Louis BECQUEY

Modified couple of GMM n modes

...@@ -55,7 +55,7 @@ modes_data = { ...@@ -55,7 +55,7 @@ modes_data = {
55 "P-O5'-C5'":2, "O5'-C5'-C4'":1, "C5'-C4'-P":2, "C5'-C4'-C1'":2, "C4'-P-O5'":2, "C4'-C1'-B1":2, "C1'-C4'-P":2, "C1'-B1-B2":2, 55 "P-O5'-C5'":2, "O5'-C5'-C4'":1, "C5'-C4'-P":2, "C5'-C4'-C1'":2, "C4'-P-O5'":2, "C4'-C1'-B1":2, "C1'-C4'-P":2, "C1'-B1-B2":2,
56 56
57 # HiRE-RNA, torsions 57 # HiRE-RNA, torsions
58 - "P-O5'-C5'-C4'":1, "O5'-C5'-C4'-P°":3, "O5'-C5'-C4'-C1'":3, "C5'-C4'-P°-O5'°":3, "C5'-C4'-C1'-B1":2, "C4'-P°-O5'°-C5'°":3, "C4'-C1'-B1-B2":3, "C1'-C4'-P°-O5'°":3, 58 + "P-O5'-C5'-C4'":3, "O5'-C5'-C4'-P°":3, "O5'-C5'-C4'-C1'":3, "C5'-C4'-P°-O5'°":3, "C5'-C4'-C1'-B1":2, "C4'-P°-O5'°-C5'°":3, "C4'-C1'-B1-B2":3, "C1'-C4'-P°-O5'°":3,
59 59
60 # HiRE-RNA, basepairs 60 # HiRE-RNA, basepairs
61 "cWW_AA_tips_distance":3, "cWW_AA_C1'-B1-B1pair":1, "cWW_AA_B1-B1pair-C1'pair":1, "cWW_AA_C4'-C1'-B1-B1pair":2, "cWW_AA_B1-B1pair-C1'pair-C4'pair":3, "cWW_AA_alpha_1":2, "cWW_AA_alpha_2":3, "cWW_AA_dB1":3, "cWW_AA_dB2":3, 61 "cWW_AA_tips_distance":3, "cWW_AA_C1'-B1-B1pair":1, "cWW_AA_B1-B1pair-C1'pair":1, "cWW_AA_C4'-C1'-B1-B1pair":2, "cWW_AA_B1-B1pair-C1'pair-C4'pair":3, "cWW_AA_alpha_1":2, "cWW_AA_alpha_2":3, "cWW_AA_dB1":3, "cWW_AA_dB2":3,
...@@ -172,7 +172,7 @@ modes_data = { ...@@ -172,7 +172,7 @@ modes_data = {
172 "tWH_CG_tips_distance":4, "tWH_CG_C1'-B1-B1pair":2, "tWH_CG_B1-B1pair-C1'pair":1, "tWH_CG_C4'-C1'-B1-B1pair":2, "tWH_CG_B1-B1pair-C1'pair-C4'pair":3, "tWH_CG_alpha_1":2, "tWH_CG_alpha_2":1, "tWH_CG_dB1":3, "tWH_CG_dB2":2, 172 "tWH_CG_tips_distance":4, "tWH_CG_C1'-B1-B1pair":2, "tWH_CG_B1-B1pair-C1'pair":1, "tWH_CG_C4'-C1'-B1-B1pair":2, "tWH_CG_B1-B1pair-C1'pair-C4'pair":3, "tWH_CG_alpha_1":2, "tWH_CG_alpha_2":1, "tWH_CG_dB1":3, "tWH_CG_dB2":2,
173 "cHW_CG_tips_distance":3, "cHW_CG_C1'-B1-B1pair":2, "cHW_CG_B1-B1pair-C1'pair":2, "cHW_CG_C4'-C1'-B1-B1pair":1, "cHW_CG_B1-B1pair-C1'pair-C4'pair":2, "cHW_CG_alpha_1":1, "cHW_CG_alpha_2":2, "cHW_CG_dB1":2, "cHW_CG_dB2":2, 173 "cHW_CG_tips_distance":3, "cHW_CG_C1'-B1-B1pair":2, "cHW_CG_B1-B1pair-C1'pair":2, "cHW_CG_C4'-C1'-B1-B1pair":1, "cHW_CG_B1-B1pair-C1'pair-C4'pair":2, "cHW_CG_alpha_1":1, "cHW_CG_alpha_2":2, "cHW_CG_dB1":2, "cHW_CG_dB2":2,
174 "tHW_CG_tips_distance":5, "tHW_CG_C1'-B1-B1pair":1, "tHW_CG_B1-B1pair-C1'pair":2, "tHW_CG_C4'-C1'-B1-B1pair":1, "tHW_CG_B1-B1pair-C1'pair-C4'pair":2, "tHW_CG_alpha_1":3, "tHW_CG_alpha_2":2, "tHW_CG_dB1":4, "tHW_CG_dB2":3, 174 "tHW_CG_tips_distance":5, "tHW_CG_C1'-B1-B1pair":1, "tHW_CG_B1-B1pair-C1'pair":2, "tHW_CG_C4'-C1'-B1-B1pair":1, "tHW_CG_B1-B1pair-C1'pair-C4'pair":2, "tHW_CG_alpha_1":3, "tHW_CG_alpha_2":2, "tHW_CG_dB1":4, "tHW_CG_dB2":3,
