NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12017 |
1se7   |
6127 | cing | 1-original | 4 | unknown | chemical shift |
do (store1 = 57.801) (resid 2 and name CA) do (store1 = 4.402) (resid 2 and name HA) do (store1 = 38.430) (resid 2 and name CB) do (store1 = 2.726) (resid 2 and name HB1) do (store1 = 133.082) (resid 2 and name CD1) do (store1 = 6.901) (resid 2 and name HD1) do (store1 = 118.065) (resid 2 and name CE1) do (store1 = 6.696) (resid 2 and name HE1) do (store1 = 174.904) (resid 2 and name C) do (store1 = 122.767) (resid 3 and name N) do (store1 = 8.163) (resid 3 and name HN) do (store1 = 53.803) (resid 3 and name CA) do (store1 = 4.509) (resid 3 and name HA) do (store1 = 41.130) (resid 3 and name CB) do (store1 = 2.635) (resid 3 and name HB2) do (store1 = 2.483) (resid 3 and name HB1) do (store1 = 175.838) (resid 3 and name C) do (store1 = 121.732) (resid 4 and name N) do (store1 = 7.899) (resid 4 and name HN) do (store1 = 57.774) (resid 4 and name CA) do (store1 = 4.507) (resid 4 and name HA) do (store1 = 29.143) (resid 4 and name CB) do (store1 = 3.323) (resid 4 and name HB2) do (store1 = 3.262) (resid 4 and name HB1) do (store1 = 127.204) (resid 4 and name CD1) do (store1 = 7.277) (resid 4 and name HD1) do (store1 = 129.636) (resid 4 and name NE1) do (store1 = 10.168) (resid 4 and name HE1) do (store1 = 114.632) (resid 4 and name CZ2) do (store1 = 7.385) (resid 4 and name HZ2) do (store1 = 124.640) (resid 4 and name CH2) do (store1 = 7.146) (resid 4 and name HH2) do (store1 = 122.034) (resid 4 and name CZ3) do (store1 = 7.121) (resid 4 and name HZ3) do (store1 = 120.816) (resid 4 and name CE3) do (store1 = 7.614) (resid 4 and name HE3) do (store1 = 176.293) (resid 4 and name C) do (store1 = 119.463) (resid 5 and name N) do (store1 = 8.191) (resid 5 and name HN) do (store1 = 53.692) (resid 5 and name CA) do (store1 = 4.567) (resid 5 and name HA) do (store1 = 38.465) (resid 5 and name CB) do (store1 = 2.689) (resid 5 and name HB2) do (store1 = 2.536) (resid 5 and name HB1) do (store1 = 112.886) (resid 5 and name ND2) do (store1 = 6.813) (resid 5 and name HD21) do (store1 = 7.602) (resid 5 and name HD22) do (store1 = 175.564) (resid 5 and name C) do (store1 = 120.403) (resid 6 and name N) do (store1 = 7.775) (resid 6 and name HN) do (store1 = 61.847) (resid 6 and name CA) do (store1 = 3.994) (resid 6 and name HA) do (store1 = 38.461) (resid 6 and name CB) do (store1 = 1.853) (resid 6 and name HB) do (store1 = 27.523) (resid 6 and name CG1) do (store1 = 1.427) (resid 6 and name HG12) do (store1 = 1.155) (resid 6 and name HG11) do (store1 = 13.051) (resid 6 and name CD1) do (store1 = 0.838) (resid 6 and name HD11) do (store1 = 17.483) (resid 6 and name CG2) do (store1 = 0.875) (resid 6 and name HG21) do (store1 = 176.391) (resid 6 and name C) do (store1 = 125.991) (resid 7 and name N) do (store1 = 8.129) (resid 7 and name HN) do (store1 = 53.038) (resid 7 and name CA) do (store1 = 4.235) (resid 7 and name HA) do (store1 = 18.976) (resid 7 and name CB) do (store1 = 1.399) (resid 7 and name HB1) do (store1 = 177.981) (resid 7 and name C) do (store1 = 122.400) (resid 8 and name N) do (store1 = 8.058) (resid 8 and name HN) do (store1 = 53.047) (resid 8 and name CA) do (store1 = 4.245) (resid 8 and name HA) do (store1 = 19.009) (resid 8 and name CB) do (store1 = 1.375) (resid 8 and name HB1) do (store1 = 178.439) (resid 8 and name C) do (store1 = 119.951) (resid 9 and name N) do (store1 = 8.143) (resid 9 and name HN) do (store1 = 56.706) (resid 9 and name CA) do (store1 = 4.322) (resid 9 and name HA) do (store1 = 33.095) (resid 9 and name CB) do (store1 = 1.836) (resid 9 and name HB2) do (store1 = 1.753) (resid 9 and name HB1) do (store1 = 24.908) (resid 9 and name CG) do (store1 = 1.466) (resid 9 and name HG1) do (store1 = 29.062) (resid 9 and name CD) do (store1 = 1.626) (resid 9 and name HD1) do (store1 = 42.149) (resid 9 and name CE) do (store1 = 2.942) (resid 9 and name HE1) do (store1 = 177.096) (resid 9 and name C) do (store1 = 116.402) (resid 10 and name N) do (store1 = 8.319) (resid 10 and name HN) do (store1 = 58.493) (resid 10 and name CA) do (store1 = 4.415) (resid 10 and name HA) do (store1 = 64.135) (resid 10 and name CB) do (store1 = 4.151) (resid 10 and name HB2) do (store1 = 3.967) (resid 10 and name HB1) do (store1 = 175.306) (resid 10 and name C) do (store1 = 122.821) (resid 11 and name N) do (store1 = 8.675) (resid 11 and name HN) do (store1 = 58.253) (resid 11 and name CA) do (store1 = 3.925) (resid 