A0A3Q0KTJ3_SCHMA Loading...

Phosphoinositide phospholipase C

AlphaFold DB (A0A5K4EXX0), UniProt , Accession A0A3Q0KTJ3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,678 aa.

						>A0A3Q0KTJ3_SCHMA|A0A3Q0KTJ3
MDNHEDNLRSLIEEASLSRNSSHLHQGKTDTLIDLPTCLSKRSDLPPIQKHERRFSSHSEKKSVTFSFSGSERSNHILNASDCFAYMRKGSEMIKLHTSGRQYKRMFYLNEQMNCIKWSSTNKRQSNSQIDIEEIHEVQLGCSSRTTHSLGRRRPLSMTPTLSHGFLSSSGSGSLIQSASKMYSSNNSSSLTIGSMSPQIQSSTSLNSTILNLSSSAFTICYGPDFTVLEILASGPEEANIWVTGLKCLMAGAQDPQVLEDRQKPRDRWLQILFHEADSTNQGYLSEFEVIRLIRSINPSLSSIHLRHKLKEMESKVRCHKTGITKDDFVNFFKKVATRQEIYYILVRYSSGSEHLSAEDLKNFFESEQGRTGLTRDQCKALINRYEPSHENRQYNLMGIDGFTLLLLSEECDIFNPVHLQVCQDMSQPITHYYIASSHKTFLLEDQLTGPCSIEGYQRALLSGCRYIELEVYDGHDGHPVVRRANSRPPGIPIQAVLNTIHDFAFIRSEYPVIVSIECYATQAQQRVLVTFLRCCLGNRLLLPNSEFTFNLSESQLEIEEQVEKTKLHSMLNNKANRKNSLTVVDLKNESTVYTSNGFFVRWPSPRDLIGRILLQGKRLPKGSTTIMNTSNNESEKWMNGGLPNLRRVFNSFYTSHQETPVIGELSDMFFFDTTNYEQVADNDSIKSNISSLNMNRKMSSLSTITSSSSTRGIKSDLKLDHSYNNTHNSSTSPVVIVGGTQTETNHPTMIMKNFQYQSKAKLDLYNNSNLKDKRNTTINSITNRTINNSMNNTTHNNNTTNKHYHQDHIHLHPYYIIIMSESEASRAIGTGAGDLVQLTRNSLIQICPSPSRADSSNLNPLDIWAWGGQIVTLNYQTAGLIMDLATGFFARNGACGYVLKPNLYRQYSSFFTPYKSNLLNITERPPDTTPQVLRLKIVSAQQLPKPRGSVSKGDTIEPYVVVEIHGIPVDCAEQRTVTAPAGSASGYNAIFEDTFEFCVQLGSLALVRFVVLDDHAIGDDFIGQNTVPFDCLLTGFRHVRLRSDTGEPIPLATLFVHITITTRTDNSHGETNTGLLHRWRSRNRQQLQLKKVGVSTFDEIFKATATTLRQVCELRTSVLSSFDNFRRLCGETSTPLSMNQCIRALSTRIATSFGSPDMWPVRMRIRPEDEMPHLEIQNSFSGSGLSGYPSLSTLGDPISHHGTLGSSLTRNSSLRFSPSPGLHRSPSLILSPRLFLNRRLKSSSKSIDEDSASALSIDVMGCHGNGNSSTHSVQEHSPTVSTNNIARRPSIHSSSSSISSFSVGRLDKLKKAVSEFENLIESCKTLIKQGPYLRVKLQQTQRTALDAYTTFLEGLKAPSSHATAISKLTSSATAATTSLRSSISHGNETRFGSLTSEISRRVTSHISEDNSDNRNKTTTTGTSIYWRRMSRVADNVTWNLRLLTGQTELMTLLLNESNEWIKQAKESSQATGLLIKLDTSSITDSHSSPTSSDKDQLTNELSIEVPLTTNKPLISDHIIQDHQTSSNRSLNITSNEISNNLNSTNQIDHNITSKSPLSPLLEIPRPNQVLNTLEPSNLSTFETHTTPNRSLIRSNVKNLSSYKVSTDIKQNVISNETTITTTTIAITTNIDTTHFSNMNSSINTTTTTTKPLPASNIMNSSGNLSKIRNRFNQAWKK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.2	Very low	26.5	Very low	229 Å²	229	173.9 Å²	173.9	100%	1.128	87%	0.872	S	S	*	*				0	84.9	0	-157.3	175.8	-176	0	0	106.4
2	D	24.8	Very low	26.6	Very low	153 Å²	153	173.3 Å²	173.3	82%	0.818	87%	0.87	S	S	*	*			trans	-113.1	88.3	-146.1	-56.9	-2.9	0	0	0	109.9
3	N	27.3	Very low	26.4	Very low	156 Å²	156	175.3 Å²	175.3	83%	0.834	88%	0.875	S	S	*	*	S	Bend	trans	172.2	61.7	159.9	-90.8	-21	0	0	0	110.8
4	H	29.1	Very low	26.3	Very low	200 Å²	200	176.7 Å²	176.7	93%	0.926	88%	0.878	S	S	*	*			trans	-165	67.7	166.4	-96.8	-50.4	0	0	0	112
5	E	26.4	Very low	26.4	Very low	185 Å²	185	171.6 Å²	171.6	86%	0.864	87%	0.874	S	S	*	*			trans	-139.2	3.1	166.3	-144.8	164.1	-136.1	0	0	115	N7	E5-N7 VanDerWaalsContact C-N 3.27Å; E5-N7 PolarHBondContact O-N 3.38Å
6	D	26.1	Very low	26.4	Very low	162 Å²	162	168.4 Å²	168.4	87%	0.866	87%	0.872	S	S	*	*			trans	-78.9	66.9	170	-70.9	-53.5	0	0	0	112.2
7	N	28.3	Very low	26.4	Very low	154 Å²	154	169 Å²	169	82%	0.824	88%	0.876	S	S	*	*	S	Bend	trans	-166.1	43.3	165.2	-109.8	-53.4	0	0	0	114.8	E5	E5-N7 VanDerWaalsContact C-N 3.27Å; E5-N7 PolarHBondContact O-N 3.38Å
8	L	26.9	Very low	26.3	Very low	159 Å²	159	165.4 Å²	165.4	83%	0.832	87%	0.868	S	S	*	*			trans	-153.4	34.8	170.7	-116.8	166.2	0	0	0	115.3
9	R	24.2	Very low	26.4	Very low	256 Å²	256	169.2 Å²	169.2	97%	0.966	87%	0.869	S	S	*	*			trans	-117.6	48	172.7	-82.8	-169	168.4	-148.1	-1.5	112.6
10	S	26	Very low	26.3	Very low	99 Å²	99	169.4 Å²	169.4	69%	0.692	87%	0.872	S	S	*	*	S	Bend	trans	-145.2	35.1	-177.5	56.8	0	0	0	0	113.8
11	L	26	Very low	26.4	Very low	160 Å²	160	166 Å²	166	84%	0.838	86%	0.863	S	S	*	*	S	Bend	trans	-158.1	137	170	-105.7	147.6	0	0	0	109.6
12	I	27.5	Very low	26.3	Very low	167 Å²	167	160 Å²	160	86%	0.856	84%	0.844	S	S	*	*			trans	68.7	65.7	-178.7	-39.9	176.9	0	0	0	114.4
13	E	24.3	Very low	26.5	Very low	199 Å²	199	161.9 Å²	161.9	93%	0.93	85%	0.847	S	S	*	*			trans	-137.2	47.6	151.1	-158.1	163.7	-130.6	0	0	111.2
14	E	25	Very low	26.4	Very low	195 Å²	195	161.6 Å²	161.6	91%	0.911	85%	0.845	S	S	*	*			trans	-115.6	85.7	168.3	-83	-163.7	132.2	0	0	110.4
15	A	26.7	Very low	26.4	Very low	100 Å²	100	161 Å²	161	83%	0.826	84%	0.842	S	S	*	*			trans	-163.8	39.3	166.6	0	0	0	0	0	111.9	L17	A15-L17 PolarHBondContact O-N 3.44Å
16	S	26.9	Very low	26.3	Very low	120 Å²	120	161.2 Å²	161.2	84%	0.839	84%	0.843	S	S	*	*			trans	-68	131	-179.5	43	0	0	0	0	111.9
17	L	25.6	Very low	26.4	Very low	179 Å²	179	157 Å²	157	94%	0.937	84%	0.838	S	S	*	*			trans	-50.7	139.3	-176.2	-71.8	143.6	0	0	0	113.9	A15	A15-L17 PolarHBondContact O-N 3.44Å
18	S	25.3	Very low	26.5	Very low	105 Å²	105	158.8 Å²	158.8	73%	0.734	84%	0.839	S	S	*	*			trans	-140.5	157.8	154.3	71.6	0	0	0	0	111.1
19	R	27.4	Very low	26.5	Very low	236 Å²	236	156 Å²	156	89%	0.891	83%	0.828	S	S	*	*			trans	80	86.6	-178.4	-55.1	-175	175.6	-166.8	-3.5	117
20	N	24.5	Very low	26.7	Very low	173 Å²	173	150.3 Å²	150.3	93%	0.925	82%	0.817	S	S	*	*			trans	-88.4	128.5	143.9	-93.1	-24.6	0	0	0	109.5
21	S	29	Very low	26.9	Very low	99 Å²	99	151.4 Å²	151.4	69%	0.692	82%	0.82	S	S	*	*			trans	-163.3	82.3	157.8	57.9	0	0	0	0	107.6
22	S	25.3	Very low	26.8	Very low	102 Å²	102	151.3 Å²	151.3	71%	0.713	82%	0.819	S	S	*	*				76.1	105.4	91.4	67.9	0	0	0	0	113.7
23	H	29.1	Very low	27	Very low	194 Å²	194	150.4 Å²	150.4	90%	0.898	81%	0.814	S	S	*	*			trans	-149.4	128.5	139.8	-109.2	-74.2	0	0	0	110
24	L	24.7	Very low	27.1	Very low	149 Å²	149	147.6 Å²	147.6	78%	0.78	81%	0.806	S	S	*	*			trans	-77.8	147	167	-90.6	64.7	0	0	0	109.3
25	H	29.3	Very low	27.2	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.875	80%	0.804	S	S	*	*				-153.5	134.6	116.3	-114.8	-73.5	0	0	0	111.3
26	Q	24.1	Very low	27.7	Very low	188 Å²	188	146.6 Å²	146.6	88%	0.879	80%	0.798	S	S	*	*			trans	-106.1	150.5	168	-78.3	-177	-27.1	0	0	110
27	G	28.4	Very low	27.7	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	80%	0.798	S	S	*	*			trans	136.3	131	166.5	0	0	0	0	0	112.9
28	K	29.6	Very low	27.8	Very low	192 Å²	192	144.1 Å²	144.1	84%	0.835	79%	0.789	S	S	*	*			cis	-164.4	155.4	-10.2	-133.9	-178.8	-177.3	-176.2	0	109.2
29	T	28.1	Very low	27.9	Very low	100 Å²	100	146.1 Å²	146.1	61%	0.613	79%	0.791	S	S	*	*			trans	15.9	137.5	143.9	54.3	0	0	0	0	119.4
30	D	27.3	Very low	27.8	Very low	137 Å²	137	139 Å²	139	73%	0.733	78%	0.777	S	S	*	*			cis	-170.7	176.4	10.9	-110.7	-25.5	0	0	0	114.2
31	T	30.2	Very low	28.1	Very low	121 Å²	121	139.8 Å²	139.8	74%	0.742	77%	0.772	S	S	*	*			trans	66.3	107.6	155	45.5	0	0	0	0	122.8
32	L	24.7	Very low	28	Very low	159 Å²	159	146 Å²	146	83%	0.832	78%	0.78	S	S	*	*				44.8	120.4	115.5	-110.7	96.3	0	0	0	122
33	I	30.5	Very low	28.1	Very low	147 Å²	147	145.5 Å²	145.5	75%	0.754	78%	0.777	S	S	*	*				163.4	134.7	117.2	-85.4	161	0	0	0	113.1
34	D	28.1	Very low	28.2	Very low	140 Å²	140	143 Å²	143	75%	0.749	77%	0.77	S	S	*	*			trans	26	131	157.4	-56.7	-20.5	0	0	0	126.2
35	L	25.6	Very low	28.3	Very low	167 Å²	167	143.4 Å²	143.4	87%	0.874	77%	0.772	S	S	*	*			trans	21.6	158.5	139.7	-88.5	75.7	0	0	0	125
36	P	38.4	Very low	28.9	Very low	108 Å²	108	139.6 Å²	139.6	70%	0.701	76%	0.764	S	S	*	*			trans	-113	172.9	-162.5	43.4	-35.6	0	0	0	115.7
37	T	25.6	Very low	29.7	Very low	136 Å²	136	135.8 Å²	135.8	83%	0.834	76%	0.756	S	S	*	*			trans	-165.5	172	140.1	2.7	0	0	0	0	113.5
38	C	28.3	Very low	29.7	Very low	111 Å²	111	138.5 Å²	138.5	75%	0.75	75%	0.751	S	S	*	*			trans	76.2	149.1	165.9	-63	0	0	0	0	119.4
39	L	27.8	Very low	29.7	Very low	147 Å²	147	136.5 Å²	136.5	77%	0.77	75%	0.745	S	S	*	*			cis	-173.3	121.5	-44.5	-115.2	167.7	0	0	0	109.2
40	S	25	Very low	29.6	Very low	85 Å²	85	139.2 Å²	139.2	59%	0.594	75%	0.748	S	S	*	*			trans	28.6	131.8	151.9	68.9	0	0	0	0	122.3
41	K	29.9	Very low	29.8	Very low	191 Å²	191	139.6 Å²	139.6	83%	0.83	75%	0.745	S	S	*	*				176.3	156.7	103.9	-96.8	163.5	-175.4	173.3	0	114.4
42	R	28.8	Very low	29.5	Very low	229 Å²	229	139.9 Å²	139.9	86%	0.864	74%	0.738	S	S	*	*			trans	67.9	128.6	173.7	-74.5	179.2	177.3	168.3	-1.4	114.9
43	S	27.2	Very low	29.8	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	74%	0.744	S	S	*	*			cis	69.2	121.3	23.3	96.8	0	0	0	0	113.3
44	D	31	Very low	29.4	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	74%	0.744	S	S	*	*				-146.6	-150.9	59.6	-66.7	-32.8	0	0	0	114
45	L	27.1	Very low	29.4	Very low	158 Å²	158	150 Å²	150	83%	0.827	75%	0.751	S	S	*	*			trans	-100.5	155.9	-152.7	-68.8	84.3	0	0	0	117.7
46	P	41.2	Very low	29.5	Very low	109 Å²	109	147.7 Å²	147.7	71%	0.708	75%	0.749	S	S	*	*			trans	-89.7	-157.5	160	43.4	-38.5	0	0	0	110.1
47	P	40.3	Very low	28.8	Very low	107 Å²	107	147.6 Å²	147.6	70%	0.695	75%	0.751	S	S	*	*			cis	-143.5	-162	2.4	28.5	-0	0	0	0	116.3
48	I	28.4	Very low	29	Very low	132 Å²	132	149.8 Å²	149.8	68%	0.677	75%	0.752	S	S	*	*			trans	122.4	109.9	142.1	-66.3	176	0	0	0	119.1
49	Q	29.2	Very low	28.8	Very low	149 Å²	149	150.4 Å²	150.4	70%	0.696	76%	0.757	S	S	*	*			trans	61.4	148.4	152.6	-68.8	172.9	52.8	0	0	118.4
50	K	27.6	Very low	28.7	Very low	158 Å²	158	152.3 Å²	152.3	69%	0.687	76%	0.762	S	S	*	*			cis	-157.7	-174.7	9	-122	155.3	173.8	156.5	0	108.1
51	H	30.1	Very low	28.7	Very low	145 Å²	145	157.7 Å²	157.7	67%	0.671	78%	0.775	S	S	*	*			cis	-143.2	-137	10	-142.2	-82.6	0	0	0	111.5
52	E	25.8	Very low	28.3	Very low	126 Å²	126	158.1 Å²	158.1	59%	0.589	78%	0.777	S	S	*	*			trans	-93.8	158.5	-172.1	-68.9	160.6	104.3	0	0	117.6
53	R	29.7	Very low	28	Very low	252 Å²	252	151.8 Å²	151.8	95%	0.951	77%	0.767	S	S	*	*				-155.3	162.6	112.1	-103.8	175.2	-163.2	-165.8	5.4	111.4
54	R	22.6	Very low	27.7	Very low	199 Å²	199	152.7 Å²	152.7	75%	0.751	77%	0.769	S	S	*	*			trans	-105.8	150.2	-173	-54.8	173.8	-173.7	168.2	1.4	111.5
55	F	27.1	Very low	27.3	Very low	208 Å²	208	150.9 Å²	150.9	91%	0.912	76%	0.763	S	S	*	*				171	123.5	119	-98.7	-66.9	0	0	0	112.5
56	S	28.5	Very low	27.1	Very low	118 Å²	118	152 Å²	152	83%	0.825	76%	0.761	S	S	*	*			trans	164.5	137.6	140.4	-174.5	0	0	0	0	108.4
57	S	22.9	Very low	26.1	Very low	106 Å²	106	151.4 Å²	151.4	74%	0.741	76%	0.76	S	S	*	*			trans	-123.2	124	-179.3	55.1	0	0	0	0	110.8
58	H	30.8	Very low	25.3	Very low	183 Å²	183	155.5 Å²	155.5	85%	0.847	77%	0.767	S	S	*	*			trans	-123.8	139.2	161.8	-96.1	29.6	0	0	0	110	E60	H58-E60 PolarHBondContact O-N 2.74Å
59	S	24.2	Very low	25	Very low	124 Å²	124	155 Å²	155	87%	0.867	78%	0.776	S	S	*	*			trans	-94.7	75.8	-166.3	55.6	0	0	0	0	111.6
60	E	25.8	Very low	24.8	Very low	186 Å²	186	149.9 Å²	149.9	87%	0.869	76%	0.763	S	S	*	*			trans	-75.4	140.9	168.7	-69.6	-158.8	120.4	0	0	111.8	H58 K62	H58-E60 PolarHBondContact O-N 2.74Å; E60-K62 PolarHBondContact O-N 3.38Å
61	K	24.4	Very low	24.7	Very low	199 Å²	199	147 Å²	147	87%	0.865	76%	0.763	S	S	*	*			trans	-70.6	118.6	-175.5	-64.6	170.4	-176.9	170.9	0	109	S63	K61-S63 VanDerWaalsContact C-N 3.28Å; K61-S63 PolarHBondContact O-N 3.24Å
62	K	21.6	Very low	24.7	Very low	200 Å²	200	146.2 Å²	146.2	87%	0.87	76%	0.759	S	S	*	*			trans	-67.3	83.3	172.2	-71.3	-174.1	177.8	-179.1	0	111.1	E60 V64	E60-K62 PolarHBondContact O-N 3.38Å; K62-V64 PolarHBondContact O-N 3.21Å
63	S	22.3	Very low	25.3	Very low	95 Å²	95	149.6 Å²	149.6	66%	0.664	77%	0.766	S	S	*	*			trans	-63.6	112	154.9	50.8	0	0	0	0	107.8	K61 T65	K61-S63 VanDerWaalsContact C-N 3.28Å; K61-S63 PolarHBondContact O-N 3.24Å; S63-T65 PolarHBondContact O-N 3.39Å
64	V	21.5	Very low	26.1	Very low	111 Å²	111	142 Å²	142	67%	0.673	75%	0.752	S	S	*	*			trans	-77.2	74.4	173.6	-174.7	0	0	0	0	108.2	K62 F66	K62-V64 PolarHBondContact O-N 3.21Å; V64-F66 HydrophobicContact CG1-CD2 4.15Å; V64-F66 HydrophobicContact CG1-CE1 4.47Å; V64-F66 HydrophobicContact CG1-CE2 3.7Å; V64-F66 HydrophobicContact CG1-CZ 3.88Å; V64-F66 PolarHBondContact O-N 3.16Å; V64-F66 VanDerWaalsContact O-N 3.17Å
65	T	22.3	Very low	27.9	Very low	104 Å²	104	135.6 Å²	135.6	64%	0.638	73%	0.733	S	S	*	*			trans	-72.3	104.3	172	-53	0	0	0	0	107.4	S63 S67	S63-T65 PolarHBondContact O-N 3.39Å; T65-S67 PolarHBondContact O-N 2.69Å
66	F	22.9	Very low	30	Very low	180 Å²	180	129.4 Å²	129.4	79%	0.789	71%	0.706	S	S	*	*			trans	-70.2	77.2	168.6	-71.7	-84.4	0	0	0	109.1	V64 F68	V64-F66 HydrophobicContact CG1-CD2 4.15Å; V64-F66 HydrophobicContact CG1-CE1 4.47Å; V64-F66 HydrophobicContact CG1-CE2 3.7Å; V64-F66 HydrophobicContact CG1-CZ 3.88Å; V64-F66 PolarHBondContact O-N 3.16Å; V64-F66 VanDerWaalsContact O-N 3.17Å; F66-F68 PolarHBondContact O-N 3.3Å
67	S	21.5	Very low	32.7	Very low	98 Å²	98	123.9 Å²	123.9	69%	0.685	67%	0.668	S	S	*	*			trans	-66.5	87.9	169	56	0	0	0	0	108.2	T65 S69	T65-S67 PolarHBondContact O-N 2.69Å; S67-S69 VanDerWaalsContact C-N 3.31Å; S67-S69 PolarHBondContact O-N 3.06Å
68	F	22.5	Very low	35.7	Very low	193 Å²	193	120.5 Å²	120.5	85%	0.846	64%	0.641	S	S	*	*			trans	-68.2	90	-179.4	-145.9	-84.5	0	0	0	108.3	F66 G70	F66-F68 PolarHBondContact O-N 3.3Å; F68-G70 PolarHBondContact O-N 2.88Å
69	S	22.9	Very low	38.4	Very low	122 Å²	122	112.7 Å²	112.7	85%	0.853	61%	0.606	S	S	*	*			trans	-74.4	48.8	174.9	66.8	0	0	0	0	111.1	S67	S67-S69 VanDerWaalsContact C-N 3.31Å; S67-S69 PolarHBondContact O-N 3.06Å
70	G	23.3	Very low	41.5	Very low	41 Å²	41	106.8 Å²	106.8	42%	0.423	57%	0.565	S	S	.	*			trans	-62.6	148.2	159	0	0	0	0	0	108.6	F68 E72	F68-G70 PolarHBondContact O-N 2.88Å; G70-E72 VanDerWaalsContact C-N 3.32Å; G70-E72 PolarHBondContact O-N 3.47Å
71	S	25.9	Very low	44.5	Very low	98 Å²	98	100.6 Å²	100.6	69%	0.685	54%	0.541	S	S	*	.			trans	-70.7	86.6	178.6	166.7	0	0	0	0	110.2	R73	S71-R73 PolarHBondContact O-N 2.91Å
72	E	30.7	Very low	47.6	Very low	128 Å²	128	93.6 Å²	93.6	60%	0.598	51%	0.513	S	S	*	.			trans	-66.5	61.7	165.4	-75.1	-159.9	152.2	0	0	111.4	G70 S74 K316	G70-E72 VanDerWaalsContact C-N 3.32Å; G70-E72 PolarHBondContact O-N 3.47Å; E72-S74 VanDerWaalsContact C-N 3.31Å; E72-K316 IonicContact OE2-NZ 2.71Å; E72-K316 PolarHBondContact OE2-NZ 2.84Å
73	R	38.5	Very low	50.9	Low	196 Å²	196	84 Å²	84	74%	0.74	47%	0.472	S	S	*	.			trans	-99.6	64.1	150.4	-76.5	-178.7	167.4	171.3	-5.4	107.2	S71 N75	S71-R73 PolarHBondContact O-N 2.91Å; R73-N75 PolarHBondContact O-N 2.87Å; R73-N75 VanDerWaalsContact O-N 3.12Å; R73-N75 PolarHBondContact O-ND2 3.46Å
74	S	46.8	Very low	54.3	Low	94 Å²	94	79.6 Å²	79.6	66%	0.657	44%	0.441	S	S	*	.			trans	-58.7	112.2	162.9	49.9	0	0	0	0	107.2	E72 H76	E72-S74 VanDerWaalsContact C-N 3.31Å; S74-H76 PolarHBondContact O-N 3.3Å
75	N	58.8	Low	57.6	Low	63 Å²	63	76.7 Å²	76.7	34%	0.337	43%	0.428	S	S	.	.			trans	-78	53.4	177.4	-45.7	-80.7	0	0	0	109.2	R73 I77 Y86	R73-N75 PolarHBondContact O-N 2.87Å; R73-N75 VanDerWaalsContact O-N 3.12Å; R73-N75 PolarHBondContact O-ND2 3.46Å; N75-I77 WeakPolarHBondContact O-CD1 3.29Å; N75-I77 WeakPolarHBondContact O-CG1 3.11Å; N75-I77 PolarHBondContact O-N 3.23Å; N75-Y86 HydrophobicContact CB-CD2 3.86Å; N75-Y86 HydrophobicContact CB-CE2 4Å
76	H	72.4	Confident	60.9	Low	78 Å²	78	73.4 Å²	73.4	36%	0.361	40%	0.404	S	S	.	.			trans	-71.1	98.3	-172.5	-167.2	-46.8	0	0	0	108.6	S74 L78 T338	S74-H76 PolarHBondContact O-N 3.3Å; H76-L78 WeakPolarHBondContact ND1-CD2 3.44Å; H76-L78 PolarHBondContact O-N 3.39Å; H76-T338 PolarHBondContact CE1-O 3.29Å
77	I	84.3	Confident	64.3	Low	3 Å²	3	64.8 Å²	64.8	2%	0.015	37%	0.367	C	S	.	.			trans	-70.2	129	-178	-56.4	-50.7	0	0	0	109	N75 N79 D82 C83 I241 Y343 Y344	N75-I77 WeakPolarHBondContact O-CD1 3.29Å; N75-I77 WeakPolarHBondContact O-CG1 3.11Å; N75-I77 PolarHBondContact O-N 3.23Å; I77-N79 WeakPolarHBondContact CG2-O 3.28Å; I77-D82 HydrophobicContact CB-CB 4.48Å; I77-D82 HydrophobicContact CD1-CB 3.68Å; I77-D82 HydrophobicContact CG2-CB 4.19Å; I77-C83 VanDerWaalsContact CG2-SG 3.52Å; I77-I241 HydrophobicContact CD1-CD1 4.33Å; I77-I241 HydrophobicContact CD1-CG1 4.46Å; I77-I241 HydrophobicContact CG1-CD1 4.09Å; I77-I241 HydrophobicContact CG1-CG1 3.94Å; I77-Y343 HydrophobicContact CG2-CD1 3.9Å; I77-Y343 HydrophobicContact CG2-CE1 3.81Å; I77-Y344 HydrophobicContact CB-CE1 4.18Å; I77-Y344 HydrophobicContact CG1-CE1 4.29Å; I77-Y344 VanDerWaalsContact CG1-OH 3.27Å; I77-Y344 WeakPolarHBondContact CG1-OH 3.48Å; I77-Y344 HydrophobicContact CG2-CE1 4.11Å
78	L	85.9	Confident	67.7	Low	35 Å²	35	66 Å²	66	18%	0.183	36%	0.357	C	S	.	.			trans	-115.8	-21.7	174.7	-53.5	177.6	0	0	0	111.8	H76 D82 K334 K335 T338	H76-L78 WeakPolarHBondContact ND1-CD2 3.44Å; H76-L78 PolarHBondContact O-N 3.39Å; L78-D82 WeakPolarHBondContact CA-OD2 3.44Å; L78-D82 WeakPolarHBondContact CB-OD2 3.35Å; L78-D82 PolarHBondContact N-OD2 3.42Å; L78-K334 HydrophobicContact CD1-CB 4.43Å; L78-K335 HydrophobicContact CD1-CB 4.45Å; L78-T338 HydrophobicContact CD2-CG2 4.44Å
79	N	88.1	Confident	71	Confident	19 Å²	19	63.4 Å²	63.4	10%	0.102	35%	0.345	C	S	.	.	S	Bend	trans	-159.8	179.1	-175.6	63.2	75.1	0	0	0	112.2	I77 S81 D82 Y343 E354	I77-N79 WeakPolarHBondContact CG2-O 3.28Å; N79-S81 PolarHBondContact O-N 3.44Å; N79-S81 VanDerWaalsContact OD1-CA 3.32Å; N79-S81 WeakPolarHBondContact OD1-CA 3.48Å; N79-S81 WeakPolarHBondContact OD1-CB 3.35Å; N79-S81 PolarHBondContact OD1-N 3.44Å; N79-D82 PolarHBondContact N-OD2 3.15Å; N79-D82 PolarHBondContact ND2-OD2 3.25Å; N79-D82 PolarHBondContact O-N 3.39Å; N79-D82 PolarHBondContact OD1-N 3.02Å; N79-Y343 VanDerWaalsContact C-OH 3.27Å; N79-E354 WeakPolarHBondContact CB-OE1 3.49Å
80	A	88.9	Confident	74.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.1	-32.6	-178.9	0	0	0	0	0	114.2	D82 C83 F84 C248 L259 Y343 E354	A80-D82 VanDerWaalsContact C-N 3.28Å; A80-D82 PolarHBondContact O-N 2.88Å; A80-C83 WeakPolarHBondContact O-CB 3.42Å; A80-C83 PolarHBondContact O-N 3.35Å; A80-F84 HydrophobicContact CB-CE2 4.15Å; A80-F84 HydrophobicContact CB-CZ 4.07Å; A80-F84 VanDerWaalsContact O-CD1 3.32Å; A80-F84 WeakPolarHBondContact O-CD1 3.37Å; A80-F84 WeakPolarHBondContact O-CD2 3.38Å; A80-F84 WeakPolarHBondContact O-CG 3.19Å; A80-F84 PolarHBondContact O-N 3.39Å; A80-C248 HydrophobicContact CB-CB 4.06Å; A80-L259 HydrophobicContact CB-CD2 3.92Å; A80-Y343 WeakPolarHBondContact CA-OH 3.47Å; A80-Y343 PolarHBondContact N-OH 3.42Å; A80-E354 WeakPolarHBondContact CB-OE1 3.3Å; A80-E354 PolarHBondContact N-OE1 3.4Å
81	S	89	Confident	77.5	Confident	55 Å²	55	56.3 Å²	56.3	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-34.3	177.2	-162.7	0	0	0	0	112	N79 F84 A85	N79-S81 PolarHBondContact O-N 3.44Å; N79-S81 VanDerWaalsContact OD1-CA 3.32Å; N79-S81 WeakPolarHBondContact OD1-CA 3.48Å; N79-S81 WeakPolarHBondContact OD1-CB 3.35Å; N79-S81 PolarHBondContact OD1-N 3.44Å; S81-F84 WeakPolarHBondContact O-CB 3.45Å; S81-F84 PolarHBondContact O-N 3.27Å; S81-A85 PolarHBondContact O-N 3.03Å
82	D	90.1	Very high	80.6	Confident	52 Å²	52	56.6 Å²	56.6	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-65.6	-42.2	173.8	-55	-41.9	0	0	0	111.2	I77 L78 N79 A80 F84 A85 Y86	I77-D82 HydrophobicContact CB-CB 4.48Å; I77-D82 HydrophobicContact CD1-CB 3.68Å; I77-D82 HydrophobicContact CG2-CB 4.19Å; L78-D82 WeakPolarHBondContact CA-OD2 3.44Å; L78-D82 WeakPolarHBondContact CB-OD2 3.35Å; L78-D82 PolarHBondContact N-OD2 3.42Å; N79-D82 PolarHBondContact N-OD2 3.15Å; N79-D82 PolarHBondContact ND2-OD2 3.25Å; N79-D82 PolarHBondContact O-N 3.39Å; N79-D82 PolarHBondContact OD1-N 3.02Å; A80-D82 VanDerWaalsContact C-N 3.28Å; A80-D82 PolarHBondContact O-N 2.88Å; D82-F84 VanDerWaalsContact C-N 3.25Å; D82-F84 PolarHBondContact O-N 3.49Å; D82-A85 PolarHBondContact O-N 3.45Å; D82-Y86 PolarHBondContact O-N 3.04Å
83	C	91.3	Very high	83.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.6	-42	171.8	-59.9	0	0	0	0	110.7	I77 A80 Y86 M87 I241	I77-C83 VanDerWaalsContact CG2-SG 3.52Å; A80-C83 WeakPolarHBondContact O-CB 3.42Å; A80-C83 PolarHBondContact O-N 3.35Å; C83-Y86 WeakPolarHBondContact O-CB 3.42Å; C83-Y86 PolarHBondContact O-N 3.08Å; C83-M87 WeakPolarHBondContact O-CB 3.47Å; C83-M87 VanDerWaalsContact O-CG 3.22Å; C83-M87 WeakPolarHBondContact O-CG 3.2Å; C83-M87 PolarHBondContact O-N 3.11Å; C83-I241 HydrophobicContact CB-CG2 4.15Å
84	F	91.8	Very high	86	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-71.4	-34.6	-179	-58.2	-20	0	0	0	113.5	A80 S81 D82 Y86 M87 R88 L109 M113 G245 C248 L249 A253 L259	A80-F84 HydrophobicContact CB-CE2 4.15Å; A80-F84 HydrophobicContact CB-CZ 4.07Å; A80-F84 VanDerWaalsContact O-CD1 3.32Å; A80-F84 WeakPolarHBondContact O-CD1 3.37Å; A80-F84 WeakPolarHBondContact O-CD2 3.38Å; A80-F84 WeakPolarHBondContact O-CG 3.19Å; A80-F84 PolarHBondContact O-N 3.39Å; S81-F84 WeakPolarHBondContact O-CB 3.45Å; S81-F84 PolarHBondContact O-N 3.27Å; D82-F84 VanDerWaalsContact C-N 3.25Å; D82-F84 PolarHBondContact O-N 3.49Å; F84-Y86 VanDerWaalsContact C-N 3.34Å; F84-M87 HydrophobicContact CD1-SD 4.3Å; F84-R88 WeakPolarHBondContact O-CB 3.36Å; F84-R88 VanDerWaalsContact O-CG 3.32Å; F84-R88 WeakPolarHBondContact O-CG 3.38Å; F84-R88 PolarHBondContact O-N 3.3Å; F84-R88 PolarHBondContact O-NE 3.38Å; F84-L109 HydrophobicContact CD1-CD2 4.49Å; F84-M113 HydrophobicContact CB-CE 3.48Å; F84-M113 VanDerWaalsContact CB-CE 3.48Å; F84-M113 HydrophobicContact CB-SD 4.43Å; F84-M113 HydrophobicContact CD1-CE 3.99Å; F84-M113 HydrophobicContact CD2-CE 3.25Å; F84-M113 HydrophobicContact CE2-CE 3.88Å; F84-M113 HydrophobicContact CG-CE 3.3Å; F84-G245 WeakPolarHBondContact CE1-O 3.32Å; F84-C248 HydrophobicContact CE1-CB 4.25Å; F84-C248 HydrophobicContact CZ-CB 3.75Å; F84-L249 HydrophobicContact CD1-CD1 4.29Å; F84-L249 HydrophobicContact CD1-CD2 4.26Å; F84-L249 HydrophobicContact CD1-CG 4.27Å; F84-L249 HydrophobicContact CE1-CD1 3.89Å; F84-L249 HydrophobicContact CE1-CD2 3.7Å; F84-L249 HydrophobicContact CE1-CG 3.48Å; F84-L249 VanDerWaalsContact CE1-CG 3.48Å; F84-L249 HydrophobicContact CE2-CD2 3.98Å; F84-L249 HydrophobicContact CZ-CD2 3.53Å; F84-L249 HydrophobicContact CZ-CG 3.64Å; F84-A253 HydrophobicContact CE2-CB 4.22Å; F84-A253 VanDerWaalsContact CE2-O 3.3Å; F84-A253 WeakPolarHBondContact CE2-O 3.1Å; F84-A253 HydrophobicContact CZ-CB 4.17Å; F84-L259 HydrophobicContact CD2-CD1 4Å; F84-L259 HydrophobicContact CD2-CD2 4.33Å; F84-L259 HydrophobicContact CE2-CD1 3.86Å; F84-L259 HydrophobicContact CE2-CD2 3.8Å; F84-L259 HydrophobicContact CE2-CG 4.26Å
85	A	91.3	Very high	88	Confident	50 Å²	50	40.8 Å²	40.8	41%	0.413	21%	0.205	S	C	.	.	H	α-helix	trans	-63.7	-41.3	170.3	0	0	0	0	0	111.2	S81 D82 K89	S81-A85 PolarHBondContact O-N 3.03Å; D82-A85 PolarHBondContact O-N 3.45Å; A85-K89 WeakPolarHBondContact O-CB 3.24Å; A85-K89 PolarHBondContact O-N 2.91Å
86	Y	92.5	Very high	89.2	Confident	34 Å²	34	38.1 Å²	38.1	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-49.3	175.2	-170	-85	0	0	0	112.2	N75 D82 C83 F84 R88 K89 G90 S91 E238 I241	N75-Y86 HydrophobicContact CB-CD2 3.86Å; N75-Y86 HydrophobicContact CB-CE2 4Å; D82-Y86 PolarHBondContact O-N 3.04Å; C83-Y86 WeakPolarHBondContact O-CB 3.42Å; C83-Y86 PolarHBondContact O-N 3.08Å; F84-Y86 VanDerWaalsContact C-N 3.34Å; Y86-R88 PolarHBondContact O-N 3.49Å; Y86-K89 WeakPolarHBondContact O-CB 3.27Å; Y86-K89 PolarHBondContact O-N 2.88Å; Y86-G90 PolarHBondContact O-N 2.99Å; Y86-S91 WeakPolarHBondContact CE1-OG 3.31Å; Y86-E238 HydrophobicContact CE1-CG 4.13Å; Y86-E238 PolarHBondContact OH-OE1 3.24Å; Y86-I241 HydrophobicContact CD1-CB 4.49Å; Y86-I241 HydrophobicContact CD1-CD1 4.34Å; Y86-I241 HydrophobicContact CD1-CG2 3.69Å; Y86-I241 HydrophobicContact CD2-CD1 4.3Å; Y86-I241 HydrophobicContact CE1-CD1 4.27Å; Y86-I241 HydrophobicContact CE1-CG2 4.35Å; Y86-I241 HydrophobicContact CE2-CD1 4.22Å; Y86-I241 HydrophobicContact CG-CD1 4.35Å; Y86-I241 HydrophobicContact CG-CG2 4.02Å
87	M	94.1	Very high	89.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-34.4	-179.4	-69.7	164.9	68.5	0	0	113.2	C83 F84 G90 Y108 L109 W242 L246 L249	C83-M87 WeakPolarHBondContact O-CB 3.47Å; C83-M87 VanDerWaalsContact O-CG 3.22Å; C83-M87 WeakPolarHBondContact O-CG 3.2Å; C83-M87 PolarHBondContact O-N 3.11Å; F84-M87 HydrophobicContact CD1-SD 4.3Å; M87-G90 PolarHBondContact O-N 3.21Å; M87-Y108 CarbonylContact O-C 3.53Å; M87-Y108 VanDerWaalsContact O-CA 3.29Å; M87-Y108 WeakPolarHBondContact O-CA 3.32Å; M87-L109 HydrophobicContact CB-CB 3.91Å; M87-L109 HydrophobicContact CB-CD2 4.37Å; M87-L109 HydrophobicContact CE-CD2 4.31Å; M87-L109 PolarHBondContact O-N 3.04Å; M87-W242 HydrophobicContact CB-CH2 4.31Å; M87-W242 HydrophobicContact CB-CZ2 4.24Å; M87-W242 HydrophobicContact CE-CD2 4.39Å; M87-W242 HydrophobicContact CE-CE3 3.73Å; M87-W242 HydrophobicContact CE-CZ3 3.86Å; M87-W242 HydrophobicContact CG-CD2 3.92Å; M87-W242 HydrophobicContact CG-CE3 4.16Å; M87-W242 HydrophobicContact CG-CG 4.37Å; M87-W242 HydrophobicContact CG-CH2 4.41Å; M87-W242 HydrophobicContact CG-CZ2 4.2Å; M87-W242 HydrophobicContact CG-CZ3 4.39Å; M87-L246 HydrophobicContact CE-CD2 3.74Å; M87-L246 HydrophobicContact CE-CG 3.9Å; M87-L249 HydrophobicContact CE-CD1 3.99Å
88	R	92.8	Very high	88.5	Confident	124 Å²	124	44.2 Å²	44.2	47%	0.468	23%	0.228	S	C	.	.	H	α-helix	trans	-72	-34.6	174.5	-74.7	-176.5	-64.4	156	-1.6	113.2	F84 Y86 G90 L109 M113	F84-R88 WeakPolarHBondContact O-CB 3.36Å; F84-R88 VanDerWaalsContact O-CG 3.32Å; F84-R88 WeakPolarHBondContact O-CG 3.38Å; F84-R88 PolarHBondContact O-N 3.3Å; F84-R88 PolarHBondContact O-NE 3.38Å; Y86-R88 PolarHBondContact O-N 3.49Å; R88-G90 PolarHBondContact O-N 3.45Å; R88-L109 HydrophobicContact CG-CB 4.06Å; R88-L109 HydrophobicContact CG-CD2 4.38Å; R88-L109 HydrophobicContact CG-CG 4.35Å; R88-M113 HydrophobicContact CG-SD 4.27Å
89	K	91.1	Very high	87.7	Confident	138 Å²	138	46.1 Å²	46.1	60%	0.6	24%	0.244	S	C	*	.	H	α-helix	trans	-64.4	-32.1	169.9	176.8	-167.1	168.5	-153	0	111.3	A85 Y86	A85-K89 WeakPolarHBondContact O-CB 3.24Å; A85-K89 PolarHBondContact O-N 2.91Å; Y86-K89 WeakPolarHBondContact O-CB 3.27Å; Y86-K89 PolarHBondContact O-N 2.88Å
90	G	90.5	Very high	86.5	Confident	11 Å²	11	46.7 Å²	46.7	11%	0.113	25%	0.254	C	S	.	.			trans	89.6	159.7	169.8	0	0	0	0	0	114.9	Y86 M87 R88 M106 F107	Y86-G90 PolarHBondContact O-N 2.99Å; M87-G90 PolarHBondContact O-N 3.21Å; R88-G90 PolarHBondContact O-N 3.45Å; G90-M106 WeakPolarHBondContact O-CE 2.8Å; G90-F107 CarbonylContact C-O 3.51Å; G90-F107 WeakPolarHBondContact CA-O 3.41Å
91	S	92.5	Very high	85.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139	-170.6	-78.1	0	0	0	0	111.9	Y86 M93 M106 F107 E238 W242	Y86-S91 WeakPolarHBondContact CE1-OG 3.31Å; S91-M93 PolarHBondContact O-N 3.5Å; S91-M106 VanDerWaalsContact C-SD 3.57Å; S91-F107 PolarHBondContact N-O 3.15Å; S91-F107 PolarHBondContact O-N 2.78Å; S91-E238 WeakPolarHBondContact CB-OE1 3.5Å; S91-E238 PolarHBondContact OG-OE1 3.32Å; S91-W242 VanDerWaalsContact CB-NE1 3.29Å; S91-W242 PolarHBondContact OG-NE1 3.35Å
92	E	91.8	Very high	85.3	Confident	105 Å²	105	55.7 Å²	55.7	49%	0.491	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	83.2	-179.2	-159.9	-163	178.8	0	0	111.5	K104 R105 M106	E92-K104 HydrophobicContact CG-CD 4.38Å; E92-K104 HydrophobicContact CG-CG 4.19Å; E92-K104 VanDerWaalsContact OE1-CD 3.25Å; E92-K104 WeakPolarHBondContact OE1-CD 3.45Å; E92-K104 WeakPolarHBondContact OE1-CE 3.47Å; E92-K104 IonicContact OE1-NZ 2.67Å; E92-K104 PolarHBondContact OE1-NZ 2.86Å; E92-K104 WeakPolarHBondContact OE2-CE 3.23Å; E92-K104 IonicContact OE2-NZ 3.26Å; E92-K104 PolarHBondContact OE2-NZ 2.92Å; E92-R105 CarbonylContact C-O 3.6Å; E92-R105 WeakPolarHBondContact CA-O 3.16Å; E92-M106 HydrophobicContact CB-SD 3.97Å; E92-M106 HydrophobicContact CG-SD 4.46Å
93	M	92.8	Very high	85	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	161.8	-171.5	-53.4	-170.8	-78.7	0	0	112.7	S91 R105 F107 F218 I231 A233 E238 W242	S91-M93 PolarHBondContact O-N 3.5Å; M93-R105 PolarHBondContact N-O 3.11Å; M93-R105 PolarHBondContact O-N 3.28Å; M93-R105 VanDerWaalsContact O-O 3.05Å; M93-F107 HydrophobicContact CB-CD2 3.86Å; M93-F107 HydrophobicContact CB-CE2 4.08Å; M93-F107 HydrophobicContact CE-CB 3.62Å; M93-F107 HydrophobicContact CE-CD2 3.95Å; M93-F107 HydrophobicContact CE-CG 3.83Å; M93-F218 HydrophobicContact CE-CE1 4.31Å; M93-F218 HydrophobicContact CE-CZ 3.95Å; M93-F218 HydrophobicContact SD-CE1 3.76Å; M93-F218 HydrophobicContact SD-CZ 4.03Å; M93-I231 HydrophobicContact CB-CG2 3.66Å; M93-I231 HydrophobicContact CE-CG2 4.14Å; M93-I231 HydrophobicContact CG-CG2 4.4Å; M93-I231 HydrophobicContact SD-CG2 3.9Å; M93-A233 HydrophobicContact CG-CB 4.29Å; M93-A233 HydrophobicContact SD-CB 3.86Å; M93-E238 HydrophobicContact SD-CG 4.45Å; M93-W242 HydrophobicContact CE-CD2 3.66Å; M93-W242 VanDerWaalsContact CE-CE2 3.49Å; M93-W242 HydrophobicContact CE-CE3 4.19Å; M93-W242 HydrophobicContact CE-CG 4.01Å; M93-W242 HydrophobicContact CE-CH2 4.39Å; M93-W242 HydrophobicContact CE-CZ2 3.88Å; M93-W242 HydrophobicContact SD-CG 4.35Å
94	I	89.9	Confident	84.8	Confident	42 Å²	42	61.4 Å²	61.4	22%	0.215	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.3	-179.8	-60.1	173.7	0	0	0	109.6	L96 Q102 K104 L232	I94-L96 HydrophobicContact CG2-CD2 4.06Å; I94-L96 PolarHBondContact O-N 3.31Å; I94-Q102 HydrophobicContact CG2-CB 3.87Å; I94-K104 HydrophobicContact CG1-CB 4.35Å; I94-K104 HydrophobicContact CG1-CG 4.12Å; I94-L232 HydrophobicContact CB-CB 4.3Å; I94-L232 PolarHBondContact N-O 3.22Å; I94-L232 PolarHBondContact O-N 3.25Å
95	K	89	Confident	84.7	Confident	42 Å²	42	62.9 Å²	62.9	18%	0.183	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	118.7	167.5	179.5	154.3	-178.6	140.3	0	109.1	Y103 F107 L229	K95-Y103 PolarHBondContact N-O 2.82Å; K95-Y103 PolarHBondContact O-N 2.7Å; K95-F107 HydrophobicContact CB-CE2 4.46Å; K95-F107 HydrophobicContact CB-CZ 4.11Å; K95-F107 HydrophobicContact CD-CZ 4.44Å; K95-L229 HydrophobicContact CD-CD1 3.63Å; K95-L229 HydrophobicContact CG-CD1 3.67Å; K95-L229 VanDerWaalsContact NZ-CD1 3.33Å
96	L	83.8	Confident	84.7	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	151.3	175.5	-58.3	176.5	0	0	0	109.6	I94 Q102 T146 L150 E230 L232	I94-L96 HydrophobicContact CG2-CD2 4.06Å; I94-L96 PolarHBondContact O-N 3.31Å; L96-Q102 HydrophobicContact CD2-CG 3.93Å; L96-T146 HydrophobicContact CB-CG2 4.31Å; L96-L150 HydrophobicContact CD1-CD1 4.04Å; L96-L150 HydrophobicContact CD2-CD1 4.49Å; L96-L150 HydrophobicContact CD2-CD2 4.17Å; L96-E230 HydrophobicContact CB-CB 3.88Å; L96-E230 HydrophobicContact CD1-CB 4.16Å; L96-E230 PolarHBondContact N-O 2.81Å; L96-L232 HydrophobicContact CD1-CB 4.29Å; L96-L232 HydrophobicContact CG-CB 4.44Å
97	H	75.8	Confident	84.8	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.417	30%	0.302	S	S	.	.			trans	-134.9	142.2	178.5	-170.3	-94.8	0	0	0	110.2	S99 G100 R101	H97-S99 PolarHBondContact ND1-N 2.86Å; H97-S99 PolarHBondContact ND1-OG 3.25Å; H97-S99 PolarHBondContact O-N 3.19Å; H97-G100 WeakPolarHBondContact O-CA 3.31Å; H97-G100 PolarHBondContact O-N 2.77Å; H97-R101 HydrophobicContact CB-CB 4.33Å; H97-R101 WeakPolarHBondContact CB-O 3.28Å; H97-R101 PolarHBondContact N-O 2.77Å
98	T	66.5	Low	84.8	Confident	119 Å²	119	67.1 Å²	67.1	73%	0.73	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.2	-174.4	54.9	0	0	0	0	114.4	G100	T98-G100 PolarHBondContact O-N 3.34Å
99	S	68.4	Low	84.9	Confident	75 Å²	75	61.4 Å²	61.4	52%	0.524	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	11.2	172.5	66.6	0	0	0	0	115.1	H97 R101	H97-S99 PolarHBondContact ND1-N 2.86Å; H97-S99 PolarHBondContact ND1-OG 3.25Å; H97-S99 PolarHBondContact O-N 3.19Å; S99-R101 PolarHBondContact O-N 3.2Å
100	G	63.1	Low	84.9	Confident	31 Å²	31	55.3 Å²	55.3	32%	0.32	27%	0.272	S	S	.	.	S	Bend	trans	73.6	8.1	-177.8	0	0	0	0	0	114.5	H97 T98	H97-G100 WeakPolarHBondContact O-CA 3.31Å; H97-G100 PolarHBondContact O-N 2.77Å; T98-G100 PolarHBondContact O-N 3.34Å
101	R	72.2	Confident	84.7	Confident	157 Å²	157	62.4 Å²	62.4	59%	0.592	30%	0.303	S	S	*	.			trans	-78.7	146.2	172.3	-66.4	-174.8	-179.8	178.4	-1.5	110	H97 S99 Y103	H97-R101 HydrophobicContact CB-CB 4.33Å; H97-R101 WeakPolarHBondContact CB-O 3.28Å; H97-R101 PolarHBondContact N-O 2.77Å; S99-R101 PolarHBondContact O-N 3.2Å; R101-Y103 HydrophobicContact CB-CE2 3.89Å; R101-Y103 WeakPolarHBondContact CD-OH 3.44Å
102	Q	80.6	Confident	84.4	Confident	87 Å²	87	68 Å²	68	41%	0.407	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.7	-175.9	-60.7	178.9	5.9	0	0	108.9	I94 L96 L150	I94-Q102 HydrophobicContact CG2-CB 3.87Å; L96-Q102 HydrophobicContact CD2-CG 3.93Å; Q102-L150 VanDerWaalsContact NE2-CD2 3.31Å
103	Y	83.6	Confident	84.3	Confident	86 Å²	86	64.1 Å²	64.1	34%	0.337	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	104.2	-174.3	-66.6	-71.5	0	0	0	110.2	K95 R101 R105	K95-Y103 PolarHBondContact N-O 2.82Å; K95-Y103 PolarHBondContact O-N 2.7Å; R101-Y103 HydrophobicContact CB-CE2 3.89Å; R101-Y103 WeakPolarHBondContact CD-OH 3.44Å; Y103-R105 WeakPolarHBondContact O-CG 3.14Å; Y103-R105 PolarHBondContact O-N 3.2Å
104	K	86.9	Confident	84.2	Confident	86 Å²	86	67.3 Å²	67.3	37%	0.374	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	130	171.5	-154.8	-179.4	-169.9	-144.5	0	109.5	E92 I94	E92-K104 HydrophobicContact CG-CD 4.38Å; E92-K104 HydrophobicContact CG-CG 4.19Å; E92-K104 VanDerWaalsContact OE1-CD 3.25Å; E92-K104 WeakPolarHBondContact OE1-CD 3.45Å; E92-K104 WeakPolarHBondContact OE1-CE 3.47Å; E92-K104 IonicContact OE1-NZ 2.67Å; E92-K104 PolarHBondContact OE1-NZ 2.86Å; E92-K104 WeakPolarHBondContact OE2-CE 3.23Å; E92-K104 IonicContact OE2-NZ 3.26Å; E92-K104 PolarHBondContact OE2-NZ 2.92Å; I94-K104 HydrophobicContact CG1-CB 4.35Å; I94-K104 HydrophobicContact CG1-CG 4.12Å
105	R	90	Very high	84.3	Confident	33 Å²	33	65.5 Å²	65.5	13%	0.125	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	143.7	-169.4	-70.1	-64.7	179.4	-90.3	4.4	110.1	E92 M93 Y103 F107 W118 S119 T121	E92-R105 CarbonylContact C-O 3.6Å; E92-R105 WeakPolarHBondContact CA-O 3.16Å; M93-R105 PolarHBondContact N-O 3.11Å; M93-R105 PolarHBondContact O-N 3.28Å; M93-R105 VanDerWaalsContact O-O 3.05Å; Y103-R105 WeakPolarHBondContact O-CG 3.14Å; Y103-R105 PolarHBondContact O-N 3.2Å; R105-F107 HydrophobicContact CB-CD2 3.98Å; R105-F107 HydrophobicContact CB-CE2 3.71Å; R105-F107 HydrophobicContact CB-CZ 4.47Å; R105-F107 PolarHBondContact O-N 2.92Å; R105-W118 HydrophobicContact CB-CB 4.42Å; R105-S119 WeakPolarHBondContact CD-O 3.43Å; R105-S119 PolarHBondContact NE-O 2.71Å; R105-S119 VanDerWaalsContact NE-O 3.1Å; R105-T121 PolarHBondContact NH2-OG1 3.14Å
106	M	91.4	Very high	84.5	Confident	77 Å²	77	63.6 Å²	63.6	38%	0.379	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.5	166.2	-163.4	67.4	174.9	0	0	107.4	G90 S91 E92 W118 S119	G90-M106 WeakPolarHBondContact O-CE 2.8Å; S91-M106 VanDerWaalsContact C-SD 3.57Å; E92-M106 HydrophobicContact CB-SD 3.97Å; E92-M106 HydrophobicContact CG-SD 4.46Å; M106-W118 WeakPolarHBondContact O-CA 3.38Å; M106-S119 PolarHBondContact N-OG 3.17Å; M106-S119 PolarHBondContact O-N 2.96Å
107	F	94.6	Very high	84.8	Confident	1 Å²	1	65.8 Å²	65.8	0%	0.004	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.2	172.5	-74	-98.4	0	0	0	109.2	G90 S91 M93 K95 R105 I116 K117 W118 I231 W242	G90-F107 CarbonylContact C-O 3.51Å; G90-F107 WeakPolarHBondContact CA-O 3.41Å; S91-F107 PolarHBondContact N-O 3.15Å; S91-F107 PolarHBondContact O-N 2.78Å; M93-F107 HydrophobicContact CB-CD2 3.86Å; M93-F107 HydrophobicContact CB-CE2 4.08Å; M93-F107 HydrophobicContact CE-CB 3.62Å; M93-F107 HydrophobicContact CE-CD2 3.95Å; M93-F107 HydrophobicContact CE-CG 3.83Å; K95-F107 HydrophobicContact CB-CE2 4.46Å; K95-F107 HydrophobicContact CB-CZ 4.11Å; K95-F107 HydrophobicContact CD-CZ 4.44Å; R105-F107 HydrophobicContact CB-CD2 3.98Å; R105-F107 HydrophobicContact CB-CE2 3.71Å; R105-F107 HydrophobicContact CB-CZ 4.47Å; R105-F107 PolarHBondContact O-N 2.92Å; F107-I116 HydrophobicContact CD1-CG2 4.16Å; F107-K117 CarbonylContact C-O 3.6Å; F107-K117 WeakPolarHBondContact CA-O 3.31Å; F107-W118 HydrophobicContact CD1-CB 3.8Å; F107-W118 HydrophobicContact CD1-CD2 4.39Å; F107-W118 AromaticContact CD1-CE3 3.96Å; F107-W118 HydrophobicContact CD1-CE3 3.96Å; F107-W118 HydrophobicContact CD1-CG 4.37Å; F107-W118 HydrophobicContact CD2-CB 4.49Å; F107-W118 HydrophobicContact CE1-CB 4Å; F107-W118 AromaticContact CE1-CD2 3.91Å; F107-W118 HydrophobicContact CE1-CD2 3.91Å; F107-W118 AromaticContact CE1-CE3 3.59Å; F107-W118 HydrophobicContact CE1-CE3 3.59Å; F107-W118 HydrophobicContact CE1-CG 4.11Å; F107-W118 HydrophobicContact CE1-CZ3 4.42Å; F107-W118 HydrophobicContact CG-CB 4.08Å; F107-W118 HydrophobicContact CZ-CB 4.45Å; F107-I231 HydrophobicContact CD1-CD1 4.29Å; F107-I231 HydrophobicContact CE1-CD1 3.66Å; F107-I231 HydrophobicContact CE1-CG1 4.45Å; F107-I231 HydrophobicContact CE2-CG2 4.35Å; F107-I231 HydrophobicContact CZ-CD1 3.77Å; F107-I231 HydrophobicContact CZ-CG1 4.1Å; F107-I231 HydrophobicContact CZ-CG2 4.5Å; F107-W242 HydrophobicContact CB-CH2 3.92Å; F107-W242 HydrophobicContact CB-CZ2 4.07Å
108	Y	94.2	Very high	85.6	Confident	95 Å²	95	62.6 Å²	62.6	37%	0.373	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.7	175.5	57.7	-81.5	0	0	0	110.8	M87 K117	M87-Y108 CarbonylContact O-C 3.53Å; M87-Y108 VanDerWaalsContact O-CA 3.29Å; M87-Y108 WeakPolarHBondContact O-CA 3.32Å; Y108-K117 HydrophobicContact CD2-CB 4.24Å; Y108-K117 HydrophobicContact CE1-CB 3.98Å; Y108-K117 HydrophobicContact CE2-CB 3.66Å; Y108-K117 HydrophobicContact CE2-CD 4.37Å; Y108-K117 PolarHBondContact N-O 3.23Å; Y108-K117 PolarHBondContact O-N 2.88Å
109	L	93.5	Very high	86.2	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140.4	166.2	-173.5	63	0	0	0	108.7	F84 M87 R88 M113 L249	F84-L109 HydrophobicContact CD1-CD2 4.49Å; M87-L109 HydrophobicContact CB-CB 3.91Å; M87-L109 HydrophobicContact CB-CD2 4.37Å; M87-L109 HydrophobicContact CE-CD2 4.31Å; M87-L109 PolarHBondContact O-N 3.04Å; R88-L109 HydrophobicContact CG-CB 4.06Å; R88-L109 HydrophobicContact CG-CD2 4.38Å; R88-L109 HydrophobicContact CG-CG 4.35Å; L109-M113 HydrophobicContact CD2-CE 3.72Å; L109-M113 HydrophobicContact CD2-SD 3.54Å; L109-M113 VanDerWaalsContact CD2-SD 3.54Å; L109-M113 HydrophobicContact CG-SD 4.2Å; L109-L249 HydrophobicContact CD1-CD1 3.97Å; L109-L249 HydrophobicContact CD2-CD1 3.7Å; L109-L249 HydrophobicContact CD2-CD2 4.47Å
110	N	91	Very high	86	Confident	10 Å²	10	58.4 Å²	58.4	5%	0.053	28%	0.279	C	S	.	.			trans	-74.3	168	177.4	71.6	-46.5	0	0	0	113	Q112 M113 N114 C115 K117	N110-Q112 WeakPolarHBondContact ND2-CB 3.44Å; N110-Q112 PolarHBondContact ND2-N 3.39Å; N110-Q112 PolarHBondContact ND2-OE1 3.04Å; N110-Q112 PolarHBondContact O-N 3Å; N110-M113 PolarHBondContact O-N 3.43Å; N110-M113 VanDerWaalsContact O-N 3.1Å; N110-M113 PolarHBondContact OD1-N 3.15Å; N110-N114 PolarHBondContact ND2-OD1 3.03Å; N110-N114 PolarHBondContact OD1-N 2.86Å; N110-N114 VanDerWaalsContact OD1-N 3.07Å; N110-N114 PolarHBondContact OD1-OD1 2.85Å; N110-C115 PolarHBondContact N-O 2.99Å; N110-C115 PolarHBondContact ND2-SG 3.48Å; N110-C115 VanDerWaalsContact ND2-SG 3.39Å; N110-C115 PolarHBondContact OD1-N 3.17Å; N110-C115 PolarHBondContact OD1-O 3.01Å; N110-C115 PolarHBondContact OD1-SG 3.23Å; N110-K117 HydrophobicContact CB-CD 4.46Å
111	E	86.9	Confident	85.8	Confident	161 Å²	161	61.8 Å²	61.8	75%	0.752	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.9	178.6	-63.3	175.9	146.5	0	0	113	M113	E111-M113 VanDerWaalsContact C-N 3.28Å; E111-M113 PolarHBondContact O-N 3.45Å
112	Q	86.7	Confident	85	Confident	120 Å²	120	60.3 Å²	60.3	56%	0.561	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	9.1	179.1	-52.5	71.9	26.6	0	0	113.1	N110 N114	N110-Q112 WeakPolarHBondContact ND2-CB 3.44Å; N110-Q112 PolarHBondContact ND2-N 3.39Å; N110-Q112 PolarHBondContact ND2-OE1 3.04Å; N110-Q112 PolarHBondContact O-N 3Å; Q112-N114 PolarHBondContact O-N 3.28Å
113	M	89.2	Confident	83.7	Confident	23 Å²	23	66.4 Å²	66.4	11%	0.113	32%	0.323	C	S	.	.	S	Bend	trans	61.7	0.3	171.3	-57.3	-68.4	-74.7	0	0	117	F84 R88 L109 N110 E111 L249 Q254	F84-M113 HydrophobicContact CB-CE 3.48Å; F84-M113 VanDerWaalsContact CB-CE 3.48Å; F84-M113 HydrophobicContact CB-SD 4.43Å; F84-M113 HydrophobicContact CD1-CE 3.99Å; F84-M113 HydrophobicContact CD2-CE 3.25Å; F84-M113 HydrophobicContact CE2-CE 3.88Å; F84-M113 HydrophobicContact CG-CE 3.3Å; R88-M113 HydrophobicContact CG-SD 4.27Å; L109-M113 HydrophobicContact CD2-CE 3.72Å; L109-M113 HydrophobicContact CD2-SD 3.54Å; L109-M113 VanDerWaalsContact CD2-SD 3.54Å; L109-M113 HydrophobicContact CG-SD 4.2Å; N110-M113 PolarHBondContact O-N 3.43Å; N110-M113 VanDerWaalsContact O-N 3.1Å; N110-M113 PolarHBondContact OD1-N 3.15Å; E111-M113 VanDerWaalsContact C-N 3.28Å; E111-M113 PolarHBondContact O-N 3.45Å; M113-L249 HydrophobicContact CB-CD2 4.38Å; M113-L249 HydrophobicContact CE-CD2 3.74Å; M113-Q254 HydrophobicContact CB-CB 4.39Å; M113-Q254 HydrophobicContact CB-CG 4.38Å
114	N	90.4	Very high	82.3	Confident	68 Å²	68	71.9 Å²	71.9	36%	0.364	34%	0.343	S	S	.	.	S	Bend	trans	-102.6	-3.4	-169.2	71.8	-19.1	0	0	0	115.2	N110 Q112 D131 I132	N110-N114 PolarHBondContact ND2-OD1 3.03Å; N110-N114 PolarHBondContact OD1-N 2.86Å; N110-N114 VanDerWaalsContact OD1-N 3.07Å; N110-N114 PolarHBondContact OD1-OD1 2.85Å; Q112-N114 PolarHBondContact O-N 3.28Å; N114-D131 WeakPolarHBondContact O-CA 3.36Å; N114-I132 WeakPolarHBondContact O-CG1 3.48Å; N114-I132 PolarHBondContact O-N 3Å
115	C	91.5	Very high	80.9	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.02	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	138.1	175.1	61.3	0	0	0	0	114.4	N110 K117 I130 D131	N110-C115 PolarHBondContact N-O 2.99Å; N110-C115 PolarHBondContact ND2-SG 3.48Å; N110-C115 VanDerWaalsContact ND2-SG 3.39Å; N110-C115 PolarHBondContact OD1-N 3.17Å; N110-C115 PolarHBondContact OD1-O 3.01Å; N110-C115 PolarHBondContact OD1-SG 3.23Å; C115-K117 WeakPolarHBondContact SG-CE 3.2Å; C115-K117 PolarHBondContact SG-NZ 3.28Å; C115-I130 CarbonylContact C-O 3.34Å; C115-I130 VanDerWaalsContact CA-O 3.3Å; C115-I130 WeakPolarHBondContact CA-O 3.45Å; C115-D131 HydrophobicContact CB-CB 4.45Å; C115-D131 WeakPolarHBondContact CB-OD1 3.39Å
116	I	93.5	Very high	79.5	Confident	3 Å²	3	78 Å²	78	2%	0.015	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.5	167.7	-47.3	171.3	0	0	0	107.7	F107 Q129 I130 I132 I135 I220 W242 L246	F107-I116 HydrophobicContact CD1-CG2 4.16Å; I116-Q129 CarbonylContact O-C 3.49Å; I116-Q129 WeakPolarHBondContact O-CA 3.23Å; I116-Q129 WeakPolarHBondContact O-CB 3.48Å; I116-I130 PolarHBondContact N-O 2.79Å; I116-I130 PolarHBondContact O-N 3.08Å; I116-I132 HydrophobicContact CD1-CD1 4.45Å; I116-I132 HydrophobicContact CG1-CD1 3.93Å; I116-I135 HydrophobicContact CD1-CD1 3.86Å; I116-I220 HydrophobicContact CD1-CD1 3.75Å; I116-W242 HydrophobicContact CG2-CH2 4.33Å; I116-W242 HydrophobicContact CG2-CZ3 3.89Å; I116-L246 HydrophobicContact CD1-CD1 3.92Å; I116-L246 HydrophobicContact CD1-CD2 3.51Å; I116-L246 HydrophobicContact CD1-CG 4.38Å; I116-L246 HydrophobicContact CG1-CD2 3.84Å
117	K	91.2	Very high	78.2	Confident	54 Å²	54	80.3 Å²	80.3	24%	0.235	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	149.9	176.7	-84.4	161.7	175	153.7	0	111.8	F107 Y108 N110 C115 Q129	F107-K117 CarbonylContact C-O 3.6Å; F107-K117 WeakPolarHBondContact CA-O 3.31Å; Y108-K117 HydrophobicContact CD2-CB 4.24Å; Y108-K117 HydrophobicContact CE1-CB 3.98Å; Y108-K117 HydrophobicContact CE2-CB 3.66Å; Y108-K117 HydrophobicContact CE2-CD 4.37Å; Y108-K117 PolarHBondContact N-O 3.23Å; Y108-K117 PolarHBondContact O-N 2.88Å; N110-K117 HydrophobicContact CB-CD 4.46Å; C115-K117 WeakPolarHBondContact SG-CE 3.2Å; C115-K117 PolarHBondContact SG-NZ 3.28Å; K117-Q129 HydrophobicContact CD-CB 4.49Å; K117-Q129 HydrophobicContact CG-CB 3.59Å
118	W	91	Very high	77.7	Confident	22 Å²	22	80.8 Å²	80.8	8%	0.083	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	159.1	172.4	65.9	77.7	0	0	0	113.6	R105 M106 F107 S120 S128 I130 L229	R105-W118 HydrophobicContact CB-CB 4.42Å; M106-W118 WeakPolarHBondContact O-CA 3.38Å; F107-W118 HydrophobicContact CD1-CB 3.8Å; F107-W118 HydrophobicContact CD1-CD2 4.39Å; F107-W118 AromaticContact CD1-CE3 3.96Å; F107-W118 HydrophobicContact CD1-CE3 3.96Å; F107-W118 HydrophobicContact CD1-CG 4.37Å; F107-W118 HydrophobicContact CD2-CB 4.49Å; F107-W118 HydrophobicContact CE1-CB 4Å; F107-W118 AromaticContact CE1-CD2 3.91Å; F107-W118 HydrophobicContact CE1-CD2 3.91Å; F107-W118 AromaticContact CE1-CE3 3.59Å; F107-W118 HydrophobicContact CE1-CE3 3.59Å; F107-W118 HydrophobicContact CE1-CG 4.11Å; F107-W118 HydrophobicContact CE1-CZ3 4.42Å; F107-W118 HydrophobicContact CG-CB 4.08Å; F107-W118 HydrophobicContact CZ-CB 4.45Å; W118-S120 PolarHBondContact O-N 3.03Å; W118-S120 VanDerWaalsContact O-N 3.12Å; W118-S128 PolarHBondContact N-O 3.5Å; W118-S128 VanDerWaalsContact NE1-CB 3.28Å; W118-S128 PolarHBondContact NE1-OG 2.73Å; W118-S128 WeakPolarHBondContact O-CB 3.39Å; W118-I130 HydrophobicContact CH2-CD1 4.01Å; W118-I130 HydrophobicContact CH2-CG1 3.87Å; W118-I130 HydrophobicContact CZ3-CD1 3.84Å; W118-I130 HydrophobicContact CZ3-CG1 3.8Å; W118-L229 HydrophobicContact CH2-CD2 4.34Å; W118-L229 HydrophobicContact CZ3-CD2 4.15Å
119	S	79.3	Confident	77.5	Confident	60 Å²	60	79.5 Å²	79.5	42%	0.42	40%	0.398	S	S	.	.			trans	-71	102.5	-177.5	46.2	0	0	0	0	113.6	R105 M106	R105-S119 WeakPolarHBondContact CD-O 3.43Å; R105-S119 PolarHBondContact NE-O 2.71Å; R105-S119 VanDerWaalsContact NE-O 3.1Å; M106-S119 PolarHBondContact N-OG 3.17Å; M106-S119 PolarHBondContact O-N 2.96Å
120	S	65	Low	77.4	Confident	46 Å²	46	79.4 Å²	79.4	32%	0.322	40%	0.398	S	S	.	.			trans	-63.5	139.8	175	-170.8	0	0	0	0	112.3	W118 N122 R124 S128	W118-S120 PolarHBondContact O-N 3.03Å; W118-S120 VanDerWaalsContact O-N 3.12Å; S120-N122 VanDerWaalsContact C-N 3.3Å; S120-N122 WeakPolarHBondContact CB-O 3.32Å; S120-N122 PolarHBondContact OG-N 2.79Å; S120-N122 PolarHBondContact OG-O 3.09Å; S120-R124 PolarHBondContact OG-O 2.88Å; S120-S128 WeakPolarHBondContact CB-OG 3.37Å
121	T	59	Low	77.5	Confident	103 Å²	103	81.8 Å²	81.8	63%	0.632	41%	0.411	S	S	*	.	S	Bend	trans	-75.6	-15.2	173.4	19.8	0	0	0	0	114	R105	R105-T121 PolarHBondContact NH2-OG1 3.14Å
122	N	55.3	Low	77.7	Confident	125 Å²	125	74.3 Å²	74.3	67%	0.668	38%	0.376	S	S	*	.	S	Bend	trans	-122	151.6	179.3	-73.4	-20.9	0	0	0	109.5	S120 R124	S120-N122 VanDerWaalsContact C-N 3.3Å; S120-N122 WeakPolarHBondContact CB-O 3.32Å; S120-N122 PolarHBondContact OG-N 2.79Å; S120-N122 PolarHBondContact OG-O 3.09Å; N122-R124 PolarHBondContact O-N 3.18Å
123	K	53.7	Low	77.9	Confident	216 Å²	216	76.9 Å²	76.9	94%	0.939	39%	0.388	S	S	*	.	S	Bend	trans	-63.3	13.6	-175.1	-68	-171.2	175.3	-175.3	0	116.7
124	R	54.2	Low	78.1	Confident	200 Å²	200	79.7 Å²	79.7	76%	0.755	40%	0.401	S	S	*	.			trans	-101.5	101.9	168.3	-67.6	-174.3	179.7	-177.7	-0.7	108.6	S120 N122	S120-R124 PolarHBondContact OG-O 2.88Å; N122-R124 PolarHBondContact O-N 3.18Å
125	Q	56.7	Low	78.2	Confident	164 Å²	164	77 Å²	77	77%	0.766	39%	0.386	S	S	*	.			trans	-75.7	-26.6	179.7	-72.9	166.6	-59.6	0	0	112.9	N127 S128	Q125-N127 PolarHBondContact O-N 3.3Å; Q125-N127 VanDerWaalsContact O-N 3.11Å; Q125-S128 PolarHBondContact O-N 2.9Å; Q125-S128 VanDerWaalsContact O-N 3.1Å
126	S	61.1	Low	78.2	Confident	83 Å²	83	81.2 Å²	81.2	58%	0.58	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-35.3	-177.7	50.3	0	0	0	0	114.9	S128	S126-S128 VanDerWaalsContact C-N 3.31Å; S126-S128 PolarHBondContact O-N 2.8Å
127	N	64.6	Low	78	Confident	127 Å²	127	85.3 Å²	85.3	68%	0.679	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	29.5	-175.5	-60.7	67.2	0	0	0	111.8	Q125	Q125-N127 PolarHBondContact O-N 3.3Å; Q125-N127 VanDerWaalsContact O-N 3.11Å
128	S	84	Confident	78	Confident	10 Å²	10	83.1 Å²	83.1	7%	0.07	42%	0.415	C	S	.	.	S	Bend	trans	-140	37.1	178.9	-67.9	0	0	0	0	112.8	W118 S120 Q125 S126	W118-S128 PolarHBondContact N-O 3.5Å; W118-S128 VanDerWaalsContact NE1-CB 3.28Å; W118-S128 PolarHBondContact NE1-OG 2.73Å; W118-S128 WeakPolarHBondContact O-CB 3.39Å; S120-S128 WeakPolarHBondContact CB-OG 3.37Å; Q125-S128 PolarHBondContact O-N 2.9Å; Q125-S128 VanDerWaalsContact O-N 3.1Å; S126-S128 VanDerWaalsContact C-N 3.31Å; S126-S128 PolarHBondContact O-N 2.8Å
129	Q	89.9	Confident	77.8	Confident	69 Å²	69	86.4 Å²	86.4	32%	0.322	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	163.5	161.6	73.6	-171.5	49.7	0	0	110.6	I116 K117 D131	I116-Q129 CarbonylContact O-C 3.49Å; I116-Q129 WeakPolarHBondContact O-CA 3.23Å; I116-Q129 WeakPolarHBondContact O-CB 3.48Å; K117-Q129 HydrophobicContact CD-CB 4.49Å; K117-Q129 HydrophobicContact CG-CB 3.59Å; Q129-D131 PolarHBondContact NE2-OD1 3.16Å; Q129-D131 PolarHBondContact NE2-OD2 3.33Å
130	I	92.2	Very high	78	Confident	1 Å²	1	85.1 Å²	85.1	1%	0.005	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	127.1	160.9	-66.8	167.1	0	0	0	105.6	C115 I116 W118 I135 Y222 L229	C115-I130 CarbonylContact C-O 3.34Å; C115-I130 VanDerWaalsContact CA-O 3.3Å; C115-I130 WeakPolarHBondContact CA-O 3.45Å; I116-I130 PolarHBondContact N-O 2.79Å; I116-I130 PolarHBondContact O-N 3.08Å; W118-I130 HydrophobicContact CH2-CD1 4.01Å; W118-I130 HydrophobicContact CH2-CG1 3.87Å; W118-I130 HydrophobicContact CZ3-CD1 3.84Å; W118-I130 HydrophobicContact CZ3-CG1 3.8Å; I130-I135 HydrophobicContact CG2-CD1 4.09Å; I130-I135 HydrophobicContact CG2-CG1 3.69Å; I130-Y222 HydrophobicContact CB-CD2 4.36Å; I130-Y222 HydrophobicContact CD1-CD1 3.63Å; I130-Y222 HydrophobicContact CD1-CD2 3.92Å; I130-Y222 HydrophobicContact CD1-CE1 3.53Å; I130-Y222 HydrophobicContact CD1-CE2 3.83Å; I130-Y222 HydrophobicContact CD1-CG 3.82Å; I130-Y222 HydrophobicContact CG1-CD1 4.38Å; I130-Y222 HydrophobicContact CG1-CD2 3.74Å; I130-Y222 HydrophobicContact CG1-CE1 4.26Å; I130-Y222 HydrophobicContact CG1-CE2 3.6Å; I130-Y222 HydrophobicContact CG1-CG 4.14Å; I130-Y222 HydrophobicContact CG2-CD2 3.75Å; I130-Y222 HydrophobicContact CG2-CE2 4.46Å; I130-Y222 HydrophobicContact CG2-CG 3.9Å; I130-L229 HydrophobicContact CD1-CD2 3.49Å; I130-L229 VanDerWaalsContact CD1-CD2 3.49Å
131	D	92	Very high	78.6	Confident	60 Å²	60	83.6 Å²	83.6	32%	0.321	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	138.4	177.5	-60.4	-14.9	0	0	0	108.2	N114 C115 Q129 E133 E134	N114-D131 WeakPolarHBondContact O-CA 3.36Å; C115-D131 HydrophobicContact CB-CB 4.45Å; C115-D131 WeakPolarHBondContact CB-OD1 3.39Å; Q129-D131 PolarHBondContact NE2-OD1 3.16Å; Q129-D131 PolarHBondContact NE2-OD2 3.33Å; D131-E133 PolarHBondContact O-N 3.01Å; D131-E133 VanDerWaalsContact O-N 3.17Å; D131-E134 HydrophobicContact CB-CG 4.49Å; D131-E134 WeakPolarHBondContact O-CB 3.48Å; D131-E134 PolarHBondContact O-N 3.42Å
132	I	92.3	Very high	79	Confident	4 Å²	4	80 Å²	80	2%	0.021	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-61.2	-32	-167.9	-65.3	-66.2	0	0	0	111.6	N114 I116 E134 I135 L246 L249 M250	N114-I132 WeakPolarHBondContact O-CG1 3.48Å; N114-I132 PolarHBondContact O-N 3Å; I116-I132 HydrophobicContact CD1-CD1 4.45Å; I116-I132 HydrophobicContact CG1-CD1 3.93Å; I132-E134 PolarHBondContact O-N 3.18Å; I132-I135 HydrophobicContact CD1-CD1 3.88Å; I132-I135 WeakPolarHBondContact O-CB 3.34Å; I132-I135 PolarHBondContact O-N 3.18Å; I132-I135 VanDerWaalsContact O-N 3.09Å; I132-L246 HydrophobicContact CD1-CD2 3.71Å; I132-L249 HydrophobicContact CD1-CB 4.43Å; I132-L249 HydrophobicContact CD1-CD1 4.22Å; I132-L249 HydrophobicContact CG2-CB 3.97Å; I132-M250 HydrophobicContact CG2-CG 4.4Å
133	E	90.6	Very high	79.2	Confident	173 Å²	173	77.7 Å²	77.7	81%	0.808	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-65.4	-22.9	176	-62.5	177.4	-168.2	0	0	113.5	D131 I135	D131-E133 PolarHBondContact O-N 3.01Å; D131-E133 VanDerWaalsContact O-N 3.17Å; E133-I135 VanDerWaalsContact C-N 3.3Å
134	E	92.4	Very high	79	Confident	83 Å²	83	69.5 Å²	69.5	39%	0.388	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-78.3	-12.9	173.5	-62.7	-166.7	135	0	0	112.7	D131 I132 Y222 G223	D131-E134 HydrophobicContact CB-CG 4.49Å; D131-E134 WeakPolarHBondContact O-CB 3.48Å; D131-E134 PolarHBondContact O-N 3.42Å; I132-E134 PolarHBondContact O-N 3.18Å; E134-Y222 CarbonylContact O-C 3.58Å; E134-Y222 WeakPolarHBondContact O-CA 3.28Å; E134-Y222 WeakPolarHBondContact O-CB 3.42Å; E134-G223 PolarHBondContact O-N 3.38Å