175 - "cWS_CG_tips_distance":2, "cWS_CG_C1'-B1-B1pair":1, "cWS_CG_B1-B1pair-C1'pair":1, "cWS_CG_C4'-C1'-B1-B1pair":1, "cWS_CG_B1-B1pair-C1'pair-C4'pair":1, "cWS_CG_alpha_1":1, "cWS_CG_alpha_2":2, "cWS_CG_dB1":2, "cWS_CG_dB2":3, 175 + "cWS_CG_tips_distance":2, "cWS_CG_C1'-B1-B1pair":1, "cWS_CG_B1-B1pair-C1'pair":1, "cWS_CG_C4'-C1'-B1-B1pair":2, "cWS_CG_B1-B1pair-C1'pair-C4'pair":1, "cWS_CG_alpha_1":1, "cWS_CG_alpha_2":2, "cWS_CG_dB1":2, "cWS_CG_dB2":3,
176 "tWS_CG_tips_distance":2, "tWS_CG_C1'-B1-B1pair":3, "tWS_CG_B1-B1pair-C1'pair":1, "tWS_CG_C4'-C1'-B1-B1pair":2, "tWS_CG_B1-B1pair-C1'pair-C4'pair":1, "tWS_CG_alpha_1":2, "tWS_CG_alpha_2":1, "tWS_CG_dB1":2, "tWS_CG_dB2":4, 176 "tWS_CG_tips_distance":2, "tWS_CG_C1'-B1-B1pair":3, "tWS_CG_B1-B1pair-C1'pair":1, "tWS_CG_C4'-C1'-B1-B1pair":2, "tWS_CG_B1-B1pair-C1'pair-C4'pair":1, "tWS_CG_alpha_1":2, "tWS_CG_alpha_2":1, "tWS_CG_dB1":2, "tWS_CG_dB2":4,
177 "cSW_CG_tips_distance":7, "cSW_CG_C1'-B1-B1pair":1, "cSW_CG_B1-B1pair-C1'pair":2, "cSW_CG_C4'-C1'-B1-B1pair":2, "cSW_CG_B1-B1pair-C1'pair-C4'pair":3, "cSW_CG_alpha_1":1, "cSW_CG_alpha_2":2, "cSW_CG_dB1":1, "cSW_CG_dB2":3, 177 "cSW_CG_tips_distance":7, "cSW_CG_C1'-B1-B1pair":1, "cSW_CG_B1-B1pair-C1'pair":2, "cSW_CG_C4'-C1'-B1-B1pair":2, "cSW_CG_B1-B1pair-C1'pair-C4'pair":3, "cSW_CG_alpha_1":1, "cSW_CG_alpha_2":2, "cSW_CG_dB1":1, "cSW_CG_dB2":3,
178 "tSW_CG_tips_distance":4, "tSW_CG_C1'-B1-B1pair":1, "tSW_CG_B1-B1pair-C1'pair":2, "tSW_CG_C4'-C1'-B1-B1pair":3, "tSW_CG_B1-B1pair-C1'pair-C4'pair":2, "tSW_CG_alpha_1":1, "tSW_CG_alpha_2":2, "tSW_CG_dB1":7, "tSW_CG_dB2":2, 178 "tSW_CG_tips_distance":4, "tSW_CG_C1'-B1-B1pair":1, "tSW_CG_B1-B1pair-C1'pair":2, "tSW_CG_C4'-C1'-B1-B1pair":3, "tSW_CG_B1-B1pair-C1'pair-C4'pair":2, "tSW_CG_alpha_1":1, "tSW_CG_alpha_2":2, "tSW_CG_dB1":7, "tSW_CG_dB2":2,
...@@ -190,7 +190,7 @@ modes_data = { ...@@ -190,7 +190,7 @@ modes_data = {
190 "tWH_CU_tips_distance":1, "tWH_CU_C1'-B1-B1pair":2, "tWH_CU_B1-B1pair-C1'pair":2, "tWH_CU_C4'-C1'-B1-B1pair":3, "tWH_CU_B1-B1pair-C1'pair-C4'pair":2, "tWH_CU_alpha_1":3, "tWH_CU_alpha_2":3, "tWH_CU_dB1":5, "tWH_CU_dB2":2, 190 "tWH_CU_tips_distance":1, "tWH_CU_C1'-B1-B1pair":2, "tWH_CU_B1-B1pair-C1'pair":2, "tWH_CU_C4'-C1'-B1-B1pair":3, "tWH_CU_B1-B1pair-C1'pair-C4'pair":2, "tWH_CU_alpha_1":3, "tWH_CU_alpha_2":3, "tWH_CU_dB1":5, "tWH_CU_dB2":2,
191 "cHW_CU_tips_distance":3, "cHW_CU_C1'-B1-B1pair":2, "cHW_CU_B1-B1pair-C1'pair":2, "cHW_CU_C4'-C1'-B1-B1pair":1, "cHW_CU_B1-B1pair-C1'pair-C4'pair":3, "cHW_CU_alpha_1":2, "cHW_CU_alpha_2":2, "cHW_CU_dB1":1, "cHW_CU_dB2":3, 191 "cHW_CU_tips_distance":3, "cHW_CU_C1'-B1-B1pair":2, "cHW_CU_B1-B1pair-C1'pair":2, "cHW_CU_C4'-C1'-B1-B1pair":1, "cHW_CU_B1-B1pair-C1'pair-C4'pair":3, "cHW_CU_alpha_1":2, "cHW_CU_alpha_2":2, "cHW_CU_dB1":1, "cHW_CU_dB2":3,