11 and name HA) do (store1 = 28.419) (resid 11 and name CB) do (store1 = 2.194) (resid 11 and name HB2) do (store1 = 2.081) (resid 11 and name HB1) do (store1 = 33.343) (resid 11 and name CG) do (store1 = 2.413) (resid 11 and name HG1) do (store1 = 115.646) (resid 11 and name NE2) do (store1 = 7.422) (resid 11 and name HE21) do (store1 = 177.008) (resid 11 and name C) do (store1 = 119.006) (resid 12 and name N) do (store1 = 8.429) (resid 12 and name HN) do (store1 = 59.587) (resid 12 and name CA) do (store1 = 4.142) (resid 12 and name HA) do (store1 = 29.684) (resid 12 and name CB) do (store1 = 2.038) (resid 12 and name HB1) do (store1 = 36.901) (resid 12 and name CG) do (store1 = 2.242) (resid 12 and name HG1) do (store1 = 178.548) (resid 12 and name C) do (store1 = 118.465) (resid 13 and name N) do (store1 = 7.815) (resid 13 and name HN) do (store1 = 58.980) (resid 13 and name CA) do (store1 = 3.988) (resid 13 and name HA) do (store1 = 29.641) (resid 13 and name CB) do (store1 = 2.078) (resid 13 and name HB1) do (store1 = 36.601) (resid 13 and name CG) do (store1 = 2.348) (resid 13 and name HG2) do (store1 = 2.274) (resid 13 and name HG1) do (store1 = 178.979) (resid 13 and name C) do (store1 = 120.637) (resid 14 and name N) do (store1 = 8.032) (resid 14 and name HN) do (store1 = 57.305) (resid 14 and name CA) do (store1 = 30.150) (resid 14 and name CB) do (store1 = 1.927) (resid 14 and name HB1) do (store1 = 27.656) (resid 14 and name CG) do (store1 = 1.761) (resid 14 and name HG2) do (store1 = 1.591) (resid 14 and name HG1) do (store1 = 43.591) (resid 14 and name CD) do (store1 = 3.191) (resid 14 and name HD1) do (store1 = 178.741) (resid 14 and name C) do (store1 = 119.852) (resid 15 and name N) do (store1 = 8.740) (resid 15 and name HN) do (store1 = 57.490) (resid 15 and name CA) do (store1 = 4.538) (resid 15 and name HA) do (store1 = 40.330) (resid 15 and name CB) do (store1 = 2.815) (resid 15 and name HB2) do (store1 = 2.519) (resid 15 and name HB1) do (store1 = 178.723) (resid 15 and name C) do (store1 = 119.283) (resid 16 and name N) do (store1 = 7.968) (resid 16 and name HN) do (store1 = 61.170) (resid 16 and name CA) do (store1 = 3.848) (resid 16 and name HA) do (store1 = 32.556) (resid 16 and name CB) do (store1 = 1.821) (resid 16 and name HB1) do (store1 = 27.133) (resid 16 and name CG) do (store1 = 0.745) (resid 16 and name HG1) do (store1 = 29.409) (resid 16 and name CD) do (store1 = 1.345) (resid 16 and name HD2) do (store1 = 1.235) (resid 16 and name HD1) do (store1 = 41.307) (resid 16 and name CE) do (store1 = 2.306) (resid 16 and name HE1) do (store1 = 178.642) (resid 16 and name C) do (store1 = 119.717) (resid 17 and name N) do (store1 = 7.730) (resid 17 and name HN) do (store1 = 66.308) (resid 17 and name CA) do (store1 = 3.885) (resid 17 and name HA) do (store1 = 31.795) (resid 17 and name CB) do (store1 = 2.295) (resid 17 and name HB) do (store1 = 22.638) (resid 17 and name CG2) do (store1 = 1.116) (resid 17 and name HG21) do (store1 = 21.068) (resid 17 and name CG1) do (store1 = 0.990) (resid 17 and name HG11) do (store1 = 179.474) (resid 17 and name C) do (store1 = 119.374) (resid 18 and name N) do (store1 = 7.923) (resid 18 and name HN) do (store1 = 56.261) (resid 18 and name CA) do (store1 = 4.665) (resid 18 and name HA) do (store1 = 37.939) (resid 18 and name CB) do (store1 = 3.062) (resid 18 and name HB2) do (store1 = 2.955) (resid 18 and name HB1) do (store1 = 112.899) (resid 18 and name ND2) do (store1 = 6.948) (resid 18 and name HD21) do (store1 = 7.851) (resid 18 and name HD22) do (store1 = 178.530) (resid 18 and name C) do (store1 = 123.808) (resid 19 and name N) do (store1 = 8.617) (resid 19 and name HN) do (store1 = 66.427) (resid 19 and name CA) do (store1 = 4.071) (resid 19 and name HA) do (store1 = 32.000) (resid 19 and name CB) do (store1 = 2.462) (resid 19 and name HB) do (store1 = 23.888) (resid 19 and name CG1) do (store1 = 1.524) (resid 19 and name HG11) do (store1 = 177.844) (resid 19 and name C) do (store1 = 120.148) (resid 20 and name N) do (store1 = 8.622) (resid 20 and name HN) do (store1 = 58.566) (resid 20 and name CA) do (store1 = 4.302) (resid 20 and name HA) do (store1 = 42.849) (resid 20 and name CB) do (store1 = 3.258) (resid 20 and name HB2) do (store1 = 3.030) (resid 20 and name HB1) do (store1 = 177.789) (resid 20 and name C) do (store1 = 118.297) (resid 21 and name N) do (store1 = 7.985) (resid 21 and name HN) do (store1 = 58.035) (resid 21 and name CA) do (store1 = 