 spectrum 1 weight 0.10000E+01 volume 0.89130E-02 ppm1 7.759 ppm2 2.148 CV 1 ASSI { 615} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HB2 )) 3.500 1.600 1.600 peak 615 spectrum 1 weight 0.10000E+01 volume 0.17868E-02 ppm1 8.385 ppm2 2.042 CV 1 OR { 615} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HB3 )) ASSI { 619} (( segid "KH " and resid 177 and name HN )) ( segid "KH " and resid 175 and name HB% ) 3.700 1.700 1.700 peak 619 spectrum 1 weight 0.10000E+01 volume 0.13497E-02 ppm1 7.754 ppm2 1.508 CV 1 ASSI { 621} (( segid "KH " and resid 54 and name HN )) ( segid "KH " and resid 52 and name HB% ) 3.000 1.200 1.200 peak 621 spectrum 1 weight 0.10000E+01 volume 0.17812E-02 ppm1 7.720 ppm2 1.409 CV 1 ASSI { 624} (( segid "KH " and resid 34 and name HN )) ( segid "KH " and resid 31 and name HB% ) 2.800 2.800 3.200 peak 624 spectrum 1 weight 0.10000E+01 volume 0.12132E-02 ppm1 7.083 ppm2 1.236 CV 1 ASSI { 625} (( segid "KH " and resid 54 and name HN )) ( segid "KH " and resid 54 and name HB% ) 3.000 1.100 1.100 peak 625 spectrum 1 weight 0.10000E+01 volume 0.20394E-02 ppm1 7.721 ppm2 1.036 CV 1 ASSI { 626} (( segid "KH " and resid 177 and name HN )) ( segid "KH " and resid 177 and name HG1%) 3.000 1.100 1.100 peak 626 spectrum 1 weight 0.10000E+01 volume 0.75690E-02 ppm1 7.759 ppm2 0.949 CV 1 ASSI { 627} (( segid "KH " and resid 177 and name HN )) ( segid "KH " and resid 177 and name HG2%) 2.500 2.500 3.500 peak 627 spectrum 1 weight 0.10000E+01 volume 0.32348E-02 ppm1 7.757 ppm2 0.855 CV 1 ASSI { 631} (( segid "KH " and resid 34 and name HN )) ( segid "KH " and resid 33 and name HB% ) 2.800 0.900 0.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.25515E-02 ppm1 7.083 ppm2 0.580 CV 1 ASSI { 634} (( segid "KH " and resid 54 and name HN )) (( segid "KH " and resid 53 and name HN )) 2.800 1.000 1.000 peak 634 spectrum 1 weight 0.10000E+01 volume 0.22501E-02 ppm1 7.725 ppm2 7.908 CV 1 ASSI { 642} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 143 and name HA )) 2.200 0.600 0.600 peak 642 spectrum 1 weight 0.10000E+01 volume 0.88562E-02 ppm1 8.907 ppm2 4.358 CV 1 ASSI { 645} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 142 and name HA )) 2.500 0.800 0.800 peak 645 spectrum 1 weight 0.10000E+01 volume 0.52402E-02 ppm1 8.908 ppm2 4.293 CV 1 ASSI { 647} (( segid "KH " and resid 82 and name HN )) (( segid "KH " and resid 82 and name HA )) 5.000 3.100 1.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.83471E-04 ppm1 7.809 ppm2 4.082 CV 1 ASSI { 651} (( segid "KH " and resid 161 and name HN )) (( segid "KH " and resid 160 and name HA )) 3.500 1.500 1.500 peak 651 spectrum 1 weight 0.10000E+01 volume 0.92733E-03 ppm1 8.612 ppm2 3.252 CV 1 ASSI { 652} (( segid "KH " and resid 82 and name HN )) (( segid "KH " and resid 81 and name HB3 )) 6.000 4.800 0.000 peak 652 spectrum 1 weight 0.10000E+01 volume 0.24757E-04 ppm1 7.813 ppm2 3.185 CV 1 ASSI { 655} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 143 and name HB2 )) 3.000 1.100 1.100 peak 655 spectrum 1 weight 0.10000E+01 volume 0.17868E-02 ppm1 8.904 ppm2 2.774 CV 1 ASSI { 656} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 143 and name HB3 )) 3.300 1.400 1.400 peak 656 spectrum 1 weight 0.10000E+01 volume 0.16170E-02 ppm1 8.907 ppm2 2.633 CV 1 ASSI { 663} (( segid "KH " and resid 52 and name HN )) ( segid "KH " and resid 52 and name HB% ) 3.100 1.200 1.200 peak 663 spectrum 1 weight 0.10000E+01 volume 0.12514E-02 ppm1 8.376 ppm2 1.390 CV 1 ASSI { 667} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 152 and name HN )) 3.500 1.500 1.500 peak 667 spectrum 1 weight 0.10000E+01 volume 0.17585E-02 ppm1 8.463 ppm2 9.146 CV 1 ASSI { 676} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 151 and name HA )) 2.900 1.000 1.000 peak 676 spectrum 1 weight 0.10000E+01 volume 0.16877E-02 ppm1 8.464 ppm2 5.060 CV 1 ASSI { 680} (( segid "KH " and resid 150 and name HN )) (( segid "KH " and resid 150 and name HA )) 2.400 0.700 0.700 peak 680 spectrum 1 weight 0.10000E+01 volume 0.37052E-02 ppm1 8.610 ppm2 3.766 CV 1 ASSI { 681} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 150 and name HA )) 2.800 1.000 1.000 peak 681 spectrum 1 weight 0.10000E+01 volume 0.20853E-02 ppm1 8.464 ppm2 3.762 CV 1 ASSI { 692} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 151 and name HG3 )) 2.600 0.900 0.900 peak 692 spectrum 1 weight 0.10000E+01 volume 0.28974E-02 ppm1 8.465 ppm2 1.772 CV 1 ASSI { 693} (( segid "KH " and resid 176 and name HN )) ( segid "KH " and resid 175 and name HB% ) 2.900 1.000 1.000 peak 693 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 7.678 ppm2 1.539 CV 1 ASSI { 703} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HA )) 2.400 0.700 0.700 peak 703 spectrum 1 weight 0.10000E+01 volume 0.55450E-02 ppm1 8.532 ppm2 4.402 CV 1 ASSI { 706} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 88 and name HA )) 3.000 1.100 1.100 peak 706 spectrum 1 weight 0.10000E+01 volume 0.15993E-02 ppm1 7.983 ppm2 3.825 CV 1 ASSI { 709} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 88 and name HB2 )) 2.900 1.100 1.100 peak 709 spectrum 1 weight 0.10000E+01 volume 0.12973E-02 ppm1 7.981 ppm2 2.890 CV 1 ASSI { 710} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 88 and name HB3 )) 3.700 1.700 1.700 peak 710 spectrum 1 weight 0.10000E+01 volume 0.86581E-03 ppm1 7.987 ppm2 2.663 CV 1 ASSI { 712} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 87 and name HB )) 3.100 1.200 1.200 peak 712 spectrum 1 weight 0.10000E+01 volume 0.10066E-02 ppm1 7.985 ppm2 1.975 CV 1 ASSI { 731} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 97 and name HA )) 2.800 1.000 1.000 peak 731 spectrum 1 weight 0.10000E+01 volume 0.22812E-02 ppm1 8.340 ppm2 4.548 CV 1 ASSI { 736} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 97 and name HB2 )) 3.100 1.200 1.200 peak 736 spectrum 1 weight 0.10000E+01 volume 0.18434E-02 ppm1 8.336 ppm2 3.245 CV 1 ASSI { 737} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 96 and name HB2 )) 2.900 1.100 1.100 peak 737 spectrum 1 weight 0.10000E+01 volume 0.20542E-02 ppm1 8.340 ppm2 2.854 CV 1 OR { 737} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 96 and name HB3 )) ASSI { 738} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 97 and name HB3 )) 3.100 1.200 1.200 peak 738 spectrum 1 weight 0.10000E+01 volume 0.23407E-02 ppm1 8.340 ppm2 2.754 CV 1 ASSI { 741} (( segid "KH " and resid 80 and name HN )) (( segid "KH " and resid 80 and name HB3 )) 3.000 1.100 1.100 peak 741 spectrum 1 weight 0.10000E+01 volume 0.16050E-02 ppm1 8.128 ppm2 2.206 CV 1 OR { 741} (( segid "KH " and resid 80 and name HN )) (( segid "KH " and resid 80 and name HB2 )) ASSI { 748} (( segid "KH " and resid 80 and name HN )) ( segid "KH " and resid 79 and name HB% ) 3.100 1.200 1.200 peak 748 spectrum 1 weight 0.10000E+01 volume 0.17479E-02 ppm1 8.132 ppm2 1.416 CV 1 ASSI { 753} (( segid "KH " and resid 55 and name HN )) (( segid "KH " and resid 74 and name HN )) 3.200 1.300 1.300 peak 753 spectrum 1 weight 0.10000E+01 volume 0.11644E-02 ppm1 8.498 ppm2 9.254 CV 1 ASSI { 754} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 69 and name HN )) 3.500 1.500 1.500 peak 754 spectrum 1 weight 0.10000E+01 volume 0.64229E-03 ppm1 8.836 ppm2 9.107 CV 1 ASSI { 761} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 97 and name HN )) 2.500 0.800 0.800 peak 761 spectrum 1 weight 0.10000E+01 volume 0.39322E-02 ppm1 7.879 ppm2 8.342 CV 1 ASSI { 766} (( segid "KH " and resid 96 and name HN )) ( segid "KH " and resid 97 and name HD% ) 3.500 1.600 1.600 peak 766 spectrum 1 weight 0.10000E+01 volume 0.15569E-02 ppm1 7.881 ppm2 7.314 CV 1 ASSI { 767} (( segid "KH " and resid 96 and name HN )) ( segid "KH " and resid 96 and name HD% ) 2.900 1.100 1.100 peak 767 spectrum 1 weight 0.10000E+01 volume 0.27120E-02 ppm1 7.881 ppm2 7.057 CV 1 ASSI { 768} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 28 and name HA )) 2.500 0.800 0.800 peak 768 spectrum 1 weight 0.10000E+01 volume 0.33593E-02 ppm1 8.835 ppm2 4.945 CV 1 ASSI { 769} (( segid "KH " and resid 55 and name HN )) (( segid "KH " and resid 54 and name HA )) 2.600 0.900 0.900 peak 769 spectrum 1 weight 0.10000E+01 volume 0.34392E-02 ppm1 8.498 ppm2 4.900 CV 1 ASSI { 772} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 95 and name HA )) 2.700 0.900 0.900 peak 772 spectrum 1 weight 0.10000E+01 volume 0.32546E-02 ppm1 7.879 ppm2 4.531 CV 1 ASSI { 774} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 96 and name HA )) 2.600 0.800 0.800 peak 774 spectrum 1 weight 0.10000E+01 volume 0.41204E-02 ppm1 7.880 ppm2 4.132 CV 1 ASSI { 779} (( segid "KH " and resid 167 and name HN )) (( segid "KH " and resid 167 and name HA )) 3.100 1.200 1.200 peak 779 spectrum 1 weight 0.10000E+01 volume 0.11105E-02 ppm1 8.424 ppm2 3.570 CV 1 ASSI { 780} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 28 and name HB2 )) 3.900 1.900 1.900 peak 780 spectrum 1 weight 0.10000E+01 volume 0.98959E-03 ppm1 8.834 ppm2 3.022 CV 1 ASSI { 781} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 96 and name HB2 )) 2.300 0.700 0.700 peak 781 spectrum 1 weight 0.10000E+01 volume 0.67426E-02 ppm1 7.880 ppm2 2.811 CV 1 OR { 781} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 96 and name HB3 )) ASSI { 784} (( segid "KH " and resid 96 and name HN )) (( segid "KH " and resid 94 and name HB2 )) 3.400 1.500 1.500 peak 784 spectrum 1 weight 0.10000E+01 volume 0.17670E-02 ppm1 7.879 ppm2 2.348 CV 1 ASSI { 785} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 91 and name HB2 )) 2.600 0.900 0.900 peak 785 spectrum 1 weight 0.10000E+01 volume 0.18837E-02 ppm1 7.571 ppm2 2.122 CV 1 ASSI { 787} (( segid "KH " and resid 167 and name HN )) (( segid "KH " and resid 167 and name HB3 )) 4.000 2.000 2.000 peak 787 spectrum 1 weight 0.10000E+01 volume 0.75122E-03 ppm1 8.422 ppm2 1.914 CV 1 ASSI { 788} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 91 and name HG )) 2.700 0.900 0.900 peak 788 spectrum 1 weight 0.10000E+01 volume 0.36656E-02 ppm1 7.572 ppm2 1.957 CV 1 ASSI { 792} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 91 and name HB3 )) 3.400 1.400 1.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.23718E-02 ppm1 7.572 ppm2 1.521 CV 1 ASSI { 797} (( segid "KH " and resid 55 and name HN )) ( segid "KH " and resid 54 and name HB% ) 2.800 1.000 1.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.27806E-02 ppm1 8.499 ppm2 1.051 CV 1 ASSI { 798} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 29 and name HG13)) 3.300 1.400 1.400 peak 798 spectrum 1 weight 0.10000E+01 volume 0.22126E-02 ppm1 8.836 ppm2 0.832 CV 1 ASSI { 799} (( segid "KH " and resid 91 and name HN )) ( segid "KH " and resid 91 and name HD1%) 3.600 1.600 1.600 peak 799 spectrum 1 weight 0.10000E+01 volume 0.16531E-02 ppm1 7.569 ppm2 0.756 CV 1 ASSI { 801} (( segid "KH " and resid 29 and name HN )) ( segid "KH " and resid 29 and name HG2%) 2.800 1.000 1.000 peak 801 spectrum 1 weight 0.10000E+01 volume 0.22303E-02 ppm1 8.833 ppm2 0.665 CV 1 ASSI { 807} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 65 and name HA )) 2.600 0.800 0.800 peak 807 spectrum 1 weight 0.10000E+01 volume 0.45406E-02 ppm1 7.502 ppm2 4.646 CV 1 ASSI { 810} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 66 and name HB2 )) 2.600 0.900 0.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.65580E-02 ppm1 7.501 ppm2 4.104 CV 1 ASSI { 812} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 65 and name HB2 )) 3.200 1.300 1.300 peak 812 spectrum 1 weight 0.10000E+01 volume 0.19884E-02 ppm1 7.502 ppm2 2.648 CV 1 OR { 812} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 65 and name HB3 )) ASSI { 815} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 38 and name HN )) 2.700 0.900 0.900 peak 815 spectrum 1 weight 0.10000E+01 volume 0.19007E-02 ppm1 7.430 ppm2 8.187 CV 1 ASSI { 820} (( segid "KH " and resid 111 and name HN )) (( segid "KH " and resid 110 and name HA )) 2.500 0.800 0.800 peak 820 spectrum 1 weight 0.10000E+01 volume 0.31301E-02 ppm1 8.882 ppm2 5.354 CV 1 ASSI { 821} (( segid "KH " and resid 111 and name HN )) (( segid "KH " and resid 111 and name HA )) 3.100 1.200 1.200 peak 821 spectrum 1 weight 0.10000E+01 volume 0.11035E-02 ppm1 8.882 ppm2 4.849 CV 1 ASSI { 822} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 36 and name HA )) 3.200 1.300 1.300 peak 822 spectrum 1 weight 0.10000E+01 volume 0.14303E-02 ppm1 7.427 ppm2 4.147 CV 1 ASSI { 824} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 37 and name HA )) 2.800 1.000 1.000 peak 824 spectrum 1 weight 0.10000E+01 volume 0.18979E-02 ppm1 7.430 ppm2 3.818 CV 1 ASSI { 826} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 34 and name HA )) 3.300 1.400 1.400 peak 826 spectrum 1 weight 0.10000E+01 volume 0.91320E-03 ppm1 7.430 ppm2 3.234 CV 1 ASSI { 829} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 37 and name HB )) 2.600 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.29292E-02 ppm1 7.430 ppm2 1.912 CV 1 ASSI { 833} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 37 and name HG12)) 2.500 0.800 0.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.19346E-02 ppm1 7.429 ppm2 1.476 CV 1 ASSI { 834} (( segid "KH " and resid 37 and name HN )) ( segid "KH " and resid 36 and name HB% ) 2.600 0.900 0.900 peak 834 spectrum 1 weight 0.10000E+01 volume 0.30898E-02 ppm1 7.432 ppm2 1.388 CV 1 ASSI { 836} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 37 and name HG13)) 3.800 1.800 1.800 peak 836 spectrum 1 weight 0.10000E+01 volume 0.22388E-02 ppm1 7.433 ppm2 1.174 CV 1 ASSI { 839} (( segid "KH " and resid 111 and name HN )) ( segid "KH " and resid 111 and name HG1%) 3.100 1.200 1.200 peak 839 spectrum 1 weight 0.10000E+01 volume 0.22558E-02 ppm1 8.881 ppm2 0.685 CV 1 ASSI { 840} (( segid "KH " and resid 37 and name HN )) ( segid "KH " and resid 37 and name HG2%) 3.500 1.600 1.600 peak 840 spectrum 1 weight 0.10000E+01 volume 0.25515E-02 ppm1 7.433 ppm2 0.711 CV 1 ASSI { 841} (( segid "KH " and resid 37 and name HN )) ( segid "KH " and resid 37 and name HD1%) 3.500 1.500 1.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.19686E-02 ppm1 7.432 ppm2 0.615 CV 1 ASSI { 842} (( segid "KH " and resid 111 and name HN )) ( segid "KH " and resid 111 and name HG2%) 2.900 1.000 1.000 peak 842 spectrum 1 weight 0.10000E+01 volume 0.21900E-02 ppm1 8.881 ppm2 0.462 CV 1 ASSI { 848} (( segid "KH " and resid 149 and name HD22)) (( segid "KH " and resid 149 and name HD21)) 1.900 0.400 0.400 peak 848 spectrum 1 weight 0.10000E+01 volume 0.13666E-01 ppm1 6.865 ppm2 7.874 CV 1 ASSI { 852} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 65 and name HA )) 2.500 0.800 0.800 peak 852 spectrum 1 weight 0.10000E+01 volume 0.51999E-02 ppm1 8.011 ppm2 4.650 CV 1 ASSI { 853} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 49 and name HA )) 2.900 1.100 1.100 peak 853 spectrum 1 weight 0.10000E+01 volume 0.19205E-02 ppm1 8.151 ppm2 4.255 CV 1 ASSI { 854} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 49 and name HB3 )) 2.800 1.000 1.000 peak 854 spectrum 1 weight 0.10000E+01 volume 0.23605E-02 ppm1 8.148 ppm2 4.084 CV 1 OR { 854} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 49 and name HB2 )) ASSI { 856} (( segid "KH " and resid 149 and name HD21)) (( segid "KH " and resid 149 and name HB2 )) 2.800 1.000 1.000 peak 856 spectrum 1 weight 0.10000E+01 volume 0.16934E-02 ppm1 7.862 ppm2 2.950 CV 1 ASSI { 857} (( segid "KH " and resid 149 and name HD22)) (( segid "KH " and resid 149 and name HB2 )) 3.700 1.700 1.700 peak 857 spectrum 1 weight 0.10000E+01 volume 0.15569E-02 ppm1 6.854 ppm2 2.950 CV 1 ASSI { 858} (( segid "KH " and resid 149 and name HD21)) (( segid "KH " and resid 149 and name HB3 )) 2.900 1.100 1.100 peak 858 spectrum 1 weight 0.10000E+01 volume 0.25112E-02 ppm1 7.862 ppm2 2.610 CV 1 ASSI { 859} (( segid "KH " and resid 149 and name HD22)) (( segid "KH " and resid 149 and name HB3 )) 3.400 1.400 1.400 peak 859 spectrum 1 weight 0.10000E+01 volume 0.26562E-02 ppm1 6.860 ppm2 2.616 CV 1 ASSI { 865} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 48 and name HB2 )) 3.200 1.300 1.300 peak 865 spectrum 1 weight 0.10000E+01 volume 0.14487E-02 ppm1 8.149 ppm2 1.612 CV 1 ASSI { 866} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 48 and name HB3 )) 3.000 1.100 1.100 peak 866 spectrum 1 weight 0.10000E+01 volume 0.15427E-02 ppm1 8.153 ppm2 1.531 CV 1 ASSI { 872} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 93 and name HN )) 2.700 0.900 0.900 peak 872 spectrum 1 weight 0.10000E+01 volume 0.21871E-02 ppm1 7.677 ppm2 8.444 CV 1 ASSI { 875} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 95 and name HN )) 2.600 0.900 0.900 peak 875 spectrum 1 weight 0.10000E+01 volume 0.29773E-02 ppm1 7.679 ppm2 7.928 CV 1 ASSI { 880} (( segid "KH " and resid 152 and name HN )) (( segid "KH " and resid 151 and name HA )) 2.600 0.900 0.900 peak 880 spectrum 1 weight 0.10000E+01 volume 0.23689E-02 ppm1 9.153 ppm2 5.075 CV 1 ASSI { 884} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 94 and name HA )) 2.700 0.900 0.900 peak 884 spectrum 1 weight 0.10000E+01 volume 0.36260E-02 ppm1 7.675 ppm2 4.329 CV 1 ASSI { 891} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 65 and name HB2 )) 2.500 0.800 0.800 peak 891 spectrum 1 weight 0.10000E+01 volume 0.56497E-02 ppm1 8.012 ppm2 2.654 CV 1 OR { 891} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 65 and name HB3 )) ASSI { 893} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 94 and name HB2 )) 2.200 0.600 0.600 peak 893 spectrum 1 weight 0.10000E+01 volume 0.56179E-02 ppm1 7.677 ppm2 2.340 CV 1 ASSI { 894} (( segid "KH " and resid 84 and name HN )) (( segid "KH " and resid 84 and name HB3 )) 3.200 1.300 1.300 peak 894 spectrum 1 weight 0.10000E+01 volume 0.12973E-02 ppm1 8.855 ppm2 2.282 CV 1 ASSI { 895} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 94 and name HG2 )) 3.100 1.200 1.200 peak 895 spectrum 1 weight 0.10000E+01 volume 0.42392E-02 ppm1 7.677 ppm2 2.199 CV 1 OR { 895} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 94 and name HG3 )) ASSI { 899} (( segid "KH " and resid 94 and name HN )) (( segid "KH " and resid 94 and name HB3 )) 2.800 1.000 1.000 peak 899 spectrum 1 weight 0.10000E+01 volume 0.28889E-02 ppm1 7.675 ppm2 1.786 CV 1 ASSI { 907} (( segid "KH " and resid 167 and name HE22)) (( segid "KH " and resid 167 and name HE21)) 6.000 5.300 0.000 peak 907 spectrum 1 weight 0.10000E+01 volume 0.70735E-05 ppm1 6.784 ppm2 7.983 CV 1 ASSI { 914} (( segid "KH " and resid 68 and name HN )) (( segid "KH " and resid 68 and name HA )) 2.900 1.000 1.000 peak 914 spectrum 1 weight 0.10000E+01 volume 0.19516E-02 ppm1 7.769 ppm2 5.183 CV 1 ASSI { 916} (( segid "KH " and resid 68 and name HN )) (( segid "KH " and resid 67 and name HA )) 3.100 1.200 1.200 peak 916 spectrum 1 weight 0.10000E+01 volume 0.17274E-02 ppm1 7.771 ppm2 4.368 CV 1 ASSI { 936} (( segid "KH " and resid 95 and name HN )) (( segid "KH " and resid 95 and name HA )) 2.400 0.700 0.700 peak 936 spectrum 1 weight 0.10000E+01 volume 0.50788E-02 ppm1 7.928 ppm2 4.534 CV 1 ASSI { 937} (( segid "KH " and resid 95 and name HN )) (( segid "KH " and resid 94 and name HA )) 3.100 1.200 1.200 peak 937 spectrum 1 weight 0.10000E+01 volume 0.17528E-02 ppm1 7.928 ppm2 4.332 CV 1 ASSI { 946} (( segid "KH " and resid 95 and name HD22)) (( segid "KH " and resid 95 and name HD21)) 1.600 0.300 0.600 peak 946 spectrum 1 weight 0.10000E+01 volume 0.33458E-01 ppm1 6.625 ppm2 7.386 CV 1 ASSI { 952} (( segid "KH " and resid 95 and name HD22)) (( segid "KH " and resid 95 and name HB2 )) 3.700 1.700 1.700 peak 952 spectrum 1 weight 0.10000E+01 volume 0.17437E-02 ppm1 6.623 ppm2 2.860 CV 1 ASSI { 953} (( segid "KH " and resid 95 and name HD21)) (( segid "KH " and resid 95 and name HB3 )) 2.700 0.900 0.900 peak 953 spectrum 1 weight 0.10000E+01 volume 0.28210E-02 ppm1 7.384 ppm2 2.685 CV 1 ASSI { 954} (( segid "KH " and resid 95 and name HD22)) (( segid "KH " and resid 95 and name HB3 )) 3.500 1.500 1.500 peak 954 spectrum 1 weight 0.10000E+01 volume 0.24659E-02 ppm1 6.621 ppm2 2.691 CV 1 ASSI { 961} (( segid "KH " and resid 53 and name HN )) (( segid "KH " and resid 52 and name HN )) 2.800 1.000 1.000 peak 961 spectrum 1 weight 0.10000E+01 volume 0.18378E-02 ppm1 7.896 ppm2 8.358 CV 1 ASSI { 977} (( segid "KH " and resid 53 and name HN )) (( segid "KH " and resid 53 and name HA )) 2.700 0.900 0.900 peak 977 spectrum 1 weight 0.10000E+01 volume 0.27962E-02 ppm1 7.901 ppm2 4.084 CV 1 ASSI { 979} (( segid "KH " and resid 53 and name HN )) (( segid "KH " and resid 53 and name HB3 )) 2.900 1.100 1.100 peak 979 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 7.900 ppm2 4.017 CV 1 ASSI { 980} (( segid "KH " and resid 163 and name HN )) (( segid "KH " and resid 163 and name HA )) 2.900 1.000 1.000 peak 980 spectrum 1 weight 0.10000E+01 volume 0.21306E-02 ppm1 8.373 ppm2 3.954 CV 1 ASSI { 982} (( segid "KH " and resid 95 and name HD21)) (( segid "KH " and resid 95 and name HB2 )) 2.900 1.100 1.100 peak 982 spectrum 1 weight 0.10000E+01 volume 0.17755E-02 ppm1 7.387 ppm2 2.866 CV 1 ASSI { 983} (( segid "KH " and resid 128 and name HD22)) (( segid "KH " and resid 128 and name HB2 )) 3.600 1.700 1.700 peak 983 spectrum 1 weight 0.10000E+01 volume 0.20082E-02 ppm1 6.866 ppm2 2.966 CV 1 ASSI { 991} (( segid "KH " and resid 176 and name HE22)) (( segid "KH " and resid 176 and name HE21)) 1.300 0.200 0.900 peak 991 spectrum 1 weight 0.10000E+01 volume 0.13581E+00 ppm1 6.785 ppm2 7.407 CV 1 ASSI { 1004} (( segid "KH " and resid 158 and name HN )) (( segid "KH " and resid 105 and name HN )) 3.000 1.200 1.200 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.14324E-02 ppm1 8.239 ppm2 7.578 CV 1 ASSI { 1005} (( segid "KH " and resid 22 and name HE22)) (( segid "KH " and resid 22 and name HE21)) 1.500 0.300 0.700 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.42626E-01 ppm1 6.730 ppm2 7.436 CV 1 ASSI { 1008} (( segid "KH " and resid 158 and name HN )) (( segid "KH " and resid 157 and name HA )) 2.700 0.900 0.900 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.21249E-02 ppm1 8.238 ppm2 5.167 CV 1 ASSI { 1018} (( segid "KH " and resid 22 and name HE21)) (( segid "KH " and resid 22 and name HG2 )) 2.700 0.900 0.900 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.27361E-02 ppm1 7.438 ppm2 2.264 CV 1 ASSI { 1020} (( segid "KH " and resid 22 and name HE21)) (( segid "KH " and resid 22 and name HG3 )) 2.900 1.000 1.000 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.20825E-02 ppm1 7.439 ppm2 2.139 CV 1 ASSI { 1021} (( segid "KH " and resid 22 and name HE22)) (( segid "KH " and resid 22 and name HG3 )) 3.600 1.600 1.600 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.17528E-02 ppm1 6.730 ppm2 2.133 CV 1 ASSI { 1026} (( segid "KH " and resid 158 and name HN )) ( segid "KH " and resid 157 and name HG2%) 2.900 1.000 1.000 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.23209E-02 ppm1 8.239 ppm2 0.800 CV 1 ASSI { 1028} (( segid "KH " and resid 151 and name HE22)) (( segid "KH " and resid 151 and name HE21)) 1.700 0.300 0.500 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.25592E-01 ppm1 6.548 ppm2 7.385 CV 1 ASSI { 1035} (( segid "KH " and resid 151 and name HE21)) (( segid "KH " and resid 151 and name HG2 )) 2.600 0.900 0.900 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.21221E-02 ppm1 7.383 ppm2 2.307 CV 1 ASSI { 1036} (( segid "KH " and resid 151 and name HE22)) (( segid "KH " and resid 151 and name HG2 )) 3.900 1.900 1.900 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.13256E-02 ppm1 6.546 ppm2 2.312 CV 1 ASSI { 1039} (( segid "KH " and resid 151 and name HE21)) (( segid "KH " and resid 151 and name HG3 )) 3.500 1.600 1.600 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.64158E-03 ppm1 7.381 ppm2 1.736 CV 1 ASSI { 1043} (( segid "KH " and resid 131 and name HE22)) (( segid "KH " and resid 131 and name HE21)) 2.400 0.700 0.700 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.34116E-02 ppm1 7.170 ppm2 7.361 CV 1 ASSI { 1049} (( segid "KH " and resid 131 and name HE21)) (( segid "KH " and resid 131 and name HB3 )) 3.300 1.400 1.400 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.12718E-02 ppm1 7.357 ppm2 2.310 CV 1 OR { 1049} (( segid "KH " and resid 131 and name HE21)) (( segid "KH " and resid 131 and name HB2 )) ASSI { 1050} (( segid "KH " and resid 131 and name HE22)) (( segid "KH " and resid 131 and name HB3 )) 3.800 1.800 1.800 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.96837E-03 ppm1 7.168 ppm2 2.310 CV 1 OR { 1050} (( segid "KH " and resid 131 and name HE22)) (( segid "KH " and resid 131 and name HB2 )) ASSI { 1055} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 97 and name HA )) 2.700 0.900 0.900 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.24914E-02 ppm1 8.348 ppm2 4.564 CV 1 ASSI { 1056} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 98 and name HA1 )) 2.600 0.800 0.800 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.44557E-02 ppm1 8.344 ppm2 4.153 CV 1 OR { 1056} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 98 and name HA2 )) ASSI { 1057} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 99 and name HD2 )) 2.800 1.000 1.000 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.19714E-02 ppm1 8.352 ppm2 3.685 CV 1 OR { 1057} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 99 and name HD3 )) ASSI { 1058} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 97 and name HB2 )) 3.400 1.400 1.400 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.87358E-03 ppm1 8.348 ppm2 3.253 CV 1 ASSI { 1060} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 99 and name HG2 )) 4.000 2.000 2.000 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.18490E-02 ppm1 8.344 ppm2 1.964 CV 1 OR { 1060} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 99 and name HG3 )) ASSI { 1062} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HN )) 2.600 0.900 0.900 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.34958E-02 ppm1 7.555 ppm2 8.913 CV 1 ASSI { 1066} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 63 and name HA )) 2.700 0.900 0.900 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.24991E-02 ppm1 7.556 ppm2 4.784 CV 1 ASSI { 1070} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HA )) 2.800 1.000 1.000 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.32305E-02 ppm1 7.555 ppm2 4.047 CV 1 ASSI { 1072} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HB2 )) 2.500 0.800 0.800 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.73425E-02 ppm1 7.555 ppm2 2.116 CV 1 OR { 1072} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HB3 )) ASSI { 1075} (( segid "KH " and resid 63 and name HN )) ( segid "KH " and resid 63 and name HG2%) 2.600 0.800 0.800 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.39782E-02 ppm1 7.556 ppm2 1.208 CV 1 ASSI { 1077} (( segid "KH " and resid 39 and name HN )) (( segid "KH " and resid 38 and name HN )) 2.600 0.800 0.800 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.27042E-02 ppm1 7.917 ppm2 8.182 CV 1 ASSI { 1081} (( segid "KH " and resid 39 and name HN )) (( segid "KH " and resid 39 and name HA1 )) 3.000 1.100 1.100 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.30735E-02 ppm1 7.916 ppm2 4.142 CV 1 ASSI { 1083} (( segid "KH " and resid 39 and name HN )) (( segid "KH " and resid 39 and name HA2 )) 2.600 0.900 0.900 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.27842E-02 ppm1 7.917 ppm2 3.885 CV 1 ASSI { 1085} (( segid "KH " and resid 39 and name HN )) (( segid "KH " and resid 38 and name HB )) 2.800 1.000 1.000 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.23294E-02 ppm1 7.923 ppm2 1.910 CV 1 ASSI { 1088} (( segid "KH " and resid 39 and name HN )) ( segid "KH " and resid 38 and name HG2%) 3.300 1.300 1.300 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.22727E-02 ppm1 7.920 ppm2 1.031 CV 1 ASSI { 1098} (( segid "KH " and resid 80 and name HE21)) (( segid "KH " and resid 80 and name HE22)) 2.800 1.000 1.000 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.11134E-02 ppm1 6.307 ppm2 6.053 CV 1 ASSI { 1113} (( segid "KH " and resid 89 and name HN )) (( segid "KH " and resid 90 and name HN )) 3.100 1.200 1.200 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.13376E-02 ppm1 8.093 ppm2 8.371 CV 1 ASSI { 1117} (( segid "KH " and resid 89 and name HN )) (( segid "KH " and resid 86 and name HA )) 3.200 1.300 1.300 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.11975E-02 ppm1 8.085 ppm2 4.141 CV 1 ASSI { 1118} (( segid "KH " and resid 89 and name HN )) (( segid "KH " and resid 89 and name HA2 )) 2.700 0.900 0.900 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.29773E-02 ppm1 8.095 ppm2 3.858 CV 1 OR { 1118} (( segid "KH " and resid 89 and name HN )) (( segid "KH " and resid 89 and name HA1 )) ASSI { 1146} (( segid "KH " and resid 174 and name HN )) (( segid "KH " and resid 174 and name HB2 )) 2.500 0.800 0.800 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.31060E-02 ppm1 8.180 ppm2 1.940 CV 1 ASSI { 1147} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 150 and name HN )) 2.400 0.700 0.700 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.50951E-02 ppm1 8.383 ppm2 8.612 CV 1 ASSI { 1148} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HG3 )) 2.600 0.900 0.900 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.28330E-02 ppm1 8.385 ppm2 2.235 CV 1 OR { 1148} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HG2 )) ASSI { 1157} (( segid "KH " and resid 28 and name HN )) (( segid "KH " and resid 28 and name HA )) 3.100 1.200 1.200 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.12414E-02 ppm1 8.584 ppm2 4.959 CV 1 ASSI { 1158} (( segid "KH " and resid 55 and name HN )) (( segid "KH " and resid 55 and name HB3 )) 2.600 0.900 0.900 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.36712E-02 ppm1 8.499 ppm2 3.798 CV 1 OR { 1158} (( segid "KH " and resid 55 and name HN )) (( segid "KH " and resid 55 and name HB2 )) ASSI { 1167} (( segid "KH " and resid 12 and name HN )) (( segid "KH " and resid 12 and name HA )) 2.800 1.000 1.000 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.25557E-02 ppm1 8.150 ppm2 4.639 CV 1 ASSI { 1169} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 21 and name HG3 )) 2.400 0.700 0.700 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.54410E-02 ppm1 8.462 ppm2 2.284 CV 1 OR { 1169} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 21 and name HG2 )) ASSI { 1171} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 21 and name HB3 )) 2.500 0.800 0.800 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.66386E-02 ppm1 8.464 ppm2 1.944 CV 1 ASSI { 1179} (( segid "KH " and resid 34 and name HN )) ( segid "KH " and resid 34 and name HG1%) 2.500 0.800 0.800 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.57141E-02 ppm1 7.086 ppm2 0.919 CV 1 ASSI { 1189} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 62 and name HG3 )) 3.300 1.400 1.400 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.16877E-02 ppm1 8.912 ppm2 2.352 CV 1 OR { 1189} (( segid "KH " and resid 62 and name HN )) (( segid "KH " and resid 62 and name HG2 )) ASSI { 1191} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 66 and name HA )) 2.600 0.800 0.800 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.41260E-02 ppm1 7.501 ppm2 4.172 CV 1 ASSI { 1195} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 70 and name HG2 )) 2.800 1.000 1.000 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.16354E-02 ppm1 8.849 ppm2 1.347 CV 1 ASSI { 1200} (( segid "KH " and resid 73 and name HN )) ( segid "KH " and resid 73 and name HD1%) 3.500 1.600 1.600 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.15470E-02 ppm1 9.025 ppm2 0.627 CV 1 ASSI { 1203} (( segid "KH " and resid 82 and name HN )) (( segid "KH " and resid 81 and name HN )) 3.000 1.100 1.100 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.13581E-02 ppm1 7.811 ppm2 7.929 CV 1 ASSI { 1208} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 93 and name HB3 )) 2.400 0.700 0.700 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.41091E-02 ppm1 8.444 ppm2 2.135 CV 1 ASSI { 1213} (( segid "KH " and resid 102 and name HN )) (( segid "KH " and resid 102 and name HA )) 2.600 0.900 0.900 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.36995E-02 ppm1 8.456 ppm2 4.325 CV 1 ASSI { 1232} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 21 and name HA )) 2.600 0.800 0.800 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.42336E-02 ppm1 8.465 ppm2 4.195 CV 1 ASSI { 1233} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 51 and name HA )) 2.900 1.000 1.000 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.21362E-02 ppm1 8.377 ppm2 4.381 CV 1 ASSI { 1234} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 50 and name HB2 )) 2.900 1.100 1.100 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.19969E-02 ppm1 8.379 ppm2 1.871 CV 1 OR { 1234} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 50 and name HB3 )) ASSI { 1235} (( segid "KH " and resid 52 and name HN )) (( segid "KH " and resid 52 and name HA )) 3.200 1.200 1.200 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.13603E-02 ppm1 8.378 ppm2 3.764 CV 1 ASSI { 1254} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 22 and name HB3 )) 3.000 1.200 1.200 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.42909E-02 ppm1 8.138 ppm2 1.842 CV 1 ASSI { 1255} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 32 and name HB3 )) 2.600 0.900 0.900 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.28047E-02 ppm1 9.123 ppm2 2.126 CV 1 ASSI { 1256} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 32 and name HB2 )) 2.900 1.100 1.100 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.26760E-02 ppm1 9.122 ppm2 2.231 CV 1 ASSI { 1257} (( segid "KH " and resid 32 and name HN )) ( segid "KH " and resid 31 and name HB% ) 2.800 1.000 1.000 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.30820E-02 ppm1 9.123 ppm2 1.247 CV 1 ASSI { 1258} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 32 and name HA )) 2.800 1.000 1.000 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.26597E-02 ppm1 9.122 ppm2 4.219 CV 1 ASSI { 1293} (( segid "KH " and resid 149 and name HD21)) (( segid "KH " and resid 149 and name HN )) 2.900 1.100 1.100 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.17034E-02 ppm1 7.861 ppm2 8.384 CV 1 ASSI { 1296} (( segid "KH " and resid 150 and name HN )) (( segid "KH " and resid 149 and name HB3 )) 3.600 1.600 1.600 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.13278E-02 ppm1 8.609 ppm2 2.639 CV 1 ASSI { 1298} (( segid "KH " and resid 150 and name HN )) (( segid "KH " and resid 150 and name HB3 )) 3.200 1.200 1.200 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.41940E-02 ppm1 8.609 ppm2 2.237 CV 1 ASSI { 1299} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 150 and name HN )) 2.600 0.900 0.900 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.33112E-02 ppm1 8.464 ppm2 8.609 CV 1 ASSI { 1301} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 151 and name HG2 )) 3.200 1.300 1.300 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.35290E-02 ppm1 8.464 ppm2 2.309 CV 1 ASSI { 1311} (( segid "KH " and resid 137 and name HN )) (( segid "KH " and resid 137 and name HA )) 2.800 1.000 1.000 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.22954E-02 ppm1 8.541 ppm2 4.394 CV 1 ASSI { 1315} (( segid "KH " and resid 137 and name HN )) (( segid "KH " and resid 137 and name HB3 )) 2.800 1.000 1.000 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.29094E-02 ppm1 8.545 ppm2 1.980 CV 1 ASSI { 1317} (( segid "KH " and resid 136 and name HN )) (( segid "KH " and resid 136 and name HA )) 3.000 1.100 1.100 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.17416E-02 ppm1 8.079 ppm2 4.569 CV 1 ASSI { 1322} (( segid "KH " and resid 131 and name HN )) (( segid "KH " and resid 131 and name HA )) 6.000 6.000 0.000 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.63662E-05 ppm1 8.243 ppm2 4.312 CV 1 ASSI { 1338} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 20 and name HA )) 2.000 0.500 0.500 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.12711E-01 ppm1 8.467 ppm2 4.409 CV 1 ASSI { 1342} (( segid "KH " and resid 25 and name HN )) ( segid "KH " and resid 73 and name HD1%) 4.200 2.200 1.800 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.85236E-03 ppm1 9.092 ppm2 0.580 CV 1 ASSI { 1363} (( segid "KH " and resid 48 and name HN )) (( segid "KH " and resid 48 and name HA )) 2.800 1.000 1.000 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.23831E-02 ppm1 8.319 ppm2 4.118 CV 1 ASSI { 1366} (( segid "KH " and resid 48 and name HN )) (( segid "KH " and resid 48 and name HB3 )) 3.000 1.200 1.200 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.31499E-02 ppm1 8.318 ppm2 1.537 CV 1 ASSI { 1370} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 50 and name HB2 )) 2.600 0.800 0.800 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.36769E-02 ppm1 7.783 ppm2 1.874 CV 1 OR { 1370} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 50 and name HB3 )) ASSI { 1371} (( segid "KH " and resid 51 and name HN )) (( segid "KH " and resid 50 and name HA )) 3.200 1.300 1.300 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.13963E-02 ppm1 8.377 ppm2 4.142 CV 1 ASSI { 1381} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 57 and name HG2 )) 3.400 1.400 1.400 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.12577E-02 ppm1 8.692 ppm2 1.291 CV 1 ASSI { 1383} (( segid "KH " and resid 57 and name HN )) ( segid "KH " and resid 58 and name HG2%) 3.200 1.300 1.300 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.16694E-02 ppm1 8.691 ppm2 0.763 CV 1 ASSI { 1384} (( segid "KH " and resid 58 and name HN )) (( segid "KH " and resid 57 and name HA )) 2.200 0.600 0.600 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.70241E-02 ppm1 8.667 ppm2 4.658 CV 1 ASSI { 1389} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HG2 )) 3.100 1.200 1.200 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.17253E-02 ppm1 7.557 ppm2 2.337 CV 1 OR { 1389} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 62 and name HG3 )) ASSI { 1396} (( segid "KH " and resid 69 and name HN )) (( segid "KH " and resid 69 and name HB3 )) 3.000 1.100 1.100 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.20655E-02 ppm1 9.107 ppm2 1.239 CV 1 ASSI { 1400} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 69 and name HB3 )) 3.200 1.300 1.300 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.16029E-02 ppm1 8.850 ppm2 1.265 CV 1 ASSI { 1409} (( segid "KH " and resid 74 and name HN )) ( segid "KH " and resid 73 and name HG2%) 3.500 1.500 1.500 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.11176E-02 ppm1 9.249 ppm2 0.704 CV 1 ASSI { 1414} (( segid "KH " and resid 78 and name HN )) (( segid "KH " and resid 78 and name HA )) 4.900 3.000 1.100 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.82051E-04 ppm1 9.631 ppm2 4.174 CV 1 ASSI { 1420} (( segid "KH " and resid 82 and name HN )) (( segid "KH " and resid 81 and name HA )) 3.600 1.600 1.600 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.68402E-03 ppm1 7.809 ppm2 4.145 CV 1 ASSI { 1432} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 91 and name HA )) 2.800 0.900 0.900 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.21815E-02 ppm1 7.572 ppm2 4.132 CV 1 ASSI { 1436} (( segid "KH " and resid 92 and name HN )) ( segid "KH " and resid 91 and name HD2%) 4.100 2.100 1.900 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.79652E-03 ppm1 7.641 ppm2 0.597 CV 1 ASSI { 1438} (( segid "KH " and resid 137 and name HN )) (( segid "KH " and resid 136 and name HA )) 2.700 0.900 0.900 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.29172E-02 ppm1 8.543 ppm2 4.570 CV 1 ASSI { 1439} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 92 and name HA )) 3.100 1.200 1.200 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.17316E-02 ppm1 8.447 ppm2 4.308 CV 1 ASSI { 1446} (( segid "KH " and resid 102 and name HN )) (( segid "KH " and resid 102 and name HB3 )) 2.500 0.800 0.800 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.48136E-02 ppm1 8.456 ppm2 1.782 CV 1 ASSI { 1447} (( segid "KH " and resid 102 and name HN )) (( segid "KH " and resid 102 and name HB2 )) 2.900 1.000 1.000 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.44614E-02 ppm1 8.456 ppm2 1.889 CV 1 ASSI { 1455} (( segid "KH " and resid 105 and name HN )) (( segid "KH " and resid 104 and name HA )) 2.900 1.100 1.100 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.15166E-02 ppm1 7.575 ppm2 4.697 CV 1 ASSI { 1459} (( segid "KH " and resid 106 and name HN )) (( segid "KH " and resid 106 and name HA )) 3.000 1.100 1.100 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.14083E-02 ppm1 8.830 ppm2 4.936 CV 1 ASSI { 1464} (( segid "KH " and resid 111 and name HN )) (( segid "KH " and resid 110 and name HB2 )) 3.700 1.700 1.700 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.14826E-02 ppm1 8.879 ppm2 1.677 CV 1 ASSI { 1491} (( segid "KH " and resid 156 and name HN )) (( segid "KH " and resid 107 and name HN )) 3.800 1.800 1.800 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.31973E-03 ppm1 9.570 ppm2 9.345 CV 1 ASSI { 1492} (( segid "KH " and resid 159 and name HN )) (( segid "KH " and resid 158 and name HA1 )) 3.400 1.400 1.400 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.14359E-02 ppm1 8.114 ppm2 4.317 CV 1 ASSI { 1519} (( segid "KH " and resid 178 and name HN )) ( segid "KH " and resid 177 and name HG1%) 3.300 1.300 1.300 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.23605E-02 ppm1 7.893 ppm2 0.947 CV 1 ASSI { 1520} (( segid "KH " and resid 80 and name HE21)) (( segid "KH " and resid 80 and name HB3 )) 3.400 1.400 1.400 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.10384E-02 ppm1 6.307 ppm2 2.205 CV 1 OR { 1520} (( segid "KH " and resid 80 and name HE21)) (( segid "KH " and resid 80 and name HB2 )) ASSI { 1526} (( segid "KH " and resid 128 and name HD21)) (( segid "KH " and resid 128 and name HB2 )) 3.000 1.100 1.100 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.17175E-02 ppm1 7.532 ppm2 2.982 CV 1 ASSI { 1530} (( segid "KH " and resid 82 and name HN )) (( segid "KH " and resid 82 and name HG3 )) 4.200 2.200 1.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.27163E-03 ppm1 7.813 ppm2 1.573 CV 1 ASSI { 1531} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 57 and name HD3 )) 3.500 1.500 1.500 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.15406E-02 ppm1 8.691 ppm2 1.570 CV 1 OR { 1531} (( segid "KH " and resid 57 and name HN )) (( segid "KH " and resid 57 and name HD2 )) ASSI { 1534} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HB3 )) 3.200 1.300 1.300 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.35234E-02 ppm1 8.531 ppm2 1.979 CV 1 ASSI { 1541} (( segid "KH " and resid 117 and name HN )) ( segid "KH " and resid 116 and name HB% ) 2.600 0.900 0.900 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.34795E-02 ppm1 8.430 ppm2 1.188 CV 1 ASSI { 1542} (( segid "KH " and resid 38 and name HN )) (( segid "KH " and resid 38 and name HA )) 3.000 1.200 1.200 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.11990E-02 ppm1 8.189 ppm2 3.909 CV 1 ASSI { 1543} (( segid "KH " and resid 38 and name HN )) (( segid "KH " and resid 38 and name HB )) 2.500 0.800 0.800 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.43248E-02 ppm1 8.187 ppm2 1.910 CV 1 ASSI { 1544} (( segid "KH " and resid 38 and name HN )) ( segid "KH " and resid 38 and name HD1%) 3.100 1.200 1.200 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.21957E-02 ppm1 8.190 ppm2 0.725 CV 1 ASSI { 1549} (( segid "KH " and resid 71 and name HN )) ( segid "KH " and resid 71 and name HG2%) 2.600 0.800 0.800 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.31301E-02 ppm1 9.136 ppm2 0.710 CV 1 ASSI { 1550} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 22 and name HB2 )) 2.700 0.900 0.900 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.30254E-02 ppm1 8.140 ppm2 1.956 CV 1 ASSI { 1551} (( segid "KH " and resid 68 and name HN )) ( segid "KH " and resid 68 and name HG1%) 2.800 1.000 1.000 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.36429E-02 ppm1 7.770 ppm2 0.887 CV 1 ASSI { 1553} (( segid "KH " and resid 105 and name HN )) ( segid "KH " and resid 105 and name HD1%) 3.400 1.400 1.400 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.25394E-02 ppm1 7.576 ppm2 0.939 CV 1 ASSI { 1556} (( segid "KH " and resid 27 and name HN )) ( segid "KH " and resid 27 and name HG2%) 3.100 1.200 1.200 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.15286E-02 ppm1 9.299 ppm2 0.701 CV 1 ASSI { 1557} (( segid "KH " and resid 79 and name HN )) (( segid "KH " and resid 78 and name HB3 )) 3.500 1.500 1.500 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.15123E-02 ppm1 7.043 ppm2 1.998 CV 1 ASSI { 1601} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HG3 )) 3.500 1.500 1.500 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.18809E-02 ppm1 8.529 ppm2 1.389 CV 1 OR { 1601} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HG2 )) ASSI { 1602} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HD3 )) 2.400 0.700 0.700 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.37108E-02 ppm1 8.532 ppm2 1.774 CV 1 OR { 1602} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 100 and name HD2 )) ASSI { 1603} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 100 and name HD2 )) 3.600 1.600 1.600 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.25274E-02 ppm1 7.591 ppm2 1.772 CV 1 OR { 1603} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 100 and name HD3 )) ASSI { 1639} (( segid "KH " and resid 109 and name HN )) ( segid "KH " and resid 109 and name HD1%) 3.700 1.700 1.700 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.15024E-02 ppm1 8.812 ppm2 0.654 CV 1 ASSI { 1648} (( segid "KH " and resid 170 and name HN )) ( segid "KH " and resid 170 and name HD1%) 3.800 1.800 1.800 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.23407E-02 ppm1 8.298 ppm2 0.598 CV 1 ASSI { 1649} (( segid "KH " and resid 170 and name HN )) ( segid "KH " and resid 170 and name HG2%) 2.600 0.900 0.900 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.29129E-02 ppm1 8.298 ppm2 0.673 CV 1 ASSI { 1652} (( segid "KH " and resid 26 and name HN )) ( segid "KH " and resid 25 and name HG1%) 2.900 1.100 1.100 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.24949E-02 ppm1 8.280 ppm2 0.798 CV 1 ASSI { 1653} (( segid "KH " and resid 142 and name HN )) (( segid "KH " and resid 142 and name HB3 )) 2.800 1.000 1.000 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.26519E-02 ppm1 8.302 ppm2 1.779 CV 1 OR { 1653} (( segid "KH " and resid 142 and name HN )) (( segid "KH " and resid 142 and name HB2 )) ASSI { 1657} (( segid "KH " and resid 140 and name HN )) ( segid "KH " and resid 140 and name HG2%) 3.000 1.100 1.100 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.12896E-02 ppm1 8.751 ppm2 0.648 CV 1 ASSI { 1671} (( segid "KH " and resid 131 and name HN )) (( segid "KH " and resid 130 and name HA )) 3.800 1.800 1.800 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.50223E-03 ppm1 8.243 ppm2 4.180 CV 1 ASSI { 1673} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 147 and name HB2 )) 3.000 1.100 1.100 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.21475E-02 ppm1 9.254 ppm2 3.313 CV 1 ASSI { 1674} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 147 and name HB3 )) 2.700 0.900 0.900 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 9.260 ppm2 2.772 CV 1 ASSI { 1675} (( segid "KH " and resid 155 and name HN )) (( segid "KH " and resid 154 and name HB )) 3.600 1.600 1.600 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.90894E-03 ppm1 9.129 ppm2 1.854 CV 1 ASSI { 1676} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 170 and name HG13)) 2.800 1.000 1.000 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.17557E-02 ppm1 8.297 ppm2 0.756 CV 1 OR { 1676} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 170 and name HG12)) ASSI { 1688} (( segid "KH " and resid 113 and name HN )) (( segid "KH " and resid 112 and name HB3 )) 3.600 1.700 1.700 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.18809E-02 ppm1 9.186 ppm2 1.739 CV 1 ASSI { 1693} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 30 and name HB2 )) 3.300 1.400 1.400 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.14444E-02 ppm1 8.417 ppm2 2.525 CV 1 ASSI { 1712} (( segid "KH " and resid 155 and name HN )) ( segid "KH " and resid 154 and name HG1%) 3.400 1.400 1.400 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.18207E-02 ppm1 9.134 ppm2 0.790 CV 1 ASSI { 1713} (( segid "KH " and resid 155 and name HN )) ( segid "KH " and resid 154 and name HG2%) 3.000 1.100 1.100 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.29292E-02 ppm1 9.132 ppm2 0.646 CV 1 ASSI { 1714} (( segid "KH " and resid 155 and name HN )) ( segid "KH " and resid 153 and name HG2%) 3.600 1.700 1.700 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.87149E-03 ppm1 9.132 ppm2 0.499 CV 1 ASSI { 1724} (( segid "KH " and resid 18 and name HN )) (( segid "KH " and resid 17 and name HA )) 2.200 0.600 0.600 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.10045E-01 ppm1 8.009 ppm2 4.591 CV 1 ASSI { 1733} (( segid "KH " and resid 23 and name HN )) (( segid "KH " and resid 23 and name HB3 )) 3.100 1.200 1.200 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.10738E-02 ppm1 7.910 ppm2 2.015 CV 1 OR { 1733} (( segid "KH " and resid 23 and name HN )) (( segid "KH " and resid 23 and name HB2 )) ASSI { 1765} (( segid "KH " and resid 116 and name HN )) ( segid "KH " and resid 115 and name HB% ) 2.900 1.100 1.100 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.33388E-02 ppm1 7.207 ppm2 1.305 CV 1 ASSI { 1766} (( segid "KH " and resid 116 and name HN )) (( segid "KH " and resid 115 and name HN )) 2.300 0.700 0.700 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.55613E-02 ppm1 7.210 ppm2 7.995 CV 1 ASSI { 1767} (( segid "KH " and resid 116 and name HN )) (( segid "KH " and resid 117 and name HN )) 2.700 0.900 0.900 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.26958E-02 ppm1 7.210 ppm2 8.437 CV 1 ASSI { 1768} (( segid "KH " and resid 58 and name HN )) (( segid "KH " and resid 57 and name HB3 )) 3.300 1.300 1.300 peak 1768 spectrum 1 weight 0.10000E+01 volume 0.20280E-02 ppm1 8.666 ppm2 1.607 CV 1 ASSI { 1790} (( segid "KH " and resid 35 and name HN )) ( segid "KH " and resid 34 and name HG2%) 2.900 1.100 1.100 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.19233E-02 ppm1 8.430 ppm2 0.878 CV 1 ASSI { 1791} (( segid "KH " and resid 35 and name HN )) (( segid "KH " and resid 35 and name HA2 )) 2.700 0.900 0.900 peak 1791 spectrum 1 weight 0.10000E+01 volume 0.26201E-02 ppm1 8.432 ppm2 3.679 CV 1 ASSI { 1792} (( segid "KH " and resid 35 and name HN )) (( segid "KH " and resid 35 and name HA1 )) 2.900 1.100 1.100 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.38134E-02 ppm1 8.430 ppm2 3.844 CV 1 ASSI { 1795} (( segid "KH " and resid 35 and name HN )) (( segid "KH " and resid 36 and name HN )) 2.700 0.900 0.900 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.26838E-02 ppm1 8.430 ppm2 7.672 CV 1 ASSI { 1800} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 61 and name HA )) 3.200 1.200 1.200 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.15145E-02 ppm1 7.555 ppm2 4.496 CV 1 ASSI { 1805} (( segid "KH " and resid 39 and name HN )) ( segid "KH " and resid 38 and name HD1%) 3.700 1.700 1.700 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.16475E-02 ppm1 7.920 ppm2 0.747 CV 1 ASSI { 1807} (( segid "KH " and resid 42 and name HN )) ( segid "KH " and resid 38 and name HG2%) 3.300 3.300 2.700 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.15123E-02 ppm1 7.856 ppm2 1.031 CV 1 ASSI { 1820} (( segid "KH " and resid 153 and name HN )) (( segid "KH " and resid 152 and name HB )) 2.700 0.900 0.900 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.17783E-02 ppm1 9.135 ppm2 2.063 CV 1 ASSI { 1828} (( segid "KH " and resid 69 and name HN )) ( segid "KH " and resid 68 and name HG1%) 3.400 1.400 1.400 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.34718E-02 ppm1 9.107 ppm2 0.848 CV 1 ASSI { 1831} (( segid "KH " and resid 87 and name HN )) (( segid "KH " and resid 84 and name HA )) 3.000 1.100 1.100 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.15427E-02 ppm1 7.620 ppm2 3.820 CV 1 ASSI { 1838} (( segid "KH " and resid 90 and name HN )) (( segid "KH " and resid 90 and name HD2 )) 2.800 2.800 3.200 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.24461E-02 ppm1 8.366 ppm2 1.742 CV 1 ASSI { 1842} (( segid "KH " and resid 48 and name HN )) (( segid "KH " and resid 47 and name HB2 )) 3.700 1.700 1.700 peak 1842 spectrum 1 weight 0.10000E+01 volume 0.12754E-02 ppm1 8.319 ppm2 2.197 CV 1 ASSI { 1862} (( segid "KH " and resid 95 and name HN )) (( segid "KH " and resid 94 and name HG3 )) 3.300 1.400 1.400 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.18009E-02 ppm1 7.928 ppm2 2.220 CV 1 OR { 1862} (( segid "KH " and resid 95 and name HN )) (( segid "KH " and resid 94 and name HG2 )) ASSI { 1868} (( segid "KH " and resid 152 and name HN )) ( segid "KH " and resid 113 and name HB% ) 3.400 1.400 1.400 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.14586E-02 ppm1 9.154 ppm2 1.387 CV 1 ASSI { 1883} (( segid "KH " and resid 34 and name HN )) ( segid "KH " and resid 34 and name HG2%) 2.500 0.800 0.800 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.35630E-02 ppm1 7.088 ppm2 0.855 CV 1 ASSI { 1885} (( segid "KH " and resid 34 and name HN )) (( segid "KH " and resid 34 and name HB )) 2.900 1.100 1.100 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.50711E-02 ppm1 7.085 ppm2 1.955 CV 1 ASSI { 1893} (( segid "KH " and resid 150 and name HN )) (( segid "KH " and resid 151 and name HG3 )) 3.200 1.300 1.300 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.13921E-02 ppm1 8.610 ppm2 1.775 CV 1 ASSI { 1894} (( segid "KH " and resid 176 and name HN )) (( segid "KH " and resid 175 and name HN )) 2.900 1.000 1.000 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.17755E-02 ppm1 7.675 ppm2 7.919 CV 1 ASSI { 1899} (( segid "KH " and resid 53 and name HN )) ( segid "KH " and resid 52 and name HB% ) 3.300 1.400 1.400 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.17557E-02 ppm1 7.893 ppm2 1.386 CV 1 ASSI { 1909} (( segid "KH " and resid 154 and name HN )) (( segid "KH " and resid 153 and name HA )) 2.800 1.000 1.000 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.18236E-02 ppm1 8.615 ppm2 4.688 CV 1 ASSI { 1913} (( segid "KH " and resid 154 and name HN )) ( segid "KH " and resid 154 and name HG1%) 2.900 1.100 1.100 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.22954E-02 ppm1 8.612 ppm2 0.791 CV 1 ASSI { 1914} (( segid "KH " and resid 154 and name HN )) ( segid "KH " and resid 154 and name HG2%) 2.800 1.000 1.000 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.25317E-02 ppm1 8.615 ppm2 0.667 CV 1 ASSI { 1915} (( segid "KH " and resid 154 and