135	I	93.3	Very high	78.7	Confident	11 Å²	11	68 Å²	68	6%	0.056	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.8	-174.5	-55.8	179.4	0	0	0	110.2	I116 I130 I132 E133 V138 I220 L246 M250	I116-I135 HydrophobicContact CD1-CD1 3.86Å; I130-I135 HydrophobicContact CG2-CD1 4.09Å; I130-I135 HydrophobicContact CG2-CG1 3.69Å; I132-I135 HydrophobicContact CD1-CD1 3.88Å; I132-I135 WeakPolarHBondContact O-CB 3.34Å; I132-I135 PolarHBondContact O-N 3.18Å; I132-I135 VanDerWaalsContact O-N 3.09Å; E133-I135 VanDerWaalsContact C-N 3.3Å; I135-V138 HydrophobicContact CG2-CG2 3.57Å; I135-I220 HydrophobicContact CD1-CG2 4.14Å; I135-I220 HydrophobicContact CG1-CG2 4.13Å; I135-I220 HydrophobicContact CG2-CG2 3.83Å; I135-L246 HydrophobicContact CD1-CD2 4.43Å; I135-M250 HydrophobicContact CB-CE 4.5Å; I135-M250 HydrophobicContact CB-CG 4.36Å; I135-M250 HydrophobicContact CB-SD 4.28Å; I135-M250 HydrophobicContact CG2-CE 3.9Å; I135-M250 HydrophobicContact CG2-CG 4.33Å; I135-M250 HydrophobicContact CG2-SD 3.62Å
136	H	90.6	Very high	78.2	Confident	91 Å²	91	60.6 Å²	60.6	42%	0.421	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-36.2	179	-62	-26.3	0	0	0	112.6	C221 G223 F226	H136-C221 PolarHBondContact N-O 3.49Å; H136-G223 PolarHBondContact NE2-O 3.15Å; H136-F226 HydrophobicContact CB-CE1 4.24Å; H136-F226 AromaticContact CD2-CD1 3.81Å; H136-F226 AromaticContact CD2-CE1 3.58Å; H136-F226 AromaticContact CD2-CZ 3.92Å
137	E	89.9	Confident	77.5	Confident	90 Å²	90	60 Å²	60	42%	0.421	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	144.7	177.2	-167.3	-173.2	173.4	0	0	111.1	Q139 C221	E137-Q139 PolarHBondContact OE1-NE2 2.95Å; E137-C221 HydrophobicContact CB-CB 4.06Å; E137-C221 PolarHBondContact N-O 3.47Å; E137-C221 PolarHBondContact O-N 3.3Å
138	V	90.8	Very high	76.6	Confident	7 Å²	7	60.1 Å²	60.1	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125	164.8	-174.5	0	0	0	0	109.6	I135 F218 T219 I220 V243 L246 M250	I135-V138 HydrophobicContact CG2-CG2 3.57Å; V138-F218 HydrophobicContact CG1-CD2 4.33Å; V138-T219 WeakPolarHBondContact CA-O 3.26Å; V138-I220 HydrophobicContact CG1-CG1 4.37Å; V138-I220 HydrophobicContact CG2-CG1 4.28Å; V138-I220 HydrophobicContact CG2-CG2 4.29Å; V138-V243 HydrophobicContact CG1-CB 4.24Å; V138-V243 HydrophobicContact CG1-CG1 4.03Å; V138-V243 HydrophobicContact CG1-CG2 3.86Å; V138-L246 HydrophobicContact CG1-CB 4.37Å; V138-L246 HydrophobicContact CG1-CD1 4.13Å; V138-L246 HydrophobicContact CG2-CB 4.04Å; V138-L246 HydrophobicContact CG2-CD1 4.2Å; V138-M250 HydrophobicContact CG2-SD 3.77Å
139	Q	87.3	Confident	74.7	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.3	-172.5	-163.4	-175.2	94.4	0	0	111.3	E137 F218 T219	E137-Q139 PolarHBondContact OE1-NE2 2.95Å; Q139-F218 CarbonylContact O-C 3.39Å; Q139-F218 VanDerWaalsContact O-CA 3.29Å; Q139-F218 WeakPolarHBondContact O-CA 3.2Å; Q139-F218 WeakPolarHBondContact O-CB 3.42Å; Q139-T219 PolarHBondContact N-O 2.8Å; Q139-T219 PolarHBondContact O-N 2.86Å
140	L	84.1	Confident	72.6	Confident	34 Å²	34	59.6 Å²	59.6	18%	0.178	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	134.9	170.3	-73.6	157.6	0	0	0	110	F218 A239 N240 V243	L140-F218 HydrophobicContact CD2-CB 4.45Å; L140-A239 HydrophobicContact CD2-CB 4.02Å; L140-N240 VanDerWaalsContact CD1-OD1 3.29Å; L140-N240 WeakPolarHBondContact CD1-OD1 3.43Å; L140-V243 HydrophobicContact CD2-CB 4.28Å; L140-V243 HydrophobicContact CD2-CG2 3.79Å; L140-V243 HydrophobicContact CG-CB 4.21Å; L140-V243 HydrophobicContact CG-CG1 4.18Å; L140-V243 HydrophobicContact CG-CG2 3.96Å
141	G	77.1	Confident	70.2	Confident	13 Å²	13	61.8 Å²	61.8	13%	0.134	33%	0.328	C	S	.	.	S	Bend	trans	107.2	176.5	-172.4	0	0	0	0	0	114.4	S214 A217 F218 T219	G141-S214 WeakPolarHBondContact CA-O 3.34Å; G141-A217 PolarHBondContact N-O 2.85Å; G141-F218 CarbonylContact O-C 3.56Å; G141-F218 WeakPolarHBondContact O-CA 3.49Å; G141-T219 PolarHBondContact O-N 3.48Å; G141-T219 PolarHBondContact O-OG1 3.34Å
142	C	68	Low	67.7	Low	28 Å²	28	69.7 Å²	69.7	19%	0.189	35%	0.353	C	S	.	.			trans	-107	125.4	169	-65	0	0	0	0	109	S144 T147 A217	C142-S144 VanDerWaalsContact C-N 3.31Å; C142-S144 PolarHBondContact O-N 3.01Å; C142-T147 HydrophobicContact CB-CG2 4.02Å; C142-A217 VanDerWaalsContact SG-CB 3.6Å
143	S	58	Low	65.1	Low	76 Å²	76	79.5 Å²	79.5	53%	0.531	39%	0.39	S	S	.	.			trans	-78.6	-10.7	178.5	58.7	0	0	0	0	113.9
144	S	50.6	Low	62.4	Low	44 Å²	44	82.5 Å²	82.5	31%	0.308	39%	0.394	S	S	.	.	S	Bend	trans	-122.4	178.1	-168.6	89	0	0	0	0	116.2	C142 T146 E230	C142-S144 VanDerWaalsContact C-N 3.31Å; C142-S144 PolarHBondContact O-N 3.01Å; S144-T146 PolarHBondContact O-N 3.09Å; S144-T146 PolarHBondContact OG-OG1 2.87Å; S144-E230 VanDerWaalsContact CB-OE1 3.27Å; S144-E230 WeakPolarHBondContact CB-OE1 3.28Å; S144-E230 PolarHBondContact N-OE1 2.84Å; S144-E230 VanDerWaalsContact N-OE1 3.16Å; S144-E230 VanDerWaalsContact OG-CD 3.26Å; S144-E230 PolarHBondContact OG-OE1 3.32Å; S144-E230 PolarHBondContact OG-OE2 3.18Å
145	R	47.1	Very low	59.6	Low	169 Å²	169	82.6 Å²	82.6	64%	0.638	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-6.7	-178.8	-73.5	-175.5	173.9	-173.8	-0.9	114.7	T147 H148	R145-T147 PolarHBondContact O-N 3.1Å; R145-H148 WeakPolarHBondContact O-CB 3.5Å; R145-H148 PolarHBondContact O-N 3.33Å
146	T	47.4	Very low	56.7	Low	9 Å²	9	89.3 Å²	89.3	6%	0.055	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.2	-176	-47.4	0	0	0	0	113.3	L96 S144 H148 S149 L150 E230	L96-T146 HydrophobicContact CB-CG2 4.31Å; S144-T146 PolarHBondContact O-N 3.09Å; S144-T146 PolarHBondContact OG-OG1 2.87Å; T146-H148 PolarHBondContact O-N 3.48Å; T146-H148 VanDerWaalsContact O-N 3.13Å; T146-S149 WeakPolarHBondContact O-CB 3.33Å; T146-S149 PolarHBondContact O-N 3.3Å; T146-S149 PolarHBondContact O-OG 3.25Å; T146-L150 PolarHBondContact O-N 3.28Å; T146-E230 WeakPolarHBondContact CB-OE2 3.37Å; T146-E230 PolarHBondContact OG1-OE2 2.8Å
147	T	46.4	Very low	53.8	Low	71 Å²	71	89.1 Å²	89.1	44%	0.436	45%	0.445	S	S	.	.	H	α-helix	trans	-52.3	-31	173.5	57.3	0	0	0	0	114.1	C142 R145 S149	C142-T147 HydrophobicContact CB-CG2 4.02Å; R145-T147 PolarHBondContact O-N 3.1Å; T147-S149 VanDerWaalsContact C-N 3.28Å; T147-S149 PolarHBondContact O-N 3.28Å
148	H	44.3	Very low	51.1	Low	128 Å²	128	91.3 Å²	91.3	59%	0.593	46%	0.457	S	S	*	.	H	α-helix	trans	-70.8	-18.6	175.3	-71.1	-74.6	0	0	0	114.3	R145 T146	R145-H148 WeakPolarHBondContact O-CB 3.5Å; R145-H148 PolarHBondContact O-N 3.33Å; T146-H148 PolarHBondContact O-N 3.48Å; T146-H148 VanDerWaalsContact O-N 3.13Å
149	S	44.5	Very low	48	Very low	39 Å²	39	95.1 Å²	95.1	27%	0.273	48%	0.481	S	S	.	.	H	α-helix	trans	-87.2	-42.2	177.5	73.9	0	0	0	0	112.1	T146 T147 G151 R152	T146-S149 WeakPolarHBondContact O-CB 3.33Å; T146-S149 PolarHBondContact O-N 3.3Å; T146-S149 PolarHBondContact O-OG 3.25Å; T147-S149 VanDerWaalsContact C-N 3.28Å; T147-S149 PolarHBondContact O-N 3.28Å; S149-G151 VanDerWaalsContact C-N 3.35Å; S149-G151 PolarHBondContact O-N 2.55Å; S149-R152 PolarHBondContact O-N 2.91Å; S149-R152 VanDerWaalsContact O-N 3.16Å
150	L	45.4	Very low	45.1	Very low	29 Å²	29	96.8 Å²	96.8	15%	0.152	50%	0.5	C	S	.	.	H	α-helix	trans	-56.3	-46.1	179.6	-78.1	155.7	0	0	0	111.7	L96 Q102 T146 R152 R153 L213 L232	L96-L150 HydrophobicContact CD1-CD1 4.04Å; L96-L150 HydrophobicContact CD2-CD1 4.49Å; L96-L150 HydrophobicContact CD2-CD2 4.17Å; Q102-L150 VanDerWaalsContact NE2-CD2 3.31Å; T146-L150 PolarHBondContact O-N 3.28Å; L150-R152 PolarHBondContact O-N 3.16Å; L150-R152 VanDerWaalsContact O-N 3.08Å; L150-R153 PolarHBondContact O-N 3.23Å; L150-L213 HydrophobicContact CB-CD2 4.35Å; L150-L213 HydrophobicContact CD1-CD2 4.26Å; L150-L213 HydrophobicContact CD2-CD2 3.96Å; L150-L213 HydrophobicContact CG-CD2 4.43Å; L150-L232 HydrophobicContact CD2-CD2 4.35Å
151	G	42.2	Very low	42.3	Very low	48 Å²	48	100.7 Å²	100.7	50%	0.495	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-1.8	-179.7	0	0	0	0	0	116.5	S149	S149-G151 VanDerWaalsContact C-N 3.35Å; S149-G151 PolarHBondContact O-N 2.55Å
152	R	39.7	Very low	39.7	Very low	225 Å²	225	108.3 Å²	108.3	85%	0.849	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-7.2	-179.6	-69.9	-165.4	-173.2	-138.7	5.3	115.1	S149 L150	S149-R152 PolarHBondContact O-N 2.91Å; S149-R152 VanDerWaalsContact O-N 3.16Å; L150-R152 PolarHBondContact O-N 3.16Å; L150-R152 VanDerWaalsContact O-N 3.08Å
153	R	37.2	Very low	37.7	Very low	211 Å²	211	111.6 Å²	111.6	80%	0.796	59%	0.585	S	S	*	*	S	Bend	trans	-121.7	143.2	174.7	-66.8	-173.6	174.4	-149.5	-4.9	108.7	L150	L150-R153 PolarHBondContact O-N 3.23Å
154	R	33.9	Very low	36.2	Very low	236 Å²	236	116.7 Å²	116.7	89%	0.891	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-58.8	131.8	173.5	-74.5	-179.7	175.9	159.5	-1.9	108.4	L156	R154-L156 PolarHBondContact O-N 3.27Å
155	P	35	Very low	35	Very low	85 Å²	85	118.1 Å²	118.1	55%	0.552	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-60.7	134.3	163.7	27.3	-32.4	0	0	0	108.2	T209	P155-T209 HydrophobicContact CG-CG2 4.49Å
156	L	30.7	Very low	34	Very low	152 Å²	152	119 Å²	119	80%	0.796	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-70.2	148.9	172.9	-70.3	169.8	0	0	0	109.4	R154 M158	R154-L156 PolarHBondContact O-N 3.27Å; L156-M158 PolarHBondContact O-N 2.86Å
157	S	31.3	Very low	33.1	Very low	86 Å²	86	126.6 Å²	126.6	60%	0.601	67%	0.67	S	S	*	*			trans	-62.7	98.1	-174.7	-173.4	0	0	0	0	112.2	T159	S157-T159 PolarHBondContact O-N 2.75Å; S157-T159 VanDerWaalsContact O-N 3.11Å; S157-T159 WeakPolarHBondContact OG-CG2 3.27Å; S157-T159 PolarHBondContact OG-OG1 2.9Å
158	M	32.7	Very low	32	Very low	136 Å²	136	128.6 Å²	128.6	67%	0.67	69%	0.687	S	S	*	*			trans	-83.6	59.2	165.2	-62.9	-67	88.4	0	0	110	L156	L156-M158 PolarHBondContact O-N 2.86Å
159	T	25.9	Very low	31.2	Very low	88 Å²	88	128.3 Å²	128.3	54%	0.54	70%	0.699	S	S	.	*			trans	-72.4	129.1	163.3	34.9	0	0	0	0	109	S157 T161	S157-T159 PolarHBondContact O-N 2.75Å; S157-T159 VanDerWaalsContact O-N 3.11Å; S157-T159 WeakPolarHBondContact OG-CG2 3.27Å; S157-T159 PolarHBondContact OG-OG1 2.9Å; T159-T161 PolarHBondContact O-N 3.1Å
160	P	24.9	Very low	30.3	Very low	126 Å²	126	132.4 Å²	132.4	82%	0.818	73%	0.728	S	S	*	*			trans	-71.8	93.3	-179.4	28.8	-34.3	0	0	0	110.8	L162	P160-L162 PolarHBondContact O-N 3.24Å; P160-L162 VanDerWaalsContact O-N 3.1Å
161	T	25.3	Very low	29.5	Very low	115 Å²	115	135 Å²	135	71%	0.706	76%	0.761	S	S	*	*			trans	-74.2	99.3	176.6	50.4	0	0	0	0	110.7	T159 S163	T159-T161 PolarHBondContact O-N 3.1Å; T161-S163 PolarHBondContact O-N 2.76Å
162	L	22.6	Very low	28.6	Very low	173 Å²	173	138.8 Å²	138.8	91%	0.906	78%	0.78	S	S	*	*			trans	-65.2	94.9	167.6	-79.7	166.7	0	0	0	110.4	P160	P160-L162 PolarHBondContact O-N 3.24Å; P160-L162 VanDerWaalsContact O-N 3.1Å
163	S	27	Very low	28	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	78%	0.778	S	S	*	*			trans	-142.8	98.5	169.2	59.4	0	0	0	0	110.9	T161 G165	T161-S163 PolarHBondContact O-N 2.76Å; S163-G165 PolarHBondContact O-N 3.44Å
164	H	27.2	Very low	27.4	Very low	183 Å²	183	126.9 Å²	126.9	85%	0.847	78%	0.776	S	S	*	*			trans	-63.8	126.4	163.5	-92.5	-101.2	0	0	0	109.1
165	G	24	Very low	27.1	Very low	74 Å²	74	123.4 Å²	123.4	76%	0.763	77%	0.774	S	S	*	*			trans	-80.4	134.8	173.8	0	0	0	0	0	111.8	S163	S163-G165 PolarHBondContact O-N 3.44Å
166	F	26.4	Very low	26.6	Very low	188 Å²	188	126.4 Å²	126.4	83%	0.825	78%	0.784	S	S	*	*			trans	-128.7	109.7	162.5	-103.7	-76.9	0	0	0	110.7
167	L	27.7	Very low	26.4	Very low	167 Å²	167	127.5 Å²	127.5	87%	0.874	79%	0.785	S	S	*	*			trans	63.8	158.3	158.3	-65.6	167.8	0	0	0	119
168	S	23.2	Very low	26.1	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	80%	0.798	S	S	*	*			trans	-114	139.8	-167.9	54.2	0	0	0	0	112.2
169	S	29	Very low	25.7	Very low	121 Å²	121	127.3 Å²	127.3	85%	0.846	80%	0.803	S	S	*	*			trans	-145.9	144.5	150.3	61.3	0	0	0	0	110.9
170	S	24.8	Very low	25.5	Very low	126 Å²	126	128.6 Å²	128.6	88%	0.881	82%	0.816	S	S	*	*			trans	-76.7	140.3	-177.2	49.4	0	0	0	0	112.8
171	G	28.2	Very low	25.4	Very low	82 Å²	82	132.5 Å²	132.5	85%	0.845	82%	0.82	S	S	*	*			trans	-166.8	120.3	168.9	0	0	0	0	0	112.4
172	S	23.4	Very low	25.3	Very low	128 Å²	128	135 Å²	135	90%	0.895	83%	0.825	S	S	*	*			trans	-103.5	128.5	-178.7	53.7	0	0	0	0	111.7
173	G	27.1	Very low	25.4	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	82%	0.824	S	S	*	*			trans	-179	86.7	178.7	0	0	0	0	0	117.3
174	S	24.4	Very low	25.2	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	83%	0.829	S	S	*	*			trans	7.1	149.4	147.1	-151.3	0	0	0	0	123.3
175	L	28.1	Very low	25.1	Very low	163 Å²	163	134.5 Å²	134.5	85%	0.853	82%	0.824	S	S	*	*			trans	90.9	135.3	149.3	-85.6	160.3	0	0	0	122.2
176	I	25	Very low	25.1	Very low	147 Å²	147	138.6 Å²	138.6	75%	0.754	83%	0.828	S	S	*	*			trans	-98.2	147	172.6	-52.5	156.8	0	0	0	104.9
177	Q	26.1	Very low	25.2	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.822	83%	0.831	S	S	*	*				178	146.6	66.6	-167.6	169	31.4	0	0	110.9
178	S	25.9	Very low	25	Very low	123 Å²	123	134.7 Å²	134.7	86%	0.86	83%	0.825	S	S	*	*			trans	166.9	150.3	135.7	-79.3	0	0	0	0	112.4
179	A	23	Very low	25.1	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	83%	0.828	S	S	*	*			trans	-147.6	160.6	175.5	0	0	0	0	0	112.5
180	S	23.3	Very low	24.7	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	82%	0.824	S	S	*	*			trans	70.9	86.3	160.3	-57.6	0	0	0	0	119.9
181	K	22.1	Very low	24.7	Very low	208 Å²	208	136.4 Å²	136.4	90%	0.904	82%	0.824	S	S	*	*				-179.2	165.7	118	-100.4	173.8	-179.7	-178.1	0	112.8
182	M	22.1	Very low	24.3	Very low	167 Å²	167	139 Å²	139	82%	0.823	82%	0.823	S	S	*	*			trans	72.5	122.9	-167.3	-49.3	-63.5	-167.9	0	0	112.2
183	Y	25.4	Very low	24.4	Very low	226 Å²	226	139.7 Å²	139.7	89%	0.886	82%	0.815	S	S	*	*			cis	-141.8	156.7	41.2	-90.3	-87.8	0	0	0	114.2
184	S	22	Very low	24.2	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	81%	0.805	S	S	*	*			trans	-153.2	113.2	161	-178.1	0	0	0	0	110.4
185	S	25	Very low	24.1	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	81%	0.809	S	S	*	*			trans	172.8	134.4	137.4	38.2	0	0	0	0	111.9
186	N	25.7	Very low	23.8	Very low	161 Å²	161	139 Å²	139	86%	0.861	81%	0.805	S	S	*	*			trans	42.9	107.2	143.9	-53	-6.4	0	0	0	119.6
187	N	27.8	Very low	23.8	Very low	166 Å²	166	137 Å²	137	89%	0.888	80%	0.804	S	S	*	*				-137.8	151	111.3	-149.4	-11.5	0	0	0	110.6
188	S	22.6	Very low	23.7	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	80%	0.795	S	S	*	*			trans	-121	123.9	-162.7	57.8	0	0	0	0	113.6
189	S	25.9	Very low	23.7	Very low	124 Å²	124	135.5 Å²	135.5	87%	0.867	79%	0.792	S	S	*	*			trans	-150.9	141	157.5	44.9	0	0	0	0	110
190	S	21.9	Very low	23.9	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	79%	0.787	S	S	*	*			trans	-86	126.8	-166.9	-174	0	0	0	0	112.6
191	L	22.8	Very low	24.1	Very low	166 Å²	166	140.1 Å²	140.1	87%	0.869	79%	0.788	S	S	*	*			trans	-133.4	112.5	156.6	-90.1	171.5	0	0	0	109.2	I193	L191-I193 PolarHBondContact O-N 2.98Å; L191-I193 VanDerWaalsContact O-N 3.14Å
192	T	21.5	Very low	24.5	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	76%	0.758	S	S	*	*			trans	-76.5	97.5	-174.3	-17.5	0	0	0	0	110.7	G194	T192-G194 PolarHBondContact O-N 3.47Å
193	I	24	Very low	25	Very low	143 Å²	143	127 Å²	127	73%	0.733	74%	0.739	S	S	*	*			trans	-76.4	105.2	172.3	-62.6	177.5	0	0	0	109	L191 M196	L191-I193 PolarHBondContact O-N 2.98Å; L191-I193 VanDerWaalsContact O-N 3.14Å; I193-M196 HydrophobicContact CG2-CG 3.87Å
194	G	22.8	Very low	25.5	Very low	57 Å²	57	118.5 Å²	118.5	59%	0.588	71%	0.71	S	S	*	*			trans	-70.7	136.4	170.1	0	0	0	0	0	112	T192 M196	T192-G194 PolarHBondContact O-N 3.47Å; G194-M196 PolarHBondContact O-N 3.29Å; G194-M196 VanDerWaalsContact O-N 3.16Å
195	S	23.2	Very low	26.5	Very low	121 Å²	121	116.3 Å²	116.3	85%	0.846	70%	0.695	S	S	*	*			trans	38.6	60.4	155.1	62	0	0	0	0	117.8	S197	S195-S197 PolarHBondContact O-N 3.1Å
196	M	22.7	Very low	26.8	Very low	157 Å²	157	115.7 Å²	115.7	77%	0.773	68%	0.683	S	S	*	*			trans	-74.6	111.6	158.7	-73.6	-102.9	70.6	0	0	109.4	I193 G194	I193-M196 HydrophobicContact CG2-CG 3.87Å; G194-M196 PolarHBondContact O-N 3.29Å; G194-M196 VanDerWaalsContact O-N 3.16Å
197	S	23.2	Very low	27.3	Very low	105 Å²	105	109.2 Å²	109.2	73%	0.734	65%	0.648	S	S	*	*			trans	-59.6	125.1	168.2	-74.1	0	0	0	0	109.6	S195 Q199	S195-S197 PolarHBondContact O-N 3.1Å; S197-Q199 PolarHBondContact O-N 3.3Å; S197-Q199 VanDerWaalsContact O-N 3.17Å
198	P	25.2	Very low	27.9	Very low	98 Å²	98	102.5 Å²	102.5	64%	0.636	62%	0.615	S	S	*	*			trans	-66.9	119.5	177.7	26.7	-33	0	0	0	109.1	I200	P198-I200 PolarHBondContact O-N 2.76Å
199	Q	24.9	Very low	29.1	Very low	171 Å²	171	99.7 Å²	99.7	80%	0.799	59%	0.593	S	S	*	*			trans	-62	96.7	175	-75.9	-174.7	-18.7	0	0	110	S197 Q201	S197-Q199 PolarHBondContact O-N 3.3Å; S197-Q199 VanDerWaalsContact O-N 3.17Å; Q199-Q201 VanDerWaalsContact C-N 3.31Å; Q199-Q201 PolarHBondContact O-N 3.46Å
200	I	27.6	Very low	30.2	Very low	129 Å²	129	96.3 Å²	96.3	66%	0.662	56%	0.564	S	S	*	*			trans	-75.4	91.3	168.5	-58.4	178.2	0	0	0	106.7	P198 S202	P198-I200 PolarHBondContact O-N 2.76Å; I200-S202 PolarHBondContact O-N 3.24Å
201	Q	28	Very low	31.6	Very low	178 Å²	178	91.7 Å²	91.7	83%	0.832	53%	0.531	S	S	*	.			trans	-63.8	84.4	160.5	-69.4	-174.1	-3.2	0	0	107.9	Q199	Q199-Q201 VanDerWaalsContact C-N 3.31Å; Q199-Q201 PolarHBondContact O-N 3.46Å
202	S	31.3	Very low	33.3	Very low	40 Å²	40	85.2 Å²	85.2	28%	0.28	50%	0.498	S	S	.	.			trans	-66.8	153.9	-177.5	59.2	0	0	0	0	110.3	I200 T204	I200-S202 PolarHBondContact O-N 3.24Å; S202-T204 PolarHBondContact O-N 3.08Å; S202-T204 PolarHBondContact O-OG1 2.94Å; S202-T204 WeakPolarHBondContact OG-CG2 3.39Å
203	S	30.7	Very low	35.3	Very low	60 Å²	60	80.9 Å²	80.9	42%	0.42	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	40.7	-175.8	63.8	0	0	0	0	112.8	Q1086 R1110	S203-Q1086 PolarHBondContact O-NE2 2.87Å; S203-R1110 PolarHBondContact OG-NH2 2.84Å; S203-R1110 VanDerWaalsContact OG-NH2 3.08Å
204	T	37	Very low	37.5	Very low	46 Å²	46	76.8 Å²	76.8	28%	0.282	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.3	-178.8	45.3	0	0	0	0	113.4	S202 L206 S208 Q1086	S202-T204 PolarHBondContact O-N 3.08Å; S202-T204 PolarHBondContact O-OG1 2.94Å; S202-T204 WeakPolarHBondContact OG-CG2 3.39Å; T204-L206 PolarHBondContact O-N 2.87Å; T204-S208 PolarHBondContact O-OG 2.8Å; T204-Q1086 VanDerWaalsContact O-CD 3.29Å; T204-Q1086 PolarHBondContact O-NE2 3.11Å; T204-Q1086 PolarHBondContact O-OE1 3.35Å
205	S	42	Very low	40	Very low	67 Å²	67	75.1 Å²	75.1	47%	0.469	43%	0.432	S	S	.	.	H	α-helix	trans	-55.4	-53.1	-171	60.9	0	0	0	0	114.6	N207 S208 T209	S205-N207 PolarHBondContact O-N 3.24Å; S205-S208 PolarHBondContact O-N 3.07Å; S205-S208 PolarHBondContact O-OG 3.03Å; S205-T209 WeakPolarHBondContact O-CA 3.17Å; S205-T209 WeakPolarHBondContact O-CB 3.12Å; S205-T209 PolarHBondContact O-N 3.42Å; S205-T209 PolarHBondContact O-OG1 3.39Å
206	L	31.8	Very low	43	Very low	92 Å²	92	69.9 Å²	69.9	48%	0.482	40%	0.396	S	S	.	.	H	α-helix	trans	-57.1	-41	-162.4	-78.1	171.2	0	0	0	116.9	T204 I210	T204-L206 PolarHBondContact O-N 2.87Å; L206-I210 WeakPolarHBondContact O-CB 3.37Å; L206-I210 WeakPolarHBondContact O-CD1 3.47Å; L206-I210 WeakPolarHBondContact O-CG1 3.3Å; L206-I210 PolarHBondContact O-N 2.83Å; L206-I210 VanDerWaalsContact O-N 3.11Å
207	N	36.2	Very low	46.1	Very low	24 Å²	24	62.5 Å²	62.5	13%	0.128	36%	0.36	C	S	.	.	H	α-helix	trans	-82.7	-41.4	178	-56.5	-39.3	0	0	0	113.1	S205 T209 I210 L211 R1083 Q1086	S205-N207 PolarHBondContact O-N 3.24Å; N207-T209 VanDerWaalsContact C-N 3.3Å; N207-I210 PolarHBondContact O-N 2.97Å; N207-I210 VanDerWaalsContact O-N 3.09Å; N207-L211 PolarHBondContact O-N 2.72Å; N207-R1083 PolarHBondContact ND2-O 2.87Å; N207-R1083 WeakPolarHBondContact OD1-CG 3.38Å; N207-Q1086 VanDerWaalsContact CG-OE1 3.28Å; N207-Q1086 PolarHBondContact ND2-OE1 2.91Å
208	S	41.5	Very low	49.3	Very low	26 Å²	26	57.5 Å²	57.5	18%	0.182	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-44.5	174.8	61.1	0	0	0	0	109.5	T204 S205 I210 L211 N212	T204-S208 PolarHBondContact O-OG 2.8Å; S205-S208 PolarHBondContact O-N 3.07Å; S205-S208 PolarHBondContact O-OG 3.03Å; S208-I210 VanDerWaalsContact C-N 3.33Å; S208-I210 PolarHBondContact O-N 2.89Å; S208-L211 PolarHBondContact O-N 3.45Å; S208-N212 WeakPolarHBondContact O-CA 3.46Å; S208-N212 WeakPolarHBondContact O-CB 3.49Å; S208-N212 PolarHBondContact O-N 3.35Å; S208-N212 PolarHBondContact O-OD1 2.75Å
209	T	46.5	Very low	52.5	Low	46 Å²	46	53 Å²	53	28%	0.282	30%	0.296	S	S	.	.	H	α-helix	trans	-55.7	-41.4	170.1	-62.3	0	0	0	0	112.1	P155 S205 N207 L213	P155-T209 HydrophobicContact CG-CG2 4.49Å; S205-T209 WeakPolarHBondContact O-CA 3.17Å; S205-T209 WeakPolarHBondContact O-CB 3.12Å; S205-T209 PolarHBondContact O-N 3.42Å; S205-T209 PolarHBondContact O-OG1 3.39Å; N207-T209 VanDerWaalsContact C-N 3.3Å; T209-L213 HydrophobicContact CG2-CD1 3.61Å; T209-L213 WeakPolarHBondContact O-CA 3.35Å; T209-L213 WeakPolarHBondContact O-CB 3.48Å; T209-L213 WeakPolarHBondContact O-CD1 3.48Å; T209-L213 PolarHBondContact O-N 3.11Å
210	I	49.3	Very low	55.7	Low	53 Å²	53	45 Å²	45	27%	0.272	26%	0.258	S	S	.	.	H	α-helix	trans	-72.9	-33.8	177.9	-73.3	167.5	0	0	0	113.2	L206 N207 S208	L206-I210 WeakPolarHBondContact O-CB 3.37Å; L206-I210 WeakPolarHBondContact O-CD1 3.47Å; L206-I210 WeakPolarHBondContact O-CG1 3.3Å; L206-I210 PolarHBondContact O-N 2.83Å; L206-I210 VanDerWaalsContact O-N 3.11Å; N207-I210 PolarHBondContact O-N 2.97Å; N207-I210 VanDerWaalsContact O-N 3.09Å; S208-I210 VanDerWaalsContact C-N 3.33Å; S208-I210 PolarHBondContact O-N 2.89Å
211	L	52.1	Low	58.8	Low	12 Å²	12	39.8 Å²	39.8	6%	0.063	23%	0.233	C	C	.	.	H	α-helix	trans	-75.6	-46.6	174.9	-69.7	173.3	0	0	0	110.9	N207 S208 L213 S214 S215 T995 E997	N207-L211 PolarHBondContact O-N 2.72Å; S208-L211 PolarHBondContact O-N 3.45Å; L211-L213 PolarHBondContact O-N 3.17Å; L211-S214 WeakPolarHBondContact O-CA 3.47Å; L211-S214 WeakPolarHBondContact O-CB 3.42Å; L211-S214 PolarHBondContact O-N 3.09Å; L211-S214 PolarHBondContact O-OG 2.82Å; L211-S215 PolarHBondContact O-N 3.42Å; L211-T995 HydrophobicContact CB-CG2 4.31Å; L211-T995 HydrophobicContact CD1-CG2 4.3Å; L211-T995 WeakPolarHBondContact CD1-O 3.27Å; L211-E997 HydrophobicContact CD1-CB 4.23Å
212	N	57	Low	61.8	Low	30 Å²	30	33.7 Å²	33.7	16%	0.16	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-24.6	174.2	-57.1	1.9	0	0	0	111.4	S208 S214 S215 S216 D994 T995	S208-N212 WeakPolarHBondContact O-CA 3.46Å; S208-N212 WeakPolarHBondContact O-CB 3.49Å; S208-N212 PolarHBondContact O-N 3.35Å; S208-N212 PolarHBondContact O-OD1 2.75Å; N212-S214 VanDerWaalsContact C-N 3.25Å; N212-S214 PolarHBondContact O-N 2.84Å; N212-S215 WeakPolarHBondContact CA-OG 3.41Å; N212-S215 PolarHBondContact O-N 2.94Å; N212-S215 PolarHBondContact O-OG 3.38Å; N212-S215 VanDerWaalsContact O-OG 3.09Å; N212-S216 VanDerWaalsContact O-CB 3.26Å; N212-S216 WeakPolarHBondContact O-CB 3.48Å; N212-S216 PolarHBondContact O-N 2.89Å; N212-S216 PolarHBondContact O-OG 2.57Å; N212-D994 PolarHBondContact ND2-OD1 3.03Å; N212-T995 PolarHBondContact OD1-N 2.98Å
213	L	65.4	Low	64.6	Low	43 Å²	43	32 Å²	32	23%	0.225	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-34.1	167	-116.3	86.1	0	0	0	111.4	L150 T209 L211 S216 A217 L232	L150-L213 HydrophobicContact CB-CD2 4.35Å; L150-L213 HydrophobicContact CD1-CD2 4.26Å; L150-L213 HydrophobicContact CD2-CD2 3.96Å; L150-L213 HydrophobicContact CG-CD2 4.43Å; T209-L213 HydrophobicContact CG2-CD1 3.61Å; T209-L213 WeakPolarHBondContact O-CA 3.35Å; T209-L213 WeakPolarHBondContact O-CB 3.48Å; T209-L213 WeakPolarHBondContact O-CD1 3.48Å; T209-L213 PolarHBondContact O-N 3.11Å; L211-L213 PolarHBondContact O-N 3.17Å; L213-S216 CarbonylContact O-C 3.58Å; L213-S216 PolarHBondContact O-N 3.09Å; L213-A217 WeakPolarHBondContact O-CB 3.48Å; L213-A217 PolarHBondContact O-N 2.92Å; L213-L232 HydrophobicContact CD2-CD1 4.4Å; L213-L232 HydrophobicContact CD2-CD2 3.86Å; L213-L232 HydrophobicContact CG-CD1 3.91Å; L213-L232 HydrophobicContact CG-CD2 4.11Å
214	S	69.6	Low	67.3	Low	57 Å²	57	34.3 Å²	34.3	40%	0.399	21%	0.206	S	C	.	.	H	α-helix	trans	-77.6	-26.1	178.4	69.3	0	0	0	0	113.1	G141 L211 N212	G141-S214 WeakPolarHBondContact CA-O 3.34Å; L211-S214 WeakPolarHBondContact O-CA 3.47Å; L211-S214 WeakPolarHBondContact O-CB 3.42Å; L211-S214 PolarHBondContact O-N 3.09Å; L211-S214 PolarHBondContact O-OG 2.82Å; N212-S214 VanDerWaalsContact C-N 3.25Å; N212-S214 PolarHBondContact O-N 2.84Å
215	S	74.9	Confident	69.7	Low	22 Å²	22	38.9 Å²	38.9	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-83.8	-20.7	167.1	53.9	0	0	0	0	113.6	L211 N212 A217	L211-S215 PolarHBondContact O-N 3.42Å; N212-S215 WeakPolarHBondContact CA-OG 3.41Å; N212-S215 PolarHBondContact O-N 2.94Å; N212-S215 PolarHBondContact O-OG 3.38Å; N212-S215 VanDerWaalsContact O-OG 3.09Å; S215-A217 VanDerWaalsContact C-N 3.33Å
216	S	85.3	Confident	71.7	Confident	12 Å²	12	42.3 Å²	42.3	8%	0.084	24%	0.235	C	C	.	.	S	Bend	trans	-84.8	-5.4	170.1	-50.4	0	0	0	0	113.1	N212 L213 A233 G235 P236	N212-S216 VanDerWaalsContact O-CB 3.26Å; N212-S216 WeakPolarHBondContact O-CB 3.48Å; N212-S216 PolarHBondContact O-N 2.89Å; N212-S216 PolarHBondContact O-OG 2.57Å; L213-S216 CarbonylContact O-C 3.58Å; L213-S216 PolarHBondContact O-N 3.09Å; S216-A233 WeakPolarHBondContact O-CB 3.39Å; S216-A233 PolarHBondContact O-N 2.89Å; S216-G235 VanDerWaalsContact OG-C 3.29Å; S216-G235 WeakPolarHBondContact OG-CA 3.08Å; S216-P236 WeakPolarHBondContact OG-CD 3.38Å
217	A	88.2	Confident	74.4	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.5	176.6	0	0	0	0	0	111	G141 C142 L213 S215 I231 L232	G141-A217 PolarHBondContact N-O 2.85Å; C142-A217 VanDerWaalsContact SG-CB 3.6Å; L213-A217 WeakPolarHBondContact O-CB 3.48Å; L213-A217 PolarHBondContact O-N 2.92Å; S215-A217 VanDerWaalsContact C-N 3.33Å; A217-I231 CarbonylContact C-O 3.56Å; A217-I231 VanDerWaalsContact CA-O 3.23Å; A217-I231 WeakPolarHBondContact CA-O 3.45Å; A217-L232 HydrophobicContact CB-CD1 4.24Å
218	F	91.7	Very high	76.8	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	160.4	169.7	64.8	-81.6	0	0	0	110.8	M93 V138 Q139 L140 G141 I220 I231 A239 W242 V243 L246	M93-F218 HydrophobicContact CE-CE1 4.31Å; M93-F218 HydrophobicContact CE-CZ 3.95Å; M93-F218 HydrophobicContact SD-CE1 3.76Å; M93-F218 HydrophobicContact SD-CZ 4.03Å; V138-F218 HydrophobicContact CG1-CD2 4.33Å; Q139-F218 CarbonylContact O-C 3.39Å; Q139-F218 VanDerWaalsContact O-CA 3.29Å; Q139-F218 WeakPolarHBondContact O-CA 3.2Å; Q139-F218 WeakPolarHBondContact O-CB 3.42Å; L140-F218 HydrophobicContact CD2-CB 4.45Å; G141-F218 CarbonylContact O-C 3.56Å; G141-F218 WeakPolarHBondContact O-CA 3.49Å; F218-I220 HydrophobicContact CD2-CG1 4.23Å; F218-I220 HydrophobicContact CE2-CD1 4.12Å; F218-I220 HydrophobicContact CE2-CG1 4.16Å; F218-I231 HydrophobicContact CD1-CB 4.31Å; F218-I231 HydrophobicContact CD1-CG2 4.47Å; F218-I231 HydrophobicContact CE1-CB 3.95Å; F218-I231 HydrophobicContact CE1-CG2 3.74Å; F218-I231 HydrophobicContact CE2-CB 4.27Å; F218-I231 HydrophobicContact CE2-CD1 3.87Å; F218-I231 HydrophobicContact CZ-CB 3.94Å; F218-I231 HydrophobicContact CZ-CD1 3.87Å; F218-I231 HydrophobicContact CZ-CG1 4.47Å; F218-I231 HydrophobicContact CZ-CG2 3.85Å; F218-I231 PolarHBondContact N-O 3.32Å; F218-I231 PolarHBondContact O-N 2.81Å; F218-A239 HydrophobicContact CD1-CB 4.09Å; F218-W242 HydrophobicContact CE1-CB 4.06Å; F218-W242 HydrophobicContact CE2-CB 4.25Å; F218-W242 HydrophobicContact CZ-CB 3.73Å; F218-W242 HydrophobicContact CZ-CD2 4.49Å; F218-W242 HydrophobicContact CZ-CG 4.14Å; F218-V243 HydrophobicContact CB-CG2 3.43Å; F218-V243 VanDerWaalsContact CB-CG2 3.43Å; F218-V243 HydrophobicContact CD1-CG2 4.45Å; F218-V243 HydrophobicContact CD2-CG2 3.84Å; F218-V243 HydrophobicContact CG-CG2 3.69Å; F218-L246 HydrophobicContact CE2-CD1 4.36Å
219	T	91.4	Very high	79.1	Confident	3 Å²	3	42 Å²	42	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.6	-176.5	-58.3	0	0	0	0	109.3	V138 Q139 G141 V228 L229 E230	V138-T219 WeakPolarHBondContact CA-O 3.26Å; Q139-T219 PolarHBondContact N-O 2.8Å; Q139-T219 PolarHBondContact O-N 2.86Å; G141-T219 PolarHBondContact O-N 3.48Å; G141-T219 PolarHBondContact O-OG1 3.34Å; T219-V228 HydrophobicContact CG2-CG1 3.44Å; T219-V228 VanDerWaalsContact CG2-CG1 3.44Å; T219-L229 WeakPolarHBondContact CA-O 3.17Å; T219-E230 HydrophobicContact CG2-CG 4.45Å
220	I	92.9	Very high	81.2	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.1	171	-54.9	176.8	0	0	0	107.8	I116 I135 V138 F218 Y222 L229 I231 L246	I116-I220 HydrophobicContact CD1-CD1 3.75Å; I135-I220 HydrophobicContact CD1-CG2 4.14Å; I135-I220 HydrophobicContact CG1-CG2 4.13Å; I135-I220 HydrophobicContact CG2-CG2 3.83Å; V138-I220 HydrophobicContact CG1-CG1 4.37Å; V138-I220 HydrophobicContact CG2-CG1 4.28Å; V138-I220 HydrophobicContact CG2-CG2 4.29Å; F218-I220 HydrophobicContact CD2-CG1 4.23Å; F218-I220 HydrophobicContact CE2-CD1 4.12Å; F218-I220 HydrophobicContact CE2-CG1 4.16Å; I220-Y222 HydrophobicContact CG2-CD1 4.32Å; I220-L229 HydrophobicContact CB-CB 4.35Å; I220-L229 PolarHBondContact N-O 2.6Å; I220-L229 PolarHBondContact O-N 3.44Å; I220-I231 HydrophobicContact CD1-CD1 4.02Å; I220-L246 HydrophobicContact CD1-CD1 3.85Å; I220-L246 HydrophobicContact CG1-CD1 4.31Å
221	C	91.4	Very high	83.2	Confident	21 Å²	21	37.8 Å²	37.8	14%	0.142	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120	170.6	-61.8	0	0	0	0	108.3	H136 E137 T227	H136-C221 PolarHBondContact N-O 3.49Å; E137-C221 HydrophobicContact CB-CB 4.06Å; E137-C221 PolarHBondContact N-O 3.47Å; E137-C221 PolarHBondContact O-N 3.3Å; C221-T227 WeakPolarHBondContact CA-O 3.41Å
222	Y	92.6	Very high	85	Confident	49 Å²	49	38 Å²	38	19%	0.192	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	156.1	-171.1	75.4	-77.7	0	0	0	114.1	I130 E134 I220 T227 L229	I130-Y222 HydrophobicContact CB-CD2 4.36Å; I130-Y222 HydrophobicContact CD1-CD1 3.63Å; I130-Y222 HydrophobicContact CD1-CD2 3.92Å; I130-Y222 HydrophobicContact CD1-CE1 3.53Å; I130-Y222 HydrophobicContact CD1-CE2 3.83Å; I130-Y222 HydrophobicContact CD1-CG 3.82Å; I130-Y222 HydrophobicContact CG1-CD1 4.38Å; I130-Y222 HydrophobicContact CG1-CD2 3.74Å; I130-Y222 HydrophobicContact CG1-CE1 4.26Å; I130-Y222 HydrophobicContact CG1-CE2 3.6Å; I130-Y222 HydrophobicContact CG1-CG 4.14Å; I130-Y222 HydrophobicContact CG2-CD2 3.75Å; I130-Y222 HydrophobicContact CG2-CE2 4.46Å; I130-Y222 HydrophobicContact CG2-CG 3.9Å; E134-Y222 CarbonylContact O-C 3.58Å; E134-Y222 WeakPolarHBondContact O-CA 3.28Å; E134-Y222 WeakPolarHBondContact O-CB 3.42Å; I220-Y222 HydrophobicContact CG2-CD1 4.32Å; Y222-T227 VanDerWaalsContact CD1-O 3.26Å; Y222-T227 WeakPolarHBondContact CD1-O 3.39Å; Y222-T227 WeakPolarHBondContact CE1-OG1 3.41Å; Y222-T227 WeakPolarHBondContact CE2-OG1 3.13Å; Y222-T227 PolarHBondContact N-O 3.22Å; Y222-T227 WeakPolarHBondContact O-CA 3.27Å; Y222-T227 WeakPolarHBondContact O-CB 3.43Å; Y222-T227 PolarHBondContact O-N 3.04Å; Y222-T227 PolarHBondContact O-OG1 3Å; Y222-L229 HydrophobicContact CD1-CB 4.35Å; Y222-L229 HydrophobicContact CE1-CB 3.85Å
223	G	89.6	Confident	86.6	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	163.2	179.2	0	0	0	0	0	113.4	E134 H136 D225 F226	E134-G223 PolarHBondContact O-N 3.38Å; H136-G223 PolarHBondContact NE2-O 3.15Å; G223-D225 PolarHBondContact O-N 3.34Å; G223-D225 VanDerWaalsContact O-N 3.09Å; G223-F226 WeakPolarHBondContact O-CA 3.44Å; G223-F226 PolarHBondContact O-N 3.47Å
224	P	86.6	Confident	87.6	Confident	109 Å²	109	39.8 Å²	39.8	71%	0.708	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.9	-171.4	25.6	-35.8	0	0	0	114.5	F226	P224-F226 VanDerWaalsContact C-N 3.27Å
225	D	87.1	Confident	88.3	Confident	142 Å²	142	37.9 Å²	37.9	76%	0.759	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	8.6	174.9	-64.7	-41.2	0	0	0	113.1	G223 T227	G223-D225 PolarHBondContact O-N 3.34Å; G223-D225 VanDerWaalsContact O-N 3.09Å; D225-T227 VanDerWaalsContact C-N 3.32Å; D225-T227 HydrophobicContact CB-CG2 3.82Å; D225-T227 PolarHBondContact O-N 3.48Å
226	F	85.6	Confident	88.7	Confident	138 Å²	138	38 Å²	38	61%	0.605	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	48.4	-174.4	-69.5	-97.9	0	0	0	112.6	H136 G223 P224	H136-F226 HydrophobicContact CB-CE1 4.24Å; H136-F226 AromaticContact CD2-CD1 3.81Å; H136-F226 AromaticContact CD2-CE1 3.58Å; H136-F226 AromaticContact CD2-CZ 3.92Å; G223-F226 WeakPolarHBondContact O-CA 3.44Å; G223-F226 PolarHBondContact O-N 3.47Å; P224-F226 VanDerWaalsContact C-N 3.27Å
227	T	87.8	Confident	88.7	Confident	50 Å²	50	41.6 Å²	41.6	31%	0.307	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	138.1	-174.3	72	0	0	0	0	111.4	C221 Y222 D225	C221-T227 WeakPolarHBondContact CA-O 3.41Å; Y222-T227 VanDerWaalsContact CD1-O 3.26Å; Y222-T227 WeakPolarHBondContact CD1-O 3.39Å; Y222-T227 WeakPolarHBondContact CE1-OG1 3.41Å; Y222-T227 WeakPolarHBondContact CE2-OG1 3.13Å; Y222-T227 PolarHBondContact N-O 3.22Å; Y222-T227 WeakPolarHBondContact O-CA 3.27Å; Y222-T227 WeakPolarHBondContact O-CB 3.43Å; Y222-T227 PolarHBondContact O-N 3.04Å; Y222-T227 PolarHBondContact O-OG1 3Å; D225-T227 VanDerWaalsContact C-N 3.32Å; D225-T227 HydrophobicContact CB-CG2 3.82Å; D225-T227 PolarHBondContact O-N 3.48Å
228	V	87.5	Confident	88.8	Confident	82 Å²	82	42 Å²	42	50%	0.497	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.9	-170	-176	0	0	0	0	110.9	T219 E230	T219-V228 HydrophobicContact CG2-CG1 3.44Å; T219-V228 VanDerWaalsContact CG2-CG1 3.44Å; V228-E230 HydrophobicContact CG1-CG 4.42Å
229	L	89.3	Confident	88.8	Confident	5 Å²	5	42 Å²	42	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	102.7	172.9	170.9	51.7	0	0	0	110.4	K95 W118 I130 T219 I220 Y222 I231	K95-L229 HydrophobicContact CD-CD1 3.63Å; K95-L229 HydrophobicContact CG-CD1 3.67Å; K95-L229 VanDerWaalsContact NZ-CD1 3.33Å; W118-L229 HydrophobicContact CH2-CD2 4.34Å; W118-L229 HydrophobicContact CZ3-CD2 4.15Å; I130-L229 HydrophobicContact CD1-CD2 3.49Å; I130-L229 VanDerWaalsContact CD1-CD2 3.49Å; T219-L229 WeakPolarHBondContact CA-O 3.17Å; I220-L229 HydrophobicContact CB-CB 4.35Å; I220-L229 PolarHBondContact N-O 2.6Å; I220-L229 PolarHBondContact O-N 3.44Å; Y222-L229 HydrophobicContact CD1-CB 4.35Å; Y222-L229 HydrophobicContact CE1-CB 3.85Å; L229-I231 HydrophobicContact CD1-CD1 4.49Å; L229-I231 HydrophobicContact CD1-CG1 3.94Å; L229-I231 HydrophobicContact CD2-CD1 4.06Å; L229-I231 HydrophobicContact CD2-CG1 4.4Å; L229-I231 HydrophobicContact CG-CD1 4Å; L229-I231 HydrophobicContact CG-CG1 3.84Å
230	E	89.5	Confident	88.7	Confident	7 Å²	7	43 Å²	43	3%	0.033	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.5	169.3	-68.8	179.3	154.7	0	0	110.4	L96 S144 T146 T219 V228	L96-E230 HydrophobicContact CB-CB 3.88Å; L96-E230 HydrophobicContact CD1-CB 4.16Å; L96-E230 PolarHBondContact N-O 2.81Å; S144-E230 VanDerWaalsContact CB-OE1 3.27Å; S144-E230 WeakPolarHBondContact CB-OE1 3.28Å; S144-E230 PolarHBondContact N-OE1 2.84Å; S144-E230 VanDerWaalsContact N-OE1 3.16Å; S144-E230 VanDerWaalsContact OG-CD 3.26Å; S144-E230 PolarHBondContact OG-OE1 3.32Å; S144-E230 PolarHBondContact OG-OE2 3.18Å; T146-E230 WeakPolarHBondContact CB-OE2 3.37Å; T146-E230 PolarHBondContact OG1-OE2 2.8Å; T219-E230 HydrophobicContact CG2-CG 4.45Å; V228-E230 HydrophobicContact CG1-CG 4.42Å
231	I	91.7	Very high	88.7	Confident	2 Å²	2	43 Å²	43	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.1	178.8	-57.6	177.4	0	0	0	108.9	M93 F107 A217 F218 I220 L229	M93-I231 HydrophobicContact CB-CG2 3.66Å; M93-I231 HydrophobicContact CE-CG2 4.14Å; M93-I231 HydrophobicContact CG-CG2 4.4Å; M93-I231 HydrophobicContact SD-CG2 3.9Å; F107-I231 HydrophobicContact CD1-CD1 4.29Å; F107-I231 HydrophobicContact CE1-CD1 3.66Å; F107-I231 HydrophobicContact CE1-CG1 4.45Å; F107-I231 HydrophobicContact CE2-CG2 4.35Å; F107-I231 HydrophobicContact CZ-CD1 3.77Å; F107-I231 HydrophobicContact CZ-CG1 4.1Å; F107-I231 HydrophobicContact CZ-CG2 4.5Å; A217-I231 CarbonylContact C-O 3.56Å; A217-I231 VanDerWaalsContact CA-O 3.23Å; A217-I231 WeakPolarHBondContact CA-O 3.45Å; F218-I231 HydrophobicContact CD1-CB 4.31Å; F218-I231 HydrophobicContact CD1-CG2 4.47Å; F218-I231 HydrophobicContact CE1-CB 3.95Å; F218-I231 HydrophobicContact CE1-CG2 3.74Å; F218-I231 HydrophobicContact CE2-CB 4.27Å; F218-I231 HydrophobicContact CE2-CD1 3.87Å; F218-I231 HydrophobicContact CZ-CB 3.94Å; F218-I231 HydrophobicContact CZ-CD1 3.87Å; F218-I231 HydrophobicContact CZ-CG1 4.47Å; F218-I231 HydrophobicContact CZ-CG2 3.85Å; F218-I231 PolarHBondContact N-O 3.32Å; F218-I231 PolarHBondContact O-N 2.81Å; I220-I231 HydrophobicContact CD1-CD1 4.02Å; L229-I231 HydrophobicContact CD1-CD1 4.49Å; L229-I231 HydrophobicContact CD1-CG1 3.94Å; L229-I231 HydrophobicContact CD2-CD1 4.06Å; L229-I231 HydrophobicContact CD2-CG1 4.4Å; L229-I231 HydrophobicContact CG-CD1 4Å; L229-I231 HydrophobicContact CG-CG1 3.84Å
232	L	90.7	Very high	88.9	Confident	18 Å²	18	42.1 Å²	42.1	9%	0.094	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114.6	170.7	173.3	64.1	0	0	0	109.3	I94 L96 L150 L213 A217	I94-L232 HydrophobicContact CB-CB 4.3Å; I94-L232 PolarHBondContact N-O 3.22Å; I94-L232 PolarHBondContact O-N 3.25Å; L96-L232 HydrophobicContact CD1-CB 4.29Å; L96-L232 HydrophobicContact CG-CB 4.44Å; L150-L232 HydrophobicContact CD2-CD2 4.35Å; L213-L232 HydrophobicContact CD2-CD1 4.4Å; L213-L232 HydrophobicContact CD2-CD2 3.86Å; L213-L232 HydrophobicContact CG-CD1 3.91Å; L213-L232 HydrophobicContact CG-CD2 4.11Å; A217-L232 HydrophobicContact CB-CD1 4.24Å
233	A	90.9	Very high	88.9	Confident	10 Å²	10	40 Å²	40	8%	0.083	23%	0.23	C	C	.	.			trans	-77.9	175.4	176.2	0	0	0	0	0	112	M93 S216 G235 E238 A239	M93-A233 HydrophobicContact CG-CB 4.29Å; M93-A233 HydrophobicContact SD-CB 3.86Å; S216-A233 WeakPolarHBondContact O-CB 3.39Å; S216-A233 PolarHBondContact O-N 2.89Å; A233-G235 VanDerWaalsContact C-N 3.26Å; A233-G235 PolarHBondContact O-N 3.17Å; A233-E238 HydrophobicContact CB-CB 4.05Å; A233-E238 HydrophobicContact CB-CG 3.97Å; A233-A239 HydrophobicContact CB-CB 4.07Å
234	S	85.2	Confident	89	Confident	100 Å²	100	40 Å²	40	70%	0.699	23%	0.229	S	C	*	.	S	Bend	trans	-68.7	-23	175	61.8	0	0	0	0	113.7	E238	S234-E238 VanDerWaalsContact CB-OE2 3.26Å; S234-E238 WeakPolarHBondContact CB-OE2 3.41Å; S234-E238 PolarHBondContact N-OE2 3.32Å; S234-E238 PolarHBondContact OG-OE2 3.48Å
235	G	84	Confident	89.3	Confident	16 Å²	16	34.9 Å²	34.9	17%	0.165	20%	0.196	C	C	.	.	S	Bend	trans	-170.8	177.2	177.2	0	0	0	0	0	112.4	S216 A233 E237 E238 A239	S216-G235 VanDerWaalsContact OG-C 3.29Å; S216-G235 WeakPolarHBondContact OG-CA 3.08Å; A233-G235 VanDerWaalsContact C-N 3.26Å; A233-G235 PolarHBondContact O-N 3.17Å; G235-E237 VanDerWaalsContact C-N 3.35Å; G235-E237 PolarHBondContact O-N 2.97Å; G235-E238 PolarHBondContact O-N 3.31Å; G235-A239 PolarHBondContact O-N 3.32Å
236	P	83.1	Confident	89.7	Confident	25 Å²	25	28.1 Å²	28.1	16%	0.162	16%	0.16	C	C	.	.	H	α-helix	trans	-70.6	-29.8	-175.6	28.9	-34.4	0	0	0	112.8	S216 A239 N240 E993	S216-P236 WeakPolarHBondContact OG-CD 3.38Å; P236-A239 PolarHBondContact O-N 2.71Å; P236-N240 WeakPolarHBondContact O-CB 3.42Å; P236-N240 VanDerWaalsContact O-CG 3.29Å; P236-N240 PolarHBondContact O-N 2.77Å; P236-N240 PolarHBondContact O-ND2 2.85Å; P236-E993 WeakPolarHBondContact CB-OE2 3.45Å; P236-E993 HydrophobicContact CG-CB 3.82Å; P236-E993 HydrophobicContact CG-CG 4.08Å
237	E	85.5	Confident	89.9	Confident	87 Å²	87	24.1 Å²	24.1	41%	0.407	14%	0.142	S	C	.	.	H	α-helix	trans	-60.2	-51.3	173.1	-176.8	177.2	-126.9	0	0	111.2	G235 A239 N240 I241 Q340	G235-E237 VanDerWaalsContact C-N 3.35Å; G235-E237 PolarHBondContact O-N 2.97Å; E237-A239 VanDerWaalsContact C-N 3.34Å; E237-A239 PolarHBondContact O-N 3.26Å; E237-N240 WeakPolarHBondContact O-CB 3.24Å; E237-N240 PolarHBondContact O-N 3.25Å; E237-N240 VanDerWaalsContact O-N 3.16Å; E237-I241 HydrophobicContact CG-CD1 4.17Å; E237-I241 VanDerWaalsContact O-CG1 3.32Å; E237-I241 WeakPolarHBondContact O-CG1 3.43Å; E237-I241 PolarHBondContact O-N 3.35Å; E237-Q340 PolarHBondContact OE1-NE2 3.46Å
238	E	90.6	Very high	90.1	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.056	13%	0.128	C	C	.	.	H	α-helix	trans	-61.9	-40.3	178.4	-178.1	172.8	-124.4	0	0	112	Y86 S91 M93 A233 S234 G235 I241 W242	Y86-E238 HydrophobicContact CE1-CG 4.13Å; Y86-E238 PolarHBondContact OH-OE1 3.24Å; S91-E238 WeakPolarHBondContact CB-OE1 3.5Å; S91-E238 PolarHBondContact OG-OE1 3.32Å; M93-E238 HydrophobicContact SD-CG 4.45Å; A233-E238 HydrophobicContact CB-CB 4.05Å; A233-E238 HydrophobicContact CB-CG 3.97Å; S234-E238 VanDerWaalsContact CB-OE2 3.26Å; S234-E238 WeakPolarHBondContact CB-OE2 3.41Å; S234-E238 PolarHBondContact N-OE2 3.32Å; S234-E238 PolarHBondContact OG-OE2 3.48Å; G235-E238 PolarHBondContact O-N 3.31Å; E238-I241 PolarHBondContact O-N 3.32Å; E238-W242 PolarHBondContact O-N 3.28Å
239	A	91.4	Very high	90.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.8	-43.7	173.9	0	0	0	0	0	112.2	L140 F218 A233 G235 P236 E237 W242 V243	L140-A239 HydrophobicContact CD2-CB 4.02Å; F218-A239 HydrophobicContact CD1-CB 4.09Å; A233-A239 HydrophobicContact CB-CB 4.07Å; G235-A239 PolarHBondContact O-N 3.32Å; P236-A239 PolarHBondContact O-N 2.71Å; E237-A239 VanDerWaalsContact C-N 3.34Å; E237-A239 PolarHBondContact O-N 3.26Å; A239-W242 PolarHBondContact O-N 3.06Å; A239-V243 WeakPolarHBondContact O-CG2 3.32Å; A239-V243 PolarHBondContact O-N 3.19Å
240	N	90.6	Very high	90.3	Very high	24 Å²	24	21 Å²	21	13%	0.128	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-43.3	175.2	-75.8	-47.4	0	0	0	111.9	L140 P236 E237 W242 V243 T244 Y344	L140-N240 VanDerWaalsContact CD1-OD1 3.29Å; L140-N240 WeakPolarHBondContact CD1-OD1 3.43Å; P236-N240 WeakPolarHBondContact O-CB 3.42Å; P236-N240 VanDerWaalsContact O-CG 3.29Å; P236-N240 PolarHBondContact O-N 2.77Å; P236-N240 PolarHBondContact O-ND2 2.85Å; E237-N240 WeakPolarHBondContact O-CB 3.24Å; E237-N240 PolarHBondContact O-N 3.25Å; E237-N240 VanDerWaalsContact O-N 3.16Å; N240-W242 PolarHBondContact O-N 3.03Å; N240-V243 PolarHBondContact O-N 3.48Å; N240-T244 WeakPolarHBondContact O-CB 3.36Å; N240-T244 PolarHBondContact O-N 2.9Å; N240-T244 PolarHBondContact O-OG1 3.34Å; N240-Y344 HydrophobicContact CB-CD1 4.27Å; N240-Y344 HydrophobicContact CB-CD2 3.57Å; N240-Y344 HydrophobicContact CB-CE2 3.88Å; N240-Y344 HydrophobicContact CB-CG 3.8Å
241	I	93	Very high	90.2	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-59	-48.6	177.6	-65.3	170.2	0	0	0	110.6	I77 C83 Y86 E237 E238 G245 Y344	I77-I241 HydrophobicContact CD1-CD1 4.33Å; I77-I241 HydrophobicContact CD1-CG1 4.46Å; I77-I241 HydrophobicContact CG1-CD1 4.09Å; I77-I241 HydrophobicContact CG1-CG1 3.94Å; C83-I241 HydrophobicContact CB-CG2 4.15Å; Y86-I241 HydrophobicContact CD1-CB 4.49Å; Y86-I241 HydrophobicContact CD1-CD1 4.34Å; Y86-I241 HydrophobicContact CD1-CG2 3.69Å; Y86-I241 HydrophobicContact CD2-CD1 4.3Å; Y86-I241 HydrophobicContact CE1-CD1 4.27Å; Y86-I241 HydrophobicContact CE1-CG2 4.35Å; Y86-I241 HydrophobicContact CE2-CD1 4.22Å; Y86-I241 HydrophobicContact CG-CD1 4.35Å; Y86-I241 HydrophobicContact CG-CG2 4.02Å; E237-I241 HydrophobicContact CG-CD1 4.17Å; E237-I241 VanDerWaalsContact O-CG1 3.32Å; E237-I241 WeakPolarHBondContact O-CG1 3.43Å; E237-I241 PolarHBondContact O-N 3.35Å; E238-I241 PolarHBondContact O-N 3.32Å; I241-G245 PolarHBondContact O-N 3.2Å; I241-Y344 HydrophobicContact CG1-CE1 4.26Å; I241-Y344 WeakPolarHBondContact CG1-OH 3.34Å
242	W	94.5	Very high	89.8	Confident	2 Å²	2	24 Å²	24	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-45.1	-179.9	-86.8	86.7	0	0	0	112.7	M87 S91 M93 F107 I116 F218 E238 A239 N240 L246	M87-W242 HydrophobicContact CB-CH2 4.31Å; M87-W242 HydrophobicContact CB-CZ2 4.24Å; M87-W242 HydrophobicContact CE-CD2 4.39Å; M87-W242 HydrophobicContact CE-CE3 3.73Å; M87-W242 HydrophobicContact CE-CZ3 3.86Å; M87-W242 HydrophobicContact CG-CD2 3.92Å; M87-W242 HydrophobicContact CG-CE3 4.16Å; M87-W242 HydrophobicContact CG-CG 4.37Å; M87-W242 HydrophobicContact CG-CH2 4.41Å; M87-W242 HydrophobicContact CG-CZ2 4.2Å; M87-W242 HydrophobicContact CG-CZ3 4.39Å; S91-W242 VanDerWaalsContact CB-NE1 3.29Å; S91-W242 PolarHBondContact OG-NE1 3.35Å; M93-W242 HydrophobicContact CE-CD2 3.66Å; M93-W242 VanDerWaalsContact CE-CE2 3.49Å; M93-W242 HydrophobicContact CE-CE3 4.19Å; M93-W242 HydrophobicContact CE-CG 4.01Å; M93-W242 HydrophobicContact CE-CH2 4.39Å; M93-W242 HydrophobicContact CE-CZ2 3.88Å; M93-W242 HydrophobicContact SD-CG 4.35Å; F107-W242 HydrophobicContact CB-CH2 3.92Å; F107-W242 HydrophobicContact CB-CZ2 4.07Å; I116-W242 HydrophobicContact CG2-CH2 4.33Å; I116-W242 HydrophobicContact CG2-CZ3 3.89Å; F218-W242 HydrophobicContact CE1-CB 4.06Å; F218-W242 HydrophobicContact CE2-CB 4.25Å; F218-W242 HydrophobicContact CZ-CB 3.73Å; F218-W242 HydrophobicContact CZ-CD2 4.49Å; F218-W242 HydrophobicContact CZ-CG 4.14Å; E238-W242 PolarHBondContact O-N 3.28Å; A239-W242 PolarHBondContact O-N 3.06Å; N240-W242 PolarHBondContact O-N 3.03Å; W242-L246 HydrophobicContact CE3-CD1 4.4Å; W242-L246 WeakPolarHBondContact O-CB 3.48Å; W242-L246 VanDerWaalsContact O-CG 3.23Å; W242-L246 WeakPolarHBondContact O-CG 3.37Å; W242-L246 PolarHBondContact O-N 3.29Å
243	V	93.1	Very high	89.4	Confident	6 Å²	6	23.2 Å²	23.2	4%	0.036	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-40.3	178.6	174	0	0	0	0	111.8	V138 L140 F218 A239 N240 K247	V138-V243 HydrophobicContact CG1-CB 4.24Å; V138-V243 HydrophobicContact CG1-CG1 4.03Å; V138-V243 HydrophobicContact CG1-CG2 3.86Å; L140-V243 HydrophobicContact CD2-CB 4.28Å; L140-V243 HydrophobicContact CD2-CG2 3.79Å; L140-V243 HydrophobicContact CG-CB 4.21Å; L140-V243 HydrophobicContact CG-CG1 4.18Å; L140-V243 HydrophobicContact CG-CG2 3.96Å; F218-V243 HydrophobicContact CB-CG2 3.43Å; F218-V243 VanDerWaalsContact CB-CG2 3.43Å; F218-V243 HydrophobicContact CD1-CG2 4.45Å; F218-V243 HydrophobicContact CD2-CG2 3.84Å; F218-V243 HydrophobicContact CG-CG2 3.69Å; A239-V243 WeakPolarHBondContact O-CG2 3.32Å; A239-V243 PolarHBondContact O-N 3.19Å; N240-V243 PolarHBondContact O-N 3.48Å; V243-K247 WeakPolarHBondContact O-CB 3.5Å; V243-K247 PolarHBondContact O-N 3.29Å
244	T	92.5	Very high	88.9	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-50.9	176	-60.9	0	0	0	0	110.8	N240 K247 C248 Y343 Y344 V347	N240-T244 WeakPolarHBondContact O-CB 3.36Å; N240-T244 PolarHBondContact O-N 2.9Å; N240-T244 PolarHBondContact O-OG1 3.34Å; T244-K247 PolarHBondContact O-N 2.82Å; T244-C248 PolarHBondContact O-N 2.94Å; T244-C248 VanDerWaalsContact O-N 3.12Å; T244-C248 PolarHBondContact O-SG 3.35Å; T244-Y343 HydrophobicContact CG2-CD1 4.44Å; T244-Y343 HydrophobicContact CG2-CE1 3.76Å; T244-Y344 HydrophobicContact CG2-CD1 4.16Å; T244-Y344 VanDerWaalsContact OG1-CD1 3.31Å; T244-Y344 WeakPolarHBondContact OG1-CD1 3.43Å; T244-V347 HydrophobicContact CG2-CB 3.91Å; T244-V347 HydrophobicContact CG2-CG1 3.81Å; T244-V347 HydrophobicContact CG2-CG2 4.08Å
245	G	92.9	Very high	88.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-46.7	178.5	0	0	0	0	0	112.5	F84 I241 K247 C248 L249	F84-G245 WeakPolarHBondContact CE1-O 3.32Å; I241-G245 PolarHBondContact O-N 3.2Å; G245-K247 PolarHBondContact O-N 2.82Å; G245-C248 PolarHBondContact O-N 2.95Å; G245-C248 VanDerWaalsContact O-N 3.14Å; G245-L249 WeakPolarHBondContact O-CG 3.33Å; G245-L249 PolarHBondContact O-N 3.46Å
246	L	93.6	Very high	88.2	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-40.9	178.2	-68.6	174.8	0	0	0	112.5	M87 I116 I132 I135 V138 F218 I220 W242 C248 L249 M250	M87-L246 HydrophobicContact CE-CD2 3.74Å; M87-L246 HydrophobicContact CE-CG 3.9Å; I116-L246 HydrophobicContact CD1-CD1 3.92Å; I116-L246 HydrophobicContact CD1-CD2 3.51Å; I116-L246 HydrophobicContact CD1-CG 4.38Å; I116-L246 HydrophobicContact CG1-CD2 3.84Å; I132-L246 HydrophobicContact CD1-CD2 3.71Å; I135-L246 HydrophobicContact CD1-CD2 4.43Å; V138-L246 HydrophobicContact CG1-CB 4.37Å; V138-L246 HydrophobicContact CG1-CD1 4.13Å; V138-L246 HydrophobicContact CG2-CB 4.04Å; V138-L246 HydrophobicContact CG2-CD1 4.2Å; F218-L246 HydrophobicContact CE2-CD1 4.36Å; I220-L246 HydrophobicContact CD1-CD1 3.85Å; I220-L246 HydrophobicContact CG1-CD1 4.31Å; W242-L246 HydrophobicContact CE3-CD1 4.4Å; W242-L246 WeakPolarHBondContact O-CB 3.48Å; W242-L246 VanDerWaalsContact O-CG 3.23Å; W242-L246 WeakPolarHBondContact O-CG 3.37Å; W242-L246 PolarHBondContact O-N 3.29Å; L246-C248 VanDerWaalsContact C-N 3.35Å; L246-C248 PolarHBondContact O-N 3Å; L246-L249 HydrophobicContact CD2-CD1 4.32Å; L246-L249 PolarHBondContact O-N 3.17Å; L246-M250 WeakPolarHBondContact O-CB 3.1Å; L246-M250 VanDerWaalsContact O-CG 3.24Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 2.84Å
247	K	91.8	Very high	88.1	Confident	55 Å²	55	33.1 Å²	33.1	24%	0.239	18%	0.183	C	C	.	.	H	α-helix	trans	-58.7	-42.8	173	-84.2	-175.4	165.9	-115.9	0	112.6	V243 T244 G245 A251 V347 R348	V243-K247 WeakPolarHBondContact O-CB 3.5Å; V243-K247 PolarHBondContact O-N 3.29Å; T244-K247 PolarHBondContact O-N 2.82Å; G245-K247 PolarHBondContact O-N 2.82Å; K247-A251 WeakPolarHBondContact O-CB 3.32Å; K247-A251 PolarHBondContact O-N 3.34Å; K247-A251 VanDerWaalsContact O-N 3.11Å; K247-V347 HydrophobicContact CB-CG1 4.31Å; K247-R348 PolarHBondContact NZ-O 3.14Å
248	C	90.4	Very high	87.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.7	-41.1	176	-69.4	0	0	0	0	112.6	A80 F84 T244 G245 L246 A251 G252 A253	A80-C248 HydrophobicContact CB-CB 4.06Å; F84-C248 HydrophobicContact CE1-CB 4.25Å; F84-C248 HydrophobicContact CZ-CB 3.75Å; T244-C248 PolarHBondContact O-N 2.94Å; T244-C248 VanDerWaalsContact O-N 3.12Å; T244-C248 PolarHBondContact O-SG 3.35Å; G245-C248 PolarHBondContact O-N 2.95Å; G245-C248 VanDerWaalsContact O-N 3.14Å; L246-C248 VanDerWaalsContact C-N 3.35Å; L246-C248 PolarHBondContact O-N 3Å; C248-A251 CarbonylContact O-C 3.56Å; C248-A251 PolarHBondContact O-N 3.37Å; C248-G252 PolarHBondContact O-N 3.18Å; C248-A253 HydrophobicContact CB-CB 4.03Å; C248-A253 WeakPolarHBondContact O-CB 3.33Å; C248-A253 PolarHBondContact O-N 3.4Å
249	L	91.4	Very high	87.1	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-68	-38.2	179.5	-65	164.1	0	0	0	112.6	F84 M87 L109 M113 I132 G245 L246 A251 G252 Q254	F84-L249 HydrophobicContact CD1-CD1 4.29Å; F84-L249 HydrophobicContact CD1-CD2 4.26Å; F84-L249 HydrophobicContact CD1-CG 4.27Å; F84-L249 HydrophobicContact CE1-CD1 3.89Å; F84-L249 HydrophobicContact CE1-CD2 3.7Å; F84-L249 HydrophobicContact CE1-CG 3.48Å; F84-L249 VanDerWaalsContact CE1-CG 3.48Å; F84-L249 HydrophobicContact CE2-CD2 3.98Å; F84-L249 HydrophobicContact CZ-CD2 3.53Å; F84-L249 HydrophobicContact CZ-CG 3.64Å; M87-L249 HydrophobicContact CE-CD1 3.99Å; L109-L249 HydrophobicContact CD1-CD1 3.97Å; L109-L249 HydrophobicContact CD2-CD1 3.7Å; L109-L249 HydrophobicContact CD2-CD2 4.47Å; M113-L249 HydrophobicContact CB-CD2 4.38Å; M113-L249 HydrophobicContact CE-CD2 3.74Å; I132-L249 HydrophobicContact CD1-CB 4.43Å; I132-L249 HydrophobicContact CD1-CD1 4.22Å; I132-L249 HydrophobicContact CG2-CB 3.97Å; G245-L249 WeakPolarHBondContact O-CG 3.33Å; G245-L249 PolarHBondContact O-N 3.46Å; L246-L249 HydrophobicContact CD2-CD1 4.32Å; L246-L249 PolarHBondContact O-N 3.17Å; L249-A251 VanDerWaalsContact C-N 3.29Å; L249-G252 PolarHBondContact O-N 3.18Å; L249-Q254 HydrophobicContact CB-CG 4.45Å; L249-Q254 HydrophobicContact CD2-CG 3.77Å; L249-Q254 PolarHBondContact O-NE2 3.4Å
250	M	90.5	Very high	86.3	Confident	69 Å²	69	37.5 Å²	37.5	34%	0.34	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-36.4	171.9	-69.7	167.7	69.2	0	0	111.5	I132 I135 V138 L246 G252	I132-M250 HydrophobicContact CG2-CG 4.4Å; I135-M250 HydrophobicContact CB-CE 4.5Å; I135-M250 HydrophobicContact CB-CG 4.36Å; I135-M250 HydrophobicContact CB-SD 4.28Å; I135-M250 HydrophobicContact CG2-CE 3.9Å; I135-M250 HydrophobicContact CG2-CG 4.33Å; I135-M250 HydrophobicContact CG2-SD 3.62Å; V138-M250 HydrophobicContact CG2-SD 3.77Å; L246-M250 WeakPolarHBondContact O-CB 3.1Å; L246-M250 VanDerWaalsContact O-CG 3.24Å; L246-M250 WeakPolarHBondContact O-CG 3.32Å; L246-M250 PolarHBondContact O-N 2.84Å; M250-G252 PolarHBondContact O-N 3.41Å
251	A	87.4	Confident	85.7	Confident	34 Å²	34	40.5 Å²	40.5	28%	0.281	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	30	173.5	0	0	0	0	0	113.5	K247 C248 L249 A253 R262 S351 G352	K247-A251 WeakPolarHBondContact O-CB 3.32Å; K247-A251 PolarHBondContact O-N 3.34Å; K247-A251 VanDerWaalsContact O-N 3.11Å; C248-A251 CarbonylContact O-C 3.56Å; C248-A251 PolarHBondContact O-N 3.37Å; L249-A251 VanDerWaalsContact C-N 3.29Å; A251-A253 PolarHBondContact O-N 3.29Å; A251-R262 PolarHBondContact O-NH2 2.9Å; A251-S351 WeakPolarHBondContact CB-O 3.5Å; A251-G352 WeakPolarHBondContact CB-O 3.29Å