192 "tHW_CU_tips_distance":8, "tHW_CU_C1'-B1-B1pair":1, "tHW_CU_B1-B1pair-C1'pair":1, "tHW_CU_C4'-C1'-B1-B1pair":3, "tHW_CU_B1-B1pair-C1'pair-C4'pair":2, "tHW_CU_alpha_1":1, "tHW_CU_alpha_2":2, "tHW_CU_dB1":3, "tHW_CU_dB2":3, 192 "tHW_CU_tips_distance":8, "tHW_CU_C1'-B1-B1pair":1, "tHW_CU_B1-B1pair-C1'pair":1, "tHW_CU_C4'-C1'-B1-B1pair":3, "tHW_CU_B1-B1pair-C1'pair-C4'pair":2, "tHW_CU_alpha_1":1, "tHW_CU_alpha_2":2, "tHW_CU_dB1":3, "tHW_CU_dB2":3,
193 - "cWS_CU_tips_distance":4, "cWS_CU_C1'-B1-B1pair":1, "cWS_CU_B1-B1pair-C1'pair":2, "cWS_CU_C4'-C1'-B1-B1pair":2, "cWS_CU_B1-B1pair-C1'pair-C4'pair":2, "cWS_CU_alpha_1":3, "cWS_CU_alpha_2":2, "cWS_CU_dB1":4, "cWS_CU_dB2":2, 193 + "cWS_CU_tips_distance":4, "cWS_CU_C1'-B1-B1pair":1, "cWS_CU_B1-B1pair-C1'pair":2, "cWS_CU_C4'-C1'-B1-B1pair":3, "cWS_CU_B1-B1pair-C1'pair-C4'pair":2, "cWS_CU_alpha_1":3, "cWS_CU_alpha_2":2, "cWS_CU_dB1":4, "cWS_CU_dB2":2,
194 "tWS_CU_tips_distance":5, "tWS_CU_C1'-B1-B1pair":3, "tWS_CU_B1-B1pair-C1'pair":1, "tWS_CU_C4'-C1'-B1-B1pair":2, "tWS_CU_B1-B1pair-C1'pair-C4'pair":2, "tWS_CU_alpha_1":2, "tWS_CU_alpha_2":1, "tWS_CU_dB1":3, "tWS_CU_dB2":5, 194 "tWS_CU_tips_distance":5, "tWS_CU_C1'-B1-B1pair":3, "tWS_CU_B1-B1pair-C1'pair":1, "tWS_CU_C4'-C1'-B1-B1pair":2, "tWS_CU_B1-B1pair-C1'pair-C4'pair":2, "tWS_CU_alpha_1":2, "tWS_CU_alpha_2":1, "tWS_CU_dB1":3, "tWS_CU_dB2":5,
195 "cSW_CU_tips_distance":3, "cSW_CU_C1'-B1-B1pair":2, "cSW_CU_B1-B1pair-C1'pair":2, "cSW_CU_C4'-C1'-B1-B1pair":2, "cSW_CU_B1-B1pair-C1'pair-C4'pair":3, "cSW_CU_alpha_1":3, "cSW_CU_alpha_2":3, "cSW_CU_dB1":2, "cSW_CU_dB2":4, 195 "cSW_CU_tips_distance":3, "cSW_CU_C1'-B1-B1pair":2, "cSW_CU_B1-B1pair-C1'pair":2, "cSW_CU_C4'-C1'-B1-B1pair":2, "cSW_CU_B1-B1pair-C1'pair-C4'pair":3, "cSW_CU_alpha_1":3, "cSW_CU_alpha_2":3, "cSW_CU_dB1":2, "cSW_CU_dB2":4,
196 "tSW_CU_tips_distance":7, "tSW_CU_C1'-B1-B1pair":2, "tSW_CU_B1-B1pair-C1'pair":2, "tSW_CU_C4'-C1'-B1-B1pair":2, "tSW_CU_B1-B1pair-C1'pair-C4'pair":2, "tSW_CU_alpha_1":2, "tSW_CU_alpha_2":2, "tSW_CU_dB1":2, "tSW_CU_dB2":2, 196 "tSW_CU_tips_distance":7, "tSW_CU_C1'-B1-B1pair":2, "tSW_CU_B1-B1pair-C1'pair":2, "tSW_CU_C4'-C1'-B1-B1pair":2, "tSW_CU_B1-B1pair-C1'pair-C4'pair":2, "tSW_CU_alpha_1":2, "tSW_CU_alpha_2":2, "tSW_CU_dB1":2, "tSW_CU_dB2":2,
...@@ -203,7 +203,7 @@ modes_data = { ...@@ -203,7 +203,7 @@ modes_data = {
203 "cSS_CU_tips_distance":5, "cSS_CU_C1'-B1-B1pair":2, "cSS_CU_B1-B1pair-C1'pair":2, "cSS_CU_C4'-C1'-B1-B1pair":1, "cSS_CU_B1-B1pair-C1'pair-C4'pair":1, "cSS_CU_alpha_1":2, "cSS_CU_alpha_2":3, "cSS_CU_dB1":6, "cSS_CU_dB2":1, 203 "cSS_CU_tips_distance":5, "cSS_CU_C1'-B1-B1pair":2, "cSS_CU_B1-B1pair-C1'pair":2, "cSS_CU_C4'-C1'-B1-B1pair":1, "cSS_CU_B1-B1pair-C1'pair-C4'pair":1, "cSS_CU_alpha_1":2, "cSS_CU_alpha_2":3, "cSS_CU_dB1":6, "cSS_CU_dB2":1,