3.988) (resid 21 and name HA) do (store1 = 42.048) (resid 21 and name CB) do (store1 = 1.798) (resid 21 and name HB2) do (store1 = 2.022) (resid 21 and name HB1) do (store1 = 27.670) (resid 21 and name CG) do (store1 = 1.910) (resid 21 and name HG) do (store1 = 25.030) (resid 21 and name CD1) do (store1 = 0.967) (resid 21 and name HD11) do (store1 = 122.551) (resid 22 and name N) do (store1 = 8.162) (resid 22 and name HN) do (store1 = 55.478) (resid 22 and name CA) do (store1 = 4.031) (resid 22 and name HA) do (store1 = 17.623) (resid 22 and name CB) do (store1 = 1.657) (resid 22 and name HB1) do (store1 = 179.254) (resid 22 and name C) do (store1 = 120.136) (resid 23 and name N) do (store1 = 8.328) (resid 23 and name HN) do (store1 = 55.568) (resid 23 and name CA) do (store1 = 3.743) (resid 23 and name HA) do (store1 = 18.034) (resid 23 and name CB) do (store1 = 1.228) (resid 23 and name HB1) do (store1 = 178.977) (resid 23 and name C) do (store1 = 113.365) (resid 24 and name N) do (store1 = 7.981) (resid 24 and name HN) do (store1 = 61.578) (resid 24 and name CA) do (store1 = 61.726) (resid 24 and name CB) do (store1 = 3.147) (resid 24 and name HB1) do (store1 = 175.780) (resid 24 and name C) do (store1 = 109.466) (resid 25 and name N) do (store1 = 8.332) (resid 25 and name HN) do (store1 = 47.303) (resid 25 and name CA) do (store1 = 3.847) (resid 25 and name HA2) do (store1 = 3.475) (resid 25 and name HA1) do (store1 = 176.493) (resid 25 and name C) do (store1 = 122.434) (resid 26 and name N) do (store1 = 8.384) (resid 26 and name HN) do (store1 = 66.903) (resid 26 and name CA) do (store1 = 3.474) (resid 26 and name HA) do (store1 = 31.380) (resid 26 and name CB) do (store1 = 2.262) (resid 26 and name HB) do (store1 = 25.332) (resid 26 and name CG2) do (store1 = 1.385) (resid 26 and name HG21) do (store1 = 22.907) (resid 26 and name CG1) do (store1 = 0.934) (resid 26 and name HG11) do (store1 = 181.109) (resid 26 and name C) do (store1 = 120.461) (resid 27 and name N) do (store1 = 7.860) (resid 27 and name HN) do (store1 = 54.884) (resid 27 and name CA) do (store1 = 3.947) (resid 27 and name HA) do (store1 = 18.630) (resid 27 and name CB) do (store1 = 1.335) (resid 27 and name HB1) do (store1 = 180.262) (resid 27 and name C) do (store1 = 118.953) (resid 28 and name N) do (store1 = 8.055) (resid 28 and name HN) do (store1 = 58.981) (resid 28 and name CA) do (store1 = 3.693) (resid 28 and name HA) do (store1 = 37.410) (resid 28 and name CB) do (store1 = 2.936) (resid 28 and name HB2) do (store1 = 2.616) (resid 28 and name HB1) do (store1 = 132.754) (resid 28 and name CD1) do (store1 = 6.780) (resid 28 and name HD1) do (store1 = 116.882) (resid 28 and name CE1) do (store1 = 6.435) (resid 28 and name HE1) do (store1 = 176.888) (resid 28 and name C) do (store1 = 117.451) (resid 29 and name N) do (store1 = 7.882) (resid 29 and name HN) do (store1 = 61.550) (resid 29 and name CA) do (store1 = 3.554) (resid 29 and name HA) do (store1 = 32.002) (resid 29 and name CB) do (store1 = 1.889) (resid 29 and name HB1) do (store1 = 178.639) (resid 29 and name C) do (store1 = 116.693) (resid 30 and name N) do (store1 = 8.529) (resid 30 and name HN) do (store1 = 59.170) (resid 30 and name CA) do (store1 = 4.053) (resid 30 and name HA) do (store1 = 29.894) (resid 30 and name CB) do (store1 = 1.872) (resid 30 and name HB1) do (store1 = 36.955) (resid 30 and name CG) do (store1 = 2.112) (resid 30 and name HG1) do (store1 = 176.913) (resid 30 and name C) do (store1 = 120.461) (resid 31 and name N) do (store1 = 7.860) (resid 31 and name HN) do (store1 = 57.505) (resid 31 and name CA) do (store1 = 4.147) (resid 31 and name HA) do (store1 = 29.575) (resid 31 and name CB) do (store1 = 2.066) (resid 31 and name HB1) do (store1 = 26.767) (resid 31 and name CG) do (store1 = 1.823) (resid 31 and name HG1) do (store1 = 43.185) (resid 31 and name CD) do (store1 = 3.102) (resid 31 and name HD1) do (store1 = 177.328) (resid 31 and name C) do (store1 = 117.844) (resid 32 and name N) do (store1 = 7.730) (resid 32 and name HN) do (store1 = 54.427) (resid 32 and name CA) do (store1 = 4.146) (resid 32 and name HA) do (store1 = 42.094) (resid 32 and name CB) do (store1 = 1.544) (resid 32 and name HB2) do (store1 = 27.401) (resid 32 and name CG) do (store1 = 1.237) (resid 32 and name HG) do (store1 = 22.754) (resid 32 and name CD1) do (store1 = 0.590) (resid 32 and name HD11) do (store1 = 25.047) (resid 32 and name CD2) do (store1 = 0.134) (resid 32 and name HD21) do (store1 = 