252	G	84	Confident	85	Confident	40 Å²	40	42.5 Å²	42.5	41%	0.412	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	8.8	169.3	0	0	0	0	0	116.7	C248 L249 M250 Q254	C248-G252 PolarHBondContact O-N 3.18Å; L249-G252 PolarHBondContact O-N 3.18Å; M250-G252 PolarHBondContact O-N 3.41Å; G252-Q254 PolarHBondContact O-N 3.08Å
253	A	81.6	Confident	84.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	30.9	177.7	0	0	0	0	0	114.1	F84 C248 A251 L259	F84-A253 HydrophobicContact CE2-CB 4.22Å; F84-A253 VanDerWaalsContact CE2-O 3.3Å; F84-A253 WeakPolarHBondContact CE2-O 3.1Å; F84-A253 HydrophobicContact CZ-CB 4.17Å; C248-A253 HydrophobicContact CB-CB 4.03Å; C248-A253 WeakPolarHBondContact O-CB 3.33Å; C248-A253 PolarHBondContact O-N 3.4Å; A251-A253 PolarHBondContact O-N 3.29Å; A253-L259 HydrophobicContact CB-CD2 4.29Å; A253-L259 HydrophobicContact CB-CG 4.29Å; A253-L259 WeakPolarHBondContact O-CD1 3.33Å
254	Q	80.1	Confident	83.8	Confident	58 Å²	58	46.9 Å²	46.9	27%	0.271	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-27	173	-63.9	178.8	51	0	0	111.4	M113 L249 G252	M113-Q254 HydrophobicContact CB-CB 4.39Å; M113-Q254 HydrophobicContact CB-CG 4.38Å; L249-Q254 HydrophobicContact CB-CG 4.45Å; L249-Q254 HydrophobicContact CD2-CG 3.77Å; L249-Q254 PolarHBondContact O-NE2 3.4Å; G252-Q254 PolarHBondContact O-N 3.08Å
255	D	80.2	Confident	83.5	Confident	74 Å²	74	47.6 Å²	47.6	40%	0.396	26%	0.255	S	S	.	.	S	Bend	trans	-78.7	123.6	174.5	-176.1	-15.7	0	0	0	110.9	Q257 V258 L259	D255-Q257 VanDerWaalsContact C-N 3.27Å; D255-Q257 PolarHBondContact O-N 2.89Å; D255-Q257 PolarHBondContact OD1-N 3.31Å; D255-V258 HydrophobicContact CB-CB 4.1Å; D255-V258 HydrophobicContact CB-CG2 3.88Å; D255-V258 PolarHBondContact O-N 3.3Å; D255-L259 PolarHBondContact O-N 2.95Å; D255-L259 VanDerWaalsContact O-N 3.11Å
256	P	75.2	Confident	83.4	Confident	91 Å²	91	48.7 Å²	48.7	59%	0.591	26%	0.259	S	S	*	.	H	α-helix	trans	-55.8	-33.8	174	-26.3	35.9	0	0	0	114.8	L259 E260	P256-L259 WeakPolarHBondContact O-CB 3.45Å; P256-L259 PolarHBondContact O-N 3.17Å; P256-E260 PolarHBondContact O-N 3.49Å
257	Q	79.3	Confident	83.2	Confident	136 Å²	136	50.5 Å²	50.5	64%	0.636	27%	0.269	S	S	*	.	H	α-helix	trans	-67.8	-44.9	178.9	-63.2	-167.6	-3.7	0	0	110.9	D255 L259 E260 D261	D255-Q257 VanDerWaalsContact C-N 3.27Å; D255-Q257 PolarHBondContact O-N 2.89Å; D255-Q257 PolarHBondContact OD1-N 3.31Å; Q257-L259 PolarHBondContact O-N 3.44Å; Q257-E260 PolarHBondContact O-N 3.12Å; Q257-D261 WeakPolarHBondContact O-CB 3.33Å; Q257-D261 VanDerWaalsContact O-CG 3.31Å; Q257-D261 PolarHBondContact O-N 2.88Å
258	V	79.1	Confident	83.1	Confident	53 Å²	53	53.3 Å²	53.3	32%	0.321	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-32.4	175.5	175.8	0	0	0	0	111.7	D255 R262	D255-V258 HydrophobicContact CB-CB 4.1Å; D255-V258 HydrophobicContact CB-CG2 3.88Å; D255-V258 PolarHBondContact O-N 3.3Å; V258-R262 VanDerWaalsContact O-CD 3.27Å; V258-R262 WeakPolarHBondContact O-CD 3.49Å; V258-R262 WeakPolarHBondContact O-CG 3.32Å; V258-R262 PolarHBondContact O-N 2.93Å
259	L	76	Confident	83.2	Confident	20 Å²	20	54.5 Å²	54.5	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-48.1	172.7	-91.6	163.3	0	0	0	112.8	A80 F84 A253 D255 P256 Q257 R262	A80-L259 HydrophobicContact CB-CD2 3.92Å; F84-L259 HydrophobicContact CD2-CD1 4Å; F84-L259 HydrophobicContact CD2-CD2 4.33Å; F84-L259 HydrophobicContact CE2-CD1 3.86Å; F84-L259 HydrophobicContact CE2-CD2 3.8Å; F84-L259 HydrophobicContact CE2-CG 4.26Å; A253-L259 HydrophobicContact CB-CD2 4.29Å; A253-L259 HydrophobicContact CB-CG 4.29Å; A253-L259 WeakPolarHBondContact O-CD1 3.33Å; D255-L259 PolarHBondContact O-N 2.95Å; D255-L259 VanDerWaalsContact O-N 3.11Å; P256-L259 WeakPolarHBondContact O-CB 3.45Å; P256-L259 PolarHBondContact O-N 3.17Å; Q257-L259 PolarHBondContact O-N 3.44Å; L259-R262 PolarHBondContact O-N 2.63Å
260	E	74.4	Confident	83.2	Confident	118 Å²	118	54.5 Å²	54.5	55%	0.551	28%	0.282	S	S	*	.	H	α-helix	trans	-66.5	-42	178.1	-70.1	-172.7	172.9	0	0	112.2	P256 Q257 R262 Q263 K264	P256-E260 PolarHBondContact O-N 3.49Å; Q257-E260 PolarHBondContact O-N 3.12Å; E260-R262 PolarHBondContact O-N 3.38Å; E260-Q263 PolarHBondContact O-N 3.02Å; E260-K264 WeakPolarHBondContact O-CG 3.41Å; E260-K264 PolarHBondContact O-N 3.35Å; E260-K264 VanDerWaalsContact O-N 3.08Å; E260-K264 IonicContact OE2-NZ 3.92Å; E260-K264 PolarHBondContact OE2-NZ 3.43Å; E260-K264 VanDerWaalsContact OE2-NZ 3.11Å
261	D	78.3	Confident	83.3	Confident	88 Å²	88	54 Å²	54	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-62.6	-27	-178.9	-74.1	-12.5	0	0	0	112.7	Q257 Q263 K264 P265	Q257-D261 WeakPolarHBondContact O-CB 3.33Å; Q257-D261 VanDerWaalsContact O-CG 3.31Å; Q257-D261 PolarHBondContact O-N 2.88Å; D261-Q263 VanDerWaalsContact C-N 3.33Å; D261-Q263 PolarHBondContact O-N 3.08Å; D261-K264 VanDerWaalsContact OD1-CD 3.29Å; D261-K264 WeakPolarHBondContact OD1-CD 3.37Å; D261-K264 WeakPolarHBondContact OD1-CE 3.38Å; D261-K264 IonicContact OD1-NZ 2.86Å; D261-K264 PolarHBondContact OD1-NZ 3.34Å; D261-P265 WeakPolarHBondContact O-CD 3.5Å
262	R	79	Confident	83.5	Confident	43 Å²	43	56.8 Å²	56.8	16%	0.162	29%	0.288	C	S	.	.	H	α-helix	trans	-66.8	-29.4	172	-74.3	164.2	-173.1	-137.5	-0.8	113.5	A251 V258 L259 E260 G352 E354 H355	A251-R262 PolarHBondContact O-NH2 2.9Å; V258-R262 VanDerWaalsContact O-CD 3.27Å; V258-R262 WeakPolarHBondContact O-CD 3.49Å; V258-R262 WeakPolarHBondContact O-CG 3.32Å; V258-R262 PolarHBondContact O-N 2.93Å; L259-R262 PolarHBondContact O-N 2.63Å; E260-R262 PolarHBondContact O-N 3.38Å; R262-G352 PolarHBondContact NH1-O 3.34Å; R262-E354 HydrophobicContact CB-CB 4.44Å; R262-E354 HydrophobicContact CB-CG 4.44Å; R262-H355 PolarHBondContact O-CE1 2.87Å
263	Q	79.6	Confident	83.9	Confident	35 Å²	35	56.2 Å²	56.2	16%	0.164	28%	0.276	C	S	.	.	H	α-helix	trans	-93.8	-25.9	178.8	-68.4	-171.6	51.1	0	0	113.7	E260 D261 P265 R266 D267 E354	E260-Q263 PolarHBondContact O-N 3.02Å; D261-Q263 VanDerWaalsContact C-N 3.33Å; D261-Q263 PolarHBondContact O-N 3.08Å; Q263-P265 VanDerWaalsContact C-CD 3.44Å; Q263-P265 VanDerWaalsContact C-N 3.34Å; Q263-P265 VanDerWaalsContact O-N 3.13Å; Q263-R266 PolarHBondContact O-N 3.14Å; Q263-D267 PolarHBondContact O-N 3.4Å; Q263-D267 VanDerWaalsContact O-N 3.08Å; Q263-E354 WeakPolarHBondContact CG-OE2 3.37Å
264	K	83.7	Confident	84.4	Confident	65 Å²	65	56.2 Å²	56.2	28%	0.283	28%	0.276	S	S	.	.	H	α-helix	trans	-49.4	-39.3	-176.6	-77.8	168.4	-162	155.8	0	115	E260 D261 D267 R268	E260-K264 WeakPolarHBondContact O-CG 3.41Å; E260-K264 PolarHBondContact O-N 3.35Å; E260-K264 VanDerWaalsContact O-N 3.08Å; E260-K264 IonicContact OE2-NZ 3.92Å; E260-K264 PolarHBondContact OE2-NZ 3.43Å; E260-K264 VanDerWaalsContact OE2-NZ 3.11Å; D261-K264 VanDerWaalsContact OD1-CD 3.29Å; D261-K264 WeakPolarHBondContact OD1-CD 3.37Å; D261-K264 WeakPolarHBondContact OD1-CE 3.38Å; D261-K264 IonicContact OD1-NZ 2.86Å; D261-K264 PolarHBondContact OD1-NZ 3.34Å; K264-D267 PolarHBondContact O-N 2.81Å; K264-R268 WeakPolarHBondContact O-CB 3.5Å; K264-R268 WeakPolarHBondContact O-CG 3.4Å; K264-R268 PolarHBondContact O-N 2.95Å
265	P	85.3	Confident	84.9	Confident	20 Å²	20	58 Å²	58	13%	0.13	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-40.9	176.6	-24	35.1	0	0	0	114	D261 Q263 D267 W269	D261-P265 WeakPolarHBondContact O-CD 3.5Å; Q263-P265 VanDerWaalsContact C-CD 3.44Å; Q263-P265 VanDerWaalsContact C-N 3.34Å; Q263-P265 VanDerWaalsContact O-N 3.13Å; P265-D267 VanDerWaalsContact C-N 3.34Å; P265-W269 WeakPolarHBondContact O-CB 3.3Å; P265-W269 PolarHBondContact O-N 3.3Å; P265-W269 VanDerWaalsContact O-N 3.15Å
266	R	89.6	Confident	85.4	Confident	23 Å²	23	61.1 Å²	61.1	9%	0.087	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-42.4	175.9	-169.3	-175.5	-170.3	-159.7	0.6	110.3	Q263 W269 L270 T338 D401	Q263-R266 PolarHBondContact O-N 3.14Å; R266-W269 HydrophobicContact CG-CE3 4.39Å; R266-W269 PolarHBondContact O-N 2.84Å; R266-L270 HydrophobicContact CG-CD1 4.32Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 3.25Å; R266-T338 PolarHBondContact NH1-OG1 3.18Å; R266-T338 PolarHBondContact NH2-OG1 3.01Å; R266-D401 IonicContact CZ-OD1 3.33Å; R266-D401 IonicContact CZ-OD2 2.77Å; R266-D401 IonicContact NE-OD1 2.9Å; R266-D401 IonicContact NE-OD2 3.77Å; R266-D401 PolarHBondContact NE-OD2 2.91Å; R266-D401 VanDerWaalsContact NH2-CG 3.35Å; R266-D401 IonicContact NH2-OD1 2.81Å; R266-D401 PolarHBondContact NH2-OD1 3.27Å; R266-D401 IonicContact NH2-OD2 2.77Å; R266-D401 PolarHBondContact NH2-OD2 3.42Å
267	D	90.1	Very high	86.1	Confident	37 Å²	37	57.7 Å²	57.7	20%	0.198	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-45.2	-175.8	-68.3	16.5	0	0	0	111.2	Q263 K264 P265 W269 L270 Q271 V330 K334	Q263-D267 PolarHBondContact O-N 3.4Å; Q263-D267 VanDerWaalsContact O-N 3.08Å; K264-D267 PolarHBondContact O-N 2.81Å; P265-D267 VanDerWaalsContact C-N 3.34Å; D267-W269 VanDerWaalsContact C-N 3.32Å; D267-W269 PolarHBondContact O-N 2.9Å; D267-L270 PolarHBondContact O-N 2.84Å; D267-Q271 WeakPolarHBondContact O-CB 3.41Å; D267-Q271 VanDerWaalsContact O-CG 3.23Å; D267-Q271 WeakPolarHBondContact O-CG 3.34Å; D267-Q271 PolarHBondContact O-N 2.88Å; D267-V330 HydrophobicContact CB-CG1 4.42Å; D267-K334 WeakPolarHBondContact OD1-CE 3.24Å; D267-K334 IonicContact OD1-NZ 3.11Å; D267-K334 PolarHBondContact OD1-NZ 2.72Å; D267-K334 IonicContact OD2-NZ 3.65Å; D267-K334 PolarHBondContact OD2-NZ 3.42Å
268	R	90.4	Very high	86.6	Confident	114 Å²	114	51.4 Å²	51.4	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-55	-46.2	171.6	-73.6	169.1	-168.6	155.4	3.6	111.8	K264 Q271 I272 E391	K264-R268 WeakPolarHBondContact O-CB 3.5Å; K264-R268 WeakPolarHBondContact O-CG 3.4Å; K264-R268 PolarHBondContact O-N 2.95Å; R268-Q271 WeakPolarHBondContact O-CB 3.09Å; R268-Q271 PolarHBondContact O-N 3.18Å; R268-I272 VanDerWaalsContact O-CG1 3.28Å; R268-I272 WeakPolarHBondContact O-CG1 3.42Å; R268-I272 PolarHBondContact O-N 3.1Å; R268-E391 IonicContact NH1-OE1 3.92Å; R268-E391 PolarHBondContact NH1-OE1 3.48Å; R268-E391 IonicContact NH1-OE2 2.74Å
269	W	92.5	Very high	86.9	Confident	26 Å²	26	53.7 Å²	53.7	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-45.9	178.8	164.6	62.8	0	0	0	112.2	P265 R266 D267 Q271 I272 L273 I297 F333 P388 D401	P265-W269 WeakPolarHBondContact O-CB 3.3Å; P265-W269 PolarHBondContact O-N 3.3Å; P265-W269 VanDerWaalsContact O-N 3.15Å; R266-W269 HydrophobicContact CG-CE3 4.39Å; R266-W269 PolarHBondContact O-N 2.84Å; D267-W269 VanDerWaalsContact C-N 3.32Å; D267-W269 PolarHBondContact O-N 2.9Å; W269-Q271 VanDerWaalsContact C-N 3.32Å; W269-Q271 PolarHBondContact O-N 2.86Å; W269-I272 PolarHBondContact O-N 3.11Å; W269-L273 HydrophobicContact CD2-CD1 4.28Å; W269-L273 VanDerWaalsContact CE2-CD1 3.45Å; W269-L273 HydrophobicContact CH2-CD1 4.44Å; W269-L273 HydrophobicContact CZ2-CD1 3.53Å; W269-L273 WeakPolarHBondContact O-CG 3.26Å; W269-L273 PolarHBondContact O-N 3.37Å; W269-I297 HydrophobicContact CH2-CG2 3.68Å; W269-I297 HydrophobicContact CZ2-CG2 3.86Å; W269-F333 HydrophobicContact CH2-CZ 4.23Å; W269-F333 HydrophobicContact CZ3-CE1 4.35Å; W269-F333 HydrophobicContact CZ3-CZ 4.49Å; W269-P388 HydrophobicContact CH2-CB 4.07Å; W269-P388 HydrophobicContact CH2-CG 3.58Å; W269-P388 HydrophobicContact CZ2-CB 3.48Å; W269-P388 VanDerWaalsContact CZ2-CB 3.48Å; W269-P388 HydrophobicContact CZ2-CG 3.52Å; W269-P388 HydrophobicContact CZ3-CG 4.24Å; W269-D401 HydrophobicContact CH2-CB 4.41Å; W269-D401 HydrophobicContact CZ3-CB 4.39Å
270	L	92	Very high	87.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.6	-35.8	174.7	-68.8	170.4	0	0	0	112.5	R266 D267 L273 F274 F329 V330 F333	R266-L270 HydrophobicContact CG-CD1 4.32Å; R266-L270 WeakPolarHBondContact O-CG 3.3Å; R266-L270 PolarHBondContact O-N 3.25Å; D267-L270 PolarHBondContact O-N 2.84Å; L270-L273 PolarHBondContact O-N 3.47Å; L270-F274 PolarHBondContact O-N 3.26Å; L270-F329 HydrophobicContact CB-CE1 4.32Å; L270-F329 HydrophobicContact CD2-CE1 4.35Å; L270-V330 HydrophobicContact CB-CG2 3.97Å; L270-V330 HydrophobicContact CD1-CG1 4.26Å; L270-F333 HydrophobicContact CD1-CB 4.32Å; L270-F333 HydrophobicContact CD1-CD1 3.56Å; L270-F333 HydrophobicContact CD1-CE1 4.21Å; L270-F333 HydrophobicContact CD1-CG 4.12Å; L270-F333 HydrophobicContact CD2-CB 4.27Å; L270-F333 HydrophobicContact CD2-CD1 3.49Å; L270-F333 VanDerWaalsContact CD2-CD1 3.49Å; L270-F333 HydrophobicContact CD2-CD2 3.91Å; L270-F333 HydrophobicContact CD2-CE1 3.74Å; L270-F333 HydrophobicContact CD2-CE2 4.15Å; L270-F333 HydrophobicContact CD2-CG 3.6Å; L270-F333 HydrophobicContact CD2-CZ 4.08Å; L270-F333 HydrophobicContact CG-CD1 4.17Å
271	Q	92	Very high	87.7	Confident	59 Å²	59	57.3 Å²	57.3	28%	0.276	29%	0.29	S	S	.	.	H	α-helix	trans	-67.9	-35.2	174.9	-75.9	-171.3	18.5	0	0	113.3	D267 R268 W269 H275 K326 V330	D267-Q271 WeakPolarHBondContact O-CB 3.41Å; D267-Q271 VanDerWaalsContact O-CG 3.23Å; D267-Q271 WeakPolarHBondContact O-CG 3.34Å; D267-Q271 PolarHBondContact O-N 2.88Å; R268-Q271 WeakPolarHBondContact O-CB 3.09Å; R268-Q271 PolarHBondContact O-N 3.18Å; W269-Q271 VanDerWaalsContact C-N 3.32Å; W269-Q271 PolarHBondContact O-N 2.86Å; Q271-H275 PolarHBondContact O-CD2 3.21Å; Q271-H275 PolarHBondContact O-N 3.43Å; Q271-K326 HydrophobicContact CG-CD 4.4Å; Q271-K326 HydrophobicContact CG-CG 4.23Å; Q271-K326 VanDerWaalsContact OE1-NZ 3.11Å; Q271-V330 HydrophobicContact CG-CG2 3.82Å
272	I	91.5	Very high	88	Confident	92 Å²	92	58.1 Å²	58.1	47%	0.472	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-50.2	172.8	-71	161.3	0	0	0	109.5	R268 W269 F274 H275 E276	R268-I272 VanDerWaalsContact O-CG1 3.28Å; R268-I272 WeakPolarHBondContact O-CG1 3.42Å; R268-I272 PolarHBondContact O-N 3.1Å; W269-I272 PolarHBondContact O-N 3.11Å; I272-F274 PolarHBondContact O-N 2.76Å; I272-H275 PolarHBondContact O-N 2.84Å; I272-E276 HydrophobicContact CG2-CG 4.31Å; I272-E276 WeakPolarHBondContact CG2-OE1 3.49Å; I272-E276 WeakPolarHBondContact O-CG 3.4Å; I272-E276 PolarHBondContact O-N 3.41Å
273	L	91.1	Very high	88.3	Confident	28 Å²	28	57.9 Å²	57.9	15%	0.147	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-32.6	177.5	-73	178.9	0	0	0	113.3	W269 L270 A277 L293 I297	W269-L273 HydrophobicContact CD2-CD1 4.28Å; W269-L273 VanDerWaalsContact CE2-CD1 3.45Å; W269-L273 HydrophobicContact CH2-CD1 4.44Å; W269-L273 HydrophobicContact CZ2-CD1 3.53Å; W269-L273 WeakPolarHBondContact O-CG 3.26Å; W269-L273 PolarHBondContact O-N 3.37Å; L270-L273 PolarHBondContact O-N 3.47Å; L273-A277 WeakPolarHBondContact O-CB 3.48Å; L273-A277 PolarHBondContact O-N 2.84Å; L273-A277 VanDerWaalsContact O-N 3.15Å; L273-L293 HydrophobicContact CB-CD1 4.36Å; L273-I297 HydrophobicContact CD1-CD1 3.64Å; L273-I297 HydrophobicContact CD1-CG1 3.85Å
274	F	92.5	Very high	88.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-45.7	172.2	-175.4	-84.9	0	0	0	111.9	L270 I272 A277 D278 L285 K326 F329	L270-F274 PolarHBondContact O-N 3.26Å; I272-F274 PolarHBondContact O-N 2.76Å; F274-A277 PolarHBondContact O-N 3.5Å; F274-D278 PolarHBondContact O-N 3.14Å; F274-L285 HydrophobicContact CD2-CD1 3.53Å; F274-L285 HydrophobicContact CD2-CG 4.07Å; F274-L285 HydrophobicContact CE2-CB 4.12Å; F274-L285 HydrophobicContact CE2-CD1 3.57Å; F274-L285 HydrophobicContact CE2-CG 3.6Å; F274-L285 HydrophobicContact CG-CD1 4.25Å; F274-L285 HydrophobicContact CZ-CB 4.49Å; F274-L285 HydrophobicContact CZ-CD1 4.27Å; F274-L285 HydrophobicContact CZ-CG 3.87Å; F274-K326 HydrophobicContact CD1-CB 3.83Å; F274-K326 HydrophobicContact CD1-CG 3.96Å; F274-K326 HydrophobicContact CE1-CB 3.74Å; F274-K326 HydrophobicContact CE1-CG 4.38Å; F274-K326 HydrophobicContact CG-CB 4.29Å; F274-K326 HydrophobicContact CG-CG 4.25Å; F274-K326 HydrophobicContact CZ-CB 4.1Å; F274-K326 VanDerWaalsContact CZ-N 3.31Å; F274-F329 HydrophobicContact CB-CD1 4.01Å; F274-F329 HydrophobicContact CB-CE1 4.37Å; F274-F329 HydrophobicContact CD2-CB 3.55Å; F274-F329 AromaticContact CD2-CD1 3.78Å; F274-F329 HydrophobicContact CD2-CD1 3.78Å; F274-F329 HydrophobicContact CD2-CD2 4.47Å; F274-F329 AromaticContact CD2-CG 3.67Å; F274-F329 HydrophobicContact CD2-CG 3.67Å; F274-F329 HydrophobicContact CE2-CB 3.81Å; F274-F329 HydrophobicContact CE2-CG 4.34Å; F274-F329 HydrophobicContact CG-CD1 4.36Å
275	H	92.2	Very high	88.9	Confident	95 Å²	95	57.7 Å²	57.7	44%	0.44	30%	0.299	S	S	.	.	H	α-helix	trans	-68.9	-32.4	177.1	-71.6	-38.4	0	0	0	113.2	Q271 I272 A277 K326	Q271-H275 PolarHBondContact O-CD2 3.21Å; Q271-H275 PolarHBondContact O-N 3.43Å; I272-H275 PolarHBondContact O-N 2.84Å; H275-A277 VanDerWaalsContact C-N 3.27Å; H275-A277 PolarHBondContact O-N 3.26Å; H275-K326 PolarHBondContact NE2-NZ 2.9Å
276	E	90.7	Very high	89.1	Confident	141 Å²	141	59 Å²	59	66%	0.659	31%	0.308	S	S	*	.	H	α-helix	trans	-68.1	-26.7	172	-70.6	177	177.4	0	0	112.6	I272	I272-E276 HydrophobicContact CG2-CG 4.31Å; I272-E276 WeakPolarHBondContact CG2-OE1 3.49Å; I272-E276 WeakPolarHBondContact O-CG 3.4Å; I272-E276 PolarHBondContact O-N 3.41Å
277	A	89.5	Confident	89	Confident	19 Å²	19	60.1 Å²	60.1	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-85.5	-36.1	175.7	0	0	0	0	0	113.4	L273 F274 H275 S279 L285 L293	L273-A277 WeakPolarHBondContact O-CB 3.48Å; L273-A277 PolarHBondContact O-N 2.84Å; L273-A277 VanDerWaalsContact O-N 3.15Å; F274-A277 PolarHBondContact O-N 3.5Å; H275-A277 VanDerWaalsContact C-N 3.27Å; H275-A277 PolarHBondContact O-N 3.26Å; A277-S279 PolarHBondContact O-N 3.08Å; A277-L285 HydrophobicContact CB-CD1 3.91Å; A277-L285 HydrophobicContact CB-CD2 4.19Å; A277-L293 HydrophobicContact CB-CD1 4.3Å; A277-L293 HydrophobicContact CB-CD2 3.82Å
278	D	90.4	Very high	88.9	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.021	33%	0.333	C	S	.	.			trans	-76.8	68.2	175.5	-177	11.1	0	0	0	111.3	F274 T280 N281 Q282 G283 L285	F274-D278 PolarHBondContact O-N 3.14Å; D278-T280 PolarHBondContact O-N 2.97Å; D278-T280 PolarHBondContact OD1-N 3.17Å; D278-T280 PolarHBondContact OD1-OG1 2.95Å; D278-N281 PolarHBondContact O-N 3.25Å; D278-N281 PolarHBondContact OD1-N 3.31Å; D278-N281 WeakPolarHBondContact OD2-CA 3.47Å; D278-Q282 PolarHBondContact OD1-N 3.35Å; D278-Q282 PolarHBondContact OD2-N 3.19Å; D278-G283 PolarHBondContact OD2-N 3.41Å; D278-L285 HydrophobicContact CB-CD2 3.92Å
279	S	84.9	Confident	88.9	Confident	101 Å²	101	62.3 Å²	62.3	71%	0.706	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-9.8	172.3	61.9	0	0	0	0	114.2	A277	A277-S279 PolarHBondContact O-N 3.08Å
280	T	82.7	Confident	88.9	Confident	77 Å²	77	61 Å²	61	47%	0.472	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-10.3	178.2	61.1	0	0	0	0	114.4	D278 Q282	D278-T280 PolarHBondContact O-N 2.97Å; D278-T280 PolarHBondContact OD1-N 3.17Å; D278-T280 PolarHBondContact OD1-OG1 2.95Å; T280-Q282 PolarHBondContact O-N 2.87Å; T280-Q282 WeakPolarHBondContact OG1-CG 3.41Å
281	N	84.2	Confident	88.8	Confident	136 Å²	136	61.4 Å²	61.4	73%	0.727	32%	0.324	S	S	*	.			trans	47.8	39.4	-170.6	-71.2	-75.1	0	0	0	113.8	D278	D278-N281 PolarHBondContact O-N 3.25Å; D278-N281 PolarHBondContact OD1-N 3.31Å; D278-N281 WeakPolarHBondContact OD2-CA 3.47Å
282	Q	83.8	Confident	88.8	Confident	105 Å²	105	66.5 Å²	66.5	49%	0.491	34%	0.341	S	S	.	.	S	Bend	trans	-86.3	-13.1	177.5	-69.2	-175.5	26.9	0	0	113.2	D278 T280 Y284	D278-Q282 PolarHBondContact OD1-N 3.35Å; D278-Q282 PolarHBondContact OD2-N 3.19Å; T280-Q282 PolarHBondContact O-N 2.87Å; T280-Q282 WeakPolarHBondContact OG1-CG 3.41Å; Q282-Y284 VanDerWaalsContact C-N 3.31Å; Q282-Y284 HydrophobicContact CB-CD1 4.43Å; Q282-Y284 HydrophobicContact CB-CD2 4.21Å; Q282-Y284 HydrophobicContact CB-CE1 4.01Å; Q282-Y284 HydrophobicContact CB-CE2 3.74Å; Q282-Y284 VanDerWaalsContact O-CD1 3.28Å; Q282-Y284 WeakPolarHBondContact O-CD1 3.34Å; Q282-Y284 VanDerWaalsContact O-CE1 3.31Å; Q282-Y284 WeakPolarHBondContact O-CE1 3.19Å; Q282-Y284 VanDerWaalsContact OE1-CZ 3.28Å; Q282-Y284 PolarHBondContact OE1-OH 2.94Å
283	G	84.9	Confident	88.8	Confident	38 Å²	38	63 Å²	63	39%	0.392	32%	0.323	S	S	.	.	S	Bend	trans	85	0.8	179.7	0	0	0	0	0	114.5	D278	D278-G283 PolarHBondContact OD2-N 3.41Å
284	Y	88.7	Confident	88.7	Confident	96 Å²	96	61.7 Å²	61.7	38%	0.376	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.7	179.5	48.1	-103.8	0	0	0	111.4	Q282 T322 I324	Q282-Y284 VanDerWaalsContact C-N 3.31Å; Q282-Y284 HydrophobicContact CB-CD1 4.43Å; Q282-Y284 HydrophobicContact CB-CD2 4.21Å; Q282-Y284 HydrophobicContact CB-CE1 4.01Å; Q282-Y284 HydrophobicContact CB-CE2 3.74Å; Q282-Y284 VanDerWaalsContact O-CD1 3.28Å; Q282-Y284 WeakPolarHBondContact O-CD1 3.34Å; Q282-Y284 VanDerWaalsContact O-CE1 3.31Å; Q282-Y284 WeakPolarHBondContact O-CE1 3.19Å; Q282-Y284 VanDerWaalsContact OE1-CZ 3.28Å; Q282-Y284 PolarHBondContact OE1-OH 2.94Å; Y284-T322 VanDerWaalsContact CD2-O 3.26Å; Y284-T322 WeakPolarHBondContact CD2-O 3.43Å; Y284-I324 CarbonylContact C-O 3.53Å; Y284-I324 VanDerWaalsContact CA-O 3.27Å; Y284-I324 WeakPolarHBondContact CA-O 3.22Å
285	L	89.1	Confident	88.5	Confident	1 Å²	1	66 Å²	66	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	150.4	174.8	-69.4	177.5	0	0	0	111.1	F274 A277 D278 E289 V290 L293 G323 I324	F274-L285 HydrophobicContact CD2-CD1 3.53Å; F274-L285 HydrophobicContact CD2-CG 4.07Å; F274-L285 HydrophobicContact CE2-CB 4.12Å; F274-L285 HydrophobicContact CE2-CD1 3.57Å; F274-L285 HydrophobicContact CE2-CG 3.6Å; F274-L285 HydrophobicContact CG-CD1 4.25Å; F274-L285 HydrophobicContact CZ-CB 4.49Å; F274-L285 HydrophobicContact CZ-CD1 4.27Å; F274-L285 HydrophobicContact CZ-CG 3.87Å; A277-L285 HydrophobicContact CB-CD1 3.91Å; A277-L285 HydrophobicContact CB-CD2 4.19Å; D278-L285 HydrophobicContact CB-CD2 3.92Å; L285-E289 HydrophobicContact CB-CB 4.28Å; L285-E289 HydrophobicContact CD2-CB 4.21Å; L285-V290 HydrophobicContact CB-CG2 3.62Å; L285-V290 HydrophobicContact CD1-CG2 4.16Å; L285-L293 HydrophobicContact CD1-CD2 4.17Å; L285-G323 WeakPolarHBondContact O-CA 3.14Å; L285-I324 PolarHBondContact N-O 3.12Å; L285-I324 PolarHBondContact O-N 2.96Å
286	S	88.1	Confident	88.3	Confident	46 Å²	46	65.5 Å²	65.5	32%	0.322	34%	0.339	S	S	.	.			trans	-73.7	162.1	172.5	69.4	0	0	0	0	112.9	F288 E289 V290	S286-F288 PolarHBondContact O-N 3.33Å; S286-E289 WeakPolarHBondContact CB-OE2 3.49Å; S286-E289 PolarHBondContact N-OE2 3.39Å; S286-E289 PolarHBondContact O-N 3.35Å; S286-E289 VanDerWaalsContact O-N 3.14Å; S286-E289 VanDerWaalsContact OG-CD 3.31Å; S286-E289 WeakPolarHBondContact OG-CG 3.48Å; S286-E289 PolarHBondContact OG-N 3.19Å; S286-E289 PolarHBondContact OG-OE2 3.1Å; S286-V290 PolarHBondContact O-N 2.97Å
287	E	87.9	Confident	88	Confident	47 Å²	47	60 Å²	60	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-50.1	-40.3	172.5	-166.7	-142.5	78	0	0	111.5	I291 R307 L310 K311	E287-I291 HydrophobicContact CG-CD1 4.05Å; E287-I291 WeakPolarHBondContact O-CB 3.39Å; E287-I291 WeakPolarHBondContact O-CD1 3.48Å; E287-I291 WeakPolarHBondContact O-CG1 3.33Å; E287-I291 PolarHBondContact O-N 2.65Å; E287-I291 VanDerWaalsContact O-N 3.08Å; E287-R307 VanDerWaalsContact CD-CG 3.41Å; E287-R307 HydrophobicContact CG-CG 4.42Å; E287-R307 WeakPolarHBondContact OE1-CD 3.32Å; E287-R307 WeakPolarHBondContact OE1-CG 3.43Å; E287-R307 IonicContact OE1-CZ 2.72Å; E287-R307 IonicContact OE1-NE 3.93Å; E287-R307 IonicContact OE1-NH1 2.73Å; E287-R307 PolarHBondContact OE1-NH1 3.49Å; E287-R307 WeakPolarHBondContact OE2-CG 3.28Å; E287-L310 HydrophobicContact CB-CD1 4.42Å; E287-L310 HydrophobicContact CG-CD1 3.6Å; E287-K311 WeakPolarHBondContact OE2-CE 3.42Å; E287-K311 IonicContact OE2-NZ 2.75Å
288	F	88.9	Confident	87.6	Confident	132 Å²	132	59.8 Å²	59.8	58%	0.579	31%	0.31	S	S	*	.	H	α-helix	trans	-69.1	-44.8	-179.9	-178.5	-94.1	0	0	0	112.5	S286 I291 R292	S286-F288 PolarHBondContact O-N 3.33Å; F288-I291 PolarHBondContact O-N 2.88Å; F288-R292 WeakPolarHBondContact O-CB 3.22Å; F288-R292 PolarHBondContact O-N 3.17Å
289	E	90.4	Very high	87.2	Confident	65 Å²	65	63.2 Å²	63.2	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-68.2	-42.2	-179.6	-71.5	157.3	135.1	0	0	111.7	L285 S286 I291 R292 L293	L285-E289 HydrophobicContact CB-CB 4.28Å; L285-E289 HydrophobicContact CD2-CB 4.21Å; S286-E289 WeakPolarHBondContact CB-OE2 3.49Å; S286-E289 PolarHBondContact N-OE2 3.39Å; S286-E289 PolarHBondContact O-N 3.35Å; S286-E289 VanDerWaalsContact O-N 3.14Å; S286-E289 VanDerWaalsContact OG-CD 3.31Å; S286-E289 WeakPolarHBondContact OG-CG 3.48Å; S286-E289 PolarHBondContact OG-N 3.19Å; S286-E289 PolarHBondContact OG-OE2 3.1Å; E289-I291 PolarHBondContact O-N 3Å; E289-R292 PolarHBondContact O-N 3.17Å; E289-L293 WeakPolarHBondContact O-CB 3.23Å; E289-L293 PolarHBondContact O-N 3.01Å
290	V	90.8	Very high	86.7	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-46.1	173.6	169.5	0	0	0	0	110.9	L285 S286 R292 L293 I294 L310 I324 F329 F332	L285-V290 HydrophobicContact CB-CG2 3.62Å; L285-V290 HydrophobicContact CD1-CG2 4.16Å; S286-V290 PolarHBondContact O-N 2.97Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 2.86Å; V290-L293 PolarHBondContact O-N 3.23Å; V290-I294 HydrophobicContact CG1-CD1 3.62Å; V290-I294 HydrophobicContact CG1-CG1 4.3Å; V290-I294 WeakPolarHBondContact O-CB 3.26Å; V290-I294 VanDerWaalsContact O-CG1 3.23Å; V290-I294 WeakPolarHBondContact O-CG1 3.22Å; V290-I294 PolarHBondContact O-N 3.41Å; V290-L310 HydrophobicContact CG1-CD1 4.33Å; V290-I324 HydrophobicContact CB-CD1 3.95Å; V290-I324 HydrophobicContact CG1-CD1 4.2Å; V290-I324 HydrophobicContact CG2-CB 4.09Å; V290-I324 HydrophobicContact CG2-CD1 3.65Å; V290-I324 HydrophobicContact CG2-CG1 4.49Å; V290-I324 HydrophobicContact CG2-CG2 4.21Å; V290-F329 HydrophobicContact CG1-CD2 3.97Å; V290-F329 HydrophobicContact CG1-CE2 4.29Å; V290-F329 HydrophobicContact CG2-CD2 4.18Å; V290-F332 HydrophobicContact CG1-CD1 4.05Å; V290-F332 HydrophobicContact CG1-CE1 4.19Å
291	I	90.5	Very high	86.6	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-36.8	177	-70.6	170.6	0	0	0	111.5	E287 F288 E289 R295 L306 R307 L310	E287-I291 HydrophobicContact CG-CD1 4.05Å; E287-I291 WeakPolarHBondContact O-CB 3.39Å; E287-I291 WeakPolarHBondContact O-CD1 3.48Å; E287-I291 WeakPolarHBondContact O-CG1 3.33Å; E287-I291 PolarHBondContact O-N 2.65Å; E287-I291 VanDerWaalsContact O-N 3.08Å; F288-I291 PolarHBondContact O-N 2.88Å; E289-I291 PolarHBondContact O-N 3Å; I291-R295 WeakPolarHBondContact O-CB 3.33Å; I291-R295 VanDerWaalsContact O-CG 3.28Å; I291-R295 WeakPolarHBondContact O-CG 3.41Å; I291-R295 PolarHBondContact O-N 3.13Å; I291-L306 HydrophobicContact CD1-CB 4.29Å; I291-L306 HydrophobicContact CG1-CB 3.84Å; I291-L306 HydrophobicContact CG2-CD1 4.31Å; I291-R307 HydrophobicContact CD1-CB 4.02Å; I291-R307 HydrophobicContact CD1-CG 3.69Å; I291-L310 HydrophobicContact CD1-CD1 4.09Å; I291-L310 HydrophobicContact CG1-CD1 3.98Å
292	R	91.2	Very high	86.3	Confident	167 Å²	167	51.8 Å²	51.8	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-65.4	-46.9	175.6	-165.2	-178.2	74.8	155.2	1.7	111.3	F288 E289 V290 R295 S296	F288-R292 WeakPolarHBondContact O-CB 3.22Å; F288-R292 PolarHBondContact O-N 3.17Å; E289-R292 PolarHBondContact O-N 3.17Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 2.86Å; R292-R295 PolarHBondContact O-N 3.28Å; R292-S296 PolarHBondContact O-N 2.93Å; R292-S296 PolarHBondContact O-OG 3.42Å
293	L	91.9	Very high	86.1	Confident	18 Å²	18	48.5 Å²	48.5	9%	0.094	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-46.9	-179.5	-178	59.7	0	0	0	112.1	L273 A277 L285 E289 V290 R295 S296 I297 F329	L273-L293 HydrophobicContact CB-CD1 4.36Å; A277-L293 HydrophobicContact CB-CD1 4.3Å; A277-L293 HydrophobicContact CB-CD2 3.82Å; L285-L293 HydrophobicContact CD1-CD2 4.17Å; E289-L293 WeakPolarHBondContact O-CB 3.23Å; E289-L293 PolarHBondContact O-N 3.01Å; V290-L293 PolarHBondContact O-N 3.23Å; L293-R295 VanDerWaalsContact C-N 3.28Å; L293-R295 PolarHBondContact O-N 3.4Å; L293-S296 WeakPolarHBondContact CA-OG 3.46Å; L293-S296 PolarHBondContact O-N 3.04Å; L293-S296 PolarHBondContact O-OG 3.24Å; L293-I297 HydrophobicContact CD1-CD1 4.46Å; L293-I297 HydrophobicContact CG-CD1 4.29Å; L293-I297 WeakPolarHBondContact O-CD1 3.49Å; L293-I297 WeakPolarHBondContact O-CG1 3.13Å; L293-I297 PolarHBondContact O-N 2.66Å; L293-F329 HydrophobicContact CD2-CE1 4.05Å; L293-F329 HydrophobicContact CD2-CE2 3.69Å; L293-F329 HydrophobicContact CD2-CZ 3.43Å; L293-F329 VanDerWaalsContact CD2-CZ 3.43Å; L293-F329 HydrophobicContact CG-CE2 4.21Å; L293-F329 HydrophobicContact CG-CZ 3.95Å
294	I	89.7	Confident	85.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-41.2	176.9	-65.9	171.9	0	0	0	110.7	V290 I297 N298 L301 L306 F329 F332 F333	V290-I294 HydrophobicContact CG1-CD1 3.62Å; V290-I294 HydrophobicContact CG1-CG1 4.3Å; V290-I294 WeakPolarHBondContact O-CB 3.26Å; V290-I294 VanDerWaalsContact O-CG1 3.23Å; V290-I294 WeakPolarHBondContact O-CG1 3.22Å; V290-I294 PolarHBondContact O-N 3.41Å; I294-I297 PolarHBondContact O-N 2.96Å; I294-N298 PolarHBondContact O-N 2.72Å; I294-L301 HydrophobicContact CG2-CD1 3.51Å; I294-L306 HydrophobicContact CB-CD1 4.06Å; I294-L306 HydrophobicContact CD1-CD2 4.14Å; I294-L306 HydrophobicContact CG2-CD1 3.7Å; I294-L306 HydrophobicContact CG2-CD2 3.91Å; I294-L306 HydrophobicContact CG2-CG 4.48Å; I294-F329 HydrophobicContact CD1-CE2 4.42Å; I294-F329 HydrophobicContact CG1-CE2 3.93Å; I294-F332 HydrophobicContact CD1-CD1 3.6Å; I294-F332 HydrophobicContact CD1-CE1 3.4Å; I294-F332 VanDerWaalsContact CD1-CE1 3.4Å; I294-F333 HydrophobicContact CG1-CD2 4.16Å
295	R	88.5	Confident	85.2	Confident	92 Å²	92	48.1 Å²	48.1	35%	0.347	25%	0.247	S	C	.	.	H	α-helix	trans	-78.6	-18.2	-179.5	-65.6	-172.7	78.7	-135.1	-6.1	114.4	I291 R292 L293 N298 P299 L301 L306	I291-R295 WeakPolarHBondContact O-CB 3.33Å; I291-R295 VanDerWaalsContact O-CG 3.28Å; I291-R295 WeakPolarHBondContact O-CG 3.41Å; I291-R295 PolarHBondContact O-N 3.13Å; R292-R295 PolarHBondContact O-N 3.28Å; L293-R295 VanDerWaalsContact C-N 3.28Å; L293-R295 PolarHBondContact O-N 3.4Å; R295-N298 CarbonylContact O-C 3.58Å; R295-P299 WeakPolarHBondContact O-CA 3.32Å; R295-L301 PolarHBondContact NE-O 3.43Å; R295-L306 HydrophobicContact CG-CD1 3.8Å
296	S	87.7	Confident	85	Confident	84 Å²	84	48.1 Å²	48.1	59%	0.587	25%	0.247	S	C	*	.	H	α-helix	trans	-75.6	-30.5	167.1	49.9	0	0	0	0	112.7	R292 L293	R292-S296 PolarHBondContact O-N 2.93Å; R292-S296 PolarHBondContact O-OG 3.42Å; L293-S296 WeakPolarHBondContact CA-OG 3.46Å; L293-S296 PolarHBondContact O-N 3.04Å; L293-S296 PolarHBondContact O-OG 3.24Å
297	I	83.7	Confident	84.8	Confident	25 Å²	25	49.9 Å²	49.9	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-76.9	-50.1	174.9	-59	158.1	0	0	0	110.4	W269 L273 L293 I294 F333	W269-I297 HydrophobicContact CH2-CG2 3.68Å; W269-I297 HydrophobicContact CZ2-CG2 3.86Å; L273-I297 HydrophobicContact CD1-CD1 3.64Å; L273-I297 HydrophobicContact CD1-CG1 3.85Å; L293-I297 HydrophobicContact CD1-CD1 4.46Å; L293-I297 HydrophobicContact CG-CD1 4.29Å; L293-I297 WeakPolarHBondContact O-CD1 3.49Å; L293-I297 WeakPolarHBondContact O-CG1 3.13Å; L293-I297 PolarHBondContact O-N 2.66Å; I294-I297 PolarHBondContact O-N 2.96Å; I297-F333 HydrophobicContact CB-CE2 4.18Å; I297-F333 HydrophobicContact CD1-CD2 4.15Å; I297-F333 HydrophobicContact CD1-CE2 3.7Å; I297-F333 HydrophobicContact CG2-CE2 3.87Å; I297-F333 HydrophobicContact CG2-CZ 3.86Å
298	N	81.4	Confident	84.5	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.08	26%	0.258	C	S	.	.			trans	-129.4	93.1	178.8	-173.1	-9.9	0	0	0	110.9	I294 R295 S300 L301	I294-N298 PolarHBondContact O-N 2.72Å; R295-N298 CarbonylContact O-C 3.58Å; N298-S300 PolarHBondContact O-N 3.26Å; N298-S300 VanDerWaalsContact O-N 3.11Å; N298-S300 WeakPolarHBondContact OD1-CA 3.32Å; N298-S300 WeakPolarHBondContact OD1-CB 3.42Å; N298-S300 PolarHBondContact OD1-N 2.67Å; N298-S300 PolarHBondContact OD1-OG 2.86Å; N298-L301 HydrophobicContact CB-CD1 4.03Å; N298-L301 HydrophobicContact CB-CG 4.2Å; N298-L301 PolarHBondContact O-N 2.81Å
299	P	81.4	Confident	84.1	Confident	76 Å²	76	47.5 Å²	47.5	49%	0.494	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.6	176.7	-26	35.5	0	0	0	114.4	R295 L301 L1052	R295-P299 WeakPolarHBondContact O-CA 3.32Å; P299-L301 PolarHBondContact O-N 3.46Å; P299-L1052 WeakPolarHBondContact O-CD1 3.48Å
300	S	75.8	Confident	83.8	Confident	33 Å²	33	44.7 Å²	44.7	23%	0.231	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	13	177.7	97.1	0	0	0	0	114	N298 Q943	N298-S300 PolarHBondContact O-N 3.26Å; N298-S300 VanDerWaalsContact O-N 3.11Å; N298-S300 WeakPolarHBondContact OD1-CA 3.32Å; N298-S300 WeakPolarHBondContact OD1-CB 3.42Å; N298-S300 PolarHBondContact OD1-N 2.67Å; N298-S300 PolarHBondContact OD1-OG 2.86Å; S300-Q943 PolarHBondContact O-NE2 2.95Å
301	L	80	Confident	83.4	Confident	24 Å²	24	50.1 Å²	50.1	13%	0.126	25%	0.247	C	C	.	.	S	Bend	trans	-100.7	137.1	169.3	-65.5	175.9	0	0	0	111.6	I294 R295 N298 P299 L306 A337 Q943	I294-L301 HydrophobicContact CG2-CD1 3.51Å; R295-L301 PolarHBondContact NE-O 3.43Å; N298-L301 HydrophobicContact CB-CD1 4.03Å; N298-L301 HydrophobicContact CB-CG 4.2Å; N298-L301 PolarHBondContact O-N 2.81Å; P299-L301 PolarHBondContact O-N 3.46Å; L301-L306 HydrophobicContact CB-CD1 4.19Å; L301-A337 HydrophobicContact CD1-CB 4.43Å; L301-Q943 VanDerWaalsContact C-NE2 3.25Å
302	S	77.6	Confident	82.7	Confident	16 Å²	16	51.1 Å²	51.1	11%	0.112	25%	0.252	C	S	.	.			trans	-80.7	128.3	-176.3	174.7	0	0	0	0	110.8	I304 H305 L306 Q943	S302-I304 PolarHBondContact O-N 3.02Å; S302-I304 PolarHBondContact OG-N 3.21Å; S302-H305 PolarHBondContact O-N 3.15Å; S302-H305 PolarHBondContact OG-N 3Å; S302-L306 VanDerWaalsContact O-CG 3.31Å; S302-L306 WeakPolarHBondContact O-CG 3.46Å; S302-L306 PolarHBondContact O-N 3.5Å; S302-Q943 VanDerWaalsContact N-NE2 3.13Å
303	S	80	Confident	81.9	Confident	36 Å²	36	45.1 Å²	45.1	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-28	173	47.7	0	0	0	0	112.7	R307	S303-R307 WeakPolarHBondContact O-CB 3.49Å; S303-R307 PolarHBondContact O-N 3.35Å
304	I	77.8	Confident	80.9	Confident	105 Å²	105	49.4 Å²	49.4	54%	0.538	25%	0.251	S	S	.	.	H	α-helix	trans	-74.4	-45.2	176.2	-52.4	176.1	0	0	0	110.1	S302 L306 R307 H308 Y988	S302-I304 PolarHBondContact O-N 3.02Å; S302-I304 PolarHBondContact OG-N 3.21Å; I304-L306 PolarHBondContact O-N 3.23Å; I304-R307 PolarHBondContact O-N 2.67Å; I304-H308 PolarHBondContact O-N 3.24Å; I304-Y988 WeakPolarHBondContact CG2-OH 3.44Å
305	H	76.9	Confident	79.7	Confident	22 Å²	22	53.4 Å²	53.4	10%	0.102	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-50.3	176.4	-172.9	68.8	0	0	0	111.8	S302 R307 H308 K309 Y988	S302-H305 PolarHBondContact O-N 3.15Å; S302-H305 PolarHBondContact OG-N 3Å; H305-R307 VanDerWaalsContact C-N 3.31Å; H305-R307 PolarHBondContact O-N 2.89Å; H305-H308 PolarHBondContact O-N 3.02Å; H305-H308 VanDerWaalsContact O-N 3.14Å; H305-K309 WeakPolarHBondContact O-CB 3.43Å; H305-K309 PolarHBondContact O-N 3.29Å; H305-Y988 HydrophobicContact CB-CD1 3.6Å; H305-Y988 HydrophobicContact CB-CD2 4.23Å; H305-Y988 HydrophobicContact CB-CE1 3.73Å; H305-Y988 HydrophobicContact CB-CE2 4.34Å; H305-Y988 HydrophobicContact CB-CG 3.84Å; H305-Y988 AromaticContact CE1-CD2 3.95Å; H305-Y988 AromaticContact CG-CD1 4Å; H305-Y988 AromaticContact CG-CD2 3.97Å; H305-Y988 AromaticContact CG-CG 3.7Å; H305-Y988 WeakPolarHBondContact ND1-CB 3.1Å; H305-Y988 AromaticContact ND1-CD1 3.91Å; H305-Y988 AromaticContact ND1-CD2 3.08Å; H305-Y988 WeakPolarHBondContact ND1-CD2 3.42Å; H305-Y988 AromaticContact ND1-CE2 3.69Å; H305-Y988 AromaticContact ND1-CG 3.18Å
306	L	84.6	Confident	78.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-41.9	-179.2	-64.3	170.3	0	0	0	111.2	I291 I294 R295 L301 S302 I304 H308 K309 L310 F332 V336	I291-L306 HydrophobicContact CD1-CB 4.29Å; I291-L306 HydrophobicContact CG1-CB 3.84Å; I291-L306 HydrophobicContact CG2-CD1 4.31Å; I294-L306 HydrophobicContact CB-CD1 4.06Å; I294-L306 HydrophobicContact CD1-CD2 4.14Å; I294-L306 HydrophobicContact CG2-CD1 3.7Å; I294-L306 HydrophobicContact CG2-CD2 3.91Å; I294-L306 HydrophobicContact CG2-CG 4.48Å; R295-L306 HydrophobicContact CG-CD1 3.8Å; L301-L306 HydrophobicContact CB-CD1 4.19Å; S302-L306 VanDerWaalsContact O-CG 3.31Å; S302-L306 WeakPolarHBondContact O-CG 3.46Å; S302-L306 PolarHBondContact O-N 3.5Å; I304-L306 PolarHBondContact O-N 3.23Å; L306-H308 PolarHBondContact O-N 3.24Å; L306-K309 PolarHBondContact O-N 3.14Å; L306-L310 WeakPolarHBondContact O-CB 3.34Å; L306-L310 WeakPolarHBondContact O-CG 3.47Å; L306-L310 PolarHBondContact O-N 3.14Å; L306-F332 HydrophobicContact CD2-CE1 4.27Å; L306-F332 HydrophobicContact CD2-CZ 4.19Å; L306-V336 HydrophobicContact CD2-CB 4.08Å; L306-V336 HydrophobicContact CD2-CG1 4.34Å; L306-V336 HydrophobicContact CD2-CG2 3.7Å
307	R	85.3	Confident	76.7	Confident	83 Å²	83	54.5 Å²	54.5	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-59.9	-44.2	174.1	-126.3	170.2	-72.2	-89.6	12.5	112.8	E287 I291 S303 I304 H305 K311	E287-R307 VanDerWaalsContact CD-CG 3.41Å; E287-R307 HydrophobicContact CG-CG 4.42Å; E287-R307 WeakPolarHBondContact OE1-CD 3.32Å; E287-R307 WeakPolarHBondContact OE1-CG 3.43Å; E287-R307 IonicContact OE1-CZ 2.72Å; E287-R307 IonicContact OE1-NE 3.93Å; E287-R307 IonicContact OE1-NH1 2.73Å; E287-R307 PolarHBondContact OE1-NH1 3.49Å; E287-R307 WeakPolarHBondContact OE2-CG 3.28Å; I291-R307 HydrophobicContact CD1-CB 4.02Å; I291-R307 HydrophobicContact CD1-CG 3.69Å; S303-R307 WeakPolarHBondContact O-CB 3.49Å; S303-R307 PolarHBondContact O-N 3.35Å; I304-R307 PolarHBondContact O-N 2.67Å; H305-R307 VanDerWaalsContact C-N 3.31Å; H305-R307 PolarHBondContact O-N 2.89Å; R307-K311 WeakPolarHBondContact O-CG 3.3Å; R307-K311 PolarHBondContact O-N 3.47Å
308	H	79.8	Confident	74.9	Confident	102 Å²	102	65.7 Å²	65.7	47%	0.472	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-38.4	178.1	-166	-107.1	0	0	0	112	I304 H305 L306 E312	I304-H308 PolarHBondContact O-N 3.24Å; H305-H308 PolarHBondContact O-N 3.02Å; H305-H308 VanDerWaalsContact O-N 3.14Å; L306-H308 PolarHBondContact O-N 3.24Å; H308-E312 PolarHBondContact O-N 2.94Å
309	K	80.9	Confident	73.2	Confident	27 Å²	27	69 Å²	69	12%	0.117	35%	0.346	C	S	.	.	H	α-helix	trans	-79	-27.7	-177.7	-126.7	63.5	173.9	155.9	0	114	H305 L306 E312 M313 F332 V336 S984	H305-K309 WeakPolarHBondContact O-CB 3.43Å; H305-K309 PolarHBondContact O-N 3.29Å; L306-K309 PolarHBondContact O-N 3.14Å; K309-E312 VanDerWaalsContact CE-OE2 3.22Å; K309-E312 WeakPolarHBondContact CE-OE2 3.47Å; K309-E312 IonicContact NZ-OE2 3.17Å; K309-E312 PolarHBondContact NZ-OE2 3.42Å; K309-M313 PolarHBondContact O-N 3.06Å; K309-F332 HydrophobicContact CB-CE2 4Å; K309-F332 HydrophobicContact CB-CZ 4.31Å; K309-V336 HydrophobicContact CB-CG1 4.1Å; K309-V336 HydrophobicContact CG-CG1 4.02Å; K309-S984 PolarHBondContact NZ-O 2.82Å; K309-S984 VanDerWaalsContact NZ-O 3.13Å; K309-S984 PolarHBondContact NZ-OG 3.01Å; K309-S984 VanDerWaalsContact NZ-OG 3.09Å
310	L	84.8	Confident	71.6	Confident	6 Å²	6	70.9 Å²	70.9	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-50.4	165.7	-76.7	175.7	0	0	0	111.1	E287 V290 I291 L306 E312 M313 E314 I324 F332	E287-L310 HydrophobicContact CB-CD1 4.42Å; E287-L310 HydrophobicContact CG-CD1 3.6Å; V290-L310 HydrophobicContact CG1-CD1 4.33Å; I291-L310 HydrophobicContact CD1-CD1 4.09Å; I291-L310 HydrophobicContact CG1-CD1 3.98Å; L306-L310 WeakPolarHBondContact O-CB 3.34Å; L306-L310 WeakPolarHBondContact O-CG 3.47Å; L306-L310 PolarHBondContact O-N 3.14Å; L310-E312 PolarHBondContact O-N 3.25Å; L310-M313 WeakPolarHBondContact O-CA 3.19Å; L310-M313 WeakPolarHBondContact O-CB 3.31Å; L310-M313 PolarHBondContact O-N 2.92Å; L310-E314 PolarHBondContact O-N 3.18Å; L310-I324 HydrophobicContact CD1-CD1 3.93Å; L310-I324 HydrophobicContact CD2-CD1 3.58Å; L310-I324 HydrophobicContact CD2-CG1 4.45Å; L310-I324 HydrophobicContact CG-CD1 4.38Å; L310-F332 HydrophobicContact CD1-CE1 4.26Å; L310-F332 HydrophobicContact CD2-CD1 3.6Å; L310-F332 HydrophobicContact CD2-CD2 4.11Å; L310-F332 HydrophobicContact CD2-CE1 3.39Å; L310-F332 HydrophobicContact CD2-CE2 3.93Å; L310-F332 HydrophobicContact CD2-CG 3.96Å; L310-F332 HydrophobicContact CD2-CZ 3.58Å; L310-F332 HydrophobicContact CG-CD1 4.34Å; L310-F332 HydrophobicContact CG-CE1 3.63Å; L310-F332 HydrophobicContact CG-CE2 4.19Å; L310-F332 HydrophobicContact CG-CZ 3.54Å
311	K	81.2	Confident	70.7	Confident	114 Å²	114	79.8 Å²	79.8	50%	0.496	38%	0.382	S	S	.	.	H	α-helix	trans	-60.4	-32.4	177.8	-71	177.7	-179.1	-176.7	0	113.3	E287 R307 S315	E287-K311 WeakPolarHBondContact OE2-CE 3.42Å; E287-K311 IonicContact OE2-NZ 2.75Å; R307-K311 WeakPolarHBondContact O-CG 3.3Å; R307-K311 PolarHBondContact O-N 3.47Å; K311-S315 WeakPolarHBondContact O-CB 3.44Å; K311-S315 PolarHBondContact O-N 2.53Å
312	E	77.5	Confident	69.9	Low	28 Å²	28	82.3 Å²	82.3	13%	0.131	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-41	170.7	-164.2	-153.9	114.4	0	0	112.1	H308 K309 L310 S315 K316 K335	H308-E312 PolarHBondContact O-N 2.94Å; K309-E312 VanDerWaalsContact CE-OE2 3.22Å; K309-E312 WeakPolarHBondContact CE-OE2 3.47Å; K309-E312 IonicContact NZ-OE2 3.17Å; K309-E312 PolarHBondContact NZ-OE2 3.42Å; L310-E312 PolarHBondContact O-N 3.25Å; E312-S315 PolarHBondContact O-OG 3.4Å; E312-K316 WeakPolarHBondContact O-CG 3.42Å; E312-K316 PolarHBondContact O-N 3.48Å; E312-K316 IonicContact OE1-NZ 3.56Å; E312-K316 PolarHBondContact OE1-NZ 3.32Å; E312-K335 IonicContact OE1-NZ 2.79Å
313	M	73.2	Confident	69.8	Low	41 Å²	41	83 Å²	83	20%	0.202	41%	0.409	C	S	.	.	H	α-helix	trans	-70.4	-44.4	175.9	-85.7	179.2	51.1	0	0	112.7	K309 L310 S315 K316 V317 F332 K335	K309-M313 PolarHBondContact O-N 3.06Å; L310-M313 WeakPolarHBondContact O-CA 3.19Å; L310-M313 WeakPolarHBondContact O-CB 3.31Å; L310-M313 PolarHBondContact O-N 2.92Å; M313-S315 PolarHBondContact O-N 2.97Å; M313-K316 PolarHBondContact O-N 2.89Å; M313-V317 PolarHBondContact O-N 3.47Å; M313-V317 VanDerWaalsContact O-N 3.09Å; M313-F332 HydrophobicContact CE-CB 4.26Å; M313-F332 HydrophobicContact CE-CD2 4.49Å; M313-F332 HydrophobicContact SD-CB 4.32Å; M313-F332 HydrophobicContact SD-CD2 3.61Å; M313-F332 HydrophobicContact SD-CE2 4.42Å; M313-F332 HydrophobicContact SD-CG 4.39Å; M313-K335 HydrophobicContact SD-CD 4.46Å
314	E	70.8	Confident	70.1	Confident	108 Å²	108	82.3 Å²	82.3	51%	0.505	40%	0.402	S	S	.	.	H	α-helix	trans	-54.7	-41.8	172.6	-66.6	175.7	157.1	0	0	111.3	L310 K316 V317	L310-E314 PolarHBondContact O-N 3.18Å; E314-K316 PolarHBondContact O-N 3.15Å; E314-V317 CarbonylContact O-C 3.57Å; E314-V317 PolarHBondContact O-N 3.07Å
315	S	64.3	Low	70.7	Confident	85 Å²	85	79.5 Å²	79.5	59%	0.594	39%	0.39	S	S	*	.	H	α-helix	trans	-64.2	-23.4	177.5	80	0	0	0	0	114.3	K311 E312 M313	K311-S315 WeakPolarHBondContact O-CB 3.44Å; K311-S315 PolarHBondContact O-N 2.53Å; E312-S315 PolarHBondContact O-OG 3.4Å; M313-S315 PolarHBondContact O-N 2.97Å
316	K	58.7	Low	71.3	Confident	120 Å²	120	80.8 Å²	80.8	52%	0.522	40%	0.395	S	S	.	.	H	α-helix	trans	-93.1	-19.5	-179	-70.2	170.8	-179.1	177.2	0	112.1	E72 E312 M313 E314	E72-K316 IonicContact OE2-NZ 2.71Å; E72-K316 PolarHBondContact OE2-NZ 2.84Å; E312-K316 WeakPolarHBondContact O-CG 3.42Å; E312-K316 PolarHBondContact O-N 3.48Å; E312-K316 IonicContact OE1-NZ 3.56Å; E312-K316 PolarHBondContact OE1-NZ 3.32Å; M313-K316 PolarHBondContact O-N 2.89Å; E314-K316 PolarHBondContact O-N 3.15Å
317	V	55.5	Low	71.5	Confident	78 Å²	78	85 Å²	85	47%	0.473	42%	0.418	S	S	.	.			trans	-115	101.6	177.3	-176.3	0	0	0	0	110.3	M313 E314 C319	M313-V317 PolarHBondContact O-N 3.47Å; M313-V317 VanDerWaalsContact O-N 3.09Å; E314-V317 CarbonylContact O-C 3.57Å; E314-V317 PolarHBondContact O-N 3.07Å; V317-C319 HydrophobicContact CG1-CB 4.5Å; V317-C319 PolarHBondContact O-N 2.91Å
318	R	46.5	Very low	71.7	Confident	261 Å²	261	83.9 Å²	83.9	99%	0.985	42%	0.418	S	S	*	.			trans	-72.4	22.7	-177.6	-60.9	-172	-176	179.5	2.4	115.1
319	C	44.4	Very low	72.3	Confident	84 Å²	84	79 Å²	79	57%	0.568	40%	0.395	S	S	*	.			trans	-135	160.7	-178.3	-156.3	0	0	0	0	110.2	V317	V317-C319 HydrophobicContact CG1-CB 4.5Å; V317-C319 PolarHBondContact O-N 2.91Å
320	H	48.2	Very low	72.8	Confident	116 Å²	116	77.9 Å²	77.9	54%	0.537	39%	0.391	S	S	.	.			trans	70.6	88.9	-177.7	-45.8	114	0	0	0	115.1	T322	H320-T322 PolarHBondContact O-N 2.98Å
321	K	55.7	Low	73	Confident	220 Å²	220	82.2 Å²	82.2	96%	0.957	41%	0.414	S	S	*	.	S	Bend	trans	-76.1	18.4	155.5	-79	-172.1	170.6	-174.7	0	112.3
322	T	63.5	Low	73.3	Confident	76 Å²	76	76.8 Å²	76.8	47%	0.466	39%	0.39	S	S	.	.	S	Bend	trans	-129.3	27.9	-153.8	52.1	0	0	0	0	113.1	Y284 H320	Y284-T322 VanDerWaalsContact CD2-O 3.26Å; Y284-T322 WeakPolarHBondContact CD2-O 3.43Å; H320-T322 PolarHBondContact O-N 2.98Å
323	G	76.8	Confident	74	Confident	32 Å²	32	75.5 Å²	75.5	33%	0.33	38%	0.384	S	S	.	.			trans	86.4	178.1	178	0	0	0	0	0	114.7	L285	L285-G323 WeakPolarHBondContact O-CA 3.14Å
324	I	86.4	Confident	74.7	Confident	20 Å²	20	74.2 Å²	74.2	10%	0.103	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122.2	-172.7	-62.5	156.5	0	0	0	108.2	Y284 L285 V290 L310 D328 F329	Y284-I324 CarbonylContact C-O 3.53Å; Y284-I324 VanDerWaalsContact CA-O 3.27Å; Y284-I324 WeakPolarHBondContact CA-O 3.22Å; L285-I324 PolarHBondContact N-O 3.12Å; L285-I324 PolarHBondContact O-N 2.96Å; V290-I324 HydrophobicContact CB-CD1 3.95Å; V290-I324 HydrophobicContact CG1-CD1 4.2Å; V290-I324 HydrophobicContact CG2-CB 4.09Å; V290-I324 HydrophobicContact CG2-CD1 3.65Å; V290-I324 HydrophobicContact CG2-CG1 4.49Å; V290-I324 HydrophobicContact CG2-CG2 4.21Å; L310-I324 HydrophobicContact CD1-CD1 3.93Å; L310-I324 HydrophobicContact CD2-CD1 3.58Å; L310-I324 HydrophobicContact CD2-CG1 4.45Å; L310-I324 HydrophobicContact CG-CD1 4.38Å; I324-D328 HydrophobicContact CG2-CB 3.82Å; I324-F329 HydrophobicContact CG2-CB 4.28Å
325	T	89.7	Confident	75.5	Confident	46 Å²	46	72.9 Å²	72.9	28%	0.282	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	168	-178.3	75.4	0	0	0	0	112.4	D327 D328 F329	T325-D327 VanDerWaalsContact C-N 3.35Å; T325-D327 PolarHBondContact O-N 3.06Å; T325-D328 WeakPolarHBondContact CB-OD2 3.43Å; T325-D328 WeakPolarHBondContact CG2-OD2 3.29Å; T325-D328 PolarHBondContact O-N 2.84Å; T325-D328 VanDerWaalsContact OG1-CG 3.23Å; T325-D328 PolarHBondContact OG1-N 3.4Å; T325-D328 PolarHBondContact OG1-OD2 2.76Å; T325-F329 WeakPolarHBondContact O-CB 3.23Å; T325-F329 PolarHBondContact O-N 3.45Å
326	K	90	Very high	76.5	Confident	49 Å²	49	69.8 Å²	69.8	21%	0.213	35%	0.348	C	S	.	.	H	α-helix	trans	-51.2	-48.5	174.6	-178.3	176.1	174.7	178.6	0	113.3	Q271 F274 H275 F329 V330	Q271-K326 HydrophobicContact CG-CD 4.4Å; Q271-K326 HydrophobicContact CG-CG 4.23Å; Q271-K326 VanDerWaalsContact OE1-NZ 3.11Å; F274-K326 HydrophobicContact CD1-CB 3.83Å; F274-K326 HydrophobicContact CD1-CG 3.96Å; F274-K326 HydrophobicContact CE1-CB 3.74Å; F274-K326 HydrophobicContact CE1-CG 4.38Å; F274-K326 HydrophobicContact CG-CB 4.29Å; F274-K326 HydrophobicContact CG-CG 4.25Å; F274-K326 HydrophobicContact CZ-CB 4.1Å; F274-K326 VanDerWaalsContact CZ-N 3.31Å; H275-K326 PolarHBondContact NE2-NZ 2.9Å; K326-F329 PolarHBondContact O-N 2.83Å; K326-V330 WeakPolarHBondContact O-CG2 3.48Å; K326-V330 PolarHBondContact O-N 2.91Å; K326-V330 VanDerWaalsContact O-N 3.15Å
327	D	89.1	Confident	77.9	Confident	90 Å²	90	64.3 Å²	64.3	48%	0.481	33%	0.325	S	S	.	.	H	α-helix	trans	-79.8	-31.5	-177.2	-60.9	-51.9	0	0	0	112.1	T325 F329 V330 N331	T325-D327 VanDerWaalsContact C-N 3.35Å; T325-D327 PolarHBondContact O-N 3.06Å; D327-F329 VanDerWaalsContact C-N 3.3Å; D327-F329 PolarHBondContact O-N 2.68Å; D327-V330 PolarHBondContact O-N 3.27Å; D327-N331 WeakPolarHBondContact O-CB 3.36Å; D327-N331 PolarHBondContact O-N 3.3Å; D327-N331 PolarHBondContact O-ND2 3.34Å
328	D	88.7	Confident	79.5	Confident	58 Å²	58	60.7 Å²	60.7	31%	0.31	30%	0.303	S	S	.	.	H	α-helix	trans	-61.5	-39.8	168.7	-68.4	-54.4	0	0	0	111.2	I324 T325 F332	I324-D328 HydrophobicContact CG2-CB 3.82Å; T325-D328 WeakPolarHBondContact CB-OD2 3.43Å; T325-D328 WeakPolarHBondContact CG2-OD2 3.29Å; T325-D328 PolarHBondContact O-N 2.84Å; T325-D328 VanDerWaalsContact OG1-CG 3.23Å; T325-D328 PolarHBondContact OG1-N 3.4Å; T325-D328 PolarHBondContact OG1-OD2 2.76Å; D328-F332 WeakPolarHBondContact O-CB 3.35Å; D328-F332 PolarHBondContact O-N 2.99Å
329	F	92.1	Very high	81.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.8	-47.3	175.9	170.3	-99.6	0	0	0	112.4	L270 F274 V290 L293 I294 I324 T325 K326 D327 N331 F332 F333	L270-F329 HydrophobicContact CB-CE1 4.32Å; L270-F329 HydrophobicContact CD2-CE1 4.35Å; F274-F329 HydrophobicContact CB-CD1 4.01Å; F274-F329 HydrophobicContact CB-CE1 4.37Å; F274-F329 HydrophobicContact CD2-CB 3.55Å; F274-F329 AromaticContact CD2-CD1 3.78Å; F274-F329 HydrophobicContact CD2-CD1 3.78Å; F274-F329 HydrophobicContact CD2-CD2 4.47Å; F274-F329 AromaticContact CD2-CG 3.67Å; F274-F329 HydrophobicContact CD2-CG 3.67Å; F274-F329 HydrophobicContact CE2-CB 3.81Å; F274-F329 HydrophobicContact CE2-CG 4.34Å; F274-F329 HydrophobicContact CG-CD1 4.36Å; V290-F329 HydrophobicContact CG1-CD2 3.97Å; V290-F329 HydrophobicContact CG1-CE2 4.29Å; V290-F329 HydrophobicContact CG2-CD2 4.18Å; L293-F329 HydrophobicContact CD2-CE1 4.05Å; L293-F329 HydrophobicContact CD2-CE2 3.69Å; L293-F329 HydrophobicContact CD2-CZ 3.43Å; L293-F329 VanDerWaalsContact CD2-CZ 3.43Å; L293-F329 HydrophobicContact CG-CE2 4.21Å; L293-F329 HydrophobicContact CG-CZ 3.95Å; I294-F329 HydrophobicContact CD1-CE2 4.42Å; I294-F329 HydrophobicContact CG1-CE2 3.93Å; I324-F329 HydrophobicContact CG2-CB 4.28Å; T325-F329 WeakPolarHBondContact O-CB 3.23Å; T325-F329 PolarHBondContact O-N 3.45Å; K326-F329 PolarHBondContact O-N 2.83Å; D327-F329 VanDerWaalsContact C-N 3.3Å; D327-F329 PolarHBondContact O-N 2.68Å; F329-N331 PolarHBondContact O-N 3.48Å; F329-F332 PolarHBondContact O-N 2.98Å; F329-F333 HydrophobicContact CZ-CD2 4.48Å; F329-F333 WeakPolarHBondContact O-CB 3.47Å; F329-F333 PolarHBondContact O-N 3.3Å
330	V	91	Very high	83.6	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.024	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-48	177.7	173.6	0	0	0	0	110.4	D267 L270 Q271 K326 D327 F333 K334	D267-V330 HydrophobicContact CB-CG1 4.42Å; L270-V330 HydrophobicContact CB-CG2 3.97Å; L270-V330 HydrophobicContact CD1-CG1 4.26Å; Q271-V330 HydrophobicContact CG-CG2 3.82Å; K326-V330 WeakPolarHBondContact O-CG2 3.48Å; K326-V330 PolarHBondContact O-N 2.91Å; K326-V330 VanDerWaalsContact O-N 3.15Å; D327-V330 PolarHBondContact O-N 3.27Å; V330-F333 PolarHBondContact O-N 3.21Å; V330-K334 WeakPolarHBondContact O-CG 3.39Å; V330-K334 PolarHBondContact O-N 2.85Å
331	N	88.9	Confident	85.5	Confident	96 Å²	96	41.3 Å²	41.3	51%	0.513	21%	0.214	S	C	.	.	H	α-helix	trans	-66.5	-38.6	179	-74	-59.8	0	0	0	112.5	D327 F329 K335	D327-N331 WeakPolarHBondContact O-CB 3.36Å; D327-N331 PolarHBondContact O-N 3.3Å; D327-N331 PolarHBondContact O-ND2 3.34Å; F329-N331 PolarHBondContact O-N 3.48Å; N331-K335 WeakPolarHBondContact O-CB 3.22Å; N331-K335 PolarHBondContact O-N 2.89Å; N331-K335 VanDerWaalsContact O-N 3.1Å