name HN )) ( segid "KH " and resid 153 and name HG2%) 2.800 1.000 1.000 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.24949E-02 ppm1 8.612 ppm2 0.497 CV 1 ASSI { 1919} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HD3 )) 3.800 1.800 1.800 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.12159E-02 ppm1 8.536 ppm2 3.601 CV 1 ASSI { 1922} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HG3 )) 4.000 2.000 2.000 peak 1922 spectrum 1 weight 0.10000E+01 volume 0.15611E-02 ppm1 8.536 ppm2 1.625 CV 1 OR { 1922} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HG2 )) ASSI { 1923} (( segid "KH " and resid 147 and name HN )) ( segid "KH " and resid 152 and name HG1%) 3.400 1.500 1.500 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.15505E-02 ppm1 8.537 ppm2 0.680 CV 1 ASSI { 1938} (( segid "KH " and resid 177 and name HN )) (( segid "KH " and resid 178 and name HN )) 2.400 0.700 0.700 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.41544E-02 ppm1 7.758 ppm2 7.896 CV 1 ASSI { 1945} (( segid "KH " and resid 171 and name HN )) (( segid "KH " and resid 168 and name HA )) 2.800 1.000 1.000 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.24375E-02 ppm1 7.930 ppm2 4.114 CV 1 ASSI { 1947} (( segid "KH " and resid 145 and name HN )) (( segid "KH " and resid 144 and name HB3 )) 4.600 2.600 1.400 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.29002E-03 ppm1 8.769 ppm2 1.937 CV 1 OR { 1947} (( segid "KH " and resid 145 and name HN )) (( segid "KH " and resid 144 and name HB2 )) ASSI { 1969} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 68 and name HA )) 3.800 1.800 1.800 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.88352E-03 ppm1 8.833 ppm2 5.173 CV 1 ASSI { 1972} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 90 and name HD2 )) 2.900 1.000 1.000 peak 1972 spectrum 1 weight 0.10000E+01 volume 0.15809E-02 ppm1 7.571 ppm2 1.729 CV 1 ASSI { 1980} (( segid "KH " and resid 111 and name HN )) (( segid "KH " and resid 152 and name HN )) 2.900 1.100 1.100 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.19007E-02 ppm1 8.878 ppm2 9.161 CV 1 ASSI { 1982} (( segid "KH " and resid 68 and name HN )) (( segid "KH " and resid 65 and name HA )) 3.400 1.400 1.400 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.13015E-02 ppm1 7.773 ppm2 4.659 CV 1 ASSI { 1984} (( segid "KH " and resid 68 and name HN )) (( segid "KH " and resid 66 and name HB3 )) 2.600 2.600 3.400 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.18321E-02 ppm1 7.774 ppm2 4.024 CV 1 ASSI { 1985} (( segid "KH " and resid 68 and name HN )) ( segid "KH " and resid 31 and name HB% ) 3.300 1.300 1.300 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.15888E-02 ppm1 7.770 ppm2 1.258 CV 1 ASSI { 1986} (( segid "KH " and resid 68 and name HN )) (( segid "KH " and resid 68 and name HB )) 3.400 1.400 1.400 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.19743E-02 ppm1 7.769 ppm2 2.088 CV 1 ASSI { 1994} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 86 and name HN )) 3.100 1.200 1.200 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.20450E-02 ppm1 7.983 ppm2 7.424 CV 1 ASSI { 1996} (( segid "KH " and resid 88 and name HN )) (( segid "KH " and resid 90 and name HD2 )) 3.200 3.200 2.800 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.12853E-02 ppm1 7.984 ppm2 1.719 CV 1 ASSI { 2008} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 147 and name HA )) 2.900 1.100 1.100 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.19177E-02 ppm1 9.254 ppm2 4.569 CV 1 ASSI { 2009} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 148 and name HG2 )) 2.900 1.000 1.000 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.19459E-02 ppm1 9.258 ppm2 2.222 CV 1 OR { 2009} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 148 and name HG3 )) ASSI { 2010} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 148 and name HB3 )) 2.600 0.900 0.900 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.34392E-02 ppm1 9.260 ppm2 2.042 CV 1 OR { 2010} (( segid "KH " and resid 148 and name HN )) (( segid "KH " and resid 148 and name HB2 )) ASSI { 2039} (( segid "KH " and resid 97 and name HN )) ( segid "KH " and resid 97 and name HD% ) 2.700 0.900 0.900 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.25515E-02 ppm1 8.338 ppm2 7.315 CV 1 ASSI { 2043} (( segid "KH " and resid 98 and name HN )) (( segid "KH " and resid 99 and name HB2 )) 3.500 1.600 1.600 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.14402E-02 ppm1 8.350 ppm2 2.316 CV 1 ASSI { 2050} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 64 and name HB2 )) 2.800 0.900 0.900 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.21419E-02 ppm1 8.011 ppm2 2.368 CV 1 ASSI { 2064} (( segid "KH " and resid 165 and name HN )) (( segid "KH " and resid 164 and name HG2 )) 2.800 1.000 1.000 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.40631E-02 ppm1 8.121 ppm2 1.899 CV 1 OR { 2064} (( segid "KH " and resid 165 and name HN )) (( segid "KH " and resid 164 and name HG3 )) ASSI { 2075} (( segid "KH " and resid 38 and name HN )) ( segid "KH " and resid 38 and name HG2%) 3.800 1.800 1.800 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.17641E-02 ppm1 8.188 ppm2 1.036 CV 1 ASSI { 2083} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 169 and name HB2 )) 2.800 1.000 1.000 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.19714E-02 ppm1 8.297 ppm2 1.850 CV 1 OR { 2083} (( segid "KH " and resid 170 and name HN )) (( segid "KH " and resid 169 and name HB3 )) ASSI { 2086} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 48 and name HN )) 2.900 1.100 1.100 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.15852E-02 ppm1 8.151 ppm2 8.318 CV 1 ASSI { 2090} (( segid "KH " and resid 172 and name HN )) (( segid "KH " and resid 171 and name HB3 )) 3.000 1.100 1.100 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.15024E-02 ppm1 8.023 ppm2 2.086 CV 1 OR { 2090} (( segid "KH " and resid 172 and name HN )) (( segid "KH " and resid 171 and name HB2 )) ASSI { 2116} (( segid "KH " and resid 128 and name HD22)) (( segid "KH " and resid 128 and name HD21)) 1.700 0.400 0.500 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.24461E-01 ppm1 6.869 ppm2 7.538 CV 1 ASSI { 2119} (( segid "KH " and resid 160 and name HN )) (( segid "KH " and resid 159 and name HA )) 3.100 1.200 1.200 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.13397E-02 ppm1 8.826 ppm2 5.610 CV 1 ASSI { 2125} (( segid "KH " and resid 121 and name HN )) (( segid "KH " and resid 121 and name HA1 )) 2.500 0.800 0.800 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.37448E-02 ppm1 8.067 ppm2 4.131 CV 1 ASSI { 2126} (( segid "KH " and resid 121 and name HN )) (( segid "KH " and resid 121 and name HA2 )) 3.400 1.400 1.400 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.14784E-02 ppm1 8.067 ppm2 4.030 CV 1 ASSI { 2128} (( segid "KH " and resid 121 and name HN )) (( segid "KH " and resid 120 and name HB )) 3.400 1.500 1.500 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.20252E-02 ppm1 8.065 ppm2 1.783 CV 1 ASSI { 2129} (( segid "KH " and resid 121 and name HN )) ( segid "KH " and resid 119 and name HG1%) 2.700 2.700 3.300 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.15308E-02 ppm1 8.065 ppm2 0.721 CV 1 ASSI { 2135} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 116 and name HA )) 2.900 1.100 1.100 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.18576E-02 ppm1 7.191 ppm2 3.338 CV 1 ASSI { 2136} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 119 and name HB )) 2.700 0.900 0.900 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.27927E-02 ppm1 7.194 ppm2 1.926 CV 1 ASSI { 2137} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 118 and name HB3 )) 3.000 1.100 1.100 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.17097E-02 ppm1 7.193 ppm2 1.787 CV 1 OR { 2137} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 118 and name HB2 )) ASSI { 2138} (( segid "KH " and resid 119 and name HN )) ( segid "KH " and resid 119 and name HG1%) 2.500 0.800 0.800 peak 2138 spectrum 1 weight 0.10000E+01 volume 0.55690E-02 ppm1 7.193 ppm2 0.718 CV 1 ASSI { 2142} (( segid "KH " and resid 136 and name HN )) (( segid "KH " and resid 134 and name HB )) 2.800 1.000 1.000 peak 2142 spectrum 1 weight 0.10000E+01 volume 0.23662E-02 ppm1 8.079 ppm2 4.104 CV 1 ASSI { 2155} (( segid "KH " and resid 140 and name HN )) ( segid "KH " and resid 139 and name HG2%) 3.200 1.300 1.300 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.14586E-02 ppm1 8.751 ppm2 0.963 CV 1 OR { 2155} (( segid "KH " and resid 140 and name HN )) ( segid "KH " and resid 139 and name HG1%) ASSI { 2231} (( segid "KH " and resid 117 and name HN )) ( segid "KH " and resid 154 and name HG1%) 3.400 3.400 2.600 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.15788E-02 ppm1 8.430 ppm2 0.787 CV 1 ASSI { 2237} (( segid "KH " and resid 115 and name HN )) ( segid "KH " and resid 115 and name HB% ) 2.500 0.800 0.800 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.42279E-02 ppm1 7.998 ppm2 1.307 CV 1 ASSI { 2259} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 32 and name HG3 )) 3.800 1.800 1.800 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.14685E-02 ppm1 9.122 ppm2 2.404 CV 1 ASSI { 2260} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 32 and name HG2 )) 3.600 1.600 1.600 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.14183E-02 ppm1 9.123 ppm2 2.586 CV 1 ASSI { 2262} (( segid "KH " and resid 32 and name HN )) ( segid "KH " and resid 33 and name HB% ) 3.900 1.900 1.900 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.13100E-02 ppm1 9.122 ppm2 0.566 CV 1 ASSI { 2265} (( segid "KH " and resid 32 and name HN )) (( segid "KH " and resid 33 and name HN )) 2.700 0.900 0.900 peak 2265 spectrum 1 weight 0.10000E+01 volume 0.23860E-02 ppm1 9.123 ppm2 7.667 CV 1 ASSI { 2303} (( segid "KH " and resid 153 and name HN )) ( segid "KH " and resid 152 and name HG1%) 3.700 1.700 1.700 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.15123E-02 ppm1 9.136 ppm2 0.681 CV 1 ASSI { 2304} (( segid "KH " and resid 153 and name HN )) ( segid "KH " and resid 152 and name HG2%) 3.100 1.200 1.200 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.19941E-02 ppm1 9.137 ppm2 0.587 CV 1 ASSI { 2309} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 99 and name HD2 )) 2.900 1.000 1.000 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.20995E-02 ppm1 8.532 ppm2 3.689 CV 1 OR { 2309} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 99 and name HD3 )) ASSI { 2324} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 94 and name HB3 )) 3.900 1.900 1.900 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.11134E-02 ppm1 8.444 ppm2 1.762 CV 1 ASSI { 2329} (( segid "KH " and resid 105 and name HN )) (( segid "KH " and resid 104 and name HN )) 3.300 1.400 1.400 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.17416E-02 ppm1 7.576 ppm2 7.107 CV 1 ASSI { 2336} (( segid "KH " and resid 66 and name HN )) (( segid "KH " and resid 65 and name HN )) 2.600 0.900 0.900 peak 2336 spectrum 1 weight 0.10000E+01 volume 0.36542E-02 ppm1 7.502 ppm2 8.008 CV 1 ASSI { 2345} (( segid "KH " and resid 158 and name HN )) (( segid "KH " and resid 136 and name HA )) 3.500 1.500 1.500 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 8.240 ppm2 4.586 CV 1 ASSI { 2352} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 142 and name HB2 )) 3.000 1.100 1.100 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.22183E-02 ppm1 8.904 ppm2 1.792 CV 1 OR { 2352} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 142 and name HB3 )) ASSI { 2353} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 142 and name HG3 )) 2.800 1.000 1.000 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.34152E-02 ppm1 8.904 ppm2 1.736 CV 1 OR { 2353} (( segid "KH " and resid 143 and name HN )) (( segid "KH " and resid 142 and name HG2 )) ASSI { 2356} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 88 and name HA )) 3.000 1.100 1.100 peak 2356 spectrum 1 weight 0.10000E+01 volume 0.17253E-02 ppm1 7.572 ppm2 3.846 CV 1 ASSI { 2385} (( segid "KH " and resid 85 and name HN )) (( segid "KH " and resid 85 and name HA1 )) 3.400 1.400 1.400 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.13737E-02 ppm1 7.985 ppm2 3.225 CV 1 ASSI { 2391} (( segid "KH " and resid 121 and name HN )) (( segid "KH " and resid 120 and name HA )) 3.100 1.200 1.200 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.16093E-02 ppm1 8.065 ppm2 3.827 CV 1 ASSI { 2421} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HB3 )) 3.300 1.400 1.400 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.21475E-02 ppm1 8.537 ppm2 1.972 CV 1 OR { 2421} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 146 and name HB2 )) ASSI { 2426} (( segid "KH " and resid 21 and name HN )) (( segid "KH " and resid 22 and name HN )) 2.800 1.000 1.000 peak 2426 spectrum 1 weight 0.10000E+01 volume 0.24751E-02 ppm1 8.467 ppm2 8.152 CV 1 ASSI { 2460} (( segid "KH " and resid 172 and name HN )) (( segid "KH " and resid 171 and name HG3 )) 3.200 1.300 1.300 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.13100E-02 ppm1 8.024 ppm2 1.896 CV 1 ASSI { 2466} (( segid "KH " and resid 43 and name HN )) (( segid "KH " and resid 43 and name HA )) 3.000 1.100 1.100 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.18038E-02 ppm1 8.279 ppm2 4.132 CV 1 ASSI { 2469} (( segid "KH " and resid 43 and name HN )) (( segid "KH " and resid 43 and name HB2 )) 3.000 1.100 1.100 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.18950E-02 ppm1 8.280 ppm2 2.259 CV 1 ASSI { 2470} (( segid "KH " and resid 43 and name HN )) (( segid "KH " and resid 43 and name HB3 )) 3.100 1.200 1.200 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.25635E-02 ppm1 8.281 ppm2 2.124 CV 1 ASSI { 2479} (( segid "KH " and resid 36 and name HN )) ( segid "KH " and resid 37 and name HD1%) 3.700 1.700 1.700 peak 2479 spectrum 1 weight 0.10000E+01 volume 0.14847E-02 ppm1 7.673 ppm2 0.612 CV 1 ASSI { 2484} (( segid "KH " and resid 136 and name HN )) (( segid "KH " and resid 137 and name HA )) 3.500 3.500 2.500 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.89765E-03 ppm1 8.078 ppm2 4.394 CV 1 ASSI { 2490} (( segid "KH " and resid 147 and name HN )) (( segid "KH " and resid 148 and name HN )) 3.900 1.900 1.900 peak 2490 spectrum 1 weight 0.10000E+01 volume 0.82335E-03 ppm1 8.536 ppm2 9.260 CV 1 ASSI { 2517} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 120 and name HN )) 2.700 0.900 0.900 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.21475E-02 ppm1 7.194 ppm2 6.523 CV 1 ASSI { 2518} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 118 and name HN )) 2.600 0.800 0.800 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.31867E-02 ppm1 7.194 ppm2 7.359 CV 1 ASSI { 2532} (( segid "KH " and resid 49 and name HN )) (( segid "KH " and resid 50 and name HN )) 3.200 1.300 1.300 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.10313E-02 ppm1 8.147 ppm2 7.806 CV 1 ASSI { 2560} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 117 and name HN )) 2.700 0.900 0.900 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.23492E-02 ppm1 7.359 ppm2 8.438 CV 1 ASSI { 2562} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 117 and name HA1 )) 3.200 1.300 1.300 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.18809E-02 ppm1 7.356 ppm2 3.999 CV 1 ASSI { 2564} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 118 and name HB2 )) 2.600 0.800 0.800 peak 2564 spectrum 1 weight 0.10000E+01 volume 0.32263E-02 ppm1 7.357 ppm2 1.773 CV 1 OR { 2564} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 118 and name HB3 )) ASSI { 2565} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 118 and name HG2 )) 3.100 1.200 1.200 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.37794E-02 ppm1 7.359 ppm2 1.667 CV 1 OR { 2565} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 118 and name HG3 )) ASSI { 2567} (( segid "KH " and resid 118 and name HN )) ( segid "KH " and resid 119 and name HG1%) 3.500 1.500 1.500 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.20139E-02 ppm1 7.356 ppm2 0.732 CV 1 ASSI { 2569} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 175 and name HA )) 2.700 2.700 3.300 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.48023E-02 ppm1 7.966 ppm2 4.159 CV 1 ASSI { 2576} (( segid "KH " and resid 25 and name HN )) (( segid "KH " and resid 73 and name HA )) 3.800 1.800 1.800 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.63662E-03 ppm1 9.089 ppm2 4.983 CV 1 ASSI { 2577} (( segid "KH " and resid 25 and name HN )) ( segid "KH " and resid 73 and name HG2%) 5.700 4.100 0.300 peak 2577 spectrum 1 weight 0.10000E+01 volume 0.66492E-04 ppm1 9.090 ppm2 0.691 CV 1 ASSI { 2579} (( segid "KH " and resid 25 and name HN )) (( segid "KH " and resid 73 and name HB )) 3.600 1.700 1.700 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.40744E-03 ppm1 9.090 ppm2 2.029 CV 1 ASSI { 2580} (( segid "KH " and resid 25 and name HN )) (( segid "KH " and resid 23 and name HG2 )) 4.600 2.600 1.400 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.22282E-03 ppm1 9.090 ppm2 2.223 CV 1 OR { 2580} (( segid "KH " and resid 25 and name HN )) (( segid "KH " and resid 23 and name HG3 )) ASSI { 2584} (( segid "KH " and resid 84 and name HN )) (( segid "KH " and resid 83 and name HN )) 3.000 1.100 1.100 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.14968E-02 ppm1 8.851 ppm2 8.876 CV 1 ASSI { 2606} (( segid "KH " and resid 71 and name HN )) (( segid "KH " and resid 73 and name HN )) 3.400 3.400 2.600 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.17953E-02 ppm1 9.133 ppm2 9.050 CV 1 ASSI { 2613} (( segid "KH " and resid 70 and name HN )) (( segid "KH " and resid 71 and name HA )) 3.100 3.100 2.900 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.16093E-02 ppm1 8.849 ppm2 4.304 CV 1 ASSI { 2616} (( segid "KH " and resid 156 and name HN )) (( segid "KH " and resid 156 and name HA )) 3.100 1.200 1.200 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.10208E-02 ppm1 9.568 ppm2 5.015 CV 1 ASSI { 2618} (( segid "KH " and resid 18 and name HN )) (( segid "KH " and resid 18 and name HA )) 2.700 0.900 0.900 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.27884E-02 ppm1 8.009 ppm2 4.712 CV 1 ASSI { 2619} (( segid "KH " and resid 18 and name HN )) (( segid "KH " and resid 18 and name HG3 )) 3.400 1.500 1.500 peak 2619 spectrum 1 weight 0.10000E+01 volume 0.18632E-02 ppm1 8.010 ppm2 2.416 CV 1 OR { 2619} (( segid "KH " and resid 18 and name HN )) (( segid "KH " and resid 18 and name HG2 )) ASSI { 2621} (( segid "KH " and resid 79 and name HN )) (( segid "KH " and resid 80 and name HB3 )) 4.000 2.000 2.000 peak 2621 spectrum 1 weight 0.10000E+01 volume 0.10695E-02 ppm1 7.036 ppm2 2.200 CV 1 OR { 2621} (( segid "KH " and resid 79 and name HN )) (( segid "KH " and resid 80 and name HB2 )) ASSI { 2630} (( segid "KH " and resid 115 and name HN )) ( segid "KH " and resid 116 and name HB% ) 3.600 1.600 1.600 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.26038E-02 ppm1 8.000 ppm2 1.208 CV 1 ASSI { 2642} (( segid "KH " and resid 93 and name HN )) (( segid "KH " and resid 160 and name HB2 )) 2.500 2.500 3.500 peak 2642 spectrum 1 weight 0.10000E+01 volume 0.26038E-02 ppm1 8.446 ppm2 2.417 CV 1 ASSI { 2644} (( segid "KH " and resid 147 and name HN )) ( segid "KH " and resid 113 and name HB% ) 3.900 1.900 1.900 peak 2644 spectrum 1 weight 0.10000E+01 volume 0.11516E-02 ppm1 8.536 ppm2 1.393 CV 1 ASSI { 2648} (( segid "KH " and resid 47 and name HN )) ( segid "KH " and resid 45 and name HG2%) 3.300 1.400 1.400 peak 2648 spectrum 1 weight 0.10000E+01 volume 0.34597E-02 ppm1 7.869 ppm2 1.016 CV 1 ASSI { 2649} (( segid "KH " and resid 118 and name HN )) (( segid "KH " and resid 117 and name HA2 )) 2.900 1.100 1.100 peak 2649 spectrum 1 weight 0.10000E+01 volume 0.19941E-02 ppm1 7.357 ppm2 3.781 CV 1 ASSI { 2667} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 99 and name HA )) 2.600 2.600 3.400 peak 2667 spectrum 1 weight 0.10000E+01 volume 0.56497E-02 ppm1 8.532 ppm2 4.356 CV 1 ASSI { 2669} (( segid "KH " and resid 100 and name HN )) (( segid "KH " and resid 99 and name HB2 )) 2.700 0.900 0.900 peak 2669 spectrum 1 weight 0.10000E+01 volume 0.13723E-02 ppm1 8.531 ppm2 2.329 CV 1 ASSI { 2671} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 100 and name HN )) 2.400 0.700 0.700 peak 2671 spectrum 1 weight 0.10000E+01 volume 0.47966E-02 ppm1 7.589 ppm2 8.526 CV 1 ASSI { 2672} (( segid "KH " and resid 101 and name HN )) (( segid "KH " and resid 102 and name HN )) 3.200 1.300 1.300 peak 2672 spectrum 1 weight 0.10000E+01 volume 0.21278E-02 ppm1 7.589 ppm2 8.466 CV 1 ASSI { 2673} (( segid "KH " and resid 105 and name HN )) ( segid "KH " and resid 157 and name HG2%) 3.100 1.200 1.200 peak 2673 spectrum 1 weight 0.10000E+01 volume 0.12959E-02 ppm1 7.576 ppm2 0.789 CV 1 ASSI { 2676} (( segid "KH " and resid 149 and name HD22)) (( segid "KH " and resid 149 and name HN )) 3.500 1.600 1.600 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.15243E-02 ppm1 6.857 ppm2 8.379 CV 1 ASSI { 2677} (( segid "KH " and resid 119 and name HN )) (( segid "KH " and resid 117 and name HA1 )) 3.200 1.300 1.300 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.18689E-02 ppm1 7.191 ppm2 4.002 CV 1 ASSI { 2682} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 64 and name HD2 )) 2.800 1.000 1.000 peak 2682 spectrum 1 weight 0.10000E+01 volume 0.18094E-02 ppm1 8.012 ppm2 3.818 CV 1 ASSI { 2683} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 64 and name HD3 )) 3.600 1.600 1.600 peak 2683 spectrum 1 weight 0.10000E+01 volume 0.16234E-02 ppm1 8.012 ppm2 3.736 CV 1 ASSI { 2684} (( segid "KH " and resid 65 and name HN )) (( segid "KH " and resid 64 and name HB3 )) 3.500 1.600 1.600 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 8.012 ppm2 1.909 CV 1 ASSI { 2685} (( segid "KH " and resid 65 and name HN )) ( segid "KH " and resid 63 and name HG2%) 2.600 2.600 3.400 peak 2685 spectrum 1 weight 0.10000E+01 volume 0.18434E-02 ppm1 8.011 ppm2 1.210 CV 1 ASSI { 2687} (( segid "KH " and resid 34 and name HN )) (( segid "KH " and resid 32 and name HA )) 3.100 3.100 2.900 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.16248E-02 ppm1 7.083 ppm2 4.233 CV 1 ASSI { 2697} (( segid "KH " and resid 120 and name HN )) (( segid "KH " and resid 119 and name HA )) 3.100 1.200 1.200 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 6.527 ppm2 3.356 CV 1 ASSI { 2698} (( segid "KH " and resid 120 and name HN )) (( segid "KH " and resid 120 and name HB )) 3.000 1.100 1.100 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.13822E-02 ppm1 6.533 ppm2 1.775 CV 1 ASSI { 2700} (( segid "KH " and resid 120 and name HN )) ( segid "KH " and resid 119 and name HG1%) 3.100 1.200 1.200 peak 2700 spectrum 1 weight 0.10000E+01 volume 0.11558E-02 ppm1 6.531 ppm2 0.716 CV 1 ASSI { 2701} (( segid "KH " and resid 152 and name HN )) (( segid "KH " and resid 151 and name HG2 )) 3.700 1.700 1.700 peak 2701 spectrum 1 weight 0.10000E+01 volume 0.12994E-02 ppm1 9.154 ppm2 2.283 CV 1 ASSI { 2702} (( segid "KH " and resid 111 and name HN )) ( segid "KH " and resid 152 and name HG2%) 3.200 1.300 1.300 peak 2702 spectrum 1 weight 0.10000E+01 volume 0.13999E-02 ppm1 8.881 ppm2 0.581 CV 1 ASSI { 2703} (( segid "KH " and resid 31 and name HN )) (( segid "KH " and resid 32 and name HN )) 2.800 1.000 1.000 peak 2703 spectrum 1 weight 0.10000E+01 volume 0.21023E-02 ppm1 8.418 ppm2 9.116 CV 1 ASSI { 2704} (( segid "KH " and resid 136 and name HN )) (( segid "KH " and resid 135 and name HN )) 2.600 0.900 0.900 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.28726E-02 ppm1 8.079 ppm2 8.193 CV 1 ASSI { 2705} (( segid "KH " and resid 136 and name HN )) ( segid "KH " and resid 134 and name HG2%) 3.300 1.300 1.300 peak 2705 spectrum 1 weight 0.10000E+01 volume 0.18066E-02 ppm1 8.078 ppm2 1.087 CV 1 ASSI { 2707} (( segid "KH " and resid 22 and name HN )) (( segid "KH " and resid 22 and name HG3 )) 2.900 1.000 1.000 peak 2707 spectrum 1 weight 0.10000E+01 volume 0.20421E-02 ppm1 8.136 ppm2 2.138 CV 1 ASSI { 2710} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 91 and name HN )) 2.300 0.700 0.700 peak 2710 spectrum 1 weight 0.10000E+01 volume 0.62687E-02 ppm1 7.639 ppm2 7.596 CV 1 ASSI { 2711} (( segid "KH " and resid 92 and name HN )) (( segid "KH " and resid 91 and name HB2 )) 2.700 0.900 0.900 peak 2711 spectrum 1 weight 0.10000E+01 volume 0.20768E-02 ppm1 7.640 ppm2 2.124 CV 1 ASSI { 2712} (( segid "KH " and resid 159 and name HN )) (( segid "KH " and resid 158 and name HA2 )) 2.600 0.900 0.900 peak 2712 spectrum 1 weight 0.10000E+01 volume 0.26074E-02 ppm1 8.111 ppm2 3.949 CV 1 ASSI { 2716} (( segid "KH " and resid 45 and name HN )) (( segid "KH " and resid 44 and name HN )) 2.600 0.900 0.900 peak 2716 spectrum 1 weight 0.10000E+01 volume 0.27000E-02 ppm1 7.838 ppm2 7.917 CV 1 ASSI { 2717} (( segid "KH " and resid 45 and name HN )) ( segid "KH " and resid 37 and name HD1%) 3.700 1.700 1.700 peak 2717 spectrum 1 weight 0.10000E+01 volume 0.14346E-02 ppm1 7.837 ppm2 0.604 CV 1 ASSI { 2719} (( segid "KH " and resid 179 and name HN )) (( segid "KH " and resid 176 and name HA )) 2.600 0.900 0.900 peak 2719 spectrum 1 weight 0.10000E+01 volume 0.38587E-02 ppm1 7.970 ppm2 4.122 CV 1 ASSI { 2725} (( segid "KH " and resid 171 and name HN )) (( segid "KH " and resid 172 and name HN )) 2.900 1.100 1.100 peak 2725 spectrum 1 weight 0.10000E+01 volume 0.16354E-02 ppm1 7.929 ppm2 8.000 CV 1 ASSI { 2727} (( segid "KH " and resid 171 and name HN )) (( segid "KH " and resid 171 and name HB3 )) 2.700 0.900 0.900 peak 2727 spectrum 1 weight 0.10000E+01 volume 0.26880E-02 ppm1 7.933 ppm2 2.138 CV 1 OR { 2727} (( segid "KH " and resid 171 and name HN )) (( segid "KH " and resid 171 and name HB2 )) ASSI { 2728} (( segid "KH " and resid 171 and name HN )) (( segid "KH " and resid 171 and name HG3 )) 3.500 1.500 1.500 peak 2728 spectrum 1 weight 0.10000E+01 volume 0.23463E-02 ppm1 7.930 ppm2 1.870 CV 1 ASSI { 2730} (( segid "KH " and resid 174 and name HN )) (( segid "KH " and resid 170 and name HB )) 3.200 3.200 2.800 peak 2730 spectrum 1 weight 0.10000E+01 volume 0.17896E-02 ppm1 8.180 ppm2 1.743 CV 1 ASSI { 2733} (( segid "KH " and resid 29 and name HN )) (( segid "KH " and resid 29 and name HB )) 3.300 1.400 1.400 peak 2733 spectrum 1 weight 0.10000E+01 volume 0.16595E-02 ppm1 8.833 ppm2 1.539 CV 1 ASSI { 2737} (( segid "KH " and resid 128 and name HD21)) (( segid "KH " and resid 128 and name HB3 )) 2.800 1.000 1.000 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.18781E-02 ppm1 7.532 ppm2 2.854 CV 1 ASSI { 2738} (( segid "KH " and resid 128 and name HD22)) (( segid "KH " and resid 128 and name HB3 )) 3.700 1.700 1.700 peak 2738 spectrum 1 weight 0.10000E+01 volume 0.18632E-02 ppm1 6.866 ppm2 2.858 CV 1 ASSI { 2753} (( segid "KH " and resid 165 and name HN )) ( segid "KH " and resid 156 and name HD1%) 3.200 3.200 2.800 peak 2753 spectrum 1 weight 0.10000E+01 volume 0.30254E-02 ppm1 8.116 ppm2 0.681 CV 1 ASSI { 2754} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 96 and name HA )) 3.100 1.200 1.200 peak 2754 spectrum 1 weight 0.10000E+01 volume 0.18434E-02 ppm1 8.337 ppm2 4.146 CV 1 ASSI { 2755} (( segid "KH " and resid 97 and name HN )) (( segid "KH " and resid 92 and name HA )) 3.100 1.200 1.200 peak 2755 spectrum 1 weight 0.10000E+01 volume 0.13963E-02 ppm1 8.337 ppm2 4.309 CV 1 ASSI { 2756} (( segid "KH " and resid 22 and name HE22)) (( segid "KH " and resid 22 and name HG2 )) 3.400 1.500 1.500 peak 2756 spectrum 1 weight 0.10000E+01 volume 0.23576E-02 ppm1 6.729 ppm2 2.264 CV 1 ASSI { 2758} (( segid "KH " and resid 22 and name HE22)) ( segid "KH " and resid 74 and name HG2%) 3.400 3.400 2.600 peak 2758 spectrum 1 weight 0.10000E+01 volume 0.14784E-02 ppm1 6.733 ppm2 1.099 CV 1 ASSI { 2760} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 64 and name HD2 )) 4.000 2.000 2.000 peak 2760 spectrum 1 weight 0.10000E+01 volume 0.17783E-02 ppm1 7.555 ppm2 3.824 CV 1 ASSI { 2761} (( segid "KH " and resid 63 and name HN )) (( segid "KH " and resid 66 and name HB2 )) 3.000 3.000 3.000 peak 2761 spectrum 1 weight 0.10000E+01 volume 0.23294E-02 ppm1 7.555 ppm2 4.113 CV 1 ASSI { 2762} (( segid "KH " and resid 121 and name HN )) (( segid "KH " and resid 120 and name HN )) 3.000 1.100 1.100 peak 2762 spectrum 1 weight 0.10000E+01 volume 0.12591E-02 ppm1 8.062 ppm2 6.525 CV 1 ASSI { 2767} (( segid "KH " and resid 139 and name HN )) (( segid "KH " and resid 155 and name HN )) 2.900 1.000 1.000 peak 2767 spectrum 1 weight 0.10000E+01 volume 0.18264E-02 ppm1 9.179 ppm2 9.133 CV 1 ASSI { 2768} (( segid "KH " and resid 139 and name HN )) (( segid "KH " and resid 156 and name HG13)) 3.200 1.300 1.300 peak 2768 spectrum 1 weight 0.10000E+01 volume 0.17812E-02 ppm1 9.179 ppm2 1.503 CV 1 OR { 2768} (( segid "KH " and resid 139 and name HN )) (( segid "KH " and resid 156 and name HG12)) ASSI { 2771} (( segid "KH " and resid 139 and name HN )) (( segid "KH " and resid 138 and name HA )) 2.700 0.900 0.900 peak 2771 spectrum 1 weight 0.10000E+01 volume 0.21589E-02 ppm1 9.179 ppm2 4.978 CV 1 ASSI { 2772} (( segid "KH " and resid 113 and name HN )) ( segid "KH " and resid 115 and name HB% ) 3.400 3.400 2.600 peak 2772 spectrum 1 weight 0.10000E+01 volume 0.20740E-02 ppm1 9.188 ppm2 1.328 CV 1 ASSI { 2774} (( segid "KH " and resid 154 and name HN )) (( segid "KH " and resid 155 and name HE2 )) 3.200 3.200 2.800 peak 2774 spectrum 1 weight 0.10000E+01 volume 0.16616E-02 ppm1 8.615 ppm2 2.631 CV 1 ASSI { 2775} (( segid "KH " and resid 46 and name HN )) ( segid "KH " and resid 45 and name HG2%) 2.700 0.900 0.900 peak 2775 spectrum 1 weight 0.10000E+01 volume 0.15145E-02 ppm1 7.765 ppm2 1.027 CV 1 ASSI { 2776} (( segid "KH " and resid 46 and name HN )) ( segid "KH " and resid 58 and name HD1%) 4.600 2.600 1.400 peak 2776 spectrum 1 weight 0.10000E+01 volume 0.12004E-02 ppm1 7.765 ppm2 0.639 CV 1 ASSI { 2777} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 49 and name HB3 )) 2.900 1.000 1.000 peak 2777 spectrum 1 weight 0.10000E+01 volume 0.20139E-02 ppm1 7.786 ppm2 4.079 CV 1 OR { 2777} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 49 and name HB2 )) ASSI { 2778} (( segid "KH " and resid 50 and name HN )) (( segid "KH " and resid 51 and name HN )) 2.900 1.100 1.100 peak 2778 spectrum 1 weight 0.10000E+01 volume 0.15711E-02 ppm1 7.792 ppm2 8.389 CV 1 ASSI { 2779} (( segid "KH " and resid 83 and name HN )) (( segid "KH " and resid 86 and name HB2 )) 2.900 2.900 3.100 peak 2779 spectrum 1 weight 0.10000E+01 volume 0.34760E-02 ppm1 8.867 ppm2 1.915 CV 1 OR { 2779} (( segid "KH " and resid 83 and name HN )) (( segid "KH " and resid 86 and name HB3 )) ASSI { 2781} (( segid "KH " and resid 83 and name HN )) (( segid "KH " and resid 79 and name HA )) 2.400 0.700 0.700 peak 2781 spectrum 1 weight 0.10000E+01 volume 0.64292E-02 ppm1 8.866 ppm2 4.307 CV 1 ASSI { 2784} (( segid "KH " and resid 84 and name HE22)) (( segid "KH " and resid 84 and name HG3 )) 3.300 1.400 1.400 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.26074E-02 ppm1 6.868 ppm2 2.899 CV 1 OR { 2784} (( segid "KH " and resid 84 and name HE22)) (( segid "KH " and resid 84 and name HG2 )) ASSI { 2788} (( segid "KH " and resid 35 and name HN )) (( segid "KH " and resid 34 and name HN )) 2.700 0.900 0.900 peak 2788 spectrum 1 weight 0.10000E+01 volume 0.25953E-02 ppm1 8.430 ppm2 7.072 CV 1 ASSI { 2789} (( segid "KH " and resid 118 and name HN )) ( segid "KH " and resid 116 and name HB% ) 3.600 1.600 1.600 peak 2789 spectrum 1 weight 0.10000E+01 volume 0.16093E-02 ppm1 7.356 ppm2 1.189 CV 1 ASSI { 2793} (( segid "KH " and resid 37 and name HN )) (( segid "KH " and resid 39 and name HN )) 3.500 1.500 1.500 peak 2793 spectrum 1 weight 0.10000E+01 volume 0.79009E-03 ppm1 7.430 ppm2 7.931 CV 1 ASSI { 2794} (( segid "KH " and resid 55 and name HN )) (( segid "KH " and resid 55 and name HA )) 3.000 1.200 1.200 peak 2794 spectrum 1 weight 0.10000E+01 volume 0.14663E-02 ppm1 8.498 ppm2 4.740 CV 1 ASSI { 2800} (( segid "KH " and resid 151 and name HN )) (( segid "KH " and resid 147 and name HN )) 2.600 0.900 0.900 peak 2800 spectrum 1 weight 0.10000E+01 volume 0.32871E-02 ppm1 8.464 ppm2 8.540 CV 1 ASSI { 2801} (( segid "KH " and resid 110 and name HN )) (( segid "KH " and resid 109 and name HA )) 2.900 1.100 1.100 peak 2801 spectrum 1 weight 0.10000E+01 volume 0.17585E-02 ppm1 8.593 ppm2 4.766 CV 1 ASSI { 2802} (( segid "KH " and resid 110 and name HN )) (( segid "KH " and resid 109 and name HB )) 2.900 1.100 1.100 peak 2802 spectrum 1 weight 0.10000E+01 volume 0.13376E-02 ppm1 8.595 ppm2 1.932 CV 1 ASSI { 2805} (( segid "KH " and resid 149 and name HN )) (( segid "KH " and resid 148 and name HA )) 3.100 1.200 1.200 peak 2805 spectrum 1 weight 0.10000E+01 volume 0.17457E-02 ppm1 8.388 ppm2 4.192 CV 1 ASSI { 2808} (( segid "KH " and resid 136 and name HN )) ( segid "KH " and resid 162 and name HB% ) 2.800 1.000 1.000 peak 2808 spectrum 1 weight 0.10000E+01 volume 0.36542E-02 ppm1 8.078 ppm2 0.990 CV 1 ASSI { 2809} (( segid "KH " and resid 38 and name HN )) (( segid "KH " and resid 38 and name HG13)) 4.000 2.000 2.000 peak 2809 spectrum 1 weight 0.10000E+01 volume 0.16191E-02 ppm1 8.188 ppm2 1.116 CV 1 ASSI { 2810} (( segid "KH " and resid 91 and name HN )) (( segid "KH " and resid 90 and name HA )) 3.000 1.100 1.100 peak 2810 spectrum 1 weight 0.10000E+01 volume 0.18866E-02 ppm1 7.572 ppm2 4.205 CV 1 ASSI { 2811} (( segid "KH " and resid 116 and name HN )) (( segid "KH " and resid 116 and name HA )) 2.600 0.900 0.900 peak 2811 spectrum 1 weight 0.10000E+01 volume 0.35800E-02 ppm1 7.210 ppm2 3.386 CV 1 ASSI { 12} (( segid "KH " and resid 149 and name HA )) (( segid "KH " and resid 149 and name HB3 )) 2.600 0.800 0.800 peak 12 spectrum 1 weight 0.10000E+01 volume 0.37297E-02 ppm1 4.982 ppm2 2.620 CV 1 ASSI { 13} (( segid "KH " and resid 149 and name HA )) (( segid "KH " and resid 149 and name HB2 )) 2.700 0.900 0.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.52534E-02 ppm1 4.982 ppm2 2.944 CV 1 ASSI { 15} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 108 and name HN )) 3.000 1.200 1.200 peak 15 spectrum 1 weight 0.10000E+01 volume 0.18384E-02 ppm1 1.104 ppm2 10.126 CV 1 ASSI { 17} (( segid "KH " and resid 156 and name HA )) (( segid "KH " and resid 157 and name HN )) 2.600 0.800 0.800 peak 17 spectrum 1 weight 0.10000E+01 volume 0.29470E-02 ppm1 4.992 ppm2 9.568 CV 1 ASSI { 18} (( segid "KH " and resid 155 and name HA )) (( segid "KH " and resid 156 and name HN )) 2.900 1.000 1.000 peak 18 spectrum 1 weight 0.10000E+01 volume 0.16852E-02 ppm1 5.150 ppm2 9.597 CV 1 ASSI { 47} (( segid "KH " and resid 151 and name HA )) (( segid "KH " and resid 113 and name HN )) 2.700 0.900 0.900 peak 47 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 5.091 ppm2 9.165 CV 1 ASSI { 57} (( segid "KH " and resid 68 and name HB )) (( segid "KH " and resid 69 and name HN )) 2.700 0.900 0.900 peak 57 spectrum 1 weight 0.10000E+01 volume 0.32813E-02 ppm1 2.078 ppm2 9.109 CV 1 ASSI { 68} (( segid "KH " and resid 25 and name HB )) (( segid "KH " and resid 25 and name HN )) 3.100 1.200 1.200 peak 68 spectrum 1 weight 0.10000E+01 volume 0.12034E-02 ppm1 2.028 ppm2 9.126 CV 1 ASSI { 95} (( segid "KH " and resid 153 and name HB )) (( segid "KH " and resid 153 and name HN )) 2.800 1.000 1.000 peak 95 spectrum 1 weight 0.10000E+01 volume 0.22145E-02 ppm1 1.628 ppm2 9.139 CV 1 ASSI { 96} (( segid "KH " and resid 152 and name HB )) (( segid "KH " and resid 152 and name HN )) 3.000 1.100 1.100 peak 96 spectrum 1 weight 0.10000E+01 volume 0.28022E-02 ppm1 2.056 ppm2 9.135 CV 1 ASSI { 99} (( segid "KH " and resid 153 and name HG12)) (( segid "KH " and resid 153 and name HN )) 2.700 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.22785E-02 ppm1 1.452 ppm2 9.140 CV 1 ASSI { 100} (( segid "KH " and resid 153 and name HG13)) (( segid "KH " and resid 153 and name HN )) 4.000 2.000 2.000 peak 100 spectrum 1 weight 0.10000E+01 volume 0.13566E-02 ppm1 0.993 ppm2 9.140 CV 1 ASSI { 113} (( segid "KH " and resid 29 and name HG12)) (( segid "KH " and resid 29 and name HN )) 2.900 1.000 1.000 peak 113 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 1.269 ppm2 8.850 CV 1 ASSI { 124} ( segid "KH " and resid 83 and name HB% ) (( segid "KH " and resid 84 and name HN )) 2.700 0.900 0.900 peak 124 spectrum 1 weight 0.10000E+01 volume 0.34735E-02 ppm1 1.244 ppm2 8.852 CV 1 ASSI { 129} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 106 and name HN )) 3.300 1.300 1.300 peak 129 spectrum 1 weight 0.10000E+01 volume 0.21281E-02 ppm1 0.956 ppm2 8.808 CV 1 ASSI { 146} (( segid "KH " and resid 58 and name HB )) (( segid "KH " and resid 59 and name HN )) 2.800 1.000 1.000 peak 146 spectrum 1 weight 0.10000E+01 volume 0.39192E-02 ppm1 1.751 ppm2 8.656 CV 1 ASSI { 147} (( segid "KH " and resid 57 and name HB2 )) (( segid "KH " and resid 57 and name HN )) 2.600 0.800 0.800 peak 147 spectrum 1 weight 0.10000E+01 volume 0.28858E-02 ppm1 1.741 ppm2 8.676 CV 1 ASSI { 148} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 57 and name HN )) 3.200 1.300 1.300 peak 148 spectrum 1 weight 0.10000E+01 volume 0.22311E-02 ppm1 1.617 ppm2 8.668 CV 1 ASSI { 153} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 59 and name HN )) 2.600 0.800 0.800 peak 153 spectrum 1 weight 0.10000E+01 volume 0.40724E-02 ppm1 1.362 ppm2 8.645 CV 1 ASSI { 154} ( segid "KH " and resid 58 and name HG2%) (( segid "KH " and resid 58 and name HN )) 2.400 0.700 0.700 peak 154 spectrum 1 weight 0.10000E+01 volume 0.49526E-02 ppm1 0.787 ppm2 8.647 CV 1 ASSI { 156} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 58 and name HN )) 3.600 1.600 1.600 peak 156 spectrum 1 weight 0.10000E+01 volume 0.31504E-02 ppm1 0.662 ppm2 8.650 CV 1 ASSI { 157} (( segid "KH " and resid 110 and name HG3 )) (( segid "KH " and resid 110 and name HN )) 3.500 1.500 1.500 peak 157 spectrum 1 weight 0.10000E+01 volume 0.19972E-02 ppm1 1.352 ppm2 8.608 CV 1 ASSI { 160} (( segid "KH " and resid 154 and name HB )) (( segid "KH " and resid 154 and name HN )) 3.200 1.300 1.300 peak 160 spectrum 1 weight 0.10000E+01 volume 0.14373E-02 ppm1 1.846 ppm2 8.604 CV 1 ASSI { 164} (( segid "KH " and resid 110 and name HA )) (( segid "KH " and resid 110 and name HN )) 3.000 1.100 1.100 peak 164 spectrum 1 weight 0.10000E+01 volume 0.13649E-02 ppm1 5.357 ppm2 8.606 CV 1 ASSI { 168} (( segid "KH " and resid 161 and name HB2 )) (( segid "KH " and resid 161 and name HN )) 2.700 0.900 0.900 peak 168 spectrum 1 weight 0.10000E+01 volume 0.22228E-02 ppm1 2.897 ppm2 8.519 CV 1 ASSI { 174} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 103 and name HN )) 3.100 1.200 1.200 peak 174 spectrum 1 weight 0.10000E+01 volume 0.23008E-02 ppm1 1.906 ppm2 8.551 CV 1 ASSI { 175} (( segid "KH " and resid 110 and name HG2 )) (( segid "KH " and resid 110 and name HN )) 3.200 1.300 1.300 peak 175 spectrum 1 weight 0.10000E+01 volume 0.18885E-02 ppm1 1.640 ppm2 8.606 CV 1 ASSI { 181} (( segid "KH " and resid 102 and name HB3 )) (( segid "KH " and resid 103 and name HN )) 3.800 1.800 1.800 peak 181 spectrum 1 weight 0.10000E+01 volume 0.14345E-02 ppm1 1.782 ppm2 8.544 CV 1 ASSI { 184} (( segid "KH " and resid 149 and name HA )) (( segid "KH " and resid 150 and name HN )) 2.800 1.000 1.000 peak 184 spectrum 1 weight 0.10000E+01 volume 0.32618E-02 ppm1 4.982 ppm2 8.604 CV 1 ASSI { 185} (( segid "KH " and resid 150 and name HG3 )) (( segid "KH " and resid 150 and name HN )) 2.700 0.900 0.900 peak 185 spectrum 1 weight 0.10000E+01 volume 0.42339E-02 ppm1 2.234 ppm2 8.603 CV 1 OR { 185} (( segid "KH " and resid 150 and name HG2 )) (( segid "KH " and resid 150 and name HN )) ASSI { 198} (( segid "KH " and resid 93 and name HA )) (( segid "KH " and resid 93 and name HN )) 2.700 0.900 0.900 peak 198 spectrum 1 weight 0.10000E+01 volume 0.36183E-02 ppm1 4.026 ppm2 8.461 CV 1 ASSI { 204} (( segid "KH " and resid 92 and name HB2 )) (( segid "KH " and resid 93 and name HN )) 2.800 1.000 1.000 peak 204 spectrum 1 weight 0.10000E+01 volume 0.18524E-02 ppm1 2.189 ppm2 8.462 CV 1 ASSI { 207} (( segid "KH " and resid 21 and name HB2 )) (( segid "KH " and resid 21 and name HN )) 3.500 1.500 1.500 peak 207 spectrum 1 weight 0.10000E+01 volume 0.14373E-02 ppm1 2.045 ppm2 8.502 CV 1 ASSI { 213} (( segid "KH " and resid 92 and name HG2 )) (( segid "KH " and resid 93 and name HN )) 3.600 1.600 1.600 peak 213 spectrum 1 weight 0.10000E+01 volume 0.18802E-02 ppm1 1.525 ppm2 8.475 CV 1 OR { 213} (( segid "KH " and resid 92 and name HG3 )) (( segid "KH " and resid 93 and name HN )) ASSI { 218} (( segid "KH " and resid 93 and name HG3 )) (( segid "KH " and resid 93 and name HN )) 3.100 1.200 1.200 peak 218 spectrum 1 weight 0.10000E+01 volume 0.28579E-02 ppm1 2.355 ppm2 8.473 CV 1 ASSI { 262} (( segid "KH " and resid 174 and name HA )) (( segid "KH " and resid 174 and name HN )) 3.100 1.200 1.200 peak 262 spectrum 1 weight 0.10000E+01 volume 0.12256E-02 ppm1 3.910 ppm2 8.110 CV 1 ASSI { 270} (( segid "KH " and resid 56 and name HG12)) (( segid "KH " and resid 56 and name HN )) 3.700 1.700 1.700 peak 270 spectrum 1 weight 0.10000E+01 volume 0.15710E-02 ppm1 1.448 ppm2 8.316 CV 1 ASSI { 271} (( segid "KH " and resid 174 and name HG )) (( segid "KH " and resid 174 and name HN )) 4.000 2.000 2.000 peak 271 spectrum 1 weight 0.10000E+01 volume 0.10418E-02 ppm1 1.908 ppm2 8.106 CV 1 ASSI { 272} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 174 and name HN )) 3.900 1.900 1.900 peak 272 spectrum 1 weight 0.10000E+01 volume 0.16824E-02 ppm1 0.843 ppm2 8.124 CV 1 ASSI { 273} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 174 and name HN )) 3.600 1.700 1.700 peak 273 spectrum 1 weight 0.10000E+01 volume 0.23816E-02 ppm1 0.685 ppm2 8.098 CV 1 ASSI { 277} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 56 and name HN )) 4.300 2.300 1.700 peak 277 spectrum 1 weight 0.10000E+01 volume 0.19108E-02 ppm1 0.666 ppm2 8.322 CV 1 ASSI { 280} (( segid "KH " and resid 37 and name HB )) (( segid "KH " and resid 38 and name HN )) 2.700 0.900 0.900 peak 280 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 1.924 ppm2 8.228 CV 1 ASSI { 300} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 158 and name HN )) 4.400 2.400 1.600 peak 300 spectrum 1 weight 0.10000E+01 volume 0.10501E-02 ppm1 0.827 ppm2 8.228 CV 1 ASSI { 336} (( segid "KH " and resid 162 and name HA )) (( segid "KH " and resid 165 and name HN )) 3.200 1.300 1.300 peak 336 spectrum 1 weight 0.10000E+01 volume 0.13064E-02 ppm1 4.106 ppm2 8.108 CV 1 ASSI { 349} ( segid "KH " and resid 87 and name HD1%) (( segid "KH " and resid 88 and name HN )) 2.800 2.800 3.200 peak 349 spectrum 1 weight 0.10000E+01 volume 0.12591E-02 ppm1 0.585 ppm2 7.986 CV 1 ASSI { 357} (( segid "KH " and resid 171 and name HA )) (( segid "KH " and resid 171 and name HN )) 2.900 1.000 1.000 peak 357 spectrum 1 weight 0.10000E+01 volume 0.20863E-02 ppm1 3.878 ppm2 7.871 CV 1 ASSI { 358} (( segid "KH " and resid 172 and name HB2 )) (( segid "KH " and resid 173 and name HN )) 3.200 1.300 1.300 peak 358 spectrum 1 weight 0.10000E+01 volume 0.10112E-02 ppm1 2.869 ppm2 7.940 CV 1 ASSI { 361} (( segid "KH " and resid 170 and name HB )) (( segid "KH " and resid 171 and name HN )) 3.600 1.600 1.600 peak 361 spectrum 1 weight 0.10000E+01 volume 0.11170E-02 ppm1 1.765 ppm2 7.876 CV 1 ASSI { 363} (( segid "KH " and resid 171 and name HG2 )) (( segid "KH " and resid 171 and name HN )) 3.800 1.800 1.800 peak 363 spectrum 1 weight 0.10000E+01 volume 0.17186E-02 ppm1 1.881 ppm2 7.857 CV 1 ASSI { 376} ( segid "KH " and resid 173 and name HD1%) (( segid "KH " and resid 173 and name HN )) 3.900 1.900 1.900 peak 376 spectrum 1 weight 0.10000E+01 volume 0.18357E-02 ppm1 0.731 ppm2 7.938 CV 1 ASSI { 386} (( segid "KH " and resid 174 and name HA )) (( segid "KH " and resid 175 and name HN )) 3.300 1.400 1.400 peak 386 spectrum 1 weight 0.10000E+01 volume 0.13454E-02 ppm1 3.908 ppm2 7.936 CV 1 ASSI { 387} (( segid "KH " and resid 22 and name HA )) (( segid "KH " and resid 23 and name HN )) 3.000 1.100 1.100 peak 387 spectrum 1 weight 0.10000E+01 volume 0.19303E-02 ppm1 3.979 ppm2 7.900 CV 1 ASSI { 392} (( segid "KH " and resid 95 and name HB2 )) (( segid "KH " and resid 95 and name HN )) 3.000 1.100 1.100 peak 392 spectrum 1 weight 0.10000E+01 volume 0.24039E-02 ppm1 2.869 ppm2 7.909 CV 1 ASSI { 393} (( segid "KH " and resid 95 and name HB3 )) (( segid "KH " and resid 95 and name HN )) 3.300 1.300 1.300 peak 393 spectrum 1 weight 0.10000E+01 volume 0.25515E-02 ppm1 2.685 ppm2 7.919 CV 1 ASSI { 398} (( segid "KH " and resid 178 and name HA )) (( segid "KH " and resid 178 and name HN )) 2.700 0.900 0.900 peak 398 spectrum 1 weight 0.10000E+01 volume 0.31197E-02 ppm1 4.140 ppm2 7.905 CV 1 ASSI { 407} (( segid "KH " and resid 45 and name HB )) (( segid "KH " and resid 45 and name HN )) 2.600 0.800 0.800 peak 407 spectrum 1 weight 0.10000E+01 volume 0.26100E-02 ppm1 2.078 ppm2 7.833 CV 1 ASSI { 415} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 45 and name HN )) 2.700 0.900 0.900 peak 415 spectrum 1 weight 0.10000E+01 volume 0.22590E-02 ppm1 1.048 ppm2 7.833 CV 1 ASSI { 437} (( segid "KH " and resid 176 and name HA )) (( segid "KH " and resid 176 and name HN )) 2.700 0.900 0.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.34401E-02 ppm1 4.115 ppm2 7.683 CV 1 ASSI { 439} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HN )) 3.600 1.600 1.600 peak 439 spectrum 1 weight 0.10000E+01 volume 0.20223E-02 ppm1 2.523 ppm2 7.665 CV 1 ASSI { 440} (( segid "KH " and resid 176 and name HG3 )) (( segid "KH " and resid 176 and name HN )) 2.600 0.900 0.900 peak 440 spectrum 1 weight 0.10000E+01 volume 0.23593E-02 ppm1 2.402 ppm2 7.662 CV 1 ASSI { 445} ( segid "KH " and resid 52 and name HB% ) (( segid "KH " and resid 82 and name HN )) 3.400 1.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.15487E-02 ppm1 1.407 ppm2 7.690 CV 1 ASSI { 451} (( segid "KH " and resid 87 and name HB )) (( segid "KH " and resid 87 and name HN )) 2.800 1.000 1.000 peak 451 spectrum 1 weight 0.10000E+01 volume 0.21393E-02 ppm1 2.005 ppm2 7.649 CV 1 ASSI { 455} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 33 and name HN )) 3.600 1.600 1.600 peak 455 spectrum 1 weight 0.10000E+01 volume 0.17186E-02 ppm1 0.937 ppm2 7.668 CV 1 ASSI { 462} (( segid "KH " and resid 93 and name HG3 )) (( segid "KH " and resid 94 and name HN )) 2.600 0.800 0.800 peak 462 spectrum 1 weight 0.10000E+01 volume 0.30613E-02 ppm1 2.337 ppm2 7.660 CV 1 ASSI { 496} (( segid "KH " and resid 161 and name HB2 )) (( segid "KH " and resid 162 and name HN )) 3.100 1.200 1.200 peak 496 spectrum 1 weight 0.10000E+01 volume 0.16908E-02 ppm1 2.896 ppm2 7.565 CV 1 ASSI { 504} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 105 and name HN )) 3.600 1.600 1.600 peak 504 spectrum 1 weight 0.10000E+01 volume 0.12256E-02 ppm1 -0.159 ppm2 7.338 CV 1 ASSI { 536} (( segid "KH " and resid 179 and name HG3 )) (( segid "KH " and resid 179 and name HE21)) 3.700 1.700 1.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.44010E-03 ppm1 2.351 ppm2 7.385 CV 1 OR { 536} (( segid "KH " and resid 179 and name HG2 )) (( segid "KH " and resid 179 and name HE21)) ASSI { 568} (( segid "KH " and resid 96 and name HA )) ( segid "KH " and resid 96 and name HD% ) 2.900 1.000 1.000 peak 568 spectrum 1 weight 0.10000E+01 volume 0.22033E-02 ppm1 4.133 ppm2 7.118 CV 1 ASSI { 573} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HN )) 3.000 1.200 1.200 peak 573 spectrum 1 weight 0.10000E+01 volume 0.13426E-02 ppm1 1.622 ppm2 7.123 CV 1 ASSI { 574} (( segid "KH " and resid 104 and name HB3 )) (( segid "KH " and resid 104 and name HN )) 3.100 1.200 1.200 peak 574 spectrum 1 weight 0.10000E+01 volume 0.14568E-02 ppm1 1.499 ppm2 7.113 CV 1 ASSI { 605} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 80 and name HE22)) 3.600 1.600 1.600 peak 605 spectrum 1 weight 0.10000E+01 volume 0.14457E-02 ppm1 0.802 ppm2 6.073 CV 1 ASSI { 632} (( segid "KH " and resid 110 and name HG3 )) (( segid "KH " and resid 110 and name HA )) 3.200 1.200 1.200 peak 632 spectrum 1 weight 0.10000E+01 volume 0.18718E-02 ppm1 1.347 ppm2 5.351 CV 1 ASSI { 637} (( segid "KH " and resid 68 and name HB )) (( segid "KH " and resid 68 and name HA )) 2.700 0.900 0.900 peak 637 spectrum 1 weight 0.10000E+01 volume 0.28384E-02 ppm1 2.078 ppm2 5.203 CV 1 ASSI { 640} ( segid "KH " and resid 31 and name HB% ) (( segid "KH " and resid 68 and name HA )) 3.100 1.200 1.200 peak 640 spectrum 1 weight 0.10000E+01 volume 0.18551E-02 ppm1 1.252 ppm2 5.206 CV 1 ASSI { 646} (( segid "KH " and resid 77 and name HD3 )) (( segid "KH " and resid 76 and name HA )) 3.000 1.100 1.100 peak 646 spectrum 1 weight 0.10000E+01 volume 0.12479E-02 ppm1 3.795 ppm2 5.171 CV 1 ASSI { 648} (( segid "KH " and resid 76 and name HB3 )) (( segid "KH " and resid 76 and name HA )) 4.400 2.400 1.600 peak 648 spectrum 1 weight 0.10000E+01 volume 0.12256E-03 ppm1 2.389 ppm2 5.178 CV 1 ASSI { 651} (( segid "KH " and resid 157 and name HG12)) (( segid "KH " and resid 157 and name HA )) 2.900 1.100 1.100 peak 651 spectrum 1 weight 0.10000E+01 volume 0.24262E-02 ppm1 1.463 ppm2 5.165 CV 1 ASSI { 652} (( segid "KH " and resid 157 and name HG13)) (( segid "KH " and resid 157 and name HA )) 3.700 1.700 1.700 peak 652 spectrum 1 weight 0.10000E+01 volume 0.14902E-02 ppm1 1.085 ppm2 5.160 CV 1 ASSI { 662} (( segid "KH " and resid 156 and name HG13)) (( segid "KH " and resid 156 and name HA )) 2.900 1.100 1.100 peak 662 spectrum 1 weight 0.10000E+01 volume 0.16239E-02 ppm1 1.523 ppm2 4.993 CV 1 OR { 662} (( segid "KH " and resid 156 and name HG12)) (( segid "KH " and resid 156 and name HA )) ASSI { 666} (( segid "KH " and resid 151 and name HG3 )) (( segid "KH " and resid 151 and name HA )) 3.100 1.200 1.200 peak 666 spectrum 1 weight 0.10000E+01 volume 0.19610E-02 ppm1 1.733 ppm2 5.094 CV 1 ASSI { 679} (( segid "KH " and resid 106 and name HB2 )) (( segid "KH " and resid 106 and name HA )) 2.800 1.000 1.000 peak 679 spectrum 1 weight 0.10000E+01 volume 0.16351E-02 ppm1 2.029 ppm2 4.925 CV 1 ASSI { 694} (( segid "KH " and resid 30 and name HD3 )) (( segid "KH " and resid 29 and name HA )) 3.000 1.200 1.200 peak 694 spectrum 1 weight 0.10000E+01 volume 0.14290E-02 ppm1 3.201 ppm2 4.938 CV 1 ASSI { 697} (( segid "KH " and resid 29 and name HB )) (( segid "KH " and resid 29 and name HA )) 2.700 0.900 0.900 peak 697 spectrum 1 weight 0.10000E+01 volume 0.22256E-02 ppm1 1.558 ppm2 4.927 CV 1 ASSI { 698} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 105 and name HA )) 3.100 1.200 1.200 peak 698 spectrum 1 weight 0.10000E+01 volume 0.19582E-02 ppm1 0.784 ppm2 4.973 CV 1 ASSI { 701} ( segid "KH " and resid 54 and name HB% ) (( segid "KH " and resid 54 and name HA )) 2.600 0.800 0.800 peak 701 spectrum 1 weight 0.10000E+01 volume 0.46518E-02 ppm1 1.035 ppm2 4.911 CV 1 ASSI { 703} ( segid "KH " and resid 138 and name HG2%) (( segid "KH " and resid 138 and name HA )) 2.800 1.000 1.000 peak 703 spectrum 1 weight 0.10000E+01 volume 0.26184E-02 ppm1 0.478 ppm2 4.982 CV 1 ASSI { 708} ( segid "KH " and resid 29 and name HG2%) (( segid "KH " and resid 29 and name HA )) 2.600 0.800 0.800 peak 708 spectrum 1 weight 0.10000E+01 volume 0.42618E-02 ppm1 0.666 ppm2 4.925 CV 1 ASSI { 709} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 29 and name HA )) 3.900 1.900 1.900 peak 709 spectrum 1 weight 0.10000E+01 volume 0.18273E-02 ppm1 0.445 ppm2 4.935 CV 1 ASSI { 717} ( segid "KH " and resid 111 and name HG1%) (( segid "KH " and resid 111 and name HA )) 2.700 0.900 0.900 peak 717 spectrum 1 weight 0.10000E+01 volume 0.34401E-02 ppm1 0.688 ppm2 4.842 CV 1 ASSI { 720} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 111 and name HA )) 3.400 1.400 1.400 peak 720 spectrum 1 weight 0.10000E+01 volume 0.19916E-02 ppm1 0.856 ppm2 4.866 CV 1 ASSI { 721} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 111 and name HA )) 2.700 2.700 3.300 peak 721 spectrum 1 weight 0.10000E+01 volume 0.17047E-02 ppm1 0.683 ppm2 4.842 CV 1 ASSI { 728} (( segid "KH " and resid 19 and name HD3 )) (( segid "KH " and resid 18 and name HA )) 2.300 0.600 0.600 peak 728 spectrum 1 weight 0.10000E+01 volume 0.88386E-02 ppm1 3.577 ppm2 4.716 CV 1 ASSI { 742} (( segid "KH " and resid 153 and name HG12)) (( segid "KH " and resid 153 and name HA )) 3.000 1.100 1.100 peak 742 spectrum 1 weight 0.10000E+01 volume 0.18579E-02 ppm1 1.439 ppm2 4.675 CV 1 ASSI { 743} (( segid "KH " and resid 153 and name HG13)) (( segid "KH " and resid 153 and name HA )) 3.800 1.800 1.800 peak 743 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 0.995 ppm2 4.671 CV 1 ASSI { 744} (( segid "KH " and resid 58 and name HG12)) (( segid "KH " and resid 58 and name HA )) 3.300 1.300 1.300 peak 744 spectrum 1 weight 0.10000E+01 volume 0.20919E-02 ppm1 1.368 ppm2 4.655 CV 1 ASSI { 745} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 57 and name HA )) 3.000 1.100 1.100 peak 745 spectrum 1 weight 0.10000E+01 volume 0.18467E-02 ppm1 1.295 ppm2 4.637 CV 1 ASSI { 752} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 153 and name HA )) 2.700 0.900 0.900 peak 752 spectrum 1 weight 0.10000E+01 volume 0.31838E-02 ppm1 0.496 ppm2 4.682 CV 1 ASSI { 757} (( segid "KH " and resid 145 and name HB )) (( segid "KH " and resid 145 and name HA )) 2.900 1.100 1.100 peak 757 spectrum 1 weight 0.10000E+01 volume 0.19638E-02 ppm1 4.038 ppm2 4.603 CV 1 ASSI { 760} (( segid "KH " and resid 146 and name HD2 )) (( segid "KH " and resid 145 and name HA )) 2.700 0.900 0.900 peak 760 spectrum 1 weight 0.10000E+01 volume 0.27270E-02 ppm1 4.153 ppm2 4.617 CV 1 ASSI { 762} (( segid "KH " and resid 58 and name HB )) (( segid "KH " and resid 58 and name HA )) 2.600 0.900 0.900 peak 762 spectrum 1 weight 0.10000E+01 volume 0.25292E-02 ppm1 1.751 ppm2 4.667 CV 1 ASSI { 763} (( segid "KH " and resid 57 and name HB2 )) (( segid "KH " and resid 57 and name HA )) 2.800 1.000 1.000 peak 763 spectrum 1 weight 0.10000E+01 volume 0.35961E-02 ppm1 1.743 ppm2 4.650 CV 1 ASSI { 764} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 57 and name HA )) 2.500 0.800 0.800 peak 764 spectrum 1 weight 0.10000E+01 volume 0.38523E-02 ppm1 1.618 ppm2 4.643 CV 1 ASSI { 768} (( segid "KH " and resid 58 and name HG13)) (( segid "KH " and resid 58 and name HA )) 2.900 1.100 1.100 peak 768 spectrum 1 weight 0.10000E+01 volume 0.31448E-02 ppm1 1.127 ppm2 4.664 CV 1 ASSI { 773} ( segid "KH " and resid 140 and name HG1%) (( segid "KH " and resid 140 and name HA )) 3.000 1.100 1.100 peak 773 spectrum 1 weight 0.10000E+01 volume 0.16490E-02 ppm1 0.766 ppm2 4.606 CV 1 ASSI { 784} (( segid "KH " and resid 181 and name HB2 )) (( segid "KH " and resid 181 and name HA )) 2.600 0.800 0.800 peak 784 spectrum 1 weight 0.10000E+01 volume 0.43008E-02 ppm1 3.164 ppm2 4.591 CV 1 ASSI { 785} (( segid "KH " and resid 181 and name HB3 )) (( segid "KH " and resid 181 and name HA )) 2.900 1.000 1.000 peak 785 spectrum 1 weight 0.10000E+01 volume 0.38189E-02 ppm1 3.084 ppm2 4.589 CV 1 ASSI { 788} (( segid "KH " and resid 26 and name HA )) (( segid "KH " and resid 72 and name HA )) 3.200 1.300 1.300 peak 788 spectrum 1 weight 0.10000E+01 volume 0.92199E-03 ppm1 5.683 ppm2 4.526 CV 1 ASSI { 792} (( segid "KH " and resid 30 and name HB3 )) (( segid "KH " and resid 30 and name HA )) 3.000 1.100 1.100 peak 792 spectrum 1 weight 0.10000E+01 volume 0.12144E-02 ppm1 1.574 ppm2 4.580 CV 1 ASSI { 800} (( segid "KH " and resid 128 and name HB3 )) (( segid "KH " and resid 128 and name HA )) 2.700 0.900 0.900 peak 800 spectrum 1 weight 0.10000E+01 volume 0.49442E-02 ppm1 2.854 ppm2 4.459 CV 1 ASSI { 801} (( segid "KH " and resid 95 and name HB2 )) (( segid "KH " and resid 95 and name HA )) 2.600 0.800 0.800 peak 801 spectrum 1 weight 0.10000E+01 volume 0.48217E-02 ppm1 2.876 ppm2 4.529 CV 1 ASSI { 803} (( segid "KH " and resid 30 and name HB2 )) (( segid "KH " and resid 30 and name HA )) 3.000 1.100 1.100 peak 803 spectrum 1 weight 0.10000E+01 volume 0.27075E-02 ppm1 2.522 ppm2 4.568 CV 1 ASSI { 811} (( segid "KH " and resid 44 and name HB2 )) (( segid "KH " and resid 44 and name HA )) 3.100 1.200 1.200 peak 811 spectrum 1 weight 0.10000E+01 volume 0.11977E-02 ppm1 3.152 ppm2 4.507 CV 1 ASSI { 819} (( segid "KH " and resid 25 and name HB )) (( segid "KH " and resid 25 and name HA )) 3.000 1.100 1.100 peak 819 spectrum 1 weight 0.10000E+01 volume 0.16212E-02 ppm1 2.024 ppm2 4.452 CV 1 ASSI { 826} (( segid "KH " and resid 172 and name HB3 )) (( segid "KH " and resid 172 and name HA )) 2.600 0.900 0.900 peak 826 spectrum 1 weight 0.10000E+01 volume 0.45403E-02 ppm1 2.695 ppm2 4.441 CV 1 ASSI { 827} (( segid "KH " and resid 143 and name HB2 )) (( segid "KH " and resid 143 and name HA )) 2.600 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.45292E-02 ppm1 2.778 ppm2 4.326 CV 1 ASSI { 828} (( segid "KH " and resid 143 and name HB3 )) (( segid "KH " and resid 143 and name HA )) 2.600 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.43732E-02 ppm1 2.631 ppm2 4.326 CV 1 ASSI { 833} (( segid "KH " and resid 137 and name HB3 )) (( segid "KH " and resid 137 and name HA )) 2.900 1.100 1.100 peak 833 spectrum 1 weight 0.10000E+01 volume 0.20807E-02 ppm1 2.073 ppm2 4.359 CV 1 ASSI { 865} (( segid "KH " and resid 51 and name HB2 )) (( segid "KH " and resid 51 and name HA )) 2.400 0.700 0.700 peak 865 spectrum 1 weight 0.10000E+01 volume 0.50696E-02 ppm1 3.348 ppm2 4.372 CV 1 ASSI { 866} (( segid "KH " and resid 51 and name HB3 )) (( segid "KH " and resid 51 and name HA )) 2.900 1.100 1.100 peak 866 spectrum 1 weight 0.10000E+01 volume 0.35961E-02 ppm1 3.111 ppm2 4.383 CV 1 ASSI { 886} (( segid "KH " and resid 133 and name HB2 )) (( segid "KH " and resid 133 and name HA )) 3.200 1.200 1.200 peak 886 spectrum 1 weight 0.10000E+01 volume 0.14345E-02 ppm1 1.804 ppm2 4.239 CV 1 ASSI { 887} (( segid "KH " and resid 133 and name HB3 )) (( segid "KH " and resid 133 and name HA )) 3.000 1.100 1.100 peak 887 spectrum 1 weight 0.10000E+01 volume 0.19136E-02 ppm1 1.620 ppm2 4.241 CV 1 ASSI { 898} ( segid "KH " and resid 133 and name HD2%) (( segid "KH " and resid 133 and name HA )) 3.300 1.300 1.300 peak 898 spectrum 1 weight 0.10000E+01 volume 0.17159E-02 ppm1 0.884 ppm2 4.256 CV 1 ASSI { 900} (( segid "KH " and resid 126 and name HB )) (( segid "KH " and resid 126 and name HA )) 2.100 0.600 0.600 peak 900 spectrum 1 weight 0.10000E+01 volume 0.14008E-01 ppm1 4.117 ppm2 4.287 CV 1 ASSI { 910} (( segid "KH " and resid 64 and name HB2 )) (( segid "KH " and resid 64 and name HA )) 2.800 1.000 1.000 peak 910 spectrum 1 weight 0.10000E+01 volume 0.64874E-02 ppm1 2.366 ppm2 4.282 CV 1 ASSI { 924} ( segid "KH " and resid 154 and name HG2%) (( segid "KH " and resid 154 and name HA )) 2.700 0.900 0.