175.885) (resid 32 and name C) do (store1 = 115.705) (resid 33 and name N) do (store1 = 7.855) (resid 33 and name HN) do (store1 = 54.429) (resid 33 and name CA) do (store1 = 4.291) (resid 33 and name HA) do (store1 = 37.080) (resid 33 and name CB) do (store1 = 3.157) (resid 33 and name HB2) do (store1 = 2.801) (resid 33 and name HB1) do (store1 = 112.000) (resid 33 and name ND2) do (store1 = 6.763) (resid 33 and name HD21) do (store1 = 7.473) (resid 33 and name HD22) do (store1 = 174.369) (resid 33 and name C) do (store1 = 122.282) (resid 34 and name N) do (store1 = 8.615) (resid 34 and name HN) do (store1 = 58.843) (resid 34 and name CA) do (store1 = 4.421) (resid 34 and name HA) do (store1 = 39.703) (resid 34 and name CB) do (store1 = 1.529) (resid 34 and name HB) do (store1 = 14.351) (resid 34 and name CD1) do (store1 = 0.965) (resid 34 and name HD11) do (store1 = 16.964) (resid 34 and name CG2) do (store1 = 1.002) (resid 34 and name HG21) do (store1 = 64.753) (resid 35 and name CA) do (store1 = 4.172) (resid 35 and name HA) do (store1 = 32.042) (resid 35 and name CB) do (store1 = 2.189) (resid 35 and name HB2) do (store1 = 2.105) (resid 35 and name HB1) do (store1 = 27.766) (resid 35 and name CG) do (store1 = 1.890) (resid 35 and name HG1) do (store1 = 51.225) (resid 35 and name CD) do (store1 = 3.949) (resid 35 and name HD1) do (store1 = 175.931) (resid 35 and name C) do (store1 = 121.744) (resid 36 and name N) do (store1 = 7.738) (resid 36 and name HN) do (store1 = 61.168) (resid 36 and name CA) do (store1 = 4.230) (resid 36 and name HA) do (store1 = 32.570) (resid 36 and name CB) do (store1 = 2.324) (resid 36 and name HB) do (store1 = 23.078) (resid 36 and name CG2) do (store1 = 0.994) (resid 36 and name HG21) do (store1 = 20.063) (resid 36 and name CG1) do (store1 = 1.008) (resid 36 and name HG11) do (store1 = 172.040) (resid 36 and name C) do (store1 = 127.731) (resid 37 and name N) do (store1 = 8.594) (resid 37 and name HN) do (store1 = 59.570) (resid 37 and name CA) do (store1 = 4.468) (resid 37 and name HA) do (store1 = 37.786) (resid 37 and name CB) do (store1 = 1.921) (resid 37 and name HB) do (store1 = 26.629) (resid 37 and name CG1) do (store1 = 1.475) (resid 37 and name HG11) do (store1 = 12.631) (resid 37 and name CD1) do (store1 = 0.852) (resid 37 and name HD11) do (store1 = 18.470) (resid 37 and name CG2) do (store1 = 1.021) (resid 37 and name HG21) do (store1 = 176.937) (resid 37 and name C) do (store1 = 132.313) (resid 38 and name N) do (store1 = 9.329) (resid 38 and name HN) do (store1 = 56.936) (resid 38 and name CA) do (store1 = 3.879) (resid 38 and name HA) do (store1 = 18.924) (resid 38 and name CB) do (store1 = 1.498) (resid 38 and name HB1) do (store1 = 178.881) (resid 38 and name C) do (store1 = 114.961) (resid 39 and name N) do (store1 = 9.332) (resid 39 and name HN) do (store1 = 59.926) (resid 39 and name CA) do (store1 = 4.021) (resid 39 and name HA) do (store1 = 29.328) (resid 39 and name CB) do (store1 = 2.053) (resid 39 and name HB1) do (store1 = 36.820) (resid 39 and name CG) do (store1 = 2.423) (resid 39 and name HG2) do (store1 = 2.286) (resid 39 and name HG1) do (store1 = 178.604) (resid 39 and name C) do (store1 = 117.853) (resid 40 and name N) do (store1 = 7.188) (resid 40 and name HN) do (store1 = 58.035) (resid 40 and name CA) do (store1 = 4.019) (resid 40 and name HA) do (store1 = 28.280) (resid 40 and name CB) do (store1 = 2.035) (resid 40 and name HB1) do (store1 = 33.811) (resid 40 and name CG) do (store1 = 2.349) (resid 40 and name HG1) do (store1 = 112.052) (resid 40 and name NE2) do (store1 = 6.828) (resid 40 and name HE21) do (store1 = 7.629) (resid 40 and name HE22) do (store1 = 178.082) (resid 40 and name C) do (store1 = 120.368) (resid 41 and name N) do (store1 = 7.531) (resid 41 and name HN) do (store1 = 65.987) (resid 41 and name CA) do (store1 = 3.512) (resid 41 and name HA) do (store1 = 31.406) (resid 41 and name CB) do (store1 = 22.675) (resid 41 and name CG2) do (store1 = 0.723) (resid 41 and name HG21) do (store1 = 22.286) (resid 41 and name CG1) do (store1 = 0.952) (resid 41 and name HG11) do (store1 = 179.839) (resid 41 and name C) do (store1 = 122.465) (resid 42 and name N) do (store1 = 8.452) (resid 42 and name HN) do (store1 = 55.310) (resid 42 and name CA) do (store1 = 2.895) (resid 42 and name HA) do (store1 = 18.743) (resid 42 and name CB) do (store1 = 1.449) (resid 42 and name HB1) do (store1 = 179.452) (resid 42 and name C) do (store1 = 113.319) (resid 43 and name