332	F	88.9	Confident	87.3	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-51.2	174.8	-178.5	-120.8	0	0	0	111.3	V290 I294 L306 K309 L310 M313 D328 F329 K334 K335 V336	V290-F332 HydrophobicContact CG1-CD1 4.05Å; V290-F332 HydrophobicContact CG1-CE1 4.19Å; I294-F332 HydrophobicContact CD1-CD1 3.6Å; I294-F332 HydrophobicContact CD1-CE1 3.4Å; I294-F332 VanDerWaalsContact CD1-CE1 3.4Å; L306-F332 HydrophobicContact CD2-CE1 4.27Å; L306-F332 HydrophobicContact CD2-CZ 4.19Å; K309-F332 HydrophobicContact CB-CE2 4Å; K309-F332 HydrophobicContact CB-CZ 4.31Å; L310-F332 HydrophobicContact CD1-CE1 4.26Å; L310-F332 HydrophobicContact CD2-CD1 3.6Å; L310-F332 HydrophobicContact CD2-CD2 4.11Å; L310-F332 HydrophobicContact CD2-CE1 3.39Å; L310-F332 HydrophobicContact CD2-CE2 3.93Å; L310-F332 HydrophobicContact CD2-CG 3.96Å; L310-F332 HydrophobicContact CD2-CZ 3.58Å; L310-F332 HydrophobicContact CG-CD1 4.34Å; L310-F332 HydrophobicContact CG-CE1 3.63Å; L310-F332 HydrophobicContact CG-CE2 4.19Å; L310-F332 HydrophobicContact CG-CZ 3.54Å; M313-F332 HydrophobicContact CE-CB 4.26Å; M313-F332 HydrophobicContact CE-CD2 4.49Å; M313-F332 HydrophobicContact SD-CB 4.32Å; M313-F332 HydrophobicContact SD-CD2 3.61Å; M313-F332 HydrophobicContact SD-CE2 4.42Å; M313-F332 HydrophobicContact SD-CG 4.39Å; D328-F332 WeakPolarHBondContact O-CB 3.35Å; D328-F332 PolarHBondContact O-N 2.99Å; F329-F332 PolarHBondContact O-N 2.98Å; F332-K334 PolarHBondContact O-N 3.29Å; F332-K335 WeakPolarHBondContact O-CA 3.38Å; F332-K335 WeakPolarHBondContact O-CB 3.17Å; F332-K335 PolarHBondContact O-N 2.9Å; F332-V336 HydrophobicContact CD1-CG2 4.33Å; F332-V336 HydrophobicContact CD2-CG2 4.38Å; F332-V336 HydrophobicContact CE1-CG2 4.05Å; F332-V336 HydrophobicContact CE2-CG1 3.86Å; F332-V336 HydrophobicContact CE2-CG2 4.12Å; F332-V336 HydrophobicContact CG-CG2 4.48Å; F332-V336 HydrophobicContact CZ-CG1 4.08Å; F332-V336 HydrophobicContact CZ-CG2 3.93Å; F332-V336 VanDerWaalsContact O-CG2 3.22Å; F332-V336 WeakPolarHBondContact O-CG2 3.39Å; F332-V336 PolarHBondContact O-N 3.09Å
333	F	90.7	Very high	88.6	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-54.6	-50.9	177.5	-178.3	-82.1	0	0	0	110.9	W269 L270 I294 I297 F329 V330 K335 V336 A337 D401	W269-F333 HydrophobicContact CH2-CZ 4.23Å; W269-F333 HydrophobicContact CZ3-CE1 4.35Å; W269-F333 HydrophobicContact CZ3-CZ 4.49Å; L270-F333 HydrophobicContact CD1-CB 4.32Å; L270-F333 HydrophobicContact CD1-CD1 3.56Å; L270-F333 HydrophobicContact CD1-CE1 4.21Å; L270-F333 HydrophobicContact CD1-CG 4.12Å; L270-F333 HydrophobicContact CD2-CB 4.27Å; L270-F333 HydrophobicContact CD2-CD1 3.49Å; L270-F333 VanDerWaalsContact CD2-CD1 3.49Å; L270-F333 HydrophobicContact CD2-CD2 3.91Å; L270-F333 HydrophobicContact CD2-CE1 3.74Å; L270-F333 HydrophobicContact CD2-CE2 4.15Å; L270-F333 HydrophobicContact CD2-CG 3.6Å; L270-F333 HydrophobicContact CD2-CZ 4.08Å; L270-F333 HydrophobicContact CG-CD1 4.17Å; I294-F333 HydrophobicContact CG1-CD2 4.16Å; I297-F333 HydrophobicContact CB-CE2 4.18Å; I297-F333 HydrophobicContact CD1-CD2 4.15Å; I297-F333 HydrophobicContact CD1-CE2 3.7Å; I297-F333 HydrophobicContact CG2-CE2 3.87Å; I297-F333 HydrophobicContact CG2-CZ 3.86Å; F329-F333 HydrophobicContact CZ-CD2 4.48Å; F329-F333 WeakPolarHBondContact O-CB 3.47Å; F329-F333 PolarHBondContact O-N 3.3Å; V330-F333 PolarHBondContact O-N 3.21Å; F333-K335 PolarHBondContact O-N 2.97Å; F333-V336 PolarHBondContact O-N 2.91Å; F333-A337 HydrophobicContact CD1-CB 3.97Å; F333-A337 HydrophobicContact CD2-CB 4.48Å; F333-A337 HydrophobicContact CE1-CB 3.58Å; F333-A337 HydrophobicContact CE2-CB 4.13Å; F333-A337 HydrophobicContact CG-CB 4.4Å; F333-A337 HydrophobicContact CZ-CB 3.66Å; F333-A337 WeakPolarHBondContact O-CB 3.11Å; F333-A337 PolarHBondContact O-N 3.25Å; F333-D401 WeakPolarHBondContact CE1-OD1 3.46Å
334	K	89.9	Confident	89.3	Confident	14 Å²	14	26.5 Å²	26.5	6%	0.061	13%	0.134	C	C	.	.	H	α-helix	trans	-50.5	-46.9	175	-76.4	-177.4	-177.9	-176.3	0	111.1	L78 D267 V330 F332 T338	L78-K334 HydrophobicContact CD1-CB 4.43Å; D267-K334 WeakPolarHBondContact OD1-CE 3.24Å; D267-K334 IonicContact OD1-NZ 3.11Å; D267-K334 PolarHBondContact OD1-NZ 2.72Å; D267-K334 IonicContact OD2-NZ 3.65Å; D267-K334 PolarHBondContact OD2-NZ 3.42Å; V330-K334 WeakPolarHBondContact O-CG 3.39Å; V330-K334 PolarHBondContact O-N 2.85Å; F332-K334 PolarHBondContact O-N 3.29Å; K334-T338 WeakPolarHBondContact O-CB 3.33Å; K334-T338 PolarHBondContact O-N 2.98Å; K334-T338 VanDerWaalsContact O-N 3.17Å; K334-T338 PolarHBondContact O-OG1 2.74Å
335	K	85.8	Confident	89.6	Confident	79 Å²	79	26 Å²	26	34%	0.343	13%	0.132	S	C	.	.	H	α-helix	trans	-71.2	-30.3	-175.3	-172.2	-178.9	174.7	-167.6	0	115.1	L78 E312 M313 N331 F332 F333	L78-K335 HydrophobicContact CD1-CB 4.45Å; E312-K335 IonicContact OE1-NZ 2.79Å; M313-K335 HydrophobicContact SD-CD 4.46Å; N331-K335 WeakPolarHBondContact O-CB 3.22Å; N331-K335 PolarHBondContact O-N 2.89Å; N331-K335 VanDerWaalsContact O-N 3.1Å; F332-K335 WeakPolarHBondContact O-CA 3.38Å; F332-K335 WeakPolarHBondContact O-CB 3.17Å; F332-K335 PolarHBondContact O-N 2.9Å; F333-K335 PolarHBondContact O-N 2.97Å
336	V	85.7	Confident	89.7	Confident	21 Å²	21	23.9 Å²	23.9	13%	0.127	12%	0.118	C	C	.	.	H	α-helix	trans	-100.6	-22	177.2	-78.3	0	0	0	0	115	L306 K309 F332 F333	L306-V336 HydrophobicContact CD2-CB 4.08Å; L306-V336 HydrophobicContact CD2-CG1 4.34Å; L306-V336 HydrophobicContact CD2-CG2 3.7Å; K309-V336 HydrophobicContact CB-CG1 4.1Å; K309-V336 HydrophobicContact CG-CG1 4.02Å; F332-V336 HydrophobicContact CD1-CG2 4.33Å; F332-V336 HydrophobicContact CD2-CG2 4.38Å; F332-V336 HydrophobicContact CE1-CG2 4.05Å; F332-V336 HydrophobicContact CE2-CG1 3.86Å; F332-V336 HydrophobicContact CE2-CG2 4.12Å; F332-V336 HydrophobicContact CG-CG2 4.48Å; F332-V336 HydrophobicContact CZ-CG1 4.08Å; F332-V336 HydrophobicContact CZ-CG2 3.93Å; F332-V336 VanDerWaalsContact O-CG2 3.22Å; F332-V336 WeakPolarHBondContact O-CG2 3.39Å; F332-V336 PolarHBondContact O-N 3.09Å; F333-V336 PolarHBondContact O-N 2.91Å
337	A	87.6	Confident	89.8	Confident	4 Å²	4	21.5 Å²	21.5	3%	0.033	11%	0.108	C	C	.	.	H	α-helix	trans	-92.4	-31.5	179.8	0	0	0	0	0	113.6	L301 F333 R339	L301-A337 HydrophobicContact CD1-CB 4.43Å; F333-A337 HydrophobicContact CD1-CB 3.97Å; F333-A337 HydrophobicContact CD2-CB 4.48Å; F333-A337 HydrophobicContact CE1-CB 3.58Å; F333-A337 HydrophobicContact CE2-CB 4.13Å; F333-A337 HydrophobicContact CG-CB 4.4Å; F333-A337 HydrophobicContact CZ-CB 3.66Å; F333-A337 WeakPolarHBondContact O-CB 3.11Å; F333-A337 PolarHBondContact O-N 3.25Å; A337-R339 PolarHBondContact O-N 3.11Å; A337-R339 VanDerWaalsContact O-N 3.17Å
338	T	89	Confident	89.7	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.018	10%	0.101	C	C	.	.			trans	-79	103	-174.6	-45.8	0	0	0	0	111.1	H76 L78 R266 K334 Q340 I400	H76-T338 PolarHBondContact CE1-O 3.29Å; L78-T338 HydrophobicContact CD2-CG2 4.44Å; R266-T338 PolarHBondContact NH1-OG1 3.18Å; R266-T338 PolarHBondContact NH2-OG1 3.01Å; K334-T338 WeakPolarHBondContact O-CB 3.33Å; K334-T338 PolarHBondContact O-N 2.98Å; K334-T338 VanDerWaalsContact O-N 3.17Å; K334-T338 PolarHBondContact O-OG1 2.74Å; T338-Q340 PolarHBondContact O-N 2.81Å; T338-I400 HydrophobicContact CG2-CG1 4.08Å
339	R	88	Confident	89.8	Confident	25 Å²	25	20.1 Å²	20.1	9%	0.094	9%	0.092	C	C	.	.			trans	-78.6	112.8	172.5	-77.5	174.5	60.4	-167.7	-8.1	110.2	A337 E341 I342 Y343 S940 Q942 H1039	A337-R339 PolarHBondContact O-N 3.11Å; A337-R339 VanDerWaalsContact O-N 3.17Å; R339-E341 VanDerWaalsContact C-N 3.26Å; R339-E341 WeakPolarHBondContact CB-OE2 3.49Å; R339-E341 IonicContact CZ-OE1 2.76Å; R339-E341 VanDerWaalsContact CZ-OE1 3.23Å; R339-E341 IonicContact NE-OE1 2.72Å; R339-E341 PolarHBondContact NE-OE1 3.19Å; R339-E341 IonicContact NH2-OE1 3.43Å; R339-E341 PolarHBondContact NH2-OE1 3.36Å; R339-E341 PolarHBondContact O-N 2.99Å; R339-I342 HydrophobicContact CB-CB 4.17Å; R339-I342 HydrophobicContact CB-CD1 4.08Å; R339-I342 HydrophobicContact CB-CG1 4.03Å; R339-I342 VanDerWaalsContact CZ-CD1 3.5Å; R339-I342 PolarHBondContact O-N 3.34Å; R339-Y343 PolarHBondContact O-N 3.02Å; R339-S940 PolarHBondContact NH2-OG 3.04Å; R339-Q942 VanDerWaalsContact NH2-NE2 3.17Å; R339-H1039 PolarHBondContact NH1-NE2 3.02Å
340	Q	89.4	Confident	89.6	Confident	17 Å²	17	20.3 Å²	20.3	8%	0.079	9%	0.093	C	C	.	.	H	α-helix	trans	-59.3	-34.8	-174.2	65.1	174.3	20	0	0	113.1	E237 T338 I342 Y343 Y344	E237-Q340 PolarHBondContact OE1-NE2 3.46Å; T338-Q340 PolarHBondContact O-N 2.81Å; Q340-I342 VanDerWaalsContact C-N 3.31Å; Q340-I342 PolarHBondContact O-N 2.98Å; Q340-Y343 PolarHBondContact O-N 3.12Å; Q340-Y344 HydrophobicContact CB-CE2 4.22Å; Q340-Y344 HydrophobicContact CG-CE2 4.28Å; Q340-Y344 WeakPolarHBondContact O-CD2 3.37Å; Q340-Y344 PolarHBondContact O-N 3.26Å
341	E	88.4	Confident	89.1	Confident	11 Å²	11	24.6 Å²	24.6	5%	0.051	12%	0.124	C	C	.	.	H	α-helix	trans	-67.7	-30.8	176.9	76.4	-80.4	-161.7	0	0	112.8	R339 I345 V939 S940 F1056	R339-E341 VanDerWaalsContact C-N 3.26Å; R339-E341 WeakPolarHBondContact CB-OE2 3.49Å; R339-E341 IonicContact CZ-OE1 2.76Å; R339-E341 VanDerWaalsContact CZ-OE1 3.23Å; R339-E341 IonicContact NE-OE1 2.72Å; R339-E341 PolarHBondContact NE-OE1 3.19Å; R339-E341 IonicContact NH2-OE1 3.43Å; R339-E341 PolarHBondContact NH2-OE1 3.36Å; R339-E341 PolarHBondContact O-N 2.99Å; E341-I345 VanDerWaalsContact O-CD1 3.3Å; E341-I345 WeakPolarHBondContact O-CD1 3.31Å; E341-I345 VanDerWaalsContact O-CG1 3.27Å; E341-I345 WeakPolarHBondContact O-CG1 3.4Å; E341-I345 PolarHBondContact O-N 3Å; E341-V939 HydrophobicContact CB-CG1 3.91Å; E341-V939 HydrophobicContact CG-CG1 3.76Å; E341-S940 WeakPolarHBondContact OE1-CB 3.42Å; E341-S940 PolarHBondContact OE1-OG 3.24Å; E341-F1056 HydrophobicContact CG-CD1 4.01Å; E341-F1056 HydrophobicContact CG-CE1 4.09Å
342	I	93	Very high	88.3	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-76.6	-37.5	173.3	-62.7	-176.1	0	0	0	110.1	R339 Q340 Y344 I345 L346 I400 F403 T404 L407 F1056	R339-I342 HydrophobicContact CB-CB 4.17Å; R339-I342 HydrophobicContact CB-CD1 4.08Å; R339-I342 HydrophobicContact CB-CG1 4.03Å; R339-I342 VanDerWaalsContact CZ-CD1 3.5Å; R339-I342 PolarHBondContact O-N 3.34Å; Q340-I342 VanDerWaalsContact C-N 3.31Å; Q340-I342 PolarHBondContact O-N 2.98Å; I342-Y344 PolarHBondContact O-N 3.45Å; I342-I345 PolarHBondContact O-N 2.98Å; I342-I345 VanDerWaalsContact O-N 3.15Å; I342-L346 PolarHBondContact O-N 2.84Å; I342-I400 HydrophobicContact CB-CD1 4.24Å; I342-I400 HydrophobicContact CG2-CD1 3.64Å; I342-F403 HydrophobicContact CG2-CD1 3.52Å; I342-F403 HydrophobicContact CG2-CE1 3.86Å; I342-T404 HydrophobicContact CD1-CG2 4.01Å; I342-L407 HydrophobicContact CB-CD1 4.41Å; I342-L407 HydrophobicContact CD1-CD1 3.91Å; I342-L407 HydrophobicContact CG1-CD1 3.99Å; I342-L407 HydrophobicContact CG2-CD1 3.65Å; I342-F1056 HydrophobicContact CG1-CE1 4.2Å; I342-F1056 HydrophobicContact CG1-CZ 4.39Å
343	Y	92.3	Very high	87.9	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-44.4	176.4	176.2	-106.8	0	0	0	112.2	I77 N79 A80 T244 R339 Q340 I345 L346 V347 E354	I77-Y343 HydrophobicContact CG2-CD1 3.9Å; I77-Y343 HydrophobicContact CG2-CE1 3.81Å; N79-Y343 VanDerWaalsContact C-OH 3.27Å; A80-Y343 WeakPolarHBondContact CA-OH 3.47Å; A80-Y343 PolarHBondContact N-OH 3.42Å; T244-Y343 HydrophobicContact CG2-CD1 4.44Å; T244-Y343 HydrophobicContact CG2-CE1 3.76Å; R339-Y343 PolarHBondContact O-N 3.02Å; Q340-Y343 PolarHBondContact O-N 3.12Å; Y343-I345 VanDerWaalsContact C-N 3.28Å; Y343-I345 PolarHBondContact O-N 3.06Å; Y343-L346 PolarHBondContact O-N 3.27Å; Y343-V347 HydrophobicContact CD2-CG2 4.22Å; Y343-V347 HydrophobicContact CE1-CG2 4.19Å; Y343-V347 HydrophobicContact CE2-CG2 3.6Å; Y343-V347 PolarHBondContact O-N 2.94Å; Y343-E354 HydrophobicContact CE2-CG 4.46Å; Y343-E354 PolarHBondContact OH-OE1 2.59Å
344	Y	90.9	Very high	87.7	Confident	13 Å²	13	22.5 Å²	22.5	5%	0.051	12%	0.115	C	C	.	.	H	α-helix	trans	-60.8	-35.5	173.9	-55.6	-37.6	0	0	0	112.7	I77 N240 I241 T244 Q340 I342 R348	I77-Y344 HydrophobicContact CB-CE1 4.18Å; I77-Y344 HydrophobicContact CG1-CE1 4.29Å; I77-Y344 VanDerWaalsContact CG1-OH 3.27Å; I77-Y344 WeakPolarHBondContact CG1-OH 3.48Å; I77-Y344 HydrophobicContact CG2-CE1 4.11Å; N240-Y344 HydrophobicContact CB-CD1 4.27Å; N240-Y344 HydrophobicContact CB-CD2 3.57Å; N240-Y344 HydrophobicContact CB-CE2 3.88Å; N240-Y344 HydrophobicContact CB-CG 3.8Å; I241-Y344 HydrophobicContact CG1-CE1 4.26Å; I241-Y344 WeakPolarHBondContact CG1-OH 3.34Å; T244-Y344 HydrophobicContact CG2-CD1 4.16Å; T244-Y344 VanDerWaalsContact OG1-CD1 3.31Å; T244-Y344 WeakPolarHBondContact OG1-CD1 3.43Å; Q340-Y344 HydrophobicContact CB-CE2 4.22Å; Q340-Y344 HydrophobicContact CG-CE2 4.28Å; Q340-Y344 WeakPolarHBondContact O-CD2 3.37Å; Q340-Y344 PolarHBondContact O-N 3.26Å; I342-Y344 PolarHBondContact O-N 3.45Å; Y344-R348 WeakPolarHBondContact O-CB 3.43Å; Y344-R348 PolarHBondContact O-N 3.09Å; Y344-R348 VanDerWaalsContact O-N 3.14Å
345	I	91.8	Very high	87.7	Confident	11 Å²	11	22.9 Å²	22.9	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-69.4	-46.3	174.5	-63.8	162.2	0	0	0	110.4	E341 I342 Y343 V347 R348 Y349 F364 F403 F1037 F1056	E341-I345 VanDerWaalsContact O-CD1 3.3Å; E341-I345 WeakPolarHBondContact O-CD1 3.31Å; E341-I345 VanDerWaalsContact O-CG1 3.27Å; E341-I345 WeakPolarHBondContact O-CG1 3.4Å; E341-I345 PolarHBondContact O-N 3Å; I342-I345 PolarHBondContact O-N 2.98Å; I342-I345 VanDerWaalsContact O-N 3.15Å; Y343-I345 VanDerWaalsContact C-N 3.28Å; Y343-I345 PolarHBondContact O-N 3.06Å; I345-V347 PolarHBondContact O-N 3.15Å; I345-R348 WeakPolarHBondContact O-CB 3.42Å; I345-R348 PolarHBondContact O-N 3.01Å; I345-R348 VanDerWaalsContact O-N 3.14Å; I345-Y349 HydrophobicContact CG2-CD2 4.07Å; I345-Y349 HydrophobicContact CG2-CE2 4.17Å; I345-Y349 VanDerWaalsContact O-CD2 3.3Å; I345-Y349 WeakPolarHBondContact O-CD2 3.4Å; I345-Y349 PolarHBondContact O-N 2.75Å; I345-F364 HydrophobicContact CG2-CE2 3.96Å; I345-F403 HydrophobicContact CB-CE1 4.24Å; I345-F403 HydrophobicContact CG2-CE1 3.85Å; I345-F403 HydrophobicContact CG2-CZ 3.83Å; I345-F1037 HydrophobicContact CD1-CD1 3.55Å; I345-F1037 HydrophobicContact CD1-CD2 4.11Å; I345-F1037 HydrophobicContact CD1-CE1 3.4Å; I345-F1037 HydrophobicContact CD1-CE2 3.98Å; I345-F1037 HydrophobicContact CD1-CG 3.91Å; I345-F1037 HydrophobicContact CD1-CZ 3.63Å; I345-F1037 HydrophobicContact CG1-CE1 4.07Å; I345-F1037 HydrophobicContact CG1-CE2 4.02Å; I345-F1037 HydrophobicContact CG1-CZ 3.77Å; I345-F1037 HydrophobicContact CG2-CD2 4.2Å; I345-F1037 HydrophobicContact CG2-CE2 4.12Å; I345-F1056 HydrophobicContact CD1-CE1 3.74Å; I345-F1056 HydrophobicContact CD1-CZ 3.73Å
346	L	93.7	Very high	88.1	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-55.8	-52.7	179.1	-177.5	147.6	0	0	0	111	I342 Y343 R348 Y349 S350 L356 I400 F403	I342-L346 PolarHBondContact O-N 2.84Å; Y343-L346 PolarHBondContact O-N 3.27Å; L346-R348 PolarHBondContact O-N 3.43Å; L346-Y349 PolarHBondContact O-N 3.46Å; L346-S350 WeakPolarHBondContact O-CB 3.49Å; L346-S350 PolarHBondContact O-N 3.08Å; L346-L356 HydrophobicContact CG-CD1 4.44Å; L346-L356 HydrophobicContact CG-CG 4.13Å; L346-I400 HydrophobicContact CB-CD1 4.32Å; L346-I400 HydrophobicContact CD1-CB 4.13Å; L346-I400 HydrophobicContact CD1-CD1 4.09Å; L346-F403 HydrophobicContact CB-CD1 3.88Å; L346-F403 HydrophobicContact CB-CE1 4.09Å; L346-F403 HydrophobicContact CD1-CB 3.96Å; L346-F403 HydrophobicContact CD1-CD1 4.09Å; L346-F403 HydrophobicContact CD1-CG 4.25Å; L346-F403 HydrophobicContact CG-CD1 4.4Å
347	V	90.6	Very high	88.4	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.2	-28.5	-179.4	177.6	0	0	0	0	111.9	T244 K247 Y343 I345 S350	T244-V347 HydrophobicContact CG2-CB 3.91Å; T244-V347 HydrophobicContact CG2-CG1 3.81Å; T244-V347 HydrophobicContact CG2-CG2 4.08Å; K247-V347 HydrophobicContact CB-CG1 4.31Å; Y343-V347 HydrophobicContact CD2-CG2 4.22Å; Y343-V347 HydrophobicContact CE1-CG2 4.19Å; Y343-V347 HydrophobicContact CE2-CG2 3.6Å; Y343-V347 PolarHBondContact O-N 2.94Å; I345-V347 PolarHBondContact O-N 3.15Å; V347-S350 WeakPolarHBondContact CA-OG 3.33Å; V347-S350 PolarHBondContact O-OG 3.37Å
348	R	87.8	Confident	88.7	Confident	89 Å²	89	20.1 Å²	20.1	34%	0.336	11%	0.11	S	C	.	.	H	α-helix	trans	-65.6	-38.3	177	172.8	175.8	162	143.6	-3.7	113.4	K247 Y344 I345 L346 E368	K247-R348 PolarHBondContact NZ-O 3.14Å; Y344-R348 WeakPolarHBondContact O-CB 3.43Å; Y344-R348 PolarHBondContact O-N 3.09Å; Y344-R348 VanDerWaalsContact O-N 3.14Å; I345-R348 WeakPolarHBondContact O-CB 3.42Å; I345-R348 PolarHBondContact O-N 3.01Å; I345-R348 VanDerWaalsContact O-N 3.14Å; L346-R348 PolarHBondContact O-N 3.43Å; R348-E368 IonicContact NH2-OE2 3.11Å
349	Y	90.3	Very high	88.9	Confident	29 Å²	29	23.6 Å²	23.6	11%	0.114	13%	0.125	C	C	.	.	H	α-helix	trans	-97.4	-21.9	179.7	-66.4	-82.9	0	0	0	114	I345 L346 F364 E368	I345-Y349 HydrophobicContact CG2-CD2 4.07Å; I345-Y349 HydrophobicContact CG2-CE2 4.17Å; I345-Y349 VanDerWaalsContact O-CD2 3.3Å; I345-Y349 WeakPolarHBondContact O-CD2 3.4Å; I345-Y349 PolarHBondContact O-N 2.75Å; L346-Y349 PolarHBondContact O-N 3.46Å; Y349-F364 HydrophobicContact CD1-CB 4.21Å; Y349-F364 HydrophobicContact CD1-CD2 4.29Å; Y349-F364 AromaticContact CD2-CD2 3.7Å; Y349-F364 HydrophobicContact CD2-CD2 3.7Å; Y349-F364 HydrophobicContact CD2-CE2 4.36Å; Y349-F364 HydrophobicContact CE2-CD2 4.14Å; Y349-F364 HydrophobicContact CG-CB 4.07Å; Y349-F364 AromaticContact CG-CD2 3.85Å; Y349-F364 HydrophobicContact CG-CD2 3.85Å; Y349-F364 HydrophobicContact CG-CG 4.45Å; Y349-E368 HydrophobicContact CE1-CB 4Å; Y349-E368 HydrophobicContact CE1-CG 4.45Å; Y349-E368 HydrophobicContact CE2-CG 4.32Å; Y349-E368 PolarHBondContact OH-OE2 2.88Å
350	S	87.9	Confident	89.2	Confident	4 Å²	4	23 Å²	23	3%	0.028	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	155.6	163.3	82.3	0	0	0	0	110.6	L346 V347 G352 S353	L346-S350 WeakPolarHBondContact O-CB 3.49Å; L346-S350 PolarHBondContact O-N 3.08Å; V347-S350 WeakPolarHBondContact CA-OG 3.33Å; V347-S350 PolarHBondContact O-OG 3.37Å; S350-G352 PolarHBondContact O-N 2.93Å; S350-G352 PolarHBondContact OG-N 2.91Å; S350-G352 VanDerWaalsContact OG-N 3.17Å; S350-S353 VanDerWaalsContact CB-O 3.27Å; S350-S353 WeakPolarHBondContact CB-O 3.22Å; S350-S353 PolarHBondContact OG-N 2.94Å; S350-S353 VanDerWaalsContact OG-N 3.1Å; S350-S353 PolarHBondContact OG-O 3.16Å
351	S	80.5	Confident	89.4	Confident	95 Å²	95	22.1 Å²	22.1	66%	0.664	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	43.9	167.9	-60.6	0	0	0	0	112.4	A251 D360	A251-S351 WeakPolarHBondContact CB-O 3.5Å; S351-D360 PolarHBondContact N-OD1 3.36Å; S351-D360 VanDerWaalsContact N-OD1 3.08Å; S351-D360 PolarHBondContact OG-OD1 2.89Å
352	G	71.8	Confident	89.6	Confident	4 Å²	4	23.4 Å²	23.4	4%	0.041	13%	0.125	C	C	.	.	S	Bend	trans	74.3	22.8	-176.8	0	0	0	0	0	115	A251 R262 S350	A251-G352 WeakPolarHBondContact CB-O 3.29Å; R262-G352 PolarHBondContact NH1-O 3.34Å; S350-G352 PolarHBondContact O-N 2.93Å; S350-G352 PolarHBondContact OG-N 2.91Å; S350-G352 VanDerWaalsContact OG-N 3.17Å
353	S	81.9	Confident	89.6	Confident	34 Å²	34	26.8 Å²	26.8	24%	0.238	14%	0.144	C	C	.	.	S	Bend	trans	-102.2	157.9	176.8	44.1	0	0	0	0	112	S350 H355	S350-S353 VanDerWaalsContact CB-O 3.27Å; S350-S353 WeakPolarHBondContact CB-O 3.22Å; S350-S353 PolarHBondContact OG-N 2.94Å; S350-S353 VanDerWaalsContact OG-N 3.1Å; S350-S353 PolarHBondContact OG-O 3.16Å; S353-H355 PolarHBondContact O-N 2.89Å; S353-H355 PolarHBondContact OG-O 3.32Å
354	E	85.3	Confident	89.6	Confident	15 Å²	15	26.6 Å²	26.6	7%	0.07	14%	0.143	C	C	.	.	S	Bend	trans	-80.9	15	173	-61.4	-172.2	147.8	0	0	112.9	N79 A80 R262 Q263 Y343	N79-E354 WeakPolarHBondContact CB-OE1 3.49Å; A80-E354 WeakPolarHBondContact CB-OE1 3.3Å; A80-E354 PolarHBondContact N-OE1 3.4Å; R262-E354 HydrophobicContact CB-CB 4.44Å; R262-E354 HydrophobicContact CB-CG 4.44Å; Q263-E354 WeakPolarHBondContact CG-OE2 3.37Å; Y343-E354 HydrophobicContact CE2-CG 4.46Å; Y343-E354 PolarHBondContact OH-OE1 2.59Å
355	H	90.6	Very high	89.7	Confident	22 Å²	22	26 Å²	26	10%	0.102	14%	0.141	C	C	.	.	S	Bend	trans	-141.3	150.5	177.6	-64.5	91.1	0	0	0	110.4	R262 S353 N392 L397 M398	R262-H355 PolarHBondContact O-CE1 2.87Å; S353-H355 PolarHBondContact O-N 2.89Å; S353-H355 PolarHBondContact OG-O 3.32Å; H355-N392 PolarHBondContact CD2-ND2 3.19Å; H355-N392 PolarHBondContact NE2-ND2 2.89Å; H355-N392 VanDerWaalsContact NE2-ND2 3.16Å; H355-L397 HydrophobicContact CB-CB 4.32Å; H355-M398 CarbonylContact C-O 3.53Å; H355-M398 WeakPolarHBondContact CA-O 3.35Å
356	L	93	Very high	89.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.8	168.9	-63.9	168.1	0	0	0	110.1	L346 D360 L397 M398 F403	L346-L356 HydrophobicContact CG-CD1 4.44Å; L346-L356 HydrophobicContact CG-CG 4.13Å; L356-D360 HydrophobicContact CB-CB 4.24Å; L356-D360 HydrophobicContact CD2-CB 3.76Å; L356-L397 CarbonylContact O-C 3.58Å; L356-L397 WeakPolarHBondContact O-CA 3.35Å; L356-M398 HydrophobicContact CB-CB 4.46Å; L356-M398 PolarHBondContact N-O 3.45Å; L356-M398 PolarHBondContact O-N 2.91Å; L356-F403 HydrophobicContact CD1-CD2 3.54Å; L356-F403 HydrophobicContact CD1-CE2 3.7Å; L356-F403 HydrophobicContact CD1-CG 4.03Å; L356-F403 HydrophobicContact CD1-CZ 4.31Å
357	S	93.6	Very high	89.4	Confident	38 Å²	38	32.1 Å²	32.1	27%	0.266	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	171.6	164.5	75.2	0	0	0	0	111.7	E359 D360 L361	S357-E359 PolarHBondContact O-N 2.85Å; S357-E359 VanDerWaalsContact O-N 3.16Å; S357-E359 PolarHBondContact OG-N 3.49Å; S357-D360 WeakPolarHBondContact CA-OD2 3.27Å; S357-D360 WeakPolarHBondContact CB-OD2 3.13Å; S357-D360 PolarHBondContact N-OD2 2.82Å; S357-D360 PolarHBondContact O-N 3.48Å; S357-D360 PolarHBondContact OG-N 2.7Å; S357-D360 PolarHBondContact OG-OD2 3.21Å; S357-L361 WeakPolarHBondContact O-CB 3.38Å; S357-L361 PolarHBondContact O-N 3.14Å
358	A	93.5	Very high	89.3	Confident	9 Å²	9	33.7 Å²	33.7	7%	0.074	19%	0.185	C	C	.	.	H	α-helix	trans	-57.7	-23.6	172.5	0	0	0	0	0	114.2	K362 R376 C379 K380 I383	A358-K362 PolarHBondContact O-N 2.83Å; A358-R376 HydrophobicContact CB-CG 4.1Å; A358-C379 HydrophobicContact CB-CB 4.15Å; A358-C379 VanDerWaalsContact O-CB 3.28Å; A358-C379 WeakPolarHBondContact O-CB 3.29Å; A358-K380 HydrophobicContact CB-CG 4.06Å; A358-I383 HydrophobicContact CB-CD1 4.12Å
359	E	92.4	Very high	89.5	Confident	75 Å²	75	29.6 Å²	29.6	35%	0.35	17%	0.17	S	C	.	.	H	α-helix	trans	-90.7	-36.8	176.1	-159.7	64.9	-144.6	0	0	112	S357 L361 K362 N363	S357-E359 PolarHBondContact O-N 2.85Å; S357-E359 VanDerWaalsContact O-N 3.16Å; S357-E359 PolarHBondContact OG-N 3.49Å; E359-L361 VanDerWaalsContact C-N 3.26Å; E359-L361 PolarHBondContact O-N 2.85Å; E359-K362 WeakPolarHBondContact O-CB 3.49Å; E359-K362 PolarHBondContact O-N 2.75Å; E359-K362 WeakPolarHBondContact OE1-CD 3.42Å; E359-K362 WeakPolarHBondContact OE1-CE 3.42Å; E359-K362 IonicContact OE1-NZ 3.23Å; E359-K362 PolarHBondContact OE1-NZ 2.82Å; E359-N363 WeakPolarHBondContact O-CB 3.27Å; E359-N363 PolarHBondContact O-N 3.33Å; E359-N363 PolarHBondContact O-ND2 3.25Å
360	D	94.1	Very high	89.1	Confident	12 Å²	12	30.4 Å²	30.4	6%	0.064	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-40.1	170.5	-54.6	-76	0	0	0	110.4	S351 L356 S357 N363 F364	S351-D360 PolarHBondContact N-OD1 3.36Å; S351-D360 VanDerWaalsContact N-OD1 3.08Å; S351-D360 PolarHBondContact OG-OD1 2.89Å; L356-D360 HydrophobicContact CB-CB 4.24Å; L356-D360 HydrophobicContact CD2-CB 3.76Å; S357-D360 WeakPolarHBondContact CA-OD2 3.27Å; S357-D360 WeakPolarHBondContact CB-OD2 3.13Å; S357-D360 PolarHBondContact N-OD2 2.82Å; S357-D360 PolarHBondContact O-N 3.48Å; S357-D360 PolarHBondContact OG-N 2.7Å; S357-D360 PolarHBondContact OG-OD2 3.21Å; D360-N363 PolarHBondContact O-N 3.06Å; D360-F364 PolarHBondContact O-N 3.25Å
361	L	94	Very high	88.9	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-38.8	175	-177.7	61.1	0	0	0	112.3	S357 E359 F364 F365 C379 L382 I383 M398 L406	S357-L361 WeakPolarHBondContact O-CB 3.38Å; S357-L361 PolarHBondContact O-N 3.14Å; E359-L361 VanDerWaalsContact C-N 3.26Å; E359-L361 PolarHBondContact O-N 2.85Å; L361-F364 HydrophobicContact CD1-CD1 4.26Å; L361-F364 PolarHBondContact O-N 3.28Å; L361-F365 HydrophobicContact CD1-CD2 4.06Å; L361-F365 HydrophobicContact CD1-CE2 3.74Å; L361-F365 HydrophobicContact CG-CD2 4.14Å; L361-F365 HydrophobicContact CG-CE2 4.05Å; L361-F365 WeakPolarHBondContact O-CD2 3.49Å; L361-F365 PolarHBondContact O-N 3.33Å; L361-F365 VanDerWaalsContact O-N 3.08Å; L361-C379 HydrophobicContact CD2-CB 4.28Å; L361-L382 HydrophobicContact CD2-CB 4.39Å; L361-I383 HydrophobicContact CD2-CD1 4.13Å; L361-I383 HydrophobicContact CD2-CG1 3.68Å; L361-M398 HydrophobicContact CD2-CE 4.43Å; L361-L406 HydrophobicContact CD1-CD2 3.71Å
362	K	93.2	Very high	88.9	Confident	37 Å²	37	36 Å²	36	16%	0.161	21%	0.206	C	C	.	.	H	α-helix	trans	-62	-48.3	172.5	-174.3	177.3	139.2	-64.8	0	110.5	A358 E359 F364 F365 E366 L374	A358-K362 PolarHBondContact O-N 2.83Å; E359-K362 WeakPolarHBondContact O-CB 3.49Å; E359-K362 PolarHBondContact O-N 2.75Å; E359-K362 WeakPolarHBondContact OE1-CD 3.42Å; E359-K362 WeakPolarHBondContact OE1-CE 3.42Å; E359-K362 IonicContact OE1-NZ 3.23Å; E359-K362 PolarHBondContact OE1-NZ 2.82Å; K362-F364 VanDerWaalsContact C-N 3.3Å; K362-F364 PolarHBondContact O-N 2.92Å; K362-F365 PolarHBondContact O-N 3.1Å; K362-F365 VanDerWaalsContact O-N 3.08Å; K362-E366 WeakPolarHBondContact CE-OE2 3.42Å; K362-E366 HydrophobicContact CG-CG 4.25Å; K362-E366 IonicContact NZ-OE2 2.7Å; K362-E366 PolarHBondContact NZ-OE2 3.16Å; K362-E366 WeakPolarHBondContact O-CG 3.43Å; K362-E366 PolarHBondContact O-N 2.93Å; K362-L374 WeakPolarHBondContact CD-O 3.41Å; K362-L374 HydrophobicContact CG-CB 4.46Å
363	N	91.6	Very high	89.5	Confident	72 Å²	72	38.7 Å²	38.7	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-58.6	-39.9	177.3	-67.9	-27.7	0	0	0	112	E359 D360 S367	E359-N363 WeakPolarHBondContact O-CB 3.27Å; E359-N363 PolarHBondContact O-N 3.33Å; E359-N363 PolarHBondContact O-ND2 3.25Å; D360-N363 PolarHBondContact O-N 3.06Å; N363-S367 VanDerWaalsContact O-CB 3.3Å; N363-S367 WeakPolarHBondContact O-CB 3.29Å; N363-S367 PolarHBondContact O-N 2.85Å; N363-S367 PolarHBondContact O-OG 3.13Å
364	F	93.5	Very high	89.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-45.5	172.5	170.6	-105.7	0	0	0	112.7	I345 Y349 D360 L361 K362 E368 Q369 F403 L407 F1037	I345-F364 HydrophobicContact CG2-CE2 3.96Å; Y349-F364 HydrophobicContact CD1-CB 4.21Å; Y349-F364 HydrophobicContact CD1-CD2 4.29Å; Y349-F364 AromaticContact CD2-CD2 3.7Å; Y349-F364 HydrophobicContact CD2-CD2 3.7Å; Y349-F364 HydrophobicContact CD2-CE2 4.36Å; Y349-F364 HydrophobicContact CE2-CD2 4.14Å; Y349-F364 HydrophobicContact CG-CB 4.07Å; Y349-F364 AromaticContact CG-CD2 3.85Å; Y349-F364 HydrophobicContact CG-CD2 3.85Å; Y349-F364 HydrophobicContact CG-CG 4.45Å; D360-F364 PolarHBondContact O-N 3.25Å; L361-F364 HydrophobicContact CD1-CD1 4.26Å; L361-F364 PolarHBondContact O-N 3.28Å; K362-F364 VanDerWaalsContact C-N 3.3Å; K362-F364 PolarHBondContact O-N 2.92Å; F364-E368 HydrophobicContact CD2-CB 4.17Å; F364-E368 HydrophobicContact CE2-CB 4.41Å; F364-E368 WeakPolarHBondContact O-CB 3.32Å; F364-E368 PolarHBondContact O-N 3.24Å; F364-E368 VanDerWaalsContact O-N 3.07Å; F364-Q369 HydrophobicContact CD1-CG 4.28Å; F364-Q369 HydrophobicContact CE1-CG 3.83Å; F364-Q369 HydrophobicContact CZ-CG 4.04Å; F364-Q369 PolarHBondContact O-N 3.44Å; F364-F403 HydrophobicContact CD1-CE2 4.13Å; F364-F403 HydrophobicContact CD2-CZ 4.4Å; F364-F403 AromaticContact CE1-CE2 3.77Å; F364-F403 HydrophobicContact CE1-CE2 3.77Å; F364-F403 HydrophobicContact CE1-CZ 4.13Å; F364-F403 HydrophobicContact CE2-CE2 4.34Å; F364-F403 AromaticContact CE2-CZ 3.9Å; F364-F403 HydrophobicContact CE2-CZ 3.9Å; F364-F403 AromaticContact CZ-CE2 3.87Å; F364-F403 HydrophobicContact CZ-CE2 3.87Å; F364-F403 AromaticContact CZ-CZ 3.73Å; F364-F403 HydrophobicContact CZ-CZ 3.73Å; F364-L407 HydrophobicContact CZ-CD2 4Å; F364-F1037 HydrophobicContact CE2-CD2 4.22Å
365	F	92.8	Very high	90	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-43	177.4	-85.3	-66.2	0	0	0	112.8	L361 K362 Q369 G370 R371 L374 L382 L406	L361-F365 HydrophobicContact CD1-CD2 4.06Å; L361-F365 HydrophobicContact CD1-CE2 3.74Å; L361-F365 HydrophobicContact CG-CD2 4.14Å; L361-F365 HydrophobicContact CG-CE2 4.05Å; L361-F365 WeakPolarHBondContact O-CD2 3.49Å; L361-F365 PolarHBondContact O-N 3.33Å; L361-F365 VanDerWaalsContact O-N 3.08Å; K362-F365 PolarHBondContact O-N 3.1Å; K362-F365 VanDerWaalsContact O-N 3.08Å; F365-Q369 HydrophobicContact CD1-CB 3.96Å; F365-Q369 HydrophobicContact CD1-CG 3.94Å; F365-Q369 HydrophobicContact CE1-CG 4.31Å; F365-Q369 CarbonylContact O-C 3.44Å; F365-Q369 WeakPolarHBondContact O-CB 3.35Å; F365-Q369 PolarHBondContact O-N 3Å; F365-G370 PolarHBondContact O-N 3.24Å; F365-G370 VanDerWaalsContact O-N 3.15Å; F365-R371 HydrophobicContact CB-CB 4.49Å; F365-R371 HydrophobicContact CD1-CB 4.43Å; F365-R371 PolarHBondContact O-N 3.34Å; F365-L374 HydrophobicContact CB-CD2 4.29Å; F365-L374 HydrophobicContact CD2-CD2 3.8Å; F365-L374 HydrophobicContact CE2-CD2 4.39Å; F365-L374 HydrophobicContact CG-CD2 4.1Å; F365-L382 HydrophobicContact CD2-CD1 4.48Å; F365-L382 HydrophobicContact CE2-CD1 3.67Å; F365-L382 HydrophobicContact CZ-CD1 4.07Å; F365-L406 HydrophobicContact CE2-CD2 4.25Å; F365-L406 HydrophobicContact CZ-CD1 4.35Å; F365-L406 HydrophobicContact CZ-CD2 4.18Å
366	E	90.9	Very high	90	Very high	58 Å²	58	46 Å²	46	27%	0.271	26%	0.263	S	S	.	.	H	α-helix	trans	-73.9	-44.3	-176.6	-65.6	-171.5	129.5	0	0	112.5	K362 G373	K362-E366 WeakPolarHBondContact CE-OE2 3.42Å; K362-E366 HydrophobicContact CG-CG 4.25Å; K362-E366 IonicContact NZ-OE2 2.7Å; K362-E366 PolarHBondContact NZ-OE2 3.16Å; K362-E366 WeakPolarHBondContact O-CG 3.43Å; K362-E366 PolarHBondContact O-N 2.93Å; E366-G373 PolarHBondContact OE1-N 3.49Å
367	S	87.5	Confident	90	Very high	80 Å²	80	50.3 Å²	50.3	56%	0.559	29%	0.286	S	S	*	.	H	α-helix	trans	-86	-37.5	-175.5	66.6	0	0	0	0	114.5	N363	N363-S367 VanDerWaalsContact O-CB 3.3Å; N363-S367 WeakPolarHBondContact O-CB 3.29Å; N363-S367 PolarHBondContact O-N 2.85Å; N363-S367 PolarHBondContact O-OG 3.13Å
368	E	90	Very high	90	Very high	33 Å²	33	53.1 Å²	53.1	15%	0.154	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-40.5	-170	-158.6	66	-163.4	0	0	112.7	R348 Y349 F364 G1036 F1037 H1058	R348-E368 IonicContact NH2-OE2 3.11Å; Y349-E368 HydrophobicContact CE1-CB 4Å; Y349-E368 HydrophobicContact CE1-CG 4.45Å; Y349-E368 HydrophobicContact CE2-CG 4.32Å; Y349-E368 PolarHBondContact OH-OE2 2.88Å; F364-E368 HydrophobicContact CD2-CB 4.17Å; F364-E368 HydrophobicContact CE2-CB 4.41Å; F364-E368 WeakPolarHBondContact O-CB 3.32Å; F364-E368 PolarHBondContact O-N 3.24Å; F364-E368 VanDerWaalsContact O-N 3.07Å; E368-G1036 WeakPolarHBondContact O-CA 3.48Å; E368-G1036 PolarHBondContact O-N 3Å; E368-F1037 HydrophobicContact CG-CD2 3.84Å; E368-F1037 HydrophobicContact CG-CE2 3.8Å; E368-H1058 IonicContact OE1-CD2 3.92Å; E368-H1058 IonicContact OE1-CE1 2.66Å; E368-H1058 IonicContact OE1-NE2 3.33Å; E368-H1058 PolarHBondContact OE1-NE2 3.27Å
369	Q	90.6	Very high	90	Very high	3 Å²	3	52.7 Å²	52.7	1%	0.014	29%	0.292	C	S	.	.	S	Bend	trans	-84.1	-13	177.5	-60.1	-68.4	-10.2	0	0	113.4	F364 F365 R371 T1035 F1037 R1038	F364-Q369 HydrophobicContact CD1-CG 4.28Å; F364-Q369 HydrophobicContact CE1-CG 3.83Å; F364-Q369 HydrophobicContact CZ-CG 4.04Å; F364-Q369 PolarHBondContact O-N 3.44Å; F365-Q369 HydrophobicContact CD1-CB 3.96Å; F365-Q369 HydrophobicContact CD1-CG 3.94Å; F365-Q369 HydrophobicContact CE1-CG 4.31Å; F365-Q369 CarbonylContact O-C 3.44Å; F365-Q369 WeakPolarHBondContact O-CB 3.35Å; F365-Q369 PolarHBondContact O-N 3Å; Q369-R371 VanDerWaalsContact C-N 3.32Å; Q369-T1035 PolarHBondContact O-OG1 3.06Å; Q369-T1035 VanDerWaalsContact O-OG1 3.14Å; Q369-T1035 PolarHBondContact OE1-O 3.18Å; Q369-T1035 VanDerWaalsContact OE1-O 3.08Å; Q369-F1037 PolarHBondContact NE2-O 3.07Å; Q369-F1037 PolarHBondContact OE1-O 3.38Å; Q369-R1038 VanDerWaalsContact OE1-CZ 3.24Å; Q369-R1038 VanDerWaalsContact OE1-NE 3.14Å
370	G	83.4	Confident	90.2	Very high	47 Å²	47	51.8 Å²	51.8	49%	0.485	29%	0.287	S	S	.	.			trans	73.3	18.7	-178.8	0	0	0	0	0	114.4	F365	F365-G370 PolarHBondContact O-N 3.24Å; F365-G370 VanDerWaalsContact O-N 3.15Å
371	R	83.4	Confident	90.2	Very high	101 Å²	101	54 Å²	54	38%	0.381	31%	0.307	S	S	.	.			trans	-101.8	89.9	-176.4	-171.3	-177.6	-174.1	174.4	2.8	110.3	F365 Q369 L374 E411	F365-R371 HydrophobicContact CB-CB 4.49Å; F365-R371 HydrophobicContact CD1-CB 4.43Å; F365-R371 PolarHBondContact O-N 3.34Å; Q369-R371 VanDerWaalsContact C-N 3.32Å; R371-L374 VanDerWaalsContact CD-CD1 3.5Å; R371-L374 HydrophobicContact CG-CD1 3.72Å; R371-E411 IonicContact CZ-OE2 3.68Å; R371-E411 IonicContact NH1-OE2 3.75Å; R371-E411 PolarHBondContact NH1-OE2 3Å; R371-E411 IonicContact NH2-OE2 2.73Å; R371-E411 PolarHBondContact NH2-OE2 3.02Å
372	T	80.7	Confident	90.3	Very high	116 Å²	116	54.8 Å²	54.8	71%	0.712	31%	0.311	S	S	*	.			trans	-75.3	155.3	179.6	49.2	0	0	0	0	112.8
373	G	83.5	Confident	90.4	Very high	59 Å²	59	53 Å²	53	61%	0.608	30%	0.303	S	S	*	.			trans	79.7	17.5	169.6	0	0	0	0	0	115.2	E366	E366-G373 PolarHBondContact OE1-N 3.49Å
374	L	86.9	Confident	90.6	Very high	14 Å²	14	53.4 Å²	53.4	7%	0.073	31%	0.305	C	S	.	.			trans	-66.2	133	169.1	-115.8	79.7	0	0	0	110.2	K362 F365 R371 L382	K362-L374 WeakPolarHBondContact CD-O 3.41Å; K362-L374 HydrophobicContact CG-CB 4.46Å; F365-L374 HydrophobicContact CB-CD2 4.29Å; F365-L374 HydrophobicContact CD2-CD2 3.8Å; F365-L374 HydrophobicContact CE2-CD2 4.39Å; F365-L374 HydrophobicContact CG-CD2 4.1Å; R371-L374 VanDerWaalsContact CD-CD1 3.5Å; R371-L374 HydrophobicContact CG-CD1 3.72Å; L374-L382 HydrophobicContact CD2-CD1 4.15Å
375	T	91.3	Very high	90.6	Very high	72 Å²	72	61.2 Å²	61.2	44%	0.442	33%	0.334	S	S	.	.			trans	-82	150.8	170.6	68	0	0	0	0	110.6	D377 Q378 C379	T375-D377 PolarHBondContact O-N 3.02Å; T375-Q378 WeakPolarHBondContact O-CB 2.99Å; T375-Q378 PolarHBondContact O-N 3.09Å; T375-Q378 VanDerWaalsContact O-N 3.1Å; T375-Q378 VanDerWaalsContact OG1-CG 3.28Å; T375-Q378 WeakPolarHBondContact OG1-CG 3.37Å; T375-Q378 PolarHBondContact OG1-N 3.13Å; T375-Q378 PolarHBondContact OG1-OE1 3.14Å; T375-C379 PolarHBondContact O-N 2.75Å; T375-C379 VanDerWaalsContact O-N 3.09Å; T375-C379 PolarHBondContact O-SG 2.9Å
376	R	90.3	Very high	90.7	Very high	140 Å²	140	62.6 Å²	62.6	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-56.9	-33.5	177	-170.3	-176	64.4	167.1	-2.7	112.2	A358 C379 K380	A358-R376 HydrophobicContact CB-CG 4.1Å; R376-C379 WeakPolarHBondContact O-CB 3.35Å; R376-C379 PolarHBondContact O-N 3.37Å; R376-K380 WeakPolarHBondContact O-CG 3.47Å; R376-K380 PolarHBondContact O-N 3.45Å
377	D	93.4	Very high	90.9	Very high	89 Å²	89	60.2 Å²	60.2	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-79.7	-25	-179.5	-55.6	-61.3	0	0	0	112.9	T375 K380 A381	T375-D377 PolarHBondContact O-N 3.02Å; D377-K380 PolarHBondContact O-N 3.07Å; D377-K380 WeakPolarHBondContact OD1-CD 3.45Å; D377-K380 VanDerWaalsContact OD1-CE 3.31Å; D377-K380 WeakPolarHBondContact OD1-CE 3.14Å; D377-K380 IonicContact OD1-NZ 3.32Å; D377-K380 PolarHBondContact OD1-NZ 3.31Å; D377-A381 PolarHBondContact O-N 3.22Å
378	Q	93.4	Very high	91	Very high	97 Å²	97	57.9 Å²	57.9	45%	0.453	31%	0.312	S	S	.	.	H	α-helix	trans	-64.7	-40.1	162.2	-74.6	164.1	-19.7	0	0	111.3	T375 K380 A381 L382	T375-Q378 WeakPolarHBondContact O-CB 2.99Å; T375-Q378 PolarHBondContact O-N 3.09Å; T375-Q378 VanDerWaalsContact O-N 3.1Å; T375-Q378 VanDerWaalsContact OG1-CG 3.28Å; T375-Q378 WeakPolarHBondContact OG1-CG 3.37Å; T375-Q378 PolarHBondContact OG1-N 3.13Å; T375-Q378 PolarHBondContact OG1-OE1 3.14Å; Q378-K380 PolarHBondContact O-N 2.69Å; Q378-A381 WeakPolarHBondContact O-CB 3Å; Q378-A381 PolarHBondContact O-N 3.01Å; Q378-L382 WeakPolarHBondContact O-CG 3.35Å; Q378-L382 PolarHBondContact O-N 2.69Å
379	C	94.3	Very high	91.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.7	-45.3	174.1	-60.7	0	0	0	0	111.4	A358 L361 T375 R376 A381 L382 I383	A358-C379 HydrophobicContact CB-CB 4.15Å; A358-C379 VanDerWaalsContact O-CB 3.28Å; A358-C379 WeakPolarHBondContact O-CB 3.29Å; L361-C379 HydrophobicContact CD2-CB 4.28Å; T375-C379 PolarHBondContact O-N 2.75Å; T375-C379 VanDerWaalsContact O-N 3.09Å; T375-C379 PolarHBondContact O-SG 2.9Å; R376-C379 WeakPolarHBondContact O-CB 3.35Å; R376-C379 PolarHBondContact O-N 3.37Å; C379-A381 VanDerWaalsContact C-N 3.31Å; C379-A381 PolarHBondContact O-N 2.74Å; C379-L382 WeakPolarHBondContact O-CB 3.33Å; C379-L382 PolarHBondContact O-N 2.78Å; C379-I383 WeakPolarHBondContact O-CG1 3.42Å; C379-I383 PolarHBondContact O-N 2.8Å
380	K	95.3	Very high	91	Very high	57 Å²	57	61.9 Å²	61.9	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-59	-39.4	173.1	-64.2	176.8	-174.6	164	0	112.9	A358 R376 D377 Q378 L382 I383 N384 N396	A358-K380 HydrophobicContact CB-CG 4.06Å; R376-K380 WeakPolarHBondContact O-CG 3.47Å; R376-K380 PolarHBondContact O-N 3.45Å; D377-K380 PolarHBondContact O-N 3.07Å; D377-K380 WeakPolarHBondContact OD1-CD 3.45Å; D377-K380 VanDerWaalsContact OD1-CE 3.31Å; D377-K380 WeakPolarHBondContact OD1-CE 3.14Å; D377-K380 IonicContact OD1-NZ 3.32Å; D377-K380 PolarHBondContact OD1-NZ 3.31Å; Q378-K380 PolarHBondContact O-N 2.69Å; K380-L382 VanDerWaalsContact C-N 3.34Å; K380-I383 PolarHBondContact O-N 3.3Å; K380-N384 WeakPolarHBondContact O-CB 3.4Å; K380-N384 PolarHBondContact O-N 3.2Å; K380-N384 PolarHBondContact O-ND2 2.78Å; K380-N396 WeakPolarHBondContact CD-OD1 3.43Å; K380-N396 HydrophobicContact CG-CB 4.42Å; K380-N396 VanDerWaalsContact CG-OD1 3.24Å; K380-N396 WeakPolarHBondContact CG-OD1 3.44Å
381	A	95.3	Very high	91.4	Very high	59 Å²	59	62 Å²	62	49%	0.488	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-38.2	176.9	0	0	0	0	0	112	D377 Q378 C379 R385	D377-A381 PolarHBondContact O-N 3.22Å; Q378-A381 WeakPolarHBondContact O-CB 3Å; Q378-A381 PolarHBondContact O-N 3.01Å; C379-A381 VanDerWaalsContact C-N 3.31Å; C379-A381 PolarHBondContact O-N 2.74Å; A381-R385 VanDerWaalsContact O-CB 3.31Å; A381-R385 WeakPolarHBondContact O-CB 3.27Å; A381-R385 PolarHBondContact O-N 2.85Å; A381-R385 VanDerWaalsContact O-N 3.09Å
382	L	94.5	Very high	91.8	Very high	16 Å²	16	57.5 Å²	57.5	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-44.3	172	-66.2	170	0	0	0	111.5	L361 F365 L374 Q378 C379 K380 R385 Y386 E411	L361-L382 HydrophobicContact CD2-CB 4.39Å; F365-L382 HydrophobicContact CD2-CD1 4.48Å; F365-L382 HydrophobicContact CE2-CD1 3.67Å; F365-L382 HydrophobicContact CZ-CD1 4.07Å; L374-L382 HydrophobicContact CD2-CD1 4.15Å; Q378-L382 WeakPolarHBondContact O-CG 3.35Å; Q378-L382 PolarHBondContact O-N 2.69Å; C379-L382 WeakPolarHBondContact O-CB 3.33Å; C379-L382 PolarHBondContact O-N 2.78Å; K380-L382 VanDerWaalsContact C-N 3.34Å; L382-R385 PolarHBondContact O-N 2.63Å; L382-Y386 HydrophobicContact CD2-CD2 4.44Å; L382-Y386 HydrophobicContact CD2-CE2 3.86Å; L382-Y386 VanDerWaalsContact O-CD2 3.24Å; L382-Y386 WeakPolarHBondContact O-CD2 3.48Å; L382-Y386 PolarHBondContact O-N 2.92Å; L382-E411 HydrophobicContact CD2-CG 4.11Å
383	I	95.9	Very high	92.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.9	-51.8	175.1	-63.9	174.9	0	0	0	110.6	A358 L361 C379 K380 R385 Y386 E387 N396 L397 M398	A358-I383 HydrophobicContact CB-CD1 4.12Å; L361-I383 HydrophobicContact CD2-CD1 4.13Å; L361-I383 HydrophobicContact CD2-CG1 3.68Å; C379-I383 WeakPolarHBondContact O-CG1 3.42Å; C379-I383 PolarHBondContact O-N 2.8Å; K380-I383 PolarHBondContact O-N 3.3Å; I383-R385 PolarHBondContact O-N 3.47Å; I383-R385 VanDerWaalsContact O-N 3.14Å; I383-Y386 PolarHBondContact O-N 3.01Å; I383-E387 HydrophobicContact CG2-CB 4.15Å; I383-E387 WeakPolarHBondContact O-CB 3.43Å; I383-E387 PolarHBondContact O-N 3.43Å; I383-N396 VanDerWaalsContact CD1-O 3.32Å; I383-N396 WeakPolarHBondContact CD1-O 3.49Å; I383-L397 VanDerWaalsContact CG2-O 3.23Å; I383-L397 WeakPolarHBondContact CG2-O 3.26Å; I383-M398 HydrophobicContact CG1-CB 4.18Å; I383-M398 HydrophobicContact CG1-CE 4.16Å; I383-M398 HydrophobicContact CG2-CB 4.47Å
384	N	95.5	Very high	92.8	Very high	80 Å²	80	59 Å²	59	43%	0.428	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-20.5	179.1	-75.8	-38.3	0	0	0	114.5	K380	K380-N384 WeakPolarHBondContact O-CB 3.4Å; K380-N384 PolarHBondContact O-N 3.2Å; K380-N384 PolarHBondContact O-ND2 2.78Å
385	R	94.9	Very high	93	Very high	163 Å²	163	65.8 Å²	65.8	62%	0.615	31%	0.307	S	S	*	.	H	α-helix	trans	-87.2	-35.4	177.9	-175.5	176	-175.5	-171.5	0.2	113.6	A381 L382 I383	A381-R385 VanDerWaalsContact O-CB 3.31Å; A381-R385 WeakPolarHBondContact O-CB 3.27Å; A381-R385 PolarHBondContact O-N 2.85Å; A381-R385 VanDerWaalsContact O-N 3.09Å; L382-R385 PolarHBondContact O-N 2.63Å; I383-R385 PolarHBondContact O-N 3.47Å; I383-R385 VanDerWaalsContact O-N 3.14Å
386	Y	93.9	Very high	93.1	Very high	31 Å²	31	64.7 Å²	64.7	12%	0.122	30%	0.299	C	S	.	.	H	α-helix	trans	-113.2	-23.2	-170.9	-62.6	-69.2	0	0	0	114.9	L382 I383 P388 G402 L405 L406 S409 E411	L382-Y386 HydrophobicContact CD2-CD2 4.44Å; L382-Y386 HydrophobicContact CD2-CE2 3.86Å; L382-Y386 VanDerWaalsContact O-CD2 3.24Å; L382-Y386 WeakPolarHBondContact O-CD2 3.48Å; L382-Y386 PolarHBondContact O-N 2.92Å; I383-Y386 PolarHBondContact O-N 3.01Å; Y386-P388 WeakPolarHBondContact O-CD 3.22Å; Y386-G402 WeakPolarHBondContact O-CA 3.38Å; Y386-L405 WeakPolarHBondContact O-CD1 3.34Å; Y386-L406 HydrophobicContact CD2-CB 4.34Å; Y386-L406 HydrophobicContact CD2-CD1 3.55Å; Y386-L406 HydrophobicContact CE2-CD1 3.68Å; Y386-L406 HydrophobicContact CG-CB 4.3Å; Y386-L406 HydrophobicContact CG-CD1 4.31Å; Y386-S409 VanDerWaalsContact CE1-CB 3.43Å; Y386-E411 HydrophobicContact CE2-CG 4.5Å
387	E	94.7	Very high	93.2	Very high	7 Å²	7	60.4 Å²	60.4	3%	0.033	29%	0.286	C	S	.	.			trans	-74.9	120.8	177.2	-179.8	63.3	-161.8	0	0	110.9	I383 N392 R393 M398 G399 G402	I383-E387 HydrophobicContact CG2-CB 4.15Å; I383-E387 WeakPolarHBondContact O-CB 3.43Å; I383-E387 PolarHBondContact O-N 3.43Å; E387-N392 HydrophobicContact CG-CB 3.65Å; E387-N392 VanDerWaalsContact OE1-CB 3.32Å; E387-N392 WeakPolarHBondContact OE1-CB 3.39Å; E387-N392 PolarHBondContact OE1-ND2 2.79Å; E387-R393 HydrophobicContact CB-CG 3.79Å; E387-R393 HydrophobicContact CG-CG 3.97Å; E387-R393 WeakPolarHBondContact O-CD 3.46Å; E387-R393 PolarHBondContact O-NE 2.75Å; E387-M398 WeakPolarHBondContact OE2-CA 3.43Å; E387-G399 PolarHBondContact OE1-N 3.42Å; E387-G399 PolarHBondContact OE2-N 3.2Å; E387-G402 WeakPolarHBondContact OE2-CA 3.08Å
388	P	90.7	Very high	93.2	Very high	32 Å²	32	56.1 Å²	56.1	21%	0.208	26%	0.263	C	S	.	.			trans	-78.7	-36.8	-176.7	31	-34.8	0	0	0	112.3	W269 Y386 H390 R393 D401	W269-P388 HydrophobicContact CH2-CB 4.07Å; W269-P388 HydrophobicContact CH2-CG 3.58Å; W269-P388 HydrophobicContact CZ2-CB 3.48Å; W269-P388 VanDerWaalsContact CZ2-CB 3.48Å; W269-P388 HydrophobicContact CZ2-CG 3.52Å; W269-P388 HydrophobicContact CZ3-CG 4.24Å; Y386-P388 WeakPolarHBondContact O-CD 3.22Å; P388-H390 PolarHBondContact O-N 3.47Å; P388-R393 PolarHBondContact O-NH2 2.87Å; P388-D401 HydrophobicContact CG-CB 4.17Å
389	S	91	Very high	93.2	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.014	24%	0.244	C	C	.	.			trans	-62.7	132.7	179.3	173.4	0	0	0	0	111.2	E391 N392 R393	S389-E391 PolarHBondContact OG-N 2.86Å; S389-N392 PolarHBondContact OG-N 3.42Å; S389-R393 WeakPolarHBondContact O-CG 3.43Å; S389-R393 PolarHBondContact O-N 3.47Å; S389-R393 PolarHBondContact O-NE 2.94Å
390	H	89.7	Confident	93.2	Very high	117 Å²	117	52.2 Å²	52.2	54%	0.542	25%	0.246	S	C	.	.	H	α-helix	trans	-73.4	-38.8	176.5	-173.2	-90.3	0	0	0	111.5	P388 R393 Q394	P388-H390 PolarHBondContact O-N 3.47Å; H390-R393 PolarHBondContact O-N 2.85Å; H390-Q394 VanDerWaalsContact CE1-CD 3.43Å; H390-Q394 PolarHBondContact CE1-NE2 2.89Å; H390-Q394 PolarHBondContact ND1-OE1 2.84Å; H390-Q394 WeakPolarHBondContact O-CG 3.29Å; H390-Q394 PolarHBondContact O-N 3.35Å
391	E	91.6	Very high	93	Very high	51 Å²	51	50.2 Å²	50.2	24%	0.238	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-48.7	177.2	-169.8	172.1	-174	0	0	110.2	R268 S389 R393 Q394 Y395	R268-E391 IonicContact NH1-OE1 3.92Å; R268-E391 PolarHBondContact NH1-OE1 3.48Å; R268-E391 IonicContact NH1-OE2 2.74Å; S389-E391 PolarHBondContact OG-N 2.86Å; E391-R393 PolarHBondContact O-N 3.32Å; E391-Q394 PolarHBondContact O-N 3.34Å; E391-Y395 HydrophobicContact CG-CD2 4.2Å; E391-Y395 HydrophobicContact CG-CE2 3.82Å; E391-Y395 WeakPolarHBondContact O-CD2 3.43Å; E391-Y395 PolarHBondContact O-N 2.93Å
392	N	91.2	Very high	92.9	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.027	22%	0.215	C	C	.	.	H	α-helix	trans	-63.9	-41	178.1	-73.3	-4.1	0	0	0	112.8	H355 E387 S389 Q394 Y395 N396 L397	H355-N392 PolarHBondContact CD2-ND2 3.19Å; H355-N392 PolarHBondContact NE2-ND2 2.89Å; H355-N392 VanDerWaalsContact NE2-ND2 3.16Å; E387-N392 HydrophobicContact CG-CB 3.65Å; E387-N392 VanDerWaalsContact OE1-CB 3.32Å; E387-N392 WeakPolarHBondContact OE1-CB 3.39Å; E387-N392 PolarHBondContact OE1-ND2 2.79Å; S389-N392 PolarHBondContact OG-N 3.42Å; N392-Q394 PolarHBondContact O-N 3Å; N392-Y395 CarbonylContact O-C 3.53Å; N392-Y395 PolarHBondContact O-N 2.68Å; N392-N396 PolarHBondContact O-N 3.08Å; N392-L397 CarbonylContact C-O 3.49Å; N392-L397 HydrophobicContact CB-CB 4.42Å; N392-L397 PolarHBondContact O-N 2.83Å
393	R	93.1	Very high	93	Very high	83 Å²	83	46.6 Å²	46.6	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-43.1	175.1	-80.2	-176.5	-76.7	166.2	-8.2	112.7	E387 P388 S389 H390 E391 Y395 N396	E387-R393 HydrophobicContact CB-CG 3.79Å; E387-R393 HydrophobicContact CG-CG 3.97Å; E387-R393 WeakPolarHBondContact O-CD 3.46Å; E387-R393 PolarHBondContact O-NE 2.75Å; P388-R393 PolarHBondContact O-NH2 2.87Å; S389-R393 WeakPolarHBondContact O-CG 3.43Å; S389-R393 PolarHBondContact O-N 3.47Å; S389-R393 PolarHBondContact O-NE 2.94Å; H390-R393 PolarHBondContact O-N 2.85Å; E391-R393 PolarHBondContact O-N 3.32Å; R393-Y395 VanDerWaalsContact C-N 3.3Å; R393-Y395 PolarHBondContact O-N 2.69Å; R393-N396 PolarHBondContact O-N 2.94Å
394	Q	91.8	Very high	92.8	Very high	124 Å²	124	46.9 Å²	46.9	58%	0.579	21%	0.212	S	C	*	.	H	α-helix	trans	-58.5	-41.9	175.4	-73	178.5	-55.5	0	0	111.9	H390 E391 N392 N396	H390-Q394 VanDerWaalsContact CE1-CD 3.43Å; H390-Q394 PolarHBondContact CE1-NE2 2.89Å; H390-Q394 PolarHBondContact ND1-OE1 2.84Å; H390-Q394 WeakPolarHBondContact O-CG 3.29Å; H390-Q394 PolarHBondContact O-N 3.35Å; E391-Q394 PolarHBondContact O-N 3.34Å; N392-Q394 PolarHBondContact O-N 3Å; Q394-N396 VanDerWaalsContact C-N 3.26Å; Q394-N396 PolarHBondContact O-N 3.08Å; Q394-N396 PolarHBondContact O-ND2 2.84Å; Q394-N396 VanDerWaalsContact O-ND2 3.16Å
395	Y	91	Very high	92.7	Very high	156 Å²	156	45.3 Å²	45.3	61%	0.612	20%	0.204	S	C	*	.	H	α-helix	trans	-79.7	-0.9	176.4	-63.4	-59	0	0	0	114.7	E391 N392 R393 L397	E391-Y395 HydrophobicContact CG-CD2 4.2Å; E391-Y395 HydrophobicContact CG-CE2 3.82Å; E391-Y395 WeakPolarHBondContact O-CD2 3.43Å; E391-Y395 PolarHBondContact O-N 2.93Å; N392-Y395 CarbonylContact O-C 3.53Å; N392-Y395 PolarHBondContact O-N 2.68Å; R393-Y395 VanDerWaalsContact C-N 3.3Å; R393-Y395 PolarHBondContact O-N 2.69Å; Y395-L397 VanDerWaalsContact C-N 3.26Å; Y395-L397 PolarHBondContact O-N 3.47Å
396	N	92.9	Very high	92.6	Very high	49 Å²	49	37.6 Å²	37.6	26%	0.262	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	42.1	-174.7	-58.9	-110.6	0	0	0	112	K380 I383 N392 R393 Q394	K380-N396 WeakPolarHBondContact CD-OD1 3.43Å; K380-N396 HydrophobicContact CG-CB 4.42Å; K380-N396 VanDerWaalsContact CG-OD1 3.24Å; K380-N396 WeakPolarHBondContact CG-OD1 3.44Å; I383-N396 VanDerWaalsContact CD1-O 3.32Å; I383-N396 WeakPolarHBondContact CD1-O 3.49Å; N392-N396 PolarHBondContact O-N 3.08Å; R393-N396 PolarHBondContact O-N 2.94Å; Q394-N396 VanDerWaalsContact C-N 3.26Å; Q394-N396 PolarHBondContact O-N 3.08Å; Q394-N396 PolarHBondContact O-ND2 2.84Å; Q394-N396 VanDerWaalsContact O-ND2 3.16Å
397	L	92.8	Very high	92.6	Very high	50 Å²	50	36.1 Å²	36.1	26%	0.262	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	147	174.9	-61.8	178.9	0	0	0	110.1	H355 L356 I383 N392 Y395	H355-L397 HydrophobicContact CB-CB 4.32Å; L356-L397 CarbonylContact O-C 3.58Å; L356-L397 WeakPolarHBondContact O-CA 3.35Å; I383-L397 VanDerWaalsContact CG2-O 3.23Å; I383-L397 WeakPolarHBondContact CG2-O 3.26Å; N392-L397 CarbonylContact C-O 3.49Å; N392-L397 HydrophobicContact CB-CB 4.42Å; N392-L397 PolarHBondContact O-N 2.83Å; Y395-L397 VanDerWaalsContact C-N 3.26Å; Y395-L397 PolarHBondContact O-N 3.47Å
398	M	94.7	Very high	92.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	122.5	170.6	179	176.6	-76.5	0	0	109.7	H355 L356 L361 I383 E387 F403 L406	H355-M398 CarbonylContact C-O 3.53Å; H355-M398 WeakPolarHBondContact CA-O 3.35Å; L356-M398 HydrophobicContact CB-CB 4.46Å; L356-M398 PolarHBondContact N-O 3.45Å; L356-M398 PolarHBondContact O-N 2.91Å; L361-M398 HydrophobicContact CD2-CE 4.43Å; I383-M398 HydrophobicContact CG1-CB 4.18Å; I383-M398 HydrophobicContact CG1-CE 4.16Å; I383-M398 HydrophobicContact CG2-CB 4.47Å; E387-M398 WeakPolarHBondContact OE2-CA 3.43Å; M398-F403 HydrophobicContact CG-CB 4.05Å; M398-F403 VanDerWaalsContact SD-CA 3.53Å; M398-F403 HydrophobicContact SD-CB 3.91Å; M398-F403 HydrophobicContact SD-CD2 4.02Å; M398-F403 HydrophobicContact SD-CG 4.48Å; M398-L406 HydrophobicContact CE-CB 4.23Å; M398-L406 HydrophobicContact CE-CD2 4.13Å; M398-L406 HydrophobicContact SD-CB 4.21Å; M398-L406 HydrophobicContact SD-CD2 3.91Å
399	G	93.5	Very high	92.5	Very high	4 Å²	4	37.5 Å²	37.5	4%	0.041	18%	0.176	C	C	.	.			trans	-87	-179.6	174.6	0	0	0	0	0	112.1	E387 D401 G402 F403	E387-G399 PolarHBondContact OE1-N 3.42Å; E387-G399 PolarHBondContact OE2-N 3.2Å; G399-D401 VanDerWaalsContact C-N 3.27Å; G399-D401 PolarHBondContact O-N 2.6Å; G399-G402 PolarHBondContact O-N 2.87Å; G399-F403 WeakPolarHBondContact O-CB 3.49Å; G399-F403 PolarHBondContact O-N 3.45Å
400	I	92.5	Very high	92.3	Very high	10 Å²	10	44 Å²	44	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-32.3	-177.3	-173	54.7	0	0	0	113.7	T338 I342 L346 T404	T338-I400 HydrophobicContact CG2-CG1 4.08Å; I342-I400 HydrophobicContact CB-CD1 4.24Å; I342-I400 HydrophobicContact CG2-CD1 3.64Å; L346-I400 HydrophobicContact CB-CD1 4.32Å; L346-I400 HydrophobicContact CD1-CB 4.13Å; L346-I400 HydrophobicContact CD1-CD1 4.09Å; I400-T404 WeakPolarHBondContact O-CB 3.26Å; I400-T404 PolarHBondContact O-N 2.83Å; I400-T404 PolarHBondContact O-OG1 2.88Å
401	D	92.2	Very high	92.3	Very high	15 Å²	15	40.8 Å²	40.8	8%	0.08	19%	0.191	C	C	.	.	H	α-helix	trans	-73	-45.8	178.1	-56.4	-61.9	0	0	0	111.3	R266 W269 F333 P388 G399 F403 T404 L405	R266-D401 IonicContact CZ-OD1 3.33Å; R266-D401 IonicContact CZ-OD2 2.77Å; R266-D401 IonicContact NE-OD1 2.9Å; R266-D401 IonicContact NE-OD2 3.77Å; R266-D401 PolarHBondContact NE-OD2 2.91Å; R266-D401 VanDerWaalsContact NH2-CG 3.35Å; R266-D401 IonicContact NH2-OD1 2.81Å; R266-D401 PolarHBondContact NH2-OD1 3.27Å; R266-D401 IonicContact NH2-OD2 2.77Å; R266-D401 PolarHBondContact NH2-OD2 3.42Å; W269-D401 HydrophobicContact CH2-CB 4.41Å; W269-D401 HydrophobicContact CZ3-CB 4.39Å; F333-D401 WeakPolarHBondContact CE1-OD1 3.46Å; P388-D401 HydrophobicContact CG-CB 4.17Å; G399-D401 VanDerWaalsContact C-N 3.27Å; G399-D401 PolarHBondContact O-N 2.6Å; D401-F403 PolarHBondContact O-N 2.8Å; D401-T404 WeakPolarHBondContact O-CB 3.46Å; D401-T404 PolarHBondContact O-N 2.9Å; D401-L405 WeakPolarHBondContact O-CG 3.23Å; D401-L405 PolarHBondContact O-N 2.81Å
402	G	93.7	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-35.9	174.8	0	0	0	0	0	113.4	Y386 E387 G399 L405 L406	Y386-G402 WeakPolarHBondContact O-CA 3.38Å; E387-G402 WeakPolarHBondContact OE2-CA 3.08Å; G399-G402 PolarHBondContact O-N 2.87Å; G402-L405 PolarHBondContact O-N 2.82Å; G402-L406 WeakPolarHBondContact O-CB 3.49Å; G402-L406 PolarHBondContact O-N 3.47Å