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.42785E-02 ppm1 0.651 ppm2 4.141 CV 1 ASSI { 931} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HA )) 3.100 1.200 1.200 peak 931 spectrum 1 weight 0.10000E+01 volume 0.27326E-02 ppm1 2.600 ppm2 4.230 CV 1 ASSI { 936} (( segid "KH " and resid 90 and name HD2 )) (( segid "KH " and resid 90 and name HA )) 2.800 2.800 3.200 peak 936 spectrum 1 weight 0.10000E+01 volume 0.33649E-02 ppm1 1.725 ppm2 4.181 CV 1 ASSI { 948} (( segid "KH " and resid 86 and name HB2 )) (( segid "KH " and resid 86 and name HA )) 2.400 0.700 0.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.70471E-02 ppm1 1.905 ppm2 4.180 CV 1 OR { 948} (( segid "KH " and resid 86 and name HB3 )) (( segid "KH " and resid 86 and name HA )) ASSI { 949} (( segid "KH " and resid 93 and name HB2 )) (( segid "KH " and resid 90 and name HA )) 3.800 1.800 1.800 peak 949 spectrum 1 weight 0.10000E+01 volume 0.28077E-02 ppm1 2.212 ppm2 4.197 CV 1 ASSI { 955} (( segid "KH " and resid 128 and name HB3 )) (( segid "KH " and resid 125 and name HA )) 2.900 1.000 1.000 peak 955 spectrum 1 weight 0.10000E+01 volume 0.23844E-02 ppm1 2.854 ppm2 4.186 CV 1 ASSI { 980} (( segid "KH " and resid 76 and name HD2 )) (( segid "KH " and resid 75 and name HA2 )) 2.500 0.800 0.800 peak 980 spectrum 1 weight 0.10000E+01 volume 0.43008E-02 ppm1 3.618 ppm2 4.129 CV 1 OR { 980} (( segid "KH " and resid 76 and name HD3 )) (( segid "KH " and resid 75 and name HA2 )) ASSI { 984} (( segid "KH " and resid 51 and name HB2 )) (( segid "KH " and resid 48 and name HA )) 4.100 2.100 1.900 peak 984 spectrum 1 weight 0.10000E+01 volume 0.85513E-03 ppm1 3.348 ppm2 4.122 CV 1 ASSI { 990} (( segid "KH " and resid 176 and name HB2 )) (( segid "KH " and resid 176 and name HA )) 2.300 0.600 0.600 peak 990 spectrum 1 weight 0.10000E+01 volume 0.10317E-01 ppm1 2.163 ppm2 4.105 CV 1 OR { 990} (( segid "KH " and resid 176 and name HB3 )) (( segid "KH " and resid 176 and name HA )) ASSI { 992} (( segid "KH " and resid 91 and name HG )) (( segid "KH " and resid 91 and name HA )) 3.300 1.300 1.300 peak 992 spectrum 1 weight 0.10000E+01 volume 0.15682E-02 ppm1 1.979 ppm2 4.137 CV 1 ASSI { 1006} (( segid "KH " and resid 48 and name HG )) (( segid "KH " and resid 48 and name HA )) 3.000 1.100 1.100 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.18997E-02 ppm1 1.508 ppm2 4.111 CV 1 ASSI { 1009} (( segid "KH " and resid 165 and name HB3 )) (( segid "KH " and resid 165 and name HA )) 3.200 1.300 1.300 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.12897E-02 ppm1 2.151 ppm2 4.072 CV 1 OR { 1009} (( segid "KH " and resid 165 and name HB2 )) (( segid "KH " and resid 165 and name HA )) ASSI { 1018} (( segid "KH " and resid 82 and name HD2 )) (( segid "KH " and resid 82 and name HA )) 3.800 1.800 1.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.62673E-03 ppm1 1.446 ppm2 4.016 CV 1 ASSI { 1019} (( segid "KH " and resid 82 and name HG2 )) (( segid "KH " and resid 82 and name HA )) 3.700 1.700 1.700 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.85513E-03 ppm1 1.919 ppm2 4.055 CV 1 ASSI { 1025} (( segid "KH " and resid 93 and name HG3 )) (( segid "KH " and resid 93 and name HA )) 3.000 1.100 1.100 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.39470E-02 ppm1 2.357 ppm2 4.028 CV 1 ASSI { 1033} (( segid "KH " and resid 70 and name HG2 )) (( segid "KH " and resid 70 and name HA )) 3.500 1.600 1.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.13036E-02 ppm1 1.301 ppm2 3.968 CV 1 ASSI { 1037} ( segid "KH " and resid 52 and name HB% ) (( segid "KH " and resid 83 and name HA )) 2.700 0.900 0.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.37465E-02 ppm1 1.411 ppm2 3.998 CV 1 ASSI { 1038} ( segid "KH " and resid 83 and name HB% ) (( segid "KH " and resid 83 and name HA )) 2.600 0.800 0.800 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.47103E-02 ppm1 1.240 ppm2 3.980 CV 1 ASSI { 1041} (( segid "KH " and resid 76 and name HA )) (( segid "KH " and resid 77 and name HD2 )) 3.200 1.300 1.300 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.14930E-02 ppm1 5.177 ppm2 3.980 CV 1 ASSI { 1044} (( segid "KH " and resid 77 and name HD3 )) (( segid "KH " and resid 77 and name HD2 )) 2.400 0.700 0.700 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.22729E-02 ppm1 3.800 ppm2 3.961 CV 1 ASSI { 1046} (( segid "KH " and resid 70 and name HG3 )) (( segid "KH " and resid 70 and name HA )) 3.900 1.900 1.900 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.78550E-03 ppm1 1.006 ppm2 3.976 CV 1 ASSI { 1047} (( segid "KH " and resid 76 and name HB2 )) (( segid "KH " and resid 77 and name HD2 )) 2.800 1.000 1.000 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.10501E-02 ppm1 2.456 ppm2 3.979 CV 1 ASSI { 1048} (( segid "KH " and resid 76 and name HB3 )) (( segid "KH " and resid 77 and name HD2 )) 3.600 1.600 1.600 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.10836E-02 ppm1 2.388 ppm2 3.982 CV 1 ASSI { 1065} (( segid "KH " and resid 22 and name HB3 )) (( segid "KH " and resid 22 and name HA )) 2.700 0.900 0.900 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.27270E-02 ppm1 1.822 ppm2 3.983 CV 1 ASSI { 1066} (( segid "KH " and resid 38 and name HG12)) (( segid "KH " and resid 38 and name HA )) 2.800 1.000 1.000 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.36740E-02 ppm1 1.653 ppm2 3.969 CV 1 ASSI { 1070} ( segid "KH " and resid 111 and name HG1%) (( segid "KH " and resid 112 and name HD2 )) 2.300 2.300 3.700 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.62423E-02 ppm1 0.688 ppm2 3.912 CV 1 ASSI { 1073} ( segid "KH " and resid 113 and name HB% ) (( segid "KH " and resid 113 and name HA )) 2.200 0.600 0.600 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.78191E-02 ppm1 1.383 ppm2 3.971 CV 1 ASSI { 1081} (( segid "KH " and resid 38 and name HB )) (( segid "KH " and resid 38 and name HA )) 3.000 1.200 1.200 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.18050E-02 ppm1 1.928 ppm2 3.962 CV 1 ASSI { 1082} (( segid "KH " and resid 45 and name HB )) (( segid "KH " and resid 45 and name HA )) 2.400 0.700 0.700 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.48718E-02 ppm1 2.076 ppm2 3.951 CV 1 ASSI { 1083} (( segid "KH " and resid 111 and name HB )) (( segid "KH " and resid 112 and name HD2 )) 2.800 1.000 1.000 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.21309E-02 ppm1 1.977 ppm2 3.918 CV 1 ASSI { 1087} (( segid "KH " and resid 38 and name HG13)) (( segid "KH " and resid 38 and name HA )) 3.900 1.900 1.900 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.11003E-02 ppm1 1.118 ppm2 3.956 CV 1 ASSI { 1088} (( segid "KH " and resid 171 and name HG2 )) (( segid "KH " and resid 171 and name HA )) 3.300 1.400 1.400 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.25264E-02 ppm1 1.877 ppm2 3.891 CV 1 ASSI { 1089} (( segid "KH " and resid 171 and name HG3 )) (( segid "KH " and resid 171 and name HA )) 3.000 1.100 1.100 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.25292E-02 ppm1 1.709 ppm2 3.884 CV 1 ASSI { 1092} (( segid "KH " and resid 174 and name HG )) (( segid "KH " and resid 174 and name HA )) 2.800 1.000 1.000 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.20000E-02 ppm1 1.908 ppm2 3.898 CV 1 ASSI { 1097} ( segid "KH " and resid 116 and name HB% ) (( segid "KH " and resid 113 and name HA )) 2.900 1.000 1.000 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.17298E-02 ppm1 1.200 ppm2 3.978 CV 1 ASSI { 1104} ( segid "KH " and resid 45 and name HD1%) (( segid "KH " and resid 45 and name HA )) 2.400 0.700 0.700 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.53787E-02 ppm1 0.763 ppm2 3.949 CV 1 ASSI { 1107} (( segid "KH " and resid 177 and name HB )) (( segid "KH " and resid 177 and name HA )) 2.700 0.900 0.900 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.36183E-02 ppm1 2.159 ppm2 3.836 CV 1 ASSI { 1108} (( segid "KH " and resid 45 and name HG12)) (( segid "KH " and resid 45 and name HA )) 3.100 1.200 1.200 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.29052E-02 ppm1 1.427 ppm2 3.914 CV 1 ASSI { 1122} (( segid "KH " and resid 88 and name HB2 )) (( segid "KH " and resid 88 and name HA )) 3.100 1.200 1.200 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.12674E-02 ppm1 2.897 ppm2 3.830 CV 1 ASSI { 1127} (( segid "KH " and resid 84 and name HB2 )) (( segid "KH " and resid 84 and name HA )) 3.500 1.500 1.500 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.64902E-03 ppm1 2.301 ppm2 3.817 CV 1 ASSI { 1133} ( segid "KH " and resid 83 and name HB% ) (( segid "KH " and resid 80 and name HA )) 3.100 1.200 1.200 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.16323E-02 ppm1 1.240 ppm2 3.810 CV 1 ASSI { 1147} (( segid "KH " and resid 150 and name HB2 )) (( segid "KH " and resid 150 and name HA )) 3.000 1.100 1.100 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.30250E-02 ppm1 2.430 ppm2 3.757 CV 1 ASSI { 1154} (( segid "KH " and resid 29 and name HA )) (( segid "KH " and resid 30 and name HD2 )) 2.400 0.700 0.700 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.46740E-02 ppm1 4.936 ppm2 3.778 CV 1 ASSI { 1158} (( segid "KH " and resid 76 and name HB2 )) (( segid "KH " and resid 77 and name HD3 )) 4.400 2.400 1.600 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.61002E-03 ppm1 2.455 ppm2 3.758 CV 1 ASSI { 1167} ( segid "KH " and resid 33 and name HB% ) (( segid "KH " and resid 30 and name HD2 )) 3.100 1.200 1.200 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.13231E-02 ppm1 0.555 ppm2 3.781 CV 1 ASSI { 1173} (( segid "KH " and resid 37 and name HB )) (( segid "KH " and resid 37 and name HA )) 3.100 1.200 1.200 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.15153E-02 ppm1 1.923 ppm2 3.776 CV 1 ASSI { 1177} (( segid "KH " and resid 37 and name HG13)) (( segid "KH " and resid 37 and name HA )) 3.800 1.800 1.800 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.14039E-02 ppm1 1.162 ppm2 3.781 CV 1 ASSI { 1182} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 37 and name HA )) 2.400 0.700 0.700 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.46685E-02 ppm1 0.619 ppm2 3.783 CV 1 ASSI { 1191} (( segid "KH " and resid 141 and name HG3 )) (( segid "KH " and resid 141 and name HD3 )) 2.000 0.500 0.500 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.16203E-01 ppm1 2.060 ppm2 3.792 CV 1 OR { 1191} (( segid "KH " and resid 141 and name HG2 )) (( segid "KH " and resid 141 and name HD2 )) OR { 1191} (( segid "KH " and resid 141 and name HG2 )) (( segid "KH " and resid 141 and name HD3 )) OR { 1191} (( segid "KH " and resid 141 and name HG3 )) (( segid "KH " and resid 141 and name HD2 )) ASSI { 1211} (( segid "KH " and resid 173 and name HG12)) (( segid "KH " and resid 173 and name HA )) 3.000 1.100 1.100 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.12980E-02 ppm1 1.827 ppm2 3.640 CV 1 ASSI { 1212} (( segid "KH " and resid 173 and name HG13)) (( segid "KH " and resid 173 and name HA )) 3.100 1.200 1.200 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.20668E-02 ppm1 0.992 ppm2 3.642 CV 1 ASSI { 1214} (( segid "KH " and resid 99 and name HG3 )) (( segid "KH " and resid 99 and name HD3 )) 2.000 0.500 0.500 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.17030E-01 ppm1 2.031 ppm2 3.685 CV 1 OR { 1214} (( segid "KH " and resid 99 and name HG2 )) (( segid "KH " and resid 99 and name HD2 )) OR { 1214} (( segid "KH " and resid 99 and name HG2 )) (( segid "KH " and resid 99 and name HD3 )) OR { 1214} (( segid "KH " and resid 99 and name HG3 )) (( segid "KH " and resid 99 and name HD2 )) ASSI { 1219} ( segid "KH " and resid 173 and name HD1%) (( segid "KH " and resid 119 and name HA )) 2.900 1.000 1.000 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.27130E-02 ppm1 0.727 ppm2 3.335 CV 1 ASSI { 1242} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 146 and name HD3 )) 2.900 1.000 1.000 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 1.630 ppm2 3.619 CV 1 OR { 1242} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 146 and name HD3 )) ASSI { 1264} (( segid "KH " and resid 87 and name HG13)) (( segid "KH " and resid 87 and name HA )) 3.400 1.400 1.400 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.14262E-02 ppm1 0.963 ppm2 3.544 CV 1 ASSI { 1267} (( segid "KH " and resid 159 and name HA )) (( segid "KH " and resid 159 and name HB2 )) 3.300 1.300 1.300 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.13509E-02 ppm1 5.638 ppm2 3.581 CV 1 ASSI { 1273} (( segid "KH " and resid 111 and name HA )) (( segid "KH " and resid 112 and name HD3 )) 2.700 0.900 0.900 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.25097E-02 ppm1 4.857 ppm2 3.312 CV 1 ASSI { 1274} (( segid "KH " and resid 112 and name HD2 )) (( segid "KH " and resid 112 and name HD3 )) 2.400 0.700 0.700 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.20279E-02 ppm1 3.915 ppm2 3.312 CV 1 ASSI { 1276} (( segid "KH " and resid 51 and name HB3 )) (( segid "KH " and resid 51 and name HB2 )) 2.400 0.700 0.700 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.23203E-02 ppm1 3.105 ppm2 3.344 CV 1 ASSI { 1280} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 112 and name HD3 )) 3.700 1.700 1.700 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.12618E-02 ppm1 0.845 ppm2 3.332 CV 1 ASSI { 1281} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 112 and name HD3 )) 3.000 1.100 1.100 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.34568E-02 ppm1 0.683 ppm2 3.328 CV 1 ASSI { 1295} (( segid "KH " and resid 147 and name HB3 )) (( segid "KH " and resid 147 and name HB2 )) 2.400 0.700 0.700 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.27604E-02 ppm1 2.785 ppm2 3.315 CV 1 ASSI { 1297} (( segid "KH " and resid 34 and name HB )) (( segid "KH " and resid 34 and name HA )) 2.600 0.900 0.900 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.32479E-02 ppm1 1.961 ppm2 3.239 CV 1 ASSI { 1298} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 34 and name HA )) 2.400 0.700 0.700 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.49916E-02 ppm1 0.939 ppm2 3.234 CV 1 ASSI { 1304} (( segid "KH " and resid 159 and name HA )) (( segid "KH " and resid 159 and name HB3 )) 3.000 1.100 1.100 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.16156E-02 ppm1 5.639 ppm2 3.181 CV 1 ASSI { 1305} (( segid "KH " and resid 97 and name HB3 )) (( segid "KH " and resid 97 and name HB2 )) 2.200 0.600 0.600 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.46573E-02 ppm1 2.759 ppm2 3.234 CV 1 ASSI { 1316} (( segid "KH " and resid 30 and name HD2 )) (( segid "KH " and resid 30 and name HD3 )) 2.400 0.700 0.700 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.22590E-02 ppm1 3.769 ppm2 3.198 CV 1 ASSI { 1338} (( segid "KH " and resid 44 and name HB3 )) (( segid "KH " and resid 44 and name HB2 )) 2.500 0.800 0.800 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.20947E-02 ppm1 2.905 ppm2 3.150 CV 1 ASSI { 1346} (( segid "KH " and resid 178 and name HA )) (( segid "KH " and resid 181 and name HB3 )) 2.900 1.000 1.000 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.20362E-02 ppm1 4.141 ppm2 3.091 CV 1 ASSI { 1364} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HE3 )) 2.100 0.500 0.500 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.15172E-01 ppm1 1.759 ppm2 3.043 CV 1 OR { 1364} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HE2 )) ASSI { 1371} (( segid "KH " and resid 149 and name HB3 )) (( segid "KH " and resid 149 and name HB2 )) 2.200 0.600 0.600 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.53620E-02 ppm1 2.627 ppm2 2.937 CV 1 ASSI { 1382} (( segid "KH " and resid 95 and name HB3 )) (( segid "KH " and resid 95 and name HB2 )) 1.800 0.400 0.400 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.20855E-01 ppm1 2.689 ppm2 2.869 CV 1 ASSI { 1404} (( segid "KH " and resid 96 and name HA )) (( segid "KH " and resid 96 and name HB3 )) 2.500 0.800 0.800 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.57186E-02 ppm1 4.135 ppm2 2.825 CV 1 OR { 1404} (( segid "KH " and resid 96 and name HA )) (( segid "KH " and resid 96 and name HB2 )) ASSI { 1408} (( segid "KH " and resid 88 and name HA )) (( segid "KH " and resid 88 and name HB3 )) 3.300 1.300 1.300 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.13342E-02 ppm1 3.849 ppm2 2.716 CV 1 ASSI { 1411} (( segid "KH " and resid 169 and name HA )) (( segid "KH " and resid 172 and name HB3 )) 3.600 1.600 1.600 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.10557E-02 ppm1 4.138 ppm2 2.687 CV 1 ASSI { 1413} (( segid "KH " and resid 172 and name HB2 )) (( segid "KH " and resid 172 and name HB3 )) 2.100 0.600 0.600 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.58941E-02 ppm1 2.870 ppm2 2.686 CV 1 ASSI { 1428} (( segid "KH " and resid 165 and name HA )) (( segid "KH " and resid 165 and name HG2 )) 3.100 1.200 1.200 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.18774E-02 ppm1 4.080 ppm2 2.527 CV 1 ASSI { 1445} (( segid "KH " and resid 28 and name HA )) (( segid "KH " and resid 28 and name HB3 )) 2.800 1.000 1.000 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.22980E-02 ppm1 4.971 ppm2 2.521 CV 1 ASSI { 1446} (( segid "KH " and resid 28 and name HB2 )) (( segid "KH " and resid 28 and name HB3 )) 2.500 0.800 0.800 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.19471E-02 ppm1 3.028 ppm2 2.525 CV 1 ASSI { 1457} (( segid "KH " and resid 76 and name HA )) (( segid "KH " and resid 76 and name HB2 )) 3.200 1.300 1.300 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.14874E-02 ppm1 5.172 ppm2 2.463 CV 1 ASSI { 1469} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HG3 )) 1.700 0.300 0.500 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.25381E-01 ppm1 2.603 ppm2 2.407 CV 1 ASSI { 1481} (( segid "KH " and resid 150 and name HG3 )) (( segid "KH " and resid 150 and name HB2 )) 2.000 0.500 0.500 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.21994E-01 ppm1 2.234 ppm2 2.433 CV 1 OR { 1481} (( segid "KH " and resid 150 and name HG2 )) (( segid "KH " and resid 150 and name HB2 )) ASSI { 1484} (( segid "KH " and resid 176 and name HB3 )) (( segid "KH " and resid 176 and name HG3 )) 2.200 0.600 0.600 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.12944E-01 ppm1 2.165 ppm2 2.388 CV 1 OR { 1484} (( segid "KH " and resid 176 and name HB2 )) (( segid "KH " and resid 176 and name HG3 )) ASSI { 1492} (( segid "KH " and resid 62 and name HA )) (( segid "KH " and resid 62 and name HG2 )) 2.700 0.900 0.900 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.60918E-02 ppm1 4.046 ppm2 2.353 CV 1 OR { 1492} (( segid "KH " and resid 62 and name HA )) (( segid "KH " and resid 62 and name HG3 )) ASSI { 1497} (( segid "KH " and resid 93 and name HB2 )) (( segid "KH " and resid 93 and name HG3 )) 2.300 0.700 0.700 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.73952E-02 ppm1 2.209 ppm2 2.353 CV 1 ASSI { 1502} (( segid "KH " and resid 94 and name HA )) (( segid "KH " and resid 94 and name HB2 )) 2.300 0.700 0.700 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.72925E-02 ppm1 4.329 ppm2 2.328 CV 1 ASSI { 1513} (( segid "KH " and resid 94 and name HB3 )) (( segid "KH " and resid 94 and name HB2 )) 2.000 0.500 0.500 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.53871E-02 ppm1 1.793 ppm2 2.334 CV 1 ASSI { 1518} (( segid "KH " and resid 141 and name HG3 )) (( segid "KH " and resid 141 and name HB2 )) 2.000 0.500 0.500 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.14479E-01 ppm1 2.060 ppm2 2.310 CV 1 OR { 1518} (( segid "KH " and resid 141 and name HG2 )) (( segid "KH " and resid 141 and name HB2 )) ASSI { 1527} (( segid "KH " and resid 165 and name HG2 )) (( segid "KH " and resid 165 and name HG3 )) 2.200 0.600 0.600 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.53063E-02 ppm1 2.530 ppm2 2.269 CV 1 ASSI { 1531} ( segid "KH " and resid 79 and name HB% ) (( segid "KH " and resid 78 and name HG3 )) 2.800 2.800 3.200 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.13370E-02 ppm1 1.420 ppm2 2.326 CV 1 OR { 1531} ( segid "KH " and resid 79 and name HB% ) (( segid "KH " and resid 78 and name HG2 )) ASSI { 1534} (( segid "KH " and resid 151 and name HA )) (( segid "KH " and resid 151 and name HB2 )) 3.200 1.300 1.300 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.16351E-02 ppm1 5.091 ppm2 2.303 CV 1 ASSI { 1545} (( segid "KH " and resid 21 and name HB2 )) (( segid "KH " and resid 21 and name HG3 )) 2.000 0.500 0.500 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.24969E-01 ppm1 2.041 ppm2 2.237 CV 1 OR { 1545} (( segid "KH " and resid 21 and name HB2 )) (( segid "KH " and resid 21 and name HG2 )) ASSI { 1553} (( segid "KH " and resid 80 and name HA )) (( segid "KH " and resid 80 and name HB3 )) 3.100 1.200 1.200 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.16239E-02 ppm1 3.794 ppm2 2.221 CV 1 OR { 1553} (( segid "KH " and resid 80 and name HA )) (( segid "KH " and resid 80 and name HB2 )) ASSI { 1559} (( segid "KH " and resid 150 and name HB2 )) (( segid "KH " and resid 150 and name HB3 )) 1.800 0.400 0.400 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.16000E-01 ppm1 2.437 ppm2 2.216 CV 1 ASSI { 1565} (( segid "KH " and resid 167 and name HA )) (( segid "KH " and resid 167 and name HB2 )) 3.400 1.500 1.500 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.94153E-03 ppm1 3.594 ppm2 2.107 CV 1 ASSI { 1570} (( segid "KH " and resid 174 and name HA )) (( segid "KH " and resid 177 and name HB )) 3.300 1.400 1.400 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.10083E-02 ppm1 3.909 ppm2 2.149 CV 1 ASSI { 1576} (( segid "KH " and resid 92 and name HG3 )) (( segid "KH " and resid 92 and name HB2 )) 2.400 0.700 0.700 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.53704E-02 ppm1 1.528 ppm2 2.185 CV 1 OR { 1576} (( segid "KH " and resid 92 and name HG2 )) (( segid "KH " and resid 92 and name HB2 )) ASSI { 1584} (( segid "KH " and resid 94 and name HA )) (( segid "KH " and resid 94 and name HG2 )) 2.700 0.900 0.900 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.49526E-02 ppm1 4.329 ppm2 2.189 CV 1 OR { 1584} (( segid "KH " and resid 94 and name HA )) (( segid "KH " and resid 94 and name HG3 )) ASSI { 1590} (( segid "KH " and resid 102 and name HB3 )) (( segid "KH " and resid 102 and name HG2 )) 2.600 0.900 0.900 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.47493E-02 ppm1 1.786 ppm2 2.215 CV 1 OR { 1590} (( segid "KH " and resid 102 and name HB3 )) (( segid "KH " and resid 102 and name HG3 )) ASSI { 1601} (( segid "KH " and resid 165 and name HG2 )) (( segid "KH " and resid 165 and name HB3 )) 3.300 1.400 1.400 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.10139E-02 ppm1 2.530 ppm2 2.140 CV 1 OR { 1601} (( segid "KH " and resid 165 and name HG2 )) (( segid "KH " and resid 165 and name HB2 )) ASSI { 1602} ( segid "KH " and resid 119 and name HG1%) (( segid "KH " and resid 119 and name HB )) 2.400 0.700 0.700 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.55375E-02 ppm1 0.730 ppm2 1.936 CV 1 ASSI { 1604} (( segid "KH " and resid 62 and name HA )) (( segid "KH " and resid 62 and name HB3 )) 2.200 0.600 0.600 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.13749E-01 ppm1 4.046 ppm2 2.114 CV 1 OR { 1604} (( segid "KH " and resid 62 and name HA )) (( segid "KH " and resid 62 and name HB2 )) ASSI { 1607} (( segid "KH " and resid 91 and name HB3 )) (( segid "KH " and resid 91 and name HB2 )) 2.300 0.700 0.700 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.20111E-02 ppm1 1.530 ppm2 2.118 CV 1 ASSI { 1635} (( segid "KH " and resid 171 and name HA )) (( segid "KH " and resid 171 and name HB2 )) 2.800 1.000 1.000 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.25988E-02 ppm1 3.877 ppm2 2.034 CV 1 OR { 1635} (( segid "KH " and resid 171 and name HA )) (( segid "KH " and resid 171 and name HB3 )) ASSI { 1648} (( segid "KH " and resid 148 and name HA )) (( segid "KH " and resid 148 and name HB2 )) 2.200 0.600 0.600 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.11217E-01 ppm1 4.190 ppm2 2.056 CV 1 OR { 1648} (( segid "KH " and resid 148 and name HA )) (( segid "KH " and resid 148 and name HB3 )) ASSI { 1649} (( segid "KH " and resid 179 and name HA )) (( segid "KH " and resid 179 and name HB2 )) 2.100 0.500 0.500 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.18106E-01 ppm1 4.205 ppm2 2.016 CV 1 OR { 1649} (( segid "KH " and resid 179 and name HA )) (( segid "KH " and resid 179 and name HB3 )) ASSI { 1670} (( segid "KH " and resid 100 and name HA )) (( segid "KH " and resid 100 and name HB2 )) 2.500 0.800 0.800 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.88048E-02 ppm1 4.358 ppm2 2.000 CV 1 ASSI { 1687} (( segid "KH " and resid 78 and name HA )) (( segid "KH " and resid 78 and name HB3 )) 2.600 0.900 0.900 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.34094E-02 ppm1 4.133 ppm2 2.001 CV 1 ASSI { 1688} (( segid "KH " and resid 111 and name HA )) (( segid "KH " and resid 111 and name HB )) 2.400 0.700 0.700 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.60751E-02 ppm1 4.851 ppm2 1.988 CV 1 ASSI { 1702} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 25 and name HB )) 3.300 1.400 1.400 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.20752E-02 ppm1 1.105 ppm2 2.017 CV 1 ASSI { 1712} (( segid "KH " and resid 170 and name HA )) (( segid "KH " and resid 173 and name HB )) 2.800 1.000 1.000 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.19722E-02 ppm1 3.545 ppm2 1.927 CV 1 ASSI { 1713} (( segid "KH " and resid 173 and name HA )) (( segid "KH " and resid 173 and name HB )) 3.200 1.300 1.300 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.13844E-02 ppm1 3.648 ppm2 1.931 CV 1 ASSI { 1724} (( segid "KH " and resid 77 and name HA )) (( segid "KH " and resid 77 and name HB3 )) 2.900 1.100 1.100 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.14930E-02 ppm1 4.006 ppm2 1.941 CV 1 ASSI { 1740} (( segid "KH " and resid 76 and name HG2 )) (( segid "KH " and resid 76 and name HG3 )) 2.000 0.500 0.500 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.59025E-02 ppm1 2.222 ppm2 1.958 CV 1 ASSI { 1743} (( segid "KH " and resid 90 and name HG3 )) (( segid "KH " and resid 90 and name HB2 )) 2.600 0.900 0.900 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.34039E-02 ppm1 1.211 ppm2 1.942 CV 1 OR { 1743} (( segid "KH " and resid 90 and name HG2 )) (( segid "KH " and resid 90 and name HB3 )) OR { 1743} (( segid "KH " and resid 90 and name HG2 )) (( segid "KH " and resid 90 and name HB2 )) OR { 1743} (( segid "KH " and resid 90 and name HG3 )) (( segid "KH " and resid 90 and name HB3 )) ASSI { 1758} (( segid "KH " and resid 164 and name HA )) (( segid "KH " and resid 164 and name HG3 )) 3.500 1.500 1.500 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.92476E-03 ppm1 3.636 ppm2 1.925 CV 1 OR { 1758} (( segid "KH " and resid 164 and name HA )) (( segid "KH " and resid 164 and name HG2 )) ASSI { 1784} (( segid "KH " and resid 82 and name HD2 )) (( segid "KH " and resid 82 and name HB2 )) 3.000 1.100 1.100 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.20083E-02 ppm1 1.462 ppm2 1.846 CV 1 ASSI { 1785} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 174 and name HB2 )) 2.200 0.600 0.600 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.98108E-02 ppm1 0.845 ppm2 1.897 CV 1 ASSI { 1789} (( segid "KH " and resid 175 and name HA )) (( segid "KH " and resid 178 and name HB3 )) 3.100 1.200 1.200 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.16908E-02 ppm1 4.163 ppm2 1.835 CV 1 OR { 1789} (( segid "KH " and resid 175 and name HA )) (( segid "KH " and resid 178 and name HB2 )) ASSI { 1804} (( segid "KH " and resid 22 and name HG2 )) (( segid "KH " and resid 22 and name HB3 )) 2.400 0.700 0.700 peak 1804 spectrum 1 weight 0.10000E+01 volume 0.48551E-02 ppm1 2.265 ppm2 1.835 CV 1 ASSI { 1823} (( segid "KH " and resid 170 and name HA )) (( segid "KH " and resid 170 and name HB )) 2.700 0.900 0.900 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.25905E-02 ppm1 3.545 ppm2 1.776 CV 1 ASSI { 1838} ( segid "KH " and resid 138 and name HG2%) (( segid "KH " and resid 138 and name HB )) 2.600 0.800 0.800 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.33927E-02 ppm1 0.478 ppm2 1.672 CV 1 ASSI { 1843} ( segid "KH " and resid 170 and name HG2%) (( segid "KH " and resid 170 and name HB )) 2.200 0.600 0.600 peak 1843 spectrum 1 weight 0.10000E+01 volume 0.95653E-02 ppm1 0.682 ppm2 1.777 CV 1 ASSI { 1844} ( segid "KH " and resid 170 and name HD1%) (( segid "KH " and resid 170 and name HB )) 2.300 0.700 0.700 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.86236E-02 ppm1 0.608 ppm2 1.779 CV 1 ASSI { 1853} (( segid "KH " and resid 151 and name HG2 )) (( segid "KH " and resid 151 and name HG3 )) 2.000 0.500 0.500 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.76515E-02 ppm1 2.334 ppm2 1.742 CV 1 ASSI { 1879} (( segid "KH " and resid 83 and name HA )) (( segid "KH " and resid 86 and name HB3 )) 2.900 1.100 1.100 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.24540E-02 ppm1 3.986 ppm2 1.910 CV 1 OR { 1879} (( segid "KH " and resid 83 and name HA )) (( segid "KH " and resid 86 and name HB2 )) ASSI { 1884} (( segid "KH " and resid 70 and name HB3 )) (( segid "KH " and resid 70 and name HB2 )) 2.500 0.800 0.800 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.21197E-02 ppm1 1.464 ppm2 1.758 CV 1 ASSI { 1897} (( segid "KH " and resid 130 and name HB2 )) (( segid "KH " and resid 130 and name HB3 )) 2.300 0.600 0.600 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.32200E-02 ppm1 1.870 ppm2 1.686 CV 1 ASSI { 1899} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 57 and name HB2 )) 1.800 0.400 0.400 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.14501E-01 ppm1 1.615 ppm2 1.738 CV 1 ASSI { 1912} (( segid "KH " and resid 38 and name HB )) (( segid "KH " and resid 38 and name HG12)) 2.600 0.900 0.900 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.25069E-02 ppm1 1.931 ppm2 1.652 CV 1 ASSI { 1950} (( segid "KH " and resid 67 and name HB2 )) (( segid "KH " and resid 67 and name HG2 )) 2.700 0.900 0.900 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.37911E-02 ppm1 2.117 ppm2 1.634 CV 1 ASSI { 1961} (( segid "KH " and resid 46 and name HA )) (( segid "KH " and resid 46 and name HG2 )) 2.700 0.900 0.900 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.25348E-02 ppm1 4.140 ppm2 1.625 CV 1 ASSI { 1966} (( segid "KH " and resid 104 and name HB3 )) (( segid "KH " and resid 104 and name HB2 )) 2.000 0.500 0.500 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.75737E-02 ppm1 1.503 ppm2 1.625 CV 1 ASSI { 1969} (( segid "KH " and resid 48 and name HG )) (( segid "KH " and resid 48 and name HB2 )) 2.300 0.600 0.600 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.69139E-02 ppm1 1.506 ppm2 1.603 CV 1 ASSI { 1997} (( segid "KH " and resid 30 and name HB2 )) (( segid "KH " and resid 30 and name HB3 )) 2.100 0.500 0.500 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.56016E-02 ppm1 2.523 ppm2 1.565 CV 1 ASSI { 2007} ( segid "KH " and resid 56 and name HG2%) (( segid "KH " and resid 56 and name HB )) 2.200 0.600 0.600 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.76068E-02 ppm1 0.615 ppm2 1.559 CV 1 ASSI { 2009} (( segid "KH " and resid 171 and name HA )) (( segid "KH " and resid 174 and name HB3 )) 2.800 1.000 1.000 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.19164E-02 ppm1 3.877 ppm2 1.489 CV 1 ASSI { 2010} (( segid "KH " and resid 92 and name HA )) (( segid "KH " and resid 92 and name HG2 )) 2.700 0.900 0.900 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.41058E-02 ppm1 4.305 ppm2 1.530 CV 1 OR { 2010} (( segid "KH " and resid 92 and name HA )) (( segid "KH " and resid 92 and name HG3 )) ASSI { 2013} (( segid "KH " and resid 174 and name HA )) (( segid "KH " and resid 174 and name HB3 )) 3.000 1.100 1.100 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.22729E-02 ppm1 3.910 ppm2 1.513 CV 1 ASSI { 2014} (( segid "KH " and resid 175 and name HA )) ( segid "KH " and resid 175 and name HB% ) 2.200 0.600 0.600 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.11187E-01 ppm1 4.163 ppm2 1.536 CV 1 ASSI { 2018} (( segid "KH " and resid 174 and name HB2 )) (( segid "KH " and resid 174 and name HB3 )) 2.200 0.600 0.600 peak 2018 spectrum 1 weight 0.10000E+01 volume 0.33342E-02 ppm1 1.890 ppm2 1.506 CV 1 ASSI { 2025} (( segid "KH " and resid 92 and name HB3 )) (( segid "KH " and resid 92 and name HG3 )) 2.400 0.700 0.700 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.70471E-02 ppm1 1.961 ppm2 1.529 CV 1 OR { 2025} (( segid "KH " and resid 92 and name HB3 )) (( segid "KH " and resid 92 and name HG2 )) ASSI { 2043} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 29 and name HB )) 2.600 0.800 0.800 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.46239E-02 ppm1 0.443 ppm2 1.551 CV 1 ASSI { 2044} (( segid "KH " and resid 37 and name HA )) (( segid "KH " and resid 37 and name HG12)) 3.100 1.200 1.200 peak 2044 spectrum 1 weight 0.10000E+01 volume 0.15571E-02 ppm1 3.785 ppm2 1.500 CV 1 ASSI { 2052} (( segid "KH " and resid 37 and name HB )) (( segid "KH " and resid 37 and name HG12)) 2.800 1.000 1.000 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.17994E-02 ppm1 1.923 ppm2 1.500 CV 1 ASSI { 2055} (( segid "KH " and resid 155 and name HB2 )) (( segid "KH " and resid 155 and name HB3 )) 2.000 0.500 0.500 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.69916E-02 ppm1 1.627 ppm2 1.493 CV 1 ASSI { 2057} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 105 and name HB2 )) 3.000 1.100 1.100 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.22368E-02 ppm1 -0.158 ppm2 1.557 CV 1 ASSI { 2059} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 37 and name HG12)) 2.400 0.700 0.700 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.45236E-02 ppm1 0.620 ppm2 1.497 CV 1 ASSI { 2071} (( segid "KH " and resid 48 and name HB2 )) (( segid "KH " and resid 48 and name HB3 )) 1.700 0.300 0.500 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.17298E-01 ppm1 1.611 ppm2 1.509 CV 1 ASSI { 2077} (( segid "KH " and resid 70 and name HG3 )) (( segid "KH " and resid 70 and name HB3 )) 3.500 1.500 1.500 peak 2077 spectrum 1 weight 0.10000E+01 volume 0.16518E-02 ppm1 1.000 ppm2 1.482 CV 1 ASSI { 2086} (( segid "KH " and resid 178 and name HA )) (( segid "KH " and resid 178 and name HG3 )) 2.900 1.000 1.000 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 4.142 ppm2 1.405 CV 1 ASSI { 2092} (( segid "KH " and resid 82 and name HE3 )) (( segid "KH " and resid 82 and name HD2 )) 3.000 1.200 1.200 peak 2092 spectrum 1 weight 0.10000E+01 volume 0.15543E-02 ppm1 2.755 ppm2 1.461 CV 1 OR { 2092} (( segid "KH " and resid 82 and name HE2 )) (( segid "KH " and resid 82 and name HD2 )) ASSI { 2095} (( segid "KH " and resid 45 and name HB )) (( segid "KH " and resid 45 and name HG12)) 2.600 0.800 0.800 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.19861E-02 ppm1 2.075 ppm2 1.428 CV 1 ASSI { 2101} (( segid "KH " and resid 45 and name HG13)) (( segid "KH " and resid 45 and name HG12)) 1.800 0.400 0.400 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.86351E-02 ppm1 1.226 ppm2 1.422 CV 1 ASSI { 2102} (( segid "KH " and resid 157 and name HG13)) (( segid "KH " and resid 157 and name HG12)) 2.000 0.500 0.500 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.55041E-02 ppm1 1.090 ppm2 1.461 CV 1 ASSI { 2106} ( segid "KH " and resid 54 and name HB% ) ( segid "KH " and resid 52 and name HB% ) 2.400 0.700 0.700 peak 2106 spectrum 1 weight 0.10000E+01 volume 0.77522E-02 ppm1 1.036 ppm2 1.419 CV 1 ASSI { 2107} ( segid "KH " and resid 56 and name HG2%) (( segid "KH " and resid 45 and name HG12)) 2.700 2.700 3.300 peak 2107 spectrum 1 weight 0.10000E+01 volume 0.56072E-02 ppm1 0.615 ppm2 1.436 CV 1 ASSI { 2113} (( segid "KH " and resid 52 and name HA )) ( segid "KH " and resid 52 and name HB% ) 2.500 0.800 0.800 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.52200E-02 ppm1 3.877 ppm2 1.408 CV 1 ASSI { 2122} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 105 and name HB3 )) 3.300 1.300 1.300 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.15125E-02 ppm1 -0.158 ppm2 1.460 CV 1 ASSI { 2127} (( segid "KH " and resid 100 and name HA )) (( segid "KH " and resid 100 and name HG2 )) 2.500 0.800 0.800 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.70586E-02 ppm1 4.357 ppm2 1.394 CV 1 OR { 2127} (( segid "KH " and resid 100 and name HA )) (( segid "KH " and resid 100 and name HG3 )) ASSI { 2130} (( segid "KH " and resid 105 and name HA )) (( segid "KH " and resid 105 and name HB3 )) 3.000 1.100 1.100 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.14847E-02 ppm1 4.946 ppm2 1.423 CV 1 ASSI { 2152} (( segid "KH " and resid 115 and name HA )) ( segid "KH " and resid 115 and name HB% ) 2.300 0.600 0.600 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.81227E-02 ppm1 4.448 ppm2 1.322 CV 1 ASSI { 2157} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 110 and name HG3 )) 2.600 0.800 0.800 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.25543E-02 ppm1 2.980 ppm2 1.348 CV 1 ASSI { 2160} (( segid "KH " and resid 58 and name HB )) (( segid "KH " and resid 58 and name HG12)) 2.900 1.000 1.000 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.34735E-02 ppm1 1.754 ppm2 1.364 CV 1 ASSI { 2165} (( segid "KH " and resid 110 and name HB2 )) (( segid "KH " and resid 110 and name HG3 )) 2.900 1.000 1.000 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.26379E-02 ppm1 1.690 ppm2 1.362 CV 1 ASSI { 2169} (( segid "KH " and resid 109 and name HG13)) (( segid "KH " and resid 109 and name HG12)) 2.400 0.700 0.700 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.23259E-02 ppm1 0.979 ppm2 1.288 CV 1 ASSI { 2181} ( segid "KH " and resid 109 and name HD1%) (( segid "KH " and resid 109 and name HG12)) 2.400 0.700 0.700 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.53230E-02 ppm1 0.703 ppm2 1.297 CV 1 ASSI { 2191} (( segid "KH " and resid 70 and name HB2 )) (( segid "KH " and resid 70 and name HG2 )) 3.000 1.100 1.100 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.35849E-02 ppm1 1.762 ppm2 1.303 CV 1 ASSI { 2193} (( segid "KH " and resid 70 and name HG3 )) (( segid "KH " and resid 70 and name HG2 )) 2.200 0.600 0.600 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.40445E-02 ppm1 0.996 ppm2 1.300 CV 1 ASSI { 2201} (( segid "KH " and resid 82 and name HE2 )) (( segid "KH " and resid 82 and name HD3 )) 3.200 1.300 1.300 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.12034E-02 ppm1 2.755 ppm2 1.328 CV 1 OR { 2201} (( segid "KH " and resid 82 and name HE3 )) (( segid "KH " and resid 82 and name HD3 )) ASSI { 2204} (( segid "KH " and resid 82 and name HB2 )) (( segid "KH " and resid 82 and name HD3 )) 3.000 1.100 1.100 peak 2204 spectrum 1 weight 0.10000E+01 volume 0.18357E-02 ppm1 1.851 ppm2 1.280 CV 1 ASSI { 2215} (( segid "KH " and resid 146 and name HD3 )) ( segid "KH " and resid 145 and name HG2%) 2.500 2.500 3.500 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.29303E-02 ppm1 3.619 ppm2 1.273 CV 1 ASSI { 2217} (( segid "KH " and resid 45 and name HB )) (( segid "KH " and resid 45 and name HG13)) 3.000 1.100 1.100 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.17214E-02 ppm1 2.076 ppm2 1.234 CV 1 ASSI { 2226} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 29 and name HG12)) 2.400 0.700 0.700 peak 2226 spectrum 1 weight 0.10000E+01 volume 0.55542E-02 ppm1 0.440 ppm2 1.265 CV 1 ASSI { 2245} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HG2 )) 2.700 0.900 0.900 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.21783E-02 ppm1 1.622 ppm2 1.247 CV 1 ASSI { 2246} (( segid "KH " and resid 104 and name HB3 )) (( segid "KH " and resid 104 and name HG2 )) 3.000 1.100 1.100 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.23482E-02 ppm1 1.501 ppm2 1.247 CV 1 ASSI { 2257} (( segid "KH " and resid 69 and name HB2 )) (( segid "KH " and resid 69 and name HB3 )) 2.500 0.800 0.800 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.18746E-02 ppm1 1.557 ppm2 1.221 CV 1 ASSI { 2281} (( segid "KH " and resid 58 and name HB )) (( segid "KH " and resid 58 and name HG13)) 2.600 0.800 0.800 peak 2281 spectrum 1 weight 0.10000E+01 volume 0.30167E-02 ppm1 1.757 ppm2 1.125 CV 1 ASSI { 2291} (( segid "KH " and resid 104 and name HE3 )) (( segid "KH " and resid 104 and name HG3 )) 2.900 1.100 1.100 peak 2291 spectrum 1 weight 0.10000E+01 volume 0.31504E-02 ppm1 2.921 ppm2 1.145 CV 1 OR { 2291} (( segid "KH " and resid 104 and name HE2 )) (( segid "KH " and resid 104 and name HG3 )) ASSI { 2305} (( segid "KH " and resid 46 and name HA )) ( segid "KH " and resid 45 and name HG2%) 3.400 1.500 1.500 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 4.140 ppm2 1.047 CV 1 ASSI { 2311} (( segid "KH " and resid 38 and name HB )) ( segid "KH " and resid 38 and name HG2%) 2.400 0.700 0.700 peak 2311 spectrum 1 weight 0.10000E+01 volume 0.65180E-02 ppm1 1.931 ppm2 1.083 CV 1 ASSI { 2312} (( segid "KH " and resid 45 and name HB )) ( segid "KH " and resid 45 and name HG2%) 2.300 0.700 0.700 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.52534E-02 ppm1 2.075 ppm2 1.054 CV 1 ASSI { 2316} (( segid "KH " and resid 155 and name HD2 )) (( segid "KH " and resid 155 and name HG2 )) 2.700 0.900 0.900 peak 2316 spectrum 1 weight 0.10000E+01 volume 0.43900E-02 ppm1 1.463 ppm2 1.052 CV 1 ASSI { 2323} ( segid "KH " and resid 38 and name HD1%) ( segid "KH " and resid 38 and name HG2%) 1.900 0.500 0.500 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.23008E-01 ppm1 0.763 ppm2 1.069 CV 1 ASSI { 2338} (( segid "KH " and resid 162 and name HA )) ( segid "KH " and resid 162 and name HB% ) 2.800 1.000 1.000 peak 2338 spectrum 1 weight 0.10000E+01 volume 0.25571E-02 ppm1 4.110 ppm2 0.943 CV 1 ASSI { 2344} ( segid "KH " and resid 79 and name HB% ) ( segid "KH " and resid 54 and name HB% ) 2.500 0.800 0.800 peak 2344 spectrum 1 weight 0.10000E+01 volume 0.54038E-02 ppm1 1.419 ppm2 1.037 CV 1 ASSI { 2358} (( segid "KH " and resid 70 and name HB2 )) (( segid "KH " and resid 70 and name HG3 )) 2.700 0.900 0.900 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.23872E-02 ppm1 1.759 ppm2 0.993 CV 1 ASSI { 2386} (( segid "KH " and resid 87 and name HA )) ( segid "KH " and resid 48 and name HD1%) 3.500 1.500 1.500 peak 2386 spectrum 1 weight 0.10000E+01 volume 0.13426E-02 ppm1 3.537 ppm2 0.952 CV 1 ASSI { 2389} (( segid "KH " and resid 48 and name HA )) ( segid "KH " and resid 48 and name HD1%) 2.800 1.000 1.000 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.41615E-02 ppm1 4.132 ppm2 0.945 CV 1 ASSI { 2407} (( segid "KH " and resid 37 and name HB )) ( segid "KH " and resid 34 and name HG1%) 3.100 1.200 1.200 peak 2407 spectrum 1 weight 0.10000E+01 volume 0.26379E-02 ppm1 1.923 ppm2 0.921 CV 1 ASSI { 2412} ( segid "KH " and resid 105 and name HD2%) ( segid "KH " and resid 105 and name HD1%) 2.300 0.700 0.700 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.92395E-02 ppm1 -0.158 ppm2 0.956 CV 1 ASSI { 2445} (( segid "KH " and resid 174 and name HG )) ( segid "KH " and resid 174 and name HD1%) 2.700 0.900 0.900 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.28941E-02 ppm1 1.909 ppm2 0.841 CV 1 ASSI { 2462} (( segid "KH " and resid 26 and name HA )) ( segid "KH " and resid 25 and name HG1%) 3.200 1.300 1.300 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.17075E-02 ppm1 5.687 ppm2 0.830 CV 1 ASSI { 2473} (( segid "KH " and resid 156 and name HG13)) ( segid "KH " and resid 156 and name HG2%) 2.600 0.800 0.800 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.63203E-02 ppm1 1.531 ppm2 0.792 CV 1 OR { 2473} (( segid "KH " and resid 156 and name HG12)) ( segid "KH " and resid 156 and name HG2%) ASSI { 2493} (( segid "KH " and resid 91 and name HB2 )) ( segid "KH " and resid 91 and name HD1%) 3.300 1.300 1.300 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.18022E-02 ppm1 2.118 ppm2 0.770 CV 1 ASSI { 2513} (( segid "KH " and resid 91 and name HG )) ( segid "KH " and resid 91 and name HD1%) 2.500 0.800 0.800 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.42061E-02 ppm1 1.970 ppm2 0.784 CV 1 ASSI { 2520} ( segid "KH " and resid 111 and name HG2%) ( segid "KH " and resid 111 and name HG1%) 2.200 0.600 0.600 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.12136E-01 ppm1 0.458 ppm2 0.688 CV 1 ASSI { 2521} ( segid "KH " and resid 116 and name HB% ) ( segid "KH " and resid 140 and name HG2%) 2.800 1.000 1.000 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.54651E-02 ppm1 1.201 ppm2 0.773 CV 1 ASSI { 2529} (( segid "KH " and resid 171 and name HA )) ( segid "KH " and resid 174 and name HD2%) 3.300 3.300 2.700 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.23509E-02 ppm1 3.875 ppm2 0.685 CV 1 ASSI { 2539} (( segid "KH " and resid 173 and name HB )) ( segid "KH " and resid 173 and name HD1%) 2.400 0.700 0.700 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.65097E-02 ppm1 1.955 ppm2 0.704 CV 1 ASSI { 2540} (( segid "KH " and resid 45 and name HB )) ( segid "KH " and resid 45 and name HD1%) 2.400 0.700 0.700 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.53230E-02 ppm1 2.077 ppm2 0.753 CV 1 ASSI { 2552} (( segid "KH " and resid 157 and name HG12)) ( segid "KH " and resid 157 and name HG2%) 2.900 1.000 1.000 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.79300E-02 ppm1 1.462 ppm2 0.805 CV 1 ASSI { 2558} (( segid "KH " and resid 174 and name HG )) ( segid "KH " and resid 174 and name HD2%) 2.500 0.800 0.800 peak 2558 spectrum 1 weight 0.10000E+01 volume 0.47381E-02 ppm1 1.910 ppm2 0.674 CV 1 ASSI { 2560} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 105 and name HG )) 2.300 0.700 0.700 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.73148E-02 ppm1 -0.158 ppm2 0.778 CV 1 ASSI { 2563} ( segid "KH " and resid 58 and name HD1%) ( segid "KH " and resid 58 and name HG2%) 1.700 0.400 0.500 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.47604E-01 ppm1 0.662 ppm2 0.755 CV 1 ASSI { 2576} (( segid "KH " and resid 156 and name HG13)) ( segid "KH " and resid 156 and name HD1%) 2.300 0.600 0.600 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.72364E-02 ppm1 1.531 ppm2 0.695 CV 1 OR { 2576} (( segid "KH " and resid 156 and name HG12)) ( segid "KH " and resid 156 and name HD1%) ASSI { 2594} (( segid "KH " and resid 71 and name HB )) ( segid "KH " and resid 71 and name HG1%) 2.200 0.600 0.600 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.78746E-02 ppm1 2.009 ppm2 0.721 CV 1 ASSI { 2597} (( segid "KH " and resid 87 and name HG12)) ( segid "KH " and resid 87 and name HG2%) 2.400 0.700 0.700 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.71140E-02 ppm1 1.806 ppm2 0.685 CV 1 ASSI { 2600} (( segid "KH " and resid 155 and name HG2 )) (( segid "KH " and resid 155 and name HG3 )) 3.100 3.100 2.900 peak 2600 spectrum 1 weight 0.10000E+01 volume 0.48189E-03 ppm1 1.050 ppm2 0.677 CV 1 ASSI { 2612} (( segid "KH " and resid 58 and name HB )) ( segid "KH " and resid 58 and name HD1%) 2.300 0.600 0.600 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.79523E-02 ppm1 1.755 ppm2 0.681 CV 1 ASSI { 2620} (( segid "KH " and resid 153 and name HG13)) ( segid "KH " and resid 153 and name HD1%) 2.400 0.700 0.700 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.56016E-02 ppm1 0.998 ppm2 0.657 CV 1 ASSI { 2638} (( segid "KH " and resid 72 and name HB )) ( segid "KH " and resid 72 and name HG2%) 2.300 0.700 0.700 peak 2638 spectrum 1 weight 0.10000E+01 volume 0.71586E-02 ppm1 1.953 ppm2 0.637 CV 1 ASSI { 2668} (( segid "KH " and resid 152 and name HB )) ( segid "KH " and resid 152 and name HG2%) 2.500 0.800 0.800 peak 2668 spectrum 1 weight 0.10000E+01 volume 0.38412E-02 ppm1 2.056 ppm2 0.573 CV 1 ASSI { 2676} (( segid "KH " and resid 96 and name HB3 )) ( segid "KH " and resid 33 and name HB% ) 2.600 2.600 3.400 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.22729E-02 ppm1 2.826 ppm2 0.571 CV 1 OR { 2676} (( segid "KH " and resid 96 and name HB2 )) ( segid "KH " and resid 33 and name HB% ) ASSI { 2684} (( segid "KH " and resid 33 and name HA )) ( segid "KH " and resid 33 and name HB% ) 2.400 0.700 0.700 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.70471E-02 ppm1 4.072 ppm2 0.558 CV 1 ASSI { 2697} (( segid "KH " and resid 34 and name HA )) ( segid "KH " and resid 29 and name HD1%) 3.000 1.100 1.100 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.19777E-02 ppm1 3.239 ppm2 0.431 CV 1 ASSI { 2730} (( segid "KH " and resid 29 and name HA )) (( segid "KH " and resid 29 and name HN )) 2.900 1.000 1.000 peak 2730 spectrum 1 weight 0.10000E+01 volume 0.19303E-02 ppm1 4.937 ppm2 8.855 CV 1 ASSI { 2733} (( segid "KH " and resid 29 and name HG12)) ( segid "KH " and resid 29 and name HG2%) 2.900 1.000 1.000 peak 2733 spectrum 1 weight 0.10000E+01 volume 0.19749E-02 ppm1 1.270 ppm2 0.669 CV 1 ASSI { 2737} (( segid "KH " and resid 37 and name HB )) ( segid "KH " and resid 37 and name HD1%) 3.400 1.400 1.400 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.25041E-02 ppm1 1.927 ppm2 0.617 CV 1 ASSI { 2745} (( segid "KH " and resid 56 and name HB )) ( segid "KH " and resid 56 and name HD1%) 2.400 0.700 0.700 peak 2745 spectrum 1 weight 0.10000E+01 volume 0.56713E-02 ppm1 1.559 ppm2 0.638 CV 1 ASSI { 2746} (( segid "KH " and resid 56 and name HB )) (( segid "KH " and resid 56 and name HG13)) 2.600 0.800 0.800 peak 2746 spectrum 1 weight 0.10000E+01 volume 0.21838E-02 ppm1 1.555 ppm2 0.868 CV 1 ASSI { 2747} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 58 and name HG12)) 2.200 0.600 0.600 peak 2747 spectrum 1 weight 0.10000E+01 volume 0.75737E-02 ppm1 0.662 ppm2 1.381 CV 1 ASSI { 2751} (( segid "KH " and resid 68 and name HB )) ( segid "KH " and resid 68 and name HG2%) 2.200 0.600 0.600 peak 2751 spectrum 1 weight 0.10000E+01 volume 0.11487E-01 ppm1 2.079 ppm2 0.830 CV 1 ASSI { 2754} (( segid "KH " and resid 73 and name HB )) ( segid "KH " and resid 73 and name HG2%) 2.600 0.800 0.800 peak 2754 spectrum 1 weight 0.10000E+01 volume 0.31838E-02 ppm1 2.035 ppm2 0.673 CV 1 ASSI { 2783} (( segid "KH " and resid 110 and name HG2 )) (( segid "KH " and resid 110 and name HD3 )) 2.600 0.800 0.800 peak 2783 spectrum 1 weight 0.10000E+01 volume 0.28468E-02 ppm1 1.638 ppm2 2.849 CV 1 ASSI { 2787} (( segid "KH " and resid 110 and name HA )) (( segid "KH " and resid 110 and name HB3 )) 3.100 1.200 1.200 peak 2787 spectrum 1 weight 0.10000E+01 volume 0.13705E-02 ppm1 5.363 ppm2 1.533 CV 1 ASSI { 2812} (( segid "KH " and resid 76 and name HG2 )) (( segid "KH " and resid 76 and name HA )) 4.900 3.000 1.100 peak 2812 spectrum 1 weight 0.10000E+01 volume 0.25905E-03 ppm1 2.223 ppm2 5.178 CV 1 ASSI { 2838} (( segid "KH " and resid 111 and name HA )) ( segid "KH " and resid 111 and name HG2%) 3.000 1.100 1.100 peak 2838 spectrum 1 weight 0.10000E+01 volume 0.22785E-02 ppm1 4.854 ppm2 0.453 CV 1 ASSI { 2851} (( segid "KH " and resid 42 and name HA2 )) (( segid "KH " and resid 42 and name HA1 )) 2.200 0.600 0.600 peak 2851 spectrum 1 weight 0.10000E+01 volume 0.47827E-02 ppm1 3.787 ppm2 4.037 CV 1 ASSI { 2871} (( segid "KH " and resid 91 and name HB2 )) (( segid "KH " and resid 91 and name HA )) 3.300 1.400 1.400 peak 2871 spectrum 1 weight 0.10000E+01 volume 0.10473E-02 ppm1 2.117 ppm2 4.139 CV 1 ASSI { 2888} (( segid "KH " and resid 137 and name HB2 )) (( segid "KH " and resid 137 and name HN )) 2.800 1.000 1.000 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.27799E-02 