N) do (store1 = 6.988) (resid 43 and name HN) do (store1 = 58.168) (resid 43 and name CA) do (store1 = 3.871) (resid 43 and name HA) do (store1 = 30.110) (resid 43 and name CB) do (store1 = 1.926) (resid 43 and name HB1) do (store1 = 28.102) (resid 43 and name CG) do (store1 = 1.711) (resid 43 and name HG1) do (store1 = 43.571) (resid 43 and name CD) do (store1 = 3.195) (resid 43 and name HD1) do (store1 = 176.601) (resid 43 and name C) do (store1 = 115.884) (resid 44 and name N) do (store1 = 7.286) (resid 44 and name HN) do (store1 = 55.744) (resid 44 and name CA) do (store1 = 4.293) (resid 44 and name HA) do (store1 = 29.487) (resid 44 and name CB) do (store1 = 1.925) (resid 44 and name HB1) do (store1 = 35.681) (resid 44 and name CG) do (store1 = 2.445) (resid 44 and name HG2) do (store1 = 2.289) (resid 44 and name HG1) do (store1 = 176.953) (resid 44 and name C) do (store1 = 118.081) (resid 45 and name N) do (store1 = 7.356) (resid 45 and name HN) do (store1 = 52.187) (resid 45 and name CA) do (store1 = 4.431) (resid 45 and name HA) do (store1 = 25.405) (resid 45 and name CB) do (store1 = 63.243) (resid 46 and name CA) do (store1 = 4.343) (resid 46 and name HA) do (store1 = 32.030) (resid 46 and name CB) do (store1 = 2.466) (resid 46 and name HB2) do (store1 = 1.800) (resid 46 and name HB1) do (store1 = 28.299) (resid 46 and name CG) do (store1 = 2.079) (resid 46 and name HG2) do (store1 = 1.974) (resid 46 and name HG1) do (store1 = 50.332) (resid 46 and name CD) do (store1 = 3.830) (resid 46 and name HD1) do (store1 = 178.433) (resid 46 and name C) do (store1 = 124.195) (resid 47 and name N) do (store1 = 8.902) (resid 47 and name HN) do (store1 = 60.588) (resid 47 and name CA) do (store1 = 3.648) (resid 47 and name HA) do (store1 = 29.980) (resid 47 and name CB) do (store1 = 2.077) (resid 47 and name HB1) do (store1 = 36.001) (resid 47 and name CG) do (store1 = 2.308) (resid 47 and name HG1) do (store1 = 177.909) (resid 47 and name C) do (store1 = 113.761) (resid 48 and name N) do (store1 = 8.912) (resid 48 and name HN) do (store1 = 54.532) (resid 48 and name CA) do (store1 = 4.665) (resid 48 and name HA) do (store1 = 36.981) (resid 48 and name CB) do (store1 = 2.955) (resid 48 and name HB2) do (store1 = 2.852) (resid 48 and name HB1) do (store1 = 113.210) (resid 48 and name ND2) do (store1 = 7.366) (resid 48 and name HD21) do (store1 = 7.744) (resid 48 and name HD22) do (store1 = 176.052) (resid 48 and name C) do (store1 = 119.251) (resid 49 and name N) do (store1 = 8.269) (resid 49 and name HN) do (store1 = 53.987) (resid 49 and name CA) do (store1 = 5.053) (resid 49 and name HA) do (store1 = 44.186) (resid 49 and name CB) do (store1 = 2.159) (resid 49 and name HB2) do (store1 = 1.629) (resid 49 and name HB1) do (store1 = 27.093) (resid 49 and name CG) do (store1 = 0.910) (resid 49 and name HG) do (store1 = 23.139) (resid 49 and name CD1) do (store1 = 0.778) (resid 49 and name HD11) do (store1 = 176.625) (resid 49 and name C) do (store1 = 123.437) (resid 50 and name N) do (store1 = 7.528) (resid 50 and name HN) do (store1 = 61.547) (resid 50 and name CA) do (store1 = 3.978) (resid 50 and name HA) do (store1 = 29.553) (resid 50 and name CB) do (store1 = 1.934) (resid 50 and name HB1) do (store1 = 29.320) (resid 50 and name CG) do (store1 = 1.780) (resid 50 and name HG1) do (store1 = 44.025) (resid 50 and name CD) do (store1 = 3.146) (resid 50 and name HD1) do (store1 = 178.770) (resid 50 and name C) do (store1 = 116.669) (resid 51 and name N) do (store1 = 8.684) (resid 51 and name HN) do (store1 = 66.428) (resid 51 and name CA) do (store1 = 4.068) (resid 51 and name HA) do (store1 = 67.874) (resid 51 and name CB) do (store1 = 4.380) (resid 51 and name HB) do (store1 = 22.248) (resid 51 and name CG2) do (store1 = 1.305) (resid 51 and name HG21) do (store1 = 176.763) (resid 51 and name C) do (store1 = 124.969) (resid 52 and name N) do (store1 = 7.992) (resid 52 and name HN) do (store1 = 61.415) (resid 52 and name CA) do (store1 = 4.335) (resid 52 and name HA) do (store1 = 38.157) (resid 52 and name CB) do (store1 = 3.356) (resid 52 and name HB2) do (store1 = 3.038) (resid 52 and name HB1) do (store1 = 133.117) (resid 52 and name CD1) do (store1 = 7.161) (resid 52 and name HD1) do (store1 = 118.162) (resid 52 and name CE1) do (store1 = 6.958) (resid 52 and name HE1) do (store1 = 176.632) (resid 52 and name C) do (store1 = 118.705) (resid 53 and name N) do (store1 = 8.741) (resid 53 and name HN) do (store1 = 62.435) (resid 53 and