204 "tSS_CU_tips_distance":5, "tSS_CU_C1'-B1-B1pair":2, "tSS_CU_B1-B1pair-C1'pair":3, "tSS_CU_C4'-C1'-B1-B1pair":2, "tSS_CU_B1-B1pair-C1'pair-C4'pair":2, "tSS_CU_alpha_1":3, "tSS_CU_alpha_2":3, "tSS_CU_dB1":7, "tSS_CU_dB2":2, 204 "tSS_CU_tips_distance":5, "tSS_CU_C1'-B1-B1pair":2, "tSS_CU_B1-B1pair-C1'pair":3, "tSS_CU_C4'-C1'-B1-B1pair":2, "tSS_CU_B1-B1pair-C1'pair-C4'pair":2, "tSS_CU_alpha_1":3, "tSS_CU_alpha_2":3, "tSS_CU_dB1":7, "tSS_CU_dB2":2,
205 "cWW_GA_tips_distance":5, "cWW_GA_C1'-B1-B1pair":1, "cWW_GA_B1-B1pair-C1'pair":1, "cWW_GA_C4'-C1'-B1-B1pair":2, "cWW_GA_B1-B1pair-C1'pair-C4'pair":2, "cWW_GA_alpha_1":1, "cWW_GA_alpha_2":1, "cWW_GA_dB1":2, "cWW_GA_dB2":1, 205 "cWW_GA_tips_distance":5, "cWW_GA_C1'-B1-B1pair":1, "cWW_GA_B1-B1pair-C1'pair":1, "cWW_GA_C4'-C1'-B1-B1pair":2, "cWW_GA_B1-B1pair-C1'pair-C4'pair":2, "cWW_GA_alpha_1":1, "cWW_GA_alpha_2":1, "cWW_GA_dB1":2, "cWW_GA_dB2":1,
206 - "tWW_GA_tips_distance":6, "tWW_GA_C1'-B1-B1pair":1, "tWW_GA_B1-B1pair-C1'pair":1, "tWW_GA_C4'-C1'-B1-B1pair":1, "tWW_GA_B1-B1pair-C1'pair-C4'pair":2, "tWW_GA_alpha_1":1, "tWW_GA_alpha_2":2, "tWW_GA_dB1":1, "tWW_GA_dB2":2, 206 + "tWW_GA_tips_distance":6, "tWW_GA_C1'-B1-B1pair":1, "tWW_GA_B1-B1pair-C1'pair":1, "tWW_GA_C4'-C1'-B1-B1pair":1, "tWW_GA_B1-B1pair-C1'pair-C4'pair":2, "tWW_GA_alpha_1":2, "tWW_GA_alpha_2":2, "tWW_GA_dB1":1, "tWW_GA_dB2":2,
207 "cWH_GA_tips_distance":2, "cWH_GA_C1'-B1-B1pair":1, "cWH_GA_B1-B1pair-C1'pair":1, "cWH_GA_C4'-C1'-B1-B1pair":3, "cWH_GA_B1-B1pair-C1'pair-C4'pair":2, "cWH_GA_alpha_1":2, "cWH_GA_alpha_2":1, "cWH_GA_dB1":2, "cWH_GA_dB2":2, 207 "cWH_GA_tips_distance":2, "cWH_GA_C1'-B1-B1pair":1, "cWH_GA_B1-B1pair-C1'pair":1, "cWH_GA_C4'-C1'-B1-B1pair":3, "cWH_GA_B1-B1pair-C1'pair-C4'pair":2, "cWH_GA_alpha_1":2, "cWH_GA_alpha_2":1, "cWH_GA_dB1":2, "cWH_GA_dB2":2,
208 "tWH_GA_tips_distance":7, "tWH_GA_C1'-B1-B1pair":1, "tWH_GA_B1-B1pair-C1'pair":2, "tWH_GA_C4'-C1'-B1-B1pair":1, "tWH_GA_B1-B1pair-C1'pair-C4'pair":2, "tWH_GA_alpha_1":2, "tWH_GA_alpha_2":2, "tWH_GA_dB1":1, "tWH_GA_dB2":6, 208 "tWH_GA_tips_distance":7, "tWH_GA_C1'-B1-B1pair":1, "tWH_GA_B1-B1pair-C1'pair":2, "tWH_GA_C4'-C1'-B1-B1pair":1, "tWH_GA_B1-B1pair-C1'pair-C4'pair":2, "tWH_GA_alpha_1":2, "tWH_GA_alpha_2":2, "tWH_GA_dB1":1, "tWH_GA_dB2":6,
209 "cHW_GA_tips_distance":4, "cHW_GA_C1'-B1-B1pair":2, "cHW_GA_B1-B1pair-C1'pair":2, "cHW_GA_C4'-C1'-B1-B1pair":2, "cHW_GA_B1-B1pair-C1'pair-C4'pair":3, "cHW_GA_alpha_1":1, "cHW_GA_alpha_2":2, "cHW_GA_dB1":1, "cHW_GA_dB2":4, 209 "cHW_GA_tips_distance":4, "cHW_GA_C1'-B1-B1pair":2, "cHW_GA_B1-B1pair-C1'pair":2, "cHW_GA_C4'-C1'-B1-B1pair":2, "cHW_GA_B1-B1pair-C1'pair-C4'pair":3, "cHW_GA_alpha_1":1, "cHW_GA_alpha_2":2, "cHW_GA_dB1":1, "cHW_GA_dB2":4,
...@@ -227,7 +227,7 @@ modes_data = { ...@@ -227,7 +227,7 @@ modes_data = {