403	F	95.2	Very high	92.5	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69	-35.7	173.8	-172.2	-122.1	0	0	0	112.1	I342 I345 L346 L356 F364 M398 G399 D401 L406 L407	I342-F403 HydrophobicContact CG2-CD1 3.52Å; I342-F403 HydrophobicContact CG2-CE1 3.86Å; I345-F403 HydrophobicContact CB-CE1 4.24Å; I345-F403 HydrophobicContact CG2-CE1 3.85Å; I345-F403 HydrophobicContact CG2-CZ 3.83Å; L346-F403 HydrophobicContact CB-CD1 3.88Å; L346-F403 HydrophobicContact CB-CE1 4.09Å; L346-F403 HydrophobicContact CD1-CB 3.96Å; L346-F403 HydrophobicContact CD1-CD1 4.09Å; L346-F403 HydrophobicContact CD1-CG 4.25Å; L346-F403 HydrophobicContact CG-CD1 4.4Å; L356-F403 HydrophobicContact CD1-CD2 3.54Å; L356-F403 HydrophobicContact CD1-CE2 3.7Å; L356-F403 HydrophobicContact CD1-CG 4.03Å; L356-F403 HydrophobicContact CD1-CZ 4.31Å; F364-F403 HydrophobicContact CD1-CE2 4.13Å; F364-F403 HydrophobicContact CD2-CZ 4.4Å; F364-F403 AromaticContact CE1-CE2 3.77Å; F364-F403 HydrophobicContact CE1-CE2 3.77Å; F364-F403 HydrophobicContact CE1-CZ 4.13Å; F364-F403 HydrophobicContact CE2-CE2 4.34Å; F364-F403 AromaticContact CE2-CZ 3.9Å; F364-F403 HydrophobicContact CE2-CZ 3.9Å; F364-F403 AromaticContact CZ-CE2 3.87Å; F364-F403 HydrophobicContact CZ-CE2 3.87Å; F364-F403 AromaticContact CZ-CZ 3.73Å; F364-F403 HydrophobicContact CZ-CZ 3.73Å; M398-F403 HydrophobicContact CG-CB 4.05Å; M398-F403 VanDerWaalsContact SD-CA 3.53Å; M398-F403 HydrophobicContact SD-CB 3.91Å; M398-F403 HydrophobicContact SD-CD2 4.02Å; M398-F403 HydrophobicContact SD-CG 4.48Å; G399-F403 WeakPolarHBondContact O-CB 3.49Å; G399-F403 PolarHBondContact O-N 3.45Å; D401-F403 PolarHBondContact O-N 2.8Å; F403-L406 HydrophobicContact CD2-CD2 4.24Å; F403-L406 PolarHBondContact O-N 3.5Å; F403-L407 HydrophobicContact CD1-CD1 4.05Å; F403-L407 HydrophobicContact CE1-CD1 3.74Å; F403-L407 HydrophobicContact CE1-CG 4.44Å; F403-L407 HydrophobicContact CE2-CG 4.39Å; F403-L407 HydrophobicContact CZ-CD1 4Å; F403-L407 HydrophobicContact CZ-CD2 4.43Å; F403-L407 HydrophobicContact CZ-CG 4.28Å; F403-L407 WeakPolarHBondContact O-CB 3.35Å; F403-L407 WeakPolarHBondContact O-CG 3Å; F403-L407 PolarHBondContact O-N 2.98Å
404	T	92.9	Very high	92.6	Very high	5 Å²	5	35 Å²	35	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-42.8	171.5	-60.8	0	0	0	0	111.2	I342 I400 D401 L407 L408	I342-T404 HydrophobicContact CD1-CG2 4.01Å; I400-T404 WeakPolarHBondContact O-CB 3.26Å; I400-T404 PolarHBondContact O-N 2.83Å; I400-T404 PolarHBondContact O-OG1 2.88Å; D401-T404 WeakPolarHBondContact O-CB 3.46Å; D401-T404 PolarHBondContact O-N 2.9Å; T404-L407 PolarHBondContact O-N 3.31Å; T404-L408 HydrophobicContact CG2-CD1 3.97Å; T404-L408 WeakPolarHBondContact O-CB 3.35Å; T404-L408 WeakPolarHBondContact O-CG 3.49Å; T404-L408 PolarHBondContact O-N 3Å
405	L	92.2	Very high	92.8	Very high	48 Å²	48	30.4 Å²	30.4	25%	0.251	15%	0.146	S	C	.	.	H	α-helix	trans	-65.5	-39.1	175.2	-70.2	172.4	0	0	0	112.5	Y386 D401 G402 L408 S409	Y386-L405 WeakPolarHBondContact O-CD1 3.34Å; D401-L405 WeakPolarHBondContact O-CG 3.23Å; D401-L405 PolarHBondContact O-N 2.81Å; G402-L405 PolarHBondContact O-N 2.82Å; L405-L408 PolarHBondContact O-N 3.37Å; L405-S409 WeakPolarHBondContact O-CB 3.43Å; L405-S409 PolarHBondContact O-N 2.81Å; L405-S409 VanDerWaalsContact O-N 3.13Å
406	L	94.4	Very high	92.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.3	-48.5	173.2	176.7	68.5	0	0	0	111.3	L361 F365 Y386 M398 G402 F403 L408 S409 E411	L361-L406 HydrophobicContact CD1-CD2 3.71Å; F365-L406 HydrophobicContact CE2-CD2 4.25Å; F365-L406 HydrophobicContact CZ-CD1 4.35Å; F365-L406 HydrophobicContact CZ-CD2 4.18Å; Y386-L406 HydrophobicContact CD2-CB 4.34Å; Y386-L406 HydrophobicContact CD2-CD1 3.55Å; Y386-L406 HydrophobicContact CE2-CD1 3.68Å; Y386-L406 HydrophobicContact CG-CB 4.3Å; Y386-L406 HydrophobicContact CG-CD1 4.31Å; M398-L406 HydrophobicContact CE-CB 4.23Å; M398-L406 HydrophobicContact CE-CD2 4.13Å; M398-L406 HydrophobicContact SD-CB 4.21Å; M398-L406 HydrophobicContact SD-CD2 3.91Å; G402-L406 WeakPolarHBondContact O-CB 3.49Å; G402-L406 PolarHBondContact O-N 3.47Å; F403-L406 HydrophobicContact CD2-CD2 4.24Å; F403-L406 PolarHBondContact O-N 3.5Å; L406-L408 VanDerWaalsContact C-N 3.27Å; L406-L408 PolarHBondContact O-N 3.49Å; L406-S409 VanDerWaalsContact O-CB 3.26Å; L406-S409 WeakPolarHBondContact O-CB 3.37Å; L406-S409 PolarHBondContact O-N 2.91Å; L406-S409 PolarHBondContact O-OG 3.06Å; L406-E411 HydrophobicContact CD1-CB 4.44Å
407	L	93.6	Very high	92.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.8	-31.8	179.3	-74.4	172.9	0	0	0	112.8	I342 F364 F403 T404 S409 C412 F1037 H1039 F1056	I342-L407 HydrophobicContact CB-CD1 4.41Å; I342-L407 HydrophobicContact CD1-CD1 3.91Å; I342-L407 HydrophobicContact CG1-CD1 3.99Å; I342-L407 HydrophobicContact CG2-CD1 3.65Å; F364-L407 HydrophobicContact CZ-CD2 4Å; F403-L407 HydrophobicContact CD1-CD1 4.05Å; F403-L407 HydrophobicContact CE1-CD1 3.74Å; F403-L407 HydrophobicContact CE1-CG 4.44Å; F403-L407 HydrophobicContact CE2-CG 4.39Å; F403-L407 HydrophobicContact CZ-CD1 4Å; F403-L407 HydrophobicContact CZ-CD2 4.43Å; F403-L407 HydrophobicContact CZ-CG 4.28Å; F403-L407 WeakPolarHBondContact O-CB 3.35Å; F403-L407 WeakPolarHBondContact O-CG 3Å; F403-L407 PolarHBondContact O-N 2.98Å; T404-L407 PolarHBondContact O-N 3.31Å; L407-S409 VanDerWaalsContact C-N 3.29Å; L407-C412 HydrophobicContact CD2-CB 4.47Å; L407-C412 WeakPolarHBondContact O-CB 3.26Å; L407-F1037 HydrophobicContact CD2-CB 4.3Å; L407-H1039 PolarHBondContact O-ND1 2.89Å; L407-F1056 HydrophobicContact CD1-CE2 4.34Å; L407-F1056 HydrophobicContact CD1-CZ 4.1Å; L407-F1056 HydrophobicContact CD2-CE2 4.38Å
408	L	90.9	Very high	92.9	Very high	51 Å²	51	27.4 Å²	27.4	27%	0.267	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.8	174.3	-70.9	168.2	0	0	0	113.5	T404 L405 L406	T404-L408 HydrophobicContact CG2-CD1 3.97Å; T404-L408 WeakPolarHBondContact O-CB 3.35Å; T404-L408 WeakPolarHBondContact O-CG 3.49Å; T404-L408 PolarHBondContact O-N 3Å; L405-L408 PolarHBondContact O-N 3.37Å; L406-L408 VanDerWaalsContact C-N 3.27Å; L406-L408 PolarHBondContact O-N 3.49Å
409	S	91.5	Very high	92.9	Very high	17 Å²	17	28.6 Å²	28.6	12%	0.119	15%	0.153	C	C	.	.	S	Bend	trans	-85	169.7	-178.8	84	0	0	0	0	113.4	Y386 L405 L406 L407 E411 C412 D413	Y386-S409 VanDerWaalsContact CE1-CB 3.43Å; L405-S409 WeakPolarHBondContact O-CB 3.43Å; L405-S409 PolarHBondContact O-N 2.81Å; L405-S409 VanDerWaalsContact O-N 3.13Å; L406-S409 VanDerWaalsContact O-CB 3.26Å; L406-S409 WeakPolarHBondContact O-CB 3.37Å; L406-S409 PolarHBondContact O-N 2.91Å; L406-S409 PolarHBondContact O-OG 3.06Å; L407-S409 VanDerWaalsContact C-N 3.29Å; S409-E411 PolarHBondContact O-N 2.84Å; S409-E411 PolarHBondContact OG-N 3.35Å; S409-C412 CarbonylContact O-C 3.53Å; S409-C412 PolarHBondContact O-N 2.93Å; S409-D413 PolarHBondContact O-N 2.6Å
410	E	87.8	Confident	92.9	Very high	140 Å²	140	33.8 Å²	33.8	65%	0.654	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-61.2	-23.5	178.8	-57.8	-178	142	0	0	113.6	C412 D413	E410-C412 PolarHBondContact O-N 2.99Å; E410-D413 PolarHBondContact O-N 2.63Å
411	E	89.3	Confident	93	Very high	49 Å²	49	40.4 Å²	40.4	23%	0.229	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-64	-24.2	174.4	-56.6	-72.5	167.2	0	0	112.3	R371 L382 Y386 L406 S409 R1038	R371-E411 IonicContact CZ-OE2 3.68Å; R371-E411 IonicContact NH1-OE2 3.75Å; R371-E411 PolarHBondContact NH1-OE2 3Å; R371-E411 IonicContact NH2-OE2 2.73Å; R371-E411 PolarHBondContact NH2-OE2 3.02Å; L382-E411 HydrophobicContact CD2-CG 4.11Å; Y386-E411 HydrophobicContact CE2-CG 4.5Å; L406-E411 HydrophobicContact CD1-CB 4.44Å; S409-E411 PolarHBondContact O-N 2.84Å; S409-E411 PolarHBondContact OG-N 3.35Å; E411-R1038 PolarHBondContact O-NH1 2.82Å
412	C	93	Very high	93.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-118.8	16.3	-177.6	-74.3	0	0	0	0	113.6	L407 S409 E410 R1038 H1039	L407-C412 HydrophobicContact CD2-CB 4.47Å; L407-C412 WeakPolarHBondContact O-CB 3.26Å; S409-C412 CarbonylContact O-C 3.53Å; S409-C412 PolarHBondContact O-N 2.93Å; E410-C412 PolarHBondContact O-N 2.99Å; C412-R1038 VanDerWaalsContact O-CA 3.29Å; C412-R1038 WeakPolarHBondContact O-CA 3.35Å; C412-R1038 WeakPolarHBondContact O-CD 3.26Å; C412-H1039 PolarHBondContact O-N 3.12Å
413	D	93.7	Very high	93.3	Very high	18 Å²	18	44.9 Å²	44.9	10%	0.096	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-66.7	147.7	165	-162.9	-72.5	0	0	0	110.3	S409 E410 F415 R1038 R1041	S409-D413 PolarHBondContact O-N 2.6Å; E410-D413 PolarHBondContact O-N 2.63Å; D413-F415 VanDerWaalsContact C-N 3.29Å; D413-F415 PolarHBondContact O-N 3.38Å; D413-F415 WeakPolarHBondContact OD1-CB 3.43Å; D413-F415 PolarHBondContact OD1-N 3.06Å; D413-R1038 WeakPolarHBondContact O-CD 3.44Å; D413-R1038 PolarHBondContact O-NH1 2.85Å; D413-R1038 VanDerWaalsContact O-NH1 3.08Å; D413-R1041 IonicContact OD2-CZ 3.71Å; D413-R1041 IonicContact OD2-NE 3.86Å; D413-R1041 PolarHBondContact OD2-NE 3.33Å; D413-R1041 IonicContact OD2-NH2 2.77Å; D413-R1041 PolarHBondContact OD2-NH2 3.28Å
414	I	95.6	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-62.8	-31.9	175.8	-174.7	166.8	0	0	0	113.2	F1010 V1028 L1033 L1034 R1038 H1039 V1040 V1057 I1059	I414-F1010 HydrophobicContact CD1-CE2 3.68Å; I414-F1010 HydrophobicContact CD1-CZ 3.67Å; I414-V1028 HydrophobicContact CG2-CG2 4.29Å; I414-L1033 HydrophobicContact CD1-CD2 3.71Å; I414-L1033 HydrophobicContact CG1-CD2 3.73Å; I414-L1034 PolarHBondContact O-N 3.4Å; I414-L1034 VanDerWaalsContact O-N 3.08Å; I414-R1038 HydrophobicContact CB-CB 4.1Å; I414-H1039 PolarHBondContact N-O 2.89Å; I414-V1040 HydrophobicContact CB-CG2 4.21Å; I414-V1040 HydrophobicContact CD1-CG2 3.6Å; I414-V1040 HydrophobicContact CG2-CB 4.39Å; I414-V1040 HydrophobicContact CG2-CG1 4.32Å; I414-V1040 HydrophobicContact CG2-CG2 4.1Å; I414-V1057 HydrophobicContact CD1-CG2 4.48Å; I414-I1059 HydrophobicContact CD1-CD1 3.55Å; I414-I1059 HydrophobicContact CG1-CD1 3.66Å
415	F	95.1	Very high	93.2	Very high	27 Å²	27	49.4 Å²	49.4	12%	0.118	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-85	119.4	-174.3	-169.7	-84.3	0	0	0	111.1	D413 P417 H419 L420 A891 V1028 C1032	D413-F415 VanDerWaalsContact C-N 3.29Å; D413-F415 PolarHBondContact O-N 3.38Å; D413-F415 WeakPolarHBondContact OD1-CB 3.43Å; D413-F415 PolarHBondContact OD1-N 3.06Å; F415-P417 WeakPolarHBondContact O-CD 3.21Å; F415-H419 HydrophobicContact CE1-CB 3.73Å; F415-H419 HydrophobicContact CZ-CB 3.84Å; F415-L420 HydrophobicContact CD1-CD2 3.79Å; F415-L420 HydrophobicContact CD1-CG 4.09Å; F415-L420 HydrophobicContact CE1-CD2 3.66Å; F415-L420 HydrophobicContact CE1-CG 4.01Å; F415-A891 HydrophobicContact CE2-CB 4.04Å; F415-A891 HydrophobicContact CZ-CB 4.32Å; F415-V1028 HydrophobicContact CD2-CG1 4.03Å; F415-C1032 HydrophobicContact CD2-CB 4.24Å; F415-C1032 HydrophobicContact CE2-CB 3.98Å; F415-C1032 HydrophobicContact CZ-CB 4.38Å
416	N	93.5	Very high	93.4	Very high	34 Å²	34	47.2 Å²	47.2	18%	0.182	25%	0.251	C	S	.	.			trans	-58.1	116	179.9	176.2	-1.1	0	0	0	111.4	V418 H419 C1032 L1034	N416-V418 PolarHBondContact O-N 3.4Å; N416-V418 VanDerWaalsContact O-N 3.09Å; N416-V418 WeakPolarHBondContact OD1-CB 3.5Å; N416-V418 WeakPolarHBondContact OD1-CG2 3.09Å; N416-V418 PolarHBondContact OD1-N 3.39Å; N416-V418 VanDerWaalsContact OD1-N 3.15Å; N416-H419 PolarHBondContact O-N 2.96Å; N416-C1032 WeakPolarHBondContact CB-O 3.23Å; N416-C1032 PolarHBondContact N-O 3.08Å; N416-L1034 HydrophobicContact CB-CD1 4.43Å; N416-L1034 HydrophobicContact CB-CD2 3.75Å; N416-L1034 HydrophobicContact CB-CG 3.86Å
417	P	92.4	Very high	93.2	Very high	69 Å²	69	48.7 Å²	48.7	45%	0.448	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-65.7	-18	-171.8	26.2	-34.6	0	0	0	113.7	F415 H419 L420	F415-P417 WeakPolarHBondContact O-CD 3.21Å; P417-H419 PolarHBondContact O-N 3.31Å; P417-L420 HydrophobicContact CB-CD1 4.05Å; P417-L420 WeakPolarHBondContact O-CB 3.44Å; P417-L420 PolarHBondContact O-N 2.84Å
418	V	92.8	Very high	92.9	Very high	88 Å²	88	49.3 Å²	49.3	53%	0.533	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-57.1	-35.2	171.8	177	0	0	0	0	111.2	N416 L420 Q421 C423	N416-V418 PolarHBondContact O-N 3.4Å; N416-V418 VanDerWaalsContact O-N 3.09Å; N416-V418 WeakPolarHBondContact OD1-CB 3.5Å; N416-V418 WeakPolarHBondContact OD1-CG2 3.09Å; N416-V418 PolarHBondContact OD1-N 3.39Å; N416-V418 VanDerWaalsContact OD1-N 3.15Å; V418-L420 VanDerWaalsContact C-N 3.32Å; V418-L420 PolarHBondContact O-N 2.8Å; V418-Q421 PolarHBondContact O-N 3.33Å; V418-C423 HydrophobicContact CG1-CB 3.78Å; V418-C423 WeakPolarHBondContact O-CB 3.47Å
419	H	95.5	Very high	92.7	Very high	25 Å²	25	47.2 Å²	47.2	12%	0.116	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-83.2	-2.9	179.6	-63.4	-91	0	0	0	114.2	F415 N416 P417 Q421 C423 R892 N893 G894	F415-H419 HydrophobicContact CE1-CB 3.73Å; F415-H419 HydrophobicContact CZ-CB 3.84Å; N416-H419 PolarHBondContact O-N 2.96Å; P417-H419 PolarHBondContact O-N 3.31Å; H419-Q421 CarbonylContact C-O 3.55Å; H419-Q421 PolarHBondContact O-N 3.09Å; H419-C423 PolarHBondContact ND1-SG 3.13Å; H419-R892 HydrophobicContact CB-CB 4.38Å; H419-N893 PolarHBondContact O-N 3.08Å; H419-G894 PolarHBondContact O-N 2.95Å
420	L	93.5	Very high	92.7	Very high	114 Å²	114	46.5 Å²	46.5	60%	0.597	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-74.2	-11.9	168.6	-61.3	173	0	0	0	112	F415 P417 V418	F415-L420 HydrophobicContact CD1-CD2 3.79Å; F415-L420 HydrophobicContact CD1-CG 4.09Å; F415-L420 HydrophobicContact CE1-CD2 3.66Å; F415-L420 HydrophobicContact CE1-CG 4.01Å; P417-L420 HydrophobicContact CB-CD1 4.05Å; P417-L420 WeakPolarHBondContact O-CB 3.44Å; P417-L420 PolarHBondContact O-N 2.84Å; V418-L420 VanDerWaalsContact C-N 3.32Å; V418-L420 PolarHBondContact O-N 2.8Å
421	Q	94.8	Very high	92.8	Very high	148 Å²	148	39.9 Å²	39.9	69%	0.692	22%	0.218	S	C	*	.	S	Bend	trans	-116.7	167.5	170	-59.5	-176.2	32.5	0	0	110	V418 H419 C423 N893 G894	V418-Q421 PolarHBondContact O-N 3.33Å; H419-Q421 CarbonylContact C-O 3.55Å; H419-Q421 PolarHBondContact O-N 3.09Å; Q421-C423 PolarHBondContact O-N 3.5Å; Q421-N893 CarbonylContact O-C 3.59Å; Q421-G894 VanDerWaalsContact C-CA 3.47Å; Q421-G894 WeakPolarHBondContact O-CA 3.49Å; Q421-G894 PolarHBondContact O-N 2.88Å
422	V	96.3	Very high	92.9	Very high	58 Å²	58	38 Å²	38	35%	0.352	21%	0.209	S	C	.	.			trans	-70	112.7	173.5	-176.3	0	0	0	0	108	M426 Y511 N893 C896	V422-M426 HydrophobicContact CG1-CG 3.56Å; V422-M426 HydrophobicContact CG1-SD 4.13Å; V422-Y511 HydrophobicContact CG1-CE2 4.3Å; V422-Y511 HydrophobicContact CG2-CE2 4.02Å; V422-N893 WeakPolarHBondContact CA-OD1 3.4Å; V422-C896 HydrophobicContact CG2-CB 4.12Å
423	C	94.4	Very high	93.1	Very high	52 Å²	52	38 Å²	38	35%	0.351	21%	0.209	S	C	.	.			trans	-127.5	-11	-168.1	69.4	0	0	0	0	113.4	V418 H419 Q421 N893	V418-C423 HydrophobicContact CG1-CB 3.78Å; V418-C423 WeakPolarHBondContact O-CB 3.47Å; H419-C423 PolarHBondContact ND1-SG 3.13Å; Q421-C423 PolarHBondContact O-N 3.5Å; C423-N893 PolarHBondContact N-OD1 3.36Å
424	Q	94.5	Very high	93.3	Very high	43 Å²	43	37.2 Å²	37.2	20%	0.201	21%	0.205	C	C	.	.	S	Bend	trans	-89.3	160	174.7	-61.3	-173.6	-38	0	0	110.4	M426 N893 L900	Q424-M426 PolarHBondContact O-N 2.78Å; Q424-N893 WeakPolarHBondContact CB-OD1 3.32Å; Q424-N893 HydrophobicContact CG-CB 4.12Å; Q424-N893 PolarHBondContact N-OD1 2.96Å; Q424-L900 HydrophobicContact CB-CB 4.31Å
425	D	92.8	Very high	93.4	Very high	56 Å²	56	37.3 Å²	37.3	30%	0.299	21%	0.205	S	C	.	.			trans	-63.7	123.6	170	177.9	22.5	0	0	0	110.2	S427 Q428 Y433 L900	D425-S427 WeakPolarHBondContact OD1-CB 3.49Å; D425-S427 PolarHBondContact OD1-N 3.17Å; D425-S427 PolarHBondContact OD1-OG 2.81Å; D425-S427 PolarHBondContact OD2-OG 3.18Å; D425-Q428 WeakPolarHBondContact OD2-CG 3.35Å; D425-Q428 PolarHBondContact OD2-NE2 2.77Å; D425-Y433 WeakPolarHBondContact O-CE1 3.38Å; D425-Y433 PolarHBondContact O-OH 3.47Å; D425-L900 HydrophobicContact CB-CD2 4.37Å
426	M	95	Very high	93.5	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	20%	0.2	C	C	.	.			trans	-104	7.9	179	-61	-54.8	-73.6	0	0	113	V422 Q424 Y433 Y511 S605 P606 R607 N893 Y898	V422-M426 HydrophobicContact CG1-CG 3.56Å; V422-M426 HydrophobicContact CG1-SD 4.13Å; Q424-M426 PolarHBondContact O-N 2.78Å; M426-Y433 VanDerWaalsContact C-OH 3.24Å; M426-Y433 WeakPolarHBondContact CA-OH 3.47Å; M426-Y433 HydrophobicContact CE-CE1 4.43Å; M426-Y433 HydrophobicContact SD-CE1 3.9Å; M426-Y511 HydrophobicContact CB-CE1 3.88Å; M426-Y511 HydrophobicContact CE-CD1 3.49Å; M426-Y511 VanDerWaalsContact CE-CD1 3.49Å; M426-Y511 HydrophobicContact CE-CD2 4.15Å; M426-Y511 HydrophobicContact CE-CE1 3.48Å; M426-Y511 VanDerWaalsContact CE-CE1 3.48Å; M426-Y511 HydrophobicContact CE-CE2 4.18Å; M426-Y511 HydrophobicContact CE-CG 3.86Å; M426-Y511 HydrophobicContact CG-CE1 3.97Å; M426-S605 WeakPolarHBondContact O-CB 3.47Å; M426-S605 PolarHBondContact O-OG 2.99Å; M426-P606 HydrophobicContact CE-CB 3.9Å; M426-P606 HydrophobicContact CE-CG 4.41Å; M426-R607 HydrophobicContact CB-CB 4.32Å; M426-R607 WeakPolarHBondContact O-CB 3.41Å; M426-R607 PolarHBondContact O-N 2.77Å; M426-R607 VanDerWaalsContact O-N 3.09Å; M426-N893 PolarHBondContact SD-ND2 3.5Å; M426-N893 VanDerWaalsContact SD-ND2 3.35Å; M426-Y898 HydrophobicContact CE-CG 4.36Å
427	S	90.6	Very high	93.7	Very high	31 Å²	31	34.6 Å²	34.6	22%	0.217	19%	0.192	C	C	.	.			trans	-99.1	1	-179.9	67.7	0	0	0	0	115.3	D425 S553 S605	D425-S427 WeakPolarHBondContact OD1-CB 3.49Å; D425-S427 PolarHBondContact OD1-N 3.17Å; D425-S427 PolarHBondContact OD1-OG 2.81Å; D425-S427 PolarHBondContact OD2-OG 3.18Å; S427-S553 WeakPolarHBondContact O-CB 3.35Å; S427-S605 WeakPolarHBondContact O-CB 3.26Å
428	Q	88.4	Confident	93.9	Very high	13 Å²	13	31.4 Å²	31.4	6%	0.061	17%	0.171	C	C	.	.	S	Bend	trans	-72.9	160.7	174.6	-59.2	-66.2	-56.1	0	0	111.2	D425 H432 Y433 S555 S605 P606 L900	D425-Q428 WeakPolarHBondContact OD2-CG 3.35Å; D425-Q428 PolarHBondContact OD2-NE2 2.77Å; Q428-H432 HydrophobicContact CB-CB 3.95Å; Q428-H432 PolarHBondContact OE1-ND1 3.3Å; Q428-Y433 HydrophobicContact CB-CE2 3.84Å; Q428-Y433 WeakPolarHBondContact CB-OH 3.27Å; Q428-Y433 PolarHBondContact N-OH 3.02Å; Q428-Y433 VanDerWaalsContact N-OH 3.16Å; Q428-Y433 WeakPolarHBondContact O-CE2 3.31Å; Q428-S555 VanDerWaalsContact CD-OG 3.29Å; Q428-S555 PolarHBondContact NE2-OG 3.06Å; Q428-S555 PolarHBondContact OE1-OG 3Å; Q428-S605 WeakPolarHBondContact O-CA 3.46Å; Q428-S605 WeakPolarHBondContact O-CB 3.46Å; Q428-P606 WeakPolarHBondContact O-CD 3.43Å; Q428-L900 HydrophobicContact CB-CD1 4.03Å; Q428-L900 HydrophobicContact CG-CD1 3.76Å
429	P	87	Confident	93.9	Very high	8 Å²	8	28.1 Å²	28.1	5%	0.052	15%	0.15	C	C	.	.			trans	-38.7	137.8	164.3	-34.9	34.9	0	0	0	114.4	T431 H432 Y433 Q556 W603	P429-T431 PolarHBondContact O-N 2.94Å; P429-T431 VanDerWaalsContact O-N 3.08Å; P429-H432 HydrophobicContact CB-CB 4.37Å; P429-H432 VanDerWaalsContact O-CB 3.27Å; P429-H432 WeakPolarHBondContact O-CB 3.47Å; P429-H432 PolarHBondContact O-N 2.85Å; P429-Y433 WeakPolarHBondContact O-CD2 3.32Å; P429-Y433 VanDerWaalsContact O-CE2 3.31Å; P429-Y433 WeakPolarHBondContact O-CE2 3.3Å; P429-Q556 HydrophobicContact CG-CG 3.89Å; P429-W603 HydrophobicContact CB-CB 4.01Å
430	I	90.8	Very high	93.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-56.1	-28.9	174.9	-164.6	169.6	0	0	0	113.3	H432 Y433 I435 W603 P604 L609 L844 Y898	I430-H432 PolarHBondContact O-N 3.4Å; I430-Y433 PolarHBondContact O-N 3.39Å; I430-I435 HydrophobicContact CG1-CD1 4.4Å; I430-W603 HydrophobicContact CG2-CB 4.24Å; I430-W603 HydrophobicContact CG2-CD2 3.94Å; I430-W603 HydrophobicContact CG2-CE3 3.59Å; I430-W603 HydrophobicContact CG2-CG 4.25Å; I430-W603 HydrophobicContact CG2-CZ3 4.26Å; I430-P604 PolarHBondContact N-O 2.83Å; I430-L609 HydrophobicContact CD1-CD1 4.24Å; I430-L844 HydrophobicContact CG2-CD1 4.38Å; I430-Y898 HydrophobicContact CD1-CE1 4.42Å; I430-Y898 HydrophobicContact CG1-CE1 4.21Å
431	T	90.3	Very high	93.6	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.012	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-66.2	-17.4	173.9	54.7	0	0	0	0	114.4	P429 Y433 W603 R841 L844 Q870 K901	P429-T431 PolarHBondContact O-N 2.94Å; P429-T431 VanDerWaalsContact O-N 3.08Å; T431-Y433 VanDerWaalsContact C-N 3.29Å; T431-Y433 PolarHBondContact O-N 3.26Å; T431-W603 HydrophobicContact CG2-CD2 4.11Å; T431-W603 HydrophobicContact CG2-CG 4.07Å; T431-W603 HydrophobicContact CG2-CZ2 4.22Å; T431-W603 VanDerWaalsContact CG2-NE1 3.29Å; T431-R841 VanDerWaalsContact CB-O 3.27Å; T431-R841 WeakPolarHBondContact CB-O 3.31Å; T431-R841 PolarHBondContact OG1-O 3.06Å; T431-L844 HydrophobicContact CG2-CD2 4.01Å; T431-L844 HydrophobicContact CG2-CG 4.02Å; T431-Q870 PolarHBondContact O-NE2 2.69Å; T431-Q870 VanDerWaalsContact O-NE2 3.08Å; T431-K901 WeakPolarHBondContact O-CE 3.46Å; T431-K901 PolarHBondContact O-NZ 2.83Å
432	H	91.9	Very high	93.5	Very high	10 Å²	10	16.5 Å²	16.5	5%	0.046	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-82.8	4.7	178.6	-75.9	-177.6	0	0	0	114	Q428 P429 I430 L900 K901 R906	Q428-H432 HydrophobicContact CB-CB 3.95Å; Q428-H432 PolarHBondContact OE1-ND1 3.3Å; P429-H432 HydrophobicContact CB-CB 4.37Å; P429-H432 VanDerWaalsContact O-CB 3.27Å; P429-H432 WeakPolarHBondContact O-CB 3.47Å; P429-H432 PolarHBondContact O-N 2.85Å; I430-H432 PolarHBondContact O-N 3.4Å; H432-L900 HydrophobicContact CB-CD1 4.29Å; H432-K901 VanDerWaalsContact O-CB 3.26Å; H432-K901 WeakPolarHBondContact O-CB 3.49Å; H432-K901 VanDerWaalsContact O-CG 3.22Å; H432-K901 WeakPolarHBondContact O-CG 3.48Å; H432-K901 PolarHBondContact O-N 3.01Å; H432-R906 HydrophobicContact CB-CG 4.11Å
433	Y	96.2	Very high	93.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	153.3	178.7	-58.8	-96.4	0	0	0	112.4	D425 M426 Q428 P429 I430 T431 P606 Q870 Y898 V899 L900	D425-Y433 WeakPolarHBondContact O-CE1 3.38Å; D425-Y433 PolarHBondContact O-OH 3.47Å; M426-Y433 VanDerWaalsContact C-OH 3.24Å; M426-Y433 WeakPolarHBondContact CA-OH 3.47Å; M426-Y433 HydrophobicContact CE-CE1 4.43Å; M426-Y433 HydrophobicContact SD-CE1 3.9Å; Q428-Y433 HydrophobicContact CB-CE2 3.84Å; Q428-Y433 WeakPolarHBondContact CB-OH 3.27Å; Q428-Y433 PolarHBondContact N-OH 3.02Å; Q428-Y433 VanDerWaalsContact N-OH 3.16Å; Q428-Y433 WeakPolarHBondContact O-CE2 3.31Å; P429-Y433 WeakPolarHBondContact O-CD2 3.32Å; P429-Y433 VanDerWaalsContact O-CE2 3.31Å; P429-Y433 WeakPolarHBondContact O-CE2 3.3Å; I430-Y433 PolarHBondContact O-N 3.39Å; T431-Y433 VanDerWaalsContact C-N 3.29Å; T431-Y433 PolarHBondContact O-N 3.26Å; Y433-P606 HydrophobicContact CD2-CG 3.69Å; Y433-P606 HydrophobicContact CE1-CG 4.43Å; Y433-P606 VanDerWaalsContact CE2-CD 3.45Å; Y433-P606 HydrophobicContact CE2-CG 3.54Å; Y433-P606 HydrophobicContact CG-CG 4.24Å; Y433-Q870 WeakPolarHBondContact O-CB 3.47Å; Y433-Q870 WeakPolarHBondContact O-CG 3.49Å; Y433-Y898 HydrophobicContact CG-CD1 4.15Å; Y433-V899 CarbonylContact C-O 3.57Å; Y433-V899 VanDerWaalsContact CA-O 3.3Å; Y433-V899 WeakPolarHBondContact CA-O 3.28Å; Y433-L900 HydrophobicContact CD1-CB 4.07Å; Y433-L900 HydrophobicContact CD1-CD1 4.16Å; Y433-L900 HydrophobicContact CE1-CB 3.88Å; Y433-L900 HydrophobicContact CE1-CD1 3.68Å; Y433-L900 HydrophobicContact CE1-CG 4.36Å; Y433-L900 HydrophobicContact CE2-CD1 4.28Å
434	Y	97.5	Very high	92.7	Very high	1 Å²	1	13.1 Å²	13.1	0%	0.004	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.1	156	-55.3	-68.8	0	0	0	108.8	W865 G869 F889 V899 K901 L1005	Y434-W865 HydrophobicContact CD1-CB 4.1Å; Y434-W865 AromaticContact CD1-CD1 3.24Å; Y434-W865 AromaticContact CD1-CG 3.74Å; Y434-W865 HydrophobicContact CD1-CG 3.74Å; Y434-W865 AromaticContact CD1-NE1 3.83Å; Y434-W865 HydrophobicContact CE1-CB 3.63Å; Y434-W865 AromaticContact CE1-CD1 3.62Å; Y434-W865 AromaticContact CE1-CG 3.82Å; Y434-W865 HydrophobicContact CE1-CG 3.82Å; Y434-W865 HydrophobicContact CG-CG 4.31Å; Y434-W865 PolarHBondContact OH-O 2.78Å; Y434-G869 WeakPolarHBondContact CD1-O 3.42Å; Y434-F889 AromaticContact CD2-CE1 3.95Å; Y434-F889 HydrophobicContact CD2-CE1 3.95Å; Y434-F889 AromaticContact CD2-CZ 3.7Å; Y434-F889 HydrophobicContact CD2-CZ 3.7Å; Y434-F889 HydrophobicContact CE2-CZ 4.05Å; Y434-F889 HydrophobicContact CG-CE1 4.25Å; Y434-F889 HydrophobicContact CG-CZ 4.27Å; Y434-V899 HydrophobicContact CD2-CG1 4.48Å; Y434-V899 PolarHBondContact N-O 3.28Å; Y434-V899 PolarHBondContact O-N 3.35Å; Y434-K901 HydrophobicContact CD1-CG 4.43Å; Y434-K901 HydrophobicContact CD2-CG 4.14Å; Y434-K901 HydrophobicContact CE1-CG 4.1Å; Y434-K901 HydrophobicContact CE2-CB 4.26Å; Y434-K901 HydrophobicContact CE2-CG 3.77Å; Y434-K901 HydrophobicContact CG-CG 4.47Å; Y434-L1005 HydrophobicContact CE2-CD2 3.88Å
435	I	98	Very high	92	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.005	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.5	-172	-52.6	-176.6	0	0	0	108.9	I430 S437 R466 I514 L844 Q870 I871 F890 Y898	I430-I435 HydrophobicContact CG1-CD1 4.4Å; I435-S437 PolarHBondContact O-N 2.87Å; I435-S437 PolarHBondContact O-OG 2.83Å; I435-R466 HydrophobicContact CG2-CB 3.86Å; I435-I514 HydrophobicContact CD1-CD1 4.42Å; I435-L844 HydrophobicContact CD1-CD2 4.46Å; I435-Q870 HydrophobicContact CG1-CB 4.42Å; I435-Q870 PolarHBondContact N-O 2.94Å; I435-I871 HydrophobicContact CB-CG1 4.32Å; I435-I871 HydrophobicContact CD1-CD1 4.43Å; I435-I871 HydrophobicContact CD1-CG1 3.98Å; I435-F890 WeakPolarHBondContact O-CZ 3.05Å; I435-Y898 HydrophobicContact CB-CE1 4.47Å; I435-Y898 HydrophobicContact CD1-CE1 3.75Å; I435-Y898 HydrophobicContact CG1-CD1 4.04Å; I435-Y898 HydrophobicContact CG1-CE1 3.67Å; I435-Y898 HydrophobicContact CG2-CE1 4.18Å
436	A	98	Very high	91.1	Very high	2 Å²	2	15.4 Å²	15.4	2%	0.017	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	114.1	175.4	0	0	0	0	0	109.5	C465 R466 Y467 F890 G897	A436-C465 PolarHBondContact O-SG 2.67Å; A436-R466 PolarHBondContact O-N 2.76Å; A436-Y467 PolarHBondContact O-N 3.01Å; A436-Y467 VanDerWaalsContact O-N 3.1Å; A436-F890 VanDerWaalsContact CA-CZ 3.5Å; A436-F890 HydrophobicContact CB-CD1 3.95Å; A436-F890 HydrophobicContact CB-CD2 3.91Å; A436-F890 HydrophobicContact CB-CE1 3.99Å; A436-F890 HydrophobicContact CB-CE2 3.93Å; A436-F890 HydrophobicContact CB-CG 3.94Å; A436-F890 HydrophobicContact CB-CZ 4Å; A436-F890 VanDerWaalsContact N-CZ 3.33Å; A436-G897 PolarHBondContact N-O 3.27Å
437	S	97.8	Very high	90	Very high	3 Å²	3	16 Å²	16	2%	0.021	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.5	-167.4	-48.5	0	0	0	0	113.9	I435 L874 Y876	I435-S437 PolarHBondContact O-N 2.87Å; I435-S437 PolarHBondContact O-OG 2.83Å; S437-L874 PolarHBondContact O-N 2.81Å; S437-Y876 VanDerWaalsContact O-CE2 3.28Å; S437-Y876 WeakPolarHBondContact O-CE2 3.08Å
438	S	96	Very high	88.9	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.007	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.2	178	171.2	0	0	0	0	111	T441 C465 Y467 L874	S438-T441 WeakPolarHBondContact CB-OG1 3.45Å; S438-T441 WeakPolarHBondContact OG-CA 3.34Å; S438-T441 WeakPolarHBondContact OG-CB 3.39Å; S438-T441 WeakPolarHBondContact OG-CG2 3.46Å; S438-T441 PolarHBondContact OG-OG1 3.44Å; S438-C465 PolarHBondContact N-SG 3.43Å; S438-C465 VanDerWaalsContact N-SG 3.38Å; S438-Y467 PolarHBondContact N-O 3.43Å; S438-L874 CarbonylContact C-O 3.55Å; S438-L874 WeakPolarHBondContact CA-O 3.37Å
439	H	92.8	Very high	88.1	Confident	20 Å²	20	21.5 Å²	21.5	9%	0.093	11%	0.112	C	C	.	.	S	Bend	trans	-87.7	135.4	167.5	178.4	-116.6	0	0	0	109.4	T441 E469 P849 L874 N875	H439-T441 VanDerWaalsContact C-N 3.32Å; H439-T441 PolarHBondContact O-N 3.41Å; H439-E469 VanDerWaalsContact CA-OE2 3.27Å; H439-E469 WeakPolarHBondContact CA-OE2 3.33Å; H439-E469 IonicContact CD2-OE1 3.33Å; H439-E469 IonicContact CD2-OE2 3.45Å; H439-E469 PolarHBondContact CD2-OE2 3.03Å; H439-E469 IonicContact CG-OE2 2.72Å; H439-P849 HydrophobicContact CB-CG 4.21Å; H439-L874 PolarHBondContact N-O 3.33Å; H439-N875 PolarHBondContact ND1-OD1 3.3Å
440	K	90.4	Very high	87.4	Confident	38 Å²	38	21.3 Å²	21.3	17%	0.165	11%	0.111	C	C	.	.	S	Bend	trans	41.9	54.9	176	-65.5	173.4	-172.5	-113.3	0	113.3	F442 L443 E469 E471	K440-F442 HydrophobicContact CB-CE1 3.94Å; K440-F442 HydrophobicContact CB-CZ 3.99Å; K440-F442 HydrophobicContact CG-CE1 4.24Å; K440-F442 HydrophobicContact CG-CZ 4.21Å; K440-F442 PolarHBondContact O-N 3.5Å; K440-L443 HydrophobicContact CB-CD1 3.98Å; K440-L443 HydrophobicContact CB-CG 4.41Å; K440-L443 HydrophobicContact CD-CD1 4.4Å; K440-L443 PolarHBondContact O-N 3.13Å; K440-E469 PolarHBondContact N-OE2 3.35Å; K440-E471 IonicContact NZ-OE1 2.66Å; K440-E471 PolarHBondContact NZ-OE1 3.31Å
441	T	93.1	Very high	87	Confident	4 Å²	4	24.2 Å²	24.2	3%	0.025	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-17.4	-168.5	-44.3	0	0	0	0	115.1	S438 H439 G456 Y457 A460 I468 E469	S438-T441 WeakPolarHBondContact CB-OG1 3.45Å; S438-T441 WeakPolarHBondContact OG-CA 3.34Å; S438-T441 WeakPolarHBondContact OG-CB 3.39Å; S438-T441 WeakPolarHBondContact OG-CG2 3.46Å; S438-T441 PolarHBondContact OG-OG1 3.44Å; H439-T441 VanDerWaalsContact C-N 3.32Å; H439-T441 PolarHBondContact O-N 3.41Å; T441-G456 CarbonylContact O-C 3.6Å; T441-G456 VanDerWaalsContact O-C 3.22Å; T441-G456 WeakPolarHBondContact O-CA 3.38Å; T441-Y457 HydrophobicContact CG2-CD1 3.57Å; T441-Y457 HydrophobicContact CG2-CE1 3.94Å; T441-Y457 HydrophobicContact CG2-CG 4.21Å; T441-A460 HydrophobicContact CG2-CB 3.74Å; T441-I468 HydrophobicContact CG2-CB 4.22Å; T441-I468 HydrophobicContact CG2-CG2 3.89Å; T441-E469 PolarHBondContact OG1-N 3.38Å
442	F	91.9	Very high	86.9	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-13.2	175	56.7	-89.5	0	0	0	114.8	K440 C452 S453 Y457 E471 V482 R484 I492	K440-F442 HydrophobicContact CB-CE1 3.94Å; K440-F442 HydrophobicContact CB-CZ 3.99Å; K440-F442 HydrophobicContact CG-CE1 4.24Å; K440-F442 HydrophobicContact CG-CZ 4.21Å; K440-F442 PolarHBondContact O-N 3.5Å; F442-C452 HydrophobicContact CD2-CB 4.13Å; F442-C452 CarbonylContact O-C 3.57Å; F442-C452 VanDerWaalsContact O-CA 3.28Å; F442-C452 WeakPolarHBondContact O-CA 3.48Å; F442-S453 PolarHBondContact O-N 3.46Å; F442-Y457 HydrophobicContact CB-CE2 3.72Å; F442-E471 HydrophobicContact CE1-CB 3.86Å; F442-E471 HydrophobicContact CE1-CG 3.94Å; F442-E471 HydrophobicContact CZ-CB 3.87Å; F442-E471 HydrophobicContact CZ-CG 3.85Å; F442-E471 WeakPolarHBondContact CZ-OE1 3.29Å; F442-V482 HydrophobicContact CB-CG1 3.83Å; F442-V482 HydrophobicContact CD1-CG1 3.82Å; F442-V482 HydrophobicContact CD2-CG1 4.4Å; F442-V482 HydrophobicContact CG-CG1 3.75Å; F442-R484 HydrophobicContact CE2-CB 4.04Å; F442-I492 HydrophobicContact CB-CD1 4.2Å
443	L	88.3	Confident	86.9	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.016	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-86.4	133.6	-178.5	-67.9	175.6	0	0	0	112.3	K440 R484	K440-L443 HydrophobicContact CB-CD1 3.98Å; K440-L443 HydrophobicContact CB-CG 4.41Å; K440-L443 HydrophobicContact CD-CD1 4.4Å; K440-L443 PolarHBondContact O-N 3.13Å; L443-R484 HydrophobicContact CD2-CB 4.4Å
444	L	85.5	Confident	86.7	Confident	37 Å²	37	29.6 Å²	29.6	19%	0.194	16%	0.164	C	C	.	.	S	Bend	trans	-98.1	-10.3	172.9	-64	-174.9	0	0	0	114.6	P451 S453 E455 Q877	L444-P451 HydrophobicContact CB-CG 4.37Å; L444-P451 PolarHBondContact N-O 3.09Å; L444-P451 VanDerWaalsContact N-O 3.15Å; L444-S453 VanDerWaalsContact CD1-CB 3.43Å; L444-E455 HydrophobicContact CD2-CB 4.49Å; L444-Q877 WeakPolarHBondContact O-CB 3.37Å
445	E	80.2	Confident	86.5	Confident	116 Å²	116	33.2 Å²	33.2	54%	0.542	18%	0.181	S	C	.	.	S	Bend	trans	-143.4	-135	-178.5	-57.7	-179.9	155.2	0	0	111.5	P451 S856 Q877	E445-P451 VanDerWaalsContact OE2-CD 3.28Å; E445-P451 WeakPolarHBondContact OE2-CD 3.5Å; E445-S856 PolarHBondContact O-OG 3.44Å; E445-Q877 VanDerWaalsContact O-CG 3.29Å; E445-Q877 WeakPolarHBondContact O-CG 3.18Å; E445-Q877 PolarHBondContact O-NE2 3.46Å
446	D	72.7	Confident	86.2	Confident	31 Å²	31	33.5 Å²	33.5	17%	0.166	19%	0.185	C	C	.	.			trans	-75	168.8	-175.8	82.7	96	0	0	0	113.9	L448 T449 G450 S856	D446-L448 PolarHBondContact O-N 3.26Å; D446-L448 WeakPolarHBondContact OD1-CA 3.43Å; D446-L448 WeakPolarHBondContact OD1-CB 3.22Å; D446-L448 PolarHBondContact OD1-N 3.25Å; D446-T449 VanDerWaalsContact CG-OG1 3.25Å; D446-T449 PolarHBondContact OD1-N 2.92Å; D446-T449 PolarHBondContact OD1-OG1 3.43Å; D446-T449 WeakPolarHBondContact OD2-CB 3.42Å; D446-T449 PolarHBondContact OD2-N 3.3Å; D446-T449 PolarHBondContact OD2-OG1 3.18Å; D446-G450 WeakPolarHBondContact O-CA 3.2Å; D446-G450 PolarHBondContact O-N 3.15Å; D446-G450 PolarHBondContact OD2-N 3.32Å; D446-S856 WeakPolarHBondContact CA-OG 3.38Å
447	Q	71.7	Confident	86.1	Confident	13 Å²	13	33.4 Å²	33.4	6%	0.061	18%	0.184	C	C	.	.	S	Bend	trans	-83.4	-1.6	-175.4	-57.2	-69.7	-47	0	0	114.7	R484 R853 A854 S856 N875	Q447-R484 WeakPolarHBondContact O-CD 3.35Å; Q447-R853 WeakPolarHBondContact CG-O 3.41Å; Q447-A854 WeakPolarHBondContact CB-O 3.22Å; Q447-A854 PolarHBondContact N-O 3.39Å; Q447-S856 WeakPolarHBondContact CG-OG 3.45Å; Q447-S856 PolarHBondContact NE2-OG 2.79Å; Q447-N875 PolarHBondContact NE2-OD1 3.49Å
448	L	68.3	Low	86	Confident	61 Å²	61	36.6 Å²	36.6	32%	0.319	20%	0.199	S	C	.	.	S	Bend	trans	-121.1	-37.3	-174.7	-60.2	-180	0	0	0	113.2	D446 R484 A854	D446-L448 PolarHBondContact O-N 3.26Å; D446-L448 WeakPolarHBondContact OD1-CA 3.43Å; D446-L448 WeakPolarHBondContact OD1-CB 3.22Å; D446-L448 PolarHBondContact OD1-N 3.25Å; L448-R484 PolarHBondContact O-NH1 3.3Å; L448-R484 PolarHBondContact O-NH2 2.76Å; L448-A854 HydrophobicContact CD1-CB 3.84Å; L448-A854 HydrophobicContact CG-CB 4.04Å
449	T	71.3	Confident	85.8	Confident	100 Å²	100	42.7 Å²	42.7	61%	0.613	22%	0.221	S	C	*	.	S	Bend	trans	-118	-21.4	179.5	39.8	0	0	0	0	114.5	D446	D446-T449 VanDerWaalsContact CG-OG1 3.25Å; D446-T449 PolarHBondContact OD1-N 2.92Å; D446-T449 PolarHBondContact OD1-OG1 3.43Å; D446-T449 WeakPolarHBondContact OD2-CB 3.42Å; D446-T449 PolarHBondContact OD2-N 3.3Å; D446-T449 PolarHBondContact OD2-OG1 3.18Å
450	G	71.5	Confident	85.9	Confident	3 Å²	3	41.8 Å²	41.8	3%	0.031	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-56.7	142	-172.9	0	0	0	0	0	114.9	D446	D446-G450 WeakPolarHBondContact O-CA 3.2Å; D446-G450 PolarHBondContact O-N 3.15Å; D446-G450 PolarHBondContact OD2-N 3.32Å
451	P	82.7	Confident	86.2	Confident	63 Å²	63	40 Å²	40	41%	0.409	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-73.2	144.7	-178.7	29.7	-33.5	0	0	0	111.7	L444 E445	L444-P451 HydrophobicContact CB-CG 4.37Å; L444-P451 PolarHBondContact N-O 3.09Å; L444-P451 VanDerWaalsContact N-O 3.15Å; E445-P451 VanDerWaalsContact OE2-CD 3.28Å; E445-P451 WeakPolarHBondContact OE2-CD 3.5Å
452	C	88.4	Confident	86.3	Confident	38 Å²	38	43.1 Å²	43.1	26%	0.257	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-86.8	126.7	170.4	-57.4	0	0	0	0	108.9	F442 R484 I492	F442-C452 HydrophobicContact CD2-CB 4.13Å; F442-C452 CarbonylContact O-C 3.57Å; F442-C452 VanDerWaalsContact O-CA 3.28Å; F442-C452 WeakPolarHBondContact O-CA 3.48Å; C452-R484 PolarHBondContact SG-N 3.23Å; C452-I492 HydrophobicContact CB-CD1 3.98Å; C452-I492 HydrophobicContact CB-CG1 4.17Å
453	S	91.4	Very high	86.3	Confident	34 Å²	34	46.6 Å²	46.6	24%	0.238	25%	0.25	C	S	.	.			trans	-140.5	148.6	178.8	-174.9	0	0	0	0	112.8	F442 L444 E455 G456	F442-S453 PolarHBondContact O-N 3.46Å; L444-S453 VanDerWaalsContact CD1-CB 3.43Å; S453-E455 PolarHBondContact O-N 2.92Å; S453-E455 WeakPolarHBondContact OG-CB 3.49Å; S453-E455 PolarHBondContact OG-N 3.5Å; S453-E455 VanDerWaalsContact OG-N 3.16Å; S453-G456 PolarHBondContact O-N 2.57Å
454	I	93.5	Very high	86.6	Confident	53 Å²	53	46.5 Å²	46.5	27%	0.272	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.5	168.9	-64.6	172	0	0	0	110.9	G456 Y457 Q458 I492 A496 T500	I454-G456 PolarHBondContact O-N 3.35Å; I454-G456 VanDerWaalsContact O-N 3.15Å; I454-Y457 WeakPolarHBondContact O-CB 3.45Å; I454-Y457 PolarHBondContact O-N 3.38Å; I454-Y457 VanDerWaalsContact O-N 3.08Å; I454-Q458 PolarHBondContact O-N 2.86Å; I454-I492 HydrophobicContact CD1-CG2 3.87Å; I454-I492 HydrophobicContact CG1-CG2 3.4Å; I454-I492 VanDerWaalsContact CG1-CG2 3.4Å; I454-A496 HydrophobicContact CD1-CB 3.63Å; I454-T500 HydrophobicContact CG2-CG2 3.65Å; I454-T500 WeakPolarHBondContact CG2-OG1 3.49Å
455	E	91.9	Very high	87.2	Confident	76 Å²	76	44.8 Å²	44.8	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-60.6	-27.3	-174.9	-156.9	-163.6	163.2	0	0	112.9	L444 S453 Y457 Q458 R459	L444-E455 HydrophobicContact CD2-CB 4.49Å; S453-E455 PolarHBondContact O-N 2.92Å; S453-E455 WeakPolarHBondContact OG-CB 3.49Å; S453-E455 PolarHBondContact OG-N 3.5Å; S453-E455 VanDerWaalsContact OG-N 3.16Å; E455-Y457 PolarHBondContact O-N 2.89Å; E455-Q458 PolarHBondContact O-N 3.1Å; E455-R459 VanDerWaalsContact CD-NE 3.26Å; E455-R459 HydrophobicContact CG-CG 4.32Å; E455-R459 WeakPolarHBondContact O-CB 3.45Å; E455-R459 VanDerWaalsContact O-CG 3.31Å; E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 3.16Å; E455-R459 IonicContact OE1-CZ 2.78Å; E455-R459 IonicContact OE1-NE 3.11Å; E455-R459 PolarHBondContact OE1-NE 3.11Å; E455-R459 IonicContact OE1-NH2 2.68Å; E455-R459 PolarHBondContact OE1-NH2 3.29Å; E455-R459 IonicContact OE2-CZ 2.69Å; E455-R459 IonicContact OE2-NE 3.62Å; E455-R459 IonicContact OE2-NH2 2.78Å; E455-R459 PolarHBondContact OE2-NH2 2.63Å
456	G	91.9	Very high	88.1	Confident	8 Å²	8	39.2 Å²	39.2	8%	0.082	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-41.2	175.8	0	0	0	0	0	112.6	T441 S453 I454 A460	T441-G456 CarbonylContact O-C 3.6Å; T441-G456 VanDerWaalsContact O-C 3.22Å; T441-G456 WeakPolarHBondContact O-CA 3.38Å; S453-G456 PolarHBondContact O-N 2.57Å; I454-G456 PolarHBondContact O-N 3.35Å; I454-G456 VanDerWaalsContact O-N 3.15Å; G456-A460 WeakPolarHBondContact O-CB 3.5Å; G456-A460 PolarHBondContact O-N 2.94Å
457	Y	96.5	Very high	89.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.4	-44.2	172.3	-63.6	-73.8	0	0	0	111.9	T441 F442 I454 E455 A460 L461 I468 E469 L470 V497 I501	T441-Y457 HydrophobicContact CG2-CD1 3.57Å; T441-Y457 HydrophobicContact CG2-CE1 3.94Å; T441-Y457 HydrophobicContact CG2-CG 4.21Å; F442-Y457 HydrophobicContact CB-CE2 3.72Å; I454-Y457 WeakPolarHBondContact O-CB 3.45Å; I454-Y457 PolarHBondContact O-N 3.38Å; I454-Y457 VanDerWaalsContact O-N 3.08Å; E455-Y457 PolarHBondContact O-N 2.89Å; Y457-A460 PolarHBondContact O-N 3.32Å; Y457-L461 WeakPolarHBondContact O-CB 3.3Å; Y457-L461 VanDerWaalsContact O-CG 3.26Å; Y457-L461 WeakPolarHBondContact O-CG 3.38Å; Y457-L461 PolarHBondContact O-N 3.06Å; Y457-I468 HydrophobicContact CD1-CB 4.48Å; Y457-I468 HydrophobicContact CD1-CD1 3.97Å; Y457-I468 HydrophobicContact CE1-CD1 4.35Å; Y457-E469 WeakPolarHBondContact CE1-O 3.37Å; Y457-E469 PolarHBondContact OH-O 2.95Å; Y457-L470 HydrophobicContact CE1-CD1 3.82Å; Y457-L470 HydrophobicContact CE1-CG 4.3Å; Y457-V497 HydrophobicContact CD2-CG1 3.87Å; Y457-V497 HydrophobicContact CE1-CG1 4.38Å; Y457-V497 HydrophobicContact CE2-CB 4.47Å; Y457-V497 HydrophobicContact CE2-CG1 3.52Å; Y457-V497 HydrophobicContact CE2-CG2 4.13Å; Y457-V497 HydrophobicContact CG-CG1 4.42Å; Y457-I501 HydrophobicContact CD1-CD1 4.4Å; Y457-I501 HydrophobicContact CD1-CG1 4.47Å
458	Q	94.9	Very high	90.5	Very high	70 Å²	70	37.1 Å²	37.1	33%	0.327	20%	0.204	S	C	.	.	H	α-helix	trans	-60.7	-49.5	178	-177.8	-179.2	-4.4	0	0	111.5	I454 E455 L462 T500 F504	I454-Q458 PolarHBondContact O-N 2.86Å; E455-Q458 PolarHBondContact O-N 3.1Å; Q458-L462 HydrophobicContact CG-CD1 3.83Å; Q458-L462 VanDerWaalsContact O-CB 3.3Å; Q458-L462 WeakPolarHBondContact O-CB 3.47Å; Q458-L462 VanDerWaalsContact O-CG 3.28Å; Q458-L462 WeakPolarHBondContact O-CG 3.05Å; Q458-L462 PolarHBondContact O-N 2.85Å; Q458-T500 HydrophobicContact CB-CG2 4.36Å; Q458-F504 HydrophobicContact CG-CD1 3.87Å; Q458-F504 HydrophobicContact CG-CD2 4.29Å; Q458-F504 HydrophobicContact CG-CE1 3.73Å; Q458-F504 HydrophobicContact CG-CE2 4.15Å; Q458-F504 HydrophobicContact CG-CG 4.16Å; Q458-F504 HydrophobicContact CG-CZ 3.87Å
459	R	92.5	Very high	91.7	Very high	128 Å²	128	35 Å²	35	48%	0.483	19%	0.193	S	C	.	.	H	α-helix	trans	-60.2	-46.6	178.3	-71.6	174.7	-176.1	-175.7	6.5	111.6	E455 S463	E455-R459 VanDerWaalsContact CD-NE 3.26Å; E455-R459 HydrophobicContact CG-CG 4.32Å; E455-R459 WeakPolarHBondContact O-CB 3.45Å; E455-R459 VanDerWaalsContact O-CG 3.31Å; E455-R459 WeakPolarHBondContact O-CG 3.46Å; E455-R459 PolarHBondContact O-N 3.16Å; E455-R459 IonicContact OE1-CZ 2.78Å; E455-R459 IonicContact OE1-NE 3.11Å; E455-R459 PolarHBondContact OE1-NE 3.11Å; E455-R459 IonicContact OE1-NH2 2.68Å; E455-R459 PolarHBondContact OE1-NH2 3.29Å; E455-R459 IonicContact OE2-CZ 2.69Å; E455-R459 IonicContact OE2-NE 3.62Å; E455-R459 IonicContact OE2-NH2 2.78Å; E455-R459 PolarHBondContact OE2-NH2 2.63Å; R459-S463 WeakPolarHBondContact O-CB 3.33Å; R459-S463 PolarHBondContact O-N 3.17Å; R459-S463 PolarHBondContact O-OG 3.22Å
460	A	95	Very high	92.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-47.1	179.6	0	0	0	0	0	112.5	T441 G456 Y457 L462 S463 G464 C465 Y876	T441-A460 HydrophobicContact CG2-CB 3.74Å; G456-A460 WeakPolarHBondContact O-CB 3.5Å; G456-A460 PolarHBondContact O-N 2.94Å; Y457-A460 PolarHBondContact O-N 3.32Å; A460-L462 PolarHBondContact O-N 2.96Å; A460-S463 PolarHBondContact O-N 3.09Å; A460-S463 PolarHBondContact O-OG 2.61Å; A460-G464 PolarHBondContact O-N 2.85Å; A460-C465 HydrophobicContact CB-CB 3.87Å; A460-C465 WeakPolarHBondContact O-CB 3.27Å; A460-C465 PolarHBondContact O-N 3.11Å; A460-Y876 HydrophobicContact CB-CD1 3.82Å; A460-Y876 HydrophobicContact CB-CE1 4.17Å
461	L	96.7	Very high	93.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.9	-37.2	-179.5	-66.2	172	0	0	0	111.8	Y457 G464 I468 I501 F504 A505 V513	Y457-L461 WeakPolarHBondContact O-CB 3.3Å; Y457-L461 VanDerWaalsContact O-CG 3.26Å; Y457-L461 WeakPolarHBondContact O-CG 3.38Å; Y457-L461 PolarHBondContact O-N 3.06Å; L461-G464 PolarHBondContact O-N 3.19Å; L461-I468 HydrophobicContact CD2-CD1 4.41Å; L461-I468 HydrophobicContact CD2-CG2 4.32Å; L461-I501 HydrophobicContact CD1-CG1 4.41Å; L461-F504 HydrophobicContact CB-CB 4.19Å; L461-F504 HydrophobicContact CD1-CB 4.14Å; L461-A505 HydrophobicContact CD1-CB 4.41Å; L461-V513 HydrophobicContact CD2-CG1 4.28Å; L461-V513 HydrophobicContact CD2-CG2 4.43Å
462	L	94.9	Very high	94.4	Very high	70 Å²	70	27.4 Å²	27.4	37%	0.366	14%	0.144	S	C	.	.	H	α-helix	trans	-71.1	-27.4	175.2	-72.1	176	0	0	0	113.9	Q458 A460 G464 F504 I507 R508	Q458-L462 HydrophobicContact CG-CD1 3.83Å; Q458-L462 VanDerWaalsContact O-CB 3.3Å; Q458-L462 WeakPolarHBondContact O-CB 3.47Å; Q458-L462 VanDerWaalsContact O-CG 3.28Å; Q458-L462 WeakPolarHBondContact O-CG 3.05Å; Q458-L462 PolarHBondContact O-N 2.85Å; A460-L462 PolarHBondContact O-N 2.96Å; L462-G464 PolarHBondContact O-N 2.8Å; L462-F504 HydrophobicContact CD1-CD1 4.06Å; L462-F504 HydrophobicContact CD1-CE1 4.12Å; L462-F504 HydrophobicContact CD2-CD1 3.96Å; L462-F504 HydrophobicContact CG-CD1 3.95Å; L462-F504 HydrophobicContact CG-CE1 4.5Å; L462-I507 HydrophobicContact CD2-CB 4.22Å; L462-I507 HydrophobicContact CD2-CG2 3.93Å; L462-R508 WeakPolarHBondContact O-CG 3.36Å
463	S	92.4	Very high	94.6	Very high	73 Å²	73	26.1 Å²	26.1	51%	0.51	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.5	172	73.7	0	0	0	0	113.8	R459 A460 Y876	R459-S463 WeakPolarHBondContact O-CB 3.33Å; R459-S463 PolarHBondContact O-N 3.17Å; R459-S463 PolarHBondContact O-OG 3.22Å; A460-S463 PolarHBondContact O-N 3.09Å; A460-S463 PolarHBondContact O-OG 2.61Å; S463-Y876 WeakPolarHBondContact OG-CE1 3.38Å
464	G	95.3	Very high	94.6	Very high	2 Å²	2	26.8 Å²	26.8	2%	0.021	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.7	11	178.2	0	0	0	0	0	114.4	A460 L461 L462 R466 G897	A460-G464 PolarHBondContact O-N 2.85Å; L461-G464 PolarHBondContact O-N 3.19Å; L462-G464 PolarHBondContact O-N 2.8Å; G464-R466 PolarHBondContact O-N 2.7Å; G464-G897 WeakPolarHBondContact O-CA 3.38Å
465	C	97.7	Very high	94.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.127	C	C	.	.			trans	-58.2	138.2	173.2	-159.2	0	0	0	0	111.1	A436 S438 A460 Y467 Y876	A436-C465 PolarHBondContact O-SG 2.67Å; S438-C465 PolarHBondContact N-SG 3.43Å; S438-C465 VanDerWaalsContact N-SG 3.38Å; A460-C465 HydrophobicContact CB-CB 3.87Å; A460-C465 WeakPolarHBondContact O-CB 3.27Å; A460-C465 PolarHBondContact O-N 3.11Å; C465-Y467 PolarHBondContact SG-O 3.36Å; C465-Y876 HydrophobicContact CB-CE1 3.7Å; C465-Y876 VanDerWaalsContact SG-CZ 3.6Å; C465-Y876 PolarHBondContact SG-OH 2.65Å; C465-Y876 VanDerWaalsContact SG-OH 3.34Å
466	R	98.2	Very high	94.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.144	C	C	.	.			trans	-121	-5.5	-177.7	-60.8	-68.3	81.9	-175.4	1.5	113.4	I435 A436 G464 A505 S509 Y511 P512 V513 I514 C896 Y898	I435-R466 HydrophobicContact CG2-CB 3.86Å; A436-R466 PolarHBondContact O-N 2.76Å; G464-R466 PolarHBondContact O-N 2.7Å; R466-A505 VanDerWaalsContact CZ-O 3.25Å; R466-A505 PolarHBondContact NH1-O 2.69Å; R466-A505 PolarHBondContact NH2-O 3Å; R466-S509 PolarHBondContact NH1-O 2.79Å; R466-Y511 PolarHBondContact NH1-O 3.47Å; R466-P512 WeakPolarHBondContact CD-O 3.38Å; R466-V513 CarbonylContact O-C 3.49Å; R466-V513 WeakPolarHBondContact O-CA 3.48Å; R466-I514 PolarHBondContact O-N 2.94Å; R466-C896 WeakPolarHBondContact CD-O 3.16Å; R466-Y898 HydrophobicContact CB-CD2 4.46Å; R466-Y898 HydrophobicContact CB-CE2 3.79Å; R466-Y898 HydrophobicContact CG-CD2 3.77Å; R466-Y898 HydrophobicContact CG-CE2 3.48Å; R466-Y898 VanDerWaalsContact CG-CE2 3.48Å
467	Y	97.8	Very high	93.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.7	173.7	177.2	-75.6	0	0	0	109.5	A436 S438 C465 E469 I514 S516 Q616 Q846 I871 T873	A436-Y467 PolarHBondContact O-N 3.01Å; A436-Y467 VanDerWaalsContact O-N 3.1Å; S438-Y467 PolarHBondContact N-O 3.43Å; C465-Y467 PolarHBondContact SG-O 3.36Å; Y467-E469 HydrophobicContact CE1-CG 3.74Å; Y467-I514 WeakPolarHBondContact CA-O 3.33Å; Y467-I514 HydrophobicContact CD2-CB 3.75Å; Y467-I514 HydrophobicContact CD2-CD1 4.44Å; Y467-I514 HydrophobicContact CD2-CG2 3.6Å; Y467-I514 HydrophobicContact CE2-CB 4.4Å; Y467-I514 HydrophobicContact CE2-CG2 3.74Å; Y467-S516 WeakPolarHBondContact OH-CB 2.95Å; Y467-S516 PolarHBondContact OH-OG 2.89Å; Y467-Q616 PolarHBondContact OH-OE1 3.12Å; Y467-Q846 PolarHBondContact OH-NE2 3.41Å; Y467-Q846 PolarHBondContact OH-OE1 2.81Å; Y467-I871 HydrophobicContact CD1-CG2 4.01Å; Y467-I871 HydrophobicContact CD2-CD1 4.03Å; Y467-I871 HydrophobicContact CD2-CG1 4.42Å; Y467-I871 HydrophobicContact CD2-CG2 3.65Å; Y467-I871 HydrophobicContact CE1-CG2 4.16Å; Y467-I871 HydrophobicContact CE2-CD1 4.23Å; Y467-I871 HydrophobicContact CE2-CG2 3.82Å; Y467-I871 HydrophobicContact CG-CG2 3.79Å; Y467-T873 HydrophobicContact CD1-CG2 3.85Å; Y467-T873 HydrophobicContact CE1-CG2 3.58Å
468	I	97	Very high	93.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	152.4	-175.8	57.9	169.7	0	0	0	112.2	T441 Y457 L461 I501 V513 I514 V515 S516	T441-I468 HydrophobicContact CG2-CB 4.22Å; T441-I468 HydrophobicContact CG2-CG2 3.89Å; Y457-I468 HydrophobicContact CD1-CB 4.48Å; Y457-I468 HydrophobicContact CD1-CD1 3.97Å; Y457-I468 HydrophobicContact CE1-CD1 4.35Å; L461-I468 HydrophobicContact CD2-CD1 4.41Å; L461-I468 HydrophobicContact CD2-CG2 4.32Å; I468-I501 HydrophobicContact CD1-CD1 3.67Å; I468-I501 HydrophobicContact CD1-CG1 3.75Å; I468-I501 HydrophobicContact CD1-CG2 4.3Å; I468-V513 HydrophobicContact CD1-CG1 4.39Å; I468-V513 HydrophobicContact CG1-CG1 4.26Å; I468-I514 PolarHBondContact N-O 3.37Å; I468-V515 HydrophobicContact CD1-CG2 4.1Å; I468-V515 HydrophobicContact CG1-CB 4.49Å; I468-V515 HydrophobicContact CG1-CG1 4.47Å; I468-V515 HydrophobicContact CG1-CG2 3.98Å; I468-S516 PolarHBondContact O-N 3.47Å
469	E	95	Very high	93.1	Very high	17 Å²	17	34.5 Å²	34.5	8%	0.079	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.4	-172.8	-69.1	173.4	-177.1	0	0	112.9	H439 K440 T441 Y457 Y467 Q846	H439-E469 VanDerWaalsContact CA-OE2 3.27Å; H439-E469 WeakPolarHBondContact CA-OE2 3.33Å; H439-E469 IonicContact CD2-OE1 3.33Å; H439-E469 IonicContact CD2-OE2 3.45Å; H439-E469 PolarHBondContact CD2-OE2 3.03Å; H439-E469 IonicContact CG-OE2 2.72Å; K440-E469 PolarHBondContact N-OE2 3.35Å; T441-E469 PolarHBondContact OG1-N 3.38Å; Y457-E469 WeakPolarHBondContact CE1-O 3.37Å; Y457-E469 PolarHBondContact OH-O 2.95Å; Y467-E469 HydrophobicContact CE1-CG 3.74Å; E469-Q846 PolarHBondContact OE1-NE2 2.97Å
470	L	94.8	Very high	93.2	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	113.1	177.3	-73.6	67.7	0	0	0	110.4	Y457 V472 V482 I494 V497 L498 I501 V515 S516 E518	Y457-L470 HydrophobicContact CE1-CD1 3.82Å; Y457-L470 HydrophobicContact CE1-CG 4.3Å; L470-V472 HydrophobicContact CB-CG2 4.1Å; L470-V482 HydrophobicContact CB-CG2 4.49Å; L470-V482 HydrophobicContact CG-CG2 4.45Å; L470-I494 HydrophobicContact CD2-CD1 4Å; L470-V497 HydrophobicContact CD2-CG1 4.15Å; L470-V497 HydrophobicContact CG-CG1 4.35Å; L470-L498 HydrophobicContact CD2-CD2 4.41Å; L470-I501 HydrophobicContact CD1-CD1 4.14Å; L470-I501 HydrophobicContact CD2-CD1 4.43Å; L470-V515 HydrophobicContact CD1-CG1 3.54Å; L470-V515 HydrophobicContact CD2-CG1 4.41Å; L470-S516 PolarHBondContact N-O 3.17Å; L470-E518 PolarHBondContact O-N 2.96Å
471	E	92.9	Very high	93.1	Very high	4 Å²	4	29 Å²	29	2%	0.019	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106	163.7	-79.8	-178.8	-138.7	0	0	109.3	K440 F442 Y473 V482 R483 R484 A485	K440-E471 IonicContact NZ-OE1 2.66Å; K440-E471 PolarHBondContact NZ-OE1 3.31Å; F442-E471 HydrophobicContact CE1-CB 3.86Å; F442-E471 HydrophobicContact CE1-CG 3.94Å; F442-E471 HydrophobicContact CZ-CB 3.87Å; F442-E471 HydrophobicContact CZ-CG 3.85Å; F442-E471 WeakPolarHBondContact CZ-OE1 3.29Å; E471-Y473 HydrophobicContact CB-CE2 4.13Å; E471-V482 VanDerWaalsContact O-CA 3.28Å; E471-V482 WeakPolarHBondContact O-CA 3.25Å; E471-R483 PolarHBondContact O-N 3.26Å; E471-R484 WeakPolarHBondContact OE2-CA 3.3Å; E471-A485 PolarHBondContact OE2-N 2.82Å
472	V	94	Very high	93	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128	-176.1	-173.8	0	0	0	0	111.3	L470 P480 V482 I494 I517 E518 Y520 L529	L470-V472 HydrophobicContact CB-CG2 4.1Å; V472-P480 HydrophobicContact CG1-CB 3.65Å; V472-V482 HydrophobicContact CG2-CG2 4.38Å; V472-I494 HydrophobicContact CG2-CD1 4.05Å; V472-I517 HydrophobicContact CG2-CG2 3.9Å; V472-E518 PolarHBondContact N-O 3.04Å; V472-Y520 PolarHBondContact O-N 3.46Å; V472-L529 HydrophobicContact CG1-CD2 4.27Å
473	Y	92.7	Very high	92.6	Very high	10 Å²	10	27.7 Å²	27.7	4%	0.039	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	168.4	178.9	-71.7	-86.5	0	0	0	111.6	E471 V481 R483 A485 Y520	E471-Y473 HydrophobicContact CB-CE2 4.13Å; Y473-V481 PolarHBondContact N-O 2.89Å; Y473-V481 PolarHBondContact O-N 2.63Å; Y473-R483 VanDerWaalsContact CB-CZ 3.41Å; Y473-R483 VanDerWaalsContact CD1-NH2 3.27Å; Y473-R483 HydrophobicContact CD2-CG 3.65Å; Y473-R483 VanDerWaalsContact CD2-NH1 3.33Å; Y473-R483 WeakPolarHBondContact CD2-O 3.37Å; Y473-R483 HydrophobicContact CE2-CG 4.44Å; Y473-R483 WeakPolarHBondContact CE2-O 3.37Å; Y473-R483 HydrophobicContact CG-CG 4.15Å; Y473-R483 VanDerWaalsContact CG-NH1 3.27Å; Y473-A485 WeakPolarHBondContact OH-CA 3.34Å; Y473-A485 WeakPolarHBondContact OH-CB 3.4Å; Y473-Y520 HydrophobicContact CD1-CD2 4.25Å; Y473-Y520 HydrophobicContact CD1-CG 4.22Å; Y473-Y520 HydrophobicContact CD2-CD2 4.42Å; Y473-Y520 VanDerWaalsContact CE1-CB 3.42Å; Y473-Y520 AromaticContact CE1-CD2 3.63Å; Y473-Y520 HydrophobicContact CE1-CD2 3.63Å; Y473-Y520 AromaticContact CE1-CG 3.66Å; Y473-Y520 HydrophobicContact CE1-CG 3.66Å; Y473-Y520 AromaticContact CE2-CD2 3.86Å; Y473-Y520 HydrophobicContact CE2-CD2 3.86Å; Y473-Y520 HydrophobicContact CE2-CE2 4.43Å; Y473-Y520 AromaticContact CZ-CD2 3.39Å; Y473-Y520 AromaticContact CZ-CE2 3.99Å; Y473-Y520 AromaticContact CZ-CG 3.92Å
474	D	91.2	Very high	92.2	Very high	49 Å²	49	25.8 Å²	25.8	26%	0.262	13%	0.134	S	C	.	.			trans	-62.9	132.9	171.6	-62.3	-81.1	0	0	0	112.7	A521 T522 Q525	D474-A521 VanDerWaalsContact OD2-CA 3.31Å; D474-A521 WeakPolarHBondContact OD2-CA 3.44Å; D474-T522 VanDerWaalsContact CG-N 3.29Å; D474-T522 VanDerWaalsContact OD1-CB 3.31Å; D474-T522 WeakPolarHBondContact OD1-CB 3.42Å; D474-T522 WeakPolarHBondContact OD1-CG2 3.11Å; D474-T522 PolarHBondContact OD1-N 2.69Å; D474-T522 PolarHBondContact OD1-OG1 2.77Å; D474-T522 PolarHBondContact OD2-N 2.97Å; D474-Q525 VanDerWaalsContact CA-OE1 3.29Å; D474-Q525 VanDerWaalsContact OD1-CD 3.25Å; D474-Q525 VanDerWaalsContact OD1-CG 3.3Å; D474-Q525 WeakPolarHBondContact OD1-CG 3.48Å; D474-Q525 PolarHBondContact OD1-NE2 2.77Å
475	G	89	Confident	91.2	Very high	11 Å²	11	26.3 Å²	26.3	11%	0.113	14%	0.138	C	C	.	.			trans	-90	159.8	165.2	0	0	0	0	0	112.5	D477 H479 Q525	G475-D477 VanDerWaalsContact C-N 3.26Å; G475-D477 PolarHBondContact O-N 2.81Å; G475-H479 WeakPolarHBondContact CA-O 3.35Å; G475-H479 PolarHBondContact N-O 3.01Å; G475-H479 VanDerWaalsContact N-O 3.16Å; G475-Q525 PolarHBondContact O-NE2 2.95Å