name CA) do (store1 = 3.691) (resid 53 and name HA) do (store1 = 38.091) (resid 53 and name CB) do (store1 = 3.536) (resid 53 and name HB2) do (store1 = 3.233) (resid 53 and name HB1) do (store1 = 131.763) (resid 53 and name CD1) do (store1 = 7.273) (resid 53 and name HD1) do (store1 = 131.282) (resid 53 and name CE1) do (store1 = 7.105) (resid 53 and name HE1) do (store1 = 176.029) (resid 53 and name C) do (store1 = 116.050) (resid 54 and name N) do (store1 = 7.751) (resid 54 and name HN) do (store1 = 56.669) (resid 54 and name CA) do (store1 = 4.219) (resid 54 and name HA) do (store1 = 30.475) (resid 54 and name CB) do (store1 = 32.355) (resid 54 and name CG) do (store1 = 2.925) (resid 54 and name HG1) do (store1 = 178.988) (resid 54 and name C) do (store1 = 121.985) (resid 55 and name N) do (store1 = 8.279) (resid 55 and name HN) do (store1 = 59.376) (resid 55 and name CA) do (store1 = 3.951) (resid 55 and name HA) do (store1 = 29.481) (resid 55 and name CB) do (store1 = 2.152) (resid 55 and name HB2) do (store1 = 2.015) (resid 55 and name HB1) do (store1 = 36.200) (resid 55 and name CG) do (store1 = 2.386) (resid 55 and name HG2) do (store1 = 2.143) (resid 55 and name HG1) do (store1 = 180.267) (resid 55 and name C) do (store1 = 118.384) (resid 56 and name N) do (store1 = 8.424) (resid 56 and name HN) do (store1 = 55.883) (resid 56 and name CA) do (store1 = 3.664) (resid 56 and name HA) do (store1 = 27.027) (resid 56 and name CB) do (store1 = 1.836) (resid 56 and name HB1) do (store1 = 23.431) (resid 56 and name CG) do (store1 = 1.567) (resid 56 and name HG1) do (store1 = 2.788) (resid 56 and name HD1) do (store1 = 177.438) (resid 56 and name C) do (store1 = 121.553) (resid 57 and name N) do (store1 = 8.752) (resid 57 and name HN) do (store1 = 58.561) (resid 57 and name CA) do (store1 = 3.894) (resid 57 and name HA) do (store1 = 41.342) (resid 57 and name CB) do (store1 = 1.819) (resid 57 and name HB1) do (store1 = 27.103) (resid 57 and name CG) do (store1 = 0.898) (resid 57 and name HG) do (store1 = 23.873) (resid 57 and name CD1) do (store1 = 0.772) (resid 57 and name HD11) do (store1 = 178.097) (resid 57 and name C) do (store1 = 118.197) (resid 58 and name N) do (store1 = 8.046) (resid 58 and name HN) do (store1 = 60.280) (resid 58 and name CA) do (store1 = 3.865) (resid 58 and name HA) do (store1 = 29.914) (resid 58 and name CB) do (store1 = 1.895) (resid 58 and name HB1) do (store1 = 27.828) (resid 58 and name CG) do (store1 = 1.571) (resid 58 and name HG1) do (store1 = 43.630) (resid 58 and name CD) do (store1 = 3.210) (resid 58 and name HD1) do (store1 = 178.809) (resid 58 and name C) do (store1 = 119.039) (resid 59 and name N) do (store1 = 7.394) (resid 59 and name HN) do (store1 = 59.553) (resid 59 and name CA) do (store1 = 4.246) (resid 59 and name HA) do (store1 = 29.575) (resid 59 and name CB) do (store1 = 3.057) (resid 59 and name HB2) do (store1 = 2.890) (resid 59 and name HB1) do (store1 = 118.853) (resid 59 and name CD2) do (store1 = 138.639) (resid 59 and name CE1) do (store1 = 7.776) (resid 59 and name HE1) do (store1 = 12.208) (resid 59 and name HD1) do (store1 = 177.425) (resid 59 and name C) do (store1 = 117.205) (resid 60 and name N) do (store1 = 8.697) (resid 60 and name HN) do (store1 = 61.600) (resid 60 and name CA) do (store1 = 4.233) (resid 60 and name HA) do (store1 = 38.312) (resid 60 and name CB) do (store1 = 2.998) (resid 60 and name HB2) do (store1 = 2.617) (resid 60 and name HB1) do (store1 = 117.824) (resid 60 and name CE1) do (store1 = 6.903) (resid 60 and name HE1) do (store1 = 180.473) (resid 60 and name C) do (store1 = 122.770) (resid 61 and name N) do (store1 = 9.158) (resid 61 and name HN) do (store1 = 59.952) (resid 61 and name CA) do (store1 = 31.145) (resid 61 and name CB) do (store1 = 1.881) (resid 61 and name HB1) do (store1 = 27.213) (resid 61 and name CG) do (store1 = 44.552) (resid 61 and name CD) do (store1 = 2.933) (resid 61 and name HD1) do (store1 = 179.353) (resid 61 and name C) do (store1 = 118.738) (resid 62 and name N) do (store1 = 7.603) (resid 62 and name HN) do (store1 = 58.188) (resid 62 and name CA) do (store1 = 4.107) (resid 62 and name HA) do (store1 = 28.149) (resid 62 and name CB) do (store1 = 2.198) (resid 62 and name HB1) do (store1 = 33.806) (resid 62 and name CG) do (store1 = 2.522) (resid 62 and name HG2) do (store1 = 2.403) (resid 62 and name HG1) do (store1 = 111.796) (resid 62 and name NE2) do (store1 = 6.830) (resid 62 and name HE21) do (store1 = 7.399) (resid 