227 "cHW_GC_tips_distance":4, "cHW_GC_C1'-B1-B1pair":1, "cHW_GC_B1-B1pair-C1'pair":1, "cHW_GC_C4'-C1'-B1-B1pair":2, "cHW_GC_B1-B1pair-C1'pair-C4'pair":2, "cHW_GC_alpha_1":1, "cHW_GC_alpha_2":1, "cHW_GC_dB1":3, "cHW_GC_dB2":4, 227 "cHW_GC_tips_distance":4, "cHW_GC_C1'-B1-B1pair":1, "cHW_GC_B1-B1pair-C1'pair":1, "cHW_GC_C4'-C1'-B1-B1pair":2, "cHW_GC_B1-B1pair-C1'pair-C4'pair":2, "cHW_GC_alpha_1":1, "cHW_GC_alpha_2":1, "cHW_GC_dB1":3, "cHW_GC_dB2":4,
228 "tHW_GC_tips_distance":5, "tHW_GC_C1'-B1-B1pair":2, "tHW_GC_B1-B1pair-C1'pair":2, "tHW_GC_C4'-C1'-B1-B1pair":2, "tHW_GC_B1-B1pair-C1'pair-C4'pair":2, "tHW_GC_alpha_1":2, "tHW_GC_alpha_2":2, "tHW_GC_dB1":2, "tHW_GC_dB2":4, 228 "tHW_GC_tips_distance":5, "tHW_GC_C1'-B1-B1pair":2, "tHW_GC_B1-B1pair-C1'pair":2, "tHW_GC_C4'-C1'-B1-B1pair":2, "tHW_GC_B1-B1pair-C1'pair-C4'pair":2, "tHW_GC_alpha_1":2, "tHW_GC_alpha_2":2, "tHW_GC_dB1":2, "tHW_GC_dB2":4,
229 "cWS_GC_tips_distance":8, "cWS_GC_C1'-B1-B1pair":1, "cWS_GC_B1-B1pair-C1'pair":1, "cWS_GC_C4'-C1'-B1-B1pair":2, "cWS_GC_B1-B1pair-C1'pair-C4'pair":2, "cWS_GC_alpha_1":2, "cWS_GC_alpha_2":1, "cWS_GC_dB1":2, "cWS_GC_dB2":1, 229 "cWS_GC_tips_distance":8, "cWS_GC_C1'-B1-B1pair":1, "cWS_GC_B1-B1pair-C1'pair":1, "cWS_GC_C4'-C1'-B1-B1pair":2, "cWS_GC_B1-B1pair-C1'pair-C4'pair":2, "cWS_GC_alpha_1":2, "cWS_GC_alpha_2":1, "cWS_GC_dB1":2, "cWS_GC_dB2":1,
230 - "tWS_GC_tips_distance":2, "tWS_GC_C1'-B1-B1pair":1, "tWS_GC_B1-B1pair-C1'pair":1, "tWS_GC_C4'-C1'-B1-B1pair":3, "tWS_GC_B1-B1pair-C1'pair-C4'pair":2, "tWS_GC_alpha_1":1, "tWS_GC_alpha_2":1, "tWS_GC_dB1":4, "tWS_GC_dB2":5, 230 + "tWS_GC_tips_distance":2, "tWS_GC_C1'-B1-B1pair":1, "tWS_GC_B1-B1pair-C1'pair":1, "tWS_GC_C4'-C1'-B1-B1pair":3, "tWS_GC_B1-B1pair-C1'pair-C4'pair":2, "tWS_GC_alpha_1":2, "tWS_GC_alpha_2":1, "tWS_GC_dB1":4, "tWS_GC_dB2":5,
231 "cSW_GC_tips_distance":4, "cSW_GC_C1'-B1-B1pair":2, "cSW_GC_B1-B1pair-C1'pair":3, "cSW_GC_C4'-C1'-B1-B1pair":1, "cSW_GC_B1-B1pair-C1'pair-C4'pair":2, "cSW_GC_alpha_1":3, "cSW_GC_alpha_2":2, "cSW_GC_dB1":3, "cSW_GC_dB2":2, 231 "cSW_GC_tips_distance":4, "cSW_GC_C1'-B1-B1pair":2, "cSW_GC_B1-B1pair-C1'pair":3, "cSW_GC_C4'-C1'-B1-B1pair":1, "cSW_GC_B1-B1pair-C1'pair-C4'pair":2, "cSW_GC_alpha_1":3, "cSW_GC_alpha_2":2, "cSW_GC_dB1":3, "cSW_GC_dB2":2,
232 "tSW_GC_tips_distance":2, "tSW_GC_C1'-B1-B1pair":1, "tSW_GC_B1-B1pair-C1'pair":3, "tSW_GC_C4'-C1'-B1-B1pair":1, "tSW_GC_B1-B1pair-C1'pair-C4'pair":2, "tSW_GC_alpha_1":2, "tSW_GC_alpha_2":2, "tSW_GC_dB1":4, "tSW_GC_dB2":2, 232 "tSW_GC_tips_distance":2, "tSW_GC_C1'-B1-B1pair":1, "tSW_GC_B1-B1pair-C1'pair":3, "tSW_GC_C4'-C1'-B1-B1pair":1, "tSW_GC_B1-B1pair-C1'pair-C4'pair":2, "tSW_GC_alpha_1":2, "tSW_GC_alpha_2":2, "tSW_GC_dB1":4, "tSW_GC_dB2":2,