ppm1 2.230 ppm2 8.547 CV 1 ASSI { 2959} (( segid "KH " and resid 64 and name HD2 )) ( segid "KH " and resid 63 and name HG2%) 3.700 1.700 1.700 peak 2959 spectrum 1 weight 0.10000E+01 volume 0.20056E-02 ppm1 3.789 ppm2 1.209 CV 1 ASSI { 2970} (( segid "KH " and resid 104 and name HD2 )) (( segid "KH " and resid 104 and name HG3 )) 2.400 0.700 0.700 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.56490E-02 ppm1 1.662 ppm2 1.140 CV 1 OR { 2970} (( segid "KH " and resid 104 and name HD3 )) (( segid "KH " and resid 104 and name HG3 )) ASSI { 3003} (( segid "KH " and resid 64 and name HB3 )) (( segid "KH " and resid 64 and name HA )) 2.400 0.700 0.700 peak 3003 spectrum 1 weight 0.10000E+01 volume 0.53787E-02 ppm1 1.903 ppm2 4.286 CV 1 ASSI { 3024} (( segid "KH " and resid 46 and name HB3 )) (( segid "KH " and resid 47 and name HN )) 3.000 1.100 1.100 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.17353E-02 ppm1 1.891 ppm2 7.927 CV 1 OR { 3024} (( segid "KH " and resid 46 and name HB2 )) (( segid "KH " and resid 47 and name HN )) ASSI { 3027} (( segid "KH " and resid 47 and name HB3 )) (( segid "KH " and resid 47 and name HA )) 2.800 1.000 1.000 peak 3027 spectrum 1 weight 0.10000E+01 volume 0.46350E-02 ppm1 2.112 ppm2 4.083 CV 1 ASSI { 3030} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 47 and name HG2 )) 2.600 0.800 0.800 peak 3030 spectrum 1 weight 0.10000E+01 volume 0.62813E-02 ppm1 2.181 ppm2 2.529 CV 1 ASSI { 3032} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 47 and name HG3 )) 2.200 0.600 0.600 peak 3032 spectrum 1 weight 0.10000E+01 volume 0.11724E-01 ppm1 2.183 ppm2 2.400 CV 1 ASSI { 3034} (( segid "KH " and resid 48 and name HA )) (( segid "KH " and resid 51 and name HB3 )) 2.700 0.900 0.900 peak 3034 spectrum 1 weight 0.10000E+01 volume 0.18774E-02 ppm1 4.115 ppm2 3.115 CV 1 ASSI { 3041} (( segid "KH " and resid 49 and name HA )) (( segid "KH " and resid 49 and name HB2 )) 2.100 0.500 0.500 peak 3041 spectrum 1 weight 0.10000E+01 volume 0.15306E-01 ppm1 4.187 ppm2 4.061 CV 1 OR { 3041} (( segid "KH " and resid 49 and name HA )) (( segid "KH " and resid 49 and name HB3 )) ASSI { 3046} (( segid "KH " and resid 50 and name HG3 )) (( segid "KH " and resid 50 and name HB2 )) 2.300 0.600 0.600 peak 3046 spectrum 1 weight 0.10000E+01 volume 0.93510E-02 ppm1 1.633 ppm2 1.879 CV 1 OR { 3046} (( segid "KH " and resid 50 and name HG3 )) (( segid "KH " and resid 50 and name HB3 )) ASSI { 3047} (( segid "KH " and resid 50 and name HG3 )) (( segid "KH " and resid 50 and name HA )) 2.800 1.000 1.000 peak 3047 spectrum 1 weight 0.10000E+01 volume 0.41002E-02 ppm1 1.633 ppm2 4.172 CV 1 ASSI { 3061} (( segid "KH " and resid 78 and name HA )) (( segid "KH " and resid 81 and name HN )) 3.700 1.700 1.700 peak 3061 spectrum 1 weight 0.10000E+01 volume 0.52924E-03 ppm1 4.091 ppm2 7.916 CV 1 ASSI { 3078} (( segid "KH " and resid 82 and name HB3 )) (( segid "KH " and resid 82 and name HN )) 6.000 4.600 0.000 peak 3078 spectrum 1 weight 0.10000E+01 volume 0.61281E-04 ppm1 1.623 ppm2 7.691 CV 1 ASSI { 3079} (( segid "KH " and resid 82 and name HB2 )) (( segid "KH " and resid 82 and name HN )) 4.100 2.100 1.900 peak 3079 spectrum 1 weight 0.10000E+01 volume 0.19498E-03 ppm1 1.855 ppm2 7.686 CV 1 ASSI { 3106} (( segid "KH " and resid 91 and name HB3 )) ( segid "KH " and resid 91 and name HD1%) 2.700 0.900 0.900 peak 3106 spectrum 1 weight 0.10000E+01 volume 0.24819E-02 ppm1 1.526 ppm2 0.772 CV 1 ASSI { 3107} (( segid "KH " and resid 92 and name HB3 )) (( segid "KH " and resid 93 and name HN )) 2.800 1.000 1.000 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.35069E-02 ppm1 1.963 ppm2 8.453 CV 1 ASSI { 3114} (( segid "KH " and resid 99 and name HB2 )) (( segid "KH " and resid 99 and name HA )) 2.600 0.800 0.800 peak 3114 spectrum 1 weight 0.10000E+01 volume 0.75737E-02 ppm1 2.335 ppm2 4.402 CV 1 ASSI { 3157} (( segid "KH " and resid 166 and name HA )) ( segid "KH " and resid 166 and name HB% ) 2.700 0.900 0.900 peak 3157 spectrum 1 weight 0.10000E+01 volume 0.27242E-02 ppm1 3.922 ppm2 1.280 CV 1 ASSI { 3163} (( segid "KH " and resid 169 and name HA )) (( segid "KH " and resid 172 and name HB2 )) 3.000 1.100 1.100 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.16992E-02 ppm1 4.134 ppm2 2.841 CV 1 ASSI { 3178} (( segid "KH " and resid 174 and name HB2 )) (( segid "KH " and resid 175 and name HN )) 4.200 2.200 1.800 peak 3178 spectrum 1 weight 0.10000E+01 volume 0.94153E-03 ppm1 1.889 ppm2 7.940 CV 1 ASSI { 3179} (( segid "KH " and resid 175 and name HA )) (( segid "KH " and resid 176 and name HN )) 3.000 1.100 1.100 peak 3179 spectrum 1 weight 0.10000E+01 volume 0.23119E-02 ppm1 4.164 ppm2 7.695 CV 1 ASSI { 3183} (( segid "KH " and resid 179 and name HG2 )) (( segid "KH " and resid 179 and name HN )) 3.700 1.700 1.700 peak 3183 spectrum 1 weight 0.10000E+01 volume 0.58495E-03 ppm1 2.359 ppm2 7.940 CV 1 OR { 3183} (( segid "KH " and resid 179 and name HG3 )) (( segid "KH " and resid 179 and name HN )) ASSI { 3184} (( segid "KH " and resid 179 and name HG3 )) (( segid "KH " and resid 179 and name HE22)) 3.800 1.800 1.800 peak 3184 spectrum 1 weight 0.10000E+01 volume 0.14039E-02 ppm1 2.348 ppm2 6.799 CV 1 OR { 3184} (( segid "KH " and resid 179 and name HG2 )) (( segid "KH " and resid 179 and name HE22)) ASSI { 3189} (( segid "KH " and resid 45 and name HG12)) (( segid "KH " and resid 45 and name HN )) 4.000 2.000 2.000 peak 3189 spectrum 1 weight 0.10000E+01 volume 0.12674E-02 ppm1 1.420 ppm2 7.829 CV 1 ASSI { 3190} (( segid "KH " and resid 45 and name HG13)) (( segid "KH " and resid 45 and name HN )) 3.900 1.900 1.900 peak 3190 spectrum 1 weight 0.10000E+01 volume 0.10557E-02 ppm1 1.229 ppm2 7.835 CV 1 ASSI { 3196} (( segid "KH " and resid 48 and name HG )) (( segid "KH " and resid 48 and name HN )) 3.400 1.500 1.500 peak 3196 spectrum 1 weight 0.10000E+01 volume 0.12813E-02 ppm1 1.504 ppm2 8.369 CV 1 ASSI { 3230} ( segid "KH " and resid 103 and name HG1%) ( segid "KH " and resid 97 and name HE% ) 2.800 1.000 1.000 peak 3230 spectrum 1 weight 0.10000E+01 volume 0.32256E-02 ppm1 0.907 ppm2 7.093 CV 1 ASSI { 3235} (( segid "KH " and resid 94 and name HG3 )) (( segid "KH " and resid 96 and name HZ )) 3.400 1.400 1.400 peak 3235 spectrum 1 weight 0.10000E+01 volume 0.15821E-02 ppm1 2.184 ppm2 7.186 CV 1 OR { 3235} (( segid "KH " and resid 94 and name HG2 )) (( segid "KH " and resid 96 and name HZ )) ASSI { 3261} (( segid "KH " and resid 67 and name HB2 )) (( segid "KH " and resid 67 and name HG3 )) 2.600 0.800 0.800 peak 3261 spectrum 1 weight 0.10000E+01 volume 0.36295E-02 ppm1 2.118 ppm2 1.543 CV 1 ASSI { 3305} (( segid "KH " and resid 155 and name HG2 )) (( segid "KH " and resid 155 and name HA )) 4.200 2.200 1.800 peak 3305 spectrum 1 weight 0.10000E+01 volume 0.43732E-03 ppm1 1.049 ppm2 5.152 CV 1 ASSI { 3343} (( segid "KH " and resid 42 and name HA2 )) (( segid "KH " and resid 42 and name HN )) 3.300 1.300 1.300 peak 3343 spectrum 1 weight 0.10000E+01 volume 0.18022E-02 ppm1 3.788 ppm2 7.797 CV 1 ASSI { 3344} (( segid "KH " and resid 42 and name HA1 )) (( segid "KH " and resid 42 and name HN )) 2.800 1.000 1.000 peak 3344 spectrum 1 weight 0.10000E+01 volume 0.22395E-02 ppm1 4.034 ppm2 7.799 CV 1 ASSI { 3358} (( segid "KH " and resid 87 and name HB )) (( segid "KH " and resid 87 and name HA )) 3.200 1.300 1.300 peak 3358 spectrum 1 weight 0.10000E+01 volume 0.13287E-02 ppm1 2.009 ppm2 3.541 CV 1 ASSI { 3382} (( segid "KH " and resid 169 and name HB3 )) ( segid "KH " and resid 130 and name HD1%) 2.700 2.700 3.300 peak 3382 spectrum 1 weight 0.10000E+01 volume 0.17883E-02 ppm1 1.886 ppm2 0.768 CV 1 OR { 3382} (( segid "KH " and resid 169 and name HB2 )) ( segid "KH " and resid 130 and name HD1%) ASSI { 3399} (( segid "KH " and resid 173 and name HA )) ( segid "KH " and resid 173 and name HD1%) 3.300 1.400 1.400 peak 3399 spectrum 1 weight 0.10000E+01 volume 0.47493E-02 ppm1 3.648 ppm2 0.696 CV 1 ASSI { 3401} (( segid "KH " and resid 173 and name HG12)) (( segid "KH " and resid 173 and name HN )) 4.000 2.000 2.000 peak 3401 spectrum 1 weight 0.10000E+01 volume 0.13203E-02 ppm1 1.823 ppm2 7.927 CV 1 ASSI { 3421} (( segid "KH " and resid 145 and name HB )) (( segid "KH " and resid 146 and name HD3 )) 4.000 2.000 2.000 peak 3421 spectrum 1 weight 0.10000E+01 volume 0.12228E-02 ppm1 4.036 ppm2 3.642 CV 1 ASSI { 3481} ( segid "KH " and resid 29 and name HD1%) ( segid "KH " and resid 29 and name HG2%) 2.100 0.500 0.500 peak 3481 spectrum 1 weight 0.10000E+01 volume 0.15217E-01 ppm1 0.441 ppm2 0.673 CV 1 ASSI { 3485} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 154 and name HB )) 3.400 1.500 1.500 peak 3485 spectrum 1 weight 0.10000E+01 volume 0.19081E-02 ppm1 0.494 ppm2 1.867 CV 1 ASSI { 3487} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 110 and name HA )) 3.700 1.700 1.700 peak 3487 spectrum 1 weight 0.10000E+01 volume 0.13231E-02 ppm1 0.496 ppm2 5.358 CV 1 ASSI { 3563} (( segid "KH " and resid 148 and name HG2 )) (( segid "KH " and resid 148 and name HB3 )) 1.900 0.500 0.500 peak 3563 spectrum 1 weight 0.10000E+01 volume 0.27089E-01 ppm1 2.268 ppm2 2.043 CV 1 OR { 3563} (( segid "KH " and resid 148 and name HG2 )) (( segid "KH " and resid 148 and name HB2 )) ASSI { 3564} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 106 and name HB2 )) 3.400 1.400 1.400 peak 3564 spectrum 1 weight 0.10000E+01 volume 0.13175E-02 ppm1 -0.157 ppm2 2.008 CV 1 OR { 3564} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 106 and name HB3 )) ASSI { 3571} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 30 and name HD2 )) 3.600 1.600 1.600 peak 3571 spectrum 1 weight 0.10000E+01 volume 0.13175E-02 ppm1 0.445 ppm2 3.769 CV 1 ASSI { 3573} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 34 and name HN )) 3.100 1.200 1.200 peak 3573 spectrum 1 weight 0.10000E+01 volume 0.15460E-02 ppm1 0.440 ppm2 7.097 CV 1 ASSI { 3576} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 29 and name HN )) 3.600 1.600 1.600 peak 3576 spectrum 1 weight 0.10000E+01 volume 0.20362E-02 ppm1 0.443 ppm2 8.860 CV 1 ASSI { 3580} (( segid "KH " and resid 145 and name HB )) (( segid "KH " and resid 145 and name HN )) 3.100 1.200 1.200 peak 3580 spectrum 1 weight 0.10000E+01 volume 0.24011E-02 ppm1 4.036 ppm2 8.866 CV 1 ASSI { 3585} (( segid "KH " and resid 177 and name HA )) (( segid "KH " and resid 180 and name HN )) 2.900 1.100 1.100 peak 3585 spectrum 1 weight 0.10000E+01 volume 0.22451E-02 ppm1 3.833 ppm2 7.879 CV 1 ASSI { 3586} (( segid "KH " and resid 55 and name HB3 )) (( segid "KH " and resid 74 and name HN )) 3.300 1.400 1.400 peak 3586 spectrum 1 weight 0.10000E+01 volume 0.11755E-02 ppm1 3.808 ppm2 9.271 CV 1 OR { 3586} (( segid "KH " and resid 55 and name HB2 )) (( segid "KH " and resid 74 and name HN )) ASSI { 3588} (( segid "KH " and resid 55 and name HB2 )) (( segid "KH " and resid 56 and name HN )) 3.300 1.400 1.400 peak 3588 spectrum 1 weight 0.10000E+01 volume 0.24540E-02 ppm1 3.808 ppm2 8.318 CV 1 OR { 3588} (( segid "KH " and resid 55 and name HB3 )) (( segid "KH " and resid 56 and name HN )) ASSI { 3597} (( segid "KH " and resid 66 and name HB3 )) (( segid "KH " and resid 66 and name HN )) 3.000 1.200 1.200 peak 3597 spectrum 1 weight 0.10000E+01 volume 0.15766E-02 ppm1 4.025 ppm2 7.493 CV 1 ASSI { 3605} (( segid "KH " and resid 77 and name HD2 )) (( segid "KH " and resid 77 and name HG2 )) 2.900 1.100 1.100 peak 3605 spectrum 1 weight 0.10000E+01 volume 0.16852E-02 ppm1 3.973 ppm2 2.068 CV 1 OR { 3605} (( segid "KH " and resid 77 and name HD2 )) (( segid "KH " and resid 77 and name HG3 )) ASSI { 3609} ( segid "KH " and resid 113 and name HB% ) (( segid "KH " and resid 113 and name HN )) 2.300 0.700 0.700 peak 3609 spectrum 1 weight 0.10000E+01 volume 0.54512E-02 ppm1 1.381 ppm2 9.171 CV 1 ASSI { 3631} (( segid "KH " and resid 113 and name HA )) (( segid "KH " and resid 113 and name HN )) 2.500 0.800 0.800 peak 3631 spectrum 1 weight 0.10000E+01 volume 0.39693E-02 ppm1 3.973 ppm2 9.166 CV 1 ASSI { 3643} (( segid "KH " and resid 57 and name HB2 )) (( segid "KH " and resid 72 and name HB )) 2.800 1.000 1.000 peak 3643 spectrum 1 weight 0.10000E+01 volume 0.16045E-02 ppm1 1.749 ppm2 1.934 CV 1 ASSI { 3644} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 72 and name HB )) 3.600 1.700 1.700 peak 3644 spectrum 1 weight 0.10000E+01 volume 0.17967E-02 ppm1 1.627 ppm2 1.934 CV 1 ASSI { 3647} (( segid "KH " and resid 57 and name HB3 )) ( segid "KH " and resid 72 and name HG2%) 3.800 1.800 1.800 peak 3647 spectrum 1 weight 0.10000E+01 volume 0.14317E-02 ppm1 1.617 ppm2 0.633 CV 1 ASSI { 3665} (( segid "KH " and resid 171 and name HG3 )) (( segid "KH " and resid 171 and name HG2 )) 1.800 0.400 0.400 peak 3665 spectrum 1 weight 0.10000E+01 volume 0.11535E-01 ppm1 1.713 ppm2 1.884 CV 1 ASSI { 3666} (( segid "KH " and resid 105 and name HG )) ( segid "KH " and resid 91 and name HD2%) 2.100 2.100 3.900 peak 3666 spectrum 1 weight 0.10000E+01 volume 0.15643E-01 ppm1 0.786 ppm2 0.582 CV 1 ASSI { 3671} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 91 and name HG )) 2.900 1.000 1.000 peak 3671 spectrum 1 weight 0.10000E+01 volume 0.23008E-02 ppm1 0.785 ppm2 1.979 CV 1 ASSI { 3678} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 105 and name HN )) 3.600 1.600 1.600 peak 3678 spectrum 1 weight 0.10000E+01 volume 0.14930E-02 ppm1 0.786 ppm2 7.336 CV 1 ASSI { 3679} (( segid "KH " and resid 105 and name HG )) ( segid "KH " and resid 88 and name HE% ) 3.100 1.200 1.200 peak 3679 spectrum 1 weight 0.10000E+01 volume 0.26518E-02 ppm1 0.785 ppm2 7.563 CV 1 ASSI { 3714} (( segid "KH " and resid 42 and name HA2 )) ( segid "KH " and resid 38 and name HG2%) 3.100 1.200 1.200 peak 3714 spectrum 1 weight 0.10000E+01 volume 0.31921E-02 ppm1 3.791 ppm2 1.049 CV 1 ASSI { 3715} (( segid "KH " and resid 42 and name HA1 )) ( segid "KH " and resid 38 and name HG2%) 2.700 2.700 3.300 peak 3715 spectrum 1 weight 0.10000E+01 volume 0.30139E-02 ppm1 4.039 ppm2 1.046 CV 1 ASSI { 3738} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 163 and name HA )) 2.700 0.900 0.900 peak 3738 spectrum 1 weight 0.10000E+01 volume 0.34373E-02 ppm1 0.810 ppm2 3.827 CV 1 ASSI { 3751} ( segid "KH " and resid 145 and name HG2%) (( segid "KH " and resid 145 and name HN )) 3.300 1.400 1.400 peak 3751 spectrum 1 weight 0.10000E+01 volume 0.12423E-02 ppm1 1.275 ppm2 8.860 CV 1 ASSI { 3752} (( segid "KH " and resid 173 and name HA )) (( segid "KH " and resid 173 and name HN )) 3.500 1.500 1.500 peak 3752 spectrum 1 weight 0.10000E+01 volume 0.69078E-03 ppm1 3.648 ppm2 7.948 CV 1 ASSI { 3771} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 62 and name HG3 )) 2.500 2.500 3.500 peak 3771 spectrum 1 weight 0.10000E+01 volume 0.25988E-02 ppm1 1.212 ppm2 2.328 CV 1 OR { 3771} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 62 and name HG2 )) ASSI { 3772} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 62 and name HB3 )) 2.700 0.900 0.900 peak 3772 spectrum 1 weight 0.10000E+01 volume 0.29610E-02 ppm1 1.213 ppm2 2.112 CV 1 ASSI { 3789} (( segid "KH " and resid 32 and name HG3 )) (( segid "KH " and resid 32 and name HB2 )) 2.000 0.500 0.500 peak 3789 spectrum 1 weight 0.10000E+01 volume 0.18173E-01 ppm1 2.404 ppm2 2.235 CV 1 ASSI { 3790} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HB2 )) 2.500 0.800 0.800 peak 3790 spectrum 1 weight 0.10000E+01 volume 0.72147E-02 ppm1 2.603 ppm2 2.235 CV 1 ASSI { 3791} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HB3 )) 2.300 0.700 0.700 peak 3791 spectrum 1 weight 0.10000E+01 volume 0.69355E-02 ppm1 2.603 ppm2 2.137 CV 1 ASSI { 3796} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 75 and name HA2 )) 3.100 1.200 1.200 peak 3796 spectrum 1 weight 0.10000E+01 volume 0.36685E-02 ppm1 1.110 ppm2 4.119 CV 1 ASSI { 3797} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 75 and name HA1 )) 2.900 1.100 1.100 peak 3797 spectrum 1 weight 0.10000E+01 volume 0.24902E-02 ppm1 1.111 ppm2 4.358 CV 1 ASSI { 3812} ( segid "KH " and resid 154 and name HG1%) (( segid "KH " and resid 153 and name HA )) 3.200 1.300 1.300 peak 3812 spectrum 1 weight 0.10000E+01 volume 0.21114E-02 ppm1 0.798 ppm2 4.695 CV 1 ASSI { 3814} ( segid "KH " and resid 154 and name HG1%) ( segid "KH " and resid 154 and name HG2%) 1.900 0.500 0.500 peak 3814 spectrum 1 weight 0.10000E+01 volume 0.28635E-01 ppm1 0.803 ppm2 0.672 CV 1 ASSI { 3821} ( segid "KH " and resid 138 and name HG2%) (( segid "KH " and resid 139 and name HN )) 4.300 2.300 1.700 peak 3821 spectrum 1 weight 0.10000E+01 volume 0.98331E-03 ppm1 0.476 ppm2 9.184 CV 1 ASSI { 3860} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 137 and name HA )) 3.300 1.300 1.300 peak 3860 spectrum 1 weight 0.10000E+01 volume 0.14457E-02 ppm1 0.957 ppm2 4.352 CV 1 ASSI { 3862} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 158 and name HA2 )) 3.100 1.200 1.200 peak 3862 spectrum 1 weight 0.10000E+01 volume 0.12479E-02 ppm1 0.955 ppm2 3.932 CV 1 ASSI { 3863} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 163 and name HA )) 3.400 1.400 1.400 peak 3863 spectrum 1 weight 0.10000E+01 volume 0.11699E-02 ppm1 0.956 ppm2 3.829 CV 1 ASSI { 3868} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 58 and name HA )) 2.600 2.600 3.400 peak 3868 spectrum 1 weight 0.10000E+01 volume 0.18885E-02 ppm1 1.212 ppm2 4.655 CV 1 ASSI { 3873} (( segid "KH " and resid 135 and name HA )) (( segid "KH " and resid 136 and name HN )) 3.000 1.100 1.100 peak 3873 spectrum 1 weight 0.10000E+01 volume 0.21838E-02 ppm1 4.091 ppm2 8.068 CV 1 ASSI { 3875} ( segid "KH " and resid 135 and name HB% ) (( segid "KH " and resid 135 and name HA )) 2.300 0.600 0.600 peak 3875 spectrum 1 weight 0.10000E+01 volume 0.10774E-01 ppm1 1.661 ppm2 4.090 CV 1 ASSI { 3877} ( segid "KH " and resid 135 and name HB% ) (( segid "KH " and resid 136 and name HN )) 3.100 1.200 1.200 peak 3877 spectrum 1 weight 0.10000E+01 volume 0.25627E-02 ppm1 1.661 ppm2 8.081 CV 1 ASSI { 3927} (( segid "KH " and resid 119 and name HA )) ( segid "KH " and resid 126 and name HG2%) 3.500 3.500 2.500 peak 3927 spectrum 1 weight 0.10000E+01 volume 0.87467E-03 ppm1 3.338 ppm2 1.137 CV 1 ASSI { 3930} (( segid "KH " and resid 119 and name HA )) (( segid "KH " and resid 119 and name HN )) 3.200 1.300 1.300 peak 3930 spectrum 1 weight 0.10000E+01 volume 0.10279E-02 ppm1 3.342 ppm2 7.215 CV 1 ASSI { 3944} (( segid "KH " and resid 157 and name HB )) (( segid "KH " and resid 157 and name HN )) 3.300 1.400 1.400 peak 3944 spectrum 1 weight 0.10000E+01 volume 0.10112E-02 ppm1 1.847 ppm2 9.549 CV 1 ASSI { 3947} (( segid "KH " and resid 157 and name HG13)) (( segid "KH " and resid 106 and name HA )) 4.000 2.000 2.000 peak 3947 spectrum 1 weight 0.10000E+01 volume 0.15515E-02 ppm1 1.083 ppm2 4.961 CV 1 ASSI { 3956} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 157 and name HN )) 3.000 1.100 1.100 peak 3956 spectrum 1 weight 0.10000E+01 volume 0.38356E-02 ppm1 0.824 ppm2 9.552 CV 1 ASSI { 3957} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 156 and name HA )) 3.000 1.100 1.100 peak 3957 spectrum 1 weight 0.10000E+01 volume 0.31866E-02 ppm1 0.823 ppm2 4.983 CV 1 ASSI { 3961} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 106 and name HB3 )) 2.300 0.700 0.700 peak 3961 spectrum 1 weight 0.10000E+01 volume 0.76407E-02 ppm1 0.824 ppm2 1.979 CV 1 ASSI { 3971} (( segid "KH " and resid 141 and name HD2 )) (( segid "KH " and resid 141 and name HB2 )) 3.400 1.400 1.400 peak 3971 spectrum 1 weight 0.10000E+01 volume 0.29582E-02 ppm1 3.794 ppm2 2.309 CV 1 OR { 3971} (( segid "KH " and resid 141 and name HD3 )) (( segid "KH " and resid 141 and name HB2 )) ASSI { 3975} (( segid "KH " and resid 150 and name HA )) (( segid "KH " and resid 150 and name HB3 )) 2.400 0.700 0.700 peak 3975 spectrum 1 weight 0.10000E+01 volume 0.41727E-02 ppm1 3.767 ppm2 2.215 CV 1 ASSI { 3981} (( segid "KH " and resid 150 and name HG3 )) (( segid "KH " and resid 151 and name HN )) 2.600 2.600 3.400 peak 3981 spectrum 1 weight 0.10000E+01 volume 0.21754E-02 ppm1 2.227 ppm2 8.465 CV 1 OR { 3981} (( segid "KH " and resid 150 and name HG2 )) (( segid "KH " and resid 151 and name HN )) ASSI { 3988} (( segid "KH " and resid 150 and name HG2 )) ( segid "KH " and resid 113 and name HB% ) 2.400 2.400 3.600 peak 3988 spectrum 1 weight 0.10000E+01 volume 0.29610E-02 ppm1 2.231 ppm2 1.381 CV 1 OR { 3988} (( segid "KH " and resid 150 and name HG3 )) ( segid "KH " and resid 113 and name HB% ) ASSI { 3992} (( segid "KH " and resid 151 and name HG3 )) (( segid "KH " and resid 113 and name HN )) 3.900 1.900 1.900 peak 3992 spectrum 1 weight 0.10000E+01 volume 0.16323E-02 ppm1 1.744 ppm2 9.171 CV 1 ASSI { 4013} ( segid "KH " and resid 152 and name HG1%) (( segid "KH " and resid 152 and name HN )) 2.700 0.900 0.900 peak 4013 spectrum 1 weight 0.10000E+01 volume 0.43732E-02 ppm1 0.668 ppm2 9.133 CV 1 ASSI { 4029} ( segid "KH " and resid 152 and name HG2%) (( segid "KH " and resid 152 and name HN )) 2.400 0.700 0.700 peak 4029 spectrum 1 weight 0.10000E+01 volume 0.57186E-02 ppm1 0.580 ppm2 9.140 CV 1 ASSI { 4035} (( segid "KH " and resid 153 and name HB )) (( segid "KH " and resid 153 and name HG13)) 2.800 1.000 1.000 peak 4035 spectrum 1 weight 0.10000E+01 volume 0.21838E-02 ppm1 1.628 ppm2 0.992 CV 1 ASSI { 4036} (( segid "KH " and resid 153 and name HB )) ( segid "KH " and resid 153 and name HD1%) 3.300 1.300 1.300 peak 4036 spectrum 1 weight 0.10000E+01 volume 0.35682E-02 ppm1 1.626 ppm2 0.665 CV 1 ASSI { 4038} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 153 and name HN )) 3.600 1.600 1.600 peak 4038 spectrum 1 weight 0.10000E+01 volume 0.18830E-02 ppm1 0.495 ppm2 9.133 CV 1 ASSI { 4051} (( segid "KH " and resid 153 and name HG12)) (( segid "KH " and resid 153 and name HG13)) 1.900 0.400 0.400 peak 4051 spectrum 1 weight 0.10000E+01 volume 0.10696E-01 ppm1 1.448 ppm2 0.992 CV 1 ASSI { 4086} (( segid "KH " and resid 135 and name HA )) (( segid "KH " and resid 135 and name HN )) 2.500 0.800 0.800 peak 4086 spectrum 1 weight 0.10000E+01 volume 0.44122E-02 ppm1 4.092 ppm2 8.186 CV 1 ASSI { 4087} ( segid "KH " and resid 135 and name HB% ) (( segid "KH " and resid 135 and name HN )) 3.000 1.100 1.100 peak 4087 spectrum 1 weight 0.10000E+01 volume 0.37353E-02 ppm1 1.661 ppm2 8.188 CV 1 ASSI { 4096} ( segid "KH " and resid 145 and name HG2%) (( segid "KH " and resid 146 and name HD2 )) 2.500 2.500 3.500 peak 4096 spectrum 1 weight 0.10000E+01 volume 0.27799E-02 ppm1 1.274 ppm2 4.168 CV 1 ASSI { 4106} ( segid "KH " and resid 138 and name HG1%) (( segid "KH " and resid 154 and name HA )) 2.800 2.800 3.200 peak 4106 spectrum 1 weight 0.10000E+01 volume 0.40334E-02 ppm1 0.651 ppm2 4.139 CV 1 ASSI { 4127} (( segid "KH " and resid 141 and name HG2 )) (( segid "KH " and resid 141 and name HB3 )) 1.700 0.300 0.500 peak 4127 spectrum 1 weight 0.10000E+01 volume 0.49888E-01 ppm1 2.066 ppm2 1.938 CV 1 OR { 4127} (( segid "KH " and resid 141 and name HG3 )) (( segid "KH " and resid 141 and name HB3 )) ASSI { 4134} (( segid "KH " and resid 141 and name HD2 )) (( segid "KH " and resid 141 and name HB3 )) 2.600 0.800 0.800 peak 4134 spectrum 1 weight 0.10000E+01 volume 0.54651E-02 ppm1 3.791 ppm2 1.919 CV 1 OR { 4134} (( segid "KH " and resid 141 and name HD3 )) (( segid "KH " and resid 141 and name HB3 )) ASSI { 4143} (( segid "KH " and resid 143 and name HB2 )) (( segid "KH " and resid 143 and name HB3 )) 1.800 0.400 0.400 peak 4143 spectrum 1 weight 0.10000E+01 volume 0.16694E-01 ppm1 2.780 ppm2 2.637 CV 1 ASSI { 4147} (( segid "KH " and resid 146 and name HD3 )) (( segid "KH " and resid 146 and name HD2 )) 2.200 0.600 0.600 peak 4147 spectrum 1 weight 0.10000E+01 volume 0.38579E-02 ppm1 3.622 ppm2 4.157 CV 1 ASSI { 4152} (( segid "KH " and resid 148 and name HA )) (( segid "KH " and resid 148 and name HN )) 2.900 1.100 1.100 peak 4152 spectrum 1 weight 0.10000E+01 volume 0.20807E-02 ppm1 4.188 ppm2 9.261 CV 1 ASSI { 4154} (( segid "KH " and resid 148 and name HG2 )) (( segid "KH " and resid 148 and name HN )) 2.800 1.000 1.000 peak 4154 spectrum 1 weight 0.10000E+01 volume 0.16908E-02 ppm1 2.273 ppm2 9.261 CV 1 ASSI { 4159} (( segid "KH " and resid 149 and name HB3 )) (( segid "KH " and resid 149 and name HN )) 3.200 1.300 1.300 peak 4159 spectrum 1 weight 0.10000E+01 volume 0.24345E-02 ppm1 2.621 ppm2 8.389 CV 1 ASSI { 4163} ( segid "KH " and resid 156 and name HG2%) ( segid "KH " and resid 166 and name HB% ) 2.400 0.700 0.700 peak 4163 spectrum 1 weight 0.10000E+01 volume 0.54345E-02 ppm1 0.810 ppm2 1.274 CV 1 ASSI { 4164} ( segid "KH " and resid 156 and name HD1%) (( segid "KH " and resid 167 and name HN )) 3.100 1.200 1.200 peak 4164 spectrum 1 weight 0.10000E+01 volume 0.17800E-02 ppm1 0.698 ppm2 8.409 CV 1 ASSI { 4169} ( segid "KH " and resid 156 and name HD1%) (( segid "KH " and resid 107 and name HB )) 2.600 2.600 3.400 peak 4169 spectrum 1 weight 0.10000E+01 volume 0.20752E-02 ppm1 0.698 ppm2 3.961 CV 1 ASSI { 4184} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 137 and name HN )) 3.800 1.800 1.800 peak 4184 spectrum 1 weight 0.10000E+01 volume 0.11393E-02 ppm1 0.824 ppm2 8.560 CV 1 ASSI { 4191} (( segid "KH " and resid 159 and name HA )) (( segid "KH " and resid 159 and name HD2 )) 3.400 1.400 1.400 peak 4191 spectrum 1 weight 0.10000E+01 volume 0.12591E-02 ppm1 5.637 ppm2 7.135 CV 1 ASSI { 4208} ( segid "KH " and resid 113 and name HB% ) ( segid "KH " and resid 152 and name HG2%) 2.700 0.900 0.900 peak 4208 spectrum 1 weight 0.10000E+01 volume 0.64317E-02 ppm1 1.382 ppm2 0.580 CV 1 ASSI { 4223} (( segid "KH " and resid 112 and name HD3 )) (( segid "KH " and resid 112 and name HG3 )) 2.700 0.900 0.900 peak 4223 spectrum 1 weight 0.10000E+01 volume 0.25264E-02 ppm1 3.323 ppm2 2.029 CV 1 OR { 4223} (( segid "KH " and resid 112 and name HD3 )) (( segid "KH " and resid 112 and name HG2 )) ASSI { 4237} ( segid "KH " and resid 111 and name HG2%) (( segid "KH " and resid 111 and name HB )) 2.600 0.800 0.800 peak 4237 spectrum 1 weight 0.10000E+01 volume 0.39693E-02 ppm1 0.458 ppm2 1.968 CV 1 ASSI { 4242} (( segid "KH " and resid 107 and name HA )) (( segid "KH " and resid 108 and name HN )) 2.700 0.900 0.900 peak 4242 spectrum 1 weight 0.10000E+01 volume 0.23454E-02 ppm1 5.525 ppm2 10.137 CV 1 ASSI { 4245} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 55 and name HN )) 3.400 1.400 1.400 peak 4245 spectrum 1 weight 0.10000E+01 volume 0.10557E-02 ppm1 1.103 ppm2 8.486 CV 1 ASSI { 4260} ( segid "KH " and resid 109 and name HG2%) (( segid "KH " and resid 110 and name HN )) 3.700 1.700 1.700 peak 4260 spectrum 1 weight 0.10000E+01 volume 0.19582E-02 ppm1 0.881 ppm2 8.585 CV 1 ASSI { 4264} ( segid "KH " and resid 109 and name HD1%) (( segid "KH " and resid 109 and name HB )) 2.500 0.800 0.800 peak 4264 spectrum 1 weight 0.10000E+01 volume 0.62813E-02 ppm1 0.706 ppm2 1.932 CV 1 ASSI { 4287} (( segid "KH " and resid 110 and name HD3 )) (( segid "KH " and resid 110 and name HB3 )) 3.100 1.200 1.200 peak 4287 spectrum 1 weight 0.10000E+01 volume 0.21086E-02 ppm1 2.878 ppm2 1.536 CV 1 ASSI { 4290} (( segid "KH " and resid 110 and name HD3 )) ( segid "KH " and resid 153 and name HG2%) 4.100 2.100 1.900 peak 4290 spectrum 1 weight 0.10000E+01 volume 0.13983E-02 ppm1 2.881 ppm2 0.482 CV 1 ASSI { 4293} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 110 and name HB3 )) 2.900 1.000 1.000 peak 4293 spectrum 1 weight 0.10000E+01 volume 0.25069E-02 ppm1 2.980 ppm2 1.531 CV 1 ASSI { 4294} (( segid "KH " and resid 110 and name HD2 )) ( segid "KH " and resid 153 and name HG2%) 4.200 2.200 1.800 peak 4294 spectrum 1 weight 0.10000E+01 volume 0.17242E-02 ppm1 2.981 ppm2 0.487 CV 1 ASSI { 4311} (( segid "KH " and resid 99 and name HD3 )) (( segid "KH " and resid 98 and name HA1 )) 2.300 0.600 0.600 peak 4311 spectrum 1 weight 0.10000E+01 volume 0.10507E-01 ppm1 3.702 ppm2 4.154 CV 1 OR { 4311} (( segid "KH " and resid 99 and name HD3 )) (( segid "KH " and resid 98 and name HA2 )) OR { 4311} (( segid "KH " and resid 99 and name HD2 )) (( segid "KH " and resid 98 and name HA2 )) ASSI { 4313} (( segid "KH " and resid 99 and name HD2 )) (( segid "KH " and resid 99 and name HB2 )) 2.700 0.900 0.900 peak 4313 spectrum 1 weight 0.10000E+01 volume 0.43788E-02 ppm1 3.697 ppm2 2.325 CV 1 OR { 4313} (( segid "KH " and resid 99 and name HD3 )) (( segid "KH " and resid 99 and name HB2 )) ASSI { 4315} (( segid "KH " and resid 99 and name HD2 )) (( segid "KH " and resid 99 and name HB3 )) 2.700 0.900 0.900 peak 4315 spectrum 1 weight 0.10000E+01 volume 0.11045E-01 ppm1 3.698 ppm2 1.974 CV 1 OR { 4315} (( segid "KH " and resid 99 and name HD3 )) (( segid "KH " and resid 99 and name HB3 )) ASSI { 4342} (( segid "KH " and resid 105 and name HB3 )) (( segid "KH " and resid 106 and name HN )) 3.500 1.500 1.500 peak 4342 spectrum 1 weight 0.10000E+01 volume 0.90529E-03 ppm1 1.431 ppm2 8.784 CV 1 ASSI { 4345} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 29 and name HG12)) 2.600 2.600 3.400 peak 4345 spectrum 1 weight 0.10000E+01 volume 0.21197E-02 ppm1 0.952 ppm2 1.280 CV 1 ASSI { 4359} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 31 and name HA )) 2.800 1.000 1.000 peak 4359 spectrum 1 weight 0.10000E+01 volume 0.40668E-02 ppm1 0.939 ppm2 3.667 CV 1 ASSI { 4375} (( segid "KH " and resid 37 and name HB )) (( segid "KH " and resid 37 and name HG13)) 2.600 0.900 0.900 peak 4375 spectrum 1 weight 0.10000E+01 volume 0.24791E-02 ppm1 1.927 ppm2 1.163 CV 1 ASSI { 4379} (( segid "KH " and resid 32 and name HB2 )) (( segid "KH " and resid 32 and name HB3 )) 1.800 0.400 0.400 peak 4379 spectrum 1 weight 0.10000E+01 volume 0.13417E-01 ppm1 2.244 ppm2 2.142 CV 1 ASSI { 4380} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HE21)) 2.900 1.100 1.100 peak 4380 spectrum 1 weight 0.10000E+01 volume 0.20083E-02 ppm1 2.600 ppm2 7.660 CV 1 ASSI { 4382} (( segid "KH " and resid 32 and name HG3 )) (( segid "KH " and resid 32 and name HE21)) 2.700 0.900 0.900 peak 4382 spectrum 1 weight 0.10000E+01 volume 0.25543E-02 ppm1 2.406 ppm2 7.666 CV 1 ASSI { 4394} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 26 and name HN )) 3.400 1.400 1.400 peak 4394 spectrum 1 weight 0.10000E+01 volume 0.30139E-02 ppm1 0.802 ppm2 8.285 CV 1 ASSI { 4395} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 25 and name HN )) 2.900 1.000 1.000 peak 4395 spectrum 1 weight 0.10000E+01 volume 0.24512E-02 ppm1 0.800 ppm2 9.106 CV 1 ASSI { 4401} (( segid "KH " and resid 24 and name HA )) (( segid "KH " and resid 25 and name HN )) 2.900 1.000 1.000 peak 4401 spectrum 1 weight 0.10000E+01 volume 0.17326E-02 ppm1 5.290 ppm2 9.119 CV 1 ASSI { 4410} ( segid "KH " and resid 24 and name HG2%) (( segid "KH " and resid 25 and name HN )) 2.900 1.100 1.100 peak 4410 spectrum 1 weight 0.10000E+01 volume 0.22869E-02 ppm1 1.037 ppm2 9.112 CV 1 ASSI { 4431} (( segid "KH " and resid 23 and name HG2 )) (( segid "KH " and resid 23 and name HN )) 4.100 2.100 1.900 peak 4431 spectrum 1 weight 0.10000E+01 volume 0.99162E-03 ppm1 2.268 ppm2 7.921 CV 1 ASSI { 4432} (( segid "KH " and resid 23 and name HG3 )) (( segid "KH " and resid 23 and name HN )) 3.800 1.800 1.800 peak 4432 spectrum 1 weight 0.10000E+01 volume 0.14178E-02 ppm1 2.197 ppm2 7.912 CV 1 ASSI { 4439} (( segid "KH " and resid 21 and name HB3 )) (( segid "KH " and resid 21 and name HB2 )) 1.300 0.200 0.900 peak 4439 spectrum 1 weight 0.10000E+01 volume 0.10875E+00 ppm1 1.953 ppm2 2.034 CV 1 ASSI { 4443} (( segid "KH " and resid 20 and name HB2 )) (( segid "KH " and resid 21 and name HN )) 3.500 1.500 1.500 peak 4443 spectrum 1 weight 0.10000E+01 volume 0.15264E-02 ppm1 2.300 ppm2 8.480 CV 1 ASSI { 4444} (( segid "KH " and resid 20 and name HB3 )) (( segid "KH " and resid 21 and name HN )) 3.700 1.700 1.700 peak 4444 spectrum 1 weight 0.10000E+01 volume 0.18217E-02 ppm1 1.938 ppm2 8.480 CV 1 ASSI { 4445} (( segid "KH " and resid 20 and name HB3 )) (( segid "KH " and resid 20 and name HA )) 2.200 0.600 0.600 peak 4445 spectrum 1 weight 0.10000E+01 volume 0.68747E-02 ppm1 1.941 ppm2 4.417 CV 1 ASSI { 4496} ( segid "KH " and resid 56 and name HG2%) (( segid "KH " and resid 56 and name HN )) 2.900 1.100 1.100 peak 4496 spectrum 1 weight 0.10000E+01 volume 0.13315E-02 ppm1 0.615 ppm2 8.322 CV 1 ASSI { 4508} (( segid "KH " and resid 27 and name HB )) ( segid "KH " and resid 71 and name HG2%) 2.500 0.800 0.800 peak 4508 spectrum 1 weight 0.10000E+01 volume 0.44122E-02 ppm1 1.699 ppm2 0.663 CV 1 ASSI { 4510} ( segid "KH " and resid 27 and name HG1%) (( segid "KH " and resid 27 and name HN )) 3.300 1.300 1.300 peak 4510 spectrum 1 weight 0.10000E+01 volume 0.22813E-02 ppm1 0.903 ppm2 9.294 CV 1 ASSI { 4547} (( segid "KH " and resid 166 and name HA )) ( segid "KH " and resid 130 and name HD2%) 2.900 1.100 1.100 peak 4547 spectrum 1 weight 0.10000E+01 volume 0.22145E-02 ppm1 3.921 ppm2 0.792 CV 1 ASSI { 4556} ( segid "KH " and resid 166 and name HB% ) (( segid "KH " and resid 167 and name HN )) 2.600 0.900 0.900 peak 4556 spectrum 1 weight 0.10000E+01 volume 0.33092E-02 ppm1 1.290 ppm2 8.413 CV 1 ASSI { 4557} ( segid "KH " and resid 166 and name HB% ) (( segid "KH " and resid 166 and name HN )) 3.100 1.200 1.200 peak 4557 spectrum 1 weight 0.10000E+01 volume 0.12284E-02 ppm1 1.289 ppm2 8.208 CV 1 ASSI { 4564} (( segid "KH " and resid 170 and name HB )) (( segid "KH " and resid 170 and name HG12)) 2.400 0.700 0.700 peak 4564 spectrum 1 weight 0.10000E+01 volume 0.60278E-02 ppm1 1.766 ppm2 0.777 CV 1 OR { 4564} (( segid "KH " and resid 170 and name HB )) (( segid "KH " and resid 170 and name HG13)) ASSI { 4599} (( segid "KH " and resid 178 and name HA )) (( segid "KH " and resid 178 and name HD2 )) 3.500 1.500 1.500 peak 4599 spectrum 1 weight 0.10000E+01 volume 0.34735E-02 ppm1 4.142 ppm2 1.646 CV 1 OR { 4599} (( segid "KH " and resid 178 and name HA )) (( segid "KH " and resid 178 and name HD3 )) ASSI { 4606} (( segid "KH " and resid 178 and name HG2 )) (( segid "KH " and resid 178 and name HA )) 2.400 0.700 0.700 peak 4606 spectrum 1 weight 0.10000E+01 volume 0.47938E-02 ppm1 1.469 ppm2 4.144 CV 1 ASSI { 4631} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 48 and name HN )) 3.500 1.500 1.500 peak 4631 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 0.934 ppm2 8.376 CV 1 ASSI { 4636} ( segid "KH " and resid 48 and name HD1%) ( segid "KH " and resid 51 and name HD% ) 3.200 1.300 1.300 peak 4636 spectrum 1 weight 0.10000E+01 volume 0.19081E-02 ppm1 0.935 ppm2 7.158 CV 1 OR { 4636} ( segid "KH " and resid 48 and name HD1%) ( segid "KH " and resid 51 and name HE% ) ASSI { 4639} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 86 and name HD3 )) 3.500 1.600 1.600 peak 4639 spectrum 1 weight 0.10000E+01 volume 0.15766E-02 ppm1 0.936 ppm2 3.033 CV 1 OR { 4639} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 86 and name HD2 )) ASSI { 4646} ( segid "KH " and resid 48 and name HD1%) ( segid "KH " and resid 56 and name HD1%) 2.400 0.700 0.700 peak 4646 spectrum 1 weight 0.10000E+01 volume 0.70586E-02 ppm1 0.936 ppm2 0.666 CV 1 ASSI { 4651} ( segid "KH " and resid 48 and name HD2%) ( segid "KH " and resid 48 and name HD1%) 2.200 0.600 0.600 peak 4651 spectrum 1 weight 0.10000E+01 volume 0.15083E-01 ppm1 0.804 ppm2 0.937 CV 1 ASSI { 4653} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 48 and name HG )) 2.200 0.600 0.600 peak 4653 spectrum 1 weight 0.10000E+01 volume 0.10317E-01 ppm1 0.803 ppm2 1.503 CV 1 OR { 4653} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 48 and name HB3 )) ASSI { 4654} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 86 and name HB3 )) 2.800 1.000 1.000 peak 4654 spectrum 1 weight 0.10000E+01 volume 0.31504E-02 ppm1 0.804 ppm2 1.926 CV 1 OR { 4654} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 86 and name HB2 )) ASSI { 4656} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 48 and name HA )) 2.800 1.000 1.000 peak 4656 spectrum 1 weight 0.10000E+01 volume 0.29582E-02 ppm1 0.803 ppm2 4.129 CV 1 ASSI { 4665} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 70 and name HN )) 2.900 1.100 1.100 peak 4665 spectrum 1 weight 0.10000E+01 volume 0.20529E-02 ppm1 1.363 ppm2 8.868 CV 1 ASSI { 4673} (( segid "KH " and resid 63 and name HA )) (( segid "KH " and resid 64 and name HD2 )) 2.800 1.000 1.000 peak 4673 spectrum 1 weight 0.10000E+01 volume 0.59080E-02 ppm1 4.793 ppm2 3.792 CV 1 ASSI { 4700} ( segid "KH " and resid 68 and name HG2%) (( segid "KH " and resid 68 and name HN )) 2.500 0.800 0.800 peak 4700 spectrum 1 weight 0.10000E+01 volume 0.51337E-02 ppm1 0.832 ppm2 7.767 CV 1 ASSI { 4701} ( segid "KH " and resid 68 and name HG2%) (( segid "KH " and resid 69 and name HN )) 3.500 1.500 1.500 peak 4701 spectrum 1 weight 0.10000E+01 volume 0.16490E-02 ppm1 0.833 ppm2 9.108 CV 1 ASSI { 4720} (( segid "KH " and resid 88 and name HB2 )) (( segid "KH " and resid 88 and name HB3 )) 2.000 0.500 0.500 peak 4720 spectrum 1 weight 0.10000E+01 volume 0.82342E-02 ppm1 2.900 ppm2 2.703 CV 1 ASSI { 4721} (( segid "KH " and resid 88 and name HB2 )) (( segid "KH " and resid 89 and name HN )) 3.600 1.600 1.600 peak 4721 spectrum 1 weight 0.10000E+01 volume 0.99723E-03 ppm1 2.898 ppm2 8.060 CV 1 ASSI { 4722} (( segid "KH " and resid 88 and name HB3 )) (( segid "KH " and resid 89 and name HN )) 3.000 1.100 1.100 peak 4722 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 2.704 ppm2 8.056 CV 1 ASSI { 4731} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 145 and name HA )) 3.800 1.800 1.800 peak 4731 spectrum 1 weight 0.10000E+01 volume 0.24123E-02 ppm1 1.630 ppm2 4.624 CV 1 OR { 4731} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 145 and name HA )) ASSI { 4762} (( segid "KH " and resid 93 and name HB3 )) (( segid "KH " and resid 93 and name HG3 )) 2.200 0.600 0.600 peak 4762 spectrum 1 weight 0.10000E+01 volume 0.19471E-01 ppm1 2.128 ppm2 2.347 CV 1 ASSI { 4765} (( segid "KH " and resid 94 and name HB2 )) (( segid "KH " and resid 96 and name HZ )) 4.000 2.000 2.000 peak 4765 spectrum 1 weight 0.10000E+01 volume 0.14123E-02 ppm1 2.333 ppm2 7.177 CV 1 ASSI { 4779} (( segid "KH " and resid 112 and name HD2 )) (( segid "KH " and resid 111 and name HA )) 2.800 1.000 1.000 peak 4779 spectrum 1 weight 0.10000E+01 volume 0.18830E-02 ppm1 3.901 ppm2 4.838 CV 1 ASSI { 4790} (( segid "KH " and resid 70 and name HG2 )) (( segid "KH " and resid 70 and name HB3 )) 2.700 0.900 0.900 peak 4790 spectrum 1 weight 0.10000E+01 volume 0.19777E-02 ppm1 1.297 ppm2 1.482 CV 1 ASSI { 4792} (( segid "KH " and resid 70 and name HA )) (( segid "KH " and resid 71 and name HN )) 2.500 0.800 0.800 peak 4792 spectrum 1 weight 0.10000E+01 volume 0.41894E-02 ppm1 3.970 ppm2 9.169 CV 1 ASSI { 4793} (( segid "KH " and resid 70 and name HA )) (( segid "KH " and resid 70 and name HN )) 2.900 1.100 1.100 peak 4793 spectrum 1 weight 0.10000E+01 volume 0.16602E-02 ppm1 3.970 ppm2 8.866 CV 1 ASSI { 4812} (( segid "KH " and resid 73 and name HA )) ( segid "KH " and resid 73 and name HG2%) 2.500 0.800 0.800 peak 4812 spectrum 1 weight 0.10000E+01 volume 0.44457E-02 ppm1 4.966 ppm2 0.672 CV 1 ASSI { 4814} (( segid "KH " and resid 74 and name HB )) (( segid "KH " and resid 55 and name HB3 )) 2.500 0.800 0.800 peak 4814 spectrum 1 weight 0.10000E+01 volume 0.46295E-02 ppm1 3.850 ppm2 3.781 CV 1 OR { 4814} (( segid "KH " and resid 74 and name HB )) (( segid "KH " and resid 55 and name HB2 )) ASSI { 4818} (( segid "KH " and resid 154 and name HA )) (( segid "KH " and resid 155 and name HN )) 2.900 1.100 1.100 peak 4818 spectrum 1 weight 0.10000E+01 volume 0.15097E-02 ppm1 4.146 ppm2 9.128 CV 1 ASSI { 4824} (( segid "KH " and resid 174 and name HA )) ( segid "KH " and resid 177 and name HG1%) 3.600 1.700 1.700 peak 4824 spectrum 1 weight 0.10000E+01 volume 0.23370E-02 ppm1 3.911 ppm2 0.945 CV 1 ASSI { 4835} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 174 and name HB3 )) 2.700 0.900 0.900 peak 4835 spectrum 1 weight 0.10000E+01 volume 0.36518E-02 ppm1 0.847 ppm2 1.506 CV 1 ASSI { 4839} ( segid "KH " and resid 174 and name HD1%) ( segid "KH " and resid 111 and name HG2%) 3.000 1.100 1.100 peak 4839 spectrum 1 weight 0.10000E+01 volume 0.32952E-02 ppm1 0.843 ppm2 0.468 CV 1 ASSI { 4849} (( segid "KH " and resid 58 and name HG12)) (( segid "KH " and resid 58 and name HG13)) 1.700 0.300 0.500 peak 4849 spectrum 1 weight 0.10000E+01 volume 0.19178E-01 ppm1 1.371 ppm2 1.119 CV 1 ASSI { 4863} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 34 and name HB )) 2.200 2.200 3.800 peak 4863 spectrum 1 weight 0.10000E+01 volume 0.54094E-02 ppm1 0.667 ppm2 1.971 CV 1 ASSI { 4873} ( segid "KH " and resid 38 and name HG2%) (( segid "KH " and resid 45 and name HN )) 3.400 1.400 1.400 peak 4873 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 1.062 ppm2 7.828 CV 1 ASSI { 4894} ( segid "KH " and resid 130 and name HD1%) (( segid "KH " and resid 130 and name HN )) 3.700 1.700 1.700 peak 4894 spectrum 1 weight 0.10000E+01 volume 0.19665E-02 ppm1 0.796 ppm2 8.293 CV 1 ASSI { 4911} (( segid "KH " and resid 173 and name HB )) (( segid "KH " and resid 173 and name HN )) 2.800 1.000 1.000 peak 4911 spectrum 1 weight 0.10000E+01 volume 0.23008E-02 ppm1 1.952 ppm2 7.932 CV 1 ASSI { 4916} (( segid "KH " and resid 173 and name HG13)) (( segid "KH " and resid 173 and name HG12)) 2.500 0.800 0.800 peak 4916 spectrum 1 weight 0.10000E+01 volume 0.16908E-02 ppm1 0.987 ppm2 1.817 CV 1 ASSI { 4946} ( segid "KH " and resid 87 and name HD1%) ( segid "KH " and resid 105 and name HD2%) 2.300 2.300 3.700 peak 4946 spectrum 1 weight 0.10000E+01 volume 0.41504E-02 ppm1 0.587 ppm2 -0.158 CV 1 ASSI { 4948} (( segid "KH " and resid 87 and name HG12)) (( segid "KH " and resid 87 and name HG13)) 2.100 0.500 0.500 peak 4948 spectrum 1 weight 0.10000E+01 volume 0.54038E-02 ppm1 1.809 ppm2 0.965 CV 1 ASSI { 4960} ( segid "KH " and resid 119 and name HG2%) ( segid "KH " and resid 119 and name HG1%) 2.200 0.600 0.600 peak 4960 spectrum 1 weight 0.10000E+01 volume 0.13053E-01 ppm1 0.505 ppm2 0.708 CV 1 ASSI { 4966} ( segid "KH " and resid 119 and name HG2%) (( segid "KH " and resid 119 and name HN )) 3.400 1.500 1.500 peak 4966 spectrum 1 weight 0.10000E+01 volume 0.12897E-02 ppm1 0.505 ppm2 7.203 CV 1 ASSI { 4968} (( segid "KH " and resid 74 and name HB )) (( segid "KH " and resid 74 and name HN )) 2.900 1.000 1.000 peak 4968 spectrum 1 weight 0.10000E+01 volume 0.19053E-02 ppm1 3.851 ppm2 9.271 CV 1 ASSI { 4974} ( segid "KH " and resid 29 and name HG2%) ( segid "KH " and resid 105 and name HD2%) 2.700 0.900 0.900 peak 4974 spectrum 1 weight 0.10000E+01 volume 0.34290E-02 ppm1 0.666 ppm2 -0.160 CV 1 ASSI { 4978} ( segid "KH " and resid 29 and name HG2%) (( segid "KH " and resid 29 and name HB )) 2.400 0.700 0.700 peak 4978 spectrum 1 weight 0.10000E+01 volume 0.56629E-02 ppm1 0.668 ppm2 1.552 CV 1 ASSI { 4986} (( segid "KH " and resid 92 and name HA )) (( segid "KH " and resid 92 and name HB2 )) 2.800 1.000 1.000 peak 4986 spectrum 1 weight 0.10000E+01 volume 0.33453E-02 ppm1 4.305 ppm2 2.202 CV 1 ASSI { 4997} (( segid "KH " and resid 92 and name HG2 )) (( segid "KH " and resid 92 and name HD2 )) 2.300 0.600 0.600 peak 4997 spectrum 1 weight 0.10000E+01 volume 0.95762E-02 ppm1 1.524 ppm2 1.847 CV 1 OR { 4997} (( segid "KH " and resid 92 and name HG3 )) (( segid "KH " and resid 92 and name HD2 )) ASSI { 5002} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HG2 )) 1.900 0.400 0.400 peak 5002 spectrum 1 weight 0.10000E+01 volume 0.21426E-01 ppm1 1.757 ppm2 1.526 CV 1 OR { 5002} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HG3 )) ASSI { 5012} (( segid "KH " and resid 90 and name HA )) (( segid "KH " and resid 93 and name HN )) 3.100 1.200 1.200 peak 5012 spectrum 1 weight 0.10000E+01 volume 0.21393E-02 ppm1 4.198 ppm2 8.477 CV 1 ASSI { 5027} (( segid "KH " and resid 90 and name HG2 )) (( segid "KH " and resid 90 and name HD2 )) 2.400 0.700 0.700 peak 5027 spectrum 1 weight 0.10000E+01 volume 0.59414E-02 ppm1 1.210 ppm2 1.736 CV 1 OR { 5027} (( segid "KH " and resid 90 and name HG3 )) (( segid "KH " and resid 90 and name HD2 )) ASSI { 5029} (( segid "KH " and resid 91 and name HB3 )) (( segid "KH " and resid 91 and name HG )) 3.100 1.200 1.200 peak 5029 spectrum 1 weight 0.10000E+01 volume 0.15487E-02 ppm1 1.530 ppm2 1.971 CV 1 ASSI { 5033} ( segid "KH " and resid 91 and name HD2%) ( segid "KH " and resid 91 and name HD1%) 2.300 0.700 0.700 peak 5033 spectrum 1 weight 0.10000E+01 volume 0.94207E-02 ppm1 0.567 ppm2 0.765 CV 1 ASSI { 5036} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 91 and name HB3 )) 2.700 0.900 0.900 peak 5036 spectrum 1 weight 0.10000E+01 volume 0.42339E-02 ppm1 0.567 ppm2 1.544 CV 1 ASSI { 5040} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 30 and name HD3 )) 3.400 1.400 1.400 peak 5040 spectrum 1 weight 0.10000E+01 volume 0.18161E-02 ppm1 0.569 ppm2 3.197 CV 1 ASSI { 5042} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 91 and name HA )) 2.300 0.700 0.700 peak 5042 spectrum 1 weight 0.10000E+01 volume 0.69355E-02 ppm1 0.566 ppm2 4.127 CV 1 ASSI { 5043} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 91 and name HN )) 2.800 1.000 1.000 peak 5043 spectrum 1 weight 0.10000E+01 volume 0.25292E-02 ppm1 0.565 ppm2 7.561 CV 1 ASSI { 5044} ( segid "KH " and resid 91 and name HD2%) ( segid "KH " and resid 97 and name HD% ) 3.600 1.600 1.600 peak 5044 spectrum 1 weight 0.10000E+01 volume 0.18663E-02 ppm1 0.565 ppm2 7.334 CV 1 ASSI { 5045} ( segid "KH " and resid 91 and name HD2%) ( segid "KH " and resid 96 and name HE% ) 3.200 1.300 1.300 peak 5045 spectrum 1 weight 0.10000E+01 volume 0.18802E-02 ppm1 0.566 ppm2 7.202 CV 1 ASSI { 5052} (( segid "KH " and resid 86 and name HD2 )) (( segid "KH " and resid 86 and name HG2 )) 1.900 0.500 0.500 peak 5052 spectrum 1 weight 0.10000E+01 volume 0.26646E-01 ppm1 3.037 ppm2 1.743 CV 1 OR { 5052} (( segid "KH " and resid 86 and name HD3 )) (( segid "KH " and resid 86 and name HG2 )) ASSI { 5060} (( segid "KH " and resid 128 and name HB2 )) (( segid "KH " and resid 128 and name HB3 )) 1.900 0.400 0.400 peak 5060 spectrum 1 weight 0.10000E+01 volume 0.12184E-01 ppm1 2.976 ppm2 2.859 CV 1 ASSI { 5063} (( segid "KH " and resid 128 and name HB2 )) (( segid "KH " and resid 125 and name HA )) 3.100 1.200 1.200 peak 5063 spectrum 1 weight 0.10000E+01 volume 0.22451E-02 ppm1 2.976 ppm2 4.192 CV 1 ASSI { 5064} (( segid "KH " and resid 128 and name HB2 )) (( segid "KH " and resid 128 and name HA )) 2.600 0.800 0.800 peak 5064 spectrum 1 weight 0.10000E+01 volume 0.41002E-02 ppm1 2.974 ppm2 4.457 CV 1 ASSI { 5068} (( segid "KH " and resid 128 and name HB3 )) (( segid "KH " and resid 129 and name HN )) 2.500 0.800 0.800 peak 5068 spectrum 1 weight 0.10000E+01 volume 0.36740E-02 ppm1 2.854 ppm2 8.193 CV 1 ASSI { 5084} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 90 and name HD2 )) 2.700 0.900 0.900 peak 5084 spectrum 1 weight 0.10000E+01 volume 0.31504E-02 ppm1 0.619 ppm2 1.737 CV 1 ASSI { 5093} (( segid "KH " and resid 45 and name HA )) (( segid "KH " and resid 45 and name HN )) 2.900 1.000 1.000 peak 5093 spectrum 1 weight 0.10000E+01 volume 0.19164E-02 ppm1 3.952 ppm2 7.839 CV 1 ASSI { 5098} ( segid "KH " and resid 45 and name HD1%) (( segid "KH " and resid 45 and name HN )) 3.900 1.900 1.900 peak 5098 spectrum 1 weight 0.10000E+01 volume 0.13092E-02 ppm1 0.767 ppm2 7.842 CV 1 ASSI { 5124} (( segid "KH " and resid 38 and name HG12)) (( segid "KH " and resid 38 and name HG13)) 1.900 0.400 0.400 peak 5124 spectrum 1 weight 0.10000E+01 volume 0.69693E-02 ppm1 1.651 ppm2 1.119 CV 1 ASSI { 5129} (( segid "KH " and resid 30 and name HD2 )) (( segid "KH " and resid 30 and name HA )) 2.700 2.700 3.300 peak 5129 spectrum 1 weight 0.10000E+01 volume 0.55125E-02 ppm1 3.794 ppm2 4.565 CV 1 ASSI { 5135} (( segid "KH " and resid 176 and name HB3 )) (( segid "KH " and resid 176 and name HN )) 2.600 0.800 0.800 peak 5135 spectrum 1 weight 0.10000E+01 volume 0.44846E-02 ppm1 2.163 ppm2 7.670 CV 1 OR { 5135} (( segid "KH " and resid 176 and name HB2 )) (( segid "KH " and resid 176 and name HN )) ASSI { 5137} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HE22)) 4.100 2.100 1.900 peak 5137 spectrum 1 weight 0.10000E+01 volume 0.10251E-02 ppm1 2.527 ppm2 6.784 CV 1 ASSI { 5143} (( segid "KH " and resid 30 and name HB3 )) ( segid "KH " and resid 33 and name HB% ) 3.700 1.800 1.800 peak 5143 spectrum 1 weight 0.10000E+01 volume 0.14178E-02 ppm1 1.569 ppm2 0.560 CV 1 ASSI { 5144} (( segid "KH " and resid 30 and name HB2 )) ( segid "KH " and resid 33 and name HB% ) 3.200 1.300 1.300 peak 5144 spectrum 1 weight 0.10000E+01 volume 0.17855E-02 ppm1 2.529 ppm2 0.566 CV 1 ASSI { 5153} (( segid "KH " and resid 155 and name HB2 )) ( segid "KH " and resid 157 and name HD1%) 2.900 1.100 1.100 peak 5153 spectrum 1 weight 0.10000E+01 volume 0.17883E-02 ppm1 1.621 ppm2 0.808 CV 1 OR { 5153} (( segid "KH " and resid 155 and name HB2 )) ( segid "KH " and resid 157 and name HG2%) ASSI { 5163} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 57 and name HG3 )) 3.100 1.200 1.200 peak 5163 spectrum 1 weight 0.10000E+01 volume 0.23509E-02 ppm1 1.621 ppm2 1.200 CV 1 ASSI { 5165} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HN )) 2.900 1.100 1.100 peak 5165 spectrum 1 weight 0.10000E+01 volume 0.14262E-02 ppm1 1.208 ppm2 8.674 CV 1 ASSI { 5205} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 102 and name HB3 )) 1.700 0.300 0.500 peak 5205 spectrum 1 weight 0.10000E+01 volume 0.23356E-01 ppm1 1.904 ppm2 1.785 CV 1 ASSI { 5207} (( segid "KH " and resid 102 and name HB3 )) ( segid "KH " and resid 135 and name HB% ) 2.200 0.600 0.600 peak 5207 spectrum 1 weight 0.10000E+01 volume 0.11612E-01 ppm1 1.788 ppm2 1.637 CV 1 ASSI { 5226} (( segid "KH " and resid 101 and name HG3 )) (( segid "KH " and resid 101 and name HN )) 3.900 1.900 1.900 peak 5226 spectrum 1 weight 0.10000E+01 volume 0.11253E-02 ppm1 2.293 ppm2 7.598 CV 1 OR { 5226} (( segid "KH " and resid 101 and name HG2 )) (( segid "KH " and resid 101 and name HN )) ASSI { 5239} (( segid "KH " and resid 106 and name HB2 )) (( segid "KH " and resid 106 and name HN )) 3.400 1.500 1.500 peak 5239 spectrum 1 weight 0.10000E+01 volume 0.16546E-02 ppm1 2.025 ppm2 8.811 CV 1 ASSI { 5242} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 75 and name HN )) 3.100 1.200 1.200 peak 5242 spectrum 1 weight 0.10000E+01 volume 0.17967E-02 ppm1 1.115 ppm2 8.969 CV 1 ASSI { 5250} (( segid "KH " and resid 110 and name HG3 )) (( segid "KH " and resid 110 and name HG2 )) 2.000 0.500 0.500 peak 5250 spectrum 1 weight 0.10000E+01 volume 0.80084E-02 ppm1 1.352 ppm2 1.643 CV 1 ASSI { 5254} (( segid "KH " and resid 111 and name HB )) ( segid "KH " and resid 174 and name HD1%) 2.900 1.100 1.100 peak 5254 spectrum 1 weight 0.10000E+01 volume 0.42172E-02 ppm1 1.981 ppm2 0.846 CV 1 ASSI { 5262} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 119 and name HN )) 3.200 1.300 1.300 peak 5262 spectrum 1 weight 0.10000E+01 volume 0.14596E-02 ppm1 1.317 ppm2 7.209 CV 1 ASSI { 5295} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 69 and name HB3 )) 2.500 0.800 0.800 peak 5295 spectrum 1 weight 0.10000E+01 volume 0.73479E-02 ppm1 0.938 ppm2 1.229 CV 1 ASSI { 5296} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 38 and name HG13)) 2.700 0.900 0.900 peak 5296 spectrum 1 weight 0.10000E+01 volume 0.39526E-02 ppm1 0.938 ppm2 1.119 CV 1 ASSI { 5307} ( segid "KH " and resid 138 and name HG1%) (( segid "KH " and resid 139 and name HN )) 2.700 0.900 0.900 peak 5307 spectrum 1 weight 0.10000E+01 volume 0.34401E-02 ppm1 0.650 ppm2 9.196 CV 1 ASSI { 5311} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 146 and name HD2 )) 2.500 0.800 0.800 peak 5311 spectrum 1 weight 0.10000E+01 volume 0.45793E-02 ppm1 1.632 ppm2 4.161 CV 1 OR { 5311} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 146 and name HD2 )) ASSI { 5315} (( segid "KH " and resid 152 and name HB )) (( segid "KH " and resid 152 and name HA )) 2.600 0.800 0.800 peak 5315 spectrum 1 weight 0.10000E+01 volume 0.35459E-02 ppm1 2.054 ppm2 4.631 CV 1 ASSI { 5319} ( segid "KH " and resid 153 and name HD1%) (( segid "KH " and resid 153 and name HN )) 3.200 1.300 1.300 peak 5319 spectrum 1 weight 0.10000E+01 volume 0.24540E-02 ppm1 0.658 ppm2 9.141 CV 1 ASSI { 5335} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 106 and name HA )) 3.000 1.100 1.100 peak 5335 spectrum 1 weight 0.10000E+01 volume 0.23175E-02 ppm1 0.803 ppm2 4.930 CV 1 ASSI { 5343} (( segid "KH " and resid 163 and name HB3 )) (( segid "KH " and resid 163 and name HN )) 3.300 1.300 1.300 peak 5343 spectrum 1 weight 0.10000E+01 volume 0.10752E-02 ppm1 3.746 ppm2 8.341 CV 1 OR { 5343} (( segid "KH " and resid 163 and name HB2 )) (( segid "KH " and resid 163 and name HN )) ASSI { 5354} (( segid "KH " and resid 171 and name HA )) (( segid "KH " and resid 174 and name HN )) 3.200 1.300 1.300 peak 5354 spectrum 1 weight 0.10000E+01 volume 0.13148E-02 ppm1 3.877 ppm2 8.125 CV 1 ASSI { 5355} (( segid "KH " and resid 172 and name HB3 )) (( segid "KH " and resid 173 and name HN )) 3.400 1.400 1.400 peak 5355 spectrum 1 weight 0.10000E+01 volume 0.83289E-03 ppm1 2.683 ppm2 7.940 CV 1 ASSI { 5363} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 173 and name HA )) 2.700 0.900 0.900 peak 5363 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 0.678 ppm2 3.650 CV 1 ASSI { 5365} ( segid "KH " and resid 174 and name HD2%) ( segid "KH " and resid 174 and name HD1%) 2.200 0.600 0.600 peak 5365 spectrum 1 weight 0.10000E+01 volume 0.11646E-01 ppm1 0.685 ppm2 0.842 CV 1 ASSI { 5370} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HE21)) 3.300 1.300 1.300 peak 5370 spectrum 1 weight 0.10000E+01 volume 0.12674E-02 ppm1 2.516 ppm2 7.342 CV 1 ASSI { 5399} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 25 and name HB )) 2.200 0.600 0.600 peak 5399 spectrum 1 weight 0.10000E+01 volume 0.96877E-02 ppm1 0.800 ppm2 2.022 CV 1 ASSI { 5413} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 35 and name HN )) 3.600 1.700 1.700 peak 5413 spectrum 1 weight 0.10000E+01 volume 0.18022E-02 ppm1 0.937 ppm2 8.421 CV 1 ASSI { 5418} (( segid "KH " and resid 35 and name HA1 )) (( segid "KH " and resid 35 and name HA2 )) 2.200 0.600 0.600 peak 5418 spectrum 1 weight 0.10000E+01 volume 0.52116E-02 ppm1 3.847 ppm2 3.715 CV 1 ASSI { 5419} (( segid "KH " and resid 36 and name HA )) (( segid "KH " and resid 39 and name HN )) 3.100 1.200 1.200 peak 5419 spectrum 1 weight 0.10000E+01 volume 0.16239E-02 ppm1 4.158 ppm2 7.909 CV 1 ASSI { 5421} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 38 and name HN )) 2.800 2.800 3.200 peak 5421 spectrum 1 weight 0.10000E+01 volume 0.12869E-02 ppm1 0.614 ppm2 8.236 CV 1 ASSI { 5423} ( segid "KH " and resid 37 and name HG2%) (( segid "KH " and resid 38 and name HN )) 3.500 1.500 1.500 peak 5423 spectrum 1 weight 0.10000E+01 volume 0.11727E-02 ppm1 0.733 ppm2 8.234 CV 1 ASSI { 5443} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 56 and name HG12)) 1.900 0.500 0.500 peak 5443 spectrum 1 weight 0.10000E+01 volume 0.17409E-01 ppm1 0.666 ppm2 1.461 CV 1 ASSI { 5446} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 49 and name HA )) 2.400 2.400 3.600 peak 5446 spectrum 1 weight 0.10000E+01 volume 0.37632E-02 ppm1 0.666 ppm2 4.208 CV 1 ASSI { 5467} (( segid "KH " and resid 78 and name HG3 )) (( segid "KH " and resid 78 and name HN )) 3.100 1.200 1.200 peak 5467 spectrum 1 weight 0.10000E+01 volume 0.14930E-02 ppm1 2.334 ppm2 7.062 CV 1 OR { 5467} (( segid "KH " and resid 78 and name HG2 )) (( segid "KH " and resid 78 and name HN )) ASSI { 5469} (( segid "KH " and resid 78 and name HG3 )) (( segid "KH " and resid 78 and name HB3 )) 2.200 0.600 0.600 peak 5469 spectrum 1 weight 0.10000E+01 volume 0.13228E-01 ppm1 2.339 ppm2 1.998 CV 1 OR { 5469} (( segid "KH " and resid 78 and name HG2 )) (( segid "KH " and resid 78 and name HB3 )) ASSI { 5484} (( segid "KH " and resid 90 and name HG3 )) (( segid "KH " and resid 90 and name HD3 )) 2.300 0.600 0.600 peak 5484 spectrum 1 weight 0.10000E+01 volume 0.78414E-02 ppm1 1.210 ppm2 1.582 CV 1 OR { 5484} (( segid "KH " and resid 90 and name HG2 )) (( segid "KH " and resid 90 and name HD3 )) ASSI { 5499} (( segid "KH " and resid 92 and name HB2 )) (( segid "KH " and resid 92 and name HB3 )) 1.800 0.400 0.400 peak 5499 spectrum 1 weight 0.10000E+01 volume 0.11866E-01 ppm1 2.187 ppm2 1.956 CV 1 ASSI { 5507} (( segid "KH " and resid 99 and name HB3 )) (( segid "KH " and resid 100 and name HN )) 3.500 1.500 1.500 peak 5507 spectrum 1 weight 0.10000E+01 volume 0.32117E-02 ppm1 1.958 ppm2 8.556 CV 1 ASSI { 5509} (( segid "KH " and resid 116 and name HA )) ( segid "KH " and resid 111 and name HG2%) 3.000 1.100 1.100 peak 5509 spectrum 1 weight 0.10000E+01 volume 0.22674E-02 ppm1 3.397 ppm2 0.456 CV 1 ASSI { 5512} ( segid "KH " and resid 116 and name HB% ) (( segid "KH " and resid 119 and name HB )) 3.500 1.500 1.500 peak 5512 spectrum 1 weight 0.10000E+01 volume 0.16490E-02 ppm1 1.199 ppm2 1.952 CV 1 ASSI { 5516} (( segid "KH " and resid 119 and name HB )) (( segid "KH " and resid 119 and name HA )) 3.000 1.200 1.200 peak 5516 spectrum 1 weight 0.10000E+01 volume 0.14596E-02 ppm1 1.948 ppm2 3.324 CV 1 ASSI { 5518} (( segid "KH " and resid 119 and name HB )) ( segid "KH " and resid 119 and name HG2%) 2.600 0.800 0.800 peak 5518 spectrum 1 weight 0.10000E+01 volume 0.41504E-02 ppm1 1.948 ppm2 0.506 CV 1 ASSI { 5523} ( segid "KH " and resid 154 and name HG1%) ( segid "KH " and resid 111 and name HG2%) 2.400 0.700 0.700 peak 5523 spectrum 1 weight 0.10000E+01 volume 0.81896E-02 ppm1 0.805 ppm2 0.473 CV 1 ASSI { 5529} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 106 and name HB3 )) 2.900 2.900 3.100 peak 5529 spectrum 1 weight 0.10000E+01 volume 0.32729E-02 ppm1 0.803 ppm2 1.975 CV 1 ASSI { 5535} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 105 and name HB2 )) 3.000 3.000 3.000 peak 5535 spectrum 1 weight 0.10000E+01 volume 0.40139E-02 ppm1 0.824 ppm2 1.560 CV 1 ASSI { 5539} (( segid "KH " and resid 138 and name HB )) (( segid "KH " and resid 138 and name HA )) 3.100 1.200 1.200 peak 5539 spectrum 1 weight 0.10000E+01 volume 0.15571E-02 ppm1 1.676 ppm2 4.979 CV 1 ASSI { 5543} (( segid "KH " and resid 24 and name HB )) (( segid "KH " and resid 24 and name HA )) 3.100 1.200 1.200 peak 5543 spectrum 1 weight 0.10000E+01 volume 0.13983E-02 ppm1 3.778 ppm2 5.274 CV 1 ASSI { 5546} (( segid "KH " and resid 130 and name HB2 )) (( segid "KH " and resid 130 and name HN )) 3.100 1.200 1.200 peak 5546 spectrum 1 weight 0.10000E+01 volume 0.12228E-02 ppm1 1.872 ppm2 8.280 CV 1 ASSI { 5547} (( segid "KH " and resid 130 and name HB3 )) (( segid "KH " and resid 130 and name HN )) 3.000 1.200 1.200 peak 5547 spectrum 1 weight 0.10000E+01 volume 0.15654E-02 ppm1 1.678 ppm2 8.280 CV 1 ASSI { 5549} ( segid "KH " and resid 130 and name HD2%) (( segid "KH " and resid 130 and name HN )) 3.700 1.700 1.700 peak 5549 spectrum 1 weight 0.10000E+01 volume 0.19498E-02 ppm1 0.770 ppm2 8.293 CV 1 ASSI { 5552} (( segid "KH " and resid 159 and name HB2 )) (( segid "KH " and resid 159 and name HD2 )) 3.500 1.500 1.500 peak 5552 spectrum 1 weight 0.10000E+01 volume 0.12479E-02 ppm1 3.569 ppm2 7.153 CV 1 ASSI { 5557} (( segid "KH " and resid 101 and name HB2 )) (( segid "KH " and resid 102 and name HN )) 3.700 1.700 1.700 peak 5557 spectrum 1 weight 0.10000E+01 volume 0.19554E-02 ppm1 2.108 ppm2 8.446 CV 1 ASSI { 5560} (( segid "KH " and resid 101 and name HB3 )) (( segid "KH " and resid 102 and name HN )) 3.200 1.300 1.300 peak 5560 spectrum 1 weight 0.10000E+01 volume 0.29999E-02 ppm1 1.986 ppm2 8.446 CV 1 ASSI { 5562} ( segid "KH " and resid 103 and name HG1%) (( segid "KH " and resid 96 and name HB2 )) 2.900 1.100 1.100 peak 5562 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 0.909 ppm2 2.844 CV 1 ASSI { 5566} (( segid "KH " and resid 103 and name HB )) (( segid "KH " and resid 103 and name HA )) 3.000 1.100 1.100 peak 5566 spectrum 1 weight 0.10000E+01 volume 0.14262E-02 ppm1 2.093 ppm2 2.968 CV 1 ASSI { 5572} (( segid "KH " and resid 104 and name HB3 )) (( segid "KH " and resid 104 and name HG3 )) 2.900 1.000 1.000 peak 5572 spectrum 1 weight 0.10000E+01 volume 0.16741E-02 ppm1 1.501 ppm2 1.141 CV 1 ASSI { 5573} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HG3 )) 3.300 1.300 1.300 peak 5573 spectrum 1 weight 0.10000E+01 volume 0.16574E-02 ppm1 1.622 ppm2 1.151 CV 1 ASSI { 5575} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HE3 )) 3.700 1.700 1.700 peak 5575 spectrum 1 weight 0.10000E+01 volume 0.14847E-02 ppm1 1.623 ppm2 2.920 CV 1 OR { 5575} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HE2 )) ASSI { 5578} (( segid "KH " and resid 105 and name HB3 )) (( segid "KH " and resid 105 and name HB2 )) 2.500 0.800 0.800 peak 5578 spectrum 1 weight 0.10000E+01 volume 0.18217E-02 ppm1 1.437 ppm2 1.562 CV 1 ASSI { 5580} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 104 and name HD2 )) 3.200 3.200 2.800 peak 5580 spectrum 1 weight 0.10000E+01 volume 0.24206E-02 ppm1 0.952 ppm2 1.668 CV 1 OR { 5580} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 104 and name HD3 )) ASSI { 5581} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 91 and name HG )) 3.000 1.200 1.200 peak 5581 spectrum 1 weight 0.10000E+01 volume 0.20919E-02 ppm1 0.952 ppm2 1.965 CV 1 ASSI { 5582} (( segid "KH " and resid 106 and name HB3 )) (( segid "KH " and resid 106 and name HN )) 3.100 1.200 1.200 peak 5582 spectrum 1 weight 0.10000E+01 volume 0.11587E-02 ppm1 1.988 ppm2 8.811 CV 1 ASSI { 5583} (( segid "KH " and resid 106 and name HB3 )) (( segid "KH " and resid 106 and name HA )) 3.000 1.100 1.100 peak 5583 spectrum 1 weight 0.10000E+01 volume 0.15237E-02 ppm1 1.988 ppm2 4.935 CV 1 ASSI { 5590} ( segid "KH " and resid 109 and name HG2%) ( segid "KH " and resid 109 and name HD1%) 2.100 0.500 0.500 peak 5590 spectrum 1 weight 0.10000E+01 volume 0.15510E-01 ppm1 0.883 ppm2 0.700 CV 1 ASSI { 5592} ( segid "KH " and resid 109 and name HG2%) (( segid "KH " and resid 109 and name HN )) 3.200 1.300 1.300 peak 5592 spectrum 1 weight 0.10000E+01 volume 0.14874E-02 ppm1 0.881 ppm2 8.819 CV 1 ASSI { 5595} (( segid "KH " and resid 109 and name HG13)) ( segid "KH " and resid 109 and name HD1%) 2.500 0.800 0.800 peak 5595 spectrum 1 weight 0.10000E+01 volume 0.44457E-02 ppm1 0.986 ppm2 0.690 CV 1 ASSI { 5601} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 150 and name HB3 )) 2.200 2.200 3.800 peak 5601 spectrum 1 weight 0.10000E+01 volume 0.53620E-02 ppm1 4.177 ppm2 2.225 CV 1 OR { 5601} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 150 and name HG2 )) ASSI { 5605} (( segid "KH " and resid 110 and name HA )) ( segid "KH " and resid 153 and name HD1%) 3.100 1.200 1.200 peak 5605 spectrum 1 weight 0.10000E+01 volume 0.12256E-02 ppm1 5.353 ppm2 0.652 CV 1 ASSI { 5606} (( segid "KH " and resid 110 and name HB3 )) (( segid "KH " and resid 110 and name HN )) 3.600 1.600 1.600 peak 5606 spectrum 1 weight 0.10000E+01 volume 0.98047E-03 ppm1 1.536 ppm2 8.607 CV 1 ASSI { 5607} (( segid "KH " and resid 110 and name HB3 )) (( segid "KH " and resid 111 and name HN )) 3.400 1.500 1.500 peak 5607 spectrum 1 weight 0.10000E+01 volume 0.12173E-02 ppm1 1.536 ppm2 8.896 CV 1 ASSI { 5609} (( segid "KH " and resid 110 and name HB2 )) (( segid "KH " and resid 110 and name HA )) 3.100 1.200 1.200 peak 5609 spectrum 1 weight 0.10000E+01 volume 0.12117E-02 ppm1 1.690 ppm2 5.365 CV 1 ASSI { 5611} (( segid "KH " and resid 110 and name HD3 )) (( segid "KH " and resid 151 and name HB2 )) 3.600 1.700 1.700 peak 5611 spectrum 1 weight 0.10000E+01 volume 0.14596E-02 ppm1 2.876 ppm2 2.289 CV 1 ASSI { 5614} (( segid "KH " and resid 153 and name HB )) (( segid "KH " and resid 153 and name HG12)) 2.800 1.000 1.000 peak 5614 spectrum 1 weight 0.10000E+01 volume 0.24902E-02 ppm1 1.626 ppm2 1.442 CV 1 ASSI { 5615} (( segid "KH " and resid 153 and name HB )) (( segid "KH " and resid 154 and name HN )) 3.500 1.500 1.500 peak 5615 spectrum 1 weight 0.10000E+01 volume 0.15487E-02 ppm1 1.628 ppm2 8.615 CV 1 ASSI { 5619} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 71 and name HN )) 3.700 1.700 1.700 peak 5619 spectrum 1 weight 0.10000E+01 volume 0.24290E-02 ppm1 0.666 ppm2 9.144 CV 1 ASSI { 5620} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 87 and name HG13)) 2.300 2.300 3.700 peak 5620 spectrum 1 weight 0.10000E+01 volume 0.11694E-01 ppm1 0.666 ppm2 0.991 CV 1 ASSI { 5625} ( segid "KH " and resid 113 and name HB% ) (( segid "KH " and resid 151 and name HN )) 3.100 1.200 1.200 peak 5625 spectrum 1 weight 0.10000E+01 volume 0.21337E-02 ppm1 1.379 ppm2 8.457 CV 1 ASSI { 5630} (( segid "KH " and resid 117 and name HA1 )) (( segid "KH " and resid 117 and name HN )) 3.400 1.400 1.400 peak 5630 spectrum 1 weight 0.10000E+01 volume 0.16741E-02 ppm1 3.966 ppm2 8.408 CV 1 ASSI { 5631} (( segid "KH " and resid 117 and name HA2 )) (( segid "KH " and resid 117 and name HN )) 2.700 0.900 0.900 peak 5631 spectrum 1 weight 0.10000E+01 volume 0.22646E-02 ppm1 3.729 ppm2 8.426 CV 1 ASSI { 5632} (( segid "KH " and resid 117 and name HA1 )) ( segid "KH " and resid 120 and name HG2%) 3.000 1.100 1.100 peak 5632 spectrum 1 weight 0.10000E+01 volume 0.14457E-02 ppm1 3.966 ppm2 0.732 CV 1 ASSI { 5634} (( segid "KH " and resid 128 and name HB2 )) (( segid "KH " and resid 129 and name HN )) 3.100 1.200 1.200 peak 5634 spectrum 1 weight 0.10000E+01 volume 0.34958E-02 ppm1 2.976 ppm2 8.193 CV 1 ASSI { 5637} (( segid "KH " and resid 148 and name HG3 )) (( segid "KH " and resid 148 and name HN )) 3.600 1.600 1.600 peak 5637 spectrum 1 weight 0.10000E+01 volume 0.23175E-02 ppm1 2.221 ppm2 9.261 CV 1 ASSI { 5638} (( segid "KH " and resid 148 and name HG2 )) (( segid "KH " and resid 149 and name HN )) 2.900 1.100 1.100 peak 5638 spectrum 1 weight 0.10000E+01 volume 0.18941E-02 ppm1 2.273 ppm2 8.421 CV 1 ASSI { 5639} (( segid "KH " and resid 148 and name HG3 )) (( segid "KH " and resid 149 and name HN )) 2.800 1.000 1.000 peak 5639 spectrum 1 weight 0.10000E+01 volume 0.16908E-02 ppm1 2.221 ppm2 8.421 CV 1 ASSI { 5642} (( segid "KH " and resid 148 and name HG3 )) (( segid "KH " and resid 148 and name HB2 )) 1.900 0.400 0.400 peak 5642 spectrum 1 weight 0.10000E+01 volume 0.30028E-01 ppm1 2.221 ppm2 2.054 CV 1 OR { 5642} (( segid "KH " and resid 148 and name HG3 )) (( segid "KH " and resid 148 and name HB3 )) ASSI { 5649} (( segid "KH " and resid 150 and name HG3 )) (( segid "KH " and resid 149 and name HA )) 2.900 1.000 1.000 peak 5649 spectrum 1 weight 0.10000E+01 volume 0.17437E-02 ppm1 2.234 ppm2 4.982 CV 1 ASSI { 5661} (( segid "KH " and resid 112 and name HB3 )) (( segid "KH " and resid 112 and name HG2 )) 2.000 0.500 0.500 peak 5661 spectrum 1 weight 0.10000E+01 volume 0.16337E-01 ppm1 1.770 ppm2 2.016 CV 1 OR { 5661} (( segid "KH " and resid 112 and name HB3 )) (( segid "KH " and resid 112 and name HG3 )) ASSI { 5667} (( segid "KH " and resid 32 and name HG3 )) (( segid "KH " and resid 32 and name HB3 )) 2.100 2.100 3.900 peak 5667 spectrum 1 weight 0.10000E+01 volume 0.22975E-01 ppm1 2.405 ppm2 2.131 CV 1 ASSI { 5669} ( segid "KH " and resid 133 and name HD2%) (( segid "KH " and resid 133 and name HB2 )) 3.000 1.100 1.100 peak 5669 spectrum 1 weight 0.10000E+01 volume 0.33008E-02 ppm1 0.886 ppm2 1.791 CV 1 ASSI { 5672} (( segid "KH " and resid 146 and name HD2 )) (( segid "KH " and resid 144 and name HG2 )) 3.700 1.700 1.700 peak 5672 spectrum 1 weight 0.10000E+01 volume 0.13788E-02 ppm1 4.163 ppm2 2.107 CV 1 ASSI { 5673} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 144 and name HG2 )) 2.700 2.700 3.300 peak 5673 spectrum 1 weight 0.10000E+01 volume 0.40557E-02 ppm1 1.631 ppm2 2.089 CV 1 OR { 5673} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 144 and name HG3 )) OR { 5673} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 144 and name HG2 )) ASSI { 5680} (( segid "KH " and resid 161 and name HB3 )) (( segid "KH " and resid 161 and name HN )) 3.400 1.400 1.400 peak 5680 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 2.711 ppm2 8.519 CV 1 ASSI { 5681} (( segid "KH " and resid 161 and name HB3 )) (( segid "KH " and resid 162 and name HN )) 3.000 1.100 1.100 peak 5681 spectrum 1 weight 0.10000E+01 volume 0.18078E-02 ppm1 2.711 ppm2 7.555 CV 1 ASSI { 5682} (( segid "KH " and resid 161 and name HB2 )) ( segid "KH " and resid 161 and name HE% ) 4.000 2.000 2.000 peak 5682 spectrum 1 weight 0.10000E+01 volume 0.15014E-02 ppm1 2.897 ppm2 6.870 CV 1 ASSI { 5683} (( segid "KH " and resid 161 and name HB3 )) ( segid "KH " and resid 161 and name HE% ) 3.800 1.800 1.800 peak 5683 spectrum 1 weight 0.10000E+01 volume 0.20223E-02 ppm1 2.711 ppm2 6.870 CV 1 ASSI { 5689} (( segid "KH " and resid 161 and name HB2 )) (( segid "KH " and resid 161 and name HB3 )) 1.900 0.400 0.400 peak 5689 spectrum 1 weight 0.10000E+01 volume 0.11061E-01 ppm1 2.895 ppm2 2.711 CV 1 ASSI { 5696} (( segid "KH " and resid 26 and name HA )) (( segid "KH " and resid 26 and name HD2 )) 3.300 1.300 1.300 peak 5696 spectrum 1 weight 0.10000E+01 volume 0.11644E-02 ppm1 5.687 ppm2 6.709 CV 1 ASSI { 5697} ( segid "KH " and resid 27 and name HG1%) ( segid "KH " and resid 27 and name HG2%) 2.100 0.500 0.500 peak 5697 spectrum 1 weight 0.10000E+01 volume 0.20760E-01 ppm1 0.908 ppm2 0.749 CV 1 ASSI { 5699} (( segid "KH " and resid 29 and name HB )) (( segid "KH " and resid 29 and name HG12)) 3.300 1.300 1.300 peak 5699 spectrum 1 weight 0.10000E+01 volume 0.14568E-02 ppm1 1.555 ppm2 1.268 CV 1 ASSI { 5700} (( segid "KH " and resid 29 and name HB )) ( segid "KH " and resid 33 and name HB% ) 2.900 1.000 1.000 peak 5700 spectrum 1 weight 0.10000E+01 volume 0.21225E-02 ppm1 1.557 ppm2 0.569 CV 1 ASSI { 5701} ( segid "KH " and resid 29 and name HD1%) (( segid "KH " and resid 37 and name HG13)) 2.500 0.800 0.800 peak 5701 spectrum 1 weight 0.10000E+01 volume 0.36740E-02 ppm1 0.440 ppm2 1.171 CV 1 ASSI { 5702} (( segid "KH " and resid 29 and name HG13)) ( segid "KH " and resid 29 and name HD1%) 2.600 0.800 0.800 peak 5702 spectrum 1 weight 0.10000E+01 volume 0.37744E-02 ppm1 0.902 ppm2 0.439 CV 1 ASSI { 5704} (( segid "KH " and resid 30 and name HD3 )) (( segid "KH " and resid 30 and name HG3 )) 2.900 1.000 1.000 peak 5704 spectrum 1 weight 0.10000E+01 volume 0.13008E-02 ppm1 3.212 ppm2 1.792 CV 1 ASSI { 5709} (( segid "KH " and resid 30 and name HG3 )) (( segid "KH " and resid 30 and name HB2 )) 3.000 1.100 1.100 peak 5709 spectrum 1 weight 0.10000E+01 volume 0.26657E-02 ppm1 1.792 ppm2 2.522 CV 1 ASSI { 5712} (( segid "KH " and resid 30 and name HG2 )) (( segid "KH " and resid 30 and name HD3 )) 3.400 1.500 1.500 peak 5712 spectrum 1 weight 0.10000E+01 volume 0.16518E-02 ppm1 2.094 ppm2 3.198 CV 1 ASSI { 5713} (( segid "KH " and resid 30 and name HG2 )) (( segid "KH " and resid 30 and name HG3 )) 1.900 0.400 0.400 peak 5713 spectrum 1 weight 0.10000E+01 volume 0.96992E-02 ppm1 2.094 ppm2 1.797 CV 1 ASSI { 5714} (( segid "KH " and resid 30 and name HG2 )) (( segid "KH " and resid 30 and name HB3 )) 3.000 1.100 1.100 peak 5714 spectrum 1 weight 0.10000E+01 volume 0.40334E-02 ppm1 2.094 ppm2 1.567 CV 1 ASSI { 5715} (( segid "KH " and resid 30 and name HG3 )) (( segid "KH " and resid 30 and name HB3 )) 2.400 0.700 0.700 peak 5715 spectrum 1 weight 0.10000E+01 volume 0.43063E-02 ppm1 1.792 ppm2 1.567 CV 1 ASSI { 5717} (( segid "KH " and resid 30 and name HD2 )) (( segid "KH " and resid 30 and name HG3 )) 2.900 1.000 1.000 peak 5717 spectrum 1 weight 0.10000E+01 volume 0.35069E-02 ppm1 3.780 ppm2 1.804 CV 1 ASSI { 5719} (( segid "KH " and resid 33 and name HA )) ( segid "KH " and resid 36 and name HB% ) 3.100 1.200 1.200 peak 5719 spectrum 1 weight 0.10000E+01 volume 0.16602E-02 ppm1 4.072 ppm2 1.378 CV 1 ASSI { 5721} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 58 and name HA )) 3.400 3.400 2.600 peak 5721 spectrum 1 weight 0.10000E+01 volume 0.17103E-02 ppm1 0.939 ppm2 4.647 CV 1 ASSI { 5723} ( segid "KH " and resid 36 and name HB% ) ( segid "KH " and resid 96 and name HE% ) 2.900 1.000 1.000 peak 5723 spectrum 1 weight 0.10000E+01 volume 0.23315E-02 ppm1 1.387 ppm2 7.223 CV 1 ASSI { 5732} (( segid "KH " and resid 37 and name HG13)) (( segid "KH " and resid 37 and name HG12)) 1.800 0.400 0.400 peak 5732 spectrum 1 weight 0.10000E+01 volume 0.92280E-02 ppm1 1.162 ppm2 1.482 CV 1 ASSI { 5734} (( segid "KH " and resid 37 and name HG13)) ( segid "KH " and resid 37 and name HG2%) 2.400 0.700 0.700 peak 5734 spectrum 1 weight 0.10000E+01 volume 0.47103E-02 ppm1 1.162 ppm2 0.725 CV 1 ASSI { 5735} (( segid "KH " and resid 37 and name HG13)) ( segid "KH " and resid 37 and name HD1%) 2.500 0.800 0.800 peak 5735 spectrum 1 weight 0.10000E+01 volume 0.41448E-02 ppm1 1.162 ppm2 0.613 CV 1 ASSI { 5741} (( segid "KH " and resid 38 and name HG12)) ( segid "KH " and resid 38 and name HG2%) 3.000 1.100 1.100 peak 5741 spectrum 1 weight 0.10000E+01 volume 0.68578E-02 ppm1 1.651 ppm2 1.070 CV 1 ASSI { 5743} ( segid "KH " and resid 45 and name HD1%) (( segid "KH " and resid 45 and name HG13)) 2.200 0.600 0.600 peak 5743 spectrum 1 weight 0.10000E+01 volume 0.81112E-02 ppm1 0.762 ppm2 1.227 CV 1 ASSI { 5753} (( segid "KH " and resid 44 and name HB2 )) (( segid "KH " and resid 45 and name HN )) 3.900 1.900 1.900 peak 5753 spectrum 1 weight 0.10000E+01 volume 0.11030E-02 ppm1 3.152 ppm2 7.849 CV 1 ASSI { 5755} (( segid "KH " and resid 46 and name HB2 )) (( segid "KH " and resid 46 and name HG2 )) 2.400 0.700 0.700 peak 5755 spectrum 1 weight 0.10000E+01 volume 0.72147E-02 ppm1 1.888 ppm2 1.625 CV 1 OR { 5755} (( segid "KH " and resid 46 and name HB3 )) (( segid "KH " and resid 46 and name HG2 )) ASSI { 5756} (( segid "KH " and resid 46 and name HB3 )) (( segid "KH " and resid 46 and name HG3 )) 2.400 0.700 0.700 peak 5756 spectrum 1 weight 0.10000E+01 volume 0.53147E-02 ppm1 1.888 ppm2 1.443 CV 1 OR { 5756} (( segid "KH " and resid 46 and name HB2 )) (( segid "KH " and resid 46 and name HG3 )) ASSI { 5758} (( segid "KH " and resid 46 and name HG3 )) (( segid "KH " and resid 46 and name HG2 )) 1.700 0.300 0.500 peak 5758 spectrum 1 weight 0.10000E+01 volume 0.16270E-01 ppm1 1.457 ppm2 1.590 CV 1 ASSI { 5760} (( segid "KH " and resid 46 and name HG3 )) (( segid "KH " and resid 46 and name HN )) 2.600 0.900 0.900 peak 5760 spectrum 1 weight 0.10000E+01 volume 0.14234E-02 ppm1 1.448 ppm2 7.680 CV 1 ASSI { 5761} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 47 and name HB3 )) 1.600 0.300 0.600 peak 5761 spectrum 1 weight 0.10000E+01 volume 0.24242E-01 ppm1 2.185 ppm2 2.108 CV 1 ASSI { 5763} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 47 and name HN )) 2.800 1.000 1.000 peak 5763 spectrum 1 weight 0.10000E+01 volume 0.21504E-02 ppm1 2.188 ppm2 7.915 CV 1 ASSI { 5764} (( segid "KH " and resid 47 and name HB3 )) (( segid "KH " and resid 47 and name HN )) 3.100 1.200 1.200 peak 5764 spectrum 1 weight 0.10000E+01 volume 0.15209E-02 ppm1 2.110 ppm2 7.917 CV 1 ASSI { 5769} (( segid "KH " and resid 48 and name HG )) ( segid "KH " and resid 48 and name HD1%) 2.600 0.800 0.800 peak 5769 spectrum 1 weight 0.10000E+01 volume 0.40668E-02 ppm1 1.509 ppm2 0.937 CV 1 ASSI { 5779} (( segid "KH " and resid 93 and name HA )) (( segid "KH " and resid 94 and name HN )) 3.000 1.100 1.100 peak 5779 spectrum 1 weight 0.10000E+01 volume 0.24094E-02 ppm1 4.025 ppm2 7.682 CV 1 ASSI { 5782} ( segid "KH " and resid 170 and name HD1%) (( segid "KH " and resid 109 and name HG12)) 3.000 1.100 1.100 peak 5782 spectrum 1 weight 0.10000E+01 volume 0.26963E-02 ppm1 0.608 ppm2 1.291 CV 1 ASSI { 5784} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 173 and name HB )) 2.300 0.600 0.600 peak 5784 spectrum 1 weight 0.10000E+01 volume 0.73952E-02 ppm1 0.682 ppm2 1.924 CV 1 ASSI { 5786} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 174 and name HN )) 3.200 1.300 1.300 peak 5786 spectrum 1 weight 0.10000E+01 volume 0.23509E-02 ppm1 0.681 ppm2 8.103 CV 1 ASSI { 5787} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 173 and name HN )) 3.600 1.700 1.700 peak 5787 spectrum 1 weight 0.10000E+01 volume 0.21560E-02 ppm1 0.681 ppm2 7.930 CV 1 ASSI { 5790} (( segid "KH " and resid 173 and name HB )) (( segid "KH " and resid 174 and name HN )) 2.900 1.000 1.000 peak 5790 spectrum 1 weight 0.10000E+01 volume 0.14791E-02 ppm1 1.949 ppm2 8.109 CV 1 ASSI { 5792} (( segid "KH " and resid 174 and name HB3 )) (( segid "KH " and resid 174 and name HN )) 3.400 1.400 1.400 peak 5792 spectrum 1 weight 0.10000E+01 volume 0.10669E-02 ppm1 1.508 ppm2 8.100 CV 1 ASSI { 5793} (( segid "KH " and resid 174 and name HB3 )) (( segid "KH " and resid 175 and name HN )) 3.000 1.100 1.100 peak 5793 spectrum 1 weight 0.10000E+01 volume 0.10947E-02 ppm1 1.508 ppm2 7.940 CV 1 ASSI { 5796} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 179 and name HG2 )) 3.000 3.000 3.000 peak 5796 spectrum 1 weight 0.10000E+01 volume 0.24819E-02 ppm1 0.683 ppm2 2.352 CV 1 OR { 5796} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 179 and name HG3 )) ASSI { 5797} (( segid "KH " and resid 176 and name HB3 )) (( segid "KH " and resid 177 and name HN )) 2.700 0.900 0.900 peak 5797 spectrum 1 weight 0.10000E+01 volume 0.25376E-02 ppm1 2.165 ppm2 7.773 CV 1 OR { 5797} (( segid "KH " and resid 176 and name HB2 )) (( segid "KH " and resid 177 and name HN )) ASSI { 5809} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HG2 )) 1.700 0.300 0.500 peak 5809 spectrum 1 weight 0.10000E+01 volume 0.20635E-01 ppm1 1.209 ppm2 1.293 CV 1 ASSI { 5813} (( segid "KH " and resid 57 and name HD2 )) (( segid "KH " and resid 57 and name HG3 )) 2.400 0.700 0.700 peak 5813 spectrum 1 weight 0.10000E+01 volume 0.68916E-02 ppm1 1.585 ppm2 1.209 CV 1 OR { 5813} (( segid "KH " and resid 57 and name HD3 )) (( segid "KH " and resid 57 and name HG3 )) ASSI { 5815} (( segid "KH " and resid 57 and name HD2 )) (( segid "KH " and resid 57 and name HA )) 3.400 1.400 1.400 peak 5815 spectrum 1 weight 0.10000E+01 volume 0.28077E-02 ppm1 1.583 ppm2 4.646 CV 1 OR { 5815} (( segid "KH " and resid 57 and name HD3 )) (( segid "KH " and resid 57 and name HA )) ASSI { 5818} (( segid "KH " and resid 58 and name HG12)) (( segid "KH " and resid 58 and name HN )) 2.500 0.800 0.800 peak 5818 spectrum 1 weight 0.10000E+01 volume 0.28189E-02 ppm1 1.375 ppm2 8.659 CV 1 ASSI { 5821} ( segid "KH " and resid 36 and name HB% ) ( segid "KH " and resid 37 and name HD1%) 2.700 0.900 0.900 peak 5821 spectrum 1 weight 0.10000E+01 volume 0.53008E-02 ppm1 1.363 ppm2 0.618 CV 1 ASSI { 5834} (( segid "KH " and resid 86 and name HG2 )) (( segid "KH " and resid 86 and name HA )) 3.400 1.400 1.400 peak 5834 spectrum 1 weight 0.10000E+01 volume 0.15404E-02 ppm1 1.754 ppm2 4.170 CV 1 ASSI { 5841} (( segid "KH " and resid 87 and name HA )) ( segid "KH " and resid 87 and name HG2%) 2.600 0.800 0.800 peak 5841 spectrum 1 weight 0.10000E+01 volume 0.46518E-02 ppm1 3.537 ppm2 0.675 CV 1 ASSI { 5842} (( segid "KH " and resid 87 and name HA )) ( segid "KH " and resid 87 and name HD1%) 3.300 1.400 1.400 peak 5842 spectrum 1 weight 0.10000E+01 volume 0.46239E-02 ppm1 3.538 ppm2 0.591 CV 1 ASSI { 5850} (( segid "KH " and resid 90 and name HB3 )) (( segid "KH " and resid 87 and name HA )) 3.100 1.200 1.200 peak 5850 spectrum 1 weight 0.10000E+01 volume 0.15878E-02 ppm1 1.942 ppm2 3.535 CV 1 OR { 5850} (( segid "KH " and resid 90 and name HB2 )) (( segid "KH " and resid 87 and name HA )) ASSI { 5852} (( segid "KH " and resid 91 and name HA )) (( segid "KH " and resid 94 and name HN )) 2.700 2.700 3.300 peak 5852 spectrum 1 weight 0.10000E+01 volume 0.35404E-02 ppm1 4.128 ppm2 7.664 CV 1 ASSI { 5861} (( segid "KH " and resid 92 and name HD2 )) (( segid "KH " and resid 92 and name HA )) 2.600 0.800 0.800 peak 5861 spectrum 1 weight 0.10000E+01 volume 0.24680E-02 ppm1 1.844 ppm2 4.304 CV 1 ASSI { 5862} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HA )) 3.200 1.200 1.200 peak 5862 spectrum 1 weight 0.10000E+01 volume 0.42339E-02 ppm1 1.761 ppm2 4.314 CV 1 ASSI { 5869} (( segid "KH " and resid 93 and name HG2 )) (( segid "KH " and resid 93 and name HN )) 2.800 0.900 0.900 peak 5869 spectrum 1 weight 0.10000E+01 volume 0.24596E-02 ppm1 2.427 ppm2 8.470 CV 1 ASSI { 5870} (( segid "KH " and resid 93 and name HG2 )) (( segid "KH " and resid 94 and name HN )) 3.300 1.400 1.400 peak 5870 spectrum 1 weight 0.10000E+01 volume 0.11671E-02 ppm1 2.427 ppm2 7.660 CV 1 ASSI { 5871} (( segid "KH " and resid 93 and name HG2 )) (( segid "KH " and resid 93 and name HA )) 3.200 1.300 1.300 peak 5871 spectrum 1 weight 0.10000E+01 volume 0.35014E-02 ppm1 2.427 ppm2 4.028 CV 1 ASSI { 5872} (( segid "KH " and resid 93 and name HG2 )) (( segid "KH " and resid 90 and name HA )) 2.600 0.800 0.800 peak 5872 spectrum 1 weight 0.10000E+01 volume 0.27716E-02 ppm1 2.427 ppm2 4.185 CV 1 ASSI { 5874} (( segid "KH " and resid 93 and name HG2 )) (( segid "KH " and resid 93 and name HG3 )) 1.600 0.300 0.600 peak 5874 spectrum 1 weight 0.10000E+01 volume 0.29081E-01 ppm1 2.426 ppm2 2.355 CV 1 ASSI { 5876} (( segid "KH " and resid 93 and name HB2 )) (( segid "KH " and resid 93 and name HG2 )) 2.700 0.900 0.900 peak 5876 spectrum 1 weight 0.10000E+01 volume 0.58049E-02 ppm1 2.212 ppm2 2.424 CV 1 ASSI { 5880} (( segid "KH " and resid 104 and name HG3 )) (( segid "KH " and resid 104 and name HG2 )) 2.000 0.500 0.500 peak 5880 spectrum 1 weight 0.10000E+01 volume 0.74290E-02 ppm1 1.148 ppm2 1.254 CV 1 ASSI { 5881} (( segid "KH " and resid 104 and name HD3 )) (( segid "KH " and resid 104 and name HG2 )) 2.400 0.700 0.700 peak 5881 spectrum 1 weight 0.10000E+01 volume 0.66462E-02 ppm1 1.662 ppm2 1.259 CV 1 OR { 5881} (( segid "KH " and resid 104 and name HD2 )) (( segid "KH " and resid 104 and name HG2 )) ASSI { 5892} ( segid "KH " and resid 139 and name HG1%) (( segid "KH " and resid 139 and name HN )) 2.900 1.000 1.000 peak 5892 spectrum 1 weight 0.10000E+01 volume 0.32813E-02 ppm1 0.952 ppm2 9.183 CV 1 OR { 5892} ( segid "KH " and resid 139 and name HG2%) (( segid "KH " and resid 139 and name HN )) ASSI { 5906} (( segid "KH " and resid 176 and name HG2 )) ( segid "KH " and resid 175 and name HB% ) 3.700 1.700 1.700 peak 5906 spectrum 1 weight 0.10000E+01 volume 0.17186E-02 ppm1 2.528 ppm2 1.516 CV 1 ASSI { 5907} (( segid "KH " and resid 22 and name HB2 )) (( segid "KH " and resid 22 and name HA )) 3.100 1.200 1.200 peak 5907 spectrum 1 weight 0.10000E+01 volume 0.28579E-02 ppm1 1.901 ppm2 3.983 CV 1 ASSI { 5908} (( segid "KH " and resid 22 and name HB3 )) (( segid "KH " and resid 22 and name HG3 )) 2.700 0.900 0.900 peak 5908 spectrum 1 weight 0.10000E+01 volume 0.55849E-02 ppm1 1.830 ppm2 2.134 CV 1 ASSI { 5909} (( segid "KH " and resid 22 and name HB3 )) (( segid "KH " and resid 22 and name HB2 )) 1.700 0.400 0.500 peak 5909 spectrum 1 weight 0.10000E+01 volume 0.15217E-01 ppm1 1.830 ppm2 1.902 CV 1 ASSI { 5911} (( segid "KH " and resid 22 and name HB3 )) ( segid "KH " and resid 74 and name HG2%) 3.600 1.700 1.700 peak 5911 spectrum 1 weight 0.10000E+01 volume 0.17465E-02 ppm1 1.830 ppm2 1.099 CV 1 ASSI { 5912} (( segid "KH " and resid 22 and name HB2 )) ( segid "KH " and resid 74 and name HG2%) 2.900 1.000 1.000 peak 5912 spectrum 1 weight 0.10000E+01 volume 0.18635E-02 ppm1 1.903 ppm2 1.099 CV 1 ASSI { 5916} (( segid "KH " and resid 30 and name HG3 )) ( segid "KH " and resid 33 and name HB% ) 3.500 1.500 1.500 peak 5916 spectrum 1 weight 0.10000E+01 volume 0.22451E-02 ppm1 1.792 ppm2 0.560 CV 1 ASSI { 5917} (( segid "KH " and resid 30 and name HG2 )) ( segid "KH " and resid 33 and name HB% ) 2.800 0.900 0.900 peak 5917 spectrum 1 weight 0.10000E+01 volume 0.22228E-02 ppm1 2.094 ppm2 0.567 CV 1 ASSI { 5919} (( segid "KH " and resid 30 and name HG3 )) ( segid "KH " and resid 29 and name HG2%) 4.100 2.100 1.900 peak 5919 spectrum 1 weight 0.10000E+01 volume 0.12395E-02 ppm1 1.792 ppm2 0.666 CV 1 ASSI { 5924} (( segid "KH " and resid 90 and name HD2 )) (( segid "KH " and resid 90 and name HD3 )) 1.700 0.300 0.500 peak 5924 spectrum 1 weight 0.10000E+01 volume 0.18955E-01 ppm1 1.722 ppm2 1.582 CV 1 ASSI { 5927} (( segid "KH " and resid 90 and name HD3 )) (( segid "KH " and resid 90 and name HA )) 2.900 1.100 1.100 peak 5927 spectrum 1 weight 0.10000E+01 volume 0.27242E-02 ppm1 1.579 ppm2 4.181 CV 1 ASSI { 5939} (( segid "KH " and resid 100 and name HB2 )) (( segid "KH " and resid 100 and name HN )) 2.400 0.700 0.700 peak 5939 spectrum 1 weight 0.10000E+01 volume 0.37409E-02 ppm1 1.999 ppm2 8.545 CV 1 ASSI { 5943} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 102 and name HG3 )) 2.300 0.600 0.600 peak 5943 spectrum 1 weight 0.10000E+01 volume 0.10301E-01 ppm1 1.904 ppm2 2.211 CV 1 OR { 5943} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 102 and name HG2 )) ASSI { 5948} (( segid "KH " and resid 102 and name HG3 )) (( segid "KH " and resid 102 and name HN )) 2.900 1.100 1.100 peak 5948 spectrum 1 weight 0.10000E+01 volume 0.24707E-02 ppm1 2.212 ppm2 8.460 CV 1 OR { 5948} (( segid "KH " and resid 102 and name HG2 )) (( segid "KH " and resid 102 and name HN )) ASSI { 5952} (( segid "KH " and resid 104 and name HG2 )) (( segid "KH " and resid 104 and name HD3 )) 2.600 0.900 0.900 peak 5952 spectrum 1 weight 0.10000E+01 volume 0.34206E-02 ppm1 1.249 ppm2 1.641 CV 1 OR { 5952} (( segid "KH " and resid 104 and name HG2 )) (( segid "KH " and resid 104 and name HB2 )) OR { 5952} (( segid "KH " and resid 104 and name HG2 )) (( segid "KH " and resid 104 and name HD2 )) ASSI { 5956} (( segid "KH " and resid 118 and name HD2 )) ( segid "KH " and resid 173 and name HG2%) 3.300 1.400 1.400 peak 5956 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 3.126 ppm2 0.676 CV 1 ASSI { 5957} (( segid "KH " and resid 118 and name HD2 )) (( segid "KH " and resid 118 and name HG3 )) 2.500 0.800 0.800 peak 5957 spectrum 1 weight 0.10000E+01 volume 0.51169E-02 ppm1 3.126 ppm2 1.668 CV 1 OR { 5957} (( segid "KH " and resid 118 and name HD2 )) (( segid "KH " and resid 118 and name HG2 )) ASSI { 5962} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 118 and name HB3 )) 3.000 1.100 1.100 peak 5962 spectrum 1 weight 0.10000E+01 volume 0.24262E-02 ppm1 1.315 ppm2 1.770 CV 1 OR { 5962} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 118 and name HB2 )) ASSI { 5963} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 112 and name HA )) 2.600 2.600 3.400 peak 5963 spectrum 1 weight 0.10000E+01 volume 0.20389E-02 ppm1 0.683 ppm2 4.412 CV 1 ASSI { 5966} ( segid "KH " and resid 177 and name HG1%) ( segid "KH " and resid 115 and name HB% ) 3.000 1.100 1.100 peak 5966 spectrum 1 weight 0.10000E+01 volume 0.21309E-02 ppm1 0.953 ppm2 1.316 CV 1 ASSI { 5971} (( segid "KH " and resid 120 and name HA )) ( segid "KH " and resid 120 and name HG2%) 3.300 1.400 1.400 peak 5971 spectrum 1 weight 0.10000E+01 volume 0.24596E-02 ppm1 3.341 ppm2 0.730 CV 1 ASSI { 5990} (( segid "KH " and resid 170 and name HA )) (( segid "KH " and resid 170 and name HG13)) 3.100 1.200 1.200 peak 5990 spectrum 1 weight 0.10000E+01 volume 0.24958E-02 ppm1 3.545 ppm2 0.773 CV 1 OR { 5990} (( segid "KH " and resid 170 and name HA )) (( segid "KH " and resid 170 and name HG12)) ASSI { 5991} ( segid "KH " and resid 170 and name HD1%) ( segid "KH " and resid 170 and name HG2%) 1.900 0.400 0.400 peak 5991 spectrum 1 weight 0.10000E+01 volume 0.29721E-01 ppm1 0.609 ppm2 0.682 CV 1 ASSI { 5992} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 86 and name HG2 )) 2.900 2.900 3.100 peak 5992 spectrum 1 weight 0.10000E+01 volume 0.28440E-02 ppm1 0.804 ppm2 1.760 CV 1 ASSI { 5993} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 48 and name HB2 )) 2.600 0.900 0.900 peak 5993 spectrum 1 weight 0.10000E+01 volume 0.56629E-02 ppm1 0.804 ppm2 1.611 CV 1 ASSI { 5994} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 96 and name HB2 )) 3.100 1.200 1.200 peak 5994 spectrum 1 weight 0.10000E+01 volume 0.26490E-02 ppm1 0.569 ppm2 2.824 CV 1 OR { 5994} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 96 and name HB3 )) ASSI { 5996} ( segid "KH " and resid 91 and name HD2%) ( segid "KH " and resid 88 and name HD% ) 3.400 1.400 1.400 peak 5996 spectrum 1 weight 0.10000E+01 volume 0.14513E-02 ppm1 0.565 ppm2 7.395 CV 1 ASSI { 5997} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 90 and name HG2 )) 3.300 1.300 1.300 peak 5997 spectrum 1 weight 0.10000E+01 volume 0.18467E-02 ppm1 0.569 ppm2 1.198 CV 1 OR { 5997} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 90 and name HG3 )) ASSI { 5998} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 91 and name HG )) 2.400 0.700 0.700 peak 5998 spectrum 1 weight 0.10000E+01 volume 0.50780E-02 ppm1 0.569 ppm2 1.976 CV 1 ASSI { 5999} (( segid "KH " and resid 170 and name HB )) (( segid "KH " and resid 167 and name HA )) 3.800 1.800 1.800 peak 5999 spectrum 1 weight 0.10000E+01 volume 0.16351E-02 ppm1 1.767 ppm2 3.593 CV 1 ASSI { 6003} ( segid "KH " and resid 173 and name HD1%) (( segid "KH " and resid 170 and name HA )) 2.700 0.900 0.900 peak 6003 spectrum 1 weight 0.10000E+01 volume 0.34039E-02 ppm1 0.727 ppm2 3.546 CV 1 ASSI { 6005} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 119 and name HA )) 3.000 1.200 1.200 peak 6005 spectrum 1 weight 0.10000E+01 volume 0.14624E-02 ppm1 0.678 ppm2 3.329 CV 1 ASSI { 6007} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 175 and name HN )) 3.900 1.900 1.900 peak 6007 spectrum 1 weight 0.10000E+01 volume 0.14066E-02 ppm1 0.843 ppm2 7.928 CV 1 ASSI { 6008} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 175 and name HN )) 3.500 1.500 1.500 peak 6008 spectrum 1 weight 0.10000E+01 volume 0.13036E-02 ppm1 0.685 ppm2 7.930 CV 1 ASSI { 6009} ( segid "KH " and resid 111 and name HG1%) ( segid "KH " and resid 174 and name HD1%) 2.100 0.500 0.500 peak 6009 spectrum 1 weight 0.10000E+01 volume 0.15799E-01 ppm1 0.680 ppm2 0.834 CV 1 ASSI { 6017} ( segid "KH " and resid 130 and name HD1%) ( segid "KH " and resid 166 and name HB% ) 2.700 0.900 0.900 peak 6017 spectrum 1 weight 0.10000E+01 volume 0.36406E-02 ppm1 0.771 ppm2 1.283 CV 1 ASSI { 6022} (( segid "KH " and resid 131 and name HG3 )) (( segid "KH " and resid 135 and name HA )) 3.200 1.300 1.300 peak 6022 spectrum 1 weight 0.10000E+01 volume 0.14652E-02 ppm1 2.408 ppm2 4.097 CV 1 ASSI { 6023} (( segid "KH " and resid 134 and name HB )) (( segid "KH " and resid 134 and name HA )) 2.700 0.900 0.900 peak 6023 spectrum 1 weight 0.10000E+01 volume 0.32952E-02 ppm1 4.212 ppm2 4.374 CV 1 ASSI { 6024} (( segid "KH " and resid 137 and name HB2 )) (( segid "KH " and resid 137 and name HB3 )) 1.500 0.300 0.700 peak 6024 spectrum 1 weight 0.10000E+01 volume 0.44234E-01 ppm1 2.226 ppm2 2.074 CV 1 ASSI { 6028} ( segid "KH " and resid 120 and name HG2%) (( segid "KH " and resid 127 and name HB )) 3.300 3.300 2.700 peak 6028 spectrum 1 weight 0.10000E+01 volume 0.25988E-02 ppm1 0.727 ppm2 1.781 CV 1 ASSI { 6029} ( segid "KH " and resid 120 and name HG2%) (( segid "KH " and resid 120 and name HB )) 2.700 0.900 0.900 peak 6029 spectrum 1 weight 0.10000E+01 volume 0.27270E-02 ppm1 0.727 ppm2 1.936 CV 1 ASSI { 6040} (( segid "KH " and resid 118 and name HG2 )) (( segid "KH " and resid 118 and name HD3 )) 2.800 1.000 1.000 peak 6040 spectrum 1 weight 0.10000E+01 volume 0.22507E-02 ppm1 1.658 ppm2 3.041 CV 1 OR { 6040} (( segid "KH " and resid 118 and name HG3 )) (( segid "KH " and resid 118 and name HD3 )) ASSI { 6045} (( segid "KH " and resid 118 and name HB2 )) (( segid "KH " and resid 118 and name HD3 )) 2.500 0.800 0.800 peak 6045 spectrum 1 weight 0.10000E+01 volume 0.46685E-02 ppm1 1.786 ppm2 3.032 CV 1 OR { 6045} (( segid "KH " and resid 118 and name HB3 )) (( segid "KH " and resid 118 and name HD3 )) ASSI { 6047} (( segid "KH " and resid 118 and name HB3 )) (( segid "KH " and resid 118 and name HG3 )) 1.900 0.400 0.400 peak 6047 spectrum 1 weight 0.10000E+01 volume 0.23356E-01 ppm1 1.786 ppm2 1.660 CV 1 OR { 6047} (( segid "KH " and resid 118 and name HB2 )) (( segid "KH " and resid 118 and name HG3 )) OR { 6047} (( segid "KH " and resid 118 and name HB3 )) (( segid "KH " and resid 118 and name HG2 )) OR { 6047} (( segid "KH " and resid 118 and name HB2 )) (( segid "KH " and resid 118 and name HG2 )) ASSI { 6049} (( segid "KH " and resid 118 and name HD2 )) (( segid "KH " and resid 118 and name HD3 )) 1.800 0.400 0.400 peak 6049 spectrum 1 weight 0.10000E+01 volume 0.98243E-02 ppm1 3.127 ppm2 3.044 CV 1 ASSI { 6051} (( segid "KH " and resid 118 and name HB3 )) ( segid "KH " and resid 173 and name HG2%) 2.700 0.900 0.900 peak 6051 spectrum 1 weight 0.10000E+01 volume 0.43286E-02 ppm1 1.786 ppm2 0.671 CV 1 OR { 6051} (( segid "KH " and resid 118 and name HB2 )) ( segid "KH " and resid 173 and name HG2%) ASSI { 6052} ( segid "KH " and resid 175 and name HB% ) (( segid "KH " and resid 178 and name HD2 )) 2.800 1.000 1.000 peak 6052 spectrum 1 weight 0.10000E+01 volume 0.89163E-02 ppm1 1.538 ppm2 1.635 CV 1 OR { 6052} ( segid "KH " and resid 175 and name HB% ) (( segid "KH " and resid 178 and name HD3 )) ASSI { 6061} (( segid "KH " and resid 178 and name HG2 )) (( segid "KH " and resid 178 and name HD3 )) 1.900 0.400 0.400 peak 6061 spectrum 1 weight 0.10000E+01 volume 0.26426E-01 ppm1 1.472 ppm2 1.644 CV 1 OR { 6061} (( segid "KH " and resid 178 and name HG2 )) (( segid "KH " and resid 178 and name HD2 )) ASSI { 6062} (( segid "KH " and resid 178 and name HG3 )) (( segid "KH " and resid 178 and name HD2 )) 1.800 0.400 0.400 peak 6062 spectrum 1 weight 0.10000E+01 volume 0.22691E-01 ppm1 1.392 ppm2 1.644 CV 1 OR { 6062} (( segid "KH " and resid 178 and name HG3 )) (( segid "KH " and resid 178 and name HD3 )) ASSI { 6065} (( segid "KH " and resid 118 and name HD3 )) ( segid "KH " and resid 177 and name HG1%) 3.100 1.200 1.200 peak 6065 spectrum 1 weight 0.10000E+01 volume 0.17298E-02 ppm1 3.037 ppm2 0.948 CV 1 ASSI { 6066} (( segid "KH " and resid 118 and name HD3 )) ( segid "KH " and resid 173 and name HG2%) 3.200 1.300 1.300 peak 6066 spectrum 1 weight 0.10000E+01 volume 0.23342E-02 ppm1 3.037 ppm2 0.676 CV 1 ASSI { 6068} (( segid "KH " and resid 57 and name HE3 )) (( segid "KH " and resid 57 and name HG3 )) 2.500 0.800 0.800 peak 6068 spectrum 1 weight 0.10000E+01 volume 0.52757E-02 ppm1 2.848 ppm2 1.202 CV 1 OR { 6068} (( segid "KH " and resid 57 and name HE2 )) (( segid "KH " and resid 57 and name HG3 )) ASSI { 6074} ( segid "KH " and resid 152 and name HG2%) (( segid "KH " and resid 117 and name HN )) 2.700 2.700 3.300 peak 6074 spectrum 1 weight 0.10000E+01 volume 0.14874E-02 ppm1 0.580 ppm2 8.409 CV 1 ASSI { 6077} (( segid "KH " and resid 87 and name HA )) (( segid "KH " and resid 87 and name HG12)) 2.700 0.900 0.900 peak 6077 spectrum 1 weight 0.10000E+01 volume 0.24791E-02 ppm1 3.538 ppm2 1.804 CV 1 ASSI { 6084} (( segid "KH " and resid 34 and name HB )) (( segid "KH " and resid 35 and name HN )) 2.900 1.000 1.000 peak 6084 spectrum 1 weight 0.10000E+01 volume 0.30974E-02 ppm1 1.943 ppm2 8.416 CV 1 ASSI { 6085} (( segid "KH " and resid 90 and name HB3 )) (( segid "KH " and resid 90 and name HE3 )) 2.900 1.100 1.100 peak 6085 spectrum 1 weight 0.10000E+01 volume 0.58468E-02 ppm1 1.943 ppm2 2.469 CV 1 OR { 6085} (( segid "KH " and resid 90 and name HB3 )) (( segid "KH " and resid 90 and name HE2 )) OR { 6085} (( segid "KH " and resid 90 and name HB2 )) (( segid "KH " and resid 90 and name HE2 )) OR { 6085} (( segid "KH " and resid 90 and name HB2 )) (( segid "KH " and resid 90 and name HE3 )) ASSI { 6086} (( segid "KH " and resid 90 and name HB2 )) (( segid "KH " and resid 90 and name HD3 )) 2.900 1.000 1.000 peak 6086 spectrum 1 weight 0.10000E+01 volume 0.38301E-02 ppm1 1.943 ppm2 1.572 CV 1 OR { 6086} (( segid "KH " and resid 90 and name HB3 )) (( segid "KH " and resid 90 and name HD3 )) ASSI { 6088} ( segid "KH " and resid 37 and name HG2%) ( segid "KH " and resid 37 and name HD1%) 1.900 0.500 0.500 peak 6088 spectrum 1 weight 0.10000E+01 volume 0.22025E-01 ppm1 0.731 ppm2 0.624 CV 1 ASSI { 6090} (( segid "KH " and resid 99 and name HG3 )) (( segid "KH " and resid 98 and name HA1 )) 3.700 1.700 1.700 peak 6090 spectrum 1 weight 0.10000E+01 volume 0.29665E-02 ppm1 2.031 ppm2 4.152 CV 1 OR { 6090} (( segid "KH " and resid 99 and name HG3 )) (( segid "KH " and resid 98 and name HA2 )) OR { 6090} (( segid "KH " and resid 99 and name HG2 )) (( segid "KH " and resid 98 and name HA2 )) ASSI { 6096} (( segid "KH " and resid 91 and name HA )) (( segid "KH " and resid 91 and name HB3 )) 2.200 0.600 0.600 peak 6096 spectrum 1 weight 0.10000E+01 volume 0.65264E-02 ppm1 4.128 ppm2 1.522 CV 1 ASSI { 6098} (( segid "KH " and resid 92 and name HD2 )) (( segid "KH " and resid 92 and name HN )) 3.500 1.500 1.500 peak 6098 spectrum 1 weight 0.10000E+01 volume 0.14930E-02 ppm1 1.846 ppm2 7.624 CV 1 ASSI { 6099} (( segid "KH " and resid 92 and name HD3 )) (( segid "KH " and resid 92 and name HN )) 3.600 1.600 1.600 peak 6099 spectrum 1 weight 0.10000E+01 volume 0.20028E-02 ppm1 1.760 ppm2 7.624 CV 1 ASSI { 6100} (( segid "KH " and resid 92 and name HD2 )) ( segid "KH " and resid 103 and name HG1%) 2.900 1.100 1.100 peak 6100 spectrum 1 weight 0.10000E+01 volume 0.23872E-02 ppm1 1.844 ppm2 0.917 CV 1 ASSI { 6101} (( segid "KH " and resid 92 and name HD3 )) ( segid "KH " and resid 103 and name HG1%) 2.800 1.000 1.000 peak 6101 spectrum 1 weight 0.10000E+01 volume 0.27827E-02 ppm1 1.757 ppm2 0.917 CV 1 ASSI { 6103} (( segid "KH " and resid 93 and name HA )) (( segid "KH " and resid 93 and name HB2 )) 2.400 0.700 0.700 peak 6103 spectrum 1 weight 0.10000E+01 volume 0.58217E-02 ppm1 4.026 ppm2 2.215 CV 1 ASSI { 6104} (( segid "KH " and resid 93 and name HG3 )) (( segid "KH " and resid 94 and name HA )) 2.700 2.700 3.300 peak 6104 spectrum 1 weight 0.10000E+01 volume 0.35626E-02 ppm1 2.333 ppm2 4.330 CV 1 ASSI { 6106} (( segid "KH " and resid 94 and name HG2 )) (( segid "KH " and resid 94 and name HB2 )) 2.200 0.600 0.600 peak 6106 spectrum 1 weight 0.10000E+01 volume 0.12201E-01 ppm1 2.187 ppm2 2.340 CV 1 OR { 6106} (( segid "KH " and resid 94 and name HG3 )) (( segid "KH " and resid 94 and name HB2 )) ASSI { 6107} (( segid "KH " and resid 93 and name HG3 )) ( segid "KH " and resid 96 and name HD% ) 3.900 1.900 1.900 peak 6107 spectrum 1 weight 0.10000E+01 volume 0.14457E-02 ppm1 2.337 ppm2 7.106 CV 1 ASSI { 6108} (( segid "KH " and resid 33 and name HA )) ( segid "KH " and resid 96 and name HE% ) 3.200 1.200 1.200 peak 6108 spectrum 1 weight 0.10000E+01 volume 0.14513E-02 ppm1 4.070 ppm2 7.210 CV 1 OR { 6108} (( segid "KH " and resid 33 and name HA )) (( segid "KH " and resid 96 and name HZ )) ASSI { 6109} (( segid "KH " and resid 34 and name HA )) (( segid "KH " and resid 37 and name HG12)) 3.900 1.900 1.900 peak 6109 spectrum 1 weight 0.10000E+01 volume 0.57660E-03 ppm1 3.240 ppm2 1.512 CV 1 ASSI { 6111} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 58 and name HB )) 2.800 1.000 1.000 peak 6111 spectrum 1 weight 0.10000E+01 volume 0.26741E-02 ppm1 0.938 ppm2 1.744 CV 1 ASSI { 6114} (( segid "KH " and resid 37 and name HG12)) ( segid "KH " and resid 29 and name HD1%) 3.100 1.200 1.200 peak 6114 spectrum 1 weight 0.10000E+01 volume 0.21811E-02 ppm1 1.496 ppm2 0.443 CV 1 ASSI { 6116} ( segid "KH " and resid 37 and name HG2%) (( segid "KH " and resid 87 and name HG12)) 2.800 1.000 1.000 peak 6116 spectrum 1 weight 0.10000E+01 volume 0.27493E-02 ppm1 0.733 ppm2 1.808 CV 1 ASSI { 6118} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 45 and name HG13)) 2.400 0.700 0.700 peak 6118 spectrum 1 weight 0.10000E+01 volume 0.66462E-02 ppm1 0.666 ppm2 1.235 CV 1 ASSI { 6120} (( segid "KH " and resid 56 and name HG12)) (( segid "KH " and resid 56 and name HG13)) 1.800 0.400 0.400 peak 6120 spectrum 1 weight 0.10000E+01 volume 0.79077E-02 ppm1 1.448 ppm2 0.860 CV 1 ASSI { 6127} (( segid "KH " and resid 113 and name HA )) (( segid "KH " and resid 151 and name HA )) 3.600 1.600 1.600 peak 6127 spectrum 1 weight 0.10000E+01 volume 0.14401E-02 ppm1 3.975 ppm2 5.095 CV 1 ASSI { 6133} ( segid "KH " and resid 140 and name HG2%) (( segid "KH " and resid 117 and name HA1 )) 2.800 1.000 1.000 peak 6133 spectrum 1 weight 0.10000E+01 volume 0.25905E-02 ppm1 0.763 ppm2 3.960 CV 1 ASSI { 6146} (( segid "KH " and resid 168 and name HA )) (( segid "KH " and resid 171 and name HG3 )) 3.400 1.400 1.400 peak 6146 spectrum 1 weight 0.10000E+01 volume 0.24094E-02 ppm1 3.891 ppm2 1.691 CV 1 ASSI { 6148} (( segid "KH " and resid 28 and name HB3 )) ( segid "KH " and resid 68 and name HG2%) 3.100 1.200 1.200 peak 6148 spectrum 1 weight 0.10000E+01 volume 0.18663E-02 ppm1 2.520 ppm2 0.843 CV 1 OR { 6148} (( segid "KH " and resid 28 and name HB3 )) ( segid "KH " and resid 68 and name HG1%) ASSI { 6149} (( segid "KH " and resid 28 and name HB2 )) ( segid "KH " and resid 68 and name HG2%) 3.700 1.700 1.700 peak 6149 spectrum 1 weight 0.10000E+01 volume 0.15321E-02 ppm1 3.025 ppm2 0.858 CV 1 OR { 6149} (( segid "KH " and resid 28 and name HB2 )) ( segid "KH " and resid 68 and name HG1%) ASSI { 6151} ( segid "KH " and resid 27 and name HG1%) (( segid "KH " and resid 26 and name HN )) 3.500 1.500 1.500 peak 6151 spectrum 1 weight 0.10000E+01 volume 0.17298E-02 ppm1 0.903 ppm2 8.258 CV 1 ASSI { 6154} ( segid "KH " and resid 27 and name HG2%) ( segid "KH " and resid 105 and name HD2%) 2.900 1.100 1.100 peak 6154 spectrum 1 weight 0.10000E+01 volume 0.43063E-02 ppm1 0.760 ppm2 -0.154 CV 1 ASSI { 6157} ( segid "KH " and resid 29 and name HD1%) ( segid "KH " and resid 33 and name HB% ) 2.300 0.700 0.700 peak 6157 spectrum 1 weight 0.10000E+01 volume 0.97939E-02 ppm1 0.441 ppm2 0.554 CV 1 ASSI { 6159} (( segid "KH " and resid 29 and name HG12)) (( segid "KH " and resid 29 and name HG13)) 2.000 0.500 0.500 peak 6159 spectrum 1 weight 0.10000E+01 volume 0.58857E-02 ppm1 1.266 ppm2 0.903 CV 1 ASSI { 6165} (( segid "KH " and resid 32 and name HG2 )) ( segid "KH " and resid 96 and name HD% ) 3.100 1.200 1.200 peak 6165 spectrum 1 weight 0.10000E+01 volume 0.14791E-02 ppm1 2.600 ppm2 7.105 CV 1 ASSI { 6166} (( segid "KH " and resid 32 and name HG2 )) (( segid "KH " and resid 32 and name HE22)) 4.000 2.000 2.000 peak 6166 spectrum 1 weight 0.10000E+01 volume 0.12089E-02 ppm1 2.600 ppm2 6.940 CV 1 ASSI { 6167} (( segid "KH " and resid 32 and name HG3 )) (( segid "KH " and resid 32 and name HE22)) 3.900 1.900 1.900 peak 6167 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 2.406 ppm2 6.940 CV 1 ASSI { 6169} ( segid "KH " and resid 48 and name HD2%) (( segid "KH " and resid 83 and name HA )) 2.800 1.000 1.000 peak 6169 spectrum 1 weight 0.10000E+01 volume 0.32145E-02 ppm1 0.803 ppm2 3.979 CV 1 ASSI { 6171} (( segid "KH " and resid 48 and name HG )) ( segid "KH " and resid 48 and name HD2%) 2.500 0.800 0.800 peak 6171 spectrum 1 weight 0.10000E+01 volume 0.52116E-02 ppm1 1.509 ppm2 0.790 CV 1 ASSI { 6172} (( segid "KH " and resid 48 and name HG )) ( segid "KH " and resid 56 and name HD1%) 2.600 0.900 0.900 peak 6172 spectrum 1 weight 0.10000E+01 volume 0.46852E-02 ppm1 1.509 ppm2 0.666 CV 1 ASSI { 6173} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 70 and name HG3 )) 3.100 1.200 1.200 peak 6173 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 1.363 ppm2 0.992 CV 1 ASSI { 6178} ( segid "KH " and resid 177 and name HG2%) (( segid "KH " and resid 118 and name HD3 )) 2.800 1.000 1.000 peak 6178 spectrum 1 weight 0.10000E+01 volume 0.20000E-02 ppm1 0.868 ppm2 3.032 CV 1 ASSI { 6184} (( segid "KH " and resid 70 and name HA )) (( segid "KH " and resid 70 and name HB2 )) 3.000 1.100 1.100 peak 6184 spectrum 1 weight 0.10000E+01 volume 0.18691E-02 ppm1 3.969 ppm2 1.743 CV 1 ASSI { 6185} ( segid "KH " and resid 153 and name HD1%) (( segid "KH " and resid 110 and name HD2 )) 3.100 1.200 1.200 peak 6185 spectrum 1 weight 0.10000E+01 volume 0.16685E-02 ppm1 0.657 ppm2 2.990 CV 1 ASSI { 6187} (( segid "KH " and resid 151 and name HG2 )) (( segid "KH " and resid 149 and name HB2 )) 4.000 2.000 2.000 peak 6187 spectrum 1 weight 0.10000E+01 volume 0.14457E-02 ppm1 2.339 ppm2 2.921 CV 1 ASSI { 6188} (( segid "KH " and resid 151 and name HG3 )) (( segid "KH " and resid 149 and name HB2 )) 2.800 1.000 1.000 peak 6188 spectrum 1 weight 0.10000E+01 volume 0.18189E-02 ppm1 1.732 ppm2 2.915 CV 1 ASSI { 6190} (( segid "KH " and resid 146 and name HG3 )) ( segid "KH " and resid 113 and name HB% ) 2.000 0.500 0.500 peak 6190 spectrum 1 weight 0.10000E+01 volume 0.15821E-01 ppm1 1.631 ppm2 1.360 CV 1 OR { 6190} (( segid "KH " and resid 146 and name HG2 )) ( segid "KH " and resid 113 and name HB% ) ASSI { 6198} (( segid "KH " and resid 142 and name HB2 )) (( segid "KH " and resid 141 and name HB3 )) 2.300 2.300 3.700 peak 6198 spectrum 1 weight 0.10000E+01 volume 0.27184E-01 ppm1 1.769 ppm2 1.911 CV 1 OR { 6198} (( segid "KH " and resid 142 and name HB3 )) (( segid "KH " and resid 141 and name HB3 )) ASSI { 6200} (( segid "KH " and resid 142 and name HB3 )) (( segid "KH " and resid 142 and name HA )) 2.500 0.800 0.800 peak 6200 spectrum 1 weight 0.10000E+01 volume 0.48802E-02 ppm1 1.769 ppm2 4.334 CV 1 OR { 6200} (( segid "KH " and resid 142 and name HB2 )) (( segid "KH " and resid 142 and name HA )) ASSI { 6205} (( segid "KH " and resid 141 and name HG3 )) (( segid "KH " and resid 144 and name HA )) 2.500 0.800 0.800 peak 6205 spectrum 1 weight 0.10000E+01 volume 0.45571E-02 ppm1 2.060 ppm2 4.401 CV 1 OR { 6205} (( segid "KH " and resid 141 and name HG2 )) (( segid "KH " and resid 144 and name HA )) ASSI { 6208} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 158 and name HA1 )) 3.500 3.500 2.500 peak 6208 spectrum 1 weight 0.10000E+01 volume 0.18467E-02 ppm1 0.810 ppm2 4.433 CV 1 ASSI { 6209} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 71 and name HA )) 2.600 2.600 3.400 peak 6209 spectrum 1 weight 0.10000E+01 volume 0.19777E-02 ppm1 0.661 ppm2 4.318 CV 1 ASSI { 6214} (( segid "KH " and resid 72 and name HB )) (( segid "KH " and resid 57 and name HN )) 2.900 1.100 1.100 peak 6214 spectrum 1 weight 0.10000E+01 volume 0.16017E-02 ppm1 1.950 ppm2 8.671 CV 1 ASSI { 6217} ( segid "KH " and resid 72 and name HG1%) ( segid "KH " and resid 72 and name HG2%) 2.100 0.600 0.600 peak 6217 spectrum 1 weight 0.10000E+01 volume 0.16875E-01 ppm1 0.836 ppm2 0.635 CV 1 ASSI { 6219} ( segid "KH " and resid 72 and name HG1%) (( segid "KH " and resid 72 and name HN )) 3.700 1.700 1.700 peak 6219 spectrum 1 weight 0.10000E+01 volume 0.17688E-02 ppm1 0.840 ppm2 9.231 CV 1 ASSI { 6220} (( segid "KH " and resid 73 and name HA )) ( segid "KH " and resid 73 and name HD1%) 2.400 0.700 0.700 peak 6220 spectrum 1 weight 0.10000E+01 volume 0.42339E-02 ppm1 4.966 ppm2 0.610 CV 1 ASSI { 6221} (( segid "KH " and resid 73 and name HA )) ( segid "KH " and resid 25 and name HG1%) 3.100 3.100 2.900 peak 6221 spectrum 1 weight 0.10000E+01 volume 0.32033E-02 ppm1 4.966 ppm2 0.805 CV 1 OR { 6221} (( segid "KH " and resid 73 and name HA )) ( segid "KH " and resid 25 and name HG2%) ASSI { 6223} (( segid "KH " and resid 127 and name HA )) (( segid "KH " and resid 130 and name HN )) 3.300 1.400 1.400 peak 6223 spectrum 1 weight 0.10000E+01 volume 0.11866E-02 ppm1 3.921 ppm2 8.283 CV 1 ASSI { 6224} (( segid "KH " and resid 127 and name HA )) ( segid "KH " and resid 127 and name HG1%) 2.700 0.900 0.900 peak 6224 spectrum 1 weight 0.10000E+01 volume 0.39916E-02 ppm1 3.921 ppm2 0.682 CV 1 ASSI { 6230} ( segid "KH " and resid 138 and name HG1%) ( segid "KH " and resid 127 and name HG2%) 2.100 2.100 3.900 peak 6230 spectrum 1 weight 0.10000E+01 volume 0.30919E-01 ppm1 0.650 ppm2 0.779 CV 1 ASSI { 6233} ( segid "KH " and resid 136 and name HB% ) ( segid "KH " and resid 162 and name HB% ) 1.600 0.300 0.600 peak 6233 spectrum 1 weight 0.10000E+01 volume 0.88609E-01 ppm1 0.956 ppm2 0.927 CV 1 ASSI { 6234} (( segid "KH " and resid 134 and name HB )) ( segid "KH " and resid 166 and name HB% ) 3.800 1.900 1.900 peak 6234 spectrum 1 weight 0.10000E+01 volume 0.52089E-03 ppm1 4.212 ppm2 1.277 CV 1 ASSI { 6235} (( segid "KH " and resid 165 and name HG2 )) ( segid "KH " and resid 134 and name HG2%) 2.800 2.800 3.200 peak 6235 spectrum 1 weight 0.10000E+01 volume 0.12144E-02 ppm1 2.530 ppm2 1.254 CV 1 ASSI { 6238} (( segid "KH " and resid 165 and name HG3 )) (( segid "KH " and resid 165 and name HB2 )) 2.100 0.500 0.500 peak 6238 spectrum 1 weight 0.10000E+01 volume 0.19685E-01 ppm1 2.269 ppm2 2.146 CV 1 OR { 6238} (( segid "KH " and resid 165 and name HG3 )) (( segid "KH " and resid 165 and name HB3 )) ASSI { 6239} (( segid "KH " and resid 165 and name HG3 )) ( segid "KH " and resid 134 and name HG2%) 2.800 2.800 3.200 peak 6239 spectrum 1 weight 0.10000E+01 volume 0.13036E-02 ppm1 2.269 ppm2 1.242 CV 1 ASSI { 6243} ( segid "KH " and resid 173 and name HD1%) ( segid "KH " and resid 126 and name HG2%) 2.400 0.700 0.700 peak 6243 spectrum 1 weight 0.10000E+01 volume 0.63036E-02 ppm1 0.728 ppm2 1.126 CV 1 ASSI { 6245} ( segid "KH " and resid 126 and name HG2%) ( segid "KH " and resid 173 and name HG2%) 3.100 3.100 2.900 peak 6245 spectrum 1 weight 0.10000E+01 volume 0.27047E-02 ppm1 1.110 ppm2 0.676 CV 1 ASSI { 6248} (( segid "KH " and resid 18 and name HB2 )) (( segid "KH " and resid 18 and name HB3 )) 1.400 0.200 0.800 peak 6248 spectrum 1 weight 0.10000E+01 volume 0.71336E-01 ppm1 1.940 ppm2 1.831 CV 1 ASSI { 6250} (( segid "KH " and resid 18 and name HB3 )) (( segid "KH " and resid 18 and name HG3 )) 2.600 0.900 0.900 peak 6250 spectrum 1 weight 0.10000E+01 volume 0.44568E-02 ppm1 1.828 ppm2 2.448 CV 1 OR { 6250} (( segid "KH " and resid 18 and name HB3 )) (( segid "KH " and resid 18 and name HG2 )) ASSI { 6251} (( segid "KH " and resid 18 and name HB2 )) (( segid "KH " and resid 18 and name HG2 )) 2.500 0.800 0.800 peak 6251 spectrum 1 weight 0.10000E+01 volume 0.66211E-02 ppm1 1.942 ppm2 2.448 CV 1 OR { 6251} (( segid "KH " and resid 18 and name HB2 )) (( segid "KH " and resid 18 and name HG3 )) ASSI { 6252} (( segid "KH " and resid 18 and name HB3 )) (( segid "KH " and resid 18 and name HA )) 2.800 1.000 1.000 peak 6252 spectrum 1 weight 0.10000E+01 volume 0.41170E-02 ppm1 1.828 ppm2 4.718 CV 1 ASSI { 6255} (( segid "KH " and resid 18 and name HB3 )) (( segid "KH " and resid 18 and name HN )) 3.200 1.300 1.300 peak 6255 spectrum 1 weight 0.10000E+01 volume 0.12758E-02 ppm1 1.828 ppm2 8.010 CV 1 ASSI { 6258} (( segid "KH " and resid 22 and name HB2 )) (( segid "KH " and resid 23 and name HN )) 3.700 1.700 1.700 peak 6258 spectrum 1 weight 0.10000E+01 volume 0.16629E-02 ppm1 1.903 ppm2 7.885 CV 1 ASSI { 6259} (( segid "KH " and resid 22 and name HB3 )) (( segid "KH " and resid 23 and name HN )) 2.700 0.900 0.900 peak 6259 spectrum 1 weight 0.10000E+01 volume 0.16100E-02 ppm1 1.827 ppm2 7.897 CV 1 ASSI { 6260} (( segid "KH " and resid 102 and name HG2 )) (( segid "KH " and resid 103 and name HN )) 3.300 1.400 1.400 peak 6260 spectrum 1 weight 0.10000E+01 volume 0.22089E-02 ppm1 2.212 ppm2 8.542 CV 1 OR { 6260} (( segid "KH " and resid 102 and name HG3 )) (( segid "KH " and resid 103 and name HN )) ASSI { 6264} (( segid "KH " and resid 61 and name HB2 )) (( segid "KH " and resid 61 and name HB3 )) 1.600 0.300 0.600 peak 6264 spectrum 1 weight 0.10000E+01 volume 0.31811E-01 ppm1 2.347 ppm2 1.900 CV 1 ASSI { 6265} (( segid "KH " and resid 61 and name HB2 )) (( segid "KH " and resid 61 and name HD3 )) 3.200 1.300 1.300 peak 6265 spectrum 1 weight 0.10000E+01 volume 0.47938E-02 ppm1 2.350 ppm2 3.697 CV 1 ASSI { 6266} (( segid "KH " and resid 61 and name HB3 )) (( segid "KH " and resid 61 and name HD3 )) 3.200 1.200 1.200 peak 6266 spectrum 1 weight 0.10000E+01 volume 0.48328E-02 ppm1 1.901 ppm2 3.691 CV 1 ASSI { 6267} (( segid "KH " and resid 61 and name HB3 )) (( segid "KH " and resid 61 and name HD2 )) 3.600 1.600 1.600 peak 6267 spectrum 1 weight 0.10000E+01 volume 0.23816E-02 ppm1 1.901 ppm2 3.793 CV 1 ASSI { 6268} (( segid "KH " and resid 61 and name HB2 )) (( segid "KH " and resid 61 and name HD2 )) 2.700 0.900 0.900 peak 6268 spectrum 1 weight 0.10000E+01 volume 0.35292E-02 ppm1 2.350 ppm2 3.793 CV 1 ASSI { 6269} (( segid "KH " and resid 61 and name HB2 )) (( segid "KH " and resid 61 and name HA )) 2.800 1.000 1.000 peak 6269 spectrum 1 weight 0.10000E+01 volume 0.57910E-02 ppm1 2.350 ppm2 4.555 CV 1 ASSI { 6270} (( segid "KH " and resid 61 and name HB3 )) (( segid "KH " and resid 61 and name HA )) 2.500 0.800 0.800 peak 6270 spectrum 1 weight 0.10000E+01 volume 0.40250E-02 ppm1 1.901 ppm2 4.566 CV 1 ASSI { 6273} (( segid "KH " and resid 61 and name HG3 )) (( segid "KH " and resid 61 and name HD3 )) 2.000 0.500 0.500 peak 6273 spectrum 1 weight 0.10000E+01 volume 0.12549E-01 ppm1 2.030 ppm2 3.689 CV 1 ASSI { 6274} (( segid "KH " and resid 61 and name HG3 )) (( segid "KH " and resid 61 and name HD2 )) 2.600 0.800 0.800 peak 6274 spectrum 1 weight 0.10000E+01 volume 0.10585E-01 ppm1 2.030 ppm2 3.777 CV 1 ASSI { 6275} (( segid "KH " and resid 61 and name HG2 )) (( segid "KH " and resid 61 and name HD3 )) 2.400 0.700 0.700 peak 6275 spectrum 1 weight 0.10000E+01 volume 0.11646E-01 ppm1 2.064 ppm2 3.689 CV 1 ASSI { 6276} (( segid "KH " and resid 61 and name HG2 )) (( segid "KH " and resid 61 and name HD2 )) 2.000 0.500 0.500 peak 6276 spectrum 1 weight 0.10000E+01 volume 0.12658E-01 ppm1 2.064 ppm2 3.777 CV 1 ASSI { 6277} (( segid "KH " and resid 122 and name HG2 )) (( segid "KH " and resid 122 and name HA )) 2.500 0.800 0.800 peak 6277 spectrum 1 weight 0.10000E+01 volume 0.43565E-02 ppm1 1.589 ppm2 4.106 CV 1 ASSI { 6278} (( segid "KH " and resid 171 and name HB3 )) (( segid "KH " and resid 168 and name HA )) 2.900 1.000 1.000 peak 6278 spectrum 1 weight 0.10000E+01 volume 0.21170E-02 ppm1 2.038 ppm2 3.863 CV 1 OR { 6278} (( segid "KH " and resid 171 and name HB2 )) (( segid "KH " and resid 168 and name HA )) ASSI { 6279} (( segid "KH " and resid 170 and name HA )) (( segid "KH " and resid 173 and name HN )) 4.600 2.700 1.400 peak 6279 spectrum 1 weight 0.10000E+01 volume 0.15599E-03 ppm1 3.545 ppm2 7.918 CV 1 ASSI { 6280} (( segid "KH " and resid 172 and name HA )) (( segid "KH " and resid 175 and name HN )) 2.900 1.100 1.100 peak 6280 spectrum 1 weight 0.10000E+01 volume 0.24624E-02 ppm1 4.439 ppm2 7.919 CV 1 ASSI { 6282} (( segid "KH " and resid 176 and name HB3 )) (( segid "KH " and resid 173 and name HA )) 3.000 1.100 1.100 peak 6282 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 2.163 ppm2 3.662 CV 1 OR { 6282} (( segid "KH " and resid 176 and name HB2 )) (( segid "KH " and resid 173 and name HA )) ASSI { 6283} (( segid "KH " and resid 175 and name HA )) (( segid "KH " and resid 178 and name HN )) 3.100 1.200 1.200 peak 6283 spectrum 1 weight 0.10000E+01 volume 0.17939E-02 ppm1 4.162 ppm2 7.883 CV 1 ASSI { 6284} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 113 and name HA )) 3.700 1.700 1.700 peak 6284 spectrum 1 weight 0.10000E+01 volume 0.22813E-02 ppm1 1.631 ppm2 3.977 CV 1 OR { 6284} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 113 and name HA )) ASSI { 6286} (( segid "KH " and resid 104 and name HD2 )) ( segid "KH " and resid 157 and name HG2%) 2.600 0.900 0.900 peak 6286 spectrum 1 weight 0.10000E+01 volume 0.41838E-02 ppm1 1.662 ppm2 0.789 CV 1 OR { 6286} (( segid "KH " and resid 104 and name HD3 )) ( segid "KH " and resid 157 and name HG2%) ASSI { 6287} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 158 and name HA2 )) 2.900 1.100 1.100 peak 6287 spectrum 1 weight 0.10000E+01 volume 0.16963E-02 ppm1 0.810 ppm2 3.934 CV 1 ASSI { 6288} ( segid "KH " and resid 27 and name HG1%) ( segid "KH " and resid 105 and name HD2%) 3.000 3.000 3.000 peak 6288 spectrum 1 weight 0.10000E+01 volume 0.23537E-02 ppm1 0.908 ppm2 -0.167 CV 1 ASSI { 6289} (( segid "KH " and resid 165 and name HA )) (( segid "KH " and resid 168 and name HB2 )) 2.500 0.800 0.800 peak 6289 spectrum 1 weight 0.10000E+01 volume 0.53565E-02 ppm1 4.080 ppm2 1.893 CV 1 OR { 6289} (( segid "KH " and resid 165 and name HA )) (( segid "KH " and resid 168 and name HB3 )) ASSI { 550} (( segid "KH " and resid 86 and name HD3 )) ( segid "KH " and resid 51 and name HE% ) 3.300 1.400 1.400 peak 550 spectrum 1 weight 0.10000E+01 volume 0.10308E-02 ppm1 3.074 ppm2 7.206 CV 1 OR { 550} (( segid "KH " and resid 86 and name HD2 )) ( segid "KH " and resid 51 and name HE% ) ASSI { 553} (( segid "KH " and resid 17 and name HB3 )) ( segid "KH " and resid 17 and name HD% ) 2.600 0.900 0.