62 and name HE22) do (store1 = 178.500) (resid 62 and name C) do (store1 = 119.078) (resid 63 and name N) do (store1 = 7.616) (resid 63 and name HN) do (store1 = 56.860) (resid 63 and name CA) do (store1 = 4.081) (resid 63 and name HA) do (store1 = 41.791) (resid 63 and name CB) do (store1 = 1.776) (resid 63 and name HB2) do (store1 = 1.545) (resid 63 and name HB1) do (store1 = 25.762) (resid 63 and name CG) do (store1 = 1.555) (resid 63 and name HG) do (store1 = 23.150) (resid 63 and name CD1) do (store1 = 0.794) (resid 63 and name HD11) do (store1 = 178.363) (resid 63 and name C) do (store1 = 112.818) (resid 64 and name N) do (store1 = 7.753) (resid 64 and name HN) do (store1 = 60.165) (resid 64 and name CA) do (store1 = 4.276) (resid 64 and name HA) do (store1 = 63.257) (resid 64 and name CB) do (store1 = 4.141) (resid 64 and name HB2) do (store1 = 4.017) (resid 64 and name HB1) do (store1 = 174.625) (resid 64 and name C) do (store1 = 121.516) (resid 65 and name N) do (store1 = 7.475) (resid 65 and name HN) do (store1 = 55.949) (resid 65 and name CA) do (store1 = 4.263) (resid 65 and name HA) do (store1 = 41.789) (resid 65 and name CB) do (store1 = 1.795) (resid 65 and name HB1) do (store1 = 26.951) (resid 65 and name CG) do (store1 = 1.640) (resid 65 and name HG) do (store1 = 22.966) (resid 65 and name CD1) do (store1 = 0.915) (resid 65 and name HD11) do (store1 = 25.166) (resid 65 and name CD2) do (store1 = 0.965) (resid 65 and name HD21) do (store1 = 177.383) (resid 65 and name C) do (store1 = 117.813) (resid 66 and name N) do (store1 = 7.918) (resid 66 and name HN) do (store1 = 55.778) (resid 66 and name CA) do (store1 = 4.318) (resid 66 and name HA) do (store1 = 29.461) (resid 66 and name CB) do (store1 = 2.178) (resid 66 and name HB2) do (store1 = 2.025) (resid 66 and name HB1) do (store1 = 33.869) (resid 66 and name CG) do (store1 = 2.386) (resid 66 and name HG1) do (store1 = 111.997) (resid 66 and name NE2) do (store1 = 6.911) (resid 66 and name HE21) do (store1 = 7.512) (resid 66 and name HE22) do (store1 = 175.767) (resid 66 and name C) do (store1 = 123.176) (resid 67 and name N) do (store1 = 8.055) (resid 67 and name HN) do (store1 = 52.794) (resid 67 and name CA) do (store1 = 4.641) (resid 67 and name HA) do (store1 = 41.741) (resid 67 and name CB) do (store1 = 1.815) (resid 67 and name HB1) do (store1 = 23.399) (resid 67 and name CD1) do (store1 = 0.889) (resid 67 and name HD11) do (store1 = 25.688) (resid 67 and name CD2) do (store1 = 0.968) (resid 67 and name HD21) do (store1 = 62.907) (resid 68 and name CA) do (store1 = 4.432) (resid 68 and name HA) do (store1 = 32.189) (resid 68 and name CB) do (store1 = 2.310) (resid 68 and name HB2) do (store1 = 1.888) (resid 68 and name HB1) do (store1 = 27.584) (resid 68 and name CG) do (store1 = 2.037) (resid 68 and name HG1) do (store1 = 50.521) (resid 68 and name CD) do (store1 = 3.882) (resid 68 and name HD2) do (store1 = 3.587) (resid 68 and name HD1) do (store1 = 176.447) (resid 68 and name C) do (store1 = 121.700) (resid 69 and name N) do (store1 = 8.431) (resid 69 and name HN) do (store1 = 56.379) (resid 69 and name CA) do (store1 = 4.259) (resid 69 and name HA) do (store1 = 33.307) (resid 69 and name CB) do (store1 = 1.826) (resid 69 and name HB2) do (store1 = 1.738) (resid 69 and name HB1) do (store1 = 24.824) (resid 69 and name CG) do (store1 = 1.501) (resid 69 and name HG1) do (store1 = 29.343) (resid 69 and name CD) do (store1 = 1.738) (resid 69 and name HD1) do (store1 = 42.216) (resid 69 and name CE) do (store1 = 3.031) (resid 69 and name HE1) do (store1 = 177.454) (resid 69 and name C) do (store1 = 110.242) (resid 70 and name N) do (store1 = 8.469) (resid 70 and name HN) do (store1 = 45.150) (resid 70 and name CA) do (store1 = 3.961) (resid 70 and name HA1) do (store1 = 173.699) (resid 70 and name C) do (store1 = 114.789) (resid 71 and name N) do (store1 = 8.172) (resid 71 and name HN) do (store1 = 58.084) (resid 71 and name CA) do (store1 = 4.489) (resid 71 and name HA) do (store1 = 64.002) (resid 71 and name CB) do (store1 = 3.844) (resid 71 and name HB1) do (store1 = 173.874) (resid 71 and name C) do (store1 = 123.748) (resid 72 and name N) do (store1 = 8.357) (resid 72 and name HN) do (store1 = 52.465) (resid 72 and name CA) do (store1 = 4.885) (resid 72 and name HA) do (store1 = 41.510) (resid 72 and name CB) do (store1 = 2.780) (resid 72 and name HB2) do (store1 = 2.562) (resid 72 and name HB1) do (store1 = 63.706) (resid 73 and name CA) do (store1 = 