233 "cHH_GC_tips_distance":1, "cHH_GC_C1'-B1-B1pair":3, "cHH_GC_B1-B1pair-C1'pair":1, "cHH_GC_C4'-C1'-B1-B1pair":2, "cHH_GC_B1-B1pair-C1'pair-C4'pair":1, "cHH_GC_alpha_1":2, "cHH_GC_alpha_2":2, "cHH_GC_dB1":3, "cHH_GC_dB2":3, 233 "cHH_GC_tips_distance":1, "cHH_GC_C1'-B1-B1pair":3, "cHH_GC_B1-B1pair-C1'pair":1, "cHH_GC_C4'-C1'-B1-B1pair":2, "cHH_GC_B1-B1pair-C1'pair-C4'pair":1, "cHH_GC_alpha_1":2, "cHH_GC_alpha_2":2, "cHH_GC_dB1":3, "cHH_GC_dB2":3,
...@@ -1884,7 +1884,7 @@ def concat_jsons(flist, outfilename): ...@@ -1884,7 +1884,7 @@ def concat_jsons(flist, outfilename):
1884 result = [] 1884 result = []
1885 for f in flist: 1885 for f in flist:
1886 if not os.path.isfile(f): 1886 if not os.path.isfile(f):
1887 - warn("Unable to find "+f) 1887 + warn("Unable to find "+f.split('/')[-1])
1888 continue 1888 continue
1889 with open(f, "rb") as infile: 1889 with open(f, "rb") as infile:
1890 result.append(json.load(infile)) 1890 result.append(json.load(infile))
......
...@@ -723,7 +723,6 @@ ...@@ -723,7 +723,6 @@
723 6r7b_1_E 723 6r7b_1_E
724 6o7i_1_I 724 6o7i_1_I
725 6o7h_1_K 725 6o7h_1_K
726 -7a5g_1_A3
727 7l6t_1_C 726 7l6t_1_C
728 7jyy_1_F 727 7jyy_1_F
729 7jyy_1_E 728 7jyy_1_E
...@@ -816,7 +815,6 @@ ...@@ -816,7 +815,6 @@
816 6ppn_1_A 815 6ppn_1_A
817 6ppn_1_I 816 6ppn_1_I
818 5flx_1_Z 817 5flx_1_Z
819 -7a5g_1_B3
820 6eri_1_AX 818 6eri_1_AX
821 7k5l_1_R 819 7k5l_1_R
822 7d80_1_Y 820 7d80_1_Y
...@@ -853,7 +851,6 @@ ...@@ -853,7 +851,6 @@
853 4x9e_1_H 851 4x9e_1_H
854 6z1p_1_BB 852 6z1p_1_BB
855 6z1p_1_BA 853 6z1p_1_BA
856 -7a5g_1_A6
857 2uxd_1_X 854 2uxd_1_X
858 6ywe_1_BB 855 6ywe_1_BB
859 3ol9_1_D 856 3ol9_1_D
...@@ -1053,8 +1050,6 @@ ...@@ -1053,8 +1050,6 @@
1053 6l74_1_I 1050 6l74_1_I
1054 5uh9_1_I 1051 5uh9_1_I
1055 7a5j_1_X 1052 7a5j_1_X
1056 -7a5g_1_24
1057 -7a5g_1_C
1058 6sag_1_R 1053 6sag_1_R
1059 4udv_1_R 1054 4udv_1_R
1060 5zsc_1_D 1055 5zsc_1_D
...@@ -1518,25 +1513,20 @@ ...@@ -1518,25 +1513,20 @@
1518 7d0g_1_A_805-913 1513 7d0g_1_A_805-913
1519 7d0f_1_A_817-913 1514 7d0f_1_A_817-913
1520 7o7z_1_AH_144-220 1515 7o7z_1_AH_144-220
1521 -7a5g_1_A3_1-1454
1522 -7a5g_1_A6_4-949
1523 4c9d_1_D_29-1 1516 4c9d_1_D_29-1
1524 4c9d_1_C_29-1 1517 4c9d_1_C_29-1
1525 -7a5g_1_24_1-70
1526 -7a5g_1_C_1-70
1527 -7a5g_1_j_1-73
1528 -7aih_1_1_2984-3610
1529 7aih_1_1_2400-2963 1518 7aih_1_1_2400-2963
1530 -7ane_1_2_2489-3115 1519 +7aih_1_1_2984-3610
1531 7ane_1_2_1904-2468 1520 7ane_1_2_1904-2468
1521 +7ane_1_2_2489-3115
1532 5g2x_1_A_595-692 1522 5g2x_1_A_595-692
1533 -7aor_1_2_2589-3210
1534 7aor_1_2_2020-2579 1523 7aor_1_2_2020-2579
1524 +7aor_1_2_2589-3210
1535 7a5p_1_2_259-449 1525 7a5p_1_2_259-449
1536 -7aor_1_A_2589-3210
1537 7aor_1_A_2020-2579 1526 7aor_1_A_2020-2579
1538 -7am2_1_1_2491-3117 1527 +7aor_1_A_2589-3210
1539 7am2_1_1_1904-2470 1528 7am2_1_1_1904-2470
1540 -7ane_1_1_2489-3115 1529 +7am2_1_1_2491-3117
1541 7ane_1_1_1904-2468 1530 7ane_1_1_1904-2468
1531 +7ane_1_1_2489-3115
1542 6uz7_1_8_2140-2825 1532 6uz7_1_8_2140-2825
......