476	H	86.3	Confident	89.8	Confident	151 Å²	151	29.8 Å²	29.8	70%	0.699	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.2	-177.4	55.9	43.1	0	0	0	114.2
477	D	85.7	Confident	88.6	Confident	87 Å²	87	31 Å²	31	47%	0.465	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-0.8	-177.9	58.3	-9.6	0	0	0	112.8	G475 H479	G475-D477 VanDerWaalsContact C-N 3.26Å; G475-D477 PolarHBondContact O-N 2.81Å; D477-H479 PolarHBondContact OD1-N 2.7Å; D477-H479 IonicContact OD2-CD2 3.88Å
478	G	85.2	Confident	87.2	Confident	33 Å²	33	42 Å²	42	34%	0.34	21%	0.207	S	C	.	.	S	Bend	trans	87.6	-0.5	-173.6	0	0	0	0	0	114.4
479	H	90.3	Very high	86	Confident	87 Å²	87	46.5 Å²	46.5	40%	0.403	24%	0.236	S	C	.	.	S	Bend	trans	-101.1	139.9	174	-63.6	-55.8	0	0	0	111.1	G475 D477 Q525 F532	G475-H479 WeakPolarHBondContact CA-O 3.35Å; G475-H479 PolarHBondContact N-O 3.01Å; G475-H479 VanDerWaalsContact N-O 3.16Å; D477-H479 PolarHBondContact OD1-N 2.7Å; D477-H479 IonicContact OD2-CD2 3.88Å; H479-Q525 PolarHBondContact O-OE1 2.85Å; H479-Q525 VanDerWaalsContact O-OE1 3.07Å; H479-F532 HydrophobicContact CB-CE2 4.4Å; H479-F532 AromaticContact ND1-CE2 3.73Å; H479-F532 AromaticContact ND1-CZ 3.86Å
480	P	94.3	Very high	85.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.			trans	-62.1	146.7	178.4	-15.2	24	0	0	0	111.9	V472 I494 Q525 V528 L529	V472-P480 HydrophobicContact CG1-CB 3.65Å; P480-I494 HydrophobicContact CB-CB 4.12Å; P480-I494 HydrophobicContact CB-CG2 3.85Å; P480-I494 HydrophobicContact CG-CG2 3.99Å; P480-I494 VanDerWaalsContact O-CB 3.23Å; P480-I494 WeakPolarHBondContact O-CB 3.47Å; P480-I494 WeakPolarHBondContact O-CG2 3.49Å; P480-I494 PolarHBondContact O-N 3.05Å; P480-Q525 HydrophobicContact CG-CB 4.2Å; P480-Q525 WeakPolarHBondContact CG-O 3.12Å; P480-V528 HydrophobicContact CG-CB 4.37Å; P480-V528 HydrophobicContact CG-CG1 4.4Å; P480-L529 HydrophobicContact CG-CB 3.93Å
481	V	94.3	Very high	84.8	Confident	12 Å²	12	51.4 Å²	51.4	7%	0.073	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.1	175.2	-64.6	0	0	0	0	111.6	Y473 R483 I492	Y473-V481 PolarHBondContact N-O 2.89Å; Y473-V481 PolarHBondContact O-N 2.63Å; V481-R483 HydrophobicContact CG2-CG 4.26Å; V481-I492 CarbonylContact C-O 3.53Å; V481-I492 WeakPolarHBondContact CA-O 3.44Å; V481-I492 WeakPolarHBondContact CB-O 3.06Å
482	V	93.4	Very high	84.8	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.4	165.1	177.5	0	0	0	0	108.5	F442 L470 E471 V472 I492 I494 V497	F442-V482 HydrophobicContact CB-CG1 3.83Å; F442-V482 HydrophobicContact CD1-CG1 3.82Å; F442-V482 HydrophobicContact CD2-CG1 4.4Å; F442-V482 HydrophobicContact CG-CG1 3.75Å; L470-V482 HydrophobicContact CB-CG2 4.49Å; L470-V482 HydrophobicContact CG-CG2 4.45Å; E471-V482 VanDerWaalsContact O-CA 3.28Å; E471-V482 WeakPolarHBondContact O-CA 3.25Å; V472-V482 HydrophobicContact CG2-CG2 4.38Å; V482-I492 HydrophobicContact CB-CB 4.35Å; V482-I492 HydrophobicContact CB-CD1 4.5Å; V482-I492 HydrophobicContact CG1-CD1 4.44Å; V482-I492 PolarHBondContact N-O 2.79Å; V482-I492 PolarHBondContact O-N 3.14Å; V482-I494 HydrophobicContact CG2-CD1 3.65Å; V482-V497 HydrophobicContact CB-CG2 4.21Å; V482-V497 HydrophobicContact CG2-CB 4.42Å; V482-V497 HydrophobicContact CG2-CG1 4.4Å; V482-V497 HydrophobicContact CG2-CG2 3.96Å
483	R	87.9	Confident	84.8	Confident	43 Å²	43	55.3 Å²	55.3	16%	0.162	30%	0.297	C	S	.	.			trans	-156.3	153	174.3	62	167.7	178.4	69	-2.9	110	E471 Y473 V481	E471-R483 PolarHBondContact O-N 3.26Å; Y473-R483 VanDerWaalsContact CB-CZ 3.41Å; Y473-R483 VanDerWaalsContact CD1-NH2 3.27Å; Y473-R483 HydrophobicContact CD2-CG 3.65Å; Y473-R483 VanDerWaalsContact CD2-NH1 3.33Å; Y473-R483 WeakPolarHBondContact CD2-O 3.37Å; Y473-R483 HydrophobicContact CE2-CG 4.44Å; Y473-R483 WeakPolarHBondContact CE2-O 3.37Å; Y473-R483 HydrophobicContact CG-CG 4.15Å; Y473-R483 VanDerWaalsContact CG-NH1 3.27Å; V481-R483 HydrophobicContact CG2-CG 4.26Å
484	R	83.8	Confident	84.9	Confident	33 Å²	33	54.9 Å²	54.9	13%	0.125	30%	0.296	C	S	.	.			trans	-60.7	145.2	170.5	-172.8	179.5	39.5	85	-13.3	111.9	F442 L443 Q447 L448 C452 E471 N486 S487	F442-R484 HydrophobicContact CE2-CB 4.04Å; L443-R484 HydrophobicContact CD2-CB 4.4Å; Q447-R484 WeakPolarHBondContact O-CD 3.35Å; L448-R484 PolarHBondContact O-NH1 3.3Å; L448-R484 PolarHBondContact O-NH2 2.76Å; C452-R484 PolarHBondContact SG-N 3.23Å; E471-R484 WeakPolarHBondContact OE2-CA 3.3Å; R484-N486 PolarHBondContact O-N 3.33Å; R484-S487 WeakPolarHBondContact O-CB 3.16Å; R484-S487 PolarHBondContact O-N 2.82Å; R484-S487 PolarHBondContact O-OG 2.93Å
485	A	74.2	Confident	85.1	Confident	14 Å²	14	57.1 Å²	57.1	12%	0.116	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.5	132.9	160.8	0	0	0	0	0	112.8	E471 Y473 S487	E471-A485 PolarHBondContact OE2-N 2.82Å; Y473-A485 WeakPolarHBondContact OH-CA 3.34Å; Y473-A485 WeakPolarHBondContact OH-CB 3.4Å; A485-S487 PolarHBondContact O-N 3.45Å; A485-S487 VanDerWaalsContact O-N 3.1Å
486	N	68.2	Low	85.4	Confident	72 Å²	72	58.1 Å²	58.1	39%	0.385	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	16.5	175.7	-56	-6.8	0	0	0	115.7	R484 F653 T655 H657	R484-N486 PolarHBondContact O-N 3.33Å; N486-F653 PolarHBondContact ND2-O 3.23Å; N486-T655 PolarHBondContact ND2-OG1 2.84Å; N486-T655 PolarHBondContact OD1-OG1 2.95Å; N486-H657 PolarHBondContact OD1-CE1 3.28Å; N486-H657 PolarHBondContact OD1-NE2 2.87Å
487	S	71.6	Confident	85.9	Confident	26 Å²	26	51 Å²	51	18%	0.182	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76	152.3	165.8	59.9	0	0	0	0	111.7	R484 A485	R484-S487 WeakPolarHBondContact O-CB 3.16Å; R484-S487 PolarHBondContact O-N 2.82Å; R484-S487 PolarHBondContact O-OG 2.93Å; A485-S487 PolarHBondContact O-N 3.45Å; A485-S487 VanDerWaalsContact O-N 3.1Å
488	R	69.3	Low	86.4	Confident	232 Å²	232	46.8 Å²	46.8	88%	0.875	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-77.9	140.3	171.7	-71.3	-175	176.2	121.8	1.1	109.8
489	P	72.8	Confident	87	Confident	94 Å²	94	48.3 Å²	48.3	61%	0.61	26%	0.257	S	S	*	.	S	Bend	trans	-59.1	158.4	170.1	-23.2	34.2	0	0	0	112.8
490	P	77.1	Confident	87.3	Confident	104 Å²	104	45 Å²	45	68%	0.675	24%	0.243	S	C	*	.	P	Polyproline II helix	cis	-77.5	154.7	1.4	32.3	-35.9	0	0	0	113.5
491	G	85.7	Confident	87.4	Confident	18 Å²	18	45 Å²	45	19%	0.186	24%	0.243	C	C	.	.			trans	-93.1	179.7	165.5	0	0	0	0	0	111.8
492	I	92.9	Very high	87.5	Confident	15 Å²	15	47 Å²	47	8%	0.077	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.9	173.8	-46.9	167.6	0	0	0	108.9	F442 C452 I454 V481 V482 I494 V497	F442-I492 HydrophobicContact CB-CD1 4.2Å; C452-I492 HydrophobicContact CB-CD1 3.98Å; C452-I492 HydrophobicContact CB-CG1 4.17Å; I454-I492 HydrophobicContact CD1-CG2 3.87Å; I454-I492 HydrophobicContact CG1-CG2 3.4Å; I454-I492 VanDerWaalsContact CG1-CG2 3.4Å; V481-I492 CarbonylContact C-O 3.53Å; V481-I492 WeakPolarHBondContact CA-O 3.44Å; V481-I492 WeakPolarHBondContact CB-O 3.06Å; V482-I492 HydrophobicContact CB-CB 4.35Å; V482-I492 HydrophobicContact CB-CD1 4.5Å; V482-I492 HydrophobicContact CG1-CD1 4.44Å; V482-I492 PolarHBondContact N-O 2.79Å; V482-I492 PolarHBondContact O-N 3.14Å; I492-I494 PolarHBondContact O-N 2.97Å; I492-V497 HydrophobicContact CB-CG2 4.18Å; I492-V497 HydrophobicContact CG2-CG2 3.57Å
493	P	94.4	Very high	87.6	Confident	70 Å²	70	51.4 Å²	51.4	46%	0.455	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	128.6	175	-25.5	35.4	0	0	0	112.3	Q495 A496 V497	P493-Q495 PolarHBondContact O-N 3.05Å; P493-Q495 VanDerWaalsContact O-N 3.17Å; P493-A496 WeakPolarHBondContact O-CB 3.34Å; P493-A496 PolarHBondContact O-N 2.61Å; P493-V497 PolarHBondContact O-N 3Å
494	I	95.1	Very high	88	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-57.5	-35.4	-174.9	-170.4	64.4	0	0	0	112.9	L470 V472 P480 V482 I492 A496 V497 L498 L529 F532	L470-I494 HydrophobicContact CD2-CD1 4Å; V472-I494 HydrophobicContact CG2-CD1 4.05Å; P480-I494 HydrophobicContact CB-CB 4.12Å; P480-I494 HydrophobicContact CB-CG2 3.85Å; P480-I494 HydrophobicContact CG-CG2 3.99Å; P480-I494 VanDerWaalsContact O-CB 3.23Å; P480-I494 WeakPolarHBondContact O-CB 3.47Å; P480-I494 WeakPolarHBondContact O-CG2 3.49Å; P480-I494 PolarHBondContact O-N 3.05Å; V482-I494 HydrophobicContact CG2-CD1 3.65Å; I492-I494 PolarHBondContact O-N 2.97Å; I494-A496 VanDerWaalsContact C-N 3.29Å; I494-A496 PolarHBondContact O-N 2.82Å; I494-V497 PolarHBondContact O-N 2.89Å; I494-L498 HydrophobicContact CD1-CD1 4.5Å; I494-L498 HydrophobicContact CD1-CG 4.35Å; I494-L498 HydrophobicContact CG1-CD1 3.88Å; I494-L498 HydrophobicContact CG1-CG 4.15Å; I494-L498 WeakPolarHBondContact O-CG 3.44Å; I494-L498 PolarHBondContact O-N 2.9Å; I494-L529 HydrophobicContact CD1-CD1 4.12Å; I494-L529 HydrophobicContact CG1-CD1 3.74Å; I494-F532 HydrophobicContact CG2-CD2 3.56Å; I494-F532 HydrophobicContact CG2-CE2 4Å; I494-F532 HydrophobicContact CG2-CG 4.31Å
495	Q	94.7	Very high	88.6	Confident	96 Å²	96	50.2 Å²	50.2	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-38.8	178.3	-170.6	-178.1	10.7	0	0	111.8	P493 L498 N499 F532	P493-Q495 PolarHBondContact O-N 3.05Å; P493-Q495 VanDerWaalsContact O-N 3.17Å; Q495-L498 PolarHBondContact O-N 2.84Å; Q495-N499 WeakPolarHBondContact O-CB 3.39Å; Q495-N499 PolarHBondContact O-N 2.94Å; Q495-N499 PolarHBondContact O-OD1 2.89Å; Q495-F532 HydrophobicContact CB-CD1 4.08Å; Q495-F532 HydrophobicContact CB-CE1 3.91Å; Q495-F532 HydrophobicContact CB-CZ 4.18Å; Q495-F532 HydrophobicContact CG-CD1 3.97Å; Q495-F532 HydrophobicContact CG-CE1 3.81Å
496	A	95.6	Very high	89.7	Confident	32 Å²	32	51.4 Å²	51.4	26%	0.264	27%	0.274	S	S	.	.	H	α-helix	trans	-70.7	-36.2	178.7	0	0	0	0	0	111.8	I454 P493 I494 T500	I454-A496 HydrophobicContact CD1-CB 3.63Å; P493-A496 WeakPolarHBondContact O-CB 3.34Å; P493-A496 PolarHBondContact O-N 2.61Å; I494-A496 VanDerWaalsContact C-N 3.29Å; I494-A496 PolarHBondContact O-N 2.82Å; A496-T500 WeakPolarHBondContact O-CB 3.47Å; A496-T500 PolarHBondContact O-N 3.13Å; A496-T500 VanDerWaalsContact O-N 3.11Å; A496-T500 PolarHBondContact O-OG1 3.31Å
497	V	96.8	Very high	91	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-48.9	172.3	176.9	0	0	0	0	110.9	Y457 L470 V482 I492 P493 I494 T500 I501	Y457-V497 HydrophobicContact CD2-CG1 3.87Å; Y457-V497 HydrophobicContact CE1-CG1 4.38Å; Y457-V497 HydrophobicContact CE2-CB 4.47Å; Y457-V497 HydrophobicContact CE2-CG1 3.52Å; Y457-V497 HydrophobicContact CE2-CG2 4.13Å; Y457-V497 HydrophobicContact CG-CG1 4.42Å; L470-V497 HydrophobicContact CD2-CG1 4.15Å; L470-V497 HydrophobicContact CG-CG1 4.35Å; V482-V497 HydrophobicContact CB-CG2 4.21Å; V482-V497 HydrophobicContact CG2-CB 4.42Å; V482-V497 HydrophobicContact CG2-CG1 4.4Å; V482-V497 HydrophobicContact CG2-CG2 3.96Å; I492-V497 HydrophobicContact CB-CG2 4.18Å; I492-V497 HydrophobicContact CG2-CG2 3.57Å; P493-V497 PolarHBondContact O-N 3Å; I494-V497 PolarHBondContact O-N 2.89Å; V497-T500 WeakPolarHBondContact O-CB 3.39Å; V497-T500 PolarHBondContact O-N 3.03Å; V497-I501 HydrophobicContact CG1-CD1 3.86Å; V497-I501 WeakPolarHBondContact O-CG1 3.42Å; V497-I501 PolarHBondContact O-N 3.07Å
498	L	97.4	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.6	-37.1	-177.7	-67.7	174.7	0	0	0	113	L470 I494 Q495 I501 H502 F532 L533 C536 L537	L470-L498 HydrophobicContact CD2-CD2 4.41Å; I494-L498 HydrophobicContact CD1-CD1 4.5Å; I494-L498 HydrophobicContact CD1-CG 4.35Å; I494-L498 HydrophobicContact CG1-CD1 3.88Å; I494-L498 HydrophobicContact CG1-CG 4.15Å; I494-L498 WeakPolarHBondContact O-CG 3.44Å; I494-L498 PolarHBondContact O-N 2.9Å; Q495-L498 PolarHBondContact O-N 2.84Å; L498-I501 HydrophobicContact CD2-CD1 4.48Å; L498-I501 PolarHBondContact O-N 3.44Å; L498-H502 WeakPolarHBondContact O-CB 3.01Å; L498-H502 PolarHBondContact O-N 3.34Å; L498-F532 HydrophobicContact CD1-CB 3.86Å; L498-L533 HydrophobicContact CD1-CD2 4.03Å; L498-L533 HydrophobicContact CD1-CG 4.25Å; L498-L533 HydrophobicContact CD2-CD2 3.7Å; L498-C536 HydrophobicContact CB-CB 3.66Å; L498-L537 HydrophobicContact CB-CD2 4.45Å; L498-L537 HydrophobicContact CD2-CD1 4.31Å; L498-L537 HydrophobicContact CD2-CD2 4.23Å; L498-L537 HydrophobicContact CD2-CG 4.38Å
499	N	96.5	Very high	93.4	Very high	65 Å²	65	47.4 Å²	47.4	35%	0.348	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-43.7	171.4	-69.4	-1	0	0	0	111	Q495 I501 H502 D503 C536	Q495-N499 WeakPolarHBondContact O-CB 3.39Å; Q495-N499 PolarHBondContact O-N 2.94Å; Q495-N499 PolarHBondContact O-OD1 2.89Å; N499-I501 VanDerWaalsContact C-N 3.32Å; N499-I501 PolarHBondContact O-N 3.4Å; N499-H502 WeakPolarHBondContact O-CB 3.38Å; N499-H502 PolarHBondContact O-N 2.84Å; N499-H502 VanDerWaalsContact O-N 3.17Å; N499-D503 VanDerWaalsContact O-CG 3.3Å; N499-D503 PolarHBondContact O-N 2.69Å; N499-C536 PolarHBondContact OD1-SG 2.7Å
500	T	96.6	Very high	94.6	Very high	18 Å²	18	47.5 Å²	47.5	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-40.4	176.3	-56.1	0	0	0	0	111.6	I454 Q458 A496 V497 D503 F504	I454-T500 HydrophobicContact CG2-CG2 3.65Å; I454-T500 WeakPolarHBondContact CG2-OG1 3.49Å; Q458-T500 HydrophobicContact CB-CG2 4.36Å; A496-T500 WeakPolarHBondContact O-CB 3.47Å; A496-T500 PolarHBondContact O-N 3.13Å; A496-T500 VanDerWaalsContact O-N 3.11Å; A496-T500 PolarHBondContact O-OG1 3.31Å; V497-T500 WeakPolarHBondContact O-CB 3.39Å; V497-T500 PolarHBondContact O-N 3.03Å; T500-D503 PolarHBondContact O-N 2.81Å; T500-F504 HydrophobicContact CG2-CD2 3.7Å; T500-F504 HydrophobicContact CG2-CE2 4.19Å; T500-F504 WeakPolarHBondContact O-CB 3.45Å; T500-F504 WeakPolarHBondContact O-CD2 3.43Å; T500-F504 PolarHBondContact O-N 3.07Å
501	I	97.4	Very high	95.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-45.9	174.1	-66.9	166.2	0	0	0	110.3	Y457 L461 I468 L470 V497 L498 N499 D503 A505 V515 L537 I613	Y457-I501 HydrophobicContact CD1-CD1 4.4Å; Y457-I501 HydrophobicContact CD1-CG1 4.47Å; L461-I501 HydrophobicContact CD1-CG1 4.41Å; I468-I501 HydrophobicContact CD1-CD1 3.67Å; I468-I501 HydrophobicContact CD1-CG1 3.75Å; I468-I501 HydrophobicContact CD1-CG2 4.3Å; L470-I501 HydrophobicContact CD1-CD1 4.14Å; L470-I501 HydrophobicContact CD2-CD1 4.43Å; V497-I501 HydrophobicContact CG1-CD1 3.86Å; V497-I501 WeakPolarHBondContact O-CG1 3.42Å; V497-I501 PolarHBondContact O-N 3.07Å; L498-I501 HydrophobicContact CD2-CD1 4.48Å; L498-I501 PolarHBondContact O-N 3.44Å; N499-I501 VanDerWaalsContact C-N 3.32Å; N499-I501 PolarHBondContact O-N 3.4Å; I501-D503 VanDerWaalsContact C-N 3.32Å; I501-D503 PolarHBondContact O-N 3.19Å; I501-A505 WeakPolarHBondContact O-CB 3.5Å; I501-A505 PolarHBondContact O-N 2.7Å; I501-V515 HydrophobicContact CG2-CG2 4.5Å; I501-L537 HydrophobicContact CG2-CD2 4.28Å; I501-I613 HydrophobicContact CG2-CD1 4.19Å
502	H	96.1	Very high	96.1	Very high	53 Å²	53	42.3 Å²	42.3	25%	0.245	21%	0.212	C	C	.	.	H	α-helix	trans	-55.6	-45.5	176.7	170.1	-85.2	0	0	0	112.6	L498 N499 C536 R540	L498-H502 WeakPolarHBondContact O-CB 3.01Å; L498-H502 PolarHBondContact O-N 3.34Å; N499-H502 WeakPolarHBondContact O-CB 3.38Å; N499-H502 PolarHBondContact O-N 2.84Å; N499-H502 VanDerWaalsContact O-N 3.17Å; H502-C536 WeakPolarHBondContact CB-O 3.22Å; H502-C536 PolarHBondContact CD2-O 2.68Å; H502-R540 PolarHBondContact CD2-NE 3.46Å; H502-R540 PolarHBondContact NE2-NE 2.8Å
503	D	95.7	Very high	96.4	Very high	93 Å²	93	41.6 Å²	41.6	50%	0.497	21%	0.208	S	C	.	.	H	α-helix	trans	-78.5	-43	-173	-65.5	-16.2	0	0	0	112.4	N499 T500 I501 I507	N499-D503 VanDerWaalsContact O-CG 3.3Å; N499-D503 PolarHBondContact O-N 2.69Å; T500-D503 PolarHBondContact O-N 2.81Å; I501-D503 VanDerWaalsContact C-N 3.32Å; I501-D503 PolarHBondContact O-N 3.19Å; D503-I507 WeakPolarHBondContact O-CD1 3.38Å; D503-I507 WeakPolarHBondContact O-CG1 3.49Å
504	F	96.9	Very high	96.5	Very high	51 Å²	51	38.2 Å²	38.2	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-92.6	-20	-174	-71	-84.9	0	0	0	114.9	Q458 L461 L462 T500 F506 I507	Q458-F504 HydrophobicContact CG-CD1 3.87Å; Q458-F504 HydrophobicContact CG-CD2 4.29Å; Q458-F504 HydrophobicContact CG-CE1 3.73Å; Q458-F504 HydrophobicContact CG-CE2 4.15Å; Q458-F504 HydrophobicContact CG-CG 4.16Å; Q458-F504 HydrophobicContact CG-CZ 3.87Å; L461-F504 HydrophobicContact CB-CB 4.19Å; L461-F504 HydrophobicContact CD1-CB 4.14Å; L462-F504 HydrophobicContact CD1-CD1 4.06Å; L462-F504 HydrophobicContact CD1-CE1 4.12Å; L462-F504 HydrophobicContact CD2-CD1 3.96Å; L462-F504 HydrophobicContact CG-CD1 3.95Å; L462-F504 HydrophobicContact CG-CE1 4.5Å; T500-F504 HydrophobicContact CG2-CD2 3.7Å; T500-F504 HydrophobicContact CG2-CE2 4.19Å; T500-F504 WeakPolarHBondContact O-CB 3.45Å; T500-F504 WeakPolarHBondContact O-CD2 3.43Å; T500-F504 PolarHBondContact O-N 3.07Å; F504-F506 PolarHBondContact O-N 3.35Å; F504-F506 VanDerWaalsContact O-N 3.09Å; F504-I507 HydrophobicContact CD1-CD1 3.74Å; F504-I507 HydrophobicContact CE1-CD1 4.19Å; F504-I507 HydrophobicContact CG-CD1 4.36Å; F504-I507 PolarHBondContact O-N 3.25Å
505	A	96	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.5	-172	0	0	0	0	0	114.2	L461 R466 I501 V513	L461-A505 HydrophobicContact CD1-CB 4.41Å; R466-A505 VanDerWaalsContact CZ-O 3.25Å; R466-A505 PolarHBondContact NH1-O 2.69Å; R466-A505 PolarHBondContact NH2-O 3Å; I501-A505 WeakPolarHBondContact O-CB 3.5Å; I501-A505 PolarHBondContact O-N 2.7Å; A505-V513 HydrophobicContact CB-CG2 3.97Å
506	F	96.9	Very high	96.6	Very high	39 Å²	39	34.1 Å²	34.1	17%	0.171	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	16.1	-171.9	-57.8	-77.4	0	0	0	114.5	F504 S509 V513 R540 G611 R612 I613	F504-F506 PolarHBondContact O-N 3.35Å; F504-F506 VanDerWaalsContact O-N 3.09Å; F506-S509 WeakPolarHBondContact CA-O 3.44Å; F506-V513 HydrophobicContact CE1-CG2 4.35Å; F506-V513 HydrophobicContact CZ-CG2 4.27Å; F506-R540 VanDerWaalsContact CD2-NH1 3.27Å; F506-G611 VanDerWaalsContact CZ-C 3.42Å; F506-G611 WeakPolarHBondContact CZ-O 3.26Å; F506-R612 WeakPolarHBondContact CZ-O 3.3Å; F506-I613 HydrophobicContact CE2-CD1 4.11Å; F506-I613 HydrophobicContact CE2-CG1 3.81Å; F506-I613 HydrophobicContact CZ-CG1 3.86Å
507	I	95.9	Very high	96.5	Very high	108 Å²	108	33 Å²	33	55%	0.554	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-45.2	176.8	-63	-177.9	0	0	0	111.5	L462 D503 F504	L462-I507 HydrophobicContact CD2-CB 4.22Å; L462-I507 HydrophobicContact CD2-CG2 3.93Å; D503-I507 WeakPolarHBondContact O-CD1 3.38Å; D503-I507 WeakPolarHBondContact O-CG1 3.49Å; F504-I507 HydrophobicContact CD1-CD1 3.74Å; F504-I507 HydrophobicContact CE1-CD1 4.19Å; F504-I507 HydrophobicContact CG-CD1 4.36Å; F504-I507 PolarHBondContact O-N 3.25Å
508	R	94.7	Very high	96.2	Very high	130 Å²	130	37.1 Å²	37.1	49%	0.491	18%	0.177	S	C	.	.	S	Bend	trans	-86.5	-26.6	-178.2	-175	58.6	179.6	-176.8	1.4	113.6	L462	L462-R508 WeakPolarHBondContact O-CG 3.36Å
509	S	96.9	Very high	95.9	Very high	7 Å²	7	38 Å²	38	5%	0.049	18%	0.183	C	C	.	.			trans	-156	132.7	-171.2	178.9	0	0	0	0	110.3	R466 F506 Y511 C896	R466-S509 PolarHBondContact NH1-O 2.79Å; F506-S509 WeakPolarHBondContact CA-O 3.44Å; S509-Y511 VanDerWaalsContact C-N 3.27Å; S509-Y511 PolarHBondContact OG-N 2.75Å; S509-C896 VanDerWaalsContact CB-O 3.32Å; S509-C896 WeakPolarHBondContact CB-O 3.41Å; S509-C896 WeakPolarHBondContact OG-CA 3.28Å; S509-C896 WeakPolarHBondContact OG-CB 3.3Å; S509-C896 PolarHBondContact OG-O 2.82Å
510	E	96.9	Very high	95.6	Very high	96 Å²	96	37.7 Å²	37.7	45%	0.449	18%	0.177	S	C	.	.	S	Bend	trans	-75.3	-16.8	175.7	66.3	-175.4	162.7	0	0	113.1	I610 G611	E510-I610 HydrophobicContact CB-CG2 4.12Å; E510-I610 HydrophobicContact CG-CD1 4.3Å; E510-I610 HydrophobicContact CG-CG1 4.23Å; E510-I610 HydrophobicContact CG-CG2 4.36Å; E510-G611 PolarHBondContact O-N 2.91Å
511	Y	98.2	Very high	95.3	Very high	13 Å²	13	36.8 Å²	36.8	5%	0.051	17%	0.172	C	C	.	.	S	Bend	trans	-73	151.7	-174.1	-66.4	-78.8	0	0	0	112.1	V422 M426 R466 S509 P606 I610 C896 Y898	V422-Y511 HydrophobicContact CG1-CE2 4.3Å; V422-Y511 HydrophobicContact CG2-CE2 4.02Å; M426-Y511 HydrophobicContact CB-CE1 3.88Å; M426-Y511 HydrophobicContact CE-CD1 3.49Å; M426-Y511 VanDerWaalsContact CE-CD1 3.49Å; M426-Y511 HydrophobicContact CE-CD2 4.15Å; M426-Y511 HydrophobicContact CE-CE1 3.48Å; M426-Y511 VanDerWaalsContact CE-CE1 3.48Å; M426-Y511 HydrophobicContact CE-CE2 4.18Å; M426-Y511 HydrophobicContact CE-CG 3.86Å; M426-Y511 HydrophobicContact CG-CE1 3.97Å; R466-Y511 PolarHBondContact NH1-O 3.47Å; S509-Y511 VanDerWaalsContact C-N 3.27Å; S509-Y511 PolarHBondContact OG-N 2.75Å; Y511-P606 HydrophobicContact CD1-CB 3.64Å; Y511-P606 WeakPolarHBondContact CD1-O 3.38Å; Y511-P606 HydrophobicContact CE1-CB 4.29Å; Y511-I610 HydrophobicContact CD1-CG1 4.24Å; Y511-I610 HydrophobicContact CE1-CD1 4.13Å; Y511-I610 HydrophobicContact CE1-CG1 4.08Å; Y511-C896 HydrophobicContact CD2-CB 3.88Å; Y511-C896 HydrophobicContact CE2-CB 4.36Å; Y511-Y898 HydrophobicContact CG-CD2 4.32Å
512	P	97	Very high	95	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.191	C	C	.	.			trans	-54.6	154	-168.9	20.4	-36.1	0	0	0	115	R466 P606 L609 R612 L614 Y898	R466-P512 WeakPolarHBondContact CD-O 3.38Å; P512-P606 WeakPolarHBondContact CD-O 3.49Å; P512-L609 HydrophobicContact CB-CB 3.88Å; P512-L609 HydrophobicContact CG-CB 3.6Å; P512-L609 HydrophobicContact CG-CD1 4.31Å; P512-R612 WeakPolarHBondContact CA-O 3.47Å; P512-L614 HydrophobicContact CB-CD1 3.54Å; P512-Y898 HydrophobicContact CG-CE2 4.23Å; P512-Y898 PolarHBondContact O-OH 3.23Å
513	V	98.2	Very high	94.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127	172.3	-179.3	0	0	0	0	110	L461 R466 I468 A505 F506 V515 R612 I613 L614	L461-V513 HydrophobicContact CD2-CG1 4.28Å; L461-V513 HydrophobicContact CD2-CG2 4.43Å; R466-V513 CarbonylContact O-C 3.49Å; R466-V513 WeakPolarHBondContact O-CA 3.48Å; I468-V513 HydrophobicContact CD1-CG1 4.39Å; I468-V513 HydrophobicContact CG1-CG1 4.26Å; A505-V513 HydrophobicContact CB-CG2 3.97Å; F506-V513 HydrophobicContact CE1-CG2 4.35Å; F506-V513 HydrophobicContact CZ-CG2 4.27Å; V513-V515 HydrophobicContact CG1-CG2 4Å; V513-R612 PolarHBondContact N-O 3.04Å; V513-I613 CarbonylContact O-C 3.44Å; V513-I613 WeakPolarHBondContact O-CA 3.37Å; V513-L614 PolarHBondContact O-N 3.48Å
514	I	97	Very high	94.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.4	170.8	-55.8	176.5	0	0	0	108.2	I435 R466 Y467 I468 L614 Q616 F672 I871	I435-I514 HydrophobicContact CD1-CD1 4.42Å; R466-I514 PolarHBondContact O-N 2.94Å; Y467-I514 WeakPolarHBondContact CA-O 3.33Å; Y467-I514 HydrophobicContact CD2-CB 3.75Å; Y467-I514 HydrophobicContact CD2-CD1 4.44Å; Y467-I514 HydrophobicContact CD2-CG2 3.6Å; Y467-I514 HydrophobicContact CE2-CB 4.4Å; Y467-I514 HydrophobicContact CE2-CG2 3.74Å; I468-I514 PolarHBondContact N-O 3.37Å; I514-L614 CarbonylContact C-O 3.52Å; I514-L614 WeakPolarHBondContact CA-O 3.45Å; I514-Q616 HydrophobicContact CG2-CB 4.46Å; I514-F672 HydrophobicContact CD1-CE2 4.06Å; I514-F672 HydrophobicContact CD1-CZ 4.34Å; I514-F672 HydrophobicContact CG1-CE2 4.16Å; I514-F672 HydrophobicContact CG2-CD2 4.32Å; I514-F672 HydrophobicContact CG2-CE2 4.31Å; I514-I871 HydrophobicContact CD1-CD1 4.3Å
515	V	97	Very high	94.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	109.7	-178.4	-177.7	0	0	0	0	108.5	I468 L470 I501 V513 I517 I613 L614 L615 Q616	I468-V515 HydrophobicContact CD1-CG2 4.1Å; I468-V515 HydrophobicContact CG1-CB 4.49Å; I468-V515 HydrophobicContact CG1-CG1 4.47Å; I468-V515 HydrophobicContact CG1-CG2 3.98Å; L470-V515 HydrophobicContact CD1-CG1 3.54Å; L470-V515 HydrophobicContact CD2-CG1 4.41Å; I501-V515 HydrophobicContact CG2-CG2 4.5Å; V513-V515 HydrophobicContact CG1-CG2 4Å; V515-I517 HydrophobicContact CG1-CG1 4.29Å; V515-I613 HydrophobicContact CB-CG2 4.4Å; V515-I613 HydrophobicContact CG2-CG2 3.58Å; V515-L614 PolarHBondContact N-O 3.33Å; V515-L615 HydrophobicContact CB-CD2 3.89Å; V515-L615 HydrophobicContact CG1-CD2 4.31Å; V515-L615 WeakPolarHBondContact O-CA 3.26Å; V515-Q616 PolarHBondContact O-N 3.42Å
516	S	95.6	Very high	94.3	Very high	11 Å²	11	38.9 Å²	38.9	8%	0.077	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.7	179.4	-168.5	0	0	0	0	110.7	Y467 I468 L470 Q616	Y467-S516 WeakPolarHBondContact OH-CB 2.95Å; Y467-S516 PolarHBondContact OH-OG 2.89Å; I468-S516 PolarHBondContact O-N 3.47Å; L470-S516 PolarHBondContact N-O 3.17Å; S516-Q616 PolarHBondContact OG-OE1 3.4Å
517	I	94.2	Very high	94.2	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	102.9	-172.5	-52.5	-176.6	0	0	0	109.9	V472 V515 C519 L529 L533 L615 Q616 F670	V472-I517 HydrophobicContact CG2-CG2 3.9Å; V515-I517 HydrophobicContact CG1-CG1 4.29Å; I517-C519 HydrophobicContact CG2-CB 4.32Å; I517-C519 PolarHBondContact O-N 3Å; I517-L529 HydrophobicContact CG2-CD2 4.35Å; I517-L533 HydrophobicContact CD1-CD1 3.99Å; I517-L533 HydrophobicContact CD1-CD2 3.91Å; I517-L615 HydrophobicContact CD1-CD1 4.37Å; I517-L615 HydrophobicContact CD1-CD2 4.25Å; I517-Q616 PolarHBondContact N-O 3.32Å; I517-F670 HydrophobicContact CB-CE1 4.11Å; I517-F670 HydrophobicContact CB-CZ 4.46Å; I517-F670 HydrophobicContact CD1-CE1 4.31Å; I517-F670 HydrophobicContact CG1-CE1 4.45Å
518	E	89.7	Confident	94.1	Very high	87 Å²	87	39.5 Å²	39.5	41%	0.407	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	99.6	168.2	-63.6	-163.2	135.8	0	0	108.5	L470 V472 Y520	L470-E518 PolarHBondContact O-N 2.96Å; V472-E518 PolarHBondContact N-O 3.04Å; E518-Y520 HydrophobicContact CB-CE2 3.89Å
519	C	90.4	Very high	94.1	Very high	18 Å²	18	33.3 Å²	33.3	12%	0.122	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.3	-174.6	-163.6	0	0	0	0	112.5	I517 L666	I517-C519 HydrophobicContact CG2-CB 4.32Å; I517-C519 PolarHBondContact O-N 3Å; C519-L666 HydrophobicContact CB-CD2 4.45Å
520	Y	90.4	Very high	94	Very high	59 Å²	59	33.2 Å²	33.2	23%	0.231	17%	0.169	C	C	.	.			trans	-113.3	11.7	176.4	-55.2	-75.5	0	0	0	112.5	V472 Y473 E518 T660	V472-Y520 PolarHBondContact O-N 3.46Å; Y473-Y520 HydrophobicContact CD1-CD2 4.25Å; Y473-Y520 HydrophobicContact CD1-CG 4.22Å; Y473-Y520 HydrophobicContact CD2-CD2 4.42Å; Y473-Y520 VanDerWaalsContact CE1-CB 3.42Å; Y473-Y520 AromaticContact CE1-CD2 3.63Å; Y473-Y520 HydrophobicContact CE1-CD2 3.63Å; Y473-Y520 AromaticContact CE1-CG 3.66Å; Y473-Y520 HydrophobicContact CE1-CG 3.66Å; Y473-Y520 AromaticContact CE2-CD2 3.86Å; Y473-Y520 HydrophobicContact CE2-CD2 3.86Å; Y473-Y520 HydrophobicContact CE2-CE2 4.43Å; Y473-Y520 AromaticContact CZ-CD2 3.39Å; Y473-Y520 AromaticContact CZ-CE2 3.99Å; Y473-Y520 AromaticContact CZ-CG 3.92Å; E518-Y520 HydrophobicContact CB-CE2 3.89Å; Y520-T660 VanDerWaalsContact C-OG1 3.31Å; Y520-T660 WeakPolarHBondContact CA-OG1 3.33Å
521	A	89.8	Confident	93.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-83.2	151.9	-177.4	0	0	0	0	0	112	D474 Q525 Q526 T660	D474-A521 VanDerWaalsContact OD2-CA 3.31Å; D474-A521 WeakPolarHBondContact OD2-CA 3.44Å; A521-Q525 HydrophobicContact CB-CB 4.17Å; A521-Q526 WeakPolarHBondContact O-CG 3.14Å; A521-Q526 PolarHBondContact O-NE2 2.79Å; A521-T660 PolarHBondContact O-OG1 2.84Å
522	T	91.5	Very high	93.8	Very high	64 Å²	64	33.2 Å²	33.2	39%	0.393	18%	0.175	S	C	.	.			trans	-54.8	152.4	173.1	60.1	0	0	0	0	112.4	D474 A524 Q525 Q526	D474-T522 VanDerWaalsContact CG-N 3.29Å; D474-T522 VanDerWaalsContact OD1-CB 3.31Å; D474-T522 WeakPolarHBondContact OD1-CB 3.42Å; D474-T522 WeakPolarHBondContact OD1-CG2 3.11Å; D474-T522 PolarHBondContact OD1-N 2.69Å; D474-T522 PolarHBondContact OD1-OG1 2.77Å; D474-T522 PolarHBondContact OD2-N 2.97Å; T522-A524 PolarHBondContact O-N 3.4Å; T522-Q525 CarbonylContact O-C 3.4Å; T522-Q525 PolarHBondContact O-N 3Å; T522-Q526 WeakPolarHBondContact O-CG 3.38Å; T522-Q526 PolarHBondContact O-N 2.87Å
523	Q	90.9	Very high	93.8	Very high	92 Å²	92	33.2 Å²	33.2	43%	0.43	18%	0.175	S	C	.	.	H	α-helix	trans	-55.2	-29.1	178.1	-66.3	-172	-16.8	0	0	113.7	R527 P661 I663	Q523-R527 PolarHBondContact O-N 3.3Å; Q523-P661 PolarHBondContact NE2-O 2.85Å; Q523-I663 HydrophobicContact CB-CG2 3.71Å; Q523-I663 HydrophobicContact CG-CG2 3.68Å
524	A	91.7	Very high	93.5	Very high	65 Å²	65	39.3 Å²	39.3	54%	0.537	20%	0.198	S	C	.	.	H	α-helix	trans	-64.4	-51.5	173.4	0	0	0	0	0	111.2	T522 Q526 R527 V528	T522-A524 PolarHBondContact O-N 3.4Å; A524-Q526 VanDerWaalsContact C-N 3.32Å; A524-Q526 PolarHBondContact O-N 3.45Å; A524-R527 PolarHBondContact O-N 3.33Å; A524-V528 PolarHBondContact O-N 3.08Å
525	Q	94	Very high	93.4	Very high	20 Å²	20	43.9 Å²	43.9	9%	0.093	23%	0.229	C	C	.	.	H	α-helix	trans	-71.3	-25.7	177.7	-61.4	-155.7	25.7	0	0	112.5	D474 G475 H479 P480 A521 T522 R527 V528 L529	D474-Q525 VanDerWaalsContact CA-OE1 3.29Å; D474-Q525 VanDerWaalsContact OD1-CD 3.25Å; D474-Q525 VanDerWaalsContact OD1-CG 3.3Å; D474-Q525 WeakPolarHBondContact OD1-CG 3.48Å; D474-Q525 PolarHBondContact OD1-NE2 2.77Å; G475-Q525 PolarHBondContact O-NE2 2.95Å; H479-Q525 PolarHBondContact O-OE1 2.85Å; H479-Q525 VanDerWaalsContact O-OE1 3.07Å; P480-Q525 HydrophobicContact CG-CB 4.2Å; P480-Q525 WeakPolarHBondContact CG-O 3.12Å; A521-Q525 HydrophobicContact CB-CB 4.17Å; T522-Q525 CarbonylContact O-C 3.4Å; T522-Q525 PolarHBondContact O-N 3Å; Q525-R527 VanDerWaalsContact C-N 3.31Å; Q525-R527 PolarHBondContact O-N 3.01Å; Q525-V528 CarbonylContact O-C 3.56Å; Q525-V528 WeakPolarHBondContact O-CA 3.35Å; Q525-V528 WeakPolarHBondContact O-CB 3.49Å; Q525-V528 PolarHBondContact O-N 3.34Å; Q525-V528 VanDerWaalsContact O-N 3.11Å; Q525-L529 PolarHBondContact O-N 2.82Å
526	Q	94.4	Very high	93.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-34.6	170.5	-69.9	-178	31.1	0	0	112.9	A521 T522 A524 V528 L529 V530 I663 L666	A521-Q526 WeakPolarHBondContact O-CG 3.14Å; A521-Q526 PolarHBondContact O-NE2 2.79Å; T522-Q526 WeakPolarHBondContact O-CG 3.38Å; T522-Q526 PolarHBondContact O-N 2.87Å; A524-Q526 VanDerWaalsContact C-N 3.32Å; A524-Q526 PolarHBondContact O-N 3.45Å; Q526-V528 VanDerWaalsContact C-N 3.34Å; Q526-L529 WeakPolarHBondContact O-CB 3.29Å; Q526-L529 PolarHBondContact O-N 2.95Å; Q526-V530 WeakPolarHBondContact O-CG2 3.48Å; Q526-V530 PolarHBondContact O-N 3.38Å; Q526-I663 HydrophobicContact CB-CD1 3.66Å; Q526-I663 HydrophobicContact CB-CG1 3.9Å; Q526-I663 HydrophobicContact CB-CG2 4.38Å; Q526-L666 HydrophobicContact CB-CD2 4.34Å; Q526-L666 HydrophobicContact CG-CD2 4.27Å
527	R	93.9	Very high	93.3	Very high	118 Å²	118	44.1 Å²	44.1	45%	0.445	23%	0.23	S	C	.	.	H	α-helix	trans	-67.5	-35.9	172.3	-66.6	-169.4	174.9	101.1	3.3	112.4	Q523 A524 Q525 V530 T531 I663 E665	Q523-R527 PolarHBondContact O-N 3.3Å; A524-R527 PolarHBondContact O-N 3.33Å; Q525-R527 VanDerWaalsContact C-N 3.31Å; Q525-R527 PolarHBondContact O-N 3.01Å; R527-V530 PolarHBondContact O-N 3.43Å; R527-T531 PolarHBondContact O-N 2.79Å; R527-T531 PolarHBondContact O-OG1 2.76Å; R527-I663 HydrophobicContact CB-CD1 4.33Å; R527-I663 HydrophobicContact CG-CD1 3.51Å; R527-E665 WeakPolarHBondContact CG-OE2 3.08Å; R527-E665 IonicContact CZ-OE1 3.44Å; R527-E665 IonicContact NE-OE1 2.73Å; R527-E665 PolarHBondContact NE-OE1 3.47Å; R527-E665 IonicContact NE-OE2 2.75Å; R527-E665 IonicContact NH2-OE1 3.56Å; R527-E665 PolarHBondContact NH2-OE1 3.23Å
528	V	94.7	Very high	93.1	Very high	41 Å²	41	45.7 Å²	45.7	25%	0.248	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-39.6	174.1	-178.4	0	0	0	0	110.5	P480 A524 Q525 Q526 T531 F532	P480-V528 HydrophobicContact CG-CB 4.37Å; P480-V528 HydrophobicContact CG-CG1 4.4Å; A524-V528 PolarHBondContact O-N 3.08Å; Q525-V528 CarbonylContact O-C 3.56Å; Q525-V528 WeakPolarHBondContact O-CA 3.35Å; Q525-V528 WeakPolarHBondContact O-CB 3.49Å; Q525-V528 PolarHBondContact O-N 3.34Å; Q525-V528 VanDerWaalsContact O-N 3.11Å; Q526-V528 VanDerWaalsContact C-N 3.34Å; V528-T531 WeakPolarHBondContact O-CB 3.45Å; V528-T531 PolarHBondContact O-N 3.19Å; V528-F532 HydrophobicContact CG1-CD2 3.76Å; V528-F532 HydrophobicContact CG1-CE2 3.47Å; V528-F532 VanDerWaalsContact CG1-CE2 3.47Å; V528-F532 HydrophobicContact CG1-CZ 4.4Å; V528-F532 WeakPolarHBondContact O-CD2 3.18Å; V528-F532 PolarHBondContact O-N 2.66Å
529	L	94.9	Very high	93.2	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-48.2	171.8	175.9	64.2	0	0	0	111.9	V472 P480 I494 I517 Q525 Q526 T531 F532 L533 L666	V472-L529 HydrophobicContact CG1-CD2 4.27Å; P480-L529 HydrophobicContact CG-CB 3.93Å; I494-L529 HydrophobicContact CD1-CD1 4.12Å; I494-L529 HydrophobicContact CG1-CD1 3.74Å; I517-L529 HydrophobicContact CG2-CD2 4.35Å; Q525-L529 PolarHBondContact O-N 2.82Å; Q526-L529 WeakPolarHBondContact O-CB 3.29Å; Q526-L529 PolarHBondContact O-N 2.95Å; L529-T531 VanDerWaalsContact C-N 3.26Å; L529-T531 PolarHBondContact O-N 3.21Å; L529-F532 PolarHBondContact O-N 3.29Å; L529-L533 HydrophobicContact CD1-CD1 4.05Å; L529-L533 HydrophobicContact CD1-CG 4.08Å; L529-L533 HydrophobicContact CG-CD1 3.88Å; L529-L533 HydrophobicContact CG-CG 4.36Å; L529-L533 WeakPolarHBondContact O-CB 3.14Å; L529-L533 VanDerWaalsContact O-CG 3.3Å; L529-L533 WeakPolarHBondContact O-CG 3.44Å; L529-L533 PolarHBondContact O-N 2.81Å; L529-L666 HydrophobicContact CD2-CD1 4.17Å; L529-L666 HydrophobicContact CD2-CD2 3.93Å; L529-L666 HydrophobicContact CG-CD1 4.42Å
530	V	94.6	Very high	93.3	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.024	27%	0.27	C	S	.	.	H	α-helix	trans	-54.4	-44.2	173.9	162.5	0	0	0	0	111.4	Q526 R527 R534 I663 E665 L666 M669	Q526-V530 WeakPolarHBondContact O-CG2 3.48Å; Q526-V530 PolarHBondContact O-N 3.38Å; R527-V530 PolarHBondContact O-N 3.43Å; V530-R534 WeakPolarHBondContact O-CG 3.43Å; V530-R534 PolarHBondContact O-N 3.3Å; V530-R534 VanDerWaalsContact O-N 3.15Å; V530-I663 HydrophobicContact CG2-CD1 4.32Å; V530-E665 HydrophobicContact CG1-CB 4.44Å; V530-E665 HydrophobicContact CG2-CB 4.23Å; V530-L666 VanDerWaalsContact CG2-CA 3.49Å; V530-L666 HydrophobicContact CG2-CB 3.57Å; V530-L666 HydrophobicContact CG2-CD1 3.91Å; V530-L666 HydrophobicContact CG2-CG 4.31Å; V530-M669 HydrophobicContact CB-SD 4.19Å; V530-M669 HydrophobicContact CG1-SD 3.79Å; V530-M669 HydrophobicContact CG2-SD 4.02Å
531	T	94.5	Very high	93.5	Very high	79 Å²	79	48.2 Å²	48.2	49%	0.485	26%	0.263	S	S	.	.	H	α-helix	trans	-63.9	-50.8	178.4	-54.5	0	0	0	0	110.9	R527 V528 L529 L533 R534 C535	R527-T531 PolarHBondContact O-N 2.79Å; R527-T531 PolarHBondContact O-OG1 2.76Å; V528-T531 WeakPolarHBondContact O-CB 3.45Å; V528-T531 PolarHBondContact O-N 3.19Å; L529-T531 VanDerWaalsContact C-N 3.26Å; L529-T531 PolarHBondContact O-N 3.21Å; T531-L533 PolarHBondContact O-N 2.83Å; T531-R534 PolarHBondContact O-N 3.08Å; T531-C535 WeakPolarHBondContact O-CB 3.5Å; T531-C535 PolarHBondContact O-N 3.5Å; T531-C535 PolarHBondContact O-SG 2.87Å; T531-C535 VanDerWaalsContact O-SG 3.36Å
532	F	95.9	Very high	93.5	Very high	30 Å²	30	48.5 Å²	48.5	13%	0.132	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-39	177.5	-74.9	-53.7	0	0	0	113.2	H479 I494 Q495 L498 V528 L529 R534 C535 C536	H479-F532 HydrophobicContact CB-CE2 4.4Å; H479-F532 AromaticContact ND1-CE2 3.73Å; H479-F532 AromaticContact ND1-CZ 3.86Å; I494-F532 HydrophobicContact CG2-CD2 3.56Å; I494-F532 HydrophobicContact CG2-CE2 4Å; I494-F532 HydrophobicContact CG2-CG 4.31Å; Q495-F532 HydrophobicContact CB-CD1 4.08Å; Q495-F532 HydrophobicContact CB-CE1 3.91Å; Q495-F532 HydrophobicContact CB-CZ 4.18Å; Q495-F532 HydrophobicContact CG-CD1 3.97Å; Q495-F532 HydrophobicContact CG-CE1 3.81Å; L498-F532 HydrophobicContact CD1-CB 3.86Å; V528-F532 HydrophobicContact CG1-CD2 3.76Å; V528-F532 HydrophobicContact CG1-CE2 3.47Å; V528-F532 VanDerWaalsContact CG1-CE2 3.47Å; V528-F532 HydrophobicContact CG1-CZ 4.4Å; V528-F532 WeakPolarHBondContact O-CD2 3.18Å; V528-F532 PolarHBondContact O-N 2.66Å; L529-F532 PolarHBondContact O-N 3.29Å; F532-R534 VanDerWaalsContact C-N 3.32Å; F532-R534 PolarHBondContact O-N 3.37Å; F532-C535 PolarHBondContact O-N 2.93Å; F532-C536 WeakPolarHBondContact O-CB 3.37Å; F532-C536 PolarHBondContact O-N 3.44Å; F532-C536 PolarHBondContact O-SG 3.01Å; F532-C536 VanDerWaalsContact O-SG 3.42Å
533	L	95.9	Very high	93.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.9	-43.3	176.1	-76.9	167.6	0	0	0	111.6	L498 I517 L529 T531 L537 L615 L666 M669	L498-L533 HydrophobicContact CD1-CD2 4.03Å; L498-L533 HydrophobicContact CD1-CG 4.25Å; L498-L533 HydrophobicContact CD2-CD2 3.7Å; I517-L533 HydrophobicContact CD1-CD1 3.99Å; I517-L533 HydrophobicContact CD1-CD2 3.91Å; L529-L533 HydrophobicContact CD1-CD1 4.05Å; L529-L533 HydrophobicContact CD1-CG 4.08Å; L529-L533 HydrophobicContact CG-CD1 3.88Å; L529-L533 HydrophobicContact CG-CG 4.36Å; L529-L533 WeakPolarHBondContact O-CB 3.14Å; L529-L533 VanDerWaalsContact O-CG 3.3Å; L529-L533 WeakPolarHBondContact O-CG 3.44Å; L529-L533 PolarHBondContact O-N 2.81Å; T531-L533 PolarHBondContact O-N 2.83Å; L533-L537 HydrophobicContact CD2-CD1 3.96Å; L533-L537 WeakPolarHBondContact O-CB 3.27Å; L533-L537 PolarHBondContact O-N 3.29Å; L533-L615 HydrophobicContact CD1-CD1 4.13Å; L533-L615 HydrophobicContact CD2-CD1 4.2Å; L533-L615 HydrophobicContact CD2-CD2 4.48Å; L533-L666 HydrophobicContact CD1-CD1 3.79Å; L533-M669 HydrophobicContact CB-CE 3.59Å; L533-M669 HydrophobicContact CD1-CE 4.27Å
534	R	93.4	Very high	92.5	Very high	128 Å²	128	44.6 Å²	44.6	48%	0.483	24%	0.244	S	C	.	.	H	α-helix	trans	-69.6	-44.4	176.4	-66.9	175.9	-170.5	173.9	4.8	112.1	V530 T531 F532 G538 E665 M669	V530-R534 WeakPolarHBondContact O-CG 3.43Å; V530-R534 PolarHBondContact O-N 3.3Å; V530-R534 VanDerWaalsContact O-N 3.15Å; T531-R534 PolarHBondContact O-N 3.08Å; F532-R534 VanDerWaalsContact C-N 3.32Å; F532-R534 PolarHBondContact O-N 3.37Å; R534-G538 WeakPolarHBondContact O-CA 3.3Å; R534-G538 PolarHBondContact O-N 2.99Å; R534-G538 VanDerWaalsContact O-N 3.14Å; R534-E665 PolarHBondContact NH2-O 2.87Å; R534-M669 HydrophobicContact CG-CE 3.65Å; R534-M669 HydrophobicContact CG-SD 4.22Å
535	C	93.9	Very high	91.5	Very high	97 Å²	97	46.4 Å²	46.4	66%	0.655	25%	0.245	S	C	*	.	H	α-helix	trans	-74.6	-40.5	-175.5	-68.5	0	0	0	0	114.1	T531 F532	T531-C535 WeakPolarHBondContact O-CB 3.5Å; T531-C535 PolarHBondContact O-N 3.5Å; T531-C535 PolarHBondContact O-SG 2.87Å; T531-C535 VanDerWaalsContact O-SG 3.36Å; F532-C535 PolarHBondContact O-N 2.93Å
536	C	95.4	Very high	90.5	Very high	14 Å²	14	47.3 Å²	47.3	10%	0.095	25%	0.253	C	S	.	.	H	α-helix	trans	-83.5	-37.3	-175.6	-63.1	0	0	0	0	113	L498 N499 H502 F532	L498-C536 HydrophobicContact CB-CB 3.66Å; N499-C536 PolarHBondContact OD1-SG 2.7Å; H502-C536 WeakPolarHBondContact CB-O 3.22Å; H502-C536 PolarHBondContact CD2-O 2.68Å; F532-C536 WeakPolarHBondContact O-CB 3.37Å; F532-C536 PolarHBondContact O-N 3.44Å; F532-C536 PolarHBondContact O-SG 3.01Å; F532-C536 VanDerWaalsContact O-SG 3.42Å
537	L	95	Very high	89.2	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-89.4	-22.6	-180	-52.4	-178.6	0	0	0	112.5	L498 I501 L533 N539 R540 L541 I613 L615	L498-L537 HydrophobicContact CB-CD2 4.45Å; L498-L537 HydrophobicContact CD2-CD1 4.31Å; L498-L537 HydrophobicContact CD2-CD2 4.23Å; L498-L537 HydrophobicContact CD2-CG 4.38Å; I501-L537 HydrophobicContact CG2-CD2 4.28Å; L533-L537 HydrophobicContact CD2-CD1 3.96Å; L533-L537 WeakPolarHBondContact O-CB 3.27Å; L533-L537 PolarHBondContact O-N 3.29Å; L537-N539 PolarHBondContact O-N 3.19Å; L537-R540 WeakPolarHBondContact O-CB 3.43Å; L537-R540 PolarHBondContact O-N 2.95Å; L537-R540 VanDerWaalsContact O-N 3.08Å; L537-L541 HydrophobicContact CB-CB 4.04Å; L537-I613 HydrophobicContact CD1-CG2 4.23Å; L537-I613 HydrophobicContact CD2-CD1 3.96Å; L537-L615 HydrophobicContact CD1-CD2 4.41Å
538	G	91.4	Very high	88.2	Confident	42 Å²	42	50.4 Å²	50.4	43%	0.433	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	53.4	-129.9	171	0	0	0	0	0	113.7	R534 R540 L541	R534-G538 WeakPolarHBondContact O-CA 3.3Å; R534-G538 PolarHBondContact O-N 2.99Å; R534-G538 VanDerWaalsContact O-N 3.14Å; G538-R540 PolarHBondContact O-N 3.49Å; G538-L541 PolarHBondContact O-N 2.87Å
539	N	90.5	Very high	87.3	Confident	132 Å²	132	52.7 Å²	52.7	71%	0.706	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-73.7	-8.4	-179.4	68.1	-20.8	0	0	0	114.7	L537 R612	L537-N539 PolarHBondContact O-N 3.19Å; N539-R612 PolarHBondContact O-NH1 2.8Å
540	R	93.3	Very high	86.5	Confident	69 Å²	69	53 Å²	53	26%	0.26	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-74.9	-32.7	175	-54.9	-177.2	-178.6	-88.4	10.8	111	H502 F506 L537 G538 L542 R612 I613	H502-R540 PolarHBondContact CD2-NE 3.46Å; H502-R540 PolarHBondContact NE2-NE 2.8Å; F506-R540 VanDerWaalsContact CD2-NH1 3.27Å; L537-R540 WeakPolarHBondContact O-CB 3.43Å; L537-R540 PolarHBondContact O-N 2.95Å; L537-R540 VanDerWaalsContact O-N 3.08Å; G538-R540 PolarHBondContact O-N 3.49Å; R540-L542 PolarHBondContact O-N 2.96Å; R540-R612 CarbonylContact O-C 3.56Å; R540-R612 VanDerWaalsContact O-CA 3.3Å; R540-R612 WeakPolarHBondContact O-CA 3.41Å; R540-I613 HydrophobicContact CB-CD1 3.94Å; R540-I613 HydrophobicContact CB-CG1 4.09Å; R540-I613 PolarHBondContact O-N 3Å
541	L	94	Very high	85.6	Confident	16 Å²	16	56.4 Å²	56.4	8%	0.084	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	123	178.3	176.6	58.5	0	0	0	111.3	L537 G538 L543 L615 M669	L537-L541 HydrophobicContact CB-CB 4.04Å; G538-L541 PolarHBondContact O-N 2.87Å; L541-L543 HydrophobicContact CD1-CD2 4.42Å; L541-L543 HydrophobicContact CD2-CD2 3.93Å; L541-L543 HydrophobicContact CG-CD2 3.97Å; L541-L543 HydrophobicContact CG-CG 4.38Å; L541-L615 HydrophobicContact CD1-CD1 3.76Å; L541-L615 HydrophobicContact CD1-CD2 4.1Å; L541-L615 HydrophobicContact CD1-CG 3.59Å; L541-M669 HydrophobicContact CD2-CE 3.55Å
542	L	90.3	Very high	84.4	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.5	172	-175.3	65.9	0	0	0	109.8	R540 F548 L609 R612 I613 L614 F671	R540-L542 PolarHBondContact O-N 2.96Å; L542-F548 HydrophobicContact CD1-CB 4.06Å; L542-F548 HydrophobicContact CD1-CD2 3.76Å; L542-F548 HydrophobicContact CD1-CG 4.07Å; L542-F548 HydrophobicContact CD2-CD2 4.33Å; L542-L609 HydrophobicContact CD2-CD2 3.53Å; L542-R612 HydrophobicContact CB-CB 4.32Å; L542-I613 PolarHBondContact N-O 3.4Å; L542-L614 HydrophobicContact CD2-CD2 4.19Å; L542-L614 HydrophobicContact CD2-CG 4.41Å; L542-F671 HydrophobicContact CD2-CD2 4.14Å; L542-F671 HydrophobicContact CD2-CE2 3.69Å; L542-F671 HydrophobicContact CD2-CZ 4.42Å; L542-F671 HydrophobicContact CG-CD2 4.22Å; L542-F671 HydrophobicContact CG-CE2 4.11Å
543	L	85.8	Confident	83.1	Confident	58 Å²	58	52.7 Å²	52.7	30%	0.304	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-103.8	146.3	-178.7	-63.4	174.8	0	0	0	111.1	L541 N545 S546 M669	L541-L543 HydrophobicContact CD1-CD2 4.42Å; L541-L543 HydrophobicContact CD2-CD2 3.93Å; L541-L543 HydrophobicContact CG-CD2 3.97Å; L541-L543 HydrophobicContact CG-CG 4.38Å; L543-N545 PolarHBondContact O-N 3.28Å; L543-N545 VanDerWaalsContact O-N 3.16Å; L543-S546 WeakPolarHBondContact O-CB 3.43Å; L543-S546 PolarHBondContact O-N 2.9Å; L543-S546 VanDerWaalsContact O-N 3.11Å; L543-S546 PolarHBondContact O-OG 2.82Å; L543-M669 HydrophobicContact CD2-CB 4.05Å; L543-M669 HydrophobicContact CD2-CE 4.4Å; L543-M669 HydrophobicContact CD2-CG 4.04Å
544	P	75.6	Confident	81.7	Confident	16 Å²	16	60.5 Å²	60.5	10%	0.104	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-36.5	-177.2	-19.1	26.3	0	0	0	113.9	D668 F670	P544-D668 WeakPolarHBondContact CD-O 3.32Å; P544-F670 WeakPolarHBondContact CG-O 3.4Å
545	N	70.9	Confident	80.3	Confident	103 Å²	103	55.8 Å²	55.8	55%	0.551	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	6.4	-173.6	-54.7	-16.9	0	0	0	112.6	L543 K588	L543-N545 PolarHBondContact O-N 3.28Å; L543-N545 VanDerWaalsContact O-N 3.16Å; N545-K588 VanDerWaalsContact O-CE 3.27Å; N545-K588 WeakPolarHBondContact O-CE 3.26Å
546	S	72	Confident	79	Confident	39 Å²	39	52.2 Å²	52.2	27%	0.273	28%	0.282	S	S	.	.	S	Bend	trans	-78.8	157.9	178.8	65.4	0	0	0	0	111.9	L543 F548	L543-S546 WeakPolarHBondContact O-CB 3.43Å; L543-S546 PolarHBondContact O-N 2.9Å; L543-S546 VanDerWaalsContact O-N 3.11Å; L543-S546 PolarHBondContact O-OG 2.82Å; S546-F548 PolarHBondContact O-N 3.48Å
547	E	67.2	Low	77.8	Confident	165 Å²	165	54.7 Å²	54.7	77%	0.771	30%	0.295	S	S	*	.			trans	-75.1	95.8	176.3	-69.9	-177.6	176.1	0	0	109.7	K588	E547-K588 HydrophobicContact CG-CD 4.06Å; E547-K588 IonicContact OE1-NZ 2.81Å; E547-K588 PolarHBondContact OE1-NZ 2.7Å
548	F	73.8	Confident	76.5	Confident	19 Å²	19	60.2 Å²	60.2	8%	0.083	32%	0.32	C	S	.	.			trans	-129.1	107.6	175.1	-174.1	-86.1	0	0	0	109.1	L542 S546 F550 L587 P604 D608 L609	L542-F548 HydrophobicContact CD1-CB 4.06Å; L542-F548 HydrophobicContact CD1-CD2 3.76Å; L542-F548 HydrophobicContact CD1-CG 4.07Å; L542-F548 HydrophobicContact CD2-CD2 4.33Å; S546-F548 PolarHBondContact O-N 3.48Å; F548-F550 HydrophobicContact CD1-CD1 4.12Å; F548-F550 HydrophobicContact CE1-CB 4.03Å; F548-F550 AromaticContact CE1-CD1 3.79Å; F548-F550 HydrophobicContact CE1-CD1 3.79Å; F548-F550 HydrophobicContact CE1-CG 4.23Å; F548-L587 HydrophobicContact CB-CD1 4.07Å; F548-L587 HydrophobicContact CD1-CD1 3.48Å; F548-L587 VanDerWaalsContact CD1-CD1 3.48Å; F548-L587 HydrophobicContact CD1-CG 3.92Å; F548-L587 HydrophobicContact CE1-CD1 4.3Å; F548-L587 HydrophobicContact CG-CD1 4.08Å; F548-L587 PolarHBondContact O-N 3.42Å; F548-P604 HydrophobicContact CE1-CB 4.17Å; F548-D608 HydrophobicContact CZ-CB 4.04Å; F548-D608 WeakPolarHBondContact CZ-O 3.26Å; F548-L609 HydrophobicContact CE1-CD2 4.13Å; F548-L609 HydrophobicContact CE2-CD2 4.09Å; F548-L609 HydrophobicContact CZ-CD2 3.63Å; F548-L609 HydrophobicContact CZ-CG 4.35Å
549	T	75.1	Confident	75.2	Confident	89 Å²	89	60.3 Å²	60.3	55%	0.546	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.6	175.2	52.9	0	0	0	0	110.2	V584 V585 D586	T549-V584 HydrophobicContact CG2-CG1 4.09Å; T549-V585 WeakPolarHBondContact CA-O 3.21Å; T549-D586 HydrophobicContact CG2-CB 4.09Å
550	F	77.8	Confident	73.9	Confident	6 Å²	6	55 Å²	55	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.1	176.5	67.2	-78.8	0	0	0	110.8	F548 V584 V585 L587 R602 P604 D608	F548-F550 HydrophobicContact CD1-CD1 4.12Å; F548-F550 HydrophobicContact CE1-CB 4.03Å; F548-F550 AromaticContact CE1-CD1 3.79Å; F548-F550 HydrophobicContact CE1-CD1 3.79Å; F548-F550 HydrophobicContact CE1-CG 4.23Å; F550-V584 WeakPolarHBondContact O-CA 3.15Å; F550-V585 HydrophobicContact CD1-CB 4.09Å; F550-V585 HydrophobicContact CD1-CG1 4.47Å; F550-V585 HydrophobicContact CE1-CB 3.55Å; F550-V585 HydrophobicContact CE1-CG1 3.53Å; F550-V585 HydrophobicContact CE1-CG2 4.45Å; F550-V585 HydrophobicContact CE2-CB 4.05Å; F550-V585 HydrophobicContact CE2-CG1 4.49Å; F550-V585 HydrophobicContact CE2-CG2 4.11Å; F550-V585 HydrophobicContact CZ-CB 3.52Å; F550-V585 HydrophobicContact CZ-CG1 3.54Å; F550-V585 HydrophobicContact CZ-CG2 3.95Å; F550-V585 PolarHBondContact N-O 2.89Å; F550-V585 VanDerWaalsContact N-O 3.1Å; F550-V585 PolarHBondContact O-N 2.82Å; F550-L587 HydrophobicContact CD1-CD2 4.45Å; F550-L587 HydrophobicContact CE1-CD2 3.7Å; F550-L587 HydrophobicContact CE1-CG 4.38Å; F550-R602 HydrophobicContact CZ-CB 4.45Å; F550-R602 WeakPolarHBondContact CZ-O 3.42Å; F550-P604 HydrophobicContact CD1-CB 3.96Å; F550-P604 HydrophobicContact CD2-CB 3.91Å; F550-P604 HydrophobicContact CE1-CB 4.06Å; F550-P604 HydrophobicContact CE1-CG 4.4Å; F550-P604 VanDerWaalsContact CE2-CA 3.46Å; F550-P604 HydrophobicContact CE2-CB 4.02Å; F550-P604 HydrophobicContact CG-CB 3.89Å; F550-P604 HydrophobicContact CZ-CB 4.09Å; F550-P604 HydrophobicContact CZ-CG 4.49Å; F550-D608 HydrophobicContact CB-CB 4.02Å
551	N	75.8	Confident	72.7	Confident	76 Å²	76	56.5 Å²	56.5	41%	0.406	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	147	-179.8	-62.4	-51.7	0	0	0	110.2
552	L	69	Low	71.3	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.099	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-65.6	141.8	166.7	-75.5	-160.9	0	0	0	112.2	Q556 L557 T583 V585 R602	L552-Q556 HydrophobicContact CB-CB 4.17Å; L552-Q556 HydrophobicContact CD1-CB 3.93Å; L552-Q556 HydrophobicContact CD2-CB 3.93Å; L552-Q556 HydrophobicContact CD2-CG 4.35Å; L552-Q556 HydrophobicContact CG-CB 4.25Å; L552-L557 HydrophobicContact CB-CD2 4.11Å; L552-L557 HydrophobicContact CB-CG 3.96Å; L552-L557 HydrophobicContact CD1-CD2 4.11Å; L552-L557 HydrophobicContact CD1-CG 4.47Å; L552-T583 PolarHBondContact N-O 2.88Å; L552-V585 HydrophobicContact CD2-CG2 4.04Å; L552-V585 HydrophobicContact CG-CG2 4.33Å; L552-R602 HydrophobicContact CD2-CB 3.95Å; L552-R602 HydrophobicContact CD2-CG 3.99Å
553	S	68.2	Low	69.9	Low	12 Å²	12	62.2 Å²	62.2	8%	0.084	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-70.1	157.8	165.1	59.8	0	0	0	0	111.9	S427 S555 Q556 L557	S427-S553 WeakPolarHBondContact O-CB 3.35Å; S553-S555 PolarHBondContact O-N 3Å; S553-S555 PolarHBondContact OG-OG 3.14Å; S553-Q556 PolarHBondContact O-N 3.1Å; S553-Q556 WeakPolarHBondContact OG-CG 3.26Å; S553-Q556 PolarHBondContact OG-N 3.3Å; S553-Q556 PolarHBondContact OG-OE1 2.96Å; S553-L557 PolarHBondContact O-N 2.99Å
554	E	66.9	Low	68.8	Low	165 Å²	165	62.2 Å²	62.2	77%	0.771	32%	0.318	S	S	*	.	H	α-helix	trans	-56.4	-37.9	177	-64.7	-176.8	147	0	0	112	Q556 L557 E558	E554-Q556 PolarHBondContact O-N 2.8Å; E554-L557 WeakPolarHBondContact O-CB 3.45Å; E554-L557 PolarHBondContact O-N 2.78Å; E554-E558 WeakPolarHBondContact O-CG 3.27Å; E554-E558 PolarHBondContact O-N 2.93Å
555	S	64.1	Low	68.2	Low	29 Å²	29	66.6 Å²	66.6	20%	0.203	34%	0.335	C	S	.	.	H	α-helix	trans	-68.9	-29.6	176.5	57.9	0	0	0	0	113.7	Q428 S553 I559	Q428-S555 VanDerWaalsContact CD-OG 3.29Å; Q428-S555 PolarHBondContact NE2-OG 3.06Å; Q428-S555 PolarHBondContact OE1-OG 3Å; S553-S555 PolarHBondContact O-N 3Å; S553-S555 PolarHBondContact OG-OG 3.14Å; S555-I559 WeakPolarHBondContact O-CD1 3.36Å; S555-I559 VanDerWaalsContact O-CG1 3.26Å; S555-I559 WeakPolarHBondContact O-CG1 3.08Å; S555-I559 PolarHBondContact O-N 3.05Å
556	Q	67.8	Low	67.5	Low	21 Å²	21	67 Å²	67	10%	0.098	34%	0.341	C	S	.	.	H	α-helix	trans	-73.5	-37.9	171	-71.3	165	-64.2	0	0	111.2	P429 L552 S553 E554 I559 E560 W603	P429-Q556 HydrophobicContact CG-CG 3.89Å; L552-Q556 HydrophobicContact CB-CB 4.17Å; L552-Q556 HydrophobicContact CD1-CB 3.93Å; L552-Q556 HydrophobicContact CD2-CB 3.93Å; L552-Q556 HydrophobicContact CD2-CG 4.35Å; L552-Q556 HydrophobicContact CG-CB 4.25Å; S553-Q556 PolarHBondContact O-N 3.1Å; S553-Q556 WeakPolarHBondContact OG-CG 3.26Å; S553-Q556 PolarHBondContact OG-N 3.3Å; S553-Q556 PolarHBondContact OG-OE1 2.96Å; E554-Q556 PolarHBondContact O-N 2.8Å; Q556-I559 PolarHBondContact O-N 2.8Å; Q556-E560 PolarHBondContact O-N 2.83Å; Q556-W603 PolarHBondContact NE2-O 2.78Å; Q556-W603 VanDerWaalsContact NE2-O 3.08Å
557	L	70	Confident	66.7	Low	67 Å²	67	70.6 Å²	70.6	35%	0.351	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-41.7	174.2	-70	169.1	0	0	0	111.9	L552 S553 E554 E560 E561 T583	L552-L557 HydrophobicContact CB-CD2 4.11Å; L552-L557 HydrophobicContact CB-CG 3.96Å; L552-L557 HydrophobicContact CD1-CD2 4.11Å; L552-L557 HydrophobicContact CD1-CG 4.47Å; S553-L557 PolarHBondContact O-N 2.99Å; E554-L557 WeakPolarHBondContact O-CB 3.45Å; E554-L557 PolarHBondContact O-N 2.78Å; L557-E560 PolarHBondContact O-N 2.83Å; L557-E561 WeakPolarHBondContact O-CB 3.39Å; L557-E561 PolarHBondContact O-N 3.11Å; L557-T583 VanDerWaalsContact CD2-OG1 3.3Å; L557-T583 WeakPolarHBondContact CD2-OG1 3.27Å
558	E	66.6	Low	66	Low	117 Å²	117	66.6 Å²	66.6	55%	0.547	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-40.3	173.7	-76.9	-171.9	154.8	0	0	112.3	E554 E561 Q562	E554-E558 WeakPolarHBondContact O-CG 3.27Å; E554-E558 PolarHBondContact O-N 2.93Å; E558-E561 PolarHBondContact O-N 2.86Å; E558-Q562 WeakPolarHBondContact O-CB 3.46Å; E558-Q562 VanDerWaalsContact O-CG 3.26Å; E558-Q562 WeakPolarHBondContact O-CG 3.35Å; E558-Q562 PolarHBondContact O-N 2.86Å
559	I	63.6	Low	64.9	Low	44 Å²	44	74.2 Å²	74.2	23%	0.226	37%	0.371	C	S	.	.	H	α-helix	trans	-65.4	-43.2	175.7	-70.6	166.3	0	0	0	110.4	S555 Q556 Q562 V563	S555-I559 WeakPolarHBondContact O-CD1 3.36Å; S555-I559 VanDerWaalsContact O-CG1 3.26Å; S555-I559 WeakPolarHBondContact O-CG1 3.08Å; S555-I559 PolarHBondContact O-N 3.05Å; Q556-I559 PolarHBondContact O-N 2.8Å; I559-Q562 PolarHBondContact O-N 2.86Å; I559-V563 WeakPolarHBondContact O-CB 3.41Å; I559-V563 VanDerWaalsContact O-CG2 3.3Å; I559-V563 WeakPolarHBondContact O-CG2 3.32Å; I559-V563 PolarHBondContact O-N 2.9Å