4.380) (resid 73 and name HA) do (store1 = 32.062) (resid 73 and name CB) do (store1 = 2.285) (resid 73 and name HB2) do (store1 = 1.884) (resid 73 and name HB1) do (store1 = 27.236) (resid 73 and name CG) do (store1 = 2.012) (resid 73 and name HG1) do (store1 = 50.927) (resid 73 and name CD) do (store1 = 3.908) (resid 73 and name HD2) do (store1 = 3.808) (resid 73 and name HD1) do (store1 = 176.923) (resid 73 and name C) do (store1 = 122.590) (resid 74 and name N) do (store1 = 8.453) (resid 74 and name HN) do (store1 = 52.803) (resid 74 and name CA) do (store1 = 4.223) (resid 74 and name HA) do (store1 = 18.809) (resid 74 and name CB) do (store1 = 1.282) (resid 74 and name HB1) do (store1 = 177.744) (resid 74 and name C) do (store1 = 118.403) (resid 75 and name N) do (store1 = 7.855) (resid 75 and name HN) do (store1 = 57.924) (resid 75 and name CA) do (store1 = 4.530) (resid 75 and name HA) do (store1 = 38.701) (resid 75 and name CB) do (store1 = 3.092) (resid 75 and name HB2) do (store1 = 2.977) (resid 75 and name HB1) do (store1 = 133.202) (resid 75 and name CD1) do (store1 = 7.116) (resid 75 and name HD1) do (store1 = 118.172) (resid 75 and name CE1) do (store1 = 6.815) (resid 75 and name HE1) do (store1 = 175.592) (resid 75 and name C) do (store1 = 122.265) (resid 76 and name N) do (store1 = 8.057) (resid 76 and name HN) do (store1 = 55.518) (resid 76 and name CA) do (store1 = 4.294) (resid 76 and name HA) do (store1 = 29.566) (resid 76 and name CB) do (store1 = 2.067) (resid 76 and name HB2) do (store1 = 1.930) (resid 76 and name HB1) do (store1 = 33.635) (resid 76 and name CG) do (store1 = 2.282) (resid 76 and name HG1) do (store1 = 112.429) (resid 76 and name NE2) do (store1 = 6.829) (resid 76 and name HE21) do (store1 = 7.531) (resid 76 and name HE22) do (store1 = 175.338) (resid 76 and name C) do (store1 = 122.786) (resid 77 and name N) do (store1 = 8.208) (resid 77 and name HN) do (store1 = 56.379) (resid 77 and name CA) do (store1 = 4.259) (resid 77 and name HA) do (store1 = 33.194) (resid 77 and name CB) do (store1 = 1.828) (resid 77 and name HB1) do (store1 = 24.626) (resid 77 and name CG) do (store1 = 1.433) (resid 77 and name HG1) do (store1 = 29.208) (resid 77 and name CD) do (store1 = 1.736) (resid 77 and name HD1) do (store1 = 42.177) (resid 77 and name CE) do (store1 = 3.021) (resid 77 and name HE1) do (store1 = 176.245) (resid 77 and name C) do (store1 = 121.804) (resid 78 and name N) do (store1 = 8.382) (resid 78 and name HN) do (store1 = 54.347) (resid 78 and name CA) do (store1 = 4.601) (resid 78 and name HA) do (store1 = 41.282) (resid 78 and name CB) do (store1 = 2.729) (resid 78 and name HB2) do (store1 = 2.623) (resid 78 and name HB1) do (store1 = 176.040) (resid 78 and name C) do (store1 = 121.156) (resid 79 and name N) do (store1 = 8.276) (resid 79 and name HN) do (store1 = 54.311) (resid 79 and name CA) do (store1 = 4.554) (resid 79 and name HA) do (store1 = 41.112) (resid 79 and name CB) do (store1 = 2.644) (resid 79 and name HB1) do (store1 = 176.139) (resid 79 and name C) do (store1 = 123.518) (resid 80 and name N) do (store1 = 8.145) (resid 80 and name HN) do (store1 = 52.831) (resid 80 and name CA) do (store1 = 2.852) (resid 80 and name HA) do (store1 = 19.341) (resid 80 and name CB) do (store1 = 177.787) (resid 80 and name C) do (store1 = 119.061) (resid 81 and name N) do (store1 = 7.949) (resid 81 and name HN) do (store1 = 62.320) (resid 81 and name CA) do (store1 = 4.040) (resid 81 and name HA) do (store1 = 32.547) (resid 81 and name CB) do (store1 = 2.067) (resid 81 and name HB) do (store1 = 21.042) (resid 81 and name CG1) do (store1 = 0.945) (resid 81 and name HG11) do (store1 = 175.979) (resid 81 and name C) do (store1 = 126.314) (resid 82 and name N) do (store1 = 8.312) (resid 82 and name HN) do (store1 = 56.221) (resid 82 and name CA) do (store1 = 4.351) (resid 82 and name HA) do (store1 = 32.960) (resid 82 and name CB) do (store1 = 1.841) (resid 82 and name HB1) do (store1 = 24.680) (resid 82 and name CG) do (store1 = 1.447) (resid 82 and name HG1) do (store1 = 29.110) (resid 82 and name CD) do (store1 = 1.722) (resid 82 and name HD1) do (store1 = 42.264) (resid 82 and name CE) do (store1 = 3.015) (resid 82 and name HE1) do (store1 = 175.432) (resid 82 and name C) do (store1 = 128.907) (resid 83 and name N) do (store1 = 7.993) (resid 83 and name HN) do (store1 = 57.681) (resid 83 and name CA) do (store1 = 33.748) (resid 83 and name CB)
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