...@@ -1145,7 +1145,7 @@ Could not find nucleotides of chain U3 in annotation 7a5k.json. Either there is ...@@ -1145,7 +1145,7 @@ Could not find nucleotides of chain U3 in annotation 7a5k.json. Either there is
1145 Could not find nucleotides of chain U in annotation 6nu2.json. Either there is a problem with 6nu2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 1145 Could not find nucleotides of chain U in annotation 6nu2.json. Either there is a problem with 6nu2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
1146 1146
1147 7a5g_1_U3 1147 7a5g_1_U3
1148 -Could not download and/or find annotations for 7a5g_1_U3. 1148 +Could not find nucleotides of chain U3 in annotation 7a5g.json. Either there is a problem with 7a5g mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
1149 1149
1150 6nu3_1_U 1150 6nu3_1_U
1151 Could not find nucleotides of chain U in annotation 6nu3.json. Either there is a problem with 6nu3 mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 1151 Could not find nucleotides of chain U in annotation 6nu3.json. Either there is a problem with 6nu3 mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
...@@ -2173,9 +2173,6 @@ Sequence is too short. (< 5 resolved nts) ...@@ -2173,9 +2173,6 @@ Sequence is too short. (< 5 resolved nts)
2173 6o7h_1_K 2173 6o7h_1_K
2174 Sequence is too short. (< 5 resolved nts) 2174 Sequence is too short. (< 5 resolved nts)
2175 2175
2176 -7a5g_1_A3
2177 -Could not download and/or find annotations for 7a5g_1_A3.
2178 -
2179 7l6t_1_C 2176 7l6t_1_C
2180 Sequence is too short. (< 5 resolved nts) 2177 Sequence is too short. (< 5 resolved nts)
2181 2178
...@@ -2452,9 +2449,6 @@ Sequence is too short. (< 5 resolved nts) ...@@ -2452,9 +2449,6 @@ Sequence is too short. (< 5 resolved nts)
2452 5flx_1_Z 2449 5flx_1_Z
2453 Could not find nucleotides of chain Z in annotation 5flx.json. Either there is a problem with 5flx mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 2450 Could not find nucleotides of chain Z in annotation 5flx.json. Either there is a problem with 5flx mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
2454 2451
2455 -7a5g_1_B3
2456 -Could not download and/or find annotations for 7a5g_1_B3.
2457 -
2458 6eri_1_AX 2452 6eri_1_AX
2459 Could not find nucleotides of chain AX in annotation 6eri.json. Either there is a problem with 6eri mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 2453 Could not find nucleotides of chain AX in annotation 6eri.json. Either there is a problem with 6eri mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
2460 2454
...@@ -2563,9 +2557,6 @@ Could not find nucleotides of chain BB in annotation 6z1p.json. Either there is ...@@ -2563,9 +2557,6 @@ Could not find nucleotides of chain BB in annotation 6z1p.json. Either there is
2563 6z1p_1_BA 2557 6z1p_1_BA
2564 Could not find nucleotides of chain BA in annotation 6z1p.json. Either there is a problem with 6z1p mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 2558 Could not find nucleotides of chain BA in annotation 6z1p.json. Either there is a problem with 6z1p mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
2565 2559
2566 -7a5g_1_A6
2567 -Could not download and/or find annotations for 7a5g_1_A6.
2568 -
2569 2uxd_1_X 2560 2uxd_1_X
2570 Sequence is too short. (< 5 resolved nts) 2561 Sequence is too short. (< 5 resolved nts)
2571 2562
...@@ -3163,12 +3154,6 @@ Sequence is too short. (< 5 resolved nts) ...@@ -3163,12 +3154,6 @@ Sequence is too short. (< 5 resolved nts)
3163 7a5j_1_X 3154 7a5j_1_X
3164 Could not find nucleotides of chain X in annotation 7a5j.json. Either there is a problem with 7a5j mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 3155 Could not find nucleotides of chain X in annotation 7a5j.json. Either there is a problem with 7a5j mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
3165 3156
3166 -7a5g_1_24
3167 -Could not download and/or find annotations for 7a5g_1_24.
3168 -
3169 -7a5g_1_C
3170 -Could not download and/or find annotations for 7a5g_1_C.
3171 -
3172 6sag_1_R 3157 6sag_1_R
3173 Sequence is too short. (< 5 resolved nts) 3158 Sequence is too short. (< 5 resolved nts)
3174 3159
...@@ -3365,7 +3350,7 @@ Sequence is too short. (< 5 resolved nts) ...@@ -3365,7 +3350,7 @@ Sequence is too short. (< 5 resolved nts)
3365 Sequence is too short. (< 5 resolved nts) 3350 Sequence is too short. (< 5 resolved nts)
3366 3351
3367 7a5g_1_J 3352 7a5g_1_J
3368 -Could not download and/or find annotations for 7a5g_1_J. 3353 +Could not find nucleotides of chain J in annotation 7a5g.json. Either there is a problem with 7a5g mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
3369 3354
3370 6gx6_1_B 3355 6gx6_1_B
3371 Sequence is too short. (< 5 resolved nts) 3356 Sequence is too short. (< 5 resolved nts)
...@@ -4558,67 +4543,52 @@ Could not find nucleotides of chain A in annotation 7d0f.json. Either there is a ...@@ -4558,67 +4543,52 @@ Could not find nucleotides of chain A in annotation 7d0f.json. Either there is a
4558 7o7z_1_AH_144-220 4543 7o7z_1_AH_144-220
4559 Could not find nucleotides of chain AH in annotation 7o7z.json. Either there is a problem with 7o7z mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4544 Could not find nucleotides of chain AH in annotation 7o7z.json. Either there is a problem with 7o7z mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4560 4545
4561 -7a5g_1_A3_1-1454
4562 -Could not download and/or find annotations for 7a5g_1_A3_1-1454.