560	E	65	Low	63.5	Low	21 Å²	21	74.8 Å²	74.8	10%	0.098	38%	0.378	C	S	.	.	H	α-helix	trans	-64.5	-40.1	175.1	-174	157	-128.2	0	0	111.6	Q556 L557 V563 E564 S596 R602	Q556-E560 PolarHBondContact O-N 2.83Å; L557-E560 PolarHBondContact O-N 2.83Å; E560-V563 PolarHBondContact O-N 3.22Å; E560-E564 PolarHBondContact O-N 3.08Å; E560-S596 PolarHBondContact OE1-N 3.04Å; E560-R602 IonicContact OE1-CZ 3.88Å; E560-R602 IonicContact OE1-NH1 2.75Å; E560-R602 PolarHBondContact OE1-NH1 3.16Å; E560-R602 IonicContact OE1-NH2 3.53Å; E560-R602 PolarHBondContact OE1-NH2 3.3Å; E560-R602 IonicContact OE2-CZ 2.7Å; E560-R602 IonicContact OE2-NH1 2.69Å; E560-R602 PolarHBondContact OE2-NH1 2.75Å; E560-R602 IonicContact OE2-NH2 3.69Å
561	E	68.3	Low	61.7	Low	99 Å²	99	81 Å²	81	46%	0.463	41%	0.409	S	S	.	.	H	α-helix	trans	-68.4	-35	175.9	-156.4	-148.1	177.8	0	0	112.3	L557 E558 E564 K565	L557-E561 WeakPolarHBondContact O-CB 3.39Å; L557-E561 PolarHBondContact O-N 3.11Å; E558-E561 PolarHBondContact O-N 2.86Å; E561-E564 PolarHBondContact O-N 3.17Å; E561-K565 HydrophobicContact CG-CD 4.36Å; E561-K565 WeakPolarHBondContact O-CB 3.26Å; E561-K565 WeakPolarHBondContact O-CD 3.42Å; E561-K565 WeakPolarHBondContact O-CG 3.37Å; E561-K565 PolarHBondContact O-N 3.32Å; E561-K565 WeakPolarHBondContact OE1-CE 3.31Å; E561-K565 IonicContact OE1-NZ 4Å; E561-K565 PolarHBondContact OE1-NZ 2.91Å; E561-K565 WeakPolarHBondContact OE2-CE 3.41Å; E561-K565 IonicContact OE2-NZ 3.98Å; E561-K565 PolarHBondContact OE2-NZ 3.08Å
562	Q	62.7	Low	59.7	Low	115 Å²	115	85.4 Å²	85.4	54%	0.537	43%	0.432	S	S	.	.	H	α-helix	trans	-68	-37	173.2	-76	178.8	24.8	0	0	112.1	E558 I559 K565 T566	E558-Q562 WeakPolarHBondContact O-CB 3.46Å; E558-Q562 VanDerWaalsContact O-CG 3.26Å; E558-Q562 WeakPolarHBondContact O-CG 3.35Å; E558-Q562 PolarHBondContact O-N 2.86Å; I559-Q562 PolarHBondContact O-N 2.86Å; Q562-K565 PolarHBondContact O-N 2.84Å; Q562-T566 PolarHBondContact O-N 2.88Å; Q562-T566 PolarHBondContact O-OG1 3.16Å
563	V	61.2	Low	58.1	Low	26 Å²	26	91.4 Å²	91.4	16%	0.158	46%	0.464	C	S	.	.	H	α-helix	trans	-69.3	-43	173	168.4	0	0	0	0	111.3	I559 E560 T566 K567 N597 F600	I559-V563 WeakPolarHBondContact O-CB 3.41Å; I559-V563 VanDerWaalsContact O-CG2 3.3Å; I559-V563 WeakPolarHBondContact O-CG2 3.32Å; I559-V563 PolarHBondContact O-N 2.9Å; E560-V563 PolarHBondContact O-N 3.22Å; V563-T566 WeakPolarHBondContact CA-OG1 3.4Å; V563-T566 PolarHBondContact O-N 2.88Å; V563-T566 PolarHBondContact O-OG1 2.97Å; V563-T566 VanDerWaalsContact O-OG1 3.11Å; V563-K567 PolarHBondContact O-N 3.5Å; V563-K567 VanDerWaalsContact O-N 3.1Å; V563-N597 HydrophobicContact CG1-CB 3.9Å; V563-F600 HydrophobicContact CG2-CE2 4.21Å
564	E	63.6	Low	56.8	Low	59 Å²	59	98.3 Å²	98.3	28%	0.276	50%	0.5	S	S	.	.	H	α-helix	trans	-64.7	-38.8	172.4	-76.1	-157.2	156.2	0	0	111.1	E560 E561 K567 L568 R578	E560-E564 PolarHBondContact O-N 3.08Å; E561-E564 PolarHBondContact O-N 3.17Å; E564-K567 PolarHBondContact O-N 3.21Å; E564-L568 VanDerWaalsContact O-CB 3.24Å; E564-L568 WeakPolarHBondContact O-CB 3.18Å; E564-L568 WeakPolarHBondContact O-CG 3.3Å; E564-L568 PolarHBondContact O-N 3.32Å; E564-R578 IonicContact OE1-NH1 3.14Å; E564-R578 PolarHBondContact OE1-NH1 2.87Å; E564-R578 IonicContact OE2-NH1 3.37Å; E564-R578 PolarHBondContact OE2-NH1 2.87Å
565	K	62.5	Low	55.1	Low	107 Å²	107	100.7 Å²	100.7	47%	0.465	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-41.6	174.9	-81.2	163.8	176.5	166.1	0	112.8	E561 Q562 L568 H569	E561-K565 HydrophobicContact CG-CD 4.36Å; E561-K565 WeakPolarHBondContact O-CB 3.26Å; E561-K565 WeakPolarHBondContact O-CD 3.42Å; E561-K565 WeakPolarHBondContact O-CG 3.37Å; E561-K565 PolarHBondContact O-N 3.32Å; E561-K565 WeakPolarHBondContact OE1-CE 3.31Å; E561-K565 IonicContact OE1-NZ 4Å; E561-K565 PolarHBondContact OE1-NZ 2.91Å; E561-K565 WeakPolarHBondContact OE2-CE 3.41Å; E561-K565 IonicContact OE2-NZ 3.98Å; E561-K565 PolarHBondContact OE2-NZ 3.08Å; Q562-K565 PolarHBondContact O-N 2.84Å; K565-L568 PolarHBondContact O-N 2.71Å; K565-H569 PolarHBondContact O-N 2.89Å
566	T	56.1	Low	53.7	Low	111 Å²	111	103.3 Å²	103.3	68%	0.681	53%	0.531	S	S	*	.	H	α-helix	trans	-69.8	-32.4	176.3	34.9	0	0	0	0	112.6	Q562 V563	Q562-T566 PolarHBondContact O-N 2.88Å; Q562-T566 PolarHBondContact O-OG1 3.16Å; V563-T566 WeakPolarHBondContact CA-OG1 3.4Å; V563-T566 PolarHBondContact O-N 2.88Å; V563-T566 PolarHBondContact O-OG1 2.97Å; V563-T566 VanDerWaalsContact O-OG1 3.11Å
567	K	55.7	Low	52.2	Low	115 Å²	115	110.1 Å²	110.1	50%	0.5	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-48.8	164.9	-86.3	-178.9	173	177.7	0	112	V563 E564 H569 S570 S596	V563-K567 PolarHBondContact O-N 3.5Å; V563-K567 VanDerWaalsContact O-N 3.1Å; E564-K567 PolarHBondContact O-N 3.21Å; K567-H569 PolarHBondContact O-N 2.99Å; K567-H569 VanDerWaalsContact O-N 3.11Å; K567-S570 WeakPolarHBondContact O-CB 3.32Å; K567-S570 PolarHBondContact O-N 3.04Å; K567-S570 PolarHBondContact O-OG 2.93Å; K567-S596 PolarHBondContact NZ-O 2.82Å
568	L	52	Low	50.8	Low	81 Å²	81	116.7 Å²	116.7	42%	0.424	59%	0.588	S	S	.	*	H	α-helix	trans	-62.6	-21	-172.8	-91.9	162.4	0	0	0	114.3	E564 K565 S570 M571	E564-L568 VanDerWaalsContact O-CB 3.24Å; E564-L568 WeakPolarHBondContact O-CB 3.18Å; E564-L568 WeakPolarHBondContact O-CG 3.3Å; E564-L568 PolarHBondContact O-N 3.32Å; K565-L568 PolarHBondContact O-N 2.71Å; L568-S570 PolarHBondContact O-N 2.87Å; L568-S570 VanDerWaalsContact O-N 3.13Å; L568-M571 CarbonylContact O-C 3.49Å; L568-M571 PolarHBondContact O-N 2.79Å
569	H	51.3	Low	49.2	Very low	180 Å²	180	120.4 Å²	120.4	83%	0.833	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-14.2	174.1	-138.7	-9.2	0	0	0	113.3	K565 K567	K565-H569 PolarHBondContact O-N 2.89Å; K567-H569 PolarHBondContact O-N 2.99Å; K567-H569 VanDerWaalsContact O-N 3.11Å
570	S	45	Very low	47.8	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-6.8	170	67.7	0	0	0	0	115.3	K567 L568	K567-S570 WeakPolarHBondContact O-CB 3.32Å; K567-S570 PolarHBondContact O-N 3.04Å; K567-S570 PolarHBondContact O-OG 2.93Å; L568-S570 PolarHBondContact O-N 2.87Å; L568-S570 VanDerWaalsContact O-N 3.13Å
571	M	39.3	Very low	46.7	Very low	137 Å²	137	130.2 Å²	130.2	68%	0.675	67%	0.665	S	S	*	*			trans	-132.6	78.7	-176.2	-68	-164.1	75.6	0	0	112.2	L568 N573	L568-M571 CarbonylContact O-C 3.49Å; L568-M571 PolarHBondContact O-N 2.79Å; M571-N573 VanDerWaalsContact C-N 3.3Å; M571-N573 PolarHBondContact O-N 3.11Å
572	L	33.9	Very low	46	Very low	169 Å²	169	131.3 Å²	131.3	89%	0.885	67%	0.673	S	S	*	*			trans	-78	74.2	173.6	-163.9	85.4	0	0	0	111.5
573	N	36.6	Very low	46.1	Very low	145 Å²	145	128.1 Å²	128.1	78%	0.775	66%	0.661	S	S	*	*			trans	179.3	93.2	152.4	-94.1	-22.3	0	0	0	111.8	M571	M571-N573 VanDerWaalsContact C-N 3.3Å; M571-N573 PolarHBondContact O-N 3.11Å
574	N	39.4	Very low	46.3	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	68%	0.676	S	S	*	*			trans	166.5	93.5	144.6	-89.4	-27.1	0	0	0	110.1
575	K	32.8	Very low	46.6	Very low	214 Å²	214	127.8 Å²	127.8	93%	0.93	66%	0.663	S	S	*	*			trans	-117.6	72.5	174.1	-91.8	-171.8	172.2	179.6	0	111.4
576	A	34.8	Very low	47.2	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	65%	0.653	S	S	*	*			trans	-147.7	154.2	166.6	0	0	0	0	0	110.3
577	N	35.4	Very low	47.8	Very low	165 Å²	165	120.1 Å²	120.1	88%	0.882	62%	0.623	S	S	*	*	S	Bend	trans	60.8	41.8	166.5	-60.7	-0.9	0	0	0	118.7
578	R	41.5	Very low	48.4	Very low	204 Å²	204	119.5 Å²	119.5	77%	0.77	62%	0.621	S	S	*	*			trans	-131.2	89.4	151.7	-78.3	-168.8	179	176.1	-1.2	111.8	E564	E564-R578 IonicContact OE1-NH1 3.14Å; E564-R578 PolarHBondContact OE1-NH1 2.87Å; E564-R578 IonicContact OE2-NH1 3.37Å; E564-R578 PolarHBondContact OE2-NH1 2.87Å
579	K	31.6	Very low	49.4	Very low	195 Å²	195	119 Å²	119	85%	0.848	62%	0.618	S	S	*	*	S	Bend	trans	-139.4	146.4	156.7	-73.1	-168.7	174.9	-173.6	0	107.5
580	N	34.1	Very low	50.1	Low	167 Å²	167	114.6 Å²	114.6	89%	0.893	60%	0.598	S	S	*	*	S	Bend	trans	67	47.8	170.6	-51.7	10.3	0	0	0	116.8
581	S	42.6	Very low	51.2	Low	104 Å²	104	114.2 Å²	114.2	73%	0.727	60%	0.595	S	S	*	*			trans	-117.2	120.1	159.1	-169.9	0	0	0	0	109.3	T583	S581-T583 PolarHBondContact O-N 2.81Å
582	L	53	Low	52.8	Low	123 Å²	123	109.3 Å²	109.3	64%	0.644	57%	0.573	S	S	*	*			trans	-69.8	121.2	170.1	-82.4	74.2	0	0	0	108	V584	L582-V584 VanDerWaalsContact C-N 3.33Å; L582-V584 PolarHBondContact O-N 2.8Å
583	T	65	Low	54.5	Low	47 Å²	47	101.3 Å²	101.3	29%	0.288	53%	0.531	S	S	.	.			trans	-77.2	88.7	170	45.4	0	0	0	0	109.2	L552 L557 S581	L552-T583 PolarHBondContact N-O 2.88Å; L557-T583 VanDerWaalsContact CD2-OG1 3.3Å; L557-T583 WeakPolarHBondContact CD2-OG1 3.27Å; S581-T583 PolarHBondContact O-N 2.81Å
584	V	66.7	Low	56.1	Low	77 Å²	77	96.6 Å²	96.6	47%	0.467	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	130.5	169	-173.8	0	0	0	0	108.7	T549 F550 L582	T549-V584 HydrophobicContact CG2-CG1 4.09Å; F550-V584 WeakPolarHBondContact O-CA 3.15Å; L582-V584 VanDerWaalsContact C-N 3.33Å; L582-V584 PolarHBondContact O-N 2.8Å
585	V	69.8	Low	57.4	Low	1 Å²	1	90 Å²	90	1%	0.006	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	130	176	-175.9	0	0	0	0	108.4	T549 F550 L552 V593 R602	T549-V585 WeakPolarHBondContact CA-O 3.21Å; F550-V585 HydrophobicContact CD1-CB 4.09Å; F550-V585 HydrophobicContact CD1-CG1 4.47Å; F550-V585 HydrophobicContact CE1-CB 3.55Å; F550-V585 HydrophobicContact CE1-CG1 3.53Å; F550-V585 HydrophobicContact CE1-CG2 4.45Å; F550-V585 HydrophobicContact CE2-CB 4.05Å; F550-V585 HydrophobicContact CE2-CG1 4.49Å; F550-V585 HydrophobicContact CE2-CG2 4.11Å; F550-V585 HydrophobicContact CZ-CB 3.52Å; F550-V585 HydrophobicContact CZ-CG1 3.54Å; F550-V585 HydrophobicContact CZ-CG2 3.95Å; F550-V585 PolarHBondContact N-O 2.89Å; F550-V585 VanDerWaalsContact N-O 3.1Å; F550-V585 PolarHBondContact O-N 2.82Å; L552-V585 HydrophobicContact CD2-CG2 4.04Å; L552-V585 HydrophobicContact CG-CG2 4.33Å; V585-V593 HydrophobicContact CG1-CG2 4.46Å; V585-R602 HydrophobicContact CG1-CB 4.28Å; V585-R602 HydrophobicContact CG2-CB 4.05Å; V585-R602 HydrophobicContact CG2-CG 4.35Å
586	D	73.7	Confident	58.9	Low	45 Å²	45	82.3 Å²	82.3	24%	0.241	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.8	177.1	173.9	14.4	0	0	0	109.4	T549 K588 N589 T592	T549-D586 HydrophobicContact CG2-CB 4.09Å; D586-K588 PolarHBondContact O-N 2.73Å; D586-K588 VanDerWaalsContact O-N 3.16Å; D586-K588 WeakPolarHBondContact OD1-CB 3.22Å; D586-K588 PolarHBondContact OD1-N 3.11Å; D586-N589 HydrophobicContact CB-CB 4.41Å; D586-N589 PolarHBondContact O-N 3.38Å; D586-T592 PolarHBondContact N-OG1 3.09Å; D586-T592 PolarHBondContact O-OG1 2.86Å
587	L	68.8	Low	60.2	Low	12 Å²	12	79.9 Å²	79.9	6%	0.063	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.9	-179.6	-61.6	-174.9	0	0	0	113.1	F548 F550 N589 F671 Y815	F548-L587 HydrophobicContact CB-CD1 4.07Å; F548-L587 HydrophobicContact CD1-CD1 3.48Å; F548-L587 VanDerWaalsContact CD1-CD1 3.48Å; F548-L587 HydrophobicContact CD1-CG 3.92Å; F548-L587 HydrophobicContact CE1-CD1 4.3Å; F548-L587 HydrophobicContact CG-CD1 4.08Å; F548-L587 PolarHBondContact O-N 3.42Å; F550-L587 HydrophobicContact CD1-CD2 4.45Å; F550-L587 HydrophobicContact CE1-CD2 3.7Å; F550-L587 HydrophobicContact CE1-CG 4.38Å; L587-N589 VanDerWaalsContact C-N 3.3Å; L587-F671 HydrophobicContact CD1-CE2 3.73Å; L587-F671 HydrophobicContact CD1-CZ 3.77Å; L587-Y815 HydrophobicContact CD2-CE1 4.17Å; L587-Y815 WeakPolarHBondContact CD2-OH 3.46Å
588	K	69.2	Low	61.5	Low	103 Å²	103	73.1 Å²	73.1	45%	0.448	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-27.6	172.9	-67.6	179.5	161.5	-172.7	0	112.8	N545 E547 D586	N545-K588 VanDerWaalsContact O-CE 3.27Å; N545-K588 WeakPolarHBondContact O-CE 3.26Å; E547-K588 HydrophobicContact CG-CD 4.06Å; E547-K588 IonicContact OE1-NZ 2.81Å; E547-K588 PolarHBondContact OE1-NZ 2.7Å; D586-K588 PolarHBondContact O-N 2.73Å; D586-K588 VanDerWaalsContact O-N 3.16Å; D586-K588 WeakPolarHBondContact OD1-CB 3.22Å; D586-K588 PolarHBondContact OD1-N 3.11Å
589	N	72.9	Confident	62.2	Low	71 Å²	71	68.9 Å²	68.9	38%	0.38	37%	0.373	S	S	.	.			trans	-110.7	95.1	-173.3	-175.1	-2.5	0	0	0	111.3	D586 L587 S591 T592 V593	D586-N589 HydrophobicContact CB-CB 4.41Å; D586-N589 PolarHBondContact O-N 3.38Å; L587-N589 VanDerWaalsContact C-N 3.3Å; N589-S591 PolarHBondContact ND2-OG 3.22Å; N589-S591 PolarHBondContact O-N 3.27Å; N589-S591 PolarHBondContact OD1-N 2.97Å; N589-S591 PolarHBondContact OD1-OG 2.72Å; N589-T592 HydrophobicContact CB-CG2 4.19Å; N589-T592 PolarHBondContact O-N 2.99Å; N589-T592 PolarHBondContact O-OG1 3.46Å; N589-V593 PolarHBondContact O-N 3.38Å
590	E	66.4	Low	63.7	Low	87 Å²	87	60.9 Å²	60.9	41%	0.407	34%	0.338	S	S	.	.	H	α-helix	trans	-48.7	-32.9	179.6	-66.6	175.3	-169	0	0	113.7	T592 V593 Y594 K622	E590-T592 PolarHBondContact O-N 3.21Å; E590-V593 PolarHBondContact O-N 3.44Å; E590-Y594 WeakPolarHBondContact O-CD2 3.43Å; E590-K622 IonicContact OE1-NZ 2.68Å; E590-K622 PolarHBondContact OE1-NZ 2.72Å
591	S	67.2	Low	65.3	Low	91 Å²	91	54.2 Å²	54.2	64%	0.636	30%	0.304	S	S	*	.	H	α-helix	trans	-66.2	-22.2	177.9	70.9	0	0	0	0	114	N589	N589-S591 PolarHBondContact ND2-OG 3.22Å; N589-S591 PolarHBondContact O-N 3.27Å; N589-S591 PolarHBondContact OD1-N 2.97Å; N589-S591 PolarHBondContact OD1-OG 2.72Å
592	T	72.4	Confident	66.9	Low	35 Å²	35	50.5 Å²	50.5	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-89.9	-25.1	174.7	73.7	0	0	0	0	112.5	D586 N589 E590 Y594 R602	D586-T592 PolarHBondContact N-OG1 3.09Å; D586-T592 PolarHBondContact O-OG1 2.86Å; N589-T592 HydrophobicContact CB-CG2 4.19Å; N589-T592 PolarHBondContact O-N 2.99Å; N589-T592 PolarHBondContact O-OG1 3.46Å; E590-T592 PolarHBondContact O-N 3.21Å; T592-Y594 PolarHBondContact O-N 3.5Å; T592-R602 WeakPolarHBondContact O-CD 3.42Å; T592-R602 PolarHBondContact O-NE 2.9Å
593	V	70.9	Confident	68.2	Low	1 Å²	1	44.9 Å²	44.9	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-68.9	-20.7	-178.2	-176.4	0	0	0	0	112.1	V585 N589 E590 V601 R602 P814 Y815	V585-V593 HydrophobicContact CG1-CG2 4.46Å; N589-V593 PolarHBondContact O-N 3.38Å; E590-V593 PolarHBondContact O-N 3.44Å; V593-V601 HydrophobicContact CG1-CG1 4.39Å; V593-R602 WeakPolarHBondContact O-CB 3.41Å; V593-R602 PolarHBondContact O-N 3.39Å; V593-P814 HydrophobicContact CB-CG 4.46Å; V593-P814 HydrophobicContact CG1-CB 3.74Å; V593-P814 HydrophobicContact CG1-CG 3.63Å; V593-Y815 WeakPolarHBondContact CG2-OH 3.47Å
594	Y	69.2	Low	69.2	Low	45 Å²	45	42.8 Å²	42.8	18%	0.176	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-100.2	155.2	175.4	-69.7	-81.1	0	0	0	113.2	E590 T592 F600 V601 R602 L812 P814	E590-Y594 WeakPolarHBondContact O-CD2 3.43Å; T592-Y594 PolarHBondContact O-N 3.5Å; Y594-F600 WeakPolarHBondContact CA-O 3.4Å; Y594-V601 HydrophobicContact CD1-CG2 4.49Å; Y594-V601 HydrophobicContact CE1-CG2 4.14Å; Y594-R602 PolarHBondContact O-NE 3.4Å; Y594-R602 PolarHBondContact O-NH2 3.08Å; Y594-L812 PolarHBondContact OH-O 3.19Å; Y594-L812 VanDerWaalsContact OH-O 3.08Å; Y594-P814 HydrophobicContact CE1-CG 4.23Å; Y594-P814 HydrophobicContact CE2-CG 3.76Å; Y594-P814 VanDerWaalsContact OH-CD 3.27Å; Y594-P814 WeakPolarHBondContact OH-CD 3.37Å
595	T	66.8	Low	70.3	Confident	20 Å²	20	39.2 Å²	39.2	12%	0.123	21%	0.21	C	C	.	.			trans	-68.2	159.4	166.9	45.3	0	0	0	0	112.1	N597 G598 F600 R602	T595-N597 WeakPolarHBondContact CB-OD1 3.4Å; T595-N597 PolarHBondContact O-N 2.97Å; T595-N597 PolarHBondContact OG1-OD1 2.98Å; T595-G598 PolarHBondContact O-N 3.33Å; T595-F600 HydrophobicContact CG2-CB 3.95Å; T595-F600 HydrophobicContact CG2-CD2 4.41Å; T595-F600 PolarHBondContact N-O 2.81Å; T595-F600 WeakPolarHBondContact OG1-CB 3.42Å; T595-F600 PolarHBondContact OG1-N 3.37Å; T595-F600 PolarHBondContact OG1-O 3.37Å; T595-R602 HydrophobicContact CG2-CG 4.44Å
596	S	65.5	Low	71.5	Confident	51 Å²	51	39.2 Å²	39.2	36%	0.357	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	7	-178.6	68.7	0	0	0	0	116.7	E560 K567	E560-S596 PolarHBondContact OE1-N 3.04Å; K567-S596 PolarHBondContact NZ-O 2.82Å
597	N	61.5	Low	72.5	Confident	34 Å²	34	43 Å²	43	18%	0.182	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-2.8	174.3	70	-9.2	0	0	0	113.5	V563 T595 F599 F600	V563-N597 HydrophobicContact CG1-CB 3.9Å; T595-N597 WeakPolarHBondContact CB-OD1 3.4Å; T595-N597 PolarHBondContact O-N 2.97Å; T595-N597 PolarHBondContact OG1-OD1 2.98Å; N597-F599 HydrophobicContact CB-CD2 3.96Å; N597-F599 WeakPolarHBondContact O-CD2 3.43Å; N597-F599 PolarHBondContact O-N 3.18Å; N597-F599 PolarHBondContact OD1-N 3.35Å; N597-F599 VanDerWaalsContact OD1-N 3.12Å; N597-F600 WeakPolarHBondContact ND2-CE2 3.12Å
598	G	62	Low	73.5	Confident	22 Å²	22	45 Å²	45	23%	0.227	23%	0.232	C	C	.	.	S	Bend	trans	72.6	-4.8	-178.5	0	0	0	0	0	116.2	T595 H811	T595-G598 PolarHBondContact O-N 3.33Å; G598-H811 PolarHBondContact O-CE1 2.8Å; G598-H811 VanDerWaalsContact O-CE1 3.22Å; G598-H811 PolarHBondContact O-ND1 3.39Å
599	F	56.9	Low	74.6	Confident	116 Å²	116	40.2 Å²	40.2	51%	0.509	21%	0.211	S	C	.	.	S	Bend	trans	-89.8	-18.8	-172.4	-70.3	-71	0	0	0	114.8	N597	N597-F599 HydrophobicContact CB-CD2 3.96Å; N597-F599 WeakPolarHBondContact O-CD2 3.43Å; N597-F599 PolarHBondContact O-N 3.18Å; N597-F599 PolarHBondContact OD1-N 3.35Å; N597-F599 VanDerWaalsContact OD1-N 3.12Å
600	F	63.8	Low	75.7	Confident	26 Å²	26	39.9 Å²	39.9	11%	0.114	21%	0.208	C	C	.	.			trans	-129.4	144.7	-174.1	-46.6	-58.3	0	0	0	113	V563 Y594 T595 N597 N842 Y908	V563-F600 HydrophobicContact CG2-CE2 4.21Å; Y594-F600 WeakPolarHBondContact CA-O 3.4Å; T595-F600 HydrophobicContact CG2-CB 3.95Å; T595-F600 HydrophobicContact CG2-CD2 4.41Å; T595-F600 PolarHBondContact N-O 2.81Å; T595-F600 WeakPolarHBondContact OG1-CB 3.42Å; T595-F600 PolarHBondContact OG1-N 3.37Å; T595-F600 PolarHBondContact OG1-O 3.37Å; N597-F600 WeakPolarHBondContact ND2-CE2 3.12Å; F600-N842 WeakPolarHBondContact CD1-ND2 3.3Å; F600-Y908 HydrophobicContact CE1-CE2 4.01Å; F600-Y908 VanDerWaalsContact CE1-OH 3.25Å; F600-Y908 WeakPolarHBondContact CE1-OH 3.11Å; F600-Y908 HydrophobicContact CE2-CE2 4.4Å; F600-Y908 AromaticContact CZ-CE2 3.64Å; F600-Y908 HydrophobicContact CZ-CE2 3.64Å; F600-Y908 AromaticContact CZ-CZ 3.9Å; F600-Y908 WeakPolarHBondContact CZ-OH 3.15Å
601	V	67.8	Low	77	Confident	27 Å²	27	36.8 Å²	36.8	16%	0.164	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-87.9	126.4	175.3	175	0	0	0	0	109.5	V593 Y594 W603 P814	V593-V601 HydrophobicContact CG1-CG1 4.39Å; Y594-V601 HydrophobicContact CD1-CG2 4.49Å; Y594-V601 HydrophobicContact CE1-CG2 4.14Å; V601-W603 HydrophobicContact CG1-CD2 3.89Å; V601-W603 HydrophobicContact CG1-CG 3.88Å; V601-W603 HydrophobicContact CG1-CZ2 4.36Å; V601-W603 PolarHBondContact O-N 3.48Å; V601-W603 VanDerWaalsContact O-N 3.11Å; V601-P814 HydrophobicContact CB-CB 4.46Å; V601-P814 HydrophobicContact CG1-CB 3.75Å; V601-P814 HydrophobicContact CG2-CB 3.83Å; V601-P814 HydrophobicContact CG2-CG 4.39Å
602	R	75.3	Confident	78.4	Confident	27 Å²	27	36.6 Å²	36.6	10%	0.102	19%	0.185	C	C	.	.			trans	-74.6	92.3	163.4	-57.6	-175.3	-154.9	-106.3	-6.9	107.7	F550 L552 E560 V585 T592 V593 Y594 T595	F550-R602 HydrophobicContact CZ-CB 4.45Å; F550-R602 WeakPolarHBondContact CZ-O 3.42Å; L552-R602 HydrophobicContact CD2-CB 3.95Å; L552-R602 HydrophobicContact CD2-CG 3.99Å; E560-R602 IonicContact OE1-CZ 3.88Å; E560-R602 IonicContact OE1-NH1 2.75Å; E560-R602 PolarHBondContact OE1-NH1 3.16Å; E560-R602 IonicContact OE1-NH2 3.53Å; E560-R602 PolarHBondContact OE1-NH2 3.3Å; E560-R602 IonicContact OE2-CZ 2.7Å; E560-R602 IonicContact OE2-NH1 2.69Å; E560-R602 PolarHBondContact OE2-NH1 2.75Å; E560-R602 IonicContact OE2-NH2 3.69Å; V585-R602 HydrophobicContact CG1-CB 4.28Å; V585-R602 HydrophobicContact CG2-CB 4.05Å; V585-R602 HydrophobicContact CG2-CG 4.35Å; T592-R602 WeakPolarHBondContact O-CD 3.42Å; T592-R602 PolarHBondContact O-NE 2.9Å; V593-R602 WeakPolarHBondContact O-CB 3.41Å; V593-R602 PolarHBondContact O-N 3.39Å; Y594-R602 PolarHBondContact O-NE 3.4Å; Y594-R602 PolarHBondContact O-NH2 3.08Å; T595-R602 HydrophobicContact CG2-CG 4.44Å
603	W	80.5	Confident	79.5	Confident	5 Å²	5	34.9 Å²	34.9	2%	0.019	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-78.4	138.9	171.8	-75	101.5	0	0	0	110.9	P429 I430 T431 Q556 V601 F672 P814 N842 L844	P429-W603 HydrophobicContact CB-CB 4.01Å; I430-W603 HydrophobicContact CG2-CB 4.24Å; I430-W603 HydrophobicContact CG2-CD2 3.94Å; I430-W603 HydrophobicContact CG2-CE3 3.59Å; I430-W603 HydrophobicContact CG2-CG 4.25Å; I430-W603 HydrophobicContact CG2-CZ3 4.26Å; T431-W603 HydrophobicContact CG2-CD2 4.11Å; T431-W603 HydrophobicContact CG2-CG 4.07Å; T431-W603 HydrophobicContact CG2-CZ2 4.22Å; T431-W603 VanDerWaalsContact CG2-NE1 3.29Å; Q556-W603 PolarHBondContact NE2-O 2.78Å; Q556-W603 VanDerWaalsContact NE2-O 3.08Å; V601-W603 HydrophobicContact CG1-CD2 3.89Å; V601-W603 HydrophobicContact CG1-CG 3.88Å; V601-W603 HydrophobicContact CG1-CZ2 4.36Å; V601-W603 PolarHBondContact O-N 3.48Å; V601-W603 VanDerWaalsContact O-N 3.11Å; W603-F672 HydrophobicContact CH2-CD1 4.4Å; W603-F672 AromaticContact CH2-CE1 3.83Å; W603-F672 HydrophobicContact CH2-CE1 3.83Å; W603-F672 AromaticContact CZ3-CE1 3.67Å; W603-F672 HydrophobicContact CZ3-CE1 3.67Å; W603-F672 HydrophobicContact CZ3-CZ 4.45Å; W603-P814 WeakPolarHBondContact CH2-O 3.28Å; W603-P814 WeakPolarHBondContact CZ2-O 3.22Å; W603-N842 PolarHBondContact NE1-O 3.5Å; W603-L844 HydrophobicContact CH2-CD1 4.38Å
604	P	86.2	Confident	80.6	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.019	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-63.7	158.1	162.1	28.5	-35.6	0	0	0	111.2	I430 F548 F550 D608 L609	I430-P604 PolarHBondContact N-O 2.83Å; F548-P604 HydrophobicContact CE1-CB 4.17Å; F550-P604 HydrophobicContact CD1-CB 3.96Å; F550-P604 HydrophobicContact CD2-CB 3.91Å; F550-P604 HydrophobicContact CE1-CB 4.06Å; F550-P604 HydrophobicContact CE1-CG 4.4Å; F550-P604 VanDerWaalsContact CE2-CA 3.46Å; F550-P604 HydrophobicContact CE2-CB 4.02Å; F550-P604 HydrophobicContact CG-CB 3.89Å; F550-P604 HydrophobicContact CZ-CB 4.09Å; F550-P604 HydrophobicContact CZ-CG 4.49Å; P604-D608 HydrophobicContact CB-CB 4.27Å; P604-L609 HydrophobicContact CB-CD1 4.33Å; P604-L609 HydrophobicContact CB-CG 4.26Å; P604-L609 HydrophobicContact CG-CD1 4.01Å; P604-L609 HydrophobicContact CG-CD2 4.49Å; P604-L609 HydrophobicContact CG-CG 4.35Å
605	S	90	Very high	81.9	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.014	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-88.8	162.3	176.6	73.5	0	0	0	0	112.6	M426 S427 Q428 R607 D608 L609	M426-S605 WeakPolarHBondContact O-CB 3.47Å; M426-S605 PolarHBondContact O-OG 2.99Å; S427-S605 WeakPolarHBondContact O-CB 3.26Å; Q428-S605 WeakPolarHBondContact O-CA 3.46Å; Q428-S605 WeakPolarHBondContact O-CB 3.46Å; S605-R607 PolarHBondContact O-N 3.3Å; S605-R607 PolarHBondContact OG-N 2.97Å; S605-D608 VanDerWaalsContact CB-OD2 3.27Å; S605-D608 WeakPolarHBondContact CB-OD2 3.5Å; S605-D608 PolarHBondContact N-OD2 3.13Å; S605-D608 PolarHBondContact O-N 3.35Å; S605-D608 PolarHBondContact OG-N 2.98Å; S605-D608 VanDerWaalsContact OG-N 3.15Å; S605-D608 PolarHBondContact OG-OD2 3.45Å; S605-L609 PolarHBondContact O-N 2.96Å
606	P	94.7	Very high	83.1	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-31.7	168.1	-26.1	35.7	0	0	0	113.1	M426 Q428 Y433 Y511 P512 L609 I610 Y898	M426-P606 HydrophobicContact CE-CB 3.9Å; M426-P606 HydrophobicContact CE-CG 4.41Å; Q428-P606 WeakPolarHBondContact O-CD 3.43Å; Y433-P606 HydrophobicContact CD2-CG 3.69Å; Y433-P606 HydrophobicContact CE1-CG 4.43Å; Y433-P606 VanDerWaalsContact CE2-CD 3.45Å; Y433-P606 HydrophobicContact CE2-CG 3.54Å; Y433-P606 HydrophobicContact CG-CG 4.24Å; Y511-P606 HydrophobicContact CD1-CB 3.64Å; Y511-P606 WeakPolarHBondContact CD1-O 3.38Å; Y511-P606 HydrophobicContact CE1-CB 4.29Å; P512-P606 WeakPolarHBondContact CD-O 3.49Å; P606-L609 PolarHBondContact O-N 3.22Å; P606-I610 PolarHBondContact O-N 3.31Å; P606-Y898 HydrophobicContact CB-CD1 4.48Å; P606-Y898 HydrophobicContact CG-CD1 4.04Å; P606-Y898 HydrophobicContact CG-CE1 4.25Å; P606-Y898 HydrophobicContact CG-CG 4.48Å
607	R	93.7	Very high	84.2	Confident	125 Å²	125	29.6 Å²	29.6	47%	0.472	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-40.3	175.9	-179.9	-176.9	-69	161.5	2.1	112.8	M426 S605 L609 I610	M426-R607 HydrophobicContact CB-CB 4.32Å; M426-R607 WeakPolarHBondContact O-CB 3.41Å; M426-R607 PolarHBondContact O-N 2.77Å; M426-R607 VanDerWaalsContact O-N 3.09Å; S605-R607 PolarHBondContact O-N 3.3Å; S605-R607 PolarHBondContact OG-N 2.97Å; R607-L609 PolarHBondContact O-N 3.11Å; R607-I610 HydrophobicContact CG-CD1 4.29Å; R607-I610 WeakPolarHBondContact O-CD1 3.32Å; R607-I610 WeakPolarHBondContact O-CG1 3.2Å; R607-I610 PolarHBondContact O-N 3.03Å
608	D	90.2	Very high	85.2	Confident	55 Å²	55	32.7 Å²	32.7	29%	0.294	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.7	177.6	-54.9	-58.2	0	0	0	111.9	F548 F550 P604 S605	F548-D608 HydrophobicContact CZ-CB 4.04Å; F548-D608 WeakPolarHBondContact CZ-O 3.26Å; F550-D608 HydrophobicContact CB-CB 4.02Å; P604-D608 HydrophobicContact CB-CB 4.27Å; S605-D608 VanDerWaalsContact CB-OD2 3.27Å; S605-D608 WeakPolarHBondContact CB-OD2 3.5Å; S605-D608 PolarHBondContact N-OD2 3.13Å; S605-D608 PolarHBondContact O-N 3.35Å; S605-D608 PolarHBondContact OG-N 2.98Å; S605-D608 VanDerWaalsContact OG-N 3.15Å; S605-D608 PolarHBondContact OG-OD2 3.45Å
609	L	92.8	Very high	85.9	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	15	-175	-66.5	173.2	0	0	0	113.9	I430 P512 L542 F548 P604 S605 P606 R607 G611 R612 L614	I430-L609 HydrophobicContact CD1-CD1 4.24Å; P512-L609 HydrophobicContact CB-CB 3.88Å; P512-L609 HydrophobicContact CG-CB 3.6Å; P512-L609 HydrophobicContact CG-CD1 4.31Å; L542-L609 HydrophobicContact CD2-CD2 3.53Å; F548-L609 HydrophobicContact CE1-CD2 4.13Å; F548-L609 HydrophobicContact CE2-CD2 4.09Å; F548-L609 HydrophobicContact CZ-CD2 3.63Å; F548-L609 HydrophobicContact CZ-CG 4.35Å; P604-L609 HydrophobicContact CB-CD1 4.33Å; P604-L609 HydrophobicContact CB-CG 4.26Å; P604-L609 HydrophobicContact CG-CD1 4.01Å; P604-L609 HydrophobicContact CG-CD2 4.49Å; P604-L609 HydrophobicContact CG-CG 4.35Å; S605-L609 PolarHBondContact O-N 2.96Å; P606-L609 PolarHBondContact O-N 3.22Å; R607-L609 PolarHBondContact O-N 3.11Å; L609-G611 PolarHBondContact O-N 2.92Å; L609-R612 VanDerWaalsContact O-CB 3.27Å; L609-R612 WeakPolarHBondContact O-CB 3.08Å; L609-R612 WeakPolarHBondContact O-CG 3.26Å; L609-R612 PolarHBondContact O-N 3.37Å; L609-R612 VanDerWaalsContact O-N 3.08Å; L609-L614 HydrophobicContact CD1-CD2 4.23Å; L609-L614 HydrophobicContact CD2-CD2 4.33Å
610	I	95.3	Very high	86.7	Confident	63 Å²	63	31.9 Å²	31.9	32%	0.323	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	134.1	178.6	-76.3	170.9	0	0	0	111.4	E510 Y511 P606 R607 R612	E510-I610 HydrophobicContact CB-CG2 4.12Å; E510-I610 HydrophobicContact CG-CD1 4.3Å; E510-I610 HydrophobicContact CG-CG1 4.23Å; E510-I610 HydrophobicContact CG-CG2 4.36Å; Y511-I610 HydrophobicContact CD1-CG1 4.24Å; Y511-I610 HydrophobicContact CE1-CD1 4.13Å; Y511-I610 HydrophobicContact CE1-CG1 4.08Å; P606-I610 PolarHBondContact O-N 3.31Å; R607-I610 HydrophobicContact CG-CD1 4.29Å; R607-I610 WeakPolarHBondContact O-CD1 3.32Å; R607-I610 WeakPolarHBondContact O-CG1 3.2Å; R607-I610 PolarHBondContact O-N 3.03Å; I610-R612 PolarHBondContact O-N 3.5Å
611	G	95.3	Very high	86.7	Confident	22 Å²	22	35.2 Å²	35.2	23%	0.227	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	5.7	-178.8	0	0	0	0	0	115.5	F506 E510 L609	F506-G611 VanDerWaalsContact CZ-C 3.42Å; F506-G611 WeakPolarHBondContact CZ-O 3.26Å; E510-G611 PolarHBondContact O-N 2.91Å; L609-G611 PolarHBondContact O-N 2.92Å
612	R	95.1	Very high	85.9	Confident	87 Å²	87	41.2 Å²	41.2	33%	0.328	20%	0.198	S	C	.	.			trans	-97	144.2	-175.5	-56	-53.9	-175.4	159.1	7.8	114.1	F506 P512 V513 N539 R540 L542 L609 I610 L614	F506-R612 WeakPolarHBondContact CZ-O 3.3Å; P512-R612 WeakPolarHBondContact CA-O 3.47Å; V513-R612 PolarHBondContact N-O 3.04Å; N539-R612 PolarHBondContact O-NH1 2.8Å; R540-R612 CarbonylContact O-C 3.56Å; R540-R612 VanDerWaalsContact O-CA 3.3Å; R540-R612 WeakPolarHBondContact O-CA 3.41Å; L542-R612 HydrophobicContact CB-CB 4.32Å; L609-R612 VanDerWaalsContact O-CB 3.27Å; L609-R612 WeakPolarHBondContact O-CB 3.08Å; L609-R612 WeakPolarHBondContact O-CG 3.26Å; L609-R612 PolarHBondContact O-N 3.37Å; L609-R612 VanDerWaalsContact O-N 3.08Å; I610-R612 PolarHBondContact O-N 3.5Å; R612-L614 HydrophobicContact CB-CD1 4.44Å
613	I	96.5	Very high	84.3	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.5	170.6	-58.3	176	0	0	0	107.6	I501 F506 V513 V515 L537 R540 L542 L615	I501-I613 HydrophobicContact CG2-CD1 4.19Å; F506-I613 HydrophobicContact CE2-CD1 4.11Å; F506-I613 HydrophobicContact CE2-CG1 3.81Å; F506-I613 HydrophobicContact CZ-CG1 3.86Å; V513-I613 CarbonylContact O-C 3.44Å; V513-I613 WeakPolarHBondContact O-CA 3.37Å; V515-I613 HydrophobicContact CB-CG2 4.4Å; V515-I613 HydrophobicContact CG2-CG2 3.58Å; L537-I613 HydrophobicContact CD1-CG2 4.23Å; L537-I613 HydrophobicContact CD2-CD1 3.96Å; R540-I613 HydrophobicContact CB-CD1 3.94Å; R540-I613 HydrophobicContact CB-CG1 4.09Å; R540-I613 PolarHBondContact O-N 3Å; L542-I613 PolarHBondContact N-O 3.4Å; I613-L615 HydrophobicContact CG2-CD2 4.32Å
614	L	94.6	Very high	82.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.4	-179.9	-56.7	91.7	0	0	0	108.9	P512 V513 I514 V515 L542 L609 R612 F671 F672	P512-L614 HydrophobicContact CB-CD1 3.54Å; V513-L614 PolarHBondContact O-N 3.48Å; I514-L614 CarbonylContact C-O 3.52Å; I514-L614 WeakPolarHBondContact CA-O 3.45Å; V515-L614 PolarHBondContact N-O 3.33Å; L542-L614 HydrophobicContact CD2-CD2 4.19Å; L542-L614 HydrophobicContact CD2-CG 4.41Å; L609-L614 HydrophobicContact CD1-CD2 4.23Å; L609-L614 HydrophobicContact CD2-CD2 4.33Å; R612-L614 HydrophobicContact CB-CD1 4.44Å; L614-F671 HydrophobicContact CB-CB 4.25Å; L614-F671 HydrophobicContact CB-CG 4.41Å; L614-F671 HydrophobicContact CD2-CD1 3.71Å; L614-F671 HydrophobicContact CD2-CD2 4.15Å; L614-F671 HydrophobicContact CD2-CE1 3.78Å; L614-F671 HydrophobicContact CD2-CE2 4.21Å; L614-F671 HydrophobicContact CD2-CG 3.9Å; L614-F671 HydrophobicContact CD2-CZ 4.04Å; L614-F672 HydrophobicContact CB-CD2 4.4Å; L614-F672 HydrophobicContact CB-CE2 3.85Å; L614-F672 HydrophobicContact CD2-CE2 3.93Å; L614-F672 HydrophobicContact CD2-CZ 4.18Å
615	L	94.8	Very high	79.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.4	179.8	-52.7	-176.7	0	0	0	111.5	V515 I517 L533 L537 L541 I613 M669 F670 F671 F672	V515-L615 HydrophobicContact CB-CD2 3.89Å; V515-L615 HydrophobicContact CG1-CD2 4.31Å; V515-L615 WeakPolarHBondContact O-CA 3.26Å; I517-L615 HydrophobicContact CD1-CD1 4.37Å; I517-L615 HydrophobicContact CD1-CD2 4.25Å; L533-L615 HydrophobicContact CD1-CD1 4.13Å; L533-L615 HydrophobicContact CD2-CD1 4.2Å; L533-L615 HydrophobicContact CD2-CD2 4.48Å; L537-L615 HydrophobicContact CD1-CD2 4.41Å; L541-L615 HydrophobicContact CD1-CD1 3.76Å; L541-L615 HydrophobicContact CD1-CD2 4.1Å; L541-L615 HydrophobicContact CD1-CG 3.59Å; I613-L615 HydrophobicContact CG2-CD2 4.32Å; L615-M669 HydrophobicContact CD1-CB 4.2Å; L615-M669 HydrophobicContact CD1-CE 4.41Å; L615-F670 HydrophobicContact CB-CD1 3.83Å; L615-F670 HydrophobicContact CB-CE1 4.4Å; L615-F671 PolarHBondContact O-N 3.33Å; L615-F672 PolarHBondContact O-N 2.93Å
616	Q	92.9	Very high	76.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.9	168.4	174.8	-171	-4.7	0	0	109.7	Y467 I514 V515 S516 I517 F670 F672 T674 I817	Y467-Q616 PolarHBondContact OH-OE1 3.12Å; I514-Q616 HydrophobicContact CG2-CB 4.46Å; V515-Q616 PolarHBondContact O-N 3.42Å; S516-Q616 PolarHBondContact OG-OE1 3.4Å; I517-Q616 PolarHBondContact N-O 3.32Å; Q616-F670 WeakPolarHBondContact O-CD1 3.34Å; Q616-F670 WeakPolarHBondContact O-CE1 3.37Å; Q616-F672 HydrophobicContact CB-CB 4.08Å; Q616-F672 HydrophobicContact CG-CB 4.18Å; Q616-T674 PolarHBondContact NE2-OG1 3.15Å; Q616-I817 HydrophobicContact CB-CD1 4.43Å; Q616-I817 HydrophobicContact CG-CD1 4.14Å
617	G	88.8	Confident	73.5	Confident	5 Å²	5	65.6 Å²	65.6	5%	0.052	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	-163.7	172.6	0	0	0	0	0	111.2	F672 D673 T674	G617-F672 PolarHBondContact N-O 3.02Å; G617-D673 WeakPolarHBondContact O-CA 3.36Å; G617-T674 PolarHBondContact O-N 3.3Å; G617-T674 PolarHBondContact O-OG1 3.15Å
618	K	81.6	Confident	70.3	Confident	100 Å²	100	66.9 Å²	66.9	44%	0.435	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-90.2	122.7	174.3	-56.8	-169.2	-170.9	-170.3	0	110.1	E659 S667 F670	K618-E659 IonicContact NZ-OE1 3.45Å; K618-E659 PolarHBondContact NZ-OE1 3.29Å; K618-E659 IonicContact NZ-OE2 3.59Å; K618-E659 PolarHBondContact NZ-OE2 3.42Å; K618-S667 PolarHBondContact O-OG 3.01Å; K618-F670 WeakPolarHBondContact O-CD2 3.49Å
619	R	77.1	Confident	67.2	Low	41 Å²	41	70.5 Å²	70.5	16%	0.155	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-88.1	145.5	170.8	-60.3	-174.3	72.8	165.9	-1.4	111.1	S667 F670 D673	R619-S667 VanDerWaalsContact CA-OG 3.25Å; R619-S667 WeakPolarHBondContact CA-OG 3.33Å; R619-F670 WeakPolarHBondContact CD-O 3.42Å; R619-F670 HydrophobicContact CG-CB 4Å; R619-F670 PolarHBondContact NH1-O 2.82Å; R619-D673 HydrophobicContact CB-CB 4.15Å; R619-D673 HydrophobicContact CG-CB 3.86Å; R619-D673 PolarHBondContact N-OD1 3.49Å
620	L	73	Confident	64	Low	79 Å²	79	77 Å²	77	41%	0.414	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-80.2	146.9	167.1	-65.2	177.6	0	0	0	109.4	K622 S667	L620-K622 PolarHBondContact O-N 2.85Å; L620-S667 PolarHBondContact N-OG 2.71Å
621	P	64.6	Low	60.8	Low	97 Å²	97	79 Å²	79	63%	0.63	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-56.4	135.4	172.7	-25.6	35.3	0	0	0	112.3	G623 S624	P621-G623 PolarHBondContact O-N 3.31Å; P621-G623 VanDerWaalsContact O-N 3.08Å; P621-S624 PolarHBondContact O-N 3.02Å; P621-S624 PolarHBondContact O-OG 3.47Å
622	K	50.6	Low	57.6	Low	152 Å²	152	85.1 Å²	85.1	66%	0.661	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	116.2	174.3	-67.4	-176.5	179.3	-175.1	0	109.3	E590 L620	E590-K622 IonicContact OE1-NZ 2.68Å; E590-K622 PolarHBondContact OE1-NZ 2.72Å; L620-K622 PolarHBondContact O-N 2.85Å
623	G	41.5	Very low	54.3	Low	64 Å²	64	88.5 Å²	88.5	66%	0.66	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.5	-3.5	179.7	0	0	0	0	0	116.1	P621 T625	P621-G623 PolarHBondContact O-N 3.31Å; P621-G623 VanDerWaalsContact O-N 3.08Å; G623-T625 PolarHBondContact O-N 3.18Å; G623-T625 VanDerWaalsContact O-N 3.07Å
624	S	40.8	Very low	50.9	Low	76 Å²	76	96.4 Å²	96.4	53%	0.531	54%	0.541	S	S	.	.			trans	-70.3	4.2	179.3	-57.9	0	0	0	0	116	P621 T626	P621-S624 PolarHBondContact O-N 3.02Å; P621-S624 PolarHBondContact O-OG 3.47Å; S624-T626 PolarHBondContact O-N 3.14Å
625	T	27.7	Very low	47.7	Very low	139 Å²	139	101.6 Å²	101.6	85%	0.853	58%	0.577	S	S	*	*			trans	-88.9	69.2	-176.3	52.4	0	0	0	0	112.8	G623	G623-T625 PolarHBondContact O-N 3.18Å; G623-T625 VanDerWaalsContact O-N 3.07Å
626	T	27.7	Very low	44.5	Very low	120 Å²	120	109.9 Å²	109.9	74%	0.736	62%	0.616	S	S	*	*			trans	-118.6	125.4	170.4	-56.2	0	0	0	0	111	S624 M628	S624-T626 PolarHBondContact O-N 3.14Å; T626-M628 PolarHBondContact O-N 3.38Å
627	I	28.4	Very low	41.3	Very low	151 Å²	151	118.1 Å²	118.1	77%	0.774	65%	0.652	S	S	*	*			trans	-35.6	110.7	-179.1	-58.3	160	0	0	0	113.4	N629	I627-N629 HydrophobicContact CG2-CB 4.29Å; I627-N629 PolarHBondContact O-N 3.45Å
628	M	27	Very low	38.4	Very low	151 Å²	151	130 Å²	130	74%	0.744	70%	0.695	S	S	*	*			trans	-92.7	79.9	167.2	-92.3	-69.6	-143.8	0	0	110.5	T626	T626-M628 PolarHBondContact O-N 3.38Å
629	N	25.1	Very low	35.8	Very low	132 Å²	132	132.8 Å²	132.8	71%	0.706	71%	0.712	S	S	*	*			trans	-108.1	132.1	158.5	-94.4	-14.9	0	0	0	108.7	I627	I627-N629 HydrophobicContact CG2-CB 4.29Å; I627-N629 PolarHBondContact O-N 3.45Å
630	T	26.4	Very low	33.3	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	74%	0.744	S	S	*	*	S	Bend	trans	53.8	76.4	163.4	58.3	0	0	0	0	118.6
631	S	26.2	Very low	31	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	77%	0.769	S	S	*	*				-173.9	139.7	121.9	57.4	0	0	0	0	112.1
632	N	28.3	Very low	29.1	Very low	150 Å²	150	137 Å²	137	80%	0.802	77%	0.768	S	S	*	*			trans	-82	158.6	170.8	-80.7	-16.1	0	0	0	111
633	N	26.7	Very low	28	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	78%	0.781	S	S	*	*	S	Bend	trans	73.2	73.6	168.5	-54.2	-12.8	0	0	0	117.4
634	E	25.4	Very low	27.3	Very low	167 Å²	167	140.2 Å²	140.2	78%	0.78	78%	0.781	S	S	*	*			trans	-162.1	-5.2	134.6	-119	-178.6	-177.8	0	0	116.7	E636	E634-E636 VanDerWaalsContact C-N 3.28Å; E634-E636 PolarHBondContact O-N 2.79Å
635	S	26	Very low	26.7	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	25.7	-168.5	61.6	0	0	0	0	117.5
636	E	28.3	Very low	26.7	Very low	174 Å²	174	144.2 Å²	144.2	81%	0.813	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-7.2	-174.4	-123.2	-175.1	-178.5	0	0	115	E634	E634-E636 VanDerWaalsContact C-N 3.28Å; E634-E636 PolarHBondContact O-N 2.79Å
637	K	26.3	Very low	26.8	Very low	173 Å²	173	148.2 Å²	148.2	75%	0.752	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-0.4	-166.3	-83.5	176.3	179.1	163.7	0	117.2
638	W	26.6	Very low	26.7	Very low	253 Å²	253	149.5 Å²	149.5	96%	0.958	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	6.9	-172.2	-74.1	1.1	0	0	0	116
639	M	27.6	Very low	26.8	Very low	159 Å²	159	148.1 Å²	148.1	78%	0.783	79%	0.787	S	S	*	*	S	Bend	trans	-130.7	43	177.2	-66.4	-158.1	-64.8	0	0	114.5
640	N	25.7	Very low	26.9	Very low	157 Å²	157	148.4 Å²	148.4	84%	0.84	78%	0.782	S	S	*	*			trans	-141.6	83.4	171.3	-89.9	-64.5	0	0	0	112.3
641	G	24	Very low	27	Very low	91 Å²	91	145.5 Å²	145.5	94%	0.938	76%	0.762	S	S	*	*			trans	-132.7	62.7	176.7	0	0	0	0	0	112.2
642	G	25.7	Very low	27.1	Very low	58 Å²	58	144.6 Å²	144.6	60%	0.598	76%	0.755	S	S	*	*	S	Bend	trans	-175.1	145.1	179.7	0	0	0	0	0	112.6	P644	G642-P644 WeakPolarHBondContact O-CD 3.11Å
643	L	25.6	Very low	27.2	Very low	179 Å²	179	145.5 Å²	145.5	94%	0.937	75%	0.753	S	S	*	*			trans	-72.8	126.5	-166.4	-76.6	70.7	0	0	0	114.1
644	P	28.5	Very low	27.4	Very low	104 Å²	104	142.2 Å²	142.2	68%	0.675	73%	0.729	S	S	*	*			trans	-115.4	62.3	178	40	-29.6	0	0	0	114.1	G642 R648	G642-P644 WeakPolarHBondContact O-CD 3.11Å; P644-R648 PolarHBondContact O-NH2 3.49Å
645	N	26.6	Very low	27.8	Very low	126 Å²	126	137.7 Å²	137.7	67%	0.674	71%	0.713	S	S	*	*	S	Bend	trans	-131.5	7.3	179.2	-103.6	-25.7	0	0	0	118.1	R648	N645-R648 PolarHBondContact OD1-NH1 3.42Å; N645-R648 PolarHBondContact OD1-NH2 3.2Å
646	L	28.6	Very low	27.9	Very low	174 Å²	174	137.8 Å²	137.8	91%	0.911	71%	0.714	S	S	*	*	S	Bend	trans	-129.1	-3	175.2	-101.2	163.3	0	0	0	116.2
647	R	29	Very low	28.5	Very low	204 Å²	204	133.7 Å²	133.7	77%	0.77	69%	0.694	S	S	*	*			trans	-85.1	-2	179.9	-72.4	-169.4	176.7	-163	0.2	115.7	V649	R647-V649 VanDerWaalsContact C-N 3.31Å; R647-V649 PolarHBondContact O-N 2.98Å; R647-V649 VanDerWaalsContact O-N 3.09Å
648	R	26.1	Very low	29.3	Very low	178 Å²	178	133.9 Å²	133.9	67%	0.672	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	4.1	-157	-149.3	174.3	-69.4	127.8	3.8	116.9	P644 N645	P644-R648 PolarHBondContact O-NH2 3.49Å; N645-R648 PolarHBondContact OD1-NH1 3.42Å; N645-R648 PolarHBondContact OD1-NH2 3.2Å
649	V	29.1	Very low	30.7	Very low	121 Å²	121	127.5 Å²	127.5	73%	0.733	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-26.9	-173.8	-176.6	0	0	0	0	114.4	R647	R647-V649 VanDerWaalsContact C-N 3.31Å; R647-V649 PolarHBondContact O-N 2.98Å; R647-V649 VanDerWaalsContact O-N 3.09Å
650	F	27.4	Very low	32.5	Very low	138 Å²	138	121.6 Å²	121.6	61%	0.605	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-17.6	178.4	-90.4	-77.3	0	0	0	114.8	S652	F650-S652 PolarHBondContact O-N 2.89Å
651	N	29.1	Very low	35	Very low	79 Å²	79	118.1 Å²	118.1	42%	0.422	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	3.9	177.5	-86	58.7	0	0	0	114.6	F653 Y654 T655	N651-F653 VanDerWaalsContact C-N 3.27Å; N651-F653 PolarHBondContact O-N 3.45Å; N651-Y654 CarbonylContact O-C 3.11Å; N651-Y654 PolarHBondContact O-N 3.31Å; N651-T655 PolarHBondContact O-N 3.17Å
652	S	28.1	Very low	37.8	Very low	85 Å²	85	115.1 Å²	115.1	59%	0.594	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-26.7	172	50.4	0	0	0	0	113	F650	F650-S652 PolarHBondContact O-N 2.89Å
653	F	31.1	Very low	40.8	Very low	170 Å²	170	112.9 Å²	112.9	75%	0.746	58%	0.575	S	S	*	*	S	Bend	trans	-92.4	-18.3	174.2	-66.1	-80.9	0	0	0	113.4	N486 N651	N486-F653 PolarHBondContact ND2-O 3.23Å; N651-F653 VanDerWaalsContact C-N 3.27Å; N651-F653 PolarHBondContact O-N 3.45Å
654	Y	30.8	Very low	43.5	Very low	87 Å²	87	105.7 Å²	105.7	34%	0.341	55%	0.545	S	S	.	.	S	Bend	trans	-114	74.4	170.2	-81.5	-84.2	0	0	0	109.1	N651 S656	N651-Y654 CarbonylContact O-C 3.11Å; N651-Y654 PolarHBondContact O-N 3.31Å; Y654-S656 PolarHBondContact O-N 2.8Å
655	T	32.6	Very low	46.4	Very low	72 Å²	72	104.4 Å²	104.4	44%	0.442	53%	0.53	S	S	.	.			trans	-42.2	134.4	173.7	44.9	0	0	0	0	111.4	N486 N651 H657	N486-T655 PolarHBondContact ND2-OG1 2.84Å; N486-T655 PolarHBondContact OD1-OG1 2.95Å; N651-T655 PolarHBondContact O-N 3.17Å; T655-H657 PolarHBondContact O-CD2 3.3Å; T655-H657 PolarHBondContact O-N 2.85Å; T655-H657 PolarHBondContact OG1-CE1 2.81Å; T655-H657 PolarHBondContact OG1-NE2 3.22Å
656	S	29.6	Very low	49.3	Very low	112 Å²	112	98.4 Å²	98.4	78%	0.783	50%	0.498	S	S	*	.			trans	-68.6	82.1	174.3	53.9	0	0	0	0	110.6	Y654 Q658	Y654-S656 PolarHBondContact O-N 2.8Å; S656-Q658 PolarHBondContact O-N 3.36Å
657	H	40.5	Very low	52.1	Low	87 Å²	87	90.3 Å²	90.3	40%	0.403	46%	0.456	S	S	.	.			trans	-58	116.7	162.4	-63.1	-58	0	0	0	107.1	N486 T655 E659	N486-H657 PolarHBondContact OD1-CE1 3.28Å; N486-H657 PolarHBondContact OD1-NE2 2.87Å; T655-H657 PolarHBondContact O-CD2 3.3Å; T655-H657 PolarHBondContact O-N 2.85Å; T655-H657 PolarHBondContact OG1-CE1 2.81Å; T655-H657 PolarHBondContact OG1-NE2 3.22Å; H657-E659 PolarHBondContact O-N 3.22Å
658	Q	43.2	Very low	54.8	Low	178 Å²	178	84.8 Å²	84.8	83%	0.832	44%	0.441	S	S	*	.			trans	-60.6	128.2	172.4	-69.7	175.3	-76.1	0	0	107.5	S656 T660	S656-Q658 PolarHBondContact O-N 3.36Å; Q658-T660 PolarHBondContact O-N 3.27Å
659	E	55	Low	57.7	Low	119 Å²	119	76.4 Å²	76.4	56%	0.556	41%	0.41	S	S	*	.			trans	-61.8	111	175.7	-68.1	-167	160.8	0	0	109	K618 H657 P661	K618-E659 IonicContact NZ-OE1 3.45Å; K618-E659 PolarHBondContact NZ-OE1 3.29Å; K618-E659 IonicContact NZ-OE2 3.59Å; K618-E659 PolarHBondContact NZ-OE2 3.42Å; H657-E659 PolarHBondContact O-N 3.22Å; E659-P661 WeakPolarHBondContact O-CD 3.43Å
660	T	66.3	Low	60.5	Low	35 Å²	35	70.7 Å²	70.7	22%	0.215	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-62.2	118.9	175	44.8	0	0	0	0	108.7	Y520 A521 Q658 V662	Y520-T660 VanDerWaalsContact C-OG1 3.31Å; Y520-T660 WeakPolarHBondContact CA-OG1 3.33Å; A521-T660 PolarHBondContact O-OG1 2.84Å; Q658-T660 PolarHBondContact O-N 3.27Å; T660-V662 PolarHBondContact O-N 3.11Å; T660-V662 VanDerWaalsContact O-N 3.16Å
661	P	78	Confident	63.2	Low	84 Å²	84	64.3 Å²	64.3	55%	0.545	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-60	123.5	-174.5	20.9	-31.5	0	0	0	110.8	Q523 E659 I663	Q523-P661 PolarHBondContact NE2-O 2.85Å; E659-P661 WeakPolarHBondContact O-CD 3.43Å; P661-I663 PolarHBondContact O-N 3.21Å
662	V	82.6	Confident	65.8	Low	28 Å²	28	60.6 Å²	60.6	17%	0.17	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-61.5	129.5	-178	175.7	0	0	0	0	110	T660 L666 F670	T660-V662 PolarHBondContact O-N 3.11Å; T660-V662 VanDerWaalsContact O-N 3.16Å; V662-L666 HydrophobicContact CG1-CB 4.31Å; V662-L666 HydrophobicContact CG1-CD2 4.31Å; V662-L666 HydrophobicContact CG1-CG 4.36Å; V662-F670 HydrophobicContact CG1-CE2 4.27Å
663	I	89.4	Confident	68.3	Low	10 Å²	10	57.6 Å²	57.6	5%	0.051	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-71.2	144.4	175.5	65.7	176.3	0	0	0	111.2	Q523 Q526 R527 V530 P661 E665 L666 S667	Q523-I663 HydrophobicContact CB-CG2 3.71Å; Q523-I663 HydrophobicContact CG-CG2 3.68Å; Q526-I663 HydrophobicContact CB-CD1 3.66Å; Q526-I663 HydrophobicContact CB-CG1 3.9Å; Q526-I663 HydrophobicContact CB-CG2 4.38Å; R527-I663 HydrophobicContact CB-CD1 4.33Å; R527-I663 HydrophobicContact CG-CD1 3.51Å; V530-I663 HydrophobicContact CG2-CD1 4.32Å; P661-I663 PolarHBondContact O-N 3.21Å; I663-E665 HydrophobicContact CD1-CB 3.98Å; I663-E665 HydrophobicContact CG1-CB 4.2Å; I663-E665 PolarHBondContact O-N 3.47Å; I663-L666 HydrophobicContact CD1-CB 4.45Å; I663-L666 HydrophobicContact CG1-CB 3.73Å; I663-L666 PolarHBondContact O-N 3.16Å; I663-S667 WeakPolarHBondContact O-CB 3.24Å; I663-S667 PolarHBondContact O-N 2.73Å
664	G	83	Confident	70.6	Confident	29 Å²	29	51 Å²	51	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-53.5	-40	177.8	0	0	0	0	0	113.2	L666 S667 D668	G664-L666 PolarHBondContact O-N 3.33Å; G664-L666 VanDerWaalsContact O-N 3.15Å; G664-S667 WeakPolarHBondContact O-CA 3.13Å; G664-S667 WeakPolarHBondContact O-CB 3.21Å; G664-S667 PolarHBondContact O-N 2.94Å; G664-D668 PolarHBondContact O-N 2.8Å
665	E	87.5	Confident	72.6	Confident	77 Å²	77	48 Å²	48	36%	0.36	27%	0.269	S	S	.	.	H	α-helix	trans	-56.5	-30.7	178.6	-56.9	163.9	-133.4	0	0	114.3	R527 V530 R534 I663 M669	R527-E665 WeakPolarHBondContact CG-OE2 3.08Å; R527-E665 IonicContact CZ-OE1 3.44Å; R527-E665 IonicContact NE-OE1 2.73Å; R527-E665 PolarHBondContact NE-OE1 3.47Å; R527-E665 IonicContact NE-OE2 2.75Å; R527-E665 IonicContact NH2-OE1 3.56Å; R527-E665 PolarHBondContact NH2-OE1 3.23Å; V530-E665 HydrophobicContact CG1-CB 4.44Å; V530-E665 HydrophobicContact CG2-CB 4.23Å; R534-E665 PolarHBondContact NH2-O 2.87Å; I663-E665 HydrophobicContact CD1-CB 3.98Å; I663-E665 HydrophobicContact CG1-CB 4.2Å; I663-E665 PolarHBondContact O-N 3.47Å; E665-M669 WeakPolarHBondContact O-CG 3.38Å
666	L	89.2	Confident	74.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-89.4	-40	175.4	-179.2	58.5	0	0	0	110.7	C519 Q526 L529 V530 L533 V662 I663 G664 D668 M669 F670	C519-L666 HydrophobicContact CB-CD2 4.45Å; Q526-L666 HydrophobicContact CB-CD2 4.34Å; Q526-L666 HydrophobicContact CG-CD2 4.27Å; L529-L666 HydrophobicContact CD2-CD1 4.17Å; L529-L666 HydrophobicContact CD2-CD2 3.93Å; L529-L666 HydrophobicContact CG-CD1 4.42Å; V530-L666 VanDerWaalsContact CG2-CA 3.49Å; V530-L666 HydrophobicContact CG2-CB 3.57Å; V530-L666 HydrophobicContact CG2-CD1 3.91Å; V530-L666 HydrophobicContact CG2-CG 4.31Å; L533-L666 HydrophobicContact CD1-CD1 3.79Å; V662-L666 HydrophobicContact CG1-CB 4.31Å; V662-L666 HydrophobicContact CG1-CD2 4.31Å; V662-L666 HydrophobicContact CG1-CG 4.36Å; I663-L666 HydrophobicContact CD1-CB 4.45Å; I663-L666 HydrophobicContact CG1-CB 3.73Å; I663-L666 PolarHBondContact O-N 3.16Å; G664-L666 PolarHBondContact O-N 3.33Å; G664-L666 VanDerWaalsContact O-N 3.15Å; L666-D668 VanDerWaalsContact C-N 3.31Å; L666-D668 PolarHBondContact O-N 2.75Å; L666-M669 WeakPolarHBondContact O-CB 3.36Å; L666-M669 PolarHBondContact O-N 2.78Å; L666-F670 HydrophobicContact CD1-CZ 4.08Å; L666-F670 HydrophobicContact CD2-CZ 4.39Å; L666-F670 HydrophobicContact CG-CE2 4Å; L666-F670 HydrophobicContact CG-CZ 3.87Å
667	S	86.7	Confident	75.9	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-40.6	177.4	-141.7	0	0	0	0	113.1	K618 R619 L620 I663 G664 M669 F670	K618-S667 PolarHBondContact O-OG 3.01Å; R619-S667 VanDerWaalsContact CA-OG 3.25Å; R619-S667 WeakPolarHBondContact CA-OG 3.33Å; L620-S667 PolarHBondContact N-OG 2.71Å; I663-S667 WeakPolarHBondContact O-CB 3.24Å; I663-S667 PolarHBondContact O-N 2.73Å; G664-S667 WeakPolarHBondContact O-CA 3.13Å; G664-S667 WeakPolarHBondContact O-CB 3.21Å; G664-S667 PolarHBondContact O-N 2.94Å; S667-M669 PolarHBondContact O-N 3.08Å; S667-F670 PolarHBondContact O-N 3.17Å
668	D	85.6	Confident	76.8	Confident	88 Å²	88	46.2 Å²	46.2	47%	0.471	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.7	176.6	-74.1	-37.6	0	0	0	113.8	P544 G664 L666	P544-D668 WeakPolarHBondContact CD-O 3.32Å; G664-D668 PolarHBondContact O-N 2.8Å; L666-D668 VanDerWaalsContact C-N 3.31Å; L666-D668 PolarHBondContact O-N 2.75Å
669	M	87.5	Confident	77.5	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-15.3	174.6	-60.8	-179.5	61.2	0	0	113.2	V530 L533 R534 L541 L543 L615 E665 L666 S667 F671	V530-M669 HydrophobicContact CB-SD 4.19Å; V530-M669 HydrophobicContact CG1-SD 3.79Å; V530-M669 HydrophobicContact CG2-SD 4.02Å; L533-M669 HydrophobicContact CB-CE 3.59Å; L533-M669 HydrophobicContact CD1-CE 4.27Å; R534-M669 HydrophobicContact CG-CE 3.65Å; R534-M669 HydrophobicContact CG-SD 4.22Å; L541-M669 HydrophobicContact CD2-CE 3.55Å; L543-M669 HydrophobicContact CD2-CB 4.05Å; L543-M669 HydrophobicContact CD2-CE 4.4Å; L543-M669 HydrophobicContact CD2-CG 4.04Å; L615-M669 HydrophobicContact CD1-CB 4.2Å; L615-M669 HydrophobicContact CD1-CE 4.41Å; E665-M669 WeakPolarHBondContact O-CG 3.38Å; L666-M669 WeakPolarHBondContact O-CB 3.36Å; L666-M669 PolarHBondContact O-N 2.78Å; S667-M669 PolarHBondContact O-N 3.08Å; M669-F671 PolarHBondContact O-N 2.97Å
670	F	86.6	Confident	77.5	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	21%	0.21	C	C	.	.			trans	-76.8	113.9	178.8	-64.1	-50.8	0	0	0	111.2	I517 P544 L615 Q616 K618 R619 V662 L666 S667	I517-F670 HydrophobicContact CB-CE1 4.11Å; I517-F670 HydrophobicContact CB-CZ 4.46Å; I517-F670 HydrophobicContact CD1-CE1 4.31Å; I517-F670 HydrophobicContact CG1-CE1 4.45Å; P544-F670 WeakPolarHBondContact CG-O 3.4Å; L615-F670 HydrophobicContact CB-CD1 3.83Å; L615-F670 HydrophobicContact CB-CE1 4.4Å; Q616-F670 WeakPolarHBondContact O-CD1 3.34Å; Q616-F670 WeakPolarHBondContact O-CE1 3.37Å; K618-F670 WeakPolarHBondContact O-CD2 3.49Å; R619-F670 WeakPolarHBondContact CD-O 3.42Å; R619-F670 HydrophobicContact CG-CB 4Å; R619-F670 PolarHBondContact NH1-O 2.82Å; V662-F670 HydrophobicContact CG1-CE2 4.27Å; L666-F670 HydrophobicContact CD1-CZ 4.08Å; L666-F670 HydrophobicContact CD2-CZ 4.39Å; L666-F670 HydrophobicContact CG-CE2 4Å; L666-F670 HydrophobicContact CG-CZ 3.87Å; S667-F670 PolarHBondContact O-N 3.17Å
671	F	84	Confident	76.8	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.018	21%	0.211	C	C	.	.	S	Bend	trans	-65.3	-50.6	172	-167.4	-83.8	0	0	0	110.1	L542 L587 L614 L615 M669 Y815	L542-F671 HydrophobicContact CD2-CD2 4.14Å; L542-F671 HydrophobicContact CD2-CE2 3.69Å; L542-F671 HydrophobicContact CD2-CZ 4.42Å; L542-F671 HydrophobicContact CG-CD2 4.22Å; L542-F671 HydrophobicContact CG-CE2 4.11Å; L587-F671 HydrophobicContact CD1-CE2 3.73Å; L587-F671 HydrophobicContact CD1-CZ 3.77Å; L614-F671 HydrophobicContact CB-CB 4.25Å; L614-F671 HydrophobicContact CB-CG 4.41Å; L614-F671 HydrophobicContact CD2-CD1 3.71Å; L614-F671 HydrophobicContact CD2-CD2 4.15Å; L614-F671 HydrophobicContact CD2-CE1 3.78Å; L614-F671 HydrophobicContact CD2-CE2 4.21Å; L614-F671 HydrophobicContact CD2-CG 3.9Å; L614-F671 HydrophobicContact CD2-CZ 4.04Å; L615-F671 PolarHBondContact O-N 3.33Å; M669-F671 PolarHBondContact O-N 2.97Å; F671-Y815 HydrophobicContact CD1-CD1 4.27Å; F671-Y815 AromaticContact CE1-CD1 3.71Å; F671-Y815 HydrophobicContact CE1-CD1 3.71Å; F671-Y815 HydrophobicContact CE1-CE1 4.06Å; F671-Y815 HydrophobicContact CZ-CD1 4.14Å; F671-Y815 HydrophobicContact CZ-CE1 4.02Å; F671-Y815 WeakPolarHBondContact O-CB 3.42Å
672	F	83.6	Confident	75.1	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.8	176.4	-59.6	-78.3	0	0	0	111.6	I514 W603 L614 L615 Q616 G617 Y815 I817 L844	I514-F672 HydrophobicContact CD1-CE2 4.06Å; I514-F672 HydrophobicContact CD1-CZ 4.34Å; I514-F672 HydrophobicContact CG1-CE2 4.16Å; I514-F672 HydrophobicContact CG2-CD2 4.32Å; I514-F672 HydrophobicContact CG2-CE2 4.31Å; W603-F672 HydrophobicContact CH2-CD1 4.4Å; W603-F672 AromaticContact CH2-CE1 3.83Å; W603-F672 HydrophobicContact CH2-CE1 3.83Å; W603-F672 AromaticContact CZ3-CE1 3.67Å; W603-F672 HydrophobicContact CZ3-CE1 3.67Å; W603-F672 HydrophobicContact CZ3-CZ 4.45Å; L614-F672 HydrophobicContact CB-CD2 4.4Å; L614-F672 HydrophobicContact CB-CE2 3.85Å; L614-F672 HydrophobicContact CD2-CE2 3.93Å; L614-F672 HydrophobicContact CD2-CZ 4.18Å; L615-F672 PolarHBondContact O-N 2.93Å; Q616-F672 HydrophobicContact CB-CB 4.08Å; Q616-F672 HydrophobicContact CG-CB 4.18Å; G617-F672 PolarHBondContact N-O 3.02Å; F672-Y815 VanDerWaalsContact CA-O 3.28Å; F672-Y815 WeakPolarHBondContact CA-O 3.49Å; F672-I817 HydrophobicContact CB-CD1 3.63Å; F672-I817 HydrophobicContact CB-CG1 3.92Å; F672-I817 HydrophobicContact CD1-CD1 3.77Å; F672-I817 HydrophobicContact CD1-CG1 3.72Å; F672-I817 HydrophobicContact CD2-CD1 3.88Å; F672-I817 HydrophobicContact CE1-CD1 4.37Å; F672-I817 HydrophobicContact CE1-CG1 4.4Å; F672-I817 HydrophobicContact CE2-CD1 4.47Å; F672-I817 HydrophobicContact CG-CD1 3.49Å; F672-I817 VanDerWaalsContact CG-CD1 3.49Å; F672-I817 HydrophobicContact CG-CG1 3.89Å; F672-L844 HydrophobicContact CD1-CD1 4.4Å; F672-L844 HydrophobicContact CE1-CD1 3.6Å; F672-L844 HydrophobicContact CZ-CD1 3.91Å