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.40515E-02 ppm1 3.053 ppm2 7.193 CV 1 OR { 553} (( segid "KH " and resid 17 and name HB2 )) ( segid "KH " and resid 17 and name HD% ) ASSI { 566} ( segid "KH " and resid 33 and name HB% ) ( segid "KH " and resid 96 and name HD% ) 3.300 1.400 1.400 peak 566 spectrum 1 weight 0.10000E+01 volume 0.13650E-02 ppm1 0.585 ppm2 7.144 CV 1 ASSI { 575} ( segid "KH " and resid 103 and name HG2%) (( segid "KH " and resid 159 and name HD2 )) 3.200 1.300 1.300 peak 575 spectrum 1 weight 0.10000E+01 volume 0.14094E-02 ppm1 0.646 ppm2 7.139 CV 1 ASSI { 611} (( segid "KH " and resid 24 and name HA )) (( segid "KH " and resid 74 and name HA )) 2.700 0.900 0.900 peak 611 spectrum 1 weight 0.10000E+01 volume 0.22989E-02 ppm1 5.327 ppm2 5.649 CV 1 ASSI { 613} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 74 and name HA )) 2.400 0.700 0.700 peak 613 spectrum 1 weight 0.10000E+01 volume 0.77495E-02 ppm1 1.137 ppm2 5.649 CV 1 ASSI { 623} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 107 and name HA )) 2.500 0.800 0.800 peak 623 spectrum 1 weight 0.10000E+01 volume 0.55388E-02 ppm1 1.132 ppm2 5.545 CV 1 ASSI { 627} ( segid "KH " and resid 24 and name HG2%) (( segid "KH " and resid 24 and name HA )) 2.500 0.800 0.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.60271E-02 ppm1 1.066 ppm2 5.321 CV 1 ASSI { 630} (( segid "KH " and resid 110 and name HD3 )) (( segid "KH " and resid 110 and name HA )) 2.800 1.000 1.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.16603E-02 ppm1 2.911 ppm2 5.386 CV 1 ASSI { 638} ( segid "KH " and resid 68 and name HG1%) (( segid "KH " and resid 68 and name HA )) 2.300 0.700 0.700 peak 638 spectrum 1 weight 0.10000E+01 volume 0.88920E-02 ppm1 0.893 ppm2 5.227 CV 1 ASSI { 639} ( segid "KH " and resid 68 and name HG2%) (( segid "KH " and resid 68 and name HA )) 2.800 1.000 1.000 peak 639 spectrum 1 weight 0.10000E+01 volume 0.56312E-02 ppm1 0.859 ppm2 5.222 CV 1 ASSI { 653} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 157 and name HA )) 2.400 0.700 0.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.60271E-02 ppm1 0.831 ppm2 5.182 CV 1 ASSI { 654} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 157 and name HA )) 2.500 0.800 0.800 peak 654 spectrum 1 weight 0.10000E+01 volume 0.40642E-02 ppm1 0.857 ppm2 5.190 CV 1 ASSI { 660} ( segid "KH " and resid 56 and name HG2%) (( segid "KH " and resid 56 and name HA )) 2.800 1.000 1.000 peak 660 spectrum 1 weight 0.10000E+01 volume 0.48541E-02 ppm1 0.645 ppm2 5.111 CV 1 ASSI { 661} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 56 and name HA )) 3.600 1.600 1.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.27001E-02 ppm1 0.697 ppm2 5.105 CV 1 ASSI { 664} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 156 and name HA )) 2.400 0.700 0.700 peak 664 spectrum 1 weight 0.10000E+01 volume 0.53613E-02 ppm1 0.847 ppm2 5.011 CV 1 ASSI { 665} ( segid "KH " and resid 156 and name HD1%) (( segid "KH " and resid 156 and name HA )) 3.400 1.500 1.500 peak 665 spectrum 1 weight 0.10000E+01 volume 0.35162E-02 ppm1 0.737 ppm2 5.023 CV 1 ASSI { 700} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 105 and name HA )) 2.700 0.900 0.900 peak 700 spectrum 1 weight 0.10000E+01 volume 0.25063E-02 ppm1 -0.136 ppm2 4.977 CV 1 ASSI { 702} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 105 and name HA )) 2.500 0.800 0.800 peak 702 spectrum 1 weight 0.10000E+01 volume 0.70511E-02 ppm1 0.983 ppm2 4.965 CV 1 ASSI { 704} ( segid "KH " and resid 138 and name HG1%) (( segid "KH " and resid 138 and name HA )) 2.400 0.700 0.700 peak 704 spectrum 1 weight 0.10000E+01 volume 0.69950E-02 ppm1 0.686 ppm2 5.018 CV 1 ASSI { 724} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 63 and name HA )) 2.300 0.700 0.700 peak 724 spectrum 1 weight 0.10000E+01 volume 0.88258E-02 ppm1 1.242 ppm2 4.819 CV 1 ASSI { 725} (( segid "KH " and resid 55 and name HB2 )) (( segid "KH " and resid 55 and name HA )) 2.400 0.700 0.700 peak 725 spectrum 1 weight 0.10000E+01 volume 0.74520E-02 ppm1 3.836 ppm2 4.771 CV 1 OR { 725} (( segid "KH " and resid 55 and name HB3 )) (( segid "KH " and resid 55 and name HA )) ASSI { 754} ( segid "KH " and resid 58 and name HG2%) (( segid "KH " and resid 58 and name HA )) 2.300 0.600 0.600 peak 754 spectrum 1 weight 0.10000E+01 volume 0.70694E-02 ppm1 0.821 ppm2 4.687 CV 1 ASSI { 756} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 58 and name HA )) 3.300 1.300 1.300 peak 756 spectrum 1 weight 0.10000E+01 volume 0.47689E-02 ppm1 0.697 ppm2 4.706 CV 1 ASSI { 761} (( segid "KH " and resid 146 and name HD3 )) (( segid "KH " and resid 145 and name HA )) 2.700 0.900 0.900 peak 761 spectrum 1 weight 0.10000E+01 volume 0.28224E-02 ppm1 3.654 ppm2 4.631 CV 1 ASSI { 772} ( segid "KH " and resid 145 and name HG2%) (( segid "KH " and resid 145 and name HA )) 2.400 0.700 0.700 peak 772 spectrum 1 weight 0.10000E+01 volume 0.83782E-02 ppm1 1.302 ppm2 4.631 CV 1 ASSI { 778} ( segid "KH " and resid 152 and name HG2%) (( segid "KH " and resid 152 and name HA )) 3.000 1.100 1.100 peak 778 spectrum 1 weight 0.10000E+01 volume 0.33722E-02 ppm1 0.610 ppm2 4.667 CV 1 ASSI { 780} (( segid "KH " and resid 17 and name HB2 )) (( segid "KH " and resid 17 and name HA )) 2.700 0.900 0.900 peak 780 spectrum 1 weight 0.10000E+01 volume 0.32644E-02 ppm1 3.056 ppm2 4.576 CV 1 OR { 780} (( segid "KH " and resid 17 and name HB3 )) (( segid "KH " and resid 17 and name HA )) ASSI { 782} (( segid "KH " and resid 23 and name HG3 )) (( segid "KH " and resid 23 and name HA )) 2.900 1.000 1.000 peak 782 spectrum 1 weight 0.10000E+01 volume 0.19048E-02 ppm1 2.230 ppm2 4.607 CV 1 ASSI { 797} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 136 and name HA )) 2.500 0.800 0.800 peak 797 spectrum 1 weight 0.10000E+01 volume 0.47028E-02 ppm1 0.987 ppm2 4.600 CV 1 ASSI { 802} (( segid "KH " and resid 95 and name HB3 )) (( segid "KH " and resid 95 and name HA )) 2.600 0.800 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.53350E-02 ppm1 2.719 ppm2 4.547 CV 1 ASSI { 813} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 44 and name HA )) 2.900 1.100 1.100 peak 813 spectrum 1 weight 0.10000E+01 volume 0.18532E-02 ppm1 2.218 ppm2 4.520 CV 1 ASSI { 814} (( segid "KH " and resid 47 and name HB3 )) (( segid "KH " and resid 44 and name HA )) 3.200 1.200 1.200 peak 814 spectrum 1 weight 0.10000E+01 volume 0.19048E-02 ppm1 2.145 ppm2 4.524 CV 1 ASSI { 815} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 59 and name HA )) 2.300 0.600 0.600 peak 815 spectrum 1 weight 0.10000E+01 volume 0.77691E-02 ppm1 1.391 ppm2 4.554 CV 1 ASSI { 829} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 136 and name HA )) 2.700 2.700 3.300 peak 829 spectrum 1 weight 0.10000E+01 volume 0.34791E-02 ppm1 1.927 ppm2 4.581 CV 1 ASSI { 830} ( segid "KH " and resid 175 and name HB% ) (( segid "KH " and resid 172 and name HA )) 2.600 0.800 0.800 peak 830 spectrum 1 weight 0.10000E+01 volume 0.49927E-02 ppm1 1.570 ppm2 4.467 CV 1 ASSI { 831} (( segid "KH " and resid 76 and name HD3 )) (( segid "KH " and resid 75 and name HA1 )) 3.100 1.200 1.200 peak 831 spectrum 1 weight 0.10000E+01 volume 0.19538E-02 ppm1 3.646 ppm2 4.422 CV 1 OR { 831} (( segid "KH " and resid 76 and name HD2 )) (( segid "KH " and resid 75 and name HA1 )) ASSI { 838} (( segid "KH " and resid 137 and name HB2 )) (( segid "KH " and resid 137 and name HA )) 2.400 0.700 0.700 peak 838 spectrum 1 weight 0.10000E+01 volume 0.61385E-02 ppm1 2.285 ppm2 4.389 CV 1 ASSI { 851} (( segid "KH " and resid 101 and name HG3 )) (( segid "KH " and resid 101 and name HA )) 2.500 0.800 0.800 peak 851 spectrum 1 weight 0.10000E+01 volume 0.65859E-02 ppm1 2.344 ppm2 4.423 CV 1 OR { 851} (( segid "KH " and resid 101 and name HG2 )) (( segid "KH " and resid 101 and name HA )) ASSI { 853} (( segid "KH " and resid 99 and name HB3 )) (( segid "KH " and resid 99 and name HA )) 2.100 0.600 0.600 peak 853 spectrum 1 weight 0.10000E+01 volume 0.99453E-02 ppm1 1.978 ppm2 4.419 CV 1 ASSI { 861} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 63 and name HB )) 2.000 0.500 0.500 peak 861 spectrum 1 weight 0.10000E+01 volume 0.15444E-01 ppm1 1.242 ppm2 4.432 CV 1 ASSI { 862} ( segid "KH " and resid 79 and name HB% ) (( segid "KH " and resid 79 and name HA )) 2.400 0.700 0.700 peak 862 spectrum 1 weight 0.10000E+01 volume 0.70694E-02 ppm1 1.452 ppm2 4.392 CV 1 ASSI { 873} (( segid "KH " and resid 67 and name HG2 )) (( segid "KH " and resid 67 and name HA )) 3.000 1.100 1.100 peak 873 spectrum 1 weight 0.10000E+01 volume 0.21404E-02 ppm1 1.655 ppm2 4.386 CV 1 ASSI { 884} ( segid "KH " and resid 71 and name HG1%) (( segid "KH " and resid 71 and name HA )) 2.500 0.800 0.800 peak 884 spectrum 1 weight 0.10000E+01 volume 0.45379E-02 ppm1 0.749 ppm2 4.380 CV 1 ASSI { 891} (( segid "KH " and resid 102 and name HB3 )) (( segid "KH " and resid 102 and name HA )) 2.800 1.000 1.000 peak 891 spectrum 1 weight 0.10000E+01 volume 0.24039E-02 ppm1 1.814 ppm2 4.354 CV 1 ASSI { 897} ( segid "KH " and resid 133 and name HD1%) (( segid "KH " and resid 133 and name HA )) 3.000 1.100 1.100 peak 897 spectrum 1 weight 0.10000E+01 volume 0.28387E-02 ppm1 0.916 ppm2 4.287 CV 1 ASSI { 902} (( segid "KH " and resid 131 and name HG3 )) (( segid "KH " and resid 131 and name HA )) 2.500 0.800 0.800 peak 902 spectrum 1 weight 0.10000E+01 volume 0.52037E-02 ppm1 2.385 ppm2 4.233 CV 1 ASSI { 905} (( segid "KH " and resid 131 and name HB2 )) (( segid "KH " and resid 131 and name HA )) 2.200 0.600 0.600 peak 905 spectrum 1 weight 0.10000E+01 volume 0.10697E-01 ppm1 2.123 ppm2 4.230 CV 1 OR { 905} (( segid "KH " and resid 131 and name HB3 )) (( segid "KH " and resid 131 and name HA )) ASSI { 922} ( segid "KH " and resid 154 and name HG1%) (( segid "KH " and resid 154 and name HA )) 2.700 0.900 0.900 peak 922 spectrum 1 weight 0.10000E+01 volume 0.33206E-02 ppm1 0.835 ppm2 4.171 CV 1 ASSI { 932} (( segid "KH " and resid 32 and name HG3 )) (( segid "KH " and resid 32 and name HA )) 2.600 0.800 0.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.58214E-02 ppm1 2.430 ppm2 4.259 CV 1 ASSI { 934} (( segid "KH " and resid 118 and name HB2 )) (( segid "KH " and resid 118 and name HA )) 2.400 0.700 0.700 peak 934 spectrum 1 weight 0.10000E+01 volume 0.69950E-02 ppm1 1.930 ppm2 4.201 CV 1 OR { 934} (( segid "KH " and resid 118 and name HB3 )) (( segid "KH " and resid 118 and name HA )) ASSI { 943} (( segid "KH " and resid 86 and name HD2 )) (( segid "KH " and resid 86 and name HA )) 2.600 0.800 0.800 peak 943 spectrum 1 weight 0.10000E+01 volume 0.47227E-02 ppm1 3.055 ppm2 4.195 CV 1 OR { 943} (( segid "KH " and resid 86 and name HD3 )) (( segid "KH " and resid 86 and name HA )) ASSI { 945} (( segid "KH " and resid 148 and name HG2 )) (( segid "KH " and resid 148 and name HA )) 2.900 1.100 1.100 peak 945 spectrum 1 weight 0.10000E+01 volume 0.61575E-02 ppm1 2.304 ppm2 4.212 CV 1 ASSI { 951} (( segid "KH " and resid 86 and name HG3 )) (( segid "KH " and resid 86 and name HA )) 3.300 1.300 1.300 peak 951 spectrum 1 weight 0.10000E+01 volume 0.18025E-02 ppm1 1.594 ppm2 4.200 CV 1 ASSI { 952} (( segid "KH " and resid 90 and name HG3 )) (( segid "KH " and resid 90 and name HA )) 3.200 1.200 1.200 peak 952 spectrum 1 weight 0.10000E+01 volume 0.16368E-02 ppm1 1.238 ppm2 4.218 CV 1 OR { 952} (( segid "KH " and resid 90 and name HG2 )) (( segid "KH " and resid 90 and name HA )) ASSI { 968} (( segid "KH " and resid 178 and name HB2 )) (( segid "KH " and resid 178 and name HA )) 2.300 0.600 0.600 peak 968 spectrum 1 weight 0.10000E+01 volume 0.90367E-02 ppm1 1.871 ppm2 4.183 CV 1 OR { 968} (( segid "KH " and resid 178 and name HB3 )) (( segid "KH " and resid 178 and name HA )) ASSI { 970} (( segid "KH " and resid 169 and name HG2 )) (( segid "KH " and resid 169 and name HA )) 3.100 1.200 1.200 peak 970 spectrum 1 weight 0.10000E+01 volume 0.16648E-02 ppm1 1.549 ppm2 4.162 CV 1 ASSI { 975} ( segid "KH " and resid 36 and name HB% ) (( segid "KH " and resid 36 and name HA )) 2.100 0.500 0.500 peak 975 spectrum 1 weight 0.10000E+01 volume 0.16884E-01 ppm1 1.419 ppm2 4.186 CV 1 ASSI { 1000} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HA )) 2.400 0.700 0.700 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.63993E-02 ppm1 2.559 ppm2 4.145 CV 1 ASSI { 1001} (( segid "KH " and resid 176 and name HG3 )) (( segid "KH " and resid 176 and name HA )) 2.400 0.700 0.700 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.80760E-02 ppm1 2.427 ppm2 4.123 CV 1 ASSI { 1003} (( segid "KH " and resid 165 and name HG3 )) (( segid "KH " and resid 165 and name HA )) 3.400 1.400 1.400 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.10371E-02 ppm1 2.305 ppm2 4.076 CV 1 ASSI { 1021} ( segid "KH " and resid 145 and name HG2%) (( segid "KH " and resid 145 and name HB )) 2.000 0.500 0.500 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.19519E-01 ppm1 1.302 ppm2 4.046 CV 1 ASSI { 1029} (( segid "KH " and resid 28 and name HA )) (( segid "KH " and resid 70 and name HA )) 2.800 1.000 1.000 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.20679E-02 ppm1 4.984 ppm2 3.996 CV 1 ASSI { 1055} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 114 and name HB3 )) 2.300 0.700 0.700 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.93112E-02 ppm1 4.208 ppm2 4.065 CV 1 OR { 1055} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 114 and name HB2 )) ASSI { 1060} (( segid "KH " and resid 22 and name HG2 )) (( segid "KH " and resid 22 and name HA )) 2.700 0.900 0.900 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.28260E-02 ppm1 2.293 ppm2 4.005 CV 1 ASSI { 1061} (( segid "KH " and resid 22 and name HG3 )) (( segid "KH " and resid 22 and name HA )) 3.400 1.400 1.400 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.20235E-02 ppm1 2.168 ppm2 4.008 CV 1 ASSI { 1071} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 107 and name HB )) 2.100 0.600 0.600 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.12626E-01 ppm1 1.134 ppm2 3.975 CV 1 ASSI { 1078} (( segid "KH " and resid 48 and name HB3 )) (( segid "KH " and resid 45 and name HA )) 3.700 1.700 1.700 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.11277E-02 ppm1 1.541 ppm2 3.954 CV 1 ASSI { 1083} (( segid "KH " and resid 111 and name HB )) (( segid "KH " and resid 113 and name HA )) 2.800 2.800 3.200 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.33767E-02 ppm1 2.020 ppm2 3.986 CV 1 ASSI { 1093} ( segid "KH " and resid 174 and name HD1%) (( segid "KH " and resid 174 and name HA )) 2.900 1.000 1.000 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.53812E-02 ppm1 0.875 ppm2 3.930 CV 1 ASSI { 1094} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 174 and name HA )) 2.300 0.600 0.600 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.11531E-01 ppm1 0.713 ppm2 3.932 CV 1 ASSI { 1096} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 112 and name HD2 )) 2.800 1.000 1.000 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.33858E-02 ppm1 1.353 ppm2 3.945 CV 1 ASSI { 1099} ( segid "KH " and resid 152 and name HG2%) (( segid "KH " and resid 113 and name HA )) 2.400 0.700 0.700 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.60542E-02 ppm1 0.610 ppm2 4.001 CV 1 ASSI { 1100} ( segid "KH " and resid 38 and name HG2%) (( segid "KH " and resid 38 and name HA )) 2.300 0.700 0.700 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.76562E-02 ppm1 1.092 ppm2 3.994 CV 1 ASSI { 1103} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 45 and name HA )) 2.800 1.000 1.000 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.53151E-02 ppm1 1.074 ppm2 3.953 CV 1 ASSI { 1109} (( segid "KH " and resid 45 and name HG13)) (( segid "KH " and resid 45 and name HA )) 2.900 1.000 1.000 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.18351E-02 ppm1 1.263 ppm2 3.951 CV 1 ASSI { 1116} ( segid "KH " and resid 177 and name HG1%) (( segid "KH " and resid 177 and name HA )) 2.300 0.600 0.600 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.10145E-01 ppm1 0.975 ppm2 3.861 CV 1 ASSI { 1123} (( segid "KH " and resid 87 and name HB )) (( segid "KH " and resid 84 and name HA )) 3.400 1.400 1.400 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.82673E-03 ppm1 2.031 ppm2 3.871 CV 1 ASSI { 1128} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 88 and name HA )) 3.400 1.400 1.400 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.13351E-02 ppm1 -0.139 ppm2 3.852 CV 1 ASSI { 1130} ( segid "KH " and resid 74 and name HG2%) (( segid "KH " and resid 74 and name HB )) 2.000 0.500 0.500 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.17418E-01 ppm1 1.140 ppm2 3.875 CV 1 ASSI { 1131} ( segid "KH " and resid 177 and name HG2%) (( segid "KH " and resid 177 and name HA )) 2.200 0.600 0.600 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.11721E-01 ppm1 0.897 ppm2 3.865 CV 1 ASSI { 1141} ( segid "KH " and resid 54 and name HB% ) (( segid "KH " and resid 55 and name HB3 )) 3.100 1.200 1.200 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.58495E-02 ppm1 1.071 ppm2 3.815 CV 1 OR { 1141} ( segid "KH " and resid 54 and name HB% ) (( segid "KH " and resid 55 and name HB2 )) ASSI { 1145} (( segid "KH " and resid 150 and name HG2 )) (( segid "KH " and resid 150 and name HA )) 2.400 0.700 0.700 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.62408E-02 ppm1 2.261 ppm2 3.798 CV 1 OR { 1145} (( segid "KH " and resid 150 and name HG3 )) (( segid "KH " and resid 150 and name HA )) ASSI { 1153} (( segid "KH " and resid 9 and name HA )) (( segid "KH " and resid 9 and name HB3 )) 2.500 0.800 0.800 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.68368E-02 ppm1 4.401 ppm2 3.669 CV 1 OR { 1153} (( segid "KH " and resid 9 and name HA )) (( segid "KH " and resid 9 and name HB2 )) ASSI { 1165} ( segid "KH " and resid 24 and name HG2%) (( segid "KH " and resid 24 and name HB )) 2.100 0.600 0.600 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.13360E-01 ppm1 1.064 ppm2 3.801 CV 1 ASSI { 1180} ( segid "KH " and resid 37 and name HG2%) (( segid "KH " and resid 37 and name HA )) 2.500 0.800 0.800 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.51439E-02 ppm1 0.760 ppm2 3.818 CV 1 ASSI { 1217} ( segid "KH " and resid 119 and name HG1%) (( segid "KH " and resid 119 and name HA )) 2.500 0.800 0.800 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.70978E-02 ppm1 0.762 ppm2 3.383 CV 1 ASSI { 1223} ( segid "KH " and resid 109 and name HD1%) (( segid "KH " and resid 167 and name HA )) 2.900 2.900 3.100 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.45054E-02 ppm1 0.758 ppm2 3.643 CV 1 ASSI { 1232} (( segid "KH " and resid 167 and name HB3 )) (( segid "KH " and resid 167 and name HA )) 3.200 1.300 1.300 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.92936E-03 ppm1 1.950 ppm2 3.640 CV 1 ASSI { 1236} ( segid "KH " and resid 116 and name HB% ) (( segid "KH " and resid 116 and name HA )) 2.200 0.600 0.600 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.11069E-01 ppm1 1.233 ppm2 3.423 CV 1 ASSI { 1237} ( segid "KH " and resid 31 and name HB% ) (( segid "KH " and resid 31 and name HA )) 2.300 0.700 0.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.86284E-02 ppm1 1.283 ppm2 3.692 CV 1 ASSI { 1244} ( segid "KH " and resid 79 and name HB% ) (( segid "KH " and resid 76 and name HD2 )) 2.600 0.900 0.900 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.28831E-02 ppm1 1.454 ppm2 3.644 CV 1 ASSI { 1282} ( segid "KH " and resid 111 and name HG1%) (( segid "KH " and resid 112 and name HD3 )) 3.300 1.400 1.400 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.36512E-02 ppm1 0.714 ppm2 3.367 CV 1 ASSI { 1283} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 112 and name HD3 )) 3.900 1.900 1.900 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.19284E-02 ppm1 1.353 ppm2 3.348 CV 1 ASSI { 1289} (( segid "KH " and resid 85 and name HA2 )) (( segid "KH " and resid 85 and name HA1 )) 5.400 3.700 0.600 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.23061E-04 ppm1 2.356 ppm2 3.210 CV 1 ASSI { 1330} ( segid "KH " and resid 33 and name HB% ) (( segid "KH " and resid 30 and name HD3 )) 3.800 1.800 1.800 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.15951E-02 ppm1 0.590 ppm2 3.249 CV 1 ASSI { 1339} (( segid "KH " and resid 171 and name HG2 )) (( segid "KH " and resid 171 and name HD3 )) 2.700 0.900 0.900 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.30090E-02 ppm1 1.910 ppm2 3.190 CV 1 OR { 1339} (( segid "KH " and resid 171 and name HG2 )) (( segid "KH " and resid 171 and name HD2 )) ASSI { 1358} (( segid "KH " and resid 28 and name HA )) (( segid "KH " and resid 28 and name HB2 )) 3.200 1.300 1.300 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.14293E-02 ppm1 4.983 ppm2 3.058 CV 1 ASSI { 1378} (( segid "KH " and resid 172 and name HA )) (( segid "KH " and resid 172 and name HB2 )) 3.100 1.200 1.200 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.17979E-02 ppm1 4.464 ppm2 2.912 CV 1 ASSI { 1389} ( segid "KH " and resid 103 and name HG2%) (( segid "KH " and resid 103 and name HA )) 3.100 1.200 1.200 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.20778E-02 ppm1 0.665 ppm2 2.994 CV 1 ASSI { 1390} ( segid "KH " and resid 103 and name HG1%) (( segid "KH " and resid 103 and name HA )) 2.300 0.700 0.700 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.65949E-02 ppm1 0.939 ppm2 2.983 CV 1 ASSI { 1461} (( segid "KH " and resid 131 and name HG2 )) (( segid "KH " and resid 131 and name HG3 )) 1.900 0.400 0.400 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.11721E-01 ppm1 2.636 ppm2 2.396 CV 1 ASSI { 1493} (( segid "KH " and resid 179 and name HA )) (( segid "KH " and resid 179 and name HG3 )) 2.300 0.600 0.600 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.11739E-01 ppm1 4.235 ppm2 2.376 CV 1 OR { 1493} (( segid "KH " and resid 179 and name HA )) (( segid "KH " and resid 179 and name HG2 )) ASSI { 1498} (( segid "KH " and resid 84 and name HB3 )) (( segid "KH " and resid 84 and name HB2 )) 1.900 0.500 0.500 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.89569E-02 ppm1 2.286 ppm2 2.333 CV 1 ASSI { 1505} (( segid "KH " and resid 98 and name HA1 )) (( segid "KH " and resid 99 and name HB2 )) 4.200 2.200 1.800 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.82079E-03 ppm1 4.184 ppm2 2.345 CV 1 OR { 1505} (( segid "KH " and resid 98 and name HA2 )) (( segid "KH " and resid 99 and name HB2 )) ASSI { 1516} (( segid "KH " and resid 99 and name HG2 )) (( segid "KH " and resid 99 and name HB2 )) 2.000 0.500 0.500 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.14266E-01 ppm1 2.066 ppm2 2.332 CV 1 OR { 1516} (( segid "KH " and resid 99 and name HG3 )) (( segid "KH " and resid 99 and name HB2 )) ASSI { 1522} (( segid "KH " and resid 141 and name HA )) (( segid "KH " and resid 141 and name HB2 )) 3.000 1.100 1.100 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.30461E-02 ppm1 4.259 ppm2 2.306 CV 1 ASSI { 1523} (( segid "KH " and resid 20 and name HA )) (( segid "KH " and resid 20 and name HB2 )) 2.400 0.700 0.700 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.10371E-01 ppm1 4.437 ppm2 2.323 CV 1 ASSI { 1529} (( segid "KH " and resid 141 and name HB3 )) (( segid "KH " and resid 141 and name HB2 )) 1.600 0.300 0.600 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.23741E-01 ppm1 1.933 ppm2 2.336 CV 1 ASSI { 1532} (( segid "KH " and resid 84 and name HA )) (( segid "KH " and resid 84 and name HB3 )) 3.900 1.900 1.900 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.52526E-03 ppm1 3.847 ppm2 2.287 CV 1 ASSI { 1543} (( segid "KH " and resid 148 and name HA )) (( segid "KH " and resid 148 and name HG3 )) 2.700 0.900 0.900 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.81673E-02 ppm1 4.218 ppm2 2.256 CV 1 ASSI { 1544} (( segid "KH " and resid 149 and name HA )) (( segid "KH " and resid 148 and name HG3 )) 3.000 1.100 1.100 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.17509E-02 ppm1 5.012 ppm2 2.256 CV 1 ASSI { 1546} (( segid "KH " and resid 21 and name HB3 )) (( segid "KH " and resid 21 and name HG2 )) 2.000 0.500 0.500 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.24030E-01 ppm1 1.971 ppm2 2.258 CV 1 OR { 1546} (( segid "KH " and resid 21 and name HB3 )) (( segid "KH " and resid 21 and name HG3 )) ASSI { 1550} (( segid "KH " and resid 77 and name HA )) (( segid "KH " and resid 77 and name HB2 )) 3.300 1.300 1.300 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.21041E-02 ppm1 4.039 ppm2 2.242 CV 1 ASSI { 1558} (( segid "KH " and resid 80 and name HG3 )) (( segid "KH " and resid 80 and name HB2 )) 3.600 1.600 1.600 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.64627E-03 ppm1 2.626 ppm2 2.258 CV 1 OR { 1558} (( segid "KH " and resid 80 and name HG2 )) (( segid "KH " and resid 80 and name HB3 )) OR { 1558} (( segid "KH " and resid 80 and name HG2 )) (( segid "KH " and resid 80 and name HB2 )) OR { 1558} (( segid "KH " and resid 80 and name HG3 )) (( segid "KH " and resid 80 and name HB3 )) ASSI { 1572} (( segid "KH " and resid 131 and name HG2 )) (( segid "KH " and resid 131 and name HB2 )) 2.800 1.000 1.000 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.27599E-02 ppm1 2.636 ppm2 2.124 CV 1 OR { 1572} (( segid "KH " and resid 131 and name HG2 )) (( segid "KH " and resid 131 and name HB3 )) ASSI { 1578} ( segid "KH " and resid 177 and name HG1%) (( segid "KH " and resid 177 and name HB )) 2.000 0.500 0.500 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.16675E-01 ppm1 0.981 ppm2 2.179 CV 1 ASSI { 1579} ( segid "KH " and resid 177 and name HG2%) (( segid "KH " and resid 177 and name HB )) 1.800 0.400 0.400 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.25298E-01 ppm1 0.898 ppm2 2.182 CV 1 ASSI { 1588} (( segid "KH " and resid 160 and name HB2 )) (( segid "KH " and resid 160 and name HB3 )) 2.300 0.600 0.600 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.31992E-02 ppm1 2.354 ppm2 2.200 CV 1 ASSI { 1606} (( segid "KH " and resid 101 and name HA )) (( segid "KH " and resid 101 and name HB2 )) 2.300 0.600 0.600 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.73216E-02 ppm1 4.420 ppm2 2.145 CV 1 ASSI { 1612} (( segid "KH " and resid 99 and name HA )) (( segid "KH " and resid 99 and name HG3 )) 2.800 0.900 0.900 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.47689E-02 ppm1 4.433 ppm2 2.095 CV 1 OR { 1612} (( segid "KH " and resid 99 and name HA )) (( segid "KH " and resid 99 and name HG2 )) ASSI { 1631} ( segid "KH " and resid 103 and name HG2%) (( segid "KH " and resid 103 and name HB )) 2.400 0.700 0.700 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.60171E-02 ppm1 0.665 ppm2 2.126 CV 1 ASSI { 1633} (( segid "KH " and resid 64 and name HA )) (( segid "KH " and resid 64 and name HG2 )) 3.700 1.700 1.700 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.24075E-02 ppm1 4.313 ppm2 2.110 CV 1 ASSI { 1643} ( segid "KH " and resid 68 and name HG1%) (( segid "KH " and resid 68 and name HB )) 1.900 0.500 0.500 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.22635E-01 ppm1 0.894 ppm2 2.102 CV 1 ASSI { 1666} (( segid "KH " and resid 77 and name HA )) (( segid "KH " and resid 77 and name HG2 )) 3.900 1.900 1.900 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.80341E-03 ppm1 4.035 ppm2 2.079 CV 1 OR { 1666} (( segid "KH " and resid 77 and name HA )) (( segid "KH " and resid 77 and name HG3 )) ASSI { 1694} (( segid "KH " and resid 101 and name HB2 )) (( segid "KH " and resid 101 and name HB3 )) 1.700 0.300 0.500 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.24736E-01 ppm1 2.141 ppm2 2.023 CV 1 ASSI { 1703} ( segid "KH " and resid 152 and name HG1%) (( segid "KH " and resid 152 and name HB )) 2.000 0.500 0.500 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.13976E-01 ppm1 0.699 ppm2 2.079 CV 1 ASSI { 1708} ( segid "KH " and resid 87 and name HD1%) (( segid "KH " and resid 87 and name HB )) 2.300 0.700 0.700 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.10099E-01 ppm1 0.618 ppm2 2.031 CV 1 ASSI { 1723} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 90 and name HB2 )) 2.600 0.800 0.800 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.59147E-02 ppm1 0.648 ppm2 1.975 CV 1 OR { 1723} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 90 and name HB3 )) ASSI { 1730} (( segid "KH " and resid 92 and name HA )) (( segid "KH " and resid 92 and name HB3 )) 2.600 0.800 0.800 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.34419E-02 ppm1 4.336 ppm2 1.997 CV 1 ASSI { 1744} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 34 and name HB )) 2.000 0.500 0.500 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.14701E-01 ppm1 0.968 ppm2 1.983 CV 1 ASSI { 1748} ( segid "KH " and resid 37 and name HG2%) (( segid "KH " and resid 37 and name HB )) 2.100 0.600 0.600 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.87859E-02 ppm1 0.761 ppm2 1.972 CV 1 ASSI { 1755} (( segid "KH " and resid 168 and name HA )) (( segid "KH " and resid 168 and name HB2 )) 2.600 0.800 0.800 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.44918E-02 ppm1 3.914 ppm2 1.921 CV 1 OR { 1755} (( segid "KH " and resid 168 and name HA )) (( segid "KH " and resid 168 and name HB3 )) ASSI { 1757} (( segid "KH " and resid 50 and name HA )) (( segid "KH " and resid 50 and name HB3 )) 2.200 0.600 0.600 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.10054E-01 ppm1 4.202 ppm2 1.919 CV 1 OR { 1757} (( segid "KH " and resid 50 and name HA )) (( segid "KH " and resid 50 and name HB2 )) ASSI { 1775} ( segid "KH " and resid 38 and name HD1%) (( segid "KH " and resid 38 and name HB )) 2.700 0.900 0.900 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.89711E-02 ppm1 0.794 ppm2 1.951 CV 1 ASSI { 1778} (( segid "KH " and resid 46 and name HA )) (( segid "KH " and resid 46 and name HB2 )) 2.400 0.700 0.700 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.73026E-02 ppm1 4.172 ppm2 1.920 CV 1 OR { 1778} (( segid "KH " and resid 46 and name HA )) (( segid "KH " and resid 46 and name HB3 )) ASSI { 1779} (( segid "KH " and resid 174 and name HA )) (( segid "KH " and resid 174 and name HB2 )) 2.700 0.900 0.900 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.23741E-02 ppm1 3.942 ppm2 1.922 CV 1 ASSI { 1782} (( segid "KH " and resid 82 and name HB3 )) (( segid "KH " and resid 82 and name HB2 )) 3.000 1.200 1.200 peak 1782 spectrum 1 weight 0.10000E+01 volume 0.53930E-03 ppm1 1.668 ppm2 1.877 CV 1 ASSI { 1786} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 174 and name HB2 )) 2.400 0.700 0.700 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.14248E-01 ppm1 0.714 ppm2 1.924 CV 1 ASSI { 1811} ( segid "KH " and resid 154 and name HG1%) (( segid "KH " and resid 154 and name HB )) 2.400 0.700 0.700 peak 1811 spectrum 1 weight 0.10000E+01 volume 0.64827E-02 ppm1 0.833 ppm2 1.879 CV 1 ASSI { 1818} ( segid "KH " and resid 109 and name HG2%) (( segid "KH " and resid 109 and name HB )) 2.300 0.600 0.600 peak 1818 spectrum 1 weight 0.10000E+01 volume 0.78063E-02 ppm1 0.918 ppm2 1.969 CV 1 ASSI { 1839} ( segid "KH " and resid 138 and name HG1%) (( segid "KH " and resid 138 and name HB )) 2.200 0.600 0.600 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.10244E-01 ppm1 0.685 ppm2 1.702 CV 1 ASSI { 1847} (( segid "KH " and resid 151 and name HA )) (( segid "KH " and resid 151 and name HB3 )) 2.700 0.900 0.900 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.22627E-02 ppm1 5.122 ppm2 1.795 CV 1 ASSI { 1859} ( segid "KH " and resid 58 and name HG2%) (( segid "KH " and resid 58 and name HB )) 2.100 0.500 0.500 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.10670E-01 ppm1 0.813 ppm2 1.778 CV 1 ASSI { 1860} ( segid "KH " and resid 87 and name HD1%) (( segid "KH " and resid 87 and name HG12)) 2.400 0.700 0.700 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.54799E-02 ppm1 0.618 ppm2 1.835 CV 1 ASSI { 1861} (( segid "KH " and resid 100 and name HA )) (( segid "KH " and resid 100 and name HD2 )) 2.300 0.600 0.600 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.97641E-02 ppm1 4.388 ppm2 1.806 CV 1 OR { 1861} (( segid "KH " and resid 100 and name HA )) (( segid "KH " and resid 100 and name HD3 )) ASSI { 1862} (( segid "KH " and resid 94 and name HA )) (( segid "KH " and resid 94 and name HB3 )) 2.400 0.700 0.700 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.80666E-02 ppm1 4.359 ppm2 1.828 CV 1 ASSI { 1868} (( segid "KH " and resid 94 and name HG3 )) (( segid "KH " and resid 94 and name HB3 )) 2.200 0.600 0.600 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.11187E-01 ppm1 2.236 ppm2 1.818 CV 1 OR { 1868} (( segid "KH " and resid 94 and name HG2 )) (( segid "KH " and resid 94 and name HB3 )) ASSI { 1878} (( segid "KH " and resid 50 and name HA )) (( segid "KH " and resid 50 and name HG2 )) 2.800 1.000 1.000 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.50714E-02 ppm1 4.203 ppm2 1.765 CV 1 ASSI { 1889} (( segid "KH " and resid 50 and name HB3 )) (( segid "KH " and resid 50 and name HG2 )) 2.000 0.500 0.500 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.17545E-01 ppm1 1.933 ppm2 1.755 CV 1 OR { 1889} (( segid "KH " and resid 50 and name HB2 )) (( segid "KH " and resid 50 and name HG2 )) ASSI { 1895} (( segid "KH " and resid 141 and name HA )) (( segid "KH " and resid 141 and name HB3 )) 2.800 1.000 1.000 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.19284E-02 ppm1 4.259 ppm2 1.929 CV 1 ASSI { 1921} ( segid "KH " and resid 27 and name HG2%) (( segid "KH " and resid 27 and name HB )) 2.300 0.700 0.700 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.69761E-02 ppm1 0.795 ppm2 1.729 CV 1 ASSI { 1924} ( segid "KH " and resid 38 and name HD1%) (( segid "KH " and resid 38 and name HG12)) 2.000 0.500 0.500 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.11159E-01 ppm1 0.793 ppm2 1.675 CV 1 ASSI { 1938} ( segid "KH " and resid 156 and name HD1%) (( segid "KH " and resid 156 and name HB )) 2.400 0.700 0.700 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.74236E-02 ppm1 0.737 ppm2 1.694 CV 1 ASSI { 1940} (( segid "KH " and resid 110 and name HA )) (( segid "KH " and resid 110 and name HG2 )) 3.100 1.200 1.200 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.20479E-02 ppm1 5.390 ppm2 1.678 CV 1 ASSI { 1956} ( segid "KH " and resid 133 and name HD1%) (( segid "KH " and resid 133 and name HB3 )) 2.500 0.800 0.800 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.85357E-02 ppm1 0.916 ppm2 1.632 CV 1 ASSI { 1957} ( segid "KH " and resid 133 and name HD2%) (( segid "KH " and resid 133 and name HB3 )) 2.700 0.900 0.900 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.31992E-02 ppm1 0.916 ppm2 1.639 CV 1 ASSI { 1996} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 90 and name HD2 )) 2.600 0.900 0.900 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.35443E-02 ppm1 2.522 ppm2 1.756 CV 1 OR { 1996} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 90 and name HD2 )) ASSI { 2006} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 153 and name HB )) 2.200 0.600 0.600 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.88393E-02 ppm1 0.527 ppm2 1.660 CV 1 ASSI { 2034} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 174 and name HB3 )) 2.300 0.700 0.700 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.62969E-02 ppm1 0.715 ppm2 1.537 CV 1 ASSI { 2047} (( segid "KH " and resid 105 and name HA )) (( segid "KH " and resid 105 and name HB2 )) 3.100 1.200 1.200 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.15389E-02 ppm1 4.976 ppm2 1.574 CV 1 ASSI { 2056} (( segid "KH " and resid 82 and name HB2 )) (( segid "KH " and resid 82 and name HG3 )) 2.600 0.900 0.900 peak 2056 spectrum 1 weight 0.10000E+01 volume 0.36557E-02 ppm1 1.883 ppm2 1.504 CV 1 ASSI { 2103} (( segid "KH " and resid 76 and name HG2 )) ( segid "KH " and resid 79 and name HB% ) 3.200 1.300 1.300 peak 2103 spectrum 1 weight 0.10000E+01 volume 0.13605E-02 ppm1 2.253 ppm2 1.460 CV 1 ASSI { 2108} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 45 and name HG12)) 2.200 0.600 0.600 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.63341E-02 ppm1 1.076 ppm2 1.452 CV 1 ASSI { 2109} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 157 and name HG12)) 2.100 0.500 0.500 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.11304E-01 ppm1 0.854 ppm2 1.488 CV 1 ASSI { 2123} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 153 and name HG12)) 3.100 1.200 1.200 peak 2123 spectrum 1 weight 0.10000E+01 volume 0.53812E-02 ppm1 0.527 ppm2 1.473 CV 1 ASSI { 2125} ( segid "KH " and resid 45 and name HD1%) (( segid "KH " and resid 45 and name HG12)) 2.000 0.500 0.500 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.12572E-01 ppm1 0.792 ppm2 1.444 CV 1 ASSI { 2158} (( segid "KH " and resid 110 and name HD3 )) (( segid "KH " and resid 110 and name HG3 )) 2.900 1.100 1.100 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.27988E-02 ppm1 2.909 ppm2 1.380 CV 1 ASSI { 2176} ( segid "KH " and resid 177 and name HG2%) ( segid "KH " and resid 115 and name HB% ) 2.200 0.600 0.600 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.10235E-01 ppm1 0.897 ppm2 1.350 CV 1 ASSI { 2243} (( segid "KH " and resid 104 and name HE3 )) (( segid "KH " and resid 104 and name HG2 )) 2.700 0.900 0.900 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.42879E-02 ppm1 2.950 ppm2 1.270 CV 1 OR { 2243} (( segid "KH " and resid 104 and name HE2 )) (( segid "KH " and resid 104 and name HG2 )) ASSI { 2253} (( segid "KH " and resid 134 and name HB )) ( segid "KH " and resid 134 and name HG2%) 3.100 1.200 1.200 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.15951E-02 ppm1 4.241 ppm2 1.223 CV 1 ASSI { 2267} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 90 and name HG2 )) 2.700 0.900 0.900 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.39492E-02 ppm1 2.523 ppm2 1.233 CV 1 OR { 2267} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 90 and name HG2 )) OR { 2267} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 90 and name HG3 )) OR { 2267} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 90 and name HG3 )) ASSI { 2275} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 90 and name HG2 )) 2.400 0.700 0.700 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.59428E-02 ppm1 0.648 ppm2 1.206 CV 1 OR { 2275} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 90 and name HG3 )) ASSI { 2290} (( segid "KH " and resid 55 and name HB3 )) ( segid "KH " and resid 74 and name HG2%) 3.100 1.200 1.200 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.36792E-02 ppm1 3.839 ppm2 1.118 CV 1 OR { 2290} (( segid "KH " and resid 55 and name HB2 )) ( segid "KH " and resid 74 and name HG2%) ASSI { 2300} ( segid "KH " and resid 58 and name HD1%) (( segid "KH " and resid 58 and name HG13)) 2.100 0.500 0.500 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.12962E-01 ppm1 0.695 ppm2 1.158 CV 1 ASSI { 2379} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 157 and name HG13)) 2.200 0.600 0.600 peak 2379 spectrum 1 weight 0.10000E+01 volume 0.10181E-01 ppm1 0.832 ppm2 1.119 CV 1 ASSI { 2398} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 153 and name HG13)) 2.400 0.700 0.700 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.61194E-02 ppm1 0.527 ppm2 1.015 CV 1 ASSI { 2435} (( segid "KH " and resid 171 and name HA )) ( segid "KH " and resid 174 and name HD1%) 3.000 1.100 1.100 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.25652E-02 ppm1 3.899 ppm2 0.860 CV 1 ASSI { 2436} (( segid "KH " and resid 116 and name HA )) ( segid "KH " and resid 119 and name HG1%) 3.000 1.100 1.100 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.18912E-02 ppm1 3.426 ppm2 0.787 CV 1 ASSI { 2468} (( segid "KH " and resid 120 and name HB )) ( segid "KH " and resid 120 and name HD1%) 2.700 0.900 0.900 peak 2468 spectrum 1 weight 0.10000E+01 volume 0.32508E-02 ppm1 1.955 ppm2 0.767 CV 1 ASSI { 2517} ( segid "KH " and resid 107 and name HG2%) ( segid "KH " and resid 25 and name HG1%) 2.000 0.500 0.500 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.22291E-01 ppm1 1.134 ppm2 0.828 CV 1 ASSI { 2521} ( segid "KH " and resid 116 and name HB% ) ( segid "KH " and resid 140 and name HG1%) 2.300 2.300 3.700 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.11531E-01 ppm1 1.234 ppm2 0.810 CV 1 ASSI { 2561} ( segid "KH " and resid 115 and name HB% ) ( segid "KH " and resid 174 and name HD2%) 2.300 0.700 0.700 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.10996E-01 ppm1 1.347 ppm2 0.719 CV 1 ASSI { 2581} (( segid "KH " and resid 170 and name HG13)) ( segid "KH " and resid 170 and name HD1%) 2.700 0.900 0.900 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.27798E-02 ppm1 0.793 ppm2 0.658 CV 1 OR { 2581} (( segid "KH " and resid 170 and name HG12)) ( segid "KH " and resid 170 and name HD1%) ASSI { 2590} (( segid "KH " and resid 155 and name HE2 )) (( segid "KH " and resid 155 and name HG3 )) 3.000 1.200 1.200 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.26811E-02 ppm1 2.534 ppm2 0.685 CV 1 ASSI { 2617} (( segid "KH " and resid 87 and name HG13)) ( segid "KH " and resid 87 and name HG2%) 3.100 1.200 1.200 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.42879E-02 ppm1 0.993 ppm2 0.695 CV 1 ASSI { 2628} ( segid "KH " and resid 38 and name HG2%) ( segid "KH " and resid 58 and name HD1%) 2.700 0.900 0.900 peak 2628 spectrum 1 weight 0.10000E+01 volume 0.85756E-02 ppm1 1.089 ppm2 0.691 CV 1 ASSI { 2629} ( segid "KH " and resid 153 and name HG2%) ( segid "KH " and resid 153 and name HD1%) 2.000 0.500 0.500 peak 2629 spectrum 1 weight 0.10000E+01 volume 0.15145E-01 ppm1 0.527 ppm2 0.697 CV 1 ASSI { 2630} ( segid "KH " and resid 45 and name HG2%) ( segid "KH " and resid 58 and name HD1%) 2.400 0.700 0.700 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.51049E-02 ppm1 1.074 ppm2 0.671 CV 1 ASSI { 2672} ( segid "KH " and resid 115 and name HB% ) ( segid "KH " and resid 111 and name HG2%) 3.100 1.200 1.200 peak 2672 spectrum 1 weight 0.10000E+01 volume 0.23478E-02 ppm1 1.347 ppm2 0.504 CV 1 ASSI { 2673} ( segid "KH " and resid 116 and name HB% ) ( segid "KH " and resid 152 and name HG2%) 2.300 0.700 0.700 peak 2673 spectrum 1 weight 0.10000E+01 volume 0.77407E-02 ppm1 1.234 ppm2 0.612 CV 1 ASSI { 2705} ( segid "KH " and resid 34 and name HG1%) ( segid "KH " and resid 29 and name HD1%) 2.300 0.600 0.600 peak 2705 spectrum 1 weight 0.10000E+01 volume 0.85499E-02 ppm1 0.969 ppm2 0.477 CV 1 ASSI { 2720} (( segid "KH " and resid 8 and name HB )) ( segid "KH " and resid 8 and name HG1%) 2.200 0.600 0.600 peak 2720 spectrum 1 weight 0.10000E+01 volume 0.10905E-01 ppm1 2.012 ppm2 0.878 CV 1 OR { 2720} (( segid "KH " and resid 8 and name HB )) ( segid "KH " and resid 8 and name HG2%) ASSI { 2722} (( segid "KH " and resid 21 and name HA )) (( segid "KH " and resid 21 and name HG3 )) 2.800 1.000 1.000 peak 2722 spectrum 1 weight 0.10000E+01 volume 0.67535E-02 ppm1 4.235 ppm2 2.285 CV 1 OR { 2722} (( segid "KH " and resid 21 and name HA )) (( segid "KH " and resid 21 and name HG2 )) ASSI { 2723} (( segid "KH " and resid 21 and name HA )) (( segid "KH " and resid 21 and name HB2 )) 2.000 0.500 0.500 peak 2723 spectrum 1 weight 0.10000E+01 volume 0.24592E-01 ppm1 4.233 ppm2 2.083 CV 1 ASSI { 2724} (( segid "KH " and resid 21 and name HA )) (( segid "KH " and resid 21 and name HB3 )) 2.100 0.500 0.500 peak 2724 spectrum 1 weight 0.10000E+01 volume 0.16648E-01 ppm1 4.233 ppm2 1.972 CV 1 ASSI { 2781} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 110 and name HA )) 2.800 1.000 1.000 peak 2781 spectrum 1 weight 0.10000E+01 volume 0.18958E-02 ppm1 3.011 ppm2 5.386 CV 1 ASSI { 2801} (( segid "KH " and resid 131 and name HG2 )) (( segid "KH " and resid 131 and name HA )) 3.100 1.200 1.200 peak 2801 spectrum 1 weight 0.10000E+01 volume 0.17046E-02 ppm1 2.636 ppm2 4.238 CV 1 ASSI { 2824} (( segid "KH " and resid 107 and name HB )) ( segid "KH " and resid 25 and name HG1%) 3.700 1.700 1.700 peak 2824 spectrum 1 weight 0.10000E+01 volume 0.20145E-02 ppm1 3.975 ppm2 0.822 CV 1 ASSI { 2865} (( segid "KH " and resid 130 and name HB2 )) (( segid "KH " and resid 127 and name HA )) 3.400 1.400 1.400 peak 2865 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 1.893 ppm2 3.978 CV 1 ASSI { 2866} (( segid "KH " and resid 48 and name HB2 )) (( segid "KH " and resid 45 and name HA )) 3.000 1.100 1.100 peak 2866 spectrum 1 weight 0.10000E+01 volume 0.13505E-02 ppm1 1.637 ppm2 3.951 CV 1 ASSI { 2899} (( segid "KH " and resid 151 and name HG2 )) (( segid "KH " and resid 151 and name HA )) 2.700 0.900 0.900 peak 2899 spectrum 1 weight 0.10000E+01 volume 0.18206E-02 ppm1 2.360 ppm2 5.114 CV 1 ASSI { 2913} (( segid "KH " and resid 106 and name HB2 )) ( segid "KH " and resid 157 and name HG2%) 3.000 1.100 1.100 peak 2913 spectrum 1 weight 0.10000E+01 volume 0.58405E-02 ppm1 2.063 ppm2 0.824 CV 1 ASSI { 2937} (( segid "KH " and resid 146 and name HG3 )) (( segid "KH " and resid 146 and name HA )) 3.100 1.200 1.200 peak 2937 spectrum 1 weight 0.10000E+01 volume 0.24827E-02 ppm1 1.660 ppm2 4.380 CV 1 OR { 2937} (( segid "KH " and resid 146 and name HG2 )) (( segid "KH " and resid 146 and name HA )) ASSI { 2950} (( segid "KH " and resid 151 and name HA )) (( segid "KH " and resid 112 and name HA )) 2.400 0.700 0.700 peak 2950 spectrum 1 weight 0.10000E+01 volume 0.55786E-02 ppm1 5.123 ppm2 4.495 CV 1 ASSI { 2966} (( segid "KH " and resid 92 and name HE3 )) (( segid "KH " and resid 92 and name HG3 )) 2.000 0.500 0.500 peak 2966 spectrum 1 weight 0.10000E+01 volume 0.24818E-01 ppm1 3.069 ppm2 1.558 CV 1 OR { 2966} (( segid "KH " and resid 92 and name HE2 )) (( segid "KH " and resid 92 and name HG3 )) OR { 2966} (( segid "KH " and resid 92 and name HE2 )) (( segid "KH " and resid 92 and name HG2 )) ASSI { 3019} ( segid "KH " and resid 36 and name HB% ) ( segid "KH " and resid 96 and name HD% ) 3.200 1.300 1.300 peak 3019 spectrum 1 weight 0.10000E+01 volume 0.34139E-02 ppm1 1.420 ppm2 7.139 CV 1 ASSI { 3028} (( segid "KH " and resid 47 and name HB2 )) (( segid "KH " and resid 47 and name HA )) 2.400 0.700 0.700 peak 3028 spectrum 1 weight 0.10000E+01 volume 0.59057E-02 ppm1 2.218 ppm2 4.106 CV 1 ASSI { 3037} (( segid "KH " and resid 48 and name HB3 )) (( segid "KH " and resid 48 and name HA )) 3.000 1.100 1.100 peak 3037 spectrum 1 weight 0.10000E+01 volume 0.16721E-02 ppm1 1.540 ppm2 4.141 CV 1 ASSI { 3104} (( segid "KH " and resid 90 and name HB2 )) (( segid "KH " and resid 90 and name HA )) 2.500 0.800 0.800 peak 3104 spectrum 1 weight 0.10000E+01 volume 0.40968E-02 ppm1 1.972 ppm2 4.220 CV 1 OR { 3104} (( segid "KH " and resid 90 and name HB3 )) (( segid "KH " and resid 90 and name HA )) ASSI { 3162} (( segid "KH " and resid 168 and name HB3 )) (( segid "KH " and resid 168 and name HD2 )) 3.000 1.100 1.100 peak 3162 spectrum 1 weight 0.10000E+01 volume 0.22491E-02 ppm1 1.933 ppm2 3.196 CV 1 OR { 3162} (( segid "KH " and resid 168 and name HB3 )) (( segid "KH " and resid 168 and name HD3 )) OR { 3162} (( segid "KH " and resid 168 and name HB2 )) (( segid "KH " and resid 168 and name HD2 )) OR { 3162} (( segid "KH " and resid 168 and name HB2 )) (( segid "KH " and resid 168 and name HD3 )) ASSI { 3165} (( segid "KH " and resid 170 and name HA )) ( segid "KH " and resid 170 and name HG2%) 2.400 0.700 0.700 peak 3165 spectrum 1 weight 0.10000E+01 volume 0.62969E-02 ppm1 3.574 ppm2 0.702 CV 1 ASSI { 3187} ( segid "KH " and resid 38 and name HD1%) (( segid "KH " and resid 45 and name HB )) 2.100 0.600 0.600 peak 3187 spectrum 1 weight 0.10000E+01 volume 0.67345E-02 ppm1 0.792 ppm2 2.083 CV 1 ASSI { 3201} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 83 and name HA )) 2.500 0.800 0.800 peak 3201 spectrum 1 weight 0.10000E+01 volume 0.57752E-02 ppm1 0.966 ppm2 4.006 CV 1 ASSI { 3204} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 86 and name HB3 )) 2.300 0.700 0.700 peak 3204 spectrum 1 weight 0.10000E+01 volume 0.94470E-02 ppm1 0.966 ppm2 1.945 CV 1 OR { 3204} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 86 and name HB2 )) ASSI { 3225} (( segid "KH " and resid 178 and name HE3 )) (( segid "KH " and resid 178 and name HG2 )) 2.300 0.700 0.700 peak 3225 spectrum 1 weight 0.10000E+01 volume 0.81538E-02 ppm1 2.971 ppm2 1.504 CV 1 OR { 3225} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HG2 )) ASSI { 3232} ( segid "KH " and resid 103 and name HG2%) ( segid "KH " and resid 88 and name HD% ) 2.700 0.900 0.900 peak 3232 spectrum 1 weight 0.10000E+01 volume 0.36285E-02 ppm1 0.653 ppm2 7.424 CV 1 ASSI { 3253} ( segid "KH " and resid 56 and name HG2%) (( segid "KH " and resid 45 and name HG13)) 2.200 0.600 0.600 peak 3253 spectrum 1 weight 0.10000E+01 volume 0.80571E-02 ppm1 0.645 ppm2 1.260 CV 1 ASSI { 3257} (( segid "KH " and resid 14 and name HB2 )) (( segid "KH " and resid 14 and name HA )) 2.600 0.900 0.900 peak 3257 spectrum 1 weight 0.10000E+01 volume 0.45579E-02 ppm1 3.091 ppm2 4.622 CV 1 ASSI { 3268} (( segid "KH " and resid 140 and name HB )) (( segid "KH " and resid 140 and name HA )) 3.100 1.200 1.200 peak 3268 spectrum 1 weight 0.10000E+01 volume 0.12019E-02 ppm1 1.986 ppm2 4.726 CV 1 ASSI { 3271} ( segid "KH " and resid 170 and name HD1%) (( segid "KH " and resid 170 and name HA )) 3.900 1.900 1.900 peak 3271 spectrum 1 weight 0.10000E+01 volume 0.19511E-02 ppm1 0.639 ppm2 3.587 CV 1 ASSI { 3280} ( segid "KH " and resid 174 and name HD2%) ( segid "KH " and resid 111 and name HG2%) 1.900 1.900 4.100 peak 3280 spectrum 1 weight 0.10000E+01 volume 0.12799E-01 ppm1 