4563 -
4564 -7a5g_1_A6_4-949
4565 -Could not download and/or find annotations for 7a5g_1_A6_4-949.
4566 -
4567 4c9d_1_D_29-1 4546 4c9d_1_D_29-1
4568 Mapping is reversed, this case is not supported (yet). 4547 Mapping is reversed, this case is not supported (yet).
4569 4548
4570 4c9d_1_C_29-1 4549 4c9d_1_C_29-1
4571 Mapping is reversed, this case is not supported (yet). 4550 Mapping is reversed, this case is not supported (yet).
4572 4551
4573 -7a5g_1_24_1-70 4552 +7aih_1_1_2400-2963
4574 -Could not download and/or find annotations for 7a5g_1_24_1-70.
4575 -
4576 -7a5g_1_C_1-70
4577 -Could not download and/or find annotations for 7a5g_1_C_1-70.
4578 -
4579 -7a5g_1_j_1-73
4580 -Could not download and/or find annotations for 7a5g_1_j_1-73.
4581 -
4582 -7aih_1_1_2984-3610
4583 Could not find nucleotides of chain 1 in annotation 7aih.json. Either there is a problem with 7aih mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4553 Could not find nucleotides of chain 1 in annotation 7aih.json. Either there is a problem with 7aih mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4584 4554
4585 -7aih_1_1_2400-2963 4555 +7aih_1_1_2984-3610
4586 Could not find nucleotides of chain 1 in annotation 7aih.json. Either there is a problem with 7aih mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4556 Could not find nucleotides of chain 1 in annotation 7aih.json. Either there is a problem with 7aih mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4587 4557
4588 -7ane_1_2_2489-3115 4558 +7ane_1_2_1904-2468
4589 Could not find nucleotides of chain 2 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4559 Could not find nucleotides of chain 2 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4590 4560
4591 -7ane_1_2_1904-2468 4561 +7ane_1_2_2489-3115
4592 Could not find nucleotides of chain 2 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4562 Could not find nucleotides of chain 2 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4593 4563
4594 5g2x_1_A_595-692 4564 5g2x_1_A_595-692
4595 Sequence is too short. (< 5 resolved nts) 4565 Sequence is too short. (< 5 resolved nts)
4596 4566
4597 -7aor_1_2_2589-3210 4567 +7aor_1_2_2020-2579
4598 Could not find nucleotides of chain 2 in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4568 Could not find nucleotides of chain 2 in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4599 4569
4600 -7aor_1_2_2020-2579 4570 +7aor_1_2_2589-3210
4601 Could not find nucleotides of chain 2 in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4571 Could not find nucleotides of chain 2 in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4602 4572
4603 7a5p_1_2_259-449 4573 7a5p_1_2_259-449
4604 Could not find nucleotides of chain 2 in annotation 7a5p.json. Either there is a problem with 7a5p mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4574 Could not find nucleotides of chain 2 in annotation 7a5p.json. Either there is a problem with 7a5p mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4605 4575
4606 -7aor_1_A_2589-3210 4576 +7aor_1_A_2020-2579
4607 Could not find nucleotides of chain A in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4577 Could not find nucleotides of chain A in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4608 4578
4609 -7aor_1_A_2020-2579 4579 +7aor_1_A_2589-3210
4610 Could not find nucleotides of chain A in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4580 Could not find nucleotides of chain A in annotation 7aor.json. Either there is a problem with 7aor mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4611 4581
4612 -7am2_1_1_2491-3117 4582 +7am2_1_1_1904-2470
4613 Could not find nucleotides of chain 1 in annotation 7am2.json. Either there is a problem with 7am2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4583 Could not find nucleotides of chain 1 in annotation 7am2.json. Either there is a problem with 7am2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4614 4584
4615 -7am2_1_1_1904-2470 4585 +7am2_1_1_2491-3117
4616 Could not find nucleotides of chain 1 in annotation 7am2.json. Either there is a problem with 7am2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4586 Could not find nucleotides of chain 1 in annotation 7am2.json. Either there is a problem with 7am2 mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4617 4587
4618 -7ane_1_1_2489-3115 4588 +7ane_1_1_1904-2468
4619 Could not find nucleotides of chain 1 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4589 Could not find nucleotides of chain 1 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4620 4590
4621 -7ane_1_1_1904-2468 4591 +7ane_1_1_2489-3115
4622 Could not find nucleotides of chain 1 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry. 4592 Could not find nucleotides of chain 1 in annotation 7ane.json. Either there is a problem with 7ane mmCIF download, or the bases are not resolved in the structure. Delete it and retry.
4623 4593
4624 6uz7_1_8_2140-2825 4594 6uz7_1_8_2140-2825
......