673	D	81.4	Confident	73	Confident	21 Å²	21	40.8 Å²	40.8	11%	0.112	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	154.6	168.1	-163.7	7.5	0	0	0	110.4	G617 R619 Y815 Y816 I817	G617-D673 WeakPolarHBondContact O-CA 3.36Å; R619-D673 HydrophobicContact CB-CB 4.15Å; R619-D673 HydrophobicContact CG-CB 3.86Å; R619-D673 PolarHBondContact N-OD1 3.49Å; D673-Y815 PolarHBondContact N-O 3.14Å; D673-Y816 HydrophobicContact CB-CD1 3.74Å; D673-Y816 HydrophobicContact CB-CE1 3.6Å; D673-Y816 VanDerWaalsContact CG-CE1 3.48Å; D673-Y816 WeakPolarHBondContact O-CA 3.26Å; D673-Y816 WeakPolarHBondContact OD2-CE1 3.47Å; D673-I817 PolarHBondContact O-N 3.4Å
674	T	78.6	Confident	70.2	Confident	33 Å²	33	45.9 Å²	45.9	20%	0.202	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.3	-169.2	-64.2	0	0	0	0	111.1	Q616 G617 I819	Q616-T674 PolarHBondContact NE2-OG1 3.15Å; G617-T674 PolarHBondContact O-N 3.3Å; G617-T674 PolarHBondContact O-OG1 3.15Å; T674-I819 HydrophobicContact CG2-CD1 3.39Å; T674-I819 HydrophobicContact CG2-CG1 3.94Å
675	T	73	Confident	68	Low	22 Å²	22	45.8 Å²	45.8	14%	0.135	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	145	174.7	38.6	0	0	0	0	112.4	Y816 I817 I819	T675-Y816 HydrophobicContact CG2-CD1 3.43Å; T675-Y816 VanDerWaalsContact CG2-CD1 3.43Å; T675-Y816 HydrophobicContact CG2-CE1 3.34Å; T675-Y816 HydrophobicContact CG2-CG 4.11Å; T675-Y816 WeakPolarHBondContact OG1-CD1 3.38Å; T675-I817 PolarHBondContact N-O 3.31Å; T675-I817 VanDerWaalsContact N-O 3.11Å; T675-I819 PolarHBondContact O-N 3.46Å
676	N	69.7	Low	65.6	Low	85 Å²	85	45.6 Å²	45.6	46%	0.455	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138	175.9	-66.3	-35	0	0	0	110.5	E678 Q679	N676-E678 VanDerWaalsContact C-N 3.28Å; N676-E678 PolarHBondContact O-N 3.34Å; N676-Q679 HydrophobicContact CB-CG 4.41Å; N676-Q679 WeakPolarHBondContact O-CB 3.43Å; N676-Q679 PolarHBondContact O-N 3.36Å
677	Y	62.1	Low	62.9	Low	47 Å²	47	49.4 Å²	49.4	18%	0.184	26%	0.258	C	S	.	.	H	α-helix	trans	-54.2	-37.2	-178.6	179.1	-93.6	0	0	0	114.5	Q679 V680 A681 I818 I819 M820 A828 L836 L839	Y677-Q679 VanDerWaalsContact C-N 3.28Å; Y677-Q679 PolarHBondContact O-N 2.94Å; Y677-V680 WeakPolarHBondContact O-CB 3.42Å; Y677-V680 PolarHBondContact O-N 3.47Å; Y677-A681 HydrophobicContact CD1-CB 4.11Å; Y677-A681 HydrophobicContact CE1-CB 3.71Å; Y677-A681 WeakPolarHBondContact O-CB 3.36Å; Y677-A681 PolarHBondContact O-N 2.91Å; Y677-I818 HydrophobicContact CD2-CG2 4.19Å; Y677-I819 PolarHBondContact N-O 2.8Å; Y677-I819 VanDerWaalsContact N-O 3.1Å; Y677-M820 VanDerWaalsContact CB-CG 3.49Å; Y677-M820 HydrophobicContact CD2-CE 4.21Å; Y677-M820 HydrophobicContact CD2-CG 3.92Å; Y677-M820 HydrophobicContact CD2-SD 3.65Å; Y677-M820 HydrophobicContact CE2-CE 4.35Å; Y677-M820 HydrophobicContact CE2-SD 4.17Å; Y677-M820 HydrophobicContact CG-CE 4.45Å; Y677-M820 HydrophobicContact CG-CG 3.81Å; Y677-M820 HydrophobicContact CG-SD 4.12Å; Y677-A828 HydrophobicContact CE1-CB 4.49Å; Y677-L836 HydrophobicContact CE2-CD1 4.43Å; Y677-L839 HydrophobicContact CE2-CD2 4.42Å
678	E	59	Low	60.2	Low	102 Å²	102	51.9 Å²	51.9	48%	0.477	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-33.3	178.9	-62.9	-170.5	152.5	0	0	112.4	N676 V680 A681 D682 E824 R827	N676-E678 VanDerWaalsContact C-N 3.28Å; N676-E678 PolarHBondContact O-N 3.34Å; E678-V680 VanDerWaalsContact C-N 3.27Å; E678-V680 PolarHBondContact O-N 3.08Å; E678-A681 PolarHBondContact O-N 2.84Å; E678-D682 PolarHBondContact O-N 3.24Å; E678-E824 WeakPolarHBondContact CG-OE1 2.97Å; E678-R827 IonicContact OE1-CZ 3.39Å; E678-R827 IonicContact OE1-NH2 2.63Å; E678-R827 PolarHBondContact OE1-NH2 3.37Å
679	Q	57.9	Low	57.6	Low	125 Å²	125	52.1 Å²	52.1	58%	0.584	28%	0.277	S	S	*	.	H	α-helix	trans	-69.6	-24.2	174.7	-61.8	170.8	-45.2	0	0	112.9	N676 Y677 N683	N676-Q679 HydrophobicContact CB-CG 4.41Å; N676-Q679 WeakPolarHBondContact O-CB 3.43Å; N676-Q679 PolarHBondContact O-N 3.36Å; Y677-Q679 VanDerWaalsContact C-N 3.28Å; Y677-Q679 PolarHBondContact O-N 2.94Å; Q679-N683 PolarHBondContact O-ND2 3.46Å; Q679-N683 VanDerWaalsContact O-ND2 3.11Å
680	V	56.7	Low	54.9	Low	15 Å²	15	57.8 Å²	57.8	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-85	-42.7	175.9	-178.5	0	0	0	0	110.4	Y677 E678 N683 L812	Y677-V680 WeakPolarHBondContact O-CB 3.42Å; Y677-V680 PolarHBondContact O-N 3.47Å; E678-V680 VanDerWaalsContact C-N 3.27Å; E678-V680 PolarHBondContact O-N 3.08Å; V680-N683 PolarHBondContact O-ND2 2.66Å; V680-L812 HydrophobicContact CG1-CD1 4.17Å; V680-L812 HydrophobicContact CG1-CD2 4.21Å; V680-L812 HydrophobicContact CG2-CD2 4Å
681	A	51.3	Low	52.1	Low	29 Å²	29	62.1 Å²	62.1	24%	0.24	34%	0.336	C	S	.	.	H	α-helix	trans	-74.3	-26.9	-172.8	0	0	0	0	0	114.5	Y677 E678 N683	Y677-A681 HydrophobicContact CD1-CB 4.11Å; Y677-A681 HydrophobicContact CE1-CB 3.71Å; Y677-A681 WeakPolarHBondContact O-CB 3.36Å; Y677-A681 PolarHBondContact O-N 2.91Å; E678-A681 PolarHBondContact O-N 2.84Å; A681-N683 PolarHBondContact O-N 3.15Å
682	D	41.7	Very low	49.3	Very low	112 Å²	112	66.4 Å²	66.4	60%	0.599	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.2	-179.8	-116.8	-36.8	0	0	0	114	E678 D684 K687	E678-D682 PolarHBondContact O-N 3.24Å; D682-D684 PolarHBondContact O-N 3.01Å; D682-K687 PolarHBondContact O-NZ 3.4Å; D682-K687 WeakPolarHBondContact OD1-CE 3.08Å; D682-K687 IonicContact OD1-NZ 2.71Å; D682-K687 PolarHBondContact OD1-NZ 2.98Å
683	N	37.6	Very low	46.5	Very low	49 Å²	49	74 Å²	74	26%	0.262	41%	0.406	S	S	.	.	S	Bend	trans	-66.3	126.9	176	-69.7	-63.8	0	0	0	112.1	Q679 V680 A681 S685 I686 I810	Q679-N683 PolarHBondContact O-ND2 3.46Å; Q679-N683 VanDerWaalsContact O-ND2 3.11Å; V680-N683 PolarHBondContact O-ND2 2.66Å; A681-N683 PolarHBondContact O-N 3.15Å; N683-S685 PolarHBondContact O-N 3.48Å; N683-I686 PolarHBondContact O-N 3.42Å; N683-I810 HydrophobicContact CB-CD1 3.98Å; N683-I810 VanDerWaalsContact OD1-CD1 3.28Å; N683-I810 WeakPolarHBondContact OD1-CD1 3.38Å
684	D	31.8	Very low	43.9	Very low	118 Å²	118	80.1 Å²	80.1	63%	0.631	44%	0.439	S	S	*	.	H	α-helix	trans	-62.9	-18	-172.2	-69.7	-38.5	0	0	0	114.7	D682 I686 K687 S688	D682-D684 PolarHBondContact O-N 3.01Å; D684-I686 PolarHBondContact O-N 2.9Å; D684-I686 VanDerWaalsContact O-N 3.17Å; D684-K687 PolarHBondContact O-N 3.39Å; D684-K687 VanDerWaalsContact O-N 3.1Å; D684-K687 WeakPolarHBondContact OD1-CD 3.45Å; D684-K687 IonicContact OD1-NZ 3.79Å; D684-K687 PolarHBondContact OD1-NZ 3.43Å; D684-S688 PolarHBondContact O-N 2.86Å
685	S	35.7	Very low	41.2	Very low	27 Å²	27	86.6 Å²	86.6	19%	0.189	47%	0.469	C	S	.	.	H	α-helix	trans	-65	-11.3	172.5	60.6	0	0	0	0	114.8	N683 S688	N683-S685 PolarHBondContact O-N 3.48Å; S685-S688 PolarHBondContact O-OG 3.05Å
686	I	37.4	Very low	39	Very low	73 Å²	73	92.3 Å²	92.3	37%	0.374	50%	0.499	S	S	.	.	H	α-helix	trans	-93.8	-38.4	170	-64.2	171.7	0	0	0	110.2	N683 D684 S688 N689	N683-I686 PolarHBondContact O-N 3.42Å; D684-I686 PolarHBondContact O-N 2.9Å; D684-I686 VanDerWaalsContact O-N 3.17Å; I686-S688 VanDerWaalsContact C-N 3.27Å; I686-S688 PolarHBondContact O-N 3.38Å; I686-N689 PolarHBondContact O-N 3.02Å
687	K	33.4	Very low	36.9	Very low	80 Å²	80	100.4 Å²	100.4	35%	0.348	52%	0.523	S	S	.	.	H	α-helix	trans	-65.1	-27.4	-178.7	-69.7	160.2	-177.5	161.1	0	112.9	D682 D684 N689 I690 S691	D682-K687 PolarHBondContact O-NZ 3.4Å; D682-K687 WeakPolarHBondContact OD1-CE 3.08Å; D682-K687 IonicContact OD1-NZ 2.71Å; D682-K687 PolarHBondContact OD1-NZ 2.98Å; D684-K687 PolarHBondContact O-N 3.39Å; D684-K687 VanDerWaalsContact O-N 3.1Å; D684-K687 WeakPolarHBondContact OD1-CD 3.45Å; D684-K687 IonicContact OD1-NZ 3.79Å; D684-K687 PolarHBondContact OD1-NZ 3.43Å; K687-N689 VanDerWaalsContact C-N 3.28Å; K687-N689 PolarHBondContact O-N 2.89Å; K687-I690 WeakPolarHBondContact O-CB 3.17Å; K687-I690 PolarHBondContact O-N 2.9Å; K687-S691 PolarHBondContact O-N 3.04Å; K687-S691 VanDerWaalsContact O-N 3.17Å; K687-S691 PolarHBondContact O-OG 3.39Å
688	S	30.1	Very low	35	Very low	56 Å²	56	108 Å²	108	39%	0.392	56%	0.557	S	S	.	*	H	α-helix	trans	-58.3	-32.8	178.5	60.3	0	0	0	0	114.5	D684 S685 I686 S691	D684-S688 PolarHBondContact O-N 2.86Å; S685-S688 PolarHBondContact O-OG 3.05Å; I686-S688 VanDerWaalsContact C-N 3.27Å; I686-S688 PolarHBondContact O-N 3.38Å; S688-S691 PolarHBondContact O-OG 2.91Å
689	N	29.8	Very low	33.5	Very low	93 Å²	93	111.9 Å²	111.9	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-76.6	-33.1	175.9	-72.1	-8.8	0	0	0	111.8	I686 K687 S692	I686-N689 PolarHBondContact O-N 3.02Å; K687-N689 VanDerWaalsContact C-N 3.28Å; K687-N689 PolarHBondContact O-N 2.89Å; N689-S692 PolarHBondContact O-N 3.4Å; N689-S692 PolarHBondContact O-OG 3.32Å
690	I	31.2	Very low	32	Very low	119 Å²	119	110.9 Å²	110.9	61%	0.61	58%	0.584	S	S	*	*	H	α-helix	trans	-70.4	-32	-178.1	-57.4	176.2	0	0	0	111.4	K687 S692 L693	K687-I690 WeakPolarHBondContact O-CB 3.17Å; K687-I690 PolarHBondContact O-N 2.9Å; I690-S692 PolarHBondContact O-N 2.89Å; I690-L693 PolarHBondContact O-N 2.87Å
691	S	27.4	Very low	30.4	Very low	94 Å²	94	115.2 Å²	115.2	66%	0.657	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-7.6	176.9	33.5	0	0	0	0	115.7	K687 S688	K687-S691 PolarHBondContact O-N 3.04Å; K687-S691 VanDerWaalsContact O-N 3.17Å; K687-S691 PolarHBondContact O-OG 3.39Å; S688-S691 PolarHBondContact O-OG 2.91Å
692	S	26.4	Very low	29.2	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-7.8	-177.5	68.4	0	0	0	0	115.5	N689 I690	N689-S692 PolarHBondContact O-N 3.4Å; N689-S692 PolarHBondContact O-OG 3.32Å; I690-S692 PolarHBondContact O-N 2.89Å
693	L	24.9	Very low	28.4	Very low	160 Å²	160	120.5 Å²	120.5	84%	0.838	65%	0.646	S	S	*	*	S	Bend	trans	-122.9	20.5	-173.1	-81.2	170.4	0	0	0	114.9	I690	I690-L693 PolarHBondContact O-N 2.87Å
694	N	25.4	Very low	27.7	Very low	151 Å²	151	124 Å²	124	81%	0.807	67%	0.669	S	S	*	*			trans	-121.9	63.9	179.8	-137.4	-14.5	0	0	0	112.4
695	M	23.2	Very low	27.6	Very low	168 Å²	168	126.2 Å²	126.2	83%	0.828	68%	0.679	S	S	*	*			trans	-73.3	141.4	166.8	-96.9	-69.5	-173.2	0	0	110.6
696	N	26	Very low	27.1	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	71%	0.706	S	S	*	*	S	Bend	trans	63.6	79.9	170.4	-61.7	-21.9	0	0	0	117.8
697	R	25.3	Very low	26.4	Very low	254 Å²	254	132.2 Å²	132.2	96%	0.958	72%	0.722	S	S	*	*				-157.7	112.8	101.5	-100.3	172.6	-160.8	-161.2	4.9	111.3
698	K	23.7	Very low	26.1	Very low	206 Å²	206	133.4 Å²	133.4	90%	0.896	74%	0.741	S	S	*	*			trans	-128.1	140.9	168.5	-105.3	-174.2	177.7	178.3	0	109.1
699	M	25.8	Very low	26	Very low	185 Å²	185	135.7 Å²	135.7	91%	0.911	76%	0.757	S	S	*	*			trans	-132.9	129.4	145.7	-107	-174.6	167.4	0	0	110
700	S	26.5	Very low	25.9	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	77%	0.767	S	S	*	*			trans	-30.9	161.2	155.5	31.8	0	0	0	0	116.6
701	S	25	Very low	25.7	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	78%	0.775	S	S	*	*			cis	-179.2	177.1	0.2	49.6	0	0	0	0	110.1
702	L	25.4	Very low	25.8	Very low	161 Å²	161	144 Å²	144	84%	0.843	79%	0.789	S	S	*	*			cis	-153	-161.3	-1.5	-146.5	66.2	0	0	0	111.2
703	S	23.7	Very low	25.9	Very low	92 Å²	92	142.8 Å²	142.8	64%	0.643	79%	0.791	S	S	*	*			trans	-81.4	178.2	175.6	49.7	0	0	0	0	115
704	T	24.7	Very low	26.1	Very low	122 Å²	122	142.7 Å²	142.7	75%	0.748	79%	0.79	S	S	*	*			cis	172	153.1	-22.4	-75.3	0	0	0	0	106.9
705	I	28.2	Very low	26.3	Very low	165 Å²	165	144.3 Å²	144.3	85%	0.846	79%	0.789	S	S	*	*			trans	-175.5	161.5	150.5	-94.5	149.2	0	0	0	111.5
706	T	24.9	Very low	26.6	Very low	123 Å²	123	140.9 Å²	140.9	76%	0.755	78%	0.782	S	S	*	*			trans	-96.6	-167.7	-171.7	52.5	0	0	0	0	114
707	S	24.6	Very low	26.7	Very low	102 Å²	102	140 Å²	140	71%	0.713	78%	0.777	S	S	*	*			cis	-166.3	-179.1	22.5	-25.1	0	0	0	0	109.4
708	S	26.3	Very low	26.8	Very low	105 Å²	105	135 Å²	135	73%	0.734	77%	0.769	S	S	*	*			cis	-172.5	161.5	-15.5	41	0	0	0	0	112.9
709	S	27.4	Very low	26.8	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	76%	0.761	S	S	*	*			trans	59.4	119.1	148.2	58.6	0	0	0	0	126.2
710	S	27.9	Very low	26.8	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	75%	0.749	S	S	*	*				93.4	106.4	122.1	66.8	0	0	0	0	127.1
711	T	28	Very low	26.7	Very low	127 Å²	127	131.8 Å²	131.8	78%	0.779	75%	0.748	S	S	*	*				84.8	128.8	123.3	54	0	0	0	0	127.4
712	R	29	Very low	26.8	Very low	252 Å²	252	134.5 Å²	134.5	95%	0.951	75%	0.749	S	S	*	*			trans	67.6	145	153.6	-64.8	173.4	179.2	-179.6	0.1	118.9
713	G	27.6	Very low	26.7	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	74%	0.742	S	S	*	*			cis	155.2	159.6	-12.8	0	0	0	0	0	114.2
714	I	29.9	Very low	26.8	Very low	158 Å²	158	136.7 Å²	136.7	81%	0.81	75%	0.749	S	S	*	*			trans	137.3	118	152.9	-73.5	163.9	0	0	0	117.1
715	K	29.1	Very low	26.8	Very low	185 Å²	185	136.9 Å²	136.9	80%	0.804	75%	0.746	S	S	*	*			trans	51.6	158.9	144.7	-70.1	-176.3	-179.2	-174.3	0	122
716	S	29.6	Very low	26.7	Very low	96 Å²	96	135 Å²	135	67%	0.671	74%	0.737	S	S	*	*			cis	-175.7	172.6	-7.8	43.9	0	0	0	0	111.1
717	D	29	Very low	26.7	Very low	125 Å²	125	134 Å²	134	67%	0.668	73%	0.731	S	S	*	*			cis	-177.5	125.5	-36.8	-83.9	-43.6	0	0	0	111.5
718	L	25.9	Very low	27	Very low	150 Å²	150	136.7 Å²	136.7	79%	0.785	73%	0.732	S	S	*	*			trans	66.9	157.5	149.1	-51.8	168.5	0	0	0	119.7
719	K	25.6	Very low	27.1	Very low	165 Å²	165	137.9 Å²	137.9	72%	0.717	73%	0.73	S	S	*	*			cis	-168.3	160.1	-8.7	-120.2	179.9	170.4	-175.4	0	113.9
720	L	24.7	Very low	27.1	Very low	128 Å²	128	137.3 Å²	137.3	67%	0.67	73%	0.726	S	S	*	*			trans	69.1	113	145.9	-68.8	168.1	0	0	0	125.2
721	D	24.3	Very low	27	Very low	133 Å²	133	137.5 Å²	137.5	71%	0.711	73%	0.728	S	S	*	*				77.6	145.3	118.3	-70.3	18.4	0	0	0	128.6
722	H	28.2	Very low	27	Very low	162 Å²	162	138.2 Å²	138.2	75%	0.75	73%	0.732	S	S	*	*			trans	89	78	152.8	-74.1	1.1	0	0	0	123.8
723	S	23.2	Very low	27	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	72%	0.724	S	S	*	*				80.7	154	113.6	80.5	0	0	0	0	124.2
724	Y	24.8	Very low	27.3	Very low	200 Å²	200	134.5 Å²	134.5	78%	0.784	73%	0.731	S	S	*	*			trans	78.7	102.7	161.1	-89.1	-85.2	0	0	0	122.8
725	N	25.3	Very low	27.1	Very low	126 Å²	126	133.2 Å²	133.2	67%	0.674	73%	0.73	S	S	*	*			trans	69	129.9	135	-76.9	13.7	0	0	0	125.3
726	N	26.1	Very low	27	Very low	126 Å²	126	130.7 Å²	130.7	67%	0.674	73%	0.73	S	S	*	*			trans	91.4	96.4	131	-78.5	16.4	0	0	0	123.7
727	T	25.1	Very low	26.9	Very low	102 Å²	102	133 Å²	133	63%	0.626	73%	0.733	S	S	*	*				77.5	145.7	119.2	58.4	0	0	0	0	122.6
728	H	29.1	Very low	26.8	Very low	157 Å²	157	133.7 Å²	133.7	73%	0.727	74%	0.741	S	S	*	*			trans	73.3	139.5	164.9	-58.7	-59.4	0	0	0	116.9
729	N	29.3	Very low	26.8	Very low	131 Å²	131	130.1 Å²	130.1	70%	0.701	74%	0.741	S	S	*	*			cis	-154.5	156.5	-3.5	-121	-2.2	0	0	0	114.8
730	S	26.4	Very low	27	Very low	92 Å²	92	125.6 Å²	125.6	64%	0.643	74%	0.741	S	S	*	*			trans	-1.5	153.4	143.5	54.4	0	0	0	0	120.3
731	S	26.3	Very low	27	Very low	106 Å²	106	125.7 Å²	125.7	74%	0.741	75%	0.747	S	S	*	*			cis	179.8	163.9	6.7	42.5	0	0	0	0	112.1
732	T	28.2	Very low	27	Very low	142 Å²	142	128 Å²	128	87%	0.871	75%	0.753	S	S	*	*			trans	-158.7	128.9	136.1	16.2	0	0	0	0	111.6
733	S	28.3	Very low	26.9	Very low	112 Å²	112	126.4 Å²	126.4	78%	0.783	76%	0.756	S	S	*	*			trans	-170.1	139.5	168.9	-82.7	0	0	0	0	110.4
734	P	35.1	Very low	26.9	Very low	129 Å²	129	130 Å²	130	84%	0.838	76%	0.762	S	S	*	*			trans	-103.9	150.4	161.3	35.3	-27.8	0	0	0	111.5
735	V	25.3	Very low	27	Very low	130 Å²	130	126.6 Å²	126.6	79%	0.788	76%	0.762	S	S	*	*			cis	151.4	120.7	-21.4	149.3	0	0	0	0	106.5
736	V	26.3	Very low	26.9	Very low	133 Å²	133	127.6 Å²	127.6	81%	0.806	77%	0.767	S	S	*	*			trans	173	132.1	162.3	134.4	0	0	0	0	107.4
737	I	28.2	Very low	26.9	Very low	145 Å²	145	130.2 Å²	130.2	74%	0.744	78%	0.775	S	S	*	*			cis	-153.5	-174.9	-16.8	-138	178.9	0	0	0	110.1
738	V	27.4	Very low	27.1	Very low	138 Å²	138	131 Å²	131	84%	0.836	78%	0.782	S	S	*	*			trans	-32.3	145.3	170.4	-175.4	0	0	0	0	115.9
739	G	26.5	Very low	26.9	Very low	75 Å²	75	129.5 Å²	129.5	77%	0.773	78%	0.784	S	S	*	*			cis	179.1	-169.2	5.2	0	0	0	0	0	109.1
740	G	27.9	Very low	26.6	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	79%	0.79	S	S	*	*			cis	132.8	134.6	-3.1	0	0	0	0	0	112.7
741	T	25.1	Very low	26.5	Very low	130 Å²	130	134.4 Å²	134.4	80%	0.798	80%	0.797	S	S	*	*			cis	-170.9	142.4	-13.5	-8.9	0	0	0	0	112.4
742	Q	24.2	Very low	26.3	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	80%	0.802	S	S	*	*			trans	65	169.3	164.8	-49.9	178.5	-0.2	0	0	117.2
743	T	27.3	Very low	26.3	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	80%	0.8	S	S	*	*			cis	-132.2	-160.1	7.5	50.1	0	0	0	0	113.2
744	E	22.3	Very low	26.1	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	80%	0.802	S	S	*	*			trans	-105.7	159	-158.3	-50.2	167.6	123	0	0	116.7
745	T	26.3	Very low	25.6	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	81%	0.805	S	S	*	*				176.3	136.8	118.8	27.7	0	0	0	0	115.6
746	N	24.9	Very low	25.5	Very low	147 Å²	147	147.5 Å²	147.5	79%	0.786	81%	0.806	S	S	*	*			trans	33.7	102	150.2	-60.3	-15.6	0	0	0	122.7
747	H	25.5	Very low	25.3	Very low	181 Å²	181	151.6 Å²	151.6	84%	0.838	81%	0.809	S	S	*	*				-169.8	152.3	117	-113.5	-90.3	0	0	0	110.3
748	P	28.3	Very low	25.1	Very low	119 Å²	119	153.2 Å²	153.2	77%	0.773	81%	0.813	S	S	*	*			trans	-91.2	119.6	-170.5	33.5	-30.8	0	0	0	113.3
749	T	25.2	Very low	24.9	Very low	125 Å²	125	151.6 Å²	151.6	77%	0.767	81%	0.808	S	S	*	*			trans	-143.7	152.4	175.1	-29.1	0	0	0	0	112.6
750	M	23.5	Very low	24.7	Very low	171 Å²	171	158.2 Å²	158.2	84%	0.842	82%	0.816	S	S	*	*			trans	-54.9	136.2	-175.2	-66.4	166.2	-81.5	0	0	114.9	M752	M750-M752 PolarHBondContact O-N 3.04Å
751	I	24.7	Very low	24.6	Very low	154 Å²	154	160.2 Å²	160.2	79%	0.79	83%	0.825	S	S	*	*			trans	-78.9	98	167	-58.6	175.7	0	0	0	109.5	K753	I751-K753 HydrophobicContact CG2-CG 4.28Å
752	M	22.7	Very low	24.5	Very low	170 Å²	170	161.9 Å²	161.9	84%	0.837	82%	0.821	S	S	*	*			trans	-77.8	118.6	155.4	-82.4	-167.2	-75.8	0	0	109.2	M750 N754	M750-M752 PolarHBondContact O-N 3.04Å; M752-N754 PolarHBondContact O-N 2.82Å
753	K	27.2	Very low	24.5	Very low	190 Å²	190	161.4 Å²	161.4	83%	0.826	82%	0.823	S	S	*	*			trans	-78	105.4	169.1	-79.7	-172.5	173.8	-179.2	0	109.8	I751 F755	I751-K753 HydrophobicContact CG2-CG 4.28Å; K753-F755 PolarHBondContact O-N 3.1Å
754	N	24.6	Very low	24.3	Very low	155 Å²	155	160.7 Å²	160.7	83%	0.829	82%	0.815	S	S	*	*			trans	-60.9	127	168.1	-75.5	-34.6	0	0	0	110.5	M752	M752-N754 PolarHBondContact O-N 2.82Å
755	F	23.4	Very low	24.3	Very low	207 Å²	207	159.9 Å²	159.9	91%	0.908	82%	0.815	S	S	*	*			trans	-89.8	105.8	160.3	-98.2	-84	0	0	0	108.9	K753	K753-F755 PolarHBondContact O-N 3.1Å
756	Q	23.5	Very low	24.1	Very low	173 Å²	173	163.4 Å²	163.4	81%	0.808	82%	0.816	S	S	*	*			trans	-89.7	113.5	176.5	-168.7	172.3	8.3	0	0	109.8
757	Y	23.3	Very low	24	Very low	219 Å²	219	162.6 Å²	162.6	86%	0.859	81%	0.811	S	S	*	*			trans	-79.7	126.4	178.2	-131.9	-95.1	0	0	0	110.1
758	Q	23.5	Very low	23.9	Very low	178 Å²	178	160.6 Å²	160.6	83%	0.832	81%	0.807	S	S	*	*			trans	-119.8	129.8	161.1	-78.9	-163.9	-7.4	0	0	109.6
759	S	23.6	Very low	23.7	Very low	104 Å²	104	159.2 Å²	159.2	73%	0.727	80%	0.8	S	S	*	*			trans	-101.7	130.9	178.7	52.7	0	0	0	0	111
760	K	22.4	Very low	23.6	Very low	215 Å²	215	160.7 Å²	160.7	94%	0.935	80%	0.803	S	S	*	*			trans	-177.6	95.6	148.2	-104.5	163.2	-175.5	180	0	111
761	A	25.8	Very low	23.8	Very low	111 Å²	111	161.1 Å²	161.1	92%	0.917	81%	0.808	S	S	*	*			trans	-146.5	116.5	156.5	0	0	0	0	0	107.4
762	K	22.1	Very low	23.7	Very low	165 Å²	165	162.2 Å²	162.2	72%	0.717	81%	0.807	S	S	*	*			trans	-109.4	131.1	175.2	-178.7	180	-172.3	-82.9	0	106.6	D764	K762-D764 IonicContact NZ-OD1 2.74Å; K762-D764 PolarHBondContact NZ-OD1 2.84Å; K762-D764 IonicContact NZ-OD2 2.65Å; K762-D764 PolarHBondContact NZ-OD2 3.38Å
763	L	24.6	Very low	23.9	Very low	171 Å²	171	160.9 Å²	160.9	90%	0.895	80%	0.803	S	S	*	*			trans	-138	111.9	174.9	-167.7	68.1	0	0	0	108.8
764	D	23.7	Very low	23.7	Very low	116 Å²	116	160.7 Å²	160.7	62%	0.62	80%	0.802	S	S	*	*			trans	-88.6	158.6	179.6	-54.5	-69.5	0	0	0	110.7	K762	K762-D764 IonicContact NZ-OD1 2.74Å; K762-D764 PolarHBondContact NZ-OD1 2.84Å; K762-D764 IonicContact NZ-OD2 2.65Å; K762-D764 PolarHBondContact NZ-OD2 3.38Å
765	L	22.1	Very low	23.9	Very low	158 Å²	158	164.5 Å²	164.5	83%	0.827	81%	0.805	S	S	*	*			trans	-107.8	130.8	177.9	-78.6	162.7	0	0	0	110.5
766	Y	20.9	Very low	23.9	Very low	202 Å²	202	162.4 Å²	162.4	79%	0.792	80%	0.804	S	S	*	*				168.7	146.3	119.3	-103.7	-83.6	0	0	0	112.5
767	N	23.8	Very low	24	Very low	131 Å²	131	160.5 Å²	160.5	70%	0.701	80%	0.804	S	S	*	*			trans	7.8	151.2	156	-60.4	-0.5	0	0	0	121
768	N	22.8	Very low	24.2	Very low	138 Å²	138	156 Å²	156	74%	0.738	80%	0.799	S	S	*	*			cis	-161.8	172.5	25.6	-144.5	-9.8	0	0	0	115.6
769	S	24.2	Very low	24.3	Very low	90 Å²	90	154.6 Å²	154.6	63%	0.629	80%	0.796	S	S	*	*			trans	60.2	109.6	150.5	58.8	0	0	0	0	122.9
770	N	23	Very low	24.3	Very low	156 Å²	156	156.9 Å²	156.9	83%	0.834	80%	0.8	S	S	*	*			trans	54.9	106.8	132.1	-63	-13.8	0	0	0	122.4
771	L	27.3	Very low	24.4	Very low	181 Å²	181	151.9 Å²	151.9	95%	0.948	79%	0.792	S	S	*	*				-150.9	168.6	122.8	-119.5	142.9	0	0	0	110.5
772	K	22.8	Very low	24.4	Very low	177 Å²	177	154.3 Å²	154.3	77%	0.77	79%	0.788	S	S	*	*			trans	-101.7	169.9	-156.4	-64	-178	176.8	177	0	115.8
773	D	26.4	Very low	24.5	Very low	142 Å²	142	152.7 Å²	152.7	76%	0.759	79%	0.792	S	S	*	*			trans	97.3	149	144.2	-62.8	-38.9	0	0	0	121.3
774	K	25	Very low	24.5	Very low	185 Å²	185	151.9 Å²	151.9	80%	0.804	79%	0.789	S	S	*	*			trans	68.8	83.2	169.8	-62.6	173.2	-176	171.9	0	117.9
775	R	27.5	Very low	24.6	Very low	236 Å²	236	158.1 Å²	158.1	89%	0.891	80%	0.803	S	S	*	*				-177.5	129.7	101.4	-93.7	163.8	-170.9	103.6	-8.1	111.2
776	N	24.6	Very low	24.8	Very low	163 Å²	163	156.7 Å²	156.7	87%	0.872	80%	0.801	S	S	*	*			trans	-154	90.3	162.9	-140	4.8	0	0	0	111.7
777	T	25.6	Very low	25	Very low	132 Å²	132	154.3 Å²	154.3	81%	0.81	80%	0.801	S	S	*	*			trans	-163.5	136	168.5	16.3	0	0	0	0	104.8
778	T	26.8	Very low	25	Very low	124 Å²	124	155.2 Å²	155.2	76%	0.761	81%	0.806	S	S	*	*			cis	-138.5	138.3	23.9	-62	0	0	0	0	111.4
779	I	24.6	Very low	25.2	Very low	150 Å²	150	156.2 Å²	156.2	77%	0.769	81%	0.811	S	S	*	*			trans	-130.5	150.3	165	-63.7	179.1	0	0	0	107.3
780	N	24.3	Very low	25.4	Very low	152 Å²	152	157.7 Å²	157.7	81%	0.813	82%	0.822	S	S	*	*			trans	95.8	89.6	-179.1	-58.9	-25.9	0	0	0	116.8
781	S	24.4	Very low	25.5	Very low	110 Å²	110	158 Å²	158	77%	0.769	82%	0.82	S	S	*	*			trans	-155.4	149	143.2	62.8	0	0	0	0	111.1
782	I	27.2	Very low	25.4	Very low	162 Å²	162	156 Å²	156	83%	0.831	81%	0.81	S	S	*	*			trans	68.6	67.1	170.1	-37.3	179.5	0	0	0	116.5
783	T	24	Very low	25.7	Very low	131 Å²	131	154.4 Å²	154.4	80%	0.804	81%	0.81	S	S	*	*			trans	-124.4	145.7	130.6	43.7	0	0	0	0	108.7
784	N	24.3	Very low	25.7	Very low	153 Å²	153	153 Å²	153	82%	0.818	81%	0.807	S	S	*	*			trans	95.1	90.7	177.7	-57.3	-15.1	0	0	0	119
785	R	25.2	Very low	25.7	Very low	247 Å²	247	150.1 Å²	150.1	93%	0.932	81%	0.805	S	S	*	*			trans	178.7	127.4	141.7	-94.3	157.6	-170.5	-178.6	3.5	103.8
786	T	25.4	Very low	25.7	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	80%	0.798	S	S	*	*			cis	-138.4	152.8	35.1	-55.2	0	0	0	0	106.7
787	I	26.3	Very low	25.7	Very low	152 Å²	152	144.4 Å²	144.4	78%	0.779	79%	0.786	S	S	*	*				-145.1	129.7	62.6	-72	159.2	0	0	0	111.5
788	N	23.5	Very low	25.7	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	78%	0.781	S	S	*	*			trans	-82.1	126.9	154.3	-75.3	-8.1	0	0	0	108.1
789	N	26.8	Very low	25.6	Very low	160 Å²	160	145.4 Å²	145.4	86%	0.856	78%	0.782	S	S	*	*			trans	-167.5	153.2	139.8	-105.8	-18.4	0	0	0	112.2
790	S	28.5	Very low	25.6	Very low	121 Å²	121	144.2 Å²	144.2	85%	0.846	78%	0.782	S	S	*	*			trans	67.5	111.2	-178	-147.9	0	0	0	0	116.4
791	M	24.4	Very low	25.6	Very low	162 Å²	162	142.5 Å²	142.5	80%	0.798	78%	0.777	S	S	*	*			trans	-101	160.1	171.9	-122.9	77.6	170	0	0	110.1
792	N	25.3	Very low	25.7	Very low	138 Å²	138	144 Å²	144	74%	0.738	78%	0.777	S	S	*	*			trans	58	112.5	150.6	-56.1	-8.3	0	0	0	120.1
793	N	30.9	Very low	25.6	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	78%	0.778	S	S	*	*				176	102.3	117.1	-90.2	-4.7	0	0	0	109.5
794	T	25.1	Very low	25.6	Very low	112 Å²	112	146.9 Å²	146.9	69%	0.687	77%	0.774	S	S	*	*				89.4	123.8	83	51.4	0	0	0	0	115.8
795	T	24.7	Very low	25.6	Very low	124 Å²	124	149.7 Å²	149.7	76%	0.761	78%	0.775	S	S	*	*			trans	72.4	119.8	148.2	51.1	0	0	0	0	123.1
796	H	27.6	Very low	25.6	Very low	162 Å²	162	145.4 Å²	145.4	75%	0.75	77%	0.765	S	S	*	*			trans	90.3	118.7	138.7	-83.5	-53	0	0	0	123.9
797	N	25.1	Very low	25.8	Very low	117 Å²	117	144.1 Å²	144.1	63%	0.626	75%	0.75	S	S	*	*			trans	76.6	104.9	133.8	-68.5	4	0	0	0	122.2
798	N	25.1	Very low	25.8	Very low	131 Å²	131	143.4 Å²	143.4	70%	0.701	75%	0.748	S	S	*	*				73.3	116.7	121.1	-61.4	-3.8	0	0	0	121.2
799	N	24.3	Very low	26.3	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	73%	0.725	S	S	*	*			trans	87.7	151.7	140.4	-65.8	-12.9	0	0	0	120.8
800	T	24.7	Very low	26.8	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	71%	0.708	S	S	*	*			trans	70.5	110	165.2	35.1	0	0	0	0	120
801	T	25.8	Very low	27.5	Very low	117 Å²	117	136.8 Å²	136.8	72%	0.718	70%	0.695	S	S	*	*			trans	56.4	96.7	137.7	58	0	0	0	0	119.7
802	N	24.9	Very low	28.8	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	67%	0.669	S	S	*	*				179.5	121.1	99.1	-90.3	-31.7	0	0	0	112.4	H804	N802-H804 PolarHBondContact O-N 3.28Å
803	K	25.1	Very low	30.3	Very low	200 Å²	200	127.4 Å²	127.4	87%	0.87	65%	0.646	S	S	*	*			trans	-83.9	88.1	166	-78.8	-171.4	175.5	-177.3	0	109.8	Y805	K803-Y805 PolarHBondContact O-N 3.2Å
804	H	24.9	Very low	31.7	Very low	153 Å²	153	120.7 Å²	120.7	71%	0.708	61%	0.611	S	S	*	*			trans	-69.7	125.3	159.8	-96	59	0	0	0	109.1	N802 H806	N802-H804 PolarHBondContact O-N 3.28Å; H804-H806 PolarHBondContact O-N 3.34Å; H804-H806 VanDerWaalsContact O-N 3.14Å
805	Y	24.9	Very low	33.8	Very low	213 Å²	213	116.3 Å²	116.3	84%	0.835	58%	0.581	S	S	*	*			trans	-74.7	96.1	165.9	-79.5	-98.8	0	0	0	108.2	K803 Q807	K803-Y805 PolarHBondContact O-N 3.2Å; Y805-Q807 PolarHBondContact O-N 2.75Å
806	H	25.4	Very low	36.3	Very low	156 Å²	156	113.3 Å²	113.3	72%	0.722	56%	0.557	S	S	*	*			trans	-71.3	110.4	158.9	-85.7	-91.8	0	0	0	107.7	H804	H804-H806 PolarHBondContact O-N 3.34Å; H804-H806 VanDerWaalsContact O-N 3.14Å
807	Q	28.3	Very low	39.1	Very low	102 Å²	102	105.6 Å²	105.6	48%	0.477	52%	0.521	S	S	.	.			trans	-103.2	94.3	175.1	-169.9	165.3	-18.2	0	0	107.6	Y805 H809	Y805-Q807 PolarHBondContact O-N 2.75Å; Q807-H809 VanDerWaalsContact C-N 3.26Å; Q807-H809 PolarHBondContact NE2-NE2 3.41Å; Q807-H809 VanDerWaalsContact NE2-NE2 3.13Å; Q807-H809 PolarHBondContact O-N 2.84Å
808	D	25.6	Very low	42	Very low	136 Å²	136	100 Å²	100	73%	0.727	49%	0.491	S	S	*	.			trans	-70.9	80.3	-174.4	-63	-29.7	0	0	0	110.8
809	H	35.5	Very low	45	Very low	71 Å²	71	95.4 Å²	95.4	33%	0.329	47%	0.466	S	S	.	.			trans	-77.2	125.8	168.9	-75.9	-69	0	0	0	109.7	Q807 H811	Q807-H809 VanDerWaalsContact C-N 3.26Å; Q807-H809 PolarHBondContact NE2-NE2 3.41Å; Q807-H809 VanDerWaalsContact NE2-NE2 3.13Å; Q807-H809 PolarHBondContact O-N 2.84Å; H809-H811 PolarHBondContact O-N 2.97Å; H809-H811 VanDerWaalsContact O-N 3.16Å
810	I	36.8	Very low	48	Very low	98 Å²	98	88.4 Å²	88.4	50%	0.503	43%	0.429	S	S	.	.			trans	-63.8	117.2	-179.6	-69.6	170.4	0	0	0	109.9	N683 L812	N683-I810 HydrophobicContact CB-CD1 3.98Å; N683-I810 VanDerWaalsContact OD1-CD1 3.28Å; N683-I810 WeakPolarHBondContact OD1-CD1 3.38Å; I810-L812 PolarHBondContact O-N 3.38Å; I810-L812 VanDerWaalsContact O-N 3.14Å
811	H	43.2	Very low	50.8	Low	124 Å²	124	84.1 Å²	84.1	57%	0.574	40%	0.404	S	S	*	.			trans	-68.9	106.3	175.1	-59.9	-91.8	0	0	0	109.7	G598 H809 H813	G598-H811 PolarHBondContact O-CE1 2.8Å; G598-H811 VanDerWaalsContact O-CE1 3.22Å; G598-H811 PolarHBondContact O-ND1 3.39Å; H809-H811 PolarHBondContact O-N 2.97Å; H809-H811 VanDerWaalsContact O-N 3.16Å; H811-H813 PolarHBondContact O-N 2.93Å
812	L	51.3	Low	53.5	Low	49 Å²	49	79.4 Å²	79.4	26%	0.257	37%	0.374	S	S	.	.			trans	-64.8	134.6	161	-82.4	81.9	0	0	0	108.6	Y594 V680 I810 Y816 I818	Y594-L812 PolarHBondContact OH-O 3.19Å; Y594-L812 VanDerWaalsContact OH-O 3.08Å; V680-L812 HydrophobicContact CG1-CD1 4.17Å; V680-L812 HydrophobicContact CG1-CD2 4.21Å; V680-L812 HydrophobicContact CG2-CD2 4Å; I810-L812 PolarHBondContact O-N 3.38Å; I810-L812 VanDerWaalsContact O-N 3.14Å; L812-Y816 HydrophobicContact CB-CD2 4.32Å; L812-I818 HydrophobicContact CD2-CD1 4.06Å; L812-I818 HydrophobicContact CD2-CG1 4.38Å
813	H	58.1	Low	55.9	Low	53 Å²	53	76.1 Å²	76.1	25%	0.245	36%	0.361	C	S	.	.			trans	-59.4	146	173.7	-173.2	-116	0	0	0	109.8	H811 Y815 Y816	H811-H813 PolarHBondContact O-N 2.93Å; H813-Y815 AromaticContact CE1-CD2 3.6Å; H813-Y815 AromaticContact ND1-CD2 3.93Å; H813-Y815 PolarHBondContact O-N 2.77Å; H813-Y815 VanDerWaalsContact O-N 3.08Å; H813-Y816 HydrophobicContact CB-CD2 3.75Å; H813-Y816 HydrophobicContact CB-CE2 3.5Å; H813-Y816 VanDerWaalsContact CB-CE2 3.5Å; H813-Y816 WeakPolarHBondContact O-CD2 3.33Å; H813-Y816 PolarHBondContact O-N 2.77Å
814	P	60	Low	58.6	Low	5 Å²	5	68.1 Å²	68.1	3%	0.032	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-34.7	-162.8	-25.4	36.1	0	0	0	113.6	V593 Y594 V601 W603 Y816	V593-P814 HydrophobicContact CB-CG 4.46Å; V593-P814 HydrophobicContact CG1-CB 3.74Å; V593-P814 HydrophobicContact CG1-CG 3.63Å; Y594-P814 HydrophobicContact CE1-CG 4.23Å; Y594-P814 HydrophobicContact CE2-CG 3.76Å; Y594-P814 VanDerWaalsContact OH-CD 3.27Å; Y594-P814 WeakPolarHBondContact OH-CD 3.37Å; V601-P814 HydrophobicContact CB-CB 4.46Å; V601-P814 HydrophobicContact CG1-CB 3.75Å; V601-P814 HydrophobicContact CG2-CB 3.83Å; V601-P814 HydrophobicContact CG2-CG 4.39Å; W603-P814 WeakPolarHBondContact CH2-O 3.28Å; W603-P814 WeakPolarHBondContact CZ2-O 3.22Å; P814-Y816 PolarHBondContact O-N 2.96Å
815	Y	68.9	Low	61.4	Low	19 Å²	19	60.8 Å²	60.8	8%	0.075	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	18.5	-167.5	-47.4	-81.1	0	0	0	114	L587 V593 F671 F672 D673 H813	L587-Y815 HydrophobicContact CD2-CE1 4.17Å; L587-Y815 WeakPolarHBondContact CD2-OH 3.46Å; V593-Y815 WeakPolarHBondContact CG2-OH 3.47Å; F671-Y815 HydrophobicContact CD1-CD1 4.27Å; F671-Y815 AromaticContact CE1-CD1 3.71Å; F671-Y815 HydrophobicContact CE1-CD1 3.71Å; F671-Y815 HydrophobicContact CE1-CE1 4.06Å; F671-Y815 HydrophobicContact CZ-CD1 4.14Å; F671-Y815 HydrophobicContact CZ-CE1 4.02Å; F671-Y815 WeakPolarHBondContact O-CB 3.42Å; F672-Y815 VanDerWaalsContact CA-O 3.28Å; F672-Y815 WeakPolarHBondContact CA-O 3.49Å; D673-Y815 PolarHBondContact N-O 3.14Å; H813-Y815 AromaticContact CE1-CD2 3.6Å; H813-Y815 AromaticContact ND1-CD2 3.93Å; H813-Y815 PolarHBondContact O-N 2.77Å; H813-Y815 VanDerWaalsContact O-N 3.08Å
816	Y	77.1	Confident	63.8	Low	62 Å²	62	54 Å²	54	24%	0.243	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	124.7	172.5	-80.4	-57.8	0	0	0	111.9	D673 T675 L812 H813 P814	D673-Y816 HydrophobicContact CB-CD1 3.74Å; D673-Y816 HydrophobicContact CB-CE1 3.6Å; D673-Y816 VanDerWaalsContact CG-CE1 3.48Å; D673-Y816 WeakPolarHBondContact O-CA 3.26Å; D673-Y816 WeakPolarHBondContact OD2-CE1 3.47Å; T675-Y816 HydrophobicContact CG2-CD1 3.43Å; T675-Y816 VanDerWaalsContact CG2-CD1 3.43Å; T675-Y816 HydrophobicContact CG2-CE1 3.34Å; T675-Y816 HydrophobicContact CG2-CG 4.11Å; T675-Y816 WeakPolarHBondContact OG1-CD1 3.38Å; L812-Y816 HydrophobicContact CB-CD2 4.32Å; H813-Y816 HydrophobicContact CB-CD2 3.75Å; H813-Y816 HydrophobicContact CB-CE2 3.5Å; H813-Y816 VanDerWaalsContact CB-CE2 3.5Å; H813-Y816 WeakPolarHBondContact O-CD2 3.33Å; H813-Y816 PolarHBondContact O-N 2.77Å; P814-Y816 PolarHBondContact O-N 2.96Å
817	I	86.1	Confident	66.2	Low	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125	155.8	-69.5	174.8	0	0	0	107.3	Q616 F672 D673 T675 I819 L844 Q846 I871	Q616-I817 HydrophobicContact CB-CD1 4.43Å; Q616-I817 HydrophobicContact CG-CD1 4.14Å; F672-I817 HydrophobicContact CB-CD1 3.63Å; F672-I817 HydrophobicContact CB-CG1 3.92Å; F672-I817 HydrophobicContact CD1-CD1 3.77Å; F672-I817 HydrophobicContact CD1-CG1 3.72Å; F672-I817 HydrophobicContact CD2-CD1 3.88Å; F672-I817 HydrophobicContact CE1-CD1 4.37Å; F672-I817 HydrophobicContact CE1-CG1 4.4Å; F672-I817 HydrophobicContact CE2-CD1 4.47Å; F672-I817 HydrophobicContact CG-CD1 3.49Å; F672-I817 VanDerWaalsContact CG-CD1 3.49Å; F672-I817 HydrophobicContact CG-CG1 3.89Å; D673-I817 PolarHBondContact O-N 3.4Å; T675-I817 PolarHBondContact N-O 3.31Å; T675-I817 VanDerWaalsContact N-O 3.11Å; I817-I819 HydrophobicContact CG2-CG1 4.47Å; I817-L844 HydrophobicContact CG1-CB 4.05Å; I817-L844 HydrophobicContact CG1-CD1 4.3Å; I817-Q846 HydrophobicContact CG2-CB 3.68Å; I817-I871 HydrophobicContact CD1-CD1 4.35Å
818	I	87	Confident	68.4	Low	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.4	176.4	-56.3	175.3	0	0	0	107.7	Y677 L812 L839 L844 I845 Q846	Y677-I818 HydrophobicContact CD2-CG2 4.19Å; L812-I818 HydrophobicContact CD2-CD1 4.06Å; L812-I818 HydrophobicContact CD2-CG1 4.38Å; I818-L839 HydrophobicContact CD1-CD1 3.96Å; I818-L839 HydrophobicContact CD1-CD2 3.94Å; I818-L839 HydrophobicContact CD1-CG 4.14Å; I818-L844 PolarHBondContact N-O 3.06Å; I818-I845 HydrophobicContact CB-CG1 4.44Å; I818-I845 WeakPolarHBondContact O-CA 3.49Å; I818-Q846 PolarHBondContact O-N 3.35Å
819	I	87.4	Confident	70.7	Confident	33 Å²	33	44 Å²	44	17%	0.169	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134	174.9	-60.1	-168.7	0	0	0	110.1	T674 T675 Y677 I817 Q846	T674-I819 HydrophobicContact CG2-CD1 3.39Å; T674-I819 HydrophobicContact CG2-CG1 3.94Å; T675-I819 PolarHBondContact O-N 3.46Å; Y677-I819 PolarHBondContact N-O 2.8Å; Y677-I819 VanDerWaalsContact N-O 3.1Å; I817-I819 HydrophobicContact CG2-CG1 4.47Å; I819-Q846 HydrophobicContact CG1-CB 4.28Å; I819-Q846 HydrophobicContact CG1-CG 4.5Å
820	M	87	Confident	72.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.5	173.2	-69.6	169	65.5	0	0	109.7	Y677 A825 A828 L836 I845 Q846 I847 C848 W867	Y677-M820 VanDerWaalsContact CB-CG 3.49Å; Y677-M820 HydrophobicContact CD2-CE 4.21Å; Y677-M820 HydrophobicContact CD2-CG 3.92Å; Y677-M820 HydrophobicContact CD2-SD 3.65Å; Y677-M820 HydrophobicContact CE2-CE 4.35Å; Y677-M820 HydrophobicContact CE2-SD 4.17Å; Y677-M820 HydrophobicContact CG-CE 4.45Å; Y677-M820 HydrophobicContact CG-CG 3.81Å; Y677-M820 HydrophobicContact CG-SD 4.12Å; M820-A825 HydrophobicContact CE-CB 4.11Å; M820-A828 HydrophobicContact CE-CB 3.97Å; M820-L836 HydrophobicContact CE-CD1 4.17Å; M820-L836 HydrophobicContact SD-CD1 4.33Å; M820-I845 HydrophobicContact CG-CG2 4.25Å; M820-I845 HydrophobicContact SD-CD1 4.38Å; M820-I845 HydrophobicContact SD-CG2 3.53Å; M820-I845 VanDerWaalsContact SD-CG2 3.53Å; M820-Q846 PolarHBondContact N-O 3.05Å; M820-I847 HydrophobicContact CB-CG1 4.47Å; M820-I847 VanDerWaalsContact O-CA 3.31Å; M820-I847 WeakPolarHBondContact O-CA 3.29Å; M820-C848 PolarHBondContact O-N 3.36Å; M820-W867 HydrophobicContact CE-CH2 4.46Å
821	S	84	Confident	73.8	Confident	34 Å²	34	44.9 Å²	44.9	24%	0.238	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	157.4	164.5	68.2	0	0	0	0	111.2	S823 E824 A825	S821-S823 PolarHBondContact O-N 3.03Å; S821-E824 WeakPolarHBondContact CA-OE2 3.31Å; S821-E824 WeakPolarHBondContact CB-OE2 3.43Å; S821-E824 PolarHBondContact N-OE2 2.83Å; S821-E824 PolarHBondContact O-N 2.94Å; S821-E824 PolarHBondContact OG-N 3.46Å; S821-E824 PolarHBondContact OG-OE2 2.98Å; S821-A825 WeakPolarHBondContact O-CB 3.47Å; S821-A825 PolarHBondContact O-N 3.11Å
822	E	81	Confident	74.9	Confident	19 Å²	19	40 Å²	40	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-46.3	-33.6	169.5	-176.5	-179.9	-175.2	0	0	113.5	S826 C848 S850 R853 L859 R1335	E822-S826 WeakPolarHBondContact O-CB 3.24Å; E822-S826 PolarHBondContact O-N 3.16Å; E822-S826 PolarHBondContact O-OG 2.88Å; E822-C848 PolarHBondContact N-O 3.17Å; E822-S850 WeakPolarHBondContact OE2-CB 3.37Å; E822-S850 PolarHBondContact OE2-N 3.27Å; E822-R853 IonicContact OE1-CZ 3.38Å; E822-R853 IonicContact OE1-NE 2.97Å; E822-R853 PolarHBondContact OE1-NE 3.13Å; E822-R853 IonicContact OE1-NH2 3.19Å; E822-R853 PolarHBondContact OE1-NH2 3.08Å; E822-R853 WeakPolarHBondContact OE2-CD 3.37Å; E822-R853 IonicContact OE2-CZ 2.7Å; E822-R853 IonicContact OE2-NE 2.72Å; E822-R853 PolarHBondContact OE2-NE 3.23Å; E822-R853 IonicContact OE2-NH2 3.17Å; E822-L859 HydrophobicContact CB-CD1 4.46Å; E822-L859 HydrophobicContact CG-CB 4.29Å; E822-L859 HydrophobicContact CG-CD1 4.24Å; E822-R1335 IonicContact OE1-NH1 2.8Å
823	S	76.2	Confident	75.8	Confident	71 Å²	71	39.4 Å²	39.4	50%	0.497	24%	0.237	S	C	.	.	H	α-helix	trans	-79.5	-35.5	179.2	-66	0	0	0	0	113.6	S821 R827	S821-S823 PolarHBondContact O-N 3.03Å; S823-R827 WeakPolarHBondContact O-CB 3.43Å; S823-R827 PolarHBondContact O-N 2.96Å; S823-R827 VanDerWaalsContact O-N 3.12Å
824	E	82.8	Confident	76.2	Confident	32 Å²	32	38.2 Å²	38.2	15%	0.15	24%	0.239	C	C	.	.	H	α-helix	trans	-72.1	-38.9	173.2	-70.4	153.6	128.2	0	0	111.1	E678 S821 R827 A828	E678-E824 WeakPolarHBondContact CG-OE1 2.97Å; S821-E824 WeakPolarHBondContact CA-OE2 3.31Å; S821-E824 WeakPolarHBondContact CB-OE2 3.43Å; S821-E824 PolarHBondContact N-OE2 2.83Å; S821-E824 PolarHBondContact O-N 2.94Å; S821-E824 PolarHBondContact OG-N 3.46Å; S821-E824 PolarHBondContact OG-OE2 2.98Å; E824-R827 WeakPolarHBondContact O-CB 3.32Å; E824-R827 PolarHBondContact O-N 3.09Å; E824-A828 WeakPolarHBondContact O-CB 3.33Å; E824-A828 PolarHBondContact O-N 3.4Å
825	A	82.6	Confident	76.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.3	-53.5	171.8	0	0	0	0	0	111.5	M820 S821 R827 A828 I829 I847 I864	M820-A825 HydrophobicContact CE-CB 4.11Å; S821-A825 WeakPolarHBondContact O-CB 3.47Å; S821-A825 PolarHBondContact O-N 3.11Å; A825-R827 PolarHBondContact O-N 2.92Å; A825-A828 PolarHBondContact O-N 2.86Å; A825-I829 VanDerWaalsContact O-CD1 3.28Å; A825-I829 WeakPolarHBondContact O-CD1 3.39Å; A825-I829 WeakPolarHBondContact O-CG1 3.32Å; A825-I829 PolarHBondContact O-N 2.82Å; A825-I847 HydrophobicContact CB-CD1 3.79Å; A825-I847 HydrophobicContact CB-CG2 4.11Å; A825-I864 HydrophobicContact CB-CD1 4.29Å
826	S	75.1	Confident	77.2	Confident	70 Å²	70	42.5 Å²	42.5	49%	0.49	26%	0.263	S	S	.	.	H	α-helix	trans	-55.4	-36.6	176.3	-59.5	0	0	0	0	112.5	E822 G830	E822-S826 WeakPolarHBondContact O-CB 3.24Å; E822-S826 PolarHBondContact O-N 3.16Å; E822-S826 PolarHBondContact O-OG 2.88Å; S826-G830 PolarHBondContact O-N 2.86Å
827	R	77.3	Confident	77.3	Confident	123 Å²	123	39.8 Å²	39.8	46%	0.464	25%	0.253	S	S	.	.	H	α-helix	trans	-70.5	-49.6	177.2	-172.3	168.5	76.5	-127.4	17.6	112	E678 S823 E824 A825 G830 T831	E678-R827 IonicContact OE1-CZ 3.39Å; E678-R827 IonicContact OE1-NH2 2.63Å; E678-R827 PolarHBondContact OE1-NH2 3.37Å; S823-R827 WeakPolarHBondContact O-CB 3.43Å; S823-R827 PolarHBondContact O-N 2.96Å; S823-R827 VanDerWaalsContact O-N 3.12Å; E824-R827 WeakPolarHBondContact O-CB 3.32Å; E824-R827 PolarHBondContact O-N 3.09Å; A825-R827 PolarHBondContact O-N 2.92Å; R827-G830 PolarHBondContact O-N 2.81Å; R827-G830 VanDerWaalsContact O-N 3.16Å; R827-T831 PolarHBondContact O-N 2.81Å; R827-T831 VanDerWaalsContact O-N 3.11Å; R827-T831 PolarHBondContact O-OG1 2.99Å
828	A	74.5	Confident	76.9	Confident	5 Å²	5	44.4 Å²	44.4	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-41.3	-178.1	0	0	0	0	0	112.6	Y677 M820 E824 A825 G830 T831 G832 L836	Y677-A828 HydrophobicContact CE1-CB 4.49Å; M820-A828 HydrophobicContact CE-CB 3.97Å; E824-A828 WeakPolarHBondContact O-CB 3.33Å; E824-A828 PolarHBondContact O-N 3.4Å; A825-A828 PolarHBondContact O-N 2.86Å; A828-G830 VanDerWaalsContact C-N 3.3Å; A828-G830 PolarHBondContact O-N 3.16Å; A828-T831 PolarHBondContact O-N 3.37Å; A828-T831 PolarHBondContact O-OG1 3.26Å; A828-G832 CarbonylContact O-C 3.53Å; A828-G832 PolarHBondContact O-N 3.01Å; A828-L836 HydrophobicContact CB-CD1 4.49Å; A828-L836 HydrophobicContact CB-CD2 3.99Å
829	I	73	Confident	76.6	Confident	57 Å²	57	46.4 Å²	46.4	29%	0.292	29%	0.285	S	S	.	.	H	α-helix	trans	-57.7	-45.3	172.8	-62.5	159.2	0	0	0	110.2	A825 T831 L836 I864 W867	A825-I829 VanDerWaalsContact O-CD1 3.28Å; A825-I829 WeakPolarHBondContact O-CD1 3.39Å; A825-I829 WeakPolarHBondContact O-CG1 3.32Å; A825-I829 PolarHBondContact O-N 2.82Å; I829-T831 VanDerWaalsContact C-N 3.31Å; I829-T831 PolarHBondContact O-N 2.86Å; I829-L836 HydrophobicContact CG1-CD2 4.03Å; I829-I864 HydrophobicContact CD1-CD1 4.3Å; I829-W867 HydrophobicContact CD1-CZ2 4.22Å; I829-W867 HydrophobicContact CG1-CG 4.45Å; I829-W867 HydrophobicContact CG1-CZ2 4.27Å; I829-W867 VanDerWaalsContact CG1-NE1 3.34Å
830	G	66.6	Low	76.5	Confident	67 Å²	67	44.8 Å²	44.8	69%	0.691	28%	0.277	S	S	*	.	H	α-helix	trans	-69.4	-20.8	-179.7	0	0	0	0	0	115.3	S826 R827 A828	S826-G830 PolarHBondContact O-N 2.86Å; R827-G830 PolarHBondContact O-N 2.81Å; R827-G830 VanDerWaalsContact O-N 3.16Å; A828-G830 VanDerWaalsContact C-N 3.3Å; A828-G830 PolarHBondContact O-N 3.16Å
831	T	71	Confident	76.2	Confident	119 Å²	119	45.6 Å²	45.6	73%	0.73	28%	0.279	S	S	*	.	H	α-helix	trans	-105.8	-29.2	-178.7	55	0	0	0	0	114.9	R827 A828 I829	R827-T831 PolarHBondContact O-N 2.81Å; R827-T831 VanDerWaalsContact O-N 3.11Å; R827-T831 PolarHBondContact O-OG1 2.99Å; A828-T831 PolarHBondContact O-N 3.37Å; A828-T831 PolarHBondContact O-OG1 3.26Å; I829-T831 VanDerWaalsContact C-N 3.31Å; I829-T831 PolarHBondContact O-N 2.86Å
832	G	66.8	Low	75.9	Confident	21 Å²	21	45.8 Å²	45.8	22%	0.216	28%	0.278	C	S	.	.	H	α-helix	trans	-165.3	44.4	-164.5	0	0	0	0	0	114.9	A828 G834 D835 L836	A828-G832 CarbonylContact O-C 3.53Å; A828-G832 PolarHBondContact O-N 3.01Å; G832-G834 PolarHBondContact O-N 2.83Å; G832-G834 VanDerWaalsContact O-N 3.09Å; G832-D835 PolarHBondContact O-N 3.21Å; G832-L836 PolarHBondContact O-N 3.23Å; G832-L836 VanDerWaalsContact O-N 3.17Å
833	A	68.8	Low	76	Confident	38 Å²	38	45.9 Å²	45.9	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-52.4	-32.1	-178.2	0	0	0	0	0	114.7	L836 V837	A833-L836 PolarHBondContact O-N 3.38Å; A833-V837 WeakPolarHBondContact O-CG2 3.36Å; A833-V837 PolarHBondContact O-N 2.85Å
834	G	67.4	Low	76.6	Confident	28 Å²	28	42.5 Å²	42.5	29%	0.289	26%	0.257	S	S	.	.	H	α-helix	trans	-66.6	-45.3	178.6	0	0	0	0	0	113.7	G832 L836 V837 Q838	G832-G834 PolarHBondContact O-N 2.83Å; G832-G834 VanDerWaalsContact O-N 3.09Å; G834-L836 VanDerWaalsContact C-N 3.29Å; G834-L836 PolarHBondContact O-N 2.89Å; G834-V837 PolarHBondContact O-N 3.02Å; G834-Q838 PolarHBondContact O-N 3.11Å
835	D	72.5	Confident	77	Confident	107 Å²	107	41 Å²	41	57%	0.572	25%	0.25	S	S	*	.	H	α-helix	trans	-66.8	-36.5	176.6	-54.5	-48.4	0	0	0	110.6	G832 Q838 L839	G832-D835 PolarHBondContact O-N 3.21Å; D835-Q838 WeakPolarHBondContact O-CB 3.37Å; D835-Q838 PolarHBondContact O-N 2.68Å; D835-L839 PolarHBondContact O-N 2.85Å
836	L	77.7	Confident	77.5	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-39.5	176.8	-169	65.7	0	0	0	112.3	Y677 M820 A828 I829 G832 A833 G834 Q838 L839 T840 I845 W867	Y677-L836 HydrophobicContact CE2-CD1 4.43Å; M820-L836 HydrophobicContact CE-CD1 4.17Å; M820-L836 HydrophobicContact SD-CD1 4.33Å; A828-L836 HydrophobicContact CB-CD1 4.49Å; A828-L836 HydrophobicContact CB-CD2 3.99Å; I829-L836 HydrophobicContact CG1-CD2 4.03Å; G832-L836 PolarHBondContact O-N 3.23Å; G832-L836 VanDerWaalsContact O-N 3.17Å; A833-L836 PolarHBondContact O-N 3.38Å; G834-L836 VanDerWaalsContact C-N 3.29Å; G834-L836 PolarHBondContact O-N 2.89Å; L836-Q838 VanDerWaalsContact C-N 3.33Å; L836-Q838 PolarHBondContact O-N 3.04Å; L836-L839 HydrophobicContact CD1-CD2 4.46Å; L836-L839 PolarHBondContact O-N 2.78Å; L836-T840 WeakPolarHBondContact O-CG2 3.47Å; L836-T840 PolarHBondContact O-N 2.82Å; L836-I845 HydrophobicContact CD1-CD1 4.2Å; L836-W867 HydrophobicContact CD1-CE3 4.39Å; L836-W867 HydrophobicContact CD1-CH2 4.18Å; L836-W867 HydrophobicContact CD1-CZ3 3.82Å; L836-W867 HydrophobicContact CD2-CD2 3.73Å; L836-W867 HydrophobicContact CD2-CE3 3.58Å; L836-W867 HydrophobicContact CD2-CG 4.46Å; L836-W867 HydrophobicContact CD2-CH2 3.67Å; L836-W867 HydrophobicContact CD2-CZ2 3.84Å; L836-W867 HydrophobicContact CD2-CZ3 3.56Å; L836-W867 HydrophobicContact CG-CD2 4.15Å; L836-W867 HydrophobicContact CG-CE3 3.49Å; L836-W867 VanDerWaalsContact CG-CE3 3.49Å; L836-W867 HydrophobicContact CG-CH2 3.98Å; L836-W867 HydrophobicContact CG-CZ3 3.41Å; L836-W867 VanDerWaalsContact CG-CZ3 3.41Å
837	V	79.4	Confident	78.3	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-47.5	169.3	165.6	0	0	0	0	110.5	A833 G834 L839 T840 R841 W867 Y905	A833-V837 WeakPolarHBondContact O-CG2 3.36Å; A833-V837 PolarHBondContact O-N 2.85Å; G834-V837 PolarHBondContact O-N 3.02Å; V837-L839 VanDerWaalsContact C-N 3.31Å; V837-L839 PolarHBondContact O-N 3.47Å; V837-T840 PolarHBondContact O-N 2.83Å; V837-T840 PolarHBondContact O-OG1 2.96Å; V837-R841 PolarHBondContact O-N 2.71Å; V837-W867 HydrophobicContact CG2-CB 3.8Å; V837-W867 WeakPolarHBondContact CG2-O 3.19Å; V837-Y905 HydrophobicContact CG1-CD1 4.08Å; V837-Y905 HydrophobicContact CG2-CD1 4.3Å; V837-Y905 HydrophobicContact CG2-CE1 4.4Å
838	Q	76.6	Confident	78.7	Confident	97 Å²	97	33.3 Å²	33.3	45%	0.453	21%	0.214	S	C	.	.	H	α-helix	trans	-62.5	-37.2	178.9	-177.4	170.4	-28.8	0	0	112.2	G834 D835 L836 R841	G834-Q838 PolarHBondContact O-N 3.11Å; D835-Q838 WeakPolarHBondContact O-CB 3.37Å; D835-Q838 PolarHBondContact O-N 2.68Å; L836-Q838 VanDerWaalsContact C-N 3.33Å; L836-Q838 PolarHBondContact O-N 3.04Å; Q838-R841 WeakPolarHBondContact O-CB 3.41Å; Q838-R841 PolarHBondContact O-N 3.46Å
839	L	80.4	Confident	79	Confident	42 Å²	42	33.3 Å²	33.3	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-46.5	175.5	-171.5	62.8	0	0	0	112.1	Y677 I818 D835 L836 V837 R841 N842 S843 I845	Y677-L839 HydrophobicContact CE2-CD2 4.42Å; I818-L839 HydrophobicContact CD1-CD1 3.96Å; I818-L839 HydrophobicContact CD1-CD2 3.94Å; I818-L839 HydrophobicContact CD1-CG 4.14Å; D835-L839 PolarHBondContact O-N 2.85Å; L836-L839 HydrophobicContact CD1-CD2 4.46Å; L836-L839 PolarHBondContact O-N 2.78Å; V837-L839 VanDerWaalsContact C-N 3.31Å; V837-L839 PolarHBondContact O-N 3.47Å; L839-R841 PolarHBondContact O-N 3.08Å; L839-R841 VanDerWaalsContact O-N 3.1Å; L839-N842 PolarHBondContact O-N 2.77Å; L839-S843 PolarHBondContact O-N 3.26Å; L839-I845 HydrophobicContact CB-CD1 4.38Å; L839-I845 HydrophobicContact CD2-CD1 3.78Å; L839-I845 HydrophobicContact CG-CD1 3.91Å
840	T	86	Confident	79.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-12.4	179	70.2	0	0	0	0	114.6	L836 V837 I845 W867 G868 Q870 K901	L836-T840 WeakPolarHBondContact O-CG2 3.47Å; L836-T840 PolarHBondContact O-N 2.82Å; V837-T840 PolarHBondContact O-N 2.83Å; V837-T840 PolarHBondContact O-OG1 2.96Å; T840-I845 HydrophobicContact CG2-CD1 3.68Å; T840-I845 HydrophobicContact CG2-CG1 4.19Å; T840-W867 HydrophobicContact CG2-CE3 3.54Å; T840-W867 HydrophobicContact CG2-CZ3 3.35Å; T840-W867 PolarHBondContact OG1-O 2.81Å; T840-G868 VanDerWaalsContact CB-O 3.31Å; T840-G868 WeakPolarHBondContact CB-O 3.26Å; T840-G868 PolarHBondContact OG1-O 3.17Å; T840-Q870 PolarHBondContact O-NE2 3.2Å; T840-K901 PolarHBondContact O-NZ 2.89Å
841	R	80.8	Confident	79.3	Confident	16 Å²	16	33.7 Å²	33.7	6%	0.06	21%	0.208	C	C	.	.	H	α-helix	trans	-76.9	-38.2	176.8	-170	170.7	169	-138.9	-2.6	111.5	T431 V837 Q838 L839 R906 Q907 Y908	T431-R841 VanDerWaalsContact CB-O 3.27Å; T431-R841 WeakPolarHBondContact CB-O 3.31Å; T431-R841 PolarHBondContact OG1-O 3.06Å; V837-R841 PolarHBondContact O-N 2.71Å; Q838-R841 WeakPolarHBondContact O-CB 3.41Å; Q838-R841 PolarHBondContact O-N 3.46Å; L839-R841 PolarHBondContact O-N 3.08Å; L839-R841 VanDerWaalsContact O-N 3.1Å; R841-R906 PolarHBondContact NE-O 3.19Å; R841-R906 PolarHBondContact NH2-O 3.28Å; R841-Q907 PolarHBondContact NH1-O 2.97Å; R841-Y908 VanDerWaalsContact NH1-CE2 3.33Å
842	N	76.9	Confident	79.1	Confident	38 Å²	38	30.2 Å²	30.2	20%	0.203	19%	0.189	C	C	.	.	H	α-helix	trans	-106.5	-20	-171	-59.9	-15.9	0	0	0	113.4	F600 W603 L839	F600-N842 WeakPolarHBondContact CD1-ND2 3.3Å; W603-N842 PolarHBondContact NE1-O 3.5Å; L839-N842 PolarHBondContact O-N 2.77Å
843	S	83.8	Confident	79.3	Confident	22 Å²	22	30 Å²	30	15%	0.154	18%	0.182	C	C	.	.	S	Bend	trans	-125.3	152.8	179.7	-57.4	0	0	0	0	111.4	L839 Q870	L839-S843 PolarHBondContact O-N 3.26Å; S843-Q870 PolarHBondContact O-NE2 3.37Å
844	L	89.2	Confident	79.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.2	168.8	-71.4	176.3	0	0	0	109.7	I430 T431 I435 W603 F672 I817 I818 Q870	I430-L844 HydrophobicContact CG2-CD1 4.38Å; T431-L844 HydrophobicContact CG2-CD2 4.01Å; T431-L844 HydrophobicContact CG2-CG 4.02Å; I435-L844 HydrophobicContact CD1-CD2 4.46Å; W603-L844 HydrophobicContact CH2-CD1 4.38Å; F672-L844 HydrophobicContact CD1-CD1 4.4Å; F672-L844 HydrophobicContact CE1-CD1 3.6Å; F672-L844 HydrophobicContact CZ-CD1 3.91Å; I817-L844 HydrophobicContact CG1-CB 4.05Å; I817-L844 HydrophobicContact CG1-CD1 4.3Å; I818-L844 PolarHBondContact N-O 3.06Å; L844-Q870 HydrophobicContact CD2-CB 4.18Å; L844-Q870 HydrophobicContact CD2-CG 4.01Å
845	I	90.8	Very high	79.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127	174.2	-53.4	-168.2	0	0	0	109.4	I818 M820 L836 L839 T840 I847 W867 I871	I818-I845 HydrophobicContact CB-CG1 4.44Å; I818-I845 WeakPolarHBondContact O-CA 3.49Å; M820-I845 HydrophobicContact CG-CG2 4.25Å; M820-I845 HydrophobicContact SD-CD1 4.38Å; M820-I845 HydrophobicContact SD-CG2 3.53Å; M820-I845 VanDerWaalsContact SD-CG2 3.53Å; L836-I845 HydrophobicContact CD1-CD1 4.2Å; L839-I845 HydrophobicContact CB-CD1 4.38Å; L839-I845 HydrophobicContact CD2-CD1 3.78Å; L839-I845 HydrophobicContact CG-CD1 3.91Å; T840-I845 HydrophobicContact CG2-CD1 3.68Å; T840-I845 HydrophobicContact CG2-CG1 4.19Å; I845-I847 HydrophobicContact CG2-CG1 4.22Å; I845-W867 HydrophobicContact CD1-CZ3 4.25Å; I845-I871 PolarHBondContact O-N 3.39Å; I845-I871 VanDerWaalsContact O-N 3.16Å
846	Q	93.2	Very high	79.7	Confident	5 Å²	5	24.8 Å²	24.8	2%	0.023	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.1	172	174.2	-176	-4.1	0	0	109.7	Y467 E469 I817 I818 I819 M820 C848 I871 T873	Y467-Q846 PolarHBondContact OH-NE2 3.41Å; Y467-Q846 PolarHBondContact OH-OE1 2.81Å; E469-Q846 PolarHBondContact OE1-NE2 2.97Å; I817-Q846 HydrophobicContact CG2-CB 3.68Å; I818-Q846 PolarHBondContact O-N 3.35Å; I819-Q846 HydrophobicContact CG1-CB 4.28Å; I819-Q846 HydrophobicContact CG1-CG 4.5Å; M820-Q846 PolarHBondContact N-O 3.05Å; Q846-C848 PolarHBondContact NE2-SG 3.17Å; Q846-C848 VanDerWaalsContact NE2-SG 3.39Å; Q846-I871 CarbonylContact C-O 3.55Å; Q846-I871 WeakPolarHBondContact CA-O 3.34Å; Q846-I871 HydrophobicContact CB-CB 4.28Å; Q846-I871 HydrophobicContact CB-CG2 4.06Å; Q846-I871 HydrophobicContact CG-CG2 3.94Å; Q846-T873 HydrophobicContact CG-CG2 4.15Å
847	I	91.6	Very high	79.7	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.3	174.5	-49.2	-162.3	0	0	0	110.3	M820 A825 I845 L859 I864 W867 I871 T873	M820-I847 HydrophobicContact CB-CG1 4.47Å; M820-I847 VanDerWaalsContact O-CA 3.31Å; M820-I847 WeakPolarHBondContact O-CA 3.29Å; A825-I847 HydrophobicContact CB-CD1 3.79Å; A825-I847 HydrophobicContact CB-CG2 4.11Å; I845-I847 HydrophobicContact CG2-CG1 4.22Å; I847-L859 HydrophobicContact CG2-CD1 3.98Å; I847-I864 HydrophobicContact CD1-CB 4.34Å; I847-I864 HydrophobicContact CD1-CD1 3.86Å; I847-I864 HydrophobicContact CD1-CG1 4.09Å; I847-I864 HydrophobicContact CD1-CG2 3.36Å; I847-I864 HydrophobicContact CG1-CG2 4.16Å; I847-W867 HydrophobicContact CD1-CH2