0.714 ppm2 0.514 CV 1 ASSI { 3290} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 25 and name HA )) 2.400 0.700 0.700 peak 3290 spectrum 1 weight 0.10000E+01 volume 0.71722E-02 ppm1 0.840 ppm2 4.486 CV 1 ASSI { 3296} ( segid "KH " and resid 153 and name HD1%) (( segid "KH " and resid 153 and name HA )) 2.300 0.700 0.700 peak 3296 spectrum 1 weight 0.10000E+01 volume 0.61194E-02 ppm1 0.693 ppm2 4.705 CV 1 ASSI { 3299} (( segid "KH " and resid 151 and name HA )) (( segid "KH " and resid 146 and name HB3 )) 3.300 1.300 1.300 peak 3299 spectrum 1 weight 0.10000E+01 volume 0.11051E-02 ppm1 5.120 ppm2 2.046 CV 1 ASSI { 3301} (( segid "KH " and resid 53 and name HB2 )) (( segid "KH " and resid 82 and name HD2 )) 3.000 3.000 3.000 peak 3301 spectrum 1 weight 0.10000E+01 volume 0.17816E-02 ppm1 4.136 ppm2 1.457 CV 1 ASSI { 3318} (( segid "KH " and resid 155 and name HE2 )) (( segid "KH " and resid 155 and name HD3 )) 2.700 0.900 0.900 peak 3318 spectrum 1 weight 0.10000E+01 volume 0.27988E-02 ppm1 2.534 ppm2 1.487 CV 1 ASSI { 3320} (( segid "KH " and resid 155 and name HE2 )) (( segid "KH " and resid 155 and name HD2 )) 2.500 0.800 0.800 peak 3320 spectrum 1 weight 0.10000E+01 volume 0.42481E-02 ppm1 2.537 ppm2 1.577 CV 1 ASSI { 3339} (( segid "KH " and resid 14 and name HB3 )) (( segid "KH " and resid 14 and name HA )) 2.400 0.700 0.700 peak 3339 spectrum 1 weight 0.10000E+01 volume 0.67254E-02 ppm1 3.051 ppm2 4.622 CV 1 ASSI { 3359} (( segid "KH " and resid 131 and name HG3 )) (( segid "KH " and resid 131 and name HB3 )) 2.000 0.500 0.500 peak 3359 spectrum 1 weight 0.10000E+01 volume 0.16521E-01 ppm1 2.385 ppm2 2.124 CV 1 OR { 3359} (( segid "KH " and resid 131 and name HG3 )) (( segid "KH " and resid 131 and name HB2 )) ASSI { 3382} (( segid "KH " and resid 169 and name HB3 )) ( segid "KH " and resid 130 and name HD2%) 2.600 2.600 3.400 peak 3382 spectrum 1 weight 0.10000E+01 volume 0.18722E-02 ppm1 1.916 ppm2 0.796 CV 1 OR { 3382} (( segid "KH " and resid 169 and name HB2 )) ( segid "KH " and resid 130 and name HD2%) ASSI { 3386} (( segid "KH " and resid 154 and name HB )) (( segid "KH " and resid 154 and name HA )) 2.400 0.700 0.700 peak 3386 spectrum 1 weight 0.10000E+01 volume 0.53948E-02 ppm1 1.878 ppm2 4.191 CV 1 ASSI { 3402} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HD2 )) 2.000 0.500 0.500 peak 3402 spectrum 1 weight 0.10000E+01 volume 0.16992E-01 ppm1 2.967 ppm2 1.689 CV 1 OR { 3402} (( segid "KH " and resid 178 and name HE3 )) (( segid "KH " and resid 178 and name HD3 )) OR { 3402} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HD3 )) OR { 3402} (( segid "KH " and resid 178 and name HE3 )) (( segid "KH " and resid 178 and name HD2 )) ASSI { 3405} (( segid "KH " and resid 178 and name HE3 )) (( segid "KH " and resid 178 and name HG3 )) 2.800 1.000 1.000 peak 3405 spectrum 1 weight 0.10000E+01 volume 0.72654E-02 ppm1 2.969 ppm2 1.430 CV 1 OR { 3405} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HG3 )) ASSI { 3451} (( segid "KH " and resid 88 and name HA )) ( segid "KH " and resid 103 and name HG1%) 3.200 1.300 1.300 peak 3451 spectrum 1 weight 0.10000E+01 volume 0.19773E-02 ppm1 3.872 ppm2 0.944 CV 1 ASSI { 3456} (( segid "KH " and resid 20 and name HA )) (( segid "KH " and resid 20 and name HG2 )) 2.900 1.100 1.100 peak 3456 spectrum 1 weight 0.10000E+01 volume 0.49863E-02 ppm1 4.437 ppm2 2.080 CV 1 OR { 3456} (( segid "KH " and resid 20 and name HA )) (( segid "KH " and resid 20 and name HG3 )) ASSI { 3501} ( segid "KH " and resid 153 and name HD1%) (( segid "KH " and resid 153 and name HG12)) 2.000 0.500 0.500 peak 3501 spectrum 1 weight 0.10000E+01 volume 0.15742E-01 ppm1 0.690 ppm2 1.466 CV 1 ASSI { 3532} ( segid "KH " and resid 138 and name HG2%) ( segid "KH " and resid 138 and name HG1%) 2.100 0.500 0.500 peak 3532 spectrum 1 weight 0.10000E+01 volume 0.18650E-01 ppm1 0.521 ppm2 0.690 CV 1 ASSI { 3545} (( segid "KH " and resid 107 and name HA )) ( segid "KH " and resid 27 and name HG2%) 3.000 1.100 1.100 peak 3545 spectrum 1 weight 0.10000E+01 volume 0.17373E-02 ppm1 5.562 ppm2 0.796 CV 1 ASSI { 3564} ( segid "KH " and resid 105 and name HD2%) (( segid "KH " and resid 91 and name HG )) 3.100 1.200 1.200 peak 3564 spectrum 1 weight 0.10000E+01 volume 0.13207E-02 ppm1 -0.136 ppm2 2.036 CV 1 ASSI { 3619} ( segid "KH " and resid 31 and name HB% ) (( segid "KH " and resid 67 and name HA )) 2.600 0.900 0.900 peak 3619 spectrum 1 weight 0.10000E+01 volume 0.46629E-02 ppm1 1.282 ppm2 4.395 CV 1 ASSI { 3636} (( segid "KH " and resid 70 and name HA )) ( segid "KH " and resid 71 and name HG1%) 2.900 1.100 1.100 peak 3636 spectrum 1 weight 0.10000E+01 volume 0.34745E-02 ppm1 4.008 ppm2 0.757 CV 1 ASSI { 3645} (( segid "KH " and resid 57 and name HB3 )) (( segid "KH " and resid 57 and name HG2 )) 2.500 0.800 0.800 peak 3645 spectrum 1 weight 0.10000E+01 volume 0.30035E-02 ppm1 1.648 ppm2 1.320 CV 1 ASSI { 3646} (( segid "KH " and resid 57 and name HB3 )) ( segid "KH " and resid 72 and name HG1%) 4.300 2.300 1.700 peak 3646 spectrum 1 weight 0.10000E+01 volume 0.11920E-02 ppm1 1.650 ppm2 0.847 CV 1 ASSI { 3670} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 105 and name HB2 )) 2.400 0.700 0.700 peak 3670 spectrum 1 weight 0.10000E+01 volume 0.38233E-02 ppm1 0.816 ppm2 1.580 CV 1 ASSI { 3674} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 30 and name HD3 )) 3.600 1.600 1.600 peak 3674 spectrum 1 weight 0.10000E+01 volume 0.94112E-03 ppm1 0.815 ppm2 3.217 CV 1 ASSI { 3676} (( segid "KH " and resid 105 and name HG )) (( segid "KH " and resid 30 and name HD2 )) 3.200 1.300 1.300 peak 3676 spectrum 1 weight 0.10000E+01 volume 0.15978E-02 ppm1 0.816 ppm2 3.831 CV 1 ASSI { 3685} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 105 and name HG )) 1.900 0.500 0.500 peak 3685 spectrum 1 weight 0.10000E+01 volume 0.19945E-01 ppm1 0.982 ppm2 0.821 CV 1 ASSI { 3695} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 88 and name HA )) 2.100 0.600 0.600 peak 3695 spectrum 1 weight 0.10000E+01 volume 0.14248E-01 ppm1 0.983 ppm2 3.867 CV 1 ASSI { 3727} ( segid "KH " and resid 156 and name HD1%) ( segid "KH " and resid 156 and name HG2%) 1.900 0.400 0.400 peak 3727 spectrum 1 weight 0.10000E+01 volume 0.24927E-01 ppm1 0.736 ppm2 0.837 CV 1 ASSI { 3729} ( segid "KH " and resid 156 and name HD1%) ( segid "KH " and resid 166 and name HB% ) 2.300 0.600 0.600 peak 3729 spectrum 1 weight 0.10000E+01 volume 0.77590E-02 ppm1 0.738 ppm2 1.310 CV 1 ASSI { 3749} ( segid "KH " and resid 145 and name HG2%) (( segid "KH " and resid 144 and name HA )) 3.300 1.400 1.400 peak 3749 spectrum 1 weight 0.10000E+01 volume 0.17862E-02 ppm1 1.302 ppm2 4.422 CV 1 ASSI { 3761} ( segid "KH " and resid 173 and name HD1%) (( segid "KH " and resid 173 and name HG12)) 2.300 0.600 0.600 peak 3761 spectrum 1 weight 0.10000E+01 volume 0.87994E-02 ppm1 0.758 ppm2 1.828 CV 1 ASSI { 3777} (( segid "KH " and resid 32 and name HA )) (( segid "KH " and resid 32 and name HB2 )) 2.200 0.600 0.600 peak 3777 spectrum 1 weight 0.10000E+01 volume 0.88920E-02 ppm1 4.255 ppm2 2.259 CV 1 ASSI { 3778} (( segid "KH " and resid 32 and name HA )) (( segid "KH " and resid 32 and name HB3 )) 2.500 0.800 0.800 peak 3778 spectrum 1 weight 0.10000E+01 volume 0.94470E-02 ppm1 4.255 ppm2 2.173 CV 1 ASSI { 3794} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 27 and name HA )) 2.900 2.900 3.100 peak 3794 spectrum 1 weight 0.10000E+01 volume 0.37028E-02 ppm1 1.135 ppm2 4.752 CV 1 ASSI { 3812} ( segid "KH " and resid 154 and name HG1%) (( segid "KH " and resid 140 and name HA )) 2.800 2.800 3.200 peak 3812 spectrum 1 weight 0.10000E+01 volume 0.27898E-02 ppm1 0.833 ppm2 4.747 CV 1 ASSI { 3827} ( segid "KH " and resid 154 and name HG2%) (( segid "KH " and resid 154 and name HB )) 2.200 0.600 0.600 peak 3827 spectrum 1 weight 0.10000E+01 volume 0.10371E-01 ppm1 0.685 ppm2 1.870 CV 1 ASSI { 3833} ( segid "KH " and resid 103 and name HG2%) ( segid "KH " and resid 105 and name HD2%) 3.100 1.200 1.200 peak 3833 spectrum 1 weight 0.10000E+01 volume 0.27762E-02 ppm1 0.668 ppm2 -0.137 CV 1 ASSI { 3847} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 112 and name HG2 )) 2.400 0.700 0.700 peak 3847 spectrum 1 weight 0.10000E+01 volume 0.58495E-02 ppm1 1.349 ppm2 2.031 CV 1 OR { 3847} ( segid "KH " and resid 115 and name HB% ) (( segid "KH " and resid 112 and name HG3 )) ASSI { 3857} ( segid "KH " and resid 103 and name HG1%) (( segid "KH " and resid 103 and name HB )) 1.900 0.500 0.500 peak 3857 spectrum 1 weight 0.10000E+01 volume 0.18867E-01 ppm1 0.940 ppm2 2.116 CV 1 ASSI { 3860} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 158 and name HA1 )) 3.600 1.600 1.600 peak 3860 spectrum 1 weight 0.10000E+01 volume 0.18143E-02 ppm1 0.987 ppm2 4.380 CV 1 ASSI { 3862} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 166 and name HA )) 3.300 1.400 1.400 peak 3862 spectrum 1 weight 0.10000E+01 volume 0.18115E-02 ppm1 0.985 ppm2 3.960 CV 1 ASSI { 3868} ( segid "KH " and resid 63 and name HG2%) (( segid "KH " and resid 65 and name HA )) 3.100 3.100 2.900 peak 3868 spectrum 1 weight 0.10000E+01 volume 0.24827E-02 ppm1 1.242 ppm2 4.683 CV 1 ASSI { 3876} ( segid "KH " and resid 135 and name HB% ) ( segid "KH " and resid 136 and name HB% ) 2.900 2.900 3.100 peak 3876 spectrum 1 weight 0.10000E+01 volume 0.40769E-02 ppm1 1.686 ppm2 0.956 CV 1 ASSI { 3911} (( segid "KH " and resid 19 and name HD3 )) (( segid "KH " and resid 19 and name HD2 )) 2.100 0.500 0.500 peak 3911 spectrum 1 weight 0.10000E+01 volume 0.61158E-02 ppm1 3.617 ppm2 3.731 CV 1 ASSI { 3946} (( segid "KH " and resid 157 and name HG12)) (( segid "KH " and resid 106 and name HA )) 3.900 1.900 1.900 peak 3946 spectrum 1 weight 0.10000E+01 volume 0.12364E-02 ppm1 1.491 ppm2 4.981 CV 1 ASSI { 3948} (( segid "KH " and resid 157 and name HG12)) (( segid "KH " and resid 157 and name HB )) 2.600 0.900 0.900 peak 3948 spectrum 1 weight 0.10000E+01 volume 0.30923E-02 ppm1 1.489 ppm2 1.876 CV 1 ASSI { 3957} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 106 and name HA )) 2.600 0.800 0.800 peak 3957 spectrum 1 weight 0.10000E+01 volume 0.35678E-02 ppm1 0.853 ppm2 5.011 CV 1 ASSI { 3959} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 157 and name HG13)) 2.100 0.500 0.500 peak 3959 spectrum 1 weight 0.10000E+01 volume 0.12690E-01 ppm1 0.854 ppm2 1.110 CV 1 ASSI { 3960} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 157 and name HB )) 2.600 0.800 0.800 peak 3960 spectrum 1 weight 0.10000E+01 volume 0.12962E-01 ppm1 0.855 ppm2 1.886 CV 1 ASSI { 3961} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 106 and name HB3 )) 2.200 0.600 0.600 peak 3961 spectrum 1 weight 0.10000E+01 volume 0.10761E-01 ppm1 0.855 ppm2 2.035 CV 1 OR { 3961} ( segid "KH " and resid 157 and name HD1%) (( segid "KH " and resid 106 and name HB2 )) ASSI { 3967} (( segid "KH " and resid 141 and name HD3 )) (( segid "KH " and resid 140 and name HA )) 2.400 0.700 0.700 peak 3967 spectrum 1 weight 0.10000E+01 volume 0.47227E-02 ppm1 3.824 ppm2 4.722 CV 1 OR { 3967} (( segid "KH " and resid 141 and name HD2 )) (( segid "KH " and resid 140 and name HA )) ASSI { 4019} ( segid "KH " and resid 152 and name HG1%) (( segid "KH " and resid 146 and name HA )) 2.300 0.700 0.700 peak 4019 spectrum 1 weight 0.10000E+01 volume 0.76197E-02 ppm1 0.705 ppm2 4.366 CV 1 ASSI { 4171} ( segid "KH " and resid 156 and name HD1%) (( segid "KH " and resid 167 and name HA )) 2.600 0.900 0.900 peak 4171 spectrum 1 weight 0.10000E+01 volume 0.30742E-02 ppm1 0.733 ppm2 3.628 CV 1 ASSI { 4205} ( segid "KH " and resid 113 and name HB% ) (( segid "KH " and resid 150 and name HB3 )) 2.600 0.800 0.800 peak 4205 spectrum 1 weight 0.10000E+01 volume 0.53677E-02 ppm1 1.416 ppm2 2.234 CV 1 OR { 4205} ( segid "KH " and resid 113 and name HB% ) (( segid "KH " and resid 150 and name HG2 )) ASSI { 4207} ( segid "KH " and resid 113 and name HB% ) ( segid "KH " and resid 152 and name HG1%) 2.100 0.600 0.600 peak 4207 spectrum 1 weight 0.10000E+01 volume 0.12128E-01 ppm1 1.412 ppm2 0.696 CV 1 ASSI { 4227} (( segid "KH " and resid 112 and name HD2 )) (( segid "KH " and resid 112 and name HG2 )) 2.600 0.800 0.800 peak 4227 spectrum 1 weight 0.10000E+01 volume 0.27699E-02 ppm1 3.927 ppm2 2.044 CV 1 OR { 4227} (( segid "KH " and resid 112 and name HD2 )) (( segid "KH " and resid 112 and name HG3 )) ASSI { 4285} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 110 and name HD3 )) 1.600 0.300 0.600 peak 4285 spectrum 1 weight 0.10000E+01 volume 0.17282E-01 ppm1 3.012 ppm2 2.906 CV 1 ASSI { 4292} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 110 and name HG2 )) 2.400 0.700 0.700 peak 4292 spectrum 1 weight 0.10000E+01 volume 0.86811E-02 ppm1 3.011 ppm2 1.680 CV 1 ASSI { 4295} (( segid "KH " and resid 110 and name HD2 )) (( segid "KH " and resid 151 and name HB2 )) 3.200 1.300 1.300 peak 4295 spectrum 1 weight 0.10000E+01 volume 0.15135E-02 ppm1 3.011 ppm2 2.316 CV 1 ASSI { 4319} (( segid "KH " and resid 100 and name HG3 )) (( segid "KH " and resid 100 and name HB2 )) 2.600 0.800 0.800 peak 4319 spectrum 1 weight 0.10000E+01 volume 0.43341E-02 ppm1 1.433 ppm2 2.040 CV 1 OR { 4319} (( segid "KH " and resid 100 and name HG2 )) (( segid "KH " and resid 100 and name HB2 )) ASSI { 4320} (( segid "KH " and resid 100 and name HG2 )) (( segid "KH " and resid 100 and name HD2 )) 2.200 0.600 0.600 peak 4320 spectrum 1 weight 0.10000E+01 volume 0.89312E-02 ppm1 1.429 ppm2 1.824 CV 1 OR { 4320} (( segid "KH " and resid 100 and name HG3 )) (( segid "KH " and resid 100 and name HD3 )) OR { 4320} (( segid "KH " and resid 100 and name HG3 )) (( segid "KH " and resid 100 and name HD2 )) OR { 4320} (( segid "KH " and resid 100 and name HG2 )) (( segid "KH " and resid 100 and name HD3 )) ASSI { 4344} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 105 and name HB3 )) 2.300 0.700 0.700 peak 4344 spectrum 1 weight 0.10000E+01 volume 0.71999E-02 ppm1 0.986 ppm2 1.442 CV 1 ASSI { 4364} ( segid "KH " and resid 34 and name HG2%) (( segid "KH " and resid 34 and name HB )) 1.900 0.400 0.400 peak 4364 spectrum 1 weight 0.10000E+01 volume 0.23251E-01 ppm1 0.920 ppm2 1.982 CV 1 ASSI { 4365} ( segid "KH " and resid 34 and name HG2%) (( segid "KH " and resid 34 and name HA )) 2.800 1.000 1.000 peak 4365 spectrum 1 weight 0.10000E+01 volume 0.68646E-02 ppm1 0.920 ppm2 3.266 CV 1 ASSI { 4423} (( segid "KH " and resid 22 and name HG3 )) (( segid "KH " and resid 22 and name HG2 )) 1.800 0.400 0.400 peak 4423 spectrum 1 weight 0.10000E+01 volume 0.13134E-01 ppm1 2.167 ppm2 2.280 CV 1 ASSI { 4426} (( segid "KH " and resid 22 and name HG3 )) ( segid "KH " and resid 74 and name HG2%) 3.200 1.300 1.300 peak 4426 spectrum 1 weight 0.10000E+01 volume 0.18795E-02 ppm1 2.169 ppm2 1.124 CV 1 ASSI { 4430} (( segid "KH " and resid 23 and name HG2 )) (( segid "KH " and resid 23 and name HA )) 3.400 1.400 1.400 peak 4430 spectrum 1 weight 0.10000E+01 volume 0.20217E-02 ppm1 2.295 ppm2 4.602 CV 1 ASSI { 4483} ( segid "KH " and resid 54 and name HB% ) ( segid "KH " and resid 83 and name HB% ) 2.700 0.900 0.900 peak 4483 spectrum 1 weight 0.10000E+01 volume 0.49528E-02 ppm1 1.067 ppm2 1.270 CV 1 ASSI { 4485} ( segid "KH " and resid 54 and name HB% ) ( segid "KH " and resid 73 and name HD1%) 2.400 0.700 0.700 peak 4485 spectrum 1 weight 0.10000E+01 volume 0.89184E-02 ppm1 1.067 ppm2 0.648 CV 1 ASSI { 4523} ( segid "KH " and resid 27 and name HG1%) (( segid "KH " and resid 27 and name HB )) 2.200 0.600 0.600 peak 4523 spectrum 1 weight 0.10000E+01 volume 0.11313E-01 ppm1 0.937 ppm2 1.728 CV 1 ASSI { 4548} (( segid "KH " and resid 166 and name HA )) (( segid "KH " and resid 169 and name HB3 )) 3.100 1.200 1.200 peak 4548 spectrum 1 weight 0.10000E+01 volume 0.13451E-02 ppm1 3.955 ppm2 1.880 CV 1 OR { 4548} (( segid "KH " and resid 166 and name HA )) (( segid "KH " and resid 169 and name HB2 )) ASSI { 4553} ( segid "KH " and resid 166 and name HB% ) ( segid "KH " and resid 130 and name HD2%) 2.400 0.700 0.700 peak 4553 spectrum 1 weight 0.10000E+01 volume 0.67713E-02 ppm1 1.319 ppm2 0.797 CV 1 OR { 4553} ( segid "KH " and resid 166 and name HB% ) ( segid "KH " and resid 130 and name HD1%) ASSI { 4603} (( segid "KH " and resid 178 and name HB2 )) (( segid "KH " and resid 178 and name HG2 )) 2.100 0.500 0.500 peak 4603 spectrum 1 weight 0.10000E+01 volume 0.12835E-01 ppm1 1.871 ppm2 1.508 CV 1 OR { 4603} (( segid "KH " and resid 178 and name HB3 )) (( segid "KH " and resid 178 and name HG2 )) ASSI { 4630} (( segid "KH " and resid 48 and name HA )) (( segid "KH " and resid 48 and name HB2 )) 2.500 0.800 0.800 peak 4630 spectrum 1 weight 0.10000E+01 volume 0.51575E-02 ppm1 4.162 ppm2 1.651 CV 1 ASSI { 4642} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 48 and name HB3 )) 2.200 0.600 0.600 peak 4642 spectrum 1 weight 0.10000E+01 volume 0.13976E-01 ppm1 0.966 ppm2 1.536 CV 1 ASSI { 4643} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 48 and name HB2 )) 2.300 0.600 0.600 peak 4643 spectrum 1 weight 0.10000E+01 volume 0.10389E-01 ppm1 0.963 ppm2 1.638 CV 1 ASSI { 4651} ( segid "KH " and resid 91 and name HD2%) ( segid "KH " and resid 105 and name HD1%) 3.100 1.200 1.200 peak 4651 spectrum 1 weight 0.10000E+01 volume 0.20316E-02 ppm1 0.596 ppm2 0.981 CV 1 ASSI { 4667} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 60 and name HD2 )) 2.800 1.000 1.000 peak 4667 spectrum 1 weight 0.10000E+01 volume 0.52227E-02 ppm1 1.394 ppm2 3.811 CV 1 ASSI { 4668} ( segid "KH " and resid 59 and name HB% ) (( segid "KH " and resid 60 and name HD3 )) 3.200 1.300 1.300 peak 4668 spectrum 1 weight 0.10000E+01 volume 0.53812E-02 ppm1 1.392 ppm2 3.624 CV 1 ASSI { 4676} (( segid "KH " and resid 62 and name HB2 )) (( segid "KH " and resid 62 and name HG3 )) 2.000 0.500 0.500 peak 4676 spectrum 1 weight 0.10000E+01 volume 0.26385E-01 ppm1 2.147 ppm2 2.354 CV 1 OR { 4676} (( segid "KH " and resid 62 and name HB3 )) (( segid "KH " and resid 62 and name HG2 )) OR { 4676} (( segid "KH " and resid 62 and name HB3 )) (( segid "KH " and resid 62 and name HG3 )) OR { 4676} (( segid "KH " and resid 62 and name HB2 )) (( segid "KH " and resid 62 and name HG2 )) ASSI { 4677} (( segid "KH " and resid 62 and name HB2 )) ( segid "KH " and resid 63 and name HG2%) 2.800 1.000 1.000 peak 4677 spectrum 1 weight 0.10000E+01 volume 0.40144E-02 ppm1 2.143 ppm2 1.240 CV 1 OR { 4677} (( segid "KH " and resid 62 and name HB3 )) ( segid "KH " and resid 63 and name HG2%) ASSI { 4695} ( segid "KH " and resid 68 and name HG2%) (( segid "KH " and resid 28 and name HB3 )) 2.800 1.000 1.000 peak 4695 spectrum 1 weight 0.10000E+01 volume 0.31720E-02 ppm1 0.862 ppm2 2.553 CV 1 ASSI { 4697} ( segid "KH " and resid 68 and name HG2%) (( segid "KH " and resid 28 and name HB2 )) 3.400 1.500 1.500 peak 4697 spectrum 1 weight 0.10000E+01 volume 0.25262E-02 ppm1 0.862 ppm2 3.048 CV 1 ASSI { 4710} (( segid "KH " and resid 67 and name HG3 )) (( segid "KH " and resid 67 and name HA )) 2.700 0.900 0.900 peak 4710 spectrum 1 weight 0.10000E+01 volume 0.42282E-02 ppm1 1.578 ppm2 4.378 CV 1 ASSI { 4756} (( segid "KH " and resid 50 and name HD3 )) (( segid "KH " and resid 50 and name HB2 )) 2.300 0.700 0.700 peak 4756 spectrum 1 weight 0.10000E+01 volume 0.13451E-01 ppm1 3.217 ppm2 1.925 CV 1 OR { 4756} (( segid "KH " and resid 50 and name HD2 )) (( segid "KH " and resid 50 and name HB3 )) OR { 4756} (( segid "KH " and resid 50 and name HD3 )) (( segid "KH " and resid 50 and name HB3 )) OR { 4756} (( segid "KH " and resid 50 and name HD2 )) (( segid "KH " and resid 50 and name HB2 )) ASSI { 4757} (( segid "KH " and resid 50 and name HD2 )) (( segid "KH " and resid 50 and name HG2 )) 2.100 0.500 0.500 peak 4757 spectrum 1 weight 0.10000E+01 volume 0.15254E-01 ppm1 3.217 ppm2 1.749 CV 1 OR { 4757} (( segid "KH " and resid 50 and name HD3 )) (( segid "KH " and resid 50 and name HG2 )) ASSI { 4758} (( segid "KH " and resid 50 and name HD3 )) (( segid "KH " and resid 50 and name HG3 )) 2.100 0.500 0.500 peak 4758 spectrum 1 weight 0.10000E+01 volume 0.14230E-01 ppm1 3.217 ppm2 1.666 CV 1 OR { 4758} (( segid "KH " and resid 50 and name HD2 )) (( segid "KH " and resid 50 and name HG3 )) ASSI { 4759} (( segid "KH " and resid 50 and name HD3 )) (( segid "KH " and resid 50 and name HA )) 2.500 0.800 0.800 peak 4759 spectrum 1 weight 0.10000E+01 volume 0.44455E-02 ppm1 3.215 ppm2 4.201 CV 1 OR { 4759} (( segid "KH " and resid 50 and name HD2 )) (( segid "KH " and resid 50 and name HA )) ASSI { 4761} (( segid "KH " and resid 93 and name HB3 )) (( segid "KH " and resid 93 and name HA )) 2.400 0.700 0.700 peak 4761 spectrum 1 weight 0.10000E+01 volume 0.73587E-02 ppm1 2.163 ppm2 4.051 CV 1 ASSI { 4762} (( segid "KH " and resid 93 and name HB3 )) (( segid "KH " and resid 94 and name HB2 )) 2.400 2.400 3.600 peak 4762 spectrum 1 weight 0.10000E+01 volume 0.22844E-01 ppm1 2.162 ppm2 2.356 CV 1 ASSI { 4773} (( segid "KH " and resid 76 and name HB2 )) (( segid "KH " and resid 77 and name HG3 )) 3.600 1.600 1.600 peak 4773 spectrum 1 weight 0.10000E+01 volume 0.22001E-02 ppm1 2.486 ppm2 2.092 CV 1 OR { 4773} (( segid "KH " and resid 76 and name HB2 )) (( segid "KH " and resid 77 and name HG2 )) ASSI { 4796} (( segid "KH " and resid 71 and name HB )) (( segid "KH " and resid 71 and name HA )) 2.200 0.600 0.600 peak 4796 spectrum 1 weight 0.10000E+01 volume 0.66321E-02 ppm1 2.044 ppm2 4.389 CV 1 ASSI { 4797} ( segid "KH " and resid 71 and name HG2%) (( segid "KH " and resid 71 and name HB )) 2.000 0.500 0.500 peak 4797 spectrum 1 weight 0.10000E+01 volume 0.15316E-01 ppm1 0.702 ppm2 2.026 CV 1 ASSI { 4798} ( segid "KH " and resid 71 and name HG2%) (( segid "KH " and resid 71 and name HA )) 2.800 1.000 1.000 peak 4798 spectrum 1 weight 0.10000E+01 volume 0.49465E-02 ppm1 0.691 ppm2 4.385 CV 1 ASSI { 4808} ( segid "KH " and resid 73 and name HD1%) (( segid "KH " and resid 73 and name HB )) 2.900 1.000 1.000 peak 4808 spectrum 1 weight 0.10000E+01 volume 0.63902E-02 ppm1 0.639 ppm2 2.055 CV 1 ASSI { 4855} ( segid "KH " and resid 58 and name HG2%) (( segid "KH " and resid 58 and name HG12)) 2.200 0.600 0.600 peak 4855 spectrum 1 weight 0.10000E+01 volume 0.68740E-02 ppm1 0.814 ppm2 1.393 CV 1 ASSI { 4856} ( segid "KH " and resid 58 and name HG2%) (( segid "KH " and resid 58 and name HG13)) 2.800 1.000 1.000 peak 4856 spectrum 1 weight 0.10000E+01 volume 0.81673E-02 ppm1 0.815 ppm2 1.150 CV 1 ASSI { 4879} ( segid "KH " and resid 38 and name HD1%) (( segid "KH " and resid 38 and name HA )) 2.200 0.600 0.600 peak 4879 spectrum 1 weight 0.10000E+01 volume 0.69301E-02 ppm1 0.793 ppm2 3.980 CV 1 ASSI { 4888} (( segid "KH " and resid 130 and name HB3 )) (( segid "KH " and resid 127 and name HA )) 2.800 0.900 0.900 peak 4888 spectrum 1 weight 0.10000E+01 volume 0.21377E-02 ppm1 1.713 ppm2 3.977 CV 1 ASSI { 4900} ( segid "KH " and resid 130 and name HD1%) (( segid "KH " and resid 130 and name HB3 )) 2.700 0.900 0.900 peak 4900 spectrum 1 weight 0.10000E+01 volume 0.90671E-02 ppm1 0.801 ppm2 1.693 CV 1 ASSI { 4901} ( segid "KH " and resid 130 and name HD1%) (( segid "KH " and resid 130 and name HB2 )) 2.300 0.700 0.700 peak 4901 spectrum 1 weight 0.10000E+01 volume 0.70978E-02 ppm1 0.801 ppm2 1.879 CV 1 ASSI { 4918} (( segid "KH " and resid 173 and name HG13)) ( segid "KH " and resid 173 and name HD1%) 2.600 0.800 0.800 peak 4918 spectrum 1 weight 0.10000E+01 volume 0.35814E-02 ppm1 1.024 ppm2 0.749 CV 1 ASSI { 4936} ( segid "KH " and resid 87 and name HD1%) (( segid "KH " and resid 84 and name HA )) 2.800 1.000 1.000 peak 4936 spectrum 1 weight 0.10000E+01 volume 0.27599E-02 ppm1 0.615 ppm2 3.856 CV 1 ASSI { 4944} ( segid "KH " and resid 87 and name HD1%) (( segid "KH " and resid 87 and name HG13)) 2.300 0.700 0.700 peak 4944 spectrum 1 weight 0.10000E+01 volume 0.71911E-02 ppm1 0.617 ppm2 0.986 CV 1 ASSI { 4963} ( segid "KH " and resid 119 and name HG2%) (( segid "KH " and resid 119 and name HA )) 2.600 0.800 0.800 peak 4963 spectrum 1 weight 0.10000E+01 volume 0.48876E-02 ppm1 0.542 ppm2 3.375 CV 1 ASSI { 4976} ( segid "KH " and resid 29 and name HG2%) ( segid "KH " and resid 105 and name HD1%) 2.300 0.700 0.700 peak 4976 spectrum 1 weight 0.10000E+01 volume 0.91029E-02 ppm1 0.701 ppm2 0.978 CV 1 ASSI { 4979} ( segid "KH " and resid 29 and name HG2%) (( segid "KH " and resid 30 and name HD3 )) 3.600 1.600 1.600 peak 4979 spectrum 1 weight 0.10000E+01 volume 0.23976E-02 ppm1 0.701 ppm2 3.240 CV 1 ASSI { 4998} (( segid "KH " and resid 92 and name HE3 )) ( segid "KH " and resid 103 and name HG1%) 2.800 1.000 1.000 peak 4998 spectrum 1 weight 0.10000E+01 volume 0.33858E-02 ppm1 3.071 ppm2 0.954 CV 1 OR { 4998} (( segid "KH " and resid 92 and name HE2 )) ( segid "KH " and resid 103 and name HG1%) ASSI { 5037} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 94 and name HB3 )) 3.300 1.300 1.300 peak 5037 spectrum 1 weight 0.10000E+01 volume 0.23813E-02 ppm1 0.599 ppm2 1.790 CV 1 ASSI { 5038} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 91 and name HB2 )) 2.800 0.900 0.900 peak 5038 spectrum 1 weight 0.10000E+01 volume 0.41629E-02 ppm1 0.599 ppm2 2.139 CV 1 ASSI { 5041} ( segid "KH " and resid 91 and name HD2%) (( segid "KH " and resid 30 and name HD2 )) 2.900 1.000 1.000 peak 5041 spectrum 1 weight 0.10000E+01 volume 0.20262E-02 ppm1 0.599 ppm2 3.793 CV 1 ASSI { 5048} (( segid "KH " and resid 86 and name HG3 )) (( segid "KH " and resid 86 and name HD3 )) 2.700 0.900 0.900 peak 5048 spectrum 1 weight 0.10000E+01 volume 0.26213E-02 ppm1 1.593 ppm2 3.052 CV 1 OR { 5048} (( segid "KH " and resid 86 and name HG3 )) (( segid "KH " and resid 86 and name HD2 )) ASSI { 5049} (( segid "KH " and resid 86 and name HG3 )) (( segid "KH " and resid 86 and name HG2 )) 1.900 0.400 0.400 peak 5049 spectrum 1 weight 0.10000E+01 volume 0.98642E-02 ppm1 1.592 ppm2 1.779 CV 1 ASSI { 5077} (( segid "KH " and resid 28 and name HB2 )) (( segid "KH " and resid 106 and name HB2 )) 3.800 1.800 1.800 peak 5077 spectrum 1 weight 0.10000E+01 volume 0.11657E-02 ppm1 3.051 ppm2 2.072 CV 1 ASSI { 5086} ( segid "KH " and resid 37 and name HD1%) (( segid "KH " and resid 87 and name HA )) 2.800 1.000 1.000 peak 5086 spectrum 1 weight 0.10000E+01 volume 0.23378E-02 ppm1 0.649 ppm2 3.557 CV 1 ASSI { 5089} ( segid "KH " and resid 37 and name HG2%) ( segid "KH " and resid 29 and name HD1%) 2.800 1.000 1.000 peak 5089 spectrum 1 weight 0.10000E+01 volume 0.43405E-02 ppm1 0.761 ppm2 0.492 CV 1 ASSI { 5116} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 46 and name HG2 )) 2.800 0.900 0.900 peak 5116 spectrum 1 weight 0.10000E+01 volume 0.46829E-02 ppm1 1.074 ppm2 1.635 CV 1 ASSI { 5158} (( segid "KH " and resid 104 and name HE3 )) ( segid "KH " and resid 157 and name HG2%) 2.900 1.100 1.100 peak 5158 spectrum 1 weight 0.10000E+01 volume 0.32228E-02 ppm1 2.949 ppm2 0.834 CV 1 OR { 5158} (( segid "KH " and resid 104 and name HE2 )) ( segid "KH " and resid 157 and name HG2%) OR { 5158} (( segid "KH " and resid 104 and name HE3 )) ( segid "KH " and resid 157 and name HD1%) ASSI { 5166} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HA )) 3.100 1.200 1.200 peak 5166 spectrum 1 weight 0.10000E+01 volume 0.16395E-02 ppm1 1.250 ppm2 4.662 CV 1 ASSI { 5169} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 57 and name HD3 )) 2.300 0.700 0.700 peak 5169 spectrum 1 weight 0.10000E+01 volume 0.63712E-02 ppm1 1.333 ppm2 1.639 CV 1 OR { 5169} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 57 and name HD2 )) OR { 5169} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 57 and name HB3 )) ASSI { 5170} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 57 and name HB2 )) 2.900 1.100 1.100 peak 5170 spectrum 1 weight 0.10000E+01 volume 0.34700E-02 ppm1 1.333 ppm2 1.771 CV 1 ASSI { 5172} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HB2 )) 2.500 0.800 0.800 peak 5172 spectrum 1 weight 0.10000E+01 volume 0.39537E-02 ppm1 1.239 ppm2 1.782 CV 1 ASSI { 5175} (( segid "KH " and resid 57 and name HG2 )) (( segid "KH " and resid 72 and name HB )) 3.100 1.200 1.200 peak 5175 spectrum 1 weight 0.10000E+01 volume 0.24664E-02 ppm1 1.335 ppm2 1.975 CV 1 ASSI { 5176} (( segid "KH " and resid 57 and name HG2 )) ( segid "KH " and resid 72 and name HG2%) 3.300 1.400 1.400 peak 5176 spectrum 1 weight 0.10000E+01 volume 0.28424E-02 ppm1 1.332 ppm2 0.677 CV 1 ASSI { 5181} (( segid "KH " and resid 57 and name HE3 )) (( segid "KH " and resid 57 and name HB2 )) 2.900 1.000 1.000 peak 5181 spectrum 1 weight 0.10000E+01 volume 0.29709E-02 ppm1 2.872 ppm2 1.774 CV 1 OR { 5181} (( segid "KH " and resid 57 and name HE2 )) (( segid "KH " and resid 57 and name HB2 )) ASSI { 5182} (( segid "KH " and resid 57 and name HE2 )) (( segid "KH " and resid 57 and name HD3 )) 2.000 0.500 0.500 peak 5182 spectrum 1 weight 0.10000E+01 volume 0.16811E-01 ppm1 2.875 ppm2 1.608 CV 1 OR { 5182} (( segid "KH " and resid 57 and name HE3 )) (( segid "KH " and resid 57 and name HD3 )) OR { 5182} (( segid "KH " and resid 57 and name HE2 )) (( segid "KH " and resid 57 and name HD2 )) OR { 5182} (( segid "KH " and resid 57 and name HE3 )) (( segid "KH " and resid 57 and name HD2 )) ASSI { 5183} (( segid "KH " and resid 57 and name HE3 )) (( segid "KH " and resid 57 and name HG2 )) 2.500 0.800 0.800 peak 5183 spectrum 1 weight 0.10000E+01 volume 0.87074E-02 ppm1 2.872 ppm2 1.329 CV 1 OR { 5183} (( segid "KH " and resid 57 and name HE2 )) (( segid "KH " and resid 57 and name HG2 )) ASSI { 5185} (( segid "KH " and resid 57 and name HE2 )) ( segid "KH " and resid 72 and name HG1%) 2.700 0.900 0.900 peak 5185 spectrum 1 weight 0.10000E+01 volume 0.43269E-02 ppm1 2.873 ppm2 0.861 CV 1 OR { 5185} (( segid "KH " and resid 57 and name HE3 )) ( segid "KH " and resid 72 and name HG1%) ASSI { 5186} (( segid "KH " and resid 57 and name HE2 )) ( segid "KH " and resid 72 and name HG2%) 3.000 1.200 1.200 peak 5186 spectrum 1 weight 0.10000E+01 volume 0.35859E-02 ppm1 2.872 ppm2 0.667 CV 1 OR { 5186} (( segid "KH " and resid 57 and name HE3 )) ( segid "KH " and resid 72 and name HG2%) ASSI { 5191} (( segid "KH " and resid 60 and name HD3 )) (( segid "KH " and resid 60 and name HG2 )) 2.100 0.600 0.600 peak 5191 spectrum 1 weight 0.10000E+01 volume 0.12092E-01 ppm1 3.648 ppm2 2.036 CV 1 OR { 5191} (( segid "KH " and resid 60 and name HD3 )) (( segid "KH " and resid 60 and name HG3 )) ASSI { 5201} (( segid "KH " and resid 102 and name HB2 )) (( segid "KH " and resid 102 and name HA )) 2.500 0.800 0.800 peak 5201 spectrum 1 weight 0.10000E+01 volume 0.50850E-02 ppm1 1.935 ppm2 4.352 CV 1 ASSI { 5220} (( segid "KH " and resid 101 and name HA )) (( segid "KH " and resid 101 and name HB3 )) 2.600 0.800 0.800 peak 5220 spectrum 1 weight 0.10000E+01 volume 0.86682E-02 ppm1 4.420 ppm2 2.027 CV 1 ASSI { 5221} (( segid "KH " and resid 137 and name HA )) (( segid "KH " and resid 131 and name HG2 )) 2.300 2.300 3.700 peak 5221 spectrum 1 weight 0.10000E+01 volume 0.44129E-02 ppm1 4.418 ppm2 2.639 CV 1 ASSI { 5224} (( segid "KH " and resid 101 and name HB2 )) (( segid "KH " and resid 101 and name HG3 )) 2.400 0.700 0.700 peak 5224 spectrum 1 weight 0.10000E+01 volume 0.89711E-02 ppm1 2.137 ppm2 2.344 CV 1 OR { 5224} (( segid "KH " and resid 101 and name HB2 )) (( segid "KH " and resid 101 and name HG2 )) ASSI { 5287} (( segid "KH " and resid 133 and name HA )) ( segid "KH " and resid 133 and name HD2%) 3.000 1.100 1.100 peak 5287 spectrum 1 weight 0.10000E+01 volume 0.27337E-02 ppm1 4.274 ppm2 0.910 CV 1 OR { 5287} (( segid "KH " and resid 133 and name HA )) ( segid "KH " and resid 133 and name HD1%) ASSI { 5291} (( segid "KH " and resid 133 and name HB2 )) (( segid "KH " and resid 133 and name HB3 )) 2.200 0.600 0.600 peak 5291 spectrum 1 weight 0.10000E+01 volume 0.37680E-02 ppm1 1.833 ppm2 1.644 CV 1 ASSI { 5294} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 69 and name HB2 )) 2.200 0.600 0.600 peak 5294 spectrum 1 weight 0.10000E+01 volume 0.11051E-01 ppm1 0.968 ppm2 1.583 CV 1 ASSI { 5295} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 29 and name HG12)) 2.400 2.400 3.600 peak 5295 spectrum 1 weight 0.10000E+01 volume 0.12672E-01 ppm1 0.968 ppm2 1.277 CV 1 ASSI { 5296} ( segid "KH " and resid 34 and name HG1%) ( segid "KH " and resid 38 and name HG2%) 2.900 2.900 3.100 peak 5296 spectrum 1 weight 0.10000E+01 volume 0.10824E-01 ppm1 0.968 ppm2 1.107 CV 1 ASSI { 5297} ( segid "KH " and resid 34 and name HG1%) (( segid "KH " and resid 38 and name HG12)) 2.100 0.600 0.600 peak 5297 spectrum 1 weight 0.10000E+01 volume 0.10779E-01 ppm1 0.968 ppm2 1.655 CV 1 ASSI { 5353} (( segid "KH " and resid 171 and name HG3 )) (( segid "KH " and resid 171 and name HD2 )) 2.400 0.700 0.700 peak 5353 spectrum 1 weight 0.10000E+01 volume 0.61665E-02 ppm1 1.741 ppm2 3.199 CV 1 OR { 5353} (( segid "KH " and resid 171 and name HG3 )) (( segid "KH " and resid 171 and name HD3 )) ASSI { 5371} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HG3 )) 1.900 0.400 0.400 peak 5371 spectrum 1 weight 0.10000E+01 volume 0.10227E-01 ppm1 2.559 ppm2 2.418 CV 1 ASSI { 5372} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HB2 )) 2.100 0.500 0.500 peak 5372 spectrum 1 weight 0.10000E+01 volume 0.16286E-01 ppm1 2.555 ppm2 2.192 CV 1 OR { 5372} (( segid "KH " and resid 176 and name HG2 )) (( segid "KH " and resid 176 and name HB3 )) ASSI { 5385} (( segid "KH " and resid 14 and name HB2 )) ( segid "KH " and resid 14 and name HD% ) 2.700 0.900 0.900 peak 5385 spectrum 1 weight 0.10000E+01 volume 0.31295E-02 ppm1 3.091 ppm2 7.217 CV 1 ASSI { 5386} (( segid "KH " and resid 14 and name HB3 )) ( segid "KH " and resid 14 and name HD% ) 2.600 0.800 0.800 peak 5386 spectrum 1 weight 0.10000E+01 volume 0.50325E-02 ppm1 3.051 ppm2 7.228 CV 1 ASSI { 5391} (( segid "KH " and resid 22 and name HA )) (( segid "KH " and resid 20 and name HB3 )) 2.600 2.600 3.400 peak 5391 spectrum 1 weight 0.10000E+01 volume 0.21965E-02 ppm1 4.010 ppm2 1.928 CV 1 ASSI { 5399} ( segid "KH " and resid 25 and name HG1%) (( segid "KH " and resid 25 and name HB )) 2.000 0.500 0.500 peak 5399 spectrum 1 weight 0.10000E+01 volume 0.18578E-01 ppm1 0.834 ppm2 2.052 CV 1 OR { 5399} ( segid "KH " and resid 25 and name HG2%) (( segid "KH " and resid 25 and name HB )) ASSI { 5444} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 48 and name HB2 )) 2.100 0.500 0.500 peak 5444 spectrum 1 weight 0.10000E+01 volume 0.17255E-01 ppm1 0.699 ppm2 1.619 CV 1 ASSI { 5445} ( segid "KH " and resid 56 and name HD1%) (( segid "KH " and resid 71 and name HB )) 2.100 0.600 0.600 peak 5445 spectrum 1 weight 0.10000E+01 volume 0.96830E-02 ppm1 0.696 ppm2 2.018 CV 1 ASSI { 5457} (( segid "KH " and resid 64 and name HB2 )) (( segid "KH " and resid 64 and name HG2 )) 2.100 0.600 0.600 peak 5457 spectrum 1 weight 0.10000E+01 volume 0.95376E-02 ppm1 2.381 ppm2 2.105 CV 1 ASSI { 5458} (( segid "KH " and resid 64 and name HB2 )) (( segid "KH " and resid 64 and name HB3 )) 1.600 0.300 0.600 peak 5458 spectrum 1 weight 0.10000E+01 volume 0.26304E-01 ppm1 2.384 ppm2 1.936 CV 1 ASSI { 5462} ( segid "KH " and resid 68 and name HG2%) ( segid "KH " and resid 28 and name HD% ) 2.500 0.800 0.800 peak 5462 spectrum 1 weight 0.10000E+01 volume 0.48677E-02 ppm1 0.860 ppm2 6.836 CV 1 ASSI { 5481} ( segid "KH " and resid 87 and name HG2%) (( segid "KH " and resid 87 and name HB )) 2.100 0.600 0.600 peak 5481 spectrum 1 weight 0.10000E+01 volume 0.11458E-01 ppm1 0.698 ppm2 2.049 CV 1 ASSI { 5486} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 90 and name HD3 )) 2.600 0.800 0.800 peak 5486 spectrum 1 weight 0.10000E+01 volume 0.40769E-02 ppm1 2.522 ppm2 1.589 CV 1 OR { 5486} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 90 and name HD3 )) ASSI { 5502} (( segid "KH " and resid 92 and name HE2 )) (( segid "KH " and resid 92 and name HB3 )) 2.300 0.700 0.700 peak 5502 spectrum 1 weight 0.10000E+01 volume 0.65859E-02 ppm1 3.071 ppm2 1.995 CV 1 OR { 5502} (( segid "KH " and resid 92 and name HE3 )) (( segid "KH " and resid 92 and name HB3 )) ASSI { 5512} ( segid "KH " and resid 116 and name HB% ) (( segid "KH " and resid 140 and name HB )) 2.800 1.000 1.000 peak 5512 spectrum 1 weight 0.10000E+01 volume 0.25914E-02 ppm1 1.232 ppm2 1.970 CV 1 ASSI { 5513} ( segid "KH " and resid 116 and name HB% ) ( segid "KH " and resid 152 and name HG1%) 2.600 0.800 0.800 peak 5513 spectrum 1 weight 0.10000E+01 volume 0.77035E-02 ppm1 1.232 ppm2 0.706 CV 1 ASSI { 5515} (( segid "KH " and resid 119 and name HA )) (( segid "KH " and resid 173 and name HB )) 3.200 1.200 1.200 peak 5515 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 3.374 ppm2 1.963 CV 1 ASSI { 5528} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 157 and name HB )) 2.200 0.600 0.600 peak 5528 spectrum 1 weight 0.10000E+01 volume 0.10244E-01 ppm1 0.833 ppm2 1.875 CV 1 ASSI { 5530} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 156 and name HB )) 2.200 0.600 0.600 peak 5530 spectrum 1 weight 0.10000E+01 volume 0.78340E-02 ppm1 0.846 ppm2 1.696 CV 1 ASSI { 5537} (( segid "KH " and resid 157 and name HG13)) (( segid "KH " and resid 157 and name HB )) 3.000 1.200 1.200 peak 5537 spectrum 1 weight 0.10000E+01 volume 0.12482E-02 ppm1 1.120 ppm2 1.876 CV 1 ASSI { 5551} ( segid "KH " and resid 136 and name HB% ) (( segid "KH " and resid 162 and name HA )) 3.100 1.200 1.200 peak 5551 spectrum 1 weight 0.10000E+01 volume 0.29012E-02 ppm1 0.987 ppm2 4.153 CV 1 ASSI { 5562} ( segid "KH " and resid 103 and name HG1%) (( segid "KH " and resid 96 and name HB2 )) 2.500 0.800 0.800 peak 5562 spectrum 1 weight 0.10000E+01 volume 0.51376E-02 ppm1 0.939 ppm2 2.872 CV 1 OR { 5562} ( segid "KH " and resid 103 and name HG1%) (( segid "KH " and resid 96 and name HB3 )) ASSI { 5576} (( segid "KH " and resid 104 and name HE3 )) (( segid "KH " and resid 104 and name HB3 )) 3.100 1.200 1.200 peak 5576 spectrum 1 weight 0.10000E+01 volume 0.48414E-02 ppm1 2.952 ppm2 1.537 CV 1 OR { 5576} (( segid "KH " and resid 104 and name HE2 )) (( segid "KH " and resid 104 and name HB3 )) ASSI { 5579} ( segid "KH " and resid 105 and name HD1%) (( segid "KH " and resid 105 and name HB2 )) 2.500 0.800 0.800 peak 5579 spectrum 1 weight 0.10000E+01 volume 0.10118E-01 ppm1 0.982 ppm2 1.581 CV 1 ASSI { 5591} ( segid "KH " and resid 109 and name HG2%) ( segid "KH " and resid 107 and name HG2%) 2.400 0.700 0.700 peak 5591 spectrum 1 weight 0.10000E+01 volume 0.60542E-02 ppm1 0.915 ppm2 1.131 CV 1 ASSI { 5593} ( segid "KH " and resid 109 and name HG2%) (( segid "KH " and resid 109 and name HA )) 2.600 0.800 0.800 peak 5593 spectrum 1 weight 0.10000E+01 volume 0.44455E-02 ppm1 0.911 ppm2 4.783 CV 1 ASSI { 5594} ( segid "KH " and resid 109 and name HG2%) (( segid "KH " and resid 25 and name HA )) 3.000 1.100 1.100 peak 5594 spectrum 1 weight 0.10000E+01 volume 0.19981E-02 ppm1 0.911 ppm2 4.475 CV 1 ASSI { 5603} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 112 and name HG2 )) 3.200 3.200 2.800 peak 5603 spectrum 1 weight 0.10000E+01 volume 0.40289E-02 ppm1 4.207 ppm2 2.085 CV 1 OR { 5603} (( segid "KH " and resid 114 and name HA )) (( segid "KH " and resid 112 and name HG3 )) ASSI { 5605} (( segid "KH " and resid 110 and name HA )) ( segid "KH " and resid 152 and name HG2%) 3.800 1.800 1.800 peak 5605 spectrum 1 weight 0.10000E+01 volume 0.86865E-03 ppm1 5.390 ppm2 0.642 CV 1 ASSI { 5633} (( segid "KH " and resid 117 and name HA2 )) ( segid "KH " and resid 120 and name HG2%) 3.700 1.700 1.700 peak 5633 spectrum 1 weight 0.10000E+01 volume 0.16322E-02 ppm1 3.759 ppm2 0.760 CV 1 ASSI { 5664} (( segid "KH " and resid 50 and name HG3 )) (( segid "KH " and resid 50 and name HG2 )) 1.700 0.300 0.500 peak 5664 spectrum 1 weight 0.10000E+01 volume 0.21286E-01 ppm1 1.663 ppm2 1.757 CV 1 ASSI { 5670} ( segid "KH " and resid 133 and name HD1%) (( segid "KH " and resid 133 and name HB2 )) 2.400 0.700 0.700 peak 5670 spectrum 1 weight 0.10000E+01 volume 0.65669E-02 ppm1 0.916 ppm2 1.812 CV 1 ASSI { 5675} ( segid "KH " and resid 107 and name HG2%) (( segid "KH " and resid 25 and name HA )) 3.100 1.200 1.200 peak 5675 spectrum 1 weight 0.10000E+01 volume 0.26575E-02 ppm1 1.134 ppm2 4.480 CV 1 ASSI { 5692} ( segid "KH " and resid 166 and name HB% ) (( segid "KH " and resid 163 and name HA )) 2.700 0.900 0.900 peak 5692 spectrum 1 weight 0.10000E+01 volume 0.31159E-02 ppm1 1.317 ppm2 3.895 CV 1 ASSI { 5697} ( segid "KH " and resid 27 and name HG1%) ( segid "KH " and resid 71 and name HG1%) 2.400 2.400 3.600 peak 5697 spectrum 1 weight 0.10000E+01 volume 0.13333E-01 ppm1 0.940 ppm2 0.744 CV 1 ASSI { 5738} (( segid "KH " and resid 37 and name HG12)) ( segid "KH " and resid 37 and name HG2%) 3.000 1.100 1.100 peak 5738 spectrum 1 weight 0.10000E+01 volume 0.57562E-02 ppm1 1.526 ppm2 0.753 CV 1 ASSI { 5750} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 46 and name HB3 )) 3.800 1.800 1.800 peak 5750 spectrum 1 weight 0.10000E+01 volume 0.21639E-02 ppm1 1.074 ppm2 1.910 CV 1 OR { 5750} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 46 and name HB2 )) ASSI { 5751} ( segid "KH " and resid 45 and name HG2%) (( segid "KH " and resid 45 and name HG13)) 2.300 0.600 0.600 peak 5751 spectrum 1 weight 0.10000E+01 volume 0.78063E-02 ppm1 1.076 ppm2 1.262 CV 1 ASSI { 5766} (( segid "KH " and resid 48 and name HB3 )) ( segid "KH " and resid 58 and name HG2%) 3.500 3.500 2.500 peak 5766 spectrum 1 weight 0.10000E+01 volume 0.25425E-02 ppm1 1.541 ppm2 0.833 CV 1 ASSI { 5767} (( segid "KH " and resid 48 and name HB2 )) ( segid "KH " and resid 58 and name HG2%) 3.400 1.500 1.500 peak 5767 spectrum 1 weight 0.10000E+01 volume 0.25815E-02 ppm1 1.634 ppm2 0.830 CV 1 ASSI { 5770} ( segid "KH " and resid 48 and name HD1%) (( segid "KH " and resid 86 and name HG2 )) 2.500 0.800 0.800 peak 5770 spectrum 1 weight 0.10000E+01 volume 0.65949E-02 ppm1 0.963 ppm2 1.782 CV 1 ASSI { 5781} ( segid "KH " and resid 54 and name HB% ) ( segid "KH " and resid 73 and name HG2%) 2.300 0.700 0.700 peak 5781 spectrum 1 weight 0.10000E+01 volume 0.82984E-02 ppm1 1.067 ppm2 0.695 CV 1 ASSI { 5791} ( segid "KH " and resid 173 and name HG2%) (( segid "KH " and resid 173 and name HG13)) 3.000 1.100 1.100 peak 5791 spectrum 1 weight 0.10000E+01 volume 0.63251E-02 ppm1 0.701 ppm2 1.027 CV 1 ASSI { 5794} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 178 and name HD3 )) 2.300 0.700 0.700 peak 5794 spectrum 1 weight 0.10000E+01 volume 0.74892E-02 ppm1 0.714 ppm2 1.704 CV 1 OR { 5794} ( segid "KH " and resid 174 and name HD2%) (( segid "KH " and resid 178 and name HD2 )) ASSI { 5795} ( segid "KH " and resid 174 and name HD2%) ( segid "KH " and resid 177 and name HG1%) 2.700 0.900 0.900 peak 5795 spectrum 1 weight 0.10000E+01 volume 0.90671E-02 ppm1 0.715 ppm2 0.967 CV 1 ASSI { 5805} (( segid "KH " and resid 181 and name HB2 )) (( segid "KH " and resid 181 and name HB3 )) 1.800 0.400 0.400 peak 5805 spectrum 1 weight 0.10000E+01 volume 0.13306E-01 ppm1 3.194 ppm2 3.119 CV 1 ASSI { 5810} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HB3 )) 2.500 0.800 0.800 peak 5810 spectrum 1 weight 0.10000E+01 volume 0.63803E-02 ppm1 1.236 ppm2 1.642 CV 1 OR { 5810} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HD2 )) OR { 5810} (( segid "KH " and resid 57 and name HG3 )) (( segid "KH " and resid 57 and name HD3 )) ASSI { 5812} (( segid "KH " and resid 57 and name HD3 )) (( segid "KH " and resid 57 and name HG2 )) 2.200 0.600 0.600 peak 5812 spectrum 1 weight 0.10000E+01 volume 0.10235E-01 ppm1 1.615 ppm2 1.322 CV 1 OR { 5812} (( segid "KH " and resid 57 and name HD2 )) (( segid "KH " and resid 57 and name HG2 )) ASSI { 5825} (( segid "KH " and resid 64 and name HB2 )) (( segid "KH " and resid 64 and name HD2 )) 2.600 0.900 0.900 peak 5825 spectrum 1 weight 0.10000E+01 volume 0.33297E-02 ppm1 2.396 ppm2 3.814 CV 1 ASSI { 5828} ( segid "KH " and resid 72 and name HG1%) (( segid "KH " and resid 72 and name HB )) 2.000 0.500 0.500 peak 5828 spectrum 1 weight 0.10000E+01 volume 0.16811E-01 ppm1 0.866 ppm2 1.976 CV 1 ASSI { 5847} (( segid "KH " and resid 90 and name HE3 )) ( segid "KH " and resid 36 and name HB% ) 2.800 1.000 1.000 peak 5847 spectrum 1 weight 0.10000E+01 volume 0.27862E-02 ppm1 2.523 ppm2 1.420 CV 1 OR { 5847} (( segid "KH " and resid 90 and name HE2 )) ( segid "KH " and resid 36 and name HB% ) ASSI { 5848} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 94 and name HG2 )) 3.100 1.200 1.200 peak 5848 spectrum 1 weight 0.10000E+01 volume 0.22427E-02 ppm1 2.522 ppm2 2.203 CV 1 OR { 5848} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 94 and name HG2 )) OR { 5848} (( segid "KH " and resid 90 and name HE2 )) (( segid "KH " and resid 94 and name HG3 )) OR { 5848} (( segid "KH " and resid 90 and name HE3 )) (( segid "KH " and resid 94 and name HG3 )) ASSI { 5859} (( segid "KH " and resid 92 and name HD2 )) (( segid "KH " and resid 92 and name HD3 )) 1.600 0.300 0.600 peak 5859 spectrum 1 weight 0.10000E+01 volume 0.24927E-01 ppm1 1.874 ppm2 1.784 CV 1 ASSI { 5863} (( segid "KH " and resid 92 and name HE2 )) (( segid "KH " and resid 92 and name HD2 )) 2.000 0.500 0.500 peak 5863 spectrum 1 weight 0.10000E+01 volume 0.16385E-01 ppm1 3.069 ppm2 1.865 CV 1 OR { 5863} (( segid "KH " and resid 92 and name HE3 )) (( segid "KH " and resid 92 and name HD2 )) ASSI { 5864} (( segid "KH " and resid 92 and name HE2 )) (( segid "KH " and resid 92 and name HB2 )) 3.100 1.200 1.200 peak 5864 spectrum 1 weight 0.10000E+01 volume 0.39772E-02 ppm1 3.071 ppm2 2.190 CV 1 OR { 5864} (( segid "KH " and resid 92 and name HE3 )) (( segid "KH " and resid 92 and name HB2 )) ASSI { 5868} (( segid "KH " and resid 93 and name HB2 )) (( segid "KH " and resid 93 and name HB3 )) 1.800 0.400 0.400 peak 5868 spectrum 1 weight 0.10000E+01 volume 0.15779E-01 ppm1 2.238 ppm2 2.162 CV 1 ASSI { 5873} (( segid "KH " and resid 93 and name HG3 )) (( segid "KH " and resid 90 and name HA )) 3.000 1.100 1.100 peak 5873 spectrum 1 weight 0.10000E+01 volume 0.35859E-02 ppm1 2.387 ppm2 4.213 CV 1 ASSI { 5884} (( segid "KH " and resid 104 and name HD2 )) (( segid "KH " and resid 104 and name HE2 )) 2.000 0.500 0.500 peak 5884 spectrum 1 weight 0.10000E+01 volume 0.19420E-01 ppm1 1.692 ppm2 2.964 CV 1 OR { 5884} (( segid "KH " and resid 104 and name HD3 )) (( segid "KH " and resid 104 and name HE3 )) OR { 5884} (( segid "KH " and resid 104 and name HD3 )) (( segid "KH " and resid 104 and name HE2 )) OR { 5884} (( segid "KH " and resid 104 and name HD2 )) (( segid "KH " and resid 104 and name HE3 )) ASSI { 5890} (( segid "KH " and resid 139 and name HB )) ( segid "KH " and resid 157 and name HD1%) 3.600 1.600 1.600 peak 5890 spectrum 1 weight 0.10000E+01 volume 0.84066E-03 ppm1 1.875 ppm2 0.870 CV 1 ASSI { 5895} ( segid "KH " and resid 139 and name HG1%) (( segid "KH " and resid 139 and name HB )) 2.000 0.500 0.500 peak 5895 spectrum 1 weight 0.10000E+01 volume 0.17074E-01 ppm1 0.989 ppm2 1.881 CV 1 OR { 5895} ( segid "KH " and resid 139 and name HG2%) (( segid "KH " and resid 139 and name HB )) ASSI { 5905} (( segid "KH " and resid 176 and name HG3 )) ( segid "KH " and resid 175 and name HB% ) 3.200 1.300 1.300 peak 5905 spectrum 1 weight 0.10000E+01 volume 0.17255E-02 ppm1 2.432 ppm2 1.539 CV 1 ASSI { 5915} (( segid "KH " and resid 22 and name HA )) (( segid "KH " and resid 22 and name HB3 )) 2.800 1.000 1.000 peak 5915 spectrum 1 weight 0.10000E+01 volume 0.26476E-02 ppm1 4.010 ppm2 1.867 CV 1 OR { 5915} (( segid "KH " and resid 22 and name HA )) (( segid "KH " and resid 22 and name HB2 )) ASSI { 5937} (( segid "KH " and resid 46 and name HG3 )) (( segid "KH " and resid 46 and name HA )) 2.700 0.900 0.900 peak 5937 spectrum 1 weight 0.10000E+01 volume 0.54863E-02 ppm1 1.488 ppm2 4.154 CV 1 ASSI { 5942} (( segid "KH " and resid 112 and name HA )) (( segid "KH " and resid 150 and name HB2 )) 3.100 3.100 2.900 peak 5942 spectrum 1 weight 0.10000E+01 volume 0.21603E-02 ppm1 4.496 ppm2 2.483 CV 1 ASSI { 5943} (( segid "KH " and resid 112 and name HA )) (( segid "KH " and resid 112 and name HG2 )) 3.400 1.500 1.500 peak 5943 spectrum 1 weight 0.10000E+01 volume 0.19674E-02 ppm1 4.495 ppm2 2.027 CV 1 OR { 5943} (( segid "KH " and resid 112 and name HA )) (( segid "KH " and resid 112 and name HG3 )) ASSI { 5944} (( segid "KH " and resid 112 and name HA )) (( segid "KH " and resid 112 and name HB3 )) 2.600 0.900 0.900 peak 5944 spectrum 1 weight 0.10000E+01 volume 0.22925E-02 ppm1 4.491 ppm2 1.803 CV 1 ASSI { 5946} ( segid "KH " and resid 68 and name HG2%) ( segid "KH " and resid 28 and name HE% ) 3.200 1.300 1.300 peak 5946 spectrum 1 weight 0.10000E+01 volume 0.20815E-02 ppm1 0.860 ppm2 6.393 CV 1 ASSI { 5951} (( segid "KH " and resid 107 and name HA )) (( segid "KH " and resid 107 and name HB )) 3.300 1.300 1.300 peak 5951 spectrum 1 weight 0.10000E+01 volume 0.11395E-02 ppm1 5.555 ppm2 3.952 CV 1 ASSI { 5952} (( segid "KH " and resid 107 and name HB )) (( segid "KH " and resid 156 and name HB )) 2.900 1.000 1.000 peak 5952 spectrum 1 weight 0.10000E+01 volume 0.18813E-02 ppm1 3.973 ppm2 1.697 CV 1 ASSI { 5958} (( segid "KH " and resid 102 and name HG3 )) (( segid "KH " and resid 102 and name HA )) 2.800 1.000 1.000 peak 5958 spectrum 1 weight 0.10000E+01 volume 0.48079E-02 ppm1 2.233 ppm2 4.336 CV 1 OR { 5958} (( segid "KH " and resid 102 and name HG2 )) (( segid "KH " and resid 102 and name HA )) ASSI { 5959} (( segid "KH " and resid 104 and name HB2 )) (( segid "KH " and resid 104 and name HA )) 3.000 1.200 1.200 peak 5959 spectrum 1 weight 0.10000E+01 volume 0.11675E-02 ppm1 1.653 ppm2 4.651 CV 1 ASSI { 5960} (( segid "KH " and resid 104 and name HB3 )) (( segid "KH " and resid 104 and name HA )) 3.600 1.600 1.600 peak 5960 spectrum 1 weight 0.10000E+01 volume 0.83370E-03 ppm1 1.531 ppm2 4.651 CV 1 ASSI { 5965} (( segid "KH " and resid 88 and name HB2 )) ( segid "KH " and resid 103 and name HG2%) 4.400 2.400 1.600 peak 5965 spectrum 1 weight 0.10000E+01 volume 0.66439E-03 ppm1 2.923 ppm2 0.651 CV 1 ASSI { 5966} (( segid "KH " and resid 88 and name HB3 )) ( segid "KH " and resid 103 and name HG2%) 3.600 1.700 1.700 peak 5966 spectrum 1 weight 0.10000E+01 volume 0.11856E-02 ppm1 2.723 ppm2 0.640 CV 1 ASSI { 5970} ( segid "KH " and resid 27 and name HG1%) (( segid "KH " and resid 107 and name HA )) 3.100 1.200 1.200 peak 5970 spectrum 1 weight 0.10000E+01 volume 0.22065E-02 ppm1 0.938 ppm2 5.563 CV 1 ASSI { 5972} (( segid "KH " and resid 27 and name HA )) (( segid "KH " and resid 107 and name HA )) 2.800 1.000 1.000 peak 5972 spectrum 1 weight 0.10000E+01 volume 0.19565E-02 ppm1 4.753 ppm2 5.556 CV 1 ASSI { 5973} (( segid "KH " and resid 27 and name HA )) (( segid "KH " and resid 27 and name HB )) 3.100 1.200 1.200 peak 5973 spectrum 1 weight 0.10000E+01 volume 0.12336E-02 ppm1 4.753 ppm2 1.729 CV 1 ASSI { 5974} (( segid "KH " and resid 27 and name HA )) ( segid "KH " and resid 27 and name HG1%) 2.700 0.900 0.900 peak 5974 spectrum 1 weight 0.10000E+01 volume 0.35724E-02 ppm1 4.753 ppm2 0.938 CV 1 ASSI { 5975} (( segid "KH " and resid 27 and name HA )) ( segid "KH " and resid 27 and name HG2%) 2.800 1.000 1.000 peak 5975 spectrum 1 weight 0.10000E+01 volume 0.26612E-02 ppm1 4.753 ppm2 0.763 CV 1 ASSI { 5978} (( segid "KH " and resid 106 and name HA )) ( segid "KH " and resid 157 and name HD1%) 3.100 1.200 1.200 peak 5978 spectrum 1 weight 0.10000E+01 volume 0.11893E-02 ppm1 5.002 ppm2 0.836 CV 1 OR { 5978} (( segid "KH " and resid 106 and name HA )) ( segid "KH " and resid 157 and name HG2%) ASSI { 5985} (( segid "KH " and resid 109 and name HA )) (( segid "KH " and resid 109 and name HB )) 2.600 0.800 0.800 peak 5985 spectrum 1 weight 0.10000E+01 volume 0.35678E-02 ppm1 4.813 ppm2 1.972 CV 1 ASSI { 5987} (( segid "KH " and resid 109 and name HA )) ( segid "KH " and resid 109 and name HD1%) 3.500 1.500 1.500 peak 5987 spectrum 1 weight 0.10000E+01 volume 0.24075E-02 ppm1 4.813 ppm2 0.720 CV 1 ASSI { 5991} ( segid "KH " and resid 111 and name HG1%) (( segid "KH " and resid 111 and name HB )) 2.000 0.500 0.500 peak 5991 spectrum 1 weight 0.10000E+01 volume 0.18550E-01 ppm1 0.714 ppm2 2.014 CV 1 ASSI { 5994} ( segid "KH " and resid 111 and name HG2%) (( segid "KH " and resid 112 and name HD2 )) 3.400 1.500 1.500 peak 5994 spectrum 1 weight 0.10000E+01 volume 0.13632E-02 ppm1 0.492 ppm2 3.957 CV 1 ASSI { 6010} ( segid "KH " and resid 24 and name HG2%) (( segid "KH " and resid 26 and name HD2 )) 2.900 1.100 1.100 peak 6010 spectrum 1 weight 0.10000E+01 volume 0.28622E-02 ppm1 1.066 ppm2 6.753 CV 1 ASSI { 6018} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 141 and name HD2 )) 3.300 1.400 1.400 peak 6018 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 0.525 ppm2 3.797 CV 1 OR { 6018} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 141 and name HD3 )) ASSI { 6019} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 108 and name HA )) 3.500 1.500 1.500 peak 6019 spectrum 1 weight 0.10000E+01 volume 0.11494E-02 ppm1 0.526 ppm2 6.208 CV 1 ASSI { 6020} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 155 and name HA )) 3.400 1.500 1.500 peak 6020 spectrum 1 weight 0.10000E+01 volume 0.11494E-02 ppm1 0.526 ppm2 5.176 CV 1 ASSI { 6021} ( segid "KH " and resid 153 and name HG2%) (( segid "KH " and resid 108 and name HD2 )) 3.600 1.600 1.600 peak 6021 spectrum 1 weight 0.10000E+01 volume 0.10806E-02 ppm1 0.526 ppm2 6.971 CV 1 ASSI { 6023} (( segid "KH " and resid 153 and name HA )) (( segid "KH " and resid 153 and name HB )) 3.100 1.200 1.200 peak 6023 spectrum 1 weight 0.10000E+01 volume 0.15932E-02 ppm1 4.729 ppm2 1.660 CV 1 ASSI { 6029} ( segid "KH " and resid 71 and name HG2%) (( segid "KH " and resid 70 and name HA )) 3.700 1.700 1.700 peak 6029 spectrum 1 weight 0.10000E+01 volume 0.21078E-02 ppm1 0.685 ppm2 3.991 CV 1 ASSI { 6033} ( segid "KH " and resid 139 and name HG1%) (( segid "KH " and resid 154 and name HA )) 3.100 3.100 2.900 peak 6033 spectrum 1 weight 0.10000E+01 volume 0.29293E-02 ppm1 0.990 ppm2 4.168 CV 1 ASSI { 6035} (( segid "KH " and resid 74 and name HA )) (( segid "KH " and resid 74 and name HB )) 3.000 1.200 1.200 peak 6035 spectrum 1 weight 0.10000E+01 volume 0.17608E-02 ppm1 5.656 ppm2 3.856 CV 1 ASSI { 6037} (( segid "KH " and resid 74 and name HB )) (( segid "KH " and resid 24 and name HA )) 4.000 2.000 2.000 peak 6037 spectrum 1 weight 0.10000E+01 volume 0.10353E-02 ppm1 3.882 ppm2 5.311 CV 1 ASSI { 6038} (( segid "KH " and resid 74 and name HB )) (( segid "KH " and resid 55 and name HA )) 2.900 2.900 3.100 peak 6038 spectrum 1 weight 0.10000E+01 volume 0.10588E-02 ppm1 3.882 ppm2 4.757 CV 1 ASSI { 6039} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 64 and name HB3 )) 4.200 2.200 1.800 peak 6039 spectrum 1 weight 0.10000E+01 volume 0.17654E-02 ppm1 4.428 ppm2 1.958 CV 1 ASSI { 6040} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 64 and name HG2 )) 4.200 2.200 1.800 peak 6040 spectrum 1 weight 0.10000E+01 volume 0.15742E-02 ppm1 4.428 ppm2 2.096 CV 1 ASSI { 6041} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 62 and name HG2 )) 2.800 2.800 3.200 peak 6041 spectrum 1 weight 0.10000E+01 volume 0.13207E-02 ppm1 4.428 ppm2 2.354 CV 1 OR { 6041} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 62 and name HG3 )) ASSI { 6042} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 64 and name HD2 )) 2.200 0.600 0.600 peak 6042 spectrum 1 weight 0.10000E+01 volume 0.58124E-02 ppm1 4.428 ppm2 3.815 CV 1 ASSI { 6043} (( segid "KH " and resid 63 and name HB )) (( segid "KH " and resid 63 and name HA )) 2.400 0.700 0.700 peak 6043 spectrum 1 weight 0.10000E+01 volume 0.51049E-02 ppm1 4.428 ppm2 4.808 CV 1 ASSI { 6045} ( segid "KH " and resid 111 and name HG2%) ( segid "KH " and resid 116 and name HB% ) 3.100 1.200 1.200 peak 6045 spectrum 1 weight 0.10000E+01 volume 0.23152E-02 ppm1 0.490 ppm2 1.220 CV 1 ASSI { 6046} ( segid "KH " and resid 111 and name HG2%) (( segid "KH " and resid 119 and name HA )) 3.300 3.300 2.700 peak 6046 spectrum 1 weight 0.10000E+01 volume 0.21902E-02 ppm1 0.497 ppm2 3.389 CV 1 ASSI { 6051} ( segid "KH " and resid 126 and name HG2%) (( segid "KH " and resid 126 and name HB )) 2.400 0.700 0.700 peak 6051 spectrum 1 weight 0.10000E+01 volume 0.70417E-02 ppm1 1.146 ppm2 4.145 CV 1 ASSI { 6052} ( segid "KH " and resid 126 and name HG2%) (( segid "KH " and resid 126 and name HA )) 3.000 1.100 1.100 peak 6052 spectrum 1 weight 0.10000E+01 volume 0.43007E-02 ppm1 1.146 ppm2 4.326 CV 1 ASSI { 6055} (( segid "KH " and resid 131 and name HB3 )) (( segid "KH " and resid 128 and name HA )) 3.200 1.300 1.300 peak 6055 spectrum 1 weight 0.10000E+01 volume 0.12527E-02 ppm1 2.123 ppm2 4.478 CV 1 OR { 6055} (( segid "KH " and resid 131 and name HB2 )) (( segid "KH " and resid 128 and name HA )) ASSI { 6060} (( segid "KH " and resid 139 and name HB )) (( segid "KH " and resid 155 and name HG3 )) 3.300 1.300 1.300 peak 6060 spectrum 1 weight 0.10000E+01 volume 0.19936E-02 ppm1 1.875 ppm2 0.715 CV 1 ASSI { 6074} (( segid "KH " and resid 54 and name HA )) (( segid "KH " and resid 55 and name HB3 )) 4.400 2.400 1.600 peak 6074 spectrum 1 weight 0.10000E+01 volume 0.77083E-03 ppm1 4.947 ppm2 3.814 CV 1 OR { 6074} (( segid "KH " and resid 54 and name HA )) (( segid "KH " and resid 55 and name HB2 )) ASSI { 6083} (( segid "KH " and resid 118 and name HD2 )) ( segid "KH " and resid 177 and name HG1%) 3.500 1.500 1.500 peak 6083 spectrum 1 weight 0.10000E+01 volume 0.21177E-02 ppm1 3.158 ppm2 0.979 CV 1 ASSI { 6084} (( segid "KH " and resid 118 and name HD2 )) ( segid "KH " and resid 173 and name HD1%) 3.400 3.400 2.600 peak 6084 spectrum 1 weight 0.10000E+01 volume 0.21476E-02 ppm1 3.158 ppm2 0.729 CV 1 ASSI { 6093} (( segid "KH " and resid 177 and name HA )) (( segid "KH " and resid 179 and name HB3 )) 3.400 1.400 1.400 peak 6093 spectrum 1 weight 0.10000E+01 volume 0.17445E-02 ppm1 3.865 ppm2 2.031 CV 1 OR { 6093} (( segid "KH " and resid 177 and name HA )) (( segid "KH " and resid 179 and name HB2 )) ASSI { 6098} (( segid "KH " and resid 178 and name HG3 )) (( segid "KH " and resid 178 and name HG2 )) 1.600 0.300 0.600 peak 6098 spectrum 1 weight 0.10000E+01 volume 0.16232E-01 ppm1 1.432 ppm2 1.510 CV 1 ASSI { 6101} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HB2 )) 2.600 0.800 0.800 peak 6101 spectrum 1 weight 0.10000E+01 volume 0.42218E-02 ppm1 2.967 ppm2 1.858 CV 1 OR { 6101} (( segid "KH " and resid 178 and name HE2 )) (( segid "KH " and resid 178 and name HB3 )) OR { 6101} (( segid "KH " and resid 178 and name HE3 )) (( segid "KH " and resid 178 and name HB3 )) ASSI { 6103} (( segid "KH " and resid 57 and name HD3 )) ( segid "KH " and resid 72 and name HG2%) 2.900 1.000 1.000 peak 6103 spectrum 1 weight 0.10000E+01 volume 0.36883E-02 ppm1 1.615 ppm2 0.670 CV 1 OR { 6103} (( segid "KH " and resid 57 and name HD2 )) ( segid "KH " and resid 72 and name HG2%) ASSI { 6105} (( segid "KH " and resid 87 and name HB )) (( segid "KH " and resid 87 and name HG13)) 2.900 1.000 1.000 peak 6105 spectrum 1 weight 0.10000E+01 volume 0.16023E-02 ppm1 2.037 ppm2 0.980 CV 1 ASSI { 6111} (( segid "KH " and resid 97 and name HB3 )) (( segid "KH " and resid 97 and name HA )) 2.300 0.700 0.700 peak 6111 spectrum 1 weight 0.10000E+01 volume 0.70883E-02 ppm1 2.767 ppm2 4.606 CV 1 ASSI { 6112} (( segid "KH " and resid 97 and name HB2 )) (( segid "KH " and resid 97 and name HA )) 3.200 1.200 1.200 peak 6112 spectrum 1 weight 0.10000E+01 volume 0.18234E-02 ppm1 3.260 ppm2 4.611 CV 1 ASSI { 6119} (( segid "KH " and resid 91 and name HA )) ( segid "KH " and resid 91 and name HD1%) 3.000 1.100 1.100 peak 6119 spectrum 1 weight 0.10000E+01 volume 0.25389E-02 ppm1 4.161 ppm2 0.796 CV 1 ASSI { 6123} (( segid "KH " and resid 92 and name HA )) ( segid "KH " and resid 103 and name HG1%) 2.900 1.100 1.100 peak 6123 spectrum 1 weight 0.10000E+01 volume 0.23052E-02 ppm1 4.335 ppm2 0.946 CV 1 ASSI { 6124} (( segid "KH " and resid 94 and name HB3 )) (( segid "KH " and resid 96 and name HZ )) 3.800 1.800 1.800 peak 6124 spectrum 1 weight 0.10000E+01 volume 0.11920E-02 ppm1 1.807 ppm2 7.198 CV 1 ASSI { 6125} (( segid "KH " and resid 94 and name HB2 )) ( segid "KH " and resid 96 and name HD% ) 3.700 1.800 1.800 peak 6125 spectrum 1 weight 0.10000E+01 volume 0.11639E-02 ppm1 2.375 ppm2 7.119 CV 1 ASSI { 6127} ( segid "KH " and resid 33 and name HB% ) ( segid "KH " and resid 96 and name HE% ) 3.400 1.400 1.400 peak 6127 spectrum 1 weight 0.10000E+01 volume 0.13586E-02 ppm1 0.585 ppm2 7.256 CV 1 ASSI { 6128} (( segid "KH " and resid 33 and name HA )) ( segid "KH " and resid 96 and name HD% ) 3.500 1.500 1.500 peak 6128 spectrum 1 weight 0.10000E+01 volume 0.87325E-03 ppm1 4.100 ppm2 7.145 CV 1 ASSI { 6129} (( segid "KH " and resid 33 and name HA )) ( segid "KH " and resid 96 and name HE% ) 3.200 1.300 1.300 peak 6129 spectrum 1 weight 0.10000E+01 volume 0.12980E-02 ppm1 4.100 ppm2 7.253 CV 1 ASSI { 6131} ( segid "KH " and resid 37 and name HG2%) (( segid "KH " and resid 38 and name HA )) 3.000 1.100 1.100 peak 6131 spectrum 1 weight 0.10000E+01 volume 0.27337E-02 ppm1 0.760 ppm2 3.998 CV 1 ASSI { 6136} (( segid "KH " and resid 155 and name HA )) (( segid "KH " and resid 108 and name HA )) 3.000 1.100 1.100 peak 6136 spectrum 1 weight 0.10000E+01 volume 0.12364E-02 ppm1 5.182 ppm2 6.198 CV 1 ASSI { 6138} ( segid "KH " and resid 153 and name HD1%) (( segid "KH " and resid 108 and name HA )) 3.800 1.800 1.800 peak 6138 spectrum 1 weight 0.10000E+01 volume 0.12138E-02 ppm1 0.699 ppm2 6.203 CV 1 ASSI { 6140} (( segid "KH " and resid 153 and name HA )) (( segid "KH " and resid 110 and name HA )) 3.300 1.400 1.400 peak 6140 spectrum 1 weight 0.10000E+01 volume 0.81619E-03 ppm1 4.728 ppm2 5.410 CV 1 ASSI { 6147} ( segid "KH " and resid 140 and name HG1%) (( segid "KH " and resid 119 and name HA )) 2.500 2.500 3.500 peak 6147 spectrum 1 weight 0.10000E+01 volume 0.23550E-02 ppm1 0.796 ppm2 3.363 CV 1 ASSI { 6157} (( segid "KH " and resid 171 and name HD3 )) ( segid "KH " and resid 174 and name HD1%) 3.200 1.300 1.300 peak 6157 spectrum 1 weight 0.10000E+01 volume 0.16675E-02 ppm1 3.195 ppm2 0.852 CV 1 OR { 6157} (( segid "KH " and resid 171 and name HD2 )) ( segid "KH " and resid 174 and name HD1%) ASSI { 6159} (( segid "KH " and resid 28 and name HA )) (( segid "KH " and resid 68 and name HB )) 3.200 1.300 1.300 peak 6159 spectrum 1 weight 0.10000E+01 volume 0.14972E-02 ppm1 4.983 ppm2 2.093 CV 1 ASSI { 6161} (( segid "KH " and resid 28 and name HA )) ( segid "KH " and resid 68 and name HG2%) 3.200 1.300 1.300 peak 6161 spectrum 1 weight 0.10000E+01 volume 0.23976E-02 ppm1 4.983 ppm2 0.875 CV 1 OR { 6161} (( segid "KH " and resid 28 and name HA )) ( segid "KH " and resid 68 and name HG1%) ASSI { 6166} (( segid "KH " and resid 29 and name HA )) ( segid "KH " and resid 105 and name HD1%) 3.300 1.400 1.400 peak 6166 spectrum 1 weight 0.10000E+01 volume 0.16114E-02 ppm1 4.959 ppm2 0.980 CV 1 ASSI { 6168} ( segid "KH " and resid 29 and name HG2%) (( segid "KH " and resid 30 and name HD2 )) 3.300 1.300 1.300 peak 6168 spectrum 1 weight 0.10000E+01 volume 0.25688E-02 ppm1 0.700 ppm2 3.806 CV 1 ASSI { 6171} (( segid "KH " and resid 32 and name HG3 )) ( segid "KH " and resid 96 and name HD% ) 3.300 3.300 2.700 peak 6171 spectrum 1 weight 0.10000E+01 volume 0.15552E-02 ppm1 2.430 ppm2 7.154 CV 1 ASSI { 6179} (( segid "KH " and resid 44 and name HB3 )) (( segid "KH " and resid 44 and name HA )) 3.600 1.600 1.600 peak 6179 spectrum 1 weight 0.10000E+01 volume 0.10707E-02 ppm1 2.950 ppm2 4.520 CV 1 ASSI { 6181} (( segid "KH " and resid 59 and name HA )) (( segid "KH " and resid 60 and name HD2 )) 2.500 0.800 0.800 peak 6181 spectrum 1 weight 0.10000E+01 volume 0.48079E-02 ppm1 4.555 ppm2 3.800 CV 1 ASSI { 6182} (( segid "KH " and resid 59 and name HA )) (( segid "KH " and resid 60 and name HD3 )) 2.200 0.600 0.600 peak 6182 spectrum 1 weight 0.10000E+01 volume 0.78800E-02 ppm1 4.555 ppm2 3.630 CV 1 ASSI { 6183} (( segid "KH " and resid 59 and name HA )) (( segid "KH " and resid 60 and name HG2 )) 4.200 2.200 1.800 peak 6183 spectrum 1 weight 0.10000E+01 volume 0.16467E-02 ppm1 4.555 ppm2 2.045 CV 1 OR { 6183} (( segid "KH " and resid 59 and name HA )) (( segid "KH " and resid 60 and name HG3 )) ASSI { 6186} (( segid "KH " and resid 77 and name HD3 )) (( segid "KH " and resid 78 and name HG3 )) 3.200 3.200 2.800 peak 6186 spectrum 1 weight 0.10000E+01 volume 0.41294E-02 ppm1 3.819 ppm2 2.358 CV 1 OR { 6186} (( segid "KH " and resid 77 and name HD3 )) (( segid "KH " and resid 78 and name HG2 )) ASSI { 6188} (( segid "KH " and resid 65 and name HB3 )) (( segid "KH " and resid 65 and name HA )) 2.300 0.600 0.600 peak 6188 spectrum 1 weight 0.10000E+01 volume 0.10707E-01 ppm1 2.686 ppm2 4.655 CV 1 OR { 6188} (( segid "KH " and resid 65 and name HB2 )) (( segid "KH " and resid 65 and name HA )) ASSI { 6189} ( segid "KH " and resid 68 and name HG1%) ( segid "KH " and resid 28 and name HD% ) 3.400 1.400 1.400 peak 6189 spectrum 1 weight 0.10000E+01 volume 0.24864E-02 ppm1 0.893 ppm2 6.847 CV 1 ASSI { 6190} (( segid "KH " and resid 153 and name HB )) (( segid "KH " and resid 110 and name HD2 )) 4.800 2.900 1.200 peak 6190 spectrum 1 weight 0.10000E+01 volume 0.50126E-03 ppm1 1.663 ppm2 2.988 CV 1 ASSI { 6192} (( segid "KH " and resid 155 and name HA )) (( segid "KH " and resid 155 and name HG3 )) 3.200 1.300 1.300 peak 6192 spectrum 1 weight 0.10000E+01 volume 0.14954E-02 ppm1 5.182 ppm2 0.703 CV 1 ASSI { 6194} (( segid "KH " and resid 147 and name HA )) (( segid "KH " and resid 147 and name HB2 )) 3.100 1.200 1.200 peak 6194 spectrum 1 weight 0.10000E+01 volume 0.25425E-02 ppm1 4.598 ppm2 3.340 CV 1 ASSI { 6195} (( segid "KH " and resid 147 and name HA )) (( segid "KH " and resid 147 and name HB3 )) 2.800 1.000 1.000 peak 6195 spectrum 1 weight 0.10000E+01 volume 0.23912E-02 ppm1 4.598 ppm2 2.825 CV 1 ASSI { 6196} (( segid "KH " and resid 110 and name HD3 )) ( segid "KH " and resid 153 and name HD1%) 2.900 1.000 1.000 peak 6196 spectrum 1 weight 0.10000E+01 volume 0.13487E-02 ppm1 2.909 ppm2 0.705 CV 1 ASSI { 6198} (( segid "KH " and resid 142 and name HA )) (( segid "KH " and resid 142 and name HD2 )) 2.800 1.000 1.000 peak 6198 spectrum 1 weight 0.10000E+01 volume 0.25624E-02 ppm1 4.327 ppm2 3.044 CV 1 OR { 6198} (( segid "KH " and resid 142 and name HA )) (( segid "KH " and resid 142 and name HD3 )) ASSI { 6200} (( segid "KH " and resid 142 and name HA )) (( segid "KH " and resid 141 and name HB2 )) 2.500 2.500 3.500 peak 6200 spectrum 1 weight 0.10000E+01 volume 0.72371E-02 ppm1 4.327 ppm2 2.350 CV 1 ASSI { 6201} (( segid "KH " and resid 142 and name HA )) (( segid "KH " and resid 140 and name HB )) 2.200 2.200 3.800 peak 6201 spectrum 1 weight 0.10000E+01 volume 0.11811E-01 ppm1 4.327 ppm2 1.997 CV 1 ASSI { 6204} (( segid "KH " and resid 142 and name HB3 )) (( segid "KH " and resid 142 and name HD3 )) 2.900 1.000 1.000 peak 6204 spectrum 1 weight 0.10000E+01 volume 0.28324E-02 ppm1 1.767 ppm2 3.039 CV 1 OR { 6204} (( segid "KH " and resid 142 and name HB3 )) (( segid "KH " and resid 142 and name HD2 )) OR { 6204} (( segid "KH " and resid 142 and name HB2 )) (( segid "KH " and resid 142 and name HD3 )) OR { 6204} (( segid "KH " and resid 142 and name HB2 )) (( segid "KH " and resid 142 and name HD2 )) ASSI { 6205} (( segid "KH " and resid 18 and name HA )) (( segid "KH " and resid 19 and name HD2 )) 2.100 0.500 0.500 peak 6205 spectrum 1 weight 0.10000E+01 volume 0.11757E-01 ppm1 4.749 ppm2 3.709 CV 1 ASSI { 6207} (( segid "KH " and resid 18 and name HA )) (( segid "KH " and resid 18 and name HG2 )) 3.000 1.100 1.100 peak 6207 spectrum 1 weight 0.10000E+01 volume 0.19891E-02 ppm1 4.749 ppm2 2.465 CV 1 OR { 6207} (( segid "KH " and resid 18 and name HA )) (( segid "KH " and resid 18 and name HG3 )) ASSI { 6208} (( segid "KH " and resid 18 and name HA )) (( segid "KH " and resid 18 and name HB2 )) 2.300 0.700 0.700 peak 6208 spectrum 1 weight 0.10000E+01 volume 0.59618E-02 ppm1 4.749 ppm2 1.979 CV 1 ASSI { 6216} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 104 and name HE3 )) 2.900 1.100 1.100 peak 6216 spectrum 1 weight 0.10000E+01 volume 0.29293E-02 ppm1 0.833 ppm2 2.970 CV 1 OR { 6216} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 104 and name HE2 )) ASSI { 6218} ( segid "KH " and resid 156 and name HG2%) (( segid "KH " and resid 166 and name HA )) 3.300 1.400 1.400 peak 6218 spectrum 1 weight 0.10000E+01 volume 0.30035E-02 ppm1 0.847 ppm2 3.978 CV 1 ASSI { 6222} (( segid "KH " and resid 157 and name HA )) (( segid "KH " and resid 106 and name HB2 )) 3.800 1.800 1.800 peak 6222 spectrum 1 weight 0.10000E+01 volume 0.11875E-02 ppm1 5.208 ppm2 2.037 CV 1 OR { 6222} (( segid "KH " and resid 157 and name HA )) (( segid "KH " and resid 106 and name HB3 )) ASSI { 6224} ( segid "KH " and resid 157 and name HG2%) (( segid "KH " and resid 104 and name HA )) 3.100 1.200 1.200 peak 6224 spectrum 1 weight 0.10000E+01 volume 0.17418E-02 ppm1 0.831 ppm2 4.655 CV 1 ASSI { 6228} (( segid "KH " and resid 67 and name HA )) (( segid "KH " and resid 67 and name HB2 )) 2.700 0.900 0.900 peak 6228 spectrum 1 weight 0.10000E+01 volume 0.37445E-02 ppm1 4.385 ppm2 2.141 CV 1 ASSI { 6230} (( segid "KH " and resid 67 and name HA )) ( segid "KH " and resid 68 and name HG1%) 3.400 1.400 1.400 peak 6230 spectrum 1 weight 0.10000E+01 volume 0.19402E-02 ppm1 4.385 ppm2 0.884 CV 1 OR { 6230} (( segid "KH " and resid 67 and name HA )) ( segid "KH " and resid 68 and name HG2%) ASSI { 6233} (( segid "KH " and resid 69 and name HA )) (( segid "KH " and resid 69 and name HB2 )) 3.100 1.200 1.200 peak 6233 spectrum 1 weight 0.10000E+01 volume 0.13324E-02 ppm1 4.776 ppm2 1.612 CV 1 ASSI { 6234} (( segid "KH " and resid 69 and name HA )) (( segid "KH " and resid 70 and name HG2 )) 3.600 1.600 1.600 peak 6234 spectrum 1 weight 0.10000E+01 volume 0.14674E-02 ppm1 4.776 ppm2 1.329 CV 1 ASSI { 6235} (( segid "KH " and resid 69 and name HA )) (( segid "KH " and resid 69 and name HB3 )) 3.100 1.200 1.200 peak 6235 spectrum 1 weight 0.10000E+01 volume 0.16395E-02 ppm1 4.776 ppm2 1.227 CV 1 ASSI { 6236} (( segid "KH " and resid 69 and name HA )) ( segid "KH " and resid 34 and name HG2%) 3.800 1.800 1.800 peak 6236 spectrum 1 weight 0.10000E+01 volume 0.81970E-03 ppm1 4.776 ppm2 0.922 CV 1 ASSI { 6239} (( segid "KH " and resid 72 and name HA )) (( segid "KH " and resid 72 and name HB )) 2.900 1.000 1.000 peak 6239 spectrum 1 weight 0.10000E+01 volume 0.22526E-02 ppm1 4.707 ppm2 1.980 CV 1 ASSI { 6240} (( segid "KH " and resid 72 and name HA )) ( segid "KH " and resid 72 and name HG1%) 2.900 1.100 1.100 peak 6240 spectrum 1 weight 0.10000E+01 volume 0.19492E-02 ppm1 4.707 ppm2 0.870 CV 1 ASSI { 6241} (( segid "KH " and resid 72 and name HA )) ( segid "KH " and resid 72 and name HG2%) 3.000 1.100 1.100 peak 6241 spectrum 1 weight 0.10000E+01 volume 0.19139E-02 ppm1 4.707 ppm2 0.677 CV 1 ASSI { 6249} (( segid "KH " and resid 151 and name HG3 )) (( segid "KH " and resid 112 and name HA )) 3.800 1.800 1.800 peak 6249 spectrum 1 weight 0.10000E+01 volume 0.16041E-02 ppm1 1.761 ppm2 4.516 CV 1 ASSI { 6250} (( segid "KH " and resid 151 and name HG2 )) (( segid "KH " and resid 112 and name HA )) 2.800 1.000 1.000 peak 6250 spectrum 1 weight 0.10000E+01 volume 0.17536E-02 ppm1 2.360 ppm2 4.516 CV 1 ASSI { 6251} (( segid "KH " and resid 157 and name HA )) (( segid "KH " and resid 106 and name HA )) 2.900 1.000 1.000 peak 6251 spectrum 1 weight 0.10000E+01 volume 0.18261E-02 ppm1 5.205 ppm2 5.028 CV 1 ASSI { 6260} (( segid "KH " and resid 127 and name HA )) ( segid "KH " and resid 127 and name HG2%) 2.500 0.800 0.800 peak 6260 spectrum 1 weight 0.10000E+01 volume 0.53749E-02 ppm1 3.950 ppm2 0.772 CV 1 ASSI { 6262} (( segid "KH " and resid 138 and name HB )) ( segid "KH " and resid 127 and name HG2%) 2.800 1.000 1.000 peak 6262 spectrum 1 weight 0.10000E+01 volume 0.20217E-02 ppm1 1.707 ppm2 0.761 CV 1 ASSI { 6263} (( segid "KH " and resid 136 and name HA )) ( segid "KH " and resid 162 and name HB% ) 3.300 3.300 2.700 peak 6263 spectrum 1 weight 0.10000E+01 volume 0.18043E-02 ppm1 4.590 ppm2 1.015 CV 1 ASSI { 6264} (( segid "KH " and resid 166 and name HA )) ( segid "KH " and resid 134 and name HG2%) 3.100 3.100 2.900 peak 6264 spectrum 1 weight 0.10000E+01 volume 0.68828E-03 ppm1 3.952 ppm2 1.244 CV 1 ASSI { 6265} ( segid "KH " and resid 166 and name HB% ) ( segid "KH " and resid 134 and name HG2%) 2.400 2.400 3.600 peak 6265 spectrum 1 weight 0.10000E+01 volume 0.32726E-02 ppm1 1.320 ppm2 1.232 CV 1 ASSI { 6270} (( segid "KH " and resid 155 and name HE3 )) (( segid "KH " and resid 155 and name HG3 )) 3.400 1.400 1.400 peak 6270 spectrum 1 weight 0.10000E+01 volume 0.14900E-02 ppm1 2.629 ppm2 0.685 CV 1 ASSI { 6274} (( segid "KH " and resid 155 and name HE3 )) (( segid "KH " and resid 155 and name HD3 )) 3.000 1.100 1.100 peak 6274 spectrum 1 weight 0.10000E+01 volume 0.15606E-02 ppm1 2.629 ppm2 1.487 CV 1 ASSI { 6275} (( segid "KH " and resid 155 and name HE3 )) (( segid "KH " and resid 155 and name HD2 )) 2.800 1.000 1.000 peak 6275 spectrum 1 weight 0.10000E+01 volume 0.24103E-02 ppm1 2.630 ppm2 1.577 CV 1 ASSI { 6276} (( segid "KH " and resid 155 and name HE3 )) (( segid "KH " and resid 141 and name HB3 )) 2.800 2.800 3.200 peak 6276 spectrum 1 weight 0.10000E+01 volume 0.11974E-02 ppm1 2.630 ppm2 1.910 CV 1 ASSI { 3} ( segid "KH " and resid 161 and name HD% ) (( segid "KH " and resid 161 and name HA )) 3.200 1.300 1.300 peak 3 spectrum 1 weight 0.10000E+01 volume 0.14263E-02 ppm1 7.175 ppm2 3.442 CV 1 ASSI { 4} ( segid "KH " and resid 161 and name HD% ) (( segid "KH " and resid 161 and name HB2 )) 2.900 1.000 1.000 peak 4 spectrum 1 weight 0.10000E+01 volume 0.21996E-02 ppm1 7.175 ppm2 2.928 CV 1 ASSI { 5} ( segid "KH " and resid 161 and name HD% ) (( segid "KH " and resid 161 and name HB3 )) 3.000 1.200 1.200 peak 5 spectrum 1 weight 0.10000E+01 volume 0.15195E-02 ppm1 7.175 ppm2 2.718 CV 1 ASSI { 8} ( segid "KH " and resid 28 and name HD% ) ( segid "KH " and resid 28 and name HE% ) 2.200 0.600 0.600 peak 8 spectrum 1 weight 0.10000E+01 volume 0.10155E-01 ppm1 6.793 ppm2 6.320 CV 1 ASSI { 9} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 28 and name HA )) 3.100 1.200 1.200 peak 9 spectrum 1 weight 0.10000E+01 volume 0.16164E-02 ppm1 6.793 ppm2 4.928 CV 1 ASSI { 12} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 28 and name HB2 )) 2.900 1.000 1.000 peak 12 spectrum 1 weight 0.10000E+01 volume 0.21157E-02 ppm1 6.787 ppm2 3.005 CV 1 ASSI { 13} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 28 and name HB3 )) 2.900 1.100 1.100 peak 13 spectrum 1 weight 0.10000E+01 volume 0.19788E-02 ppm1 6.787 ppm2 2.487 CV 1 ASSI { 14} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 106 and name HG3 )) 2.800 1.000 1.000 peak 14 spectrum 1 weight 0.10000E+01 volume 0.25479E-02 ppm1 6.787 ppm2 2.053 CV 1 OR { 14} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 106 and name HG2 )) ASSI { 15} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 70 and name HB3 )) 3.000 3.000 3.000 peak 15 spectrum 1 weight 0.10000E+01 volume 0.15384E-02 ppm1 6.787 ppm2 1.423 CV 1 ASSI { 17} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 106 and name HB2 )) 3.300 1.300 1.300 peak 17 spectrum 1 weight 0.10000E+01 volume 0.19079E-02 ppm1 6.787 ppm2 1.972 CV 1 OR { 17} ( segid "KH " and resid 28 and name HD% ) (( segid "KH " and resid 106 and name HB3 )) ASSI { 20} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 88 and name HA )) 2.700 0.900 0.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.27533E-02 ppm1 7.394 ppm2 3.815 CV 1 ASSI { 21} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 159 and name HB3 )) 3.400 3.400 2.600 peak 21 spectrum 1 weight 0.10000E+01 volume 0.13129E-02 ppm1 7.394 ppm2 3.116 CV 1 ASSI { 22} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 88 and name HB2 )) 2.600 0.900 0.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.27935E-02 ppm1 7.394 ppm2 2.857 CV 1 ASSI { 23} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 88 and name HB3 )) 3.000 1.100 1.100 peak 23 spectrum 1 weight 0.10000E+01 volume 0.19528E-02 ppm1 7.394 ppm2 2.686 CV 1 ASSI { 24} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 84 and name HB2 )) 3.300 1.400 1.400 peak 24 spectrum 1 weight 0.10000E+01 volume 0.15243E-02 ppm1 7.394 ppm2 2.344 CV 1 ASSI { 25} ( segid "KH " and resid 88 and name HD% ) (( segid "KH " and resid 103 and name HB )) 2.800 1.000 1.000 peak 25 spectrum 1 weight 0.10000E+01 volume 0.28797E-02 ppm1 7.394 ppm2 2.078 CV 1 ASSI { 26} ( segid "KH " and resid 88 and name HD% ) ( segid "KH " and resid 105 and name HD1%) 3.000 1.200 1.200 peak 26 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 7.398 ppm2 0.921 CV 1 ASSI { 28} ( segid "KH " and resid 88 and name HD% ) ( segid "KH " and resid 105 and name HD2%) 3.600 1.600 1.600 peak 28 spectrum 1 weight 0.10000E+01 volume 0.12515E-02 ppm1 7.398 ppm2 -0.205 CV 1 ASSI { 30} ( segid "KH " and resid 96 and name HD% ) (( segid "KH " and resid 91 and name HA )) 2.300 0.700 0.700 peak 30 spectrum 1 weight 0.10000E+01 volume 0.53791E-02 ppm1 7.097 ppm2 4.090 CV 1 ASSI { 31} ( segid "KH " and resid 96 and name HD% ) (( segid "KH " and resid 96 and name HB2 )) 2.500 0.800 0.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.40261E-02 ppm1 7.098 ppm2 2.820 CV 1 OR { 31} ( segid "KH " and resid 96 and name HD% ) (( segid "KH " and resid 96 and name HB3 )) ASSI { 32} ( segid "KH " and resid 96 and name HD% ) ( segid "KH " and resid 91 and name HD2%) 2.900 1.000 1.000 peak 32 spectrum 1 weight 0.10000E+01 volume 0.34901E-02 ppm1 7.097 ppm2 0.536 CV 1 ASSI { 33} ( segid "KH " and resid 96 and name HD% ) (( segid "KH " and resid 94 and name HB3 )) 2.400 0.700 0.700 peak 33 spectrum 1 weight 0.10000E+01 volume 0.32669E-02 ppm1 7.097 ppm2 1.756 CV 1 ASSI { 35} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 97 and name HA )) 2.900 1.100 1.100 peak 35 spectrum 1 weight 0.10000E+01 volume 0.42858E-02 ppm1 7.290 ppm2 4.544 CV 1 ASSI { 36} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 97 and name HB2 )) 2.400 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.64500E-02 ppm1 7.290 ppm2 3.195 CV 1 ASSI { 37} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 96 and name HB3 )) 2.500 0.800 0.800 peak 37 spectrum 1 weight 0.10000E+01 volume 0.50096E-02 ppm1 7.290 ppm2 2.811 CV 1 OR { 37} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 96 and name HB2 )) ASSI { 38} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 97 and name HB3 )) 2.300 0.700 0.700 peak 38 spectrum 1 weight 0.10000E+01 volume 0.64122E-02 ppm1 7.290 ppm2 2.715 CV 1 ASSI { 39} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 91 and name HB2 )) 3.300 1.300 1.300 peak 39 spectrum 1 weight 0.10000E+01 volume 0.43390E-02 ppm1 7.290 ppm2 2.084 CV 1 ASSI { 40} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 91 and name HB3 )) 2.500 0.800 0.800 peak 40 spectrum 1 weight 0.10000E+01 volume 0.36034E-02 ppm1 7.290 ppm2 1.499 CV 1 ASSI { 41} ( segid "KH " and resid 97 and name HD% ) ( segid "KH " and resid 91 and name HD1%) 3.000 1.100 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.26990E-02 ppm1 7.290 ppm2 0.765 CV 1 ASSI { 42} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 91 and name HG )) 3.300 3.300 2.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.33850E-02 ppm1 7.290 ppm2 1.966 CV 1 ASSI { 43} ( segid "KH " and resid 97 and name HD% ) ( segid "KH " and resid 103 and name HG2%) 3.100 1.200 1.200 peak 43 spectrum 1 weight 0.10000E+01 volume 0.32103E-02 ppm1 7.290 ppm2 0.587 CV 1 ASSI { 44} ( segid "KH " and resid 97 and name HD% ) ( segid "KH " and resid 103 and name HG1%) 2.500 0.800 0.800 peak 44 spectrum 1 weight 0.10000E+01 volume 0.43862E-02 ppm1 7.290 ppm2 0.875 CV 1 ASSI { 45} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 101 and name HG2 )) 3.100 1.200 1.200 peak 45 spectrum 1 weight 0.10000E+01 volume 0.18088E-02 ppm1 7.290 ppm2 2.258 CV 1 OR { 45} ( segid "KH " and resid 97 and name HD% ) (( segid "KH " and resid 101 and name HG3 )) ASSI { 47} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 108 and name HA )) 3.000 1.100 1.100 peak 47 spectrum 1 weight 0.10000E+01 volume 0.15573E-02 ppm1 6.914 ppm2 6.122 CV 1 ASSI { 48} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 155 and name HA )) 3.000 1.100 1.100 peak 48 spectrum 1 weight 0.10000E+01 volume 0.21689E-02 ppm1 6.914 ppm2 5.131 CV 1 ASSI { 49} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 106 and name HG3 )) 3.100 1.200 1.200 peak 49 spectrum 1 weight 0.10000E+01 volume 0.16328E-02 ppm1 6.920 ppm2 2.011 CV 1 OR { 49} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 106 and name HG2 )) ASSI { 50} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 155 and name HB3 )) 2.900 1.100 1.100 peak 50 spectrum 1 weight 0.10000E+01 volume 0.14310E-02 ppm1 6.920 ppm2 1.512 CV 1 ASSI { 51} (( segid "KH " and resid 108 and name HD2 )) (( segid "KH " and resid 155 and name HG3 )) 3.100 1.200 1.200 peak 51 spectrum 1 weight 0.10000E+01 volume 0.14133E-02 ppm1 6.917 ppm2 0.634 CV 1 ASSI { 54} (( segid "KH " and resid 159 and name HD2 )) (( segid "KH " and resid 159 and name HB3 )) 3.000 1.200 1.200 peak 54 spectrum 1 weight 0.10000E+01 volume 0.14699E-02 ppm1 7.157 ppm2 3.122 CV 1 ASSI { 56} ( segid "KH " and resid 17 and name HD% ) (( segid "KH " and resid 17 and name HA )) 3.100 1.200 1.200 peak 56 spectrum 1 weight 0.10000E+01 volume 0.17970E-02 ppm1 7.182 ppm2 4.527 CV 1 ASSI { 59} (( segid "KH " and resid 26 and name HD2 )) ( segid "KH " and resid 72 and name HG1%) 3.100 1.200 1.200 peak 59 spectrum 1 weight 0.10000E+01 volume 0.17828E-02 ppm1 6.688 ppm2 0.819 CV 1 ASSI { 61} ( segid "KH " and resid 51 and name HD% ) (( segid "KH " and resid 51 and name HA )) 2.700 0.900 0.900 peak 61 spectrum 1 weight 0.10000E+01 volume 0.34133E-02 ppm1 7.129 ppm2 4.330 CV 1 ASSI { 62} ( segid "KH " and resid 51 and name HD% ) (( segid "KH " and resid 51 and name HB2 )) 2.800 1.000 1.000 peak 62 spectrum 1 weight 0.10000E+01 volume 0.29776E-02 ppm1 7.129 ppm2 3.315 CV 1 ASSI { 63} ( segid "KH " and resid 51 and name HD% ) (( segid "KH " and resid 51 and name HB3 )) 2.600 0.800 0.800 peak 63 spectrum 1 weight 0.10000E+01 volume 0.32291E-02 ppm1 7.129 ppm2 3.067 CV 1 ASSI { 64} ( segid "KH " and resid 51 and name HD% ) ( segid "KH " and resid 48 and name HD1%) 3.200 1.300 1.300 peak 64 spectrum 1 weight 0.10000E+01 volume 0.16683E-02 ppm1 7.132 ppm2 0.912 CV 1 ASSI { 66} ( segid "KH " and resid 97 and name HE% ) (( segid "KH " and resid 103 and name HA )) 3.100 1.200 1.200 peak 66 spectrum 1 weight 0.10000E+01 volume 0.19316E-02 ppm1 7.364 ppm2 2.823 CV 1 ASSI { 67} ( segid "KH " and resid 97 and name HE% ) (( segid "KH " and resid 91 and name HB2 )) 3.500 1.500 1.500 peak 67 spectrum 1 weight 0.10000E+01 volume 0.23236E-02 ppm1 7.363 ppm2 2.091 CV 1 ASSI { 68} ( segid "KH " and resid 97 and name HE% ) (( segid "KH " and resid 91 and name HB3 )) 2.600 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.21961E-02 ppm1 7.363 ppm2 1.510 CV 1 ASSI { 70} ( segid "KH " and resid 97 and name HE% ) ( segid "KH " and resid 103 and name HG2%) 3.000 1.100 1.100 peak 70 spectrum 1 weight 0.10000E+01 volume 0.38171E-02 ppm1 7.363 ppm2 0.588 CV 1 ASSI { 71} ( segid "KH " and resid 97 and name HE% ) ( segid "KH " and resid 91 and name HD1%) 2.800 1.000 1.000 peak 71 spectrum 1 weight 0.10000E+01 volume 0.23307E-02 ppm1 7.363 ppm2 0.765 CV 1 ASSI { 73} ( segid "KH " and resid 88 and name HE% ) ( segid "KH " and resid 88 and name HD% ) 2.200 0.600 0.600 peak 73 spectrum 1 weight 0.10000E+01 volume 0.96181E-02 ppm1 7.091 ppm2 7.384 CV 1 ASSI { 74} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 159 and name HA )) 2.600 0.800 0.800 peak 74 spectrum 1 weight 0.10000E+01 volume 0.35326E-02 ppm1 7.091 ppm2 5.631 CV 1 ASSI { 75} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 104 and name HA )) 3.100 3.100 2.900 peak 75 spectrum 1 weight 0.10000E+01 volume 0.34523E-02 ppm1 7.091 ppm2 4.587 CV 1 ASSI { 76} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 88 and name HA )) 3.500 1.600 1.600 peak 76 spectrum 1 weight 0.10000E+01 volume 0.22197E-02 ppm1 7.089 ppm2 3.797 CV 1 ASSI { 77} ( segid "KH " and resid 88 and name HE% ) ( segid "KH " and resid 105 and name HD2%) 3.500 1.500 1.500 peak 77 spectrum 1 weight 0.10000E+01 volume 0.16919E-02 ppm1 7.091 ppm2 -0.197 CV 1 ASSI { 78} ( segid "KH " and resid 88 and name HE% ) ( segid "KH " and resid 103 and name HG2%) 2.600 0.900 0.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.33661E-02 ppm1 7.091 ppm2 0.596 CV 1 ASSI { 80} ( segid "KH " and resid 88 and name HE% ) ( segid "KH " and resid 105 and name HD1%) 2.900 1.100 1.100 peak 80 spectrum 1 weight 0.10000E+01 volume 0.32858E-02 ppm1 7.091 ppm2 0.930 CV 1 ASSI { 81} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 105 and name HB2 )) 2.700 0.900 0.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.21086E-02 ppm1 7.091 ppm2 1.529 CV 1 ASSI { 82} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 103 and name HB )) 2.900 1.100 1.100 peak 82 spectrum 1 weight 0.10000E+01 volume 0.20556E-02 ppm1 7.091 ppm2 2.085 CV 1 ASSI { 83} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 160 and name HA )) 3.200 1.300 1.300 peak 83 spectrum 1 weight 0.10000E+01 volume 0.16022E-02 ppm1 7.091 ppm2 3.157 CV 1 ASSI { 84} ( segid "KH " and resid 88 and name HE% ) (( segid "KH " and resid 103 and name HA )) 3.600 3.600 2.400 peak 84 spectrum 1 weight 0.10000E+01 volume 0.13176E-02 ppm1 7.091 ppm2 2.823 CV 1 ASSI { 86} ( segid "KH " and resid 161 and name HE% ) ( segid "KH " and resid 160 and name HE% ) 2.000 2.000 4.000 peak 86 spectrum 1 weight 0.10000E+01 volume 0.93355E-02 ppm1 6.886 ppm2 7.061 CV 1 !################filtered################################# ASSI { 1} (( segid "KH " and resid 139 and name HG1%)) (( segid "RN " and resid 5 and name H2 )) 3.500 1.800 1.800 peak 1 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ASSI { 5} (( segid "KH " and resid 139 and name HG2%)) (( segid "RN " and resid 5 and name H2 )) 3.500 1.800 1.800 peak 5 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ASSI { 2} (( segid "KH " and resid 117 and name HA1 )) (( segid "RN " and resid 3 and name H1' )) 3.200 0.500 1.700 peak 2 spectrum 1 weight 0.10000E+01 volume 5.690e+02 ppm1 3.817 ppm2 7.979 CV 1 ! ! ASSI { 3} (( segid "KH " and resid 117 and name HA2 )) (( segid "RN " and resid 3 and name H1' )) 3.200 0.500 1.700 peak 3 spectrum 1 weight 0.10000E+01 volume 6.550e+02 ppm1 3.549 ppm2 7.986 CV 1 ! ! ASSI { 4} (( segid "KH " and resid 118 and name HG% )) (( segid "RN " and resid 2 and name H1' )) 6.000 1.500 1.500 peak 4 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 6} ! (( segid "KH " and resid 120 and name HG2% )) ! (( segid "RN " and resid 3 and name H1' )) ! 4.500 0.500 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ASSI { 6} (( segid "KH " and resid 120 and name HG2% )) (( segid "RN " and resid 4 and name H1' )) 4.500 1.000 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 7} (( segid "KH " and resid 120 and name HG2% )) (( segid "RN " and resid 4 and name H8 )) 3.500 1.000 1.500 peak 7 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ! ASSI { 8} (( segid "KH " and resid 118 and name HD3 )) (( segid "RN " and resid 2 and name H1' )) 5.000 1.500 1.500 peak 8 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 9} (( segid "KH " and resid 118 and name HD3 )) (( segid "RN " and resid 2 and name H6 )) 6.000 1.500 1.500 peak 9 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 10} (( segid "KH " and resid 140 and name O )) (( segid "RN " and resid 5 and name N6 )) 2.800 0.300 0.500 peak 10 spectrum 1 weight 0.10000E+01 volume 3.720e+02 ppm1 1.570 ppm2 7.980 CV 1 ! ASSI { 11} (( segid "KH " and resid 140 and name N )) (( segid "RN " and resid 5 and name N1 )) 2.800 0.300 0.500 peak 11 spectrum 1 weight 0.50000E+01 volume 3.720e+02 ppm1 1.570 ppm2 7.980 CV 1 ! ASSI { 12} (( segid "RN " and resid 5 and name H8 )) (( segid "RN " and resid 6 and name H6 )) 5.000 0.500 0.500 peak 12 spectrum 1 weight 0.10000E+02 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 13} (( segid "RN " and resid 5 and name H8 )) (( segid "RN " and resid 6 and name H5 )) 4.000 0.500 0.500 peak 13 spectrum 1 weight 0.10000E+02 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 14} ! (( segid "RN " and resid 5 and name H8 )) ! (( segid "RN " and resid 4 and name H8 )) ! 5.000 0.500 0.500 peak 14 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 15} (( segid "RN " and resid 5 and name H8 )) (( segid "RN " and resid 4 and name H1' )) 3.000 0.000 0.500 peak 15 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 16} (( segid "RN " and resid 5 and name H2 )) (( segid "RN " and resid 5 and name H1' )) 5.000 1.500 1.500 peak 16 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 17} (( segid "RN " and resid 5 and name H1' )) (( segid "RN " and resid 6 and name H6 )) 4.800 0.500 0.500 peak 17 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 18} (( segid "RN " and resid 5 and name H2 )) (( segid "RN " and resid 6 and name H1' )) 4.000 1.000 0.700 peak 18 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 19} (( segid "RN " and resid 6 and name H1' )) (( segid "RN " and resid 6 and name H6 )) 3.500 0.500 0.500 peak 19 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 20} (( segid "RN " and resid 5 and name H2' )) (( segid "RN " and resid 6 and name H5 )) 4.000 0.500 0.500 peak 20 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 21} (( segid "RN " and resid 5 and name H8 )) (( segid "RN " and resid 5 and name H1' )) 3.500 1.500 1.500 peak 21 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 22} ! (( segid "RN " and resid 1 and name H6 )) ! (( segid "RN " and resid 2 and name H5 )) ! 5.000 1.000 1.000 peak 22 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 23} (( segid "RN " and resid 6 and name H6 )) (( segid "RN " and resid 7 and name H5 )) 5.000 1.500 1.500 peak 23 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 24} (( segid "RN " and resid 7 and name H1' )) (( segid "RN " and resid 7 and name H6 )) 3.500 1.500 1.500 peak 24 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 25} (( segid "RN " and resid 2 and name H1' )) (( segid "RN " and resid 2 and name H6 )) 3.500 1.500 1.500 peak 25 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 26} (( segid "RN " and resid 5 and name H3' )) (( segid "RN " and resid 6 and name H5 )) 3.500 0.500 0.500 peak 26 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 27} ! (( segid "RN " and resid 4 and name H2' )) ! (( segid "RN " and resid 5 and name H1' )) ! 5.000 0.500 0.500 peak 27 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 28} (( segid "RN " and resid 5 and name H2' )) (( segid "RN " and resid 6 and name H6 )) 2.500 0.500 0.500 peak 28 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 29} (( segid "RN " and resid 5 and name H2' )) (( segid "RN " and resid 6 and name H1' )) 4.000 0.500 0.500 peak 29 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 30} (( segid "RN " and resid 5 and name H3' )) (( segid "RN " and resid 6 and name H6 )) 2.700 0.500 0.500 peak 30 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 31} (( segid "RN " and resid 4 and name H2' )) (( segid "RN " and resid 5 and name H8 )) 4.000 0.500 0.500 peak 31 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 32} ! (( segid "RN " and resid 3 and name H2' )) ! (( segid "RN " and resid 4 and name H8 )) ! 2.700 0.500 0.500 peak 32 spectrum 1 weight 0.10000E+02 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 33} (( segid "RN " and resid 2 and name H2' )) (( segid "RN " and resid 3 and name H8 )) 3.500 1.000 1.000 peak 33 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! !ASSI { 34} ! (( segid "RN " and resid 2 and name H2' )) ! (( segid "RN " and resid 3 and name H1' )) ! 4.000 0.500 0.500 peak 34 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! !ASSI { 34} ! (( segid "RN " and resid 3 and name O2' )) ! (( segid "RN " and resid 4 and name N7 )) ! 4.000 0.500 0.500 peak 34 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 35} (( segid "RN " and resid 2 and name H4' )) (( segid "RN " and resid 3 and name H8 )) 5.000 1.500 1.500 peak 35 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 36} (( segid "KH " and resid 118 and name HD3 )) (( segid "RN " and resid 2 and name H4' )) 5.000 1.500 1.500 peak 36 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 77} ! (( segid "KH " and resid 118 and name HD2 )) ! (( segid "RN " and resid 2 and name H4' )) ! 5.000 0.500 1.500 peak 77 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 37} (( segid "KH " and resid 139 and name HB)) (( segid "RN " and resid 5 and name H2 )) 5.000 1.500 1.500 peak 37 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ! ! ASSI { 38} ! (( segid "KH " and resid 120 and name HD1% )) ! (( segid "RN " and resid 3 and name H1' )) ! 4.500 0.500 1.500 peak 38 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 38} (( segid "KH " and resid 120 and name HD1% )) (( segid "RN " and resid 4 and name H1' )) 4.500 0.500 1.500 peak 38 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 39} (( segid "RN " and resid 5 and name H2' )) (( segid "RN " and resid 6 and name H5' )) 2.700 0.500 0.500 peak 39 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 40} (( segid "RN " and resid 5 and name H8 )) (( segid "RN " and resid 5 and name H5' )) 3.700 1.000 1.000 peak 40 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 41} (( segid "RN " and resid 6 and name H6 )) (( segid "RN " and resid 6 and name H5' )) 3.500 1.000 1.000 peak 41 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 42} ! (( segid "RN " and resid 1 and name H2' )) ! (( segid "RN " and resid 2 and name H1' )) ! 3.500 1.500 1.500 peak 42 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 43} ! (( segid "RN " and resid 1 and name H2' )) ! (( segid "RN " and resid 2 and name H5'' )) ! 3.500 1.500 1.500 peak 43 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 44} (( segid "RN " and resid 2 and name H6 )) (( segid "RN " and resid 2 and name H5'' )) 4.000 1.500 1.500 peak 44 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 45} ! (( segid "RN " and resid 2 and name H2' )) ! (( segid "RN " and resid 3 and name H5'' )) ! 3.500 0.500 0.500 peak 45 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 46} ! (( segid "RN " and resid 3 and name H8 )) ! (( segid "RN " and resid 3 and name H5'' )) ! 3.000 0.500 0.500 peak 46 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 47} ! (( segid "RN " and resid 4 and name H2' )) ! (( segid "RN " and resid 5 and name H5'' )) ! 4.000 1.500 1.500 peak 47 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 48} ! (( segid "KH " and resid 120 and name HG1% )) ! (( segid "RN " and resid 2 and name H2' )) ! 3.500 1.500 1.500 peak 48 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 49} (( segid "KH " and resid 118 and name HD3 )) (( segid "RN " and resid 2 and name H2' )) 5.000 1.500 1.500 peak 49 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! !! ! ! ASSI { 50} (( segid "KH " and resid 118 and name HD3 )) (( segid "RN " and resid 2 and name H5' )) 5.000 1.500 1.500 peak 50 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 51} (( segid "KH " and resid 118 and name HB% )) (( segid "RN " and resid 2 and name H5' )) 6.000 1.500 1.500 peak 51 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 51} ! (( segid "KH " and resid 122 and name HD% )) ! (( segid "RN " and resid 3 and name H5' )) ! 3.500 1.500 1.500 peak 51 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ! ! ! ! ASSI { 52} ! (( segid "KH " and resid 118 and name HB% )) ! (( segid "RN " and resid 2 and name H2' )) ! 5.000 0.500 1.500 peak 52 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 53} ! (( segid "KH " and resid 118 and name HB% )) ! (( segid "RN " and resid 2 and name H4' )) ! 5.000 0.500 1.500 peak 53 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! !ASSI { 53} ! (( segid "KH " and resid 122 and name HD% )) ! (( segid "RN " and resid 2 and name H4' )) ! 5.000 1.500 1.500 peak 53 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 54} (( segid "KH " and resid 120 and name HG2% )) (( segid "RN " and resid 3 and name H4' )) 4.500 0.500 0.500 peak 54 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! !ASSI { 55} ! (( segid "RN " and resid 3 and name H8 )) ! (( segid "RN " and resid 4 and name H8 )) ! 4.500 0.500 0.500 peak 55 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 56} (( segid "KH " and resid 118 and name HB% )) (( segid "RN " and resid 2 and name H1' )) 6.000 1.500 1.500 peak 56 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 56} ! (( segid "KH " and resid 122 and name HD% )) ! (( segid "RN " and resid 2 and name H1' )) ! 5.000 1.500 1.500 peak 56 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 57} ! (( segid "KH " and resid 118 and name HB% )) ! (( segid "RN " and resid 2 and name H6 )) ! 5.000 0.500 1.500 peak 57 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 58} (( segid "KH " and resid 140 and name HG2% )) (( segid "RN " and resid 4 and name H1' )) 5.000 0.500 1.800 peak 58 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 59} (( segid "RN " and resid 6 and name H2' )) (( segid "RN " and resid 7 and name H1' )) 5.000 1.500 1.500 peak 59 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 60} (( segid "RN " and resid 6 and name H2' )) (( segid "RN " and resid 7 and name H6 )) 3.000 1.500 1.500 peak 60 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 61} (( segid "KH " and resid 118 and name HG% )) (( segid "RN " and resid 2 and name H4' )) 5.000 1.500 1.500 peak 61 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 61} ! (( segid "KH " and resid 118 and name HG% )) ! (( segid "RN " and resid 2 and name H5' )) ! 5.000 0.500 1.500 peak 61 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 62} ! (( segid "KH " and resid 122 and name HG% )) ! (( segid "RN " and resid 3 and name H4' )) ! 5.000 1.500 1.500 peak 62 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 63} (( segid "KH " and resid 122 and name HG% )) (( segid "RN " and resid 3 and name H5' )) 5.000 1.500 1.500 peak 63 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 64} (( segid "KH " and resid 140 and name O )) (( segid "RN " and resid 5 and name H62 )) 1.800 0.300 0.500 peak 64 spectrum 1 weight 0.10000E+01 volume 3.720e+02 ppm1 1.570 ppm2 7.980 CV 1 ! ASSI { 65} (( segid "KH " and resid 140 and name HN )) (( segid "RN " and resid 5 and name N1 )) 1.800 0.300 0.500 peak 65 spectrum 1 weight 0.50000E+01 volume 3.720e+02 ppm1 1.570 ppm2 7.980 CV 1 ! ! ASSI { 66} (( segid "RN " and resid 3 and name H8 )) (( segid "RN " and resid 3 and name H1' )) 3.500 0.500 0.500 peak 66 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 67} (( segid "RN " and resid 4 and name H8 )) (( segid "RN " and resid 4 and name H1' )) 3.500 0.500 0.500 peak 67 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 68} (( segid "RN " and resid 3 and name H1' )) (( segid "RN " and resid 4 and name H8 )) 2.700 0.500 0.500 peak 32 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 69} (( segid "RN " and resid 4 and name H5' )) (( segid "RN " and resid 4 and name H8 )) 3.500 0.500 1.500 peak 32 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! !ASSI { 70} ! (( segid "KH " and resid 142 and name HH21 )) ! (( segid "RN " and resid 4 and name O6 )) ! 1.800 0.000 0.500 peak 70 spectrum 1 weight 0.10000E+01 volume 3.720e+02 ppm1 1.570 ppm2 7.980 CV 1 ! ! ! ASSI { 71} (( segid "RN " and resid 4 and name H2' )) (( segid "RN " and resid 4 and name H8 )) 4.000 1.000 1.000 peak 71 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 72} (( segid "RN " and resid 4 and name H3' )) (( segid "RN " and resid 4 and name H8 )) 3.500 0.500 0.500 peak 72 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 73} ! (( segid "KH " and resid 127 and name HG1%)) ! (( segid "RN " and resid 5 and name H2 )) ! 5.000 1.000 1.000 peak 73 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ASSI { 74} (( segid "KH " and resid 138 and name HB)) (( segid "RN " and resid 5 and name H2 )) 5.000 1.000 1.000 peak 74 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ! ASSI { 75} (( segid "KH " and resid 120 and name HD1% )) (( segid "RN " and resid 4 and name H8 )) 6.000 1.500 1.500 peak 75 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! !ASSI { 76} ! (( segid "RN " and resid 3 and name H3' )) ! (( segid "RN " and resid 4 and name H8 )) ! 4.000 0.500 0.500 peak 76 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 78} ! (( segid "KH " and resid 118 and name HA )) ! (( segid "RN " and resid 2 and name H4' )) ! 5.000 0.500 1.500 peak 78 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! !ASSI { 79} ! (( segid "RN " and resid 3 and name H1' )) ! (( segid "RN " and resid 4 and name H2' )) ! 3.700 0.500 0.500 peak 79 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ASSI { 80} ! (( segid "KH " and resid 122 and name HA )) ! (( segid "RN " and resid 3 and name H3' )) ! 3.500 0.500 1.500 peak 80 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 81} ! (( segid "KH " and resid 122 and name HG% )) ! (( segid "RN " and resid 3 and name H3' )) ! 5.000 1.500 1.500 peak 81 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 82} (( segid "RN " and resid 3 and name H4' )) (( segid "RN " and resid 4 and name H8 )) 2.500 0.500 0.500 peak 82 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 83} (( segid "KH " and resid 122 and name HA )) (( segid "RN " and resid 3 and name H4' )) 3.000 0.500 0.500 peak 83 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 84} (( segid "KH " and resid 123 and name HN )) (( segid "RN " and resid 3 and name H4' )) 3.000 0.500 0.500 peak 84 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 85} ! (( segid "KH " and resid 117 and name HA2 )) ! (( segid "RN " and resid 3 and name H8 )) ! 3.500 0.500 1.500 peak 85 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 86} (( segid "RN " and resid 4 and name H4' )) (( segid "RN " and resid 5 and name H8 )) 2.500 0.500 0.500 peak 86 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 87} (( segid "RN " and resid 4 and name H4' )) (( segid "RN " and resid 5 and name H5' )) 2.500 0.500 0.500 peak 87 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 88} (( segid "KH " and resid 120 and name HG2% )) (( segid "RN " and resid 5 and name H1' )) 3.500 0.500 0.500 peak 88 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! !ASSI { 89} ! (( segid "RN " and resid 4 and name H1' )) ! (( segid "RN " and resid 5 and name H8 )) ! 3.500 0.500 1.500 peak 89 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 90} (( segid "KH " and resid 124 and name HA% )) (( segid "RN " and resid 5 and name H1' )) 3.500 1.000 1.000 peak 90 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! !! ! ASSI { 91} ! (( segid "KH " and resid 118 and name HB% )) ! (( segid "RN " and resid 2 and name H5 )) ! 5.000 0.500 0.500 peak 91 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 92} (( segid "RN " and resid 2 and name H6 )) (( segid "RN " and resid 2 and name H5' )) 3.500 1.500 1.500 peak 92 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 93} ! (( segid "RN " and resid 2 and name H6 )) ! (( segid "RN " and resid 1 and name H2' )) ! 2.500 0.500 0.500 peak 93 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! ! ASSI { 94} ! (( segid "KH " and resid 127 and name HG1%)) ! (( segid "RN " and resid 5 and name H1' )) ! 5.000 1.500 1.500 peak 94 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ! ! ASSI { 95} ! (( segid "KH " and resid 118 and name HG% )) ! (( segid "RN " and resid 2 and name H6 )) ! 5.000 0.500 1.500 peak 95 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 96} ! (( segid "KH " and resid 122 and name HD% )) ! (( segid "RN " and resid 3 and name H4' )) ! 5.000 1.500 1.500 peak 96 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 97} (( segid "KH " and resid 122 and name HD% )) (( segid "RN " and resid 3 and name H5'' )) 5.000 1.500 1.500 peak 97 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 98} ! (( segid "KH " and resid 122 and name HD% )) ! (( segid "RN " and resid 3 and name H3' )) ! 5.000 1.500 1.500 peak 98 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 99} ! (( segid "KH " and resid 122 and name HG% )) ! (( segid "RN " and resid 3 and name H5'' )) ! 5.000 1.500 1.500 peak 99 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 100} (( segid "KH " and resid 177 and name HG1% )) (( segid "RN " and resid 2 and name H1' )) 4.500 0.500 1.000 peak 100 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 101} (( segid "KH " and resid 177 and name HG2% )) (( segid "RN " and resid 2 and name H1' )) 4.500 0.500 1.000 peak 101 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 102} ! (( segid "KH " and resid 178 and name HG2 )) ! (( segid "RN " and resid 2 and name H5' )) ! 5.000 0.500 1.500 peak 102 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ! ASSI { 103} ! (( segid "KH " and resid 178 and name HG3 )) ! (( segid "RN " and resid 2 and name H5' )) ! 5.000 0.500 1.500 peak 103 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ! ASSI { 104} ! (( segid "KH " and resid 122 and name HG% )) ! (( segid "RN " and resid 3 and name H1' )) ! 5.000 1.500 1.500 peak 104 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ! ASSI { 104} ! (( segid "KH " and resid 122 and name HB% )) ! (( segid "RN " and resid 3 and name H4' )) ! 5.000 1.500 1.500 peak 104 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ! ASSI { 105} (( segid "RN " and resid 3 and name H8 )) (( segid "RN " and resid 3 and name H2' )) 3.500 0.500 0.500 peak 105 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ASSI { 106} (( segid "KH " and resid 120 and name HG2% )) (( segid "RN " and resid 3 and name H1' )) 4.500 0.500 0.500 peak 106 spectrum 1 weight 0.10000E+01 volume 1.900e+03 ppm1 3.978 ppm2 5.789 CV 1 ! ! ASSI { 107} (( segid "KH " and resid 139 and name HA)) (( segid "RN " and resid 5 and name H2 )) 3.500 1.000 1.500 peak 107 spectrum 1 weight 0.10000E+01 volume 2.759e+03 ppm1 0.993 ppm2 5.791 CV 1 ! ! ASSI { 108} (( segid "RN " and resid 2 and name H6 )) (( segid "RN " and resid 1 and name H5' )) 5.000 1.500 1.500 peak 22 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ASSI { 108} (( segid "RN " and resid 2 and name H6 )) (( segid "RN " and resid 1 and name H5'' )) 5.000 1.500 1.500 peak 108 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ASSI { 109} (( segid "RN " and resid 3 and name H8 )) (( segid "RN " and resid 2 and name H3' )) 5.000 1.000 1.000 peak 109 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 110} ! (( segid "RN " and resid 2 and name H5 )) ! (( segid "RN " and resid 1 and name H2' )) ! 5.000 1.000 1.000 peak 110 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 111} ! (( segid "RN " and resid 2 and name H5'' )) ! (( segid "RN " and resid 1 and name H1' )) ! 5.000 1.000 1.000 peak 111 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 112} ! (( segid "RN " and resid 1 and name H5'' )) ! (( segid "RN " and resid 1 and name H1' )) ! 5.000 1.000 1.000 peak 112 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! !ASSI { 113} ! (( segid "RN " and resid 1 and name H5' )) ! (( segid "RN " and resid 1 and name H1' )) ! 5.000 1.000 1.000 peak 113 spectrum 1 weight 0.10000E+01 volume 8.532e+03 ppm1 5.852 ppm2 7.989 CV 1 ! ! ! assign ( residue 107 and name HA ) ( residue 27 and name HA ) 2.80 0.00 0.50 assign ( residue 106 and name HA ) ( residue 157 and name HA ) 2.80 0.00 0.50 assign ( residue 138 and name HA ) ( residue 156 and name HA ) 2.80 0.00 0.50 assign ( residue 140 and name HA ) ( residue 154 and name HA ) 2.80 0.00 0.50 assign ( residue 71 and name HA ) ( residue 58 and name HA ) 2.80 0.00 0.50 assign ( residue 26 and name HA ) ( residue 72 and name HA ) 2.80 0.00 0.50 assign ( residue 28 and name HA ) ( residue 70 and name HA ) 2.80 0.00 0.50 assign ( residue 73 and name HA ) ( residue 56 and name HA ) 2.80 0.00 0.50 assign ( residue 165 and name HA ) ( residue 168 and name HN ) 3.50 0.20 0.30 assign ( residue 166 and name HA ) ( residue 169 and name HN ) 3.50 0.20 0.30 assign ( residue 167 and name HA ) ( residue 170 and name HN ) 3.50 0.20 0.30 assign ( residue 168 and name HA ) ( residue 171 and name HN ) 3.50 0.20 0.30 assign ( residue 169 and name HA ) ( residue 172 and name HN ) 3.50 0.20 0.30 assign ( residue 170 and name HA ) ( residue 173 and name HN ) 3.50 0.20 0.30 assign ( residue 171 and name HA ) ( residue 174 and name HN ) 3.50 0.20 0.30 assign ( residue 172 and name HA ) ( residue 175 and name HN ) 3.50 0.20 0.30 assign ( residue 173 and name HA ) ( residue 176 and name HN ) 3.50 0.20 0.30 assign ( residue 174 and name HA ) ( residue 177 and name HN ) 3.50 0.20 0.30 assign ( residue 175 and name HA ) ( residue 178 and name HN ) 3.50 0.20 0.30 assign ( residue 176 and name HA ) ( residue 179 and name HN ) 3.50 0.20 0.30 assign ( residue 177 and name HA ) ( residue 180 and name HN ) 3.50 0.20 0.30 assign ( residue 178 and name HA ) ( residue 181 and name HN ) 3.50 0.20 0.30 assign ( residue 179 and name HA ) ( residue 182 and name HN ) 3.50 0.20 0.30 assign ( residue 164 and name HN ) ( residue 165 and name HN ) 2.80 0.00 0.50 assign ( residue 165 and name HN ) ( residue 166 and name HN ) 2.80 0.00 0.50 assign ( residue 166 and name HN ) ( residue 167 and name HN ) 2.80 0.00 0.50 assign ( residue 167 and name HN ) ( residue 168 and name HN ) 2.80 0.00 0.50 assign ( residue 168 and name HN ) ( residue 169 and name HN ) 2.80 0.00 0.50 assign ( residue 169 and name HN ) ( residue 170 and name HN ) 2.80 0.00 0.50 assign ( residue 170 and name HN ) ( residue 171 and name HN ) 2.80 0.00 0.50 assign ( residue 171 and name HN ) ( residue 172 and name HN ) 2.80 0.00 0.50 assign ( residue 172 and name HN ) ( residue 173 and name HN ) 2.80 0.00 0.50 assign ( residue 173 and name HN ) ( residue 174 and name HN ) 2.80 0.00 0.50 assign ( residue 174 and name HN ) ( residue 175 and name HN ) 2.80 0.00 0.50 assign ( residue 175 and name HN ) ( residue 176 and name HN ) 2.80 0.00 0.50 assign ( residue 176 and name HN ) ( residue 177 and name HN ) 2.80 0.00 0.50 assign ( residue 177 and name HN ) ( residue 178 and name HN ) 2.80 0.00 0.50 assign ( residue 178 and name HN ) ( residue 179 and name HN ) 2.80 0.00 0.50 assign ( residue 179 and name HN ) ( residue 180 and name HN ) 2.80 0.00 0.50 assign ( residue 180 and name HN ) ( residue 181 and name HN ) 2.80 0.00 0.50 assign ( residue 181 and name HN ) ( residue 182 and name HN ) 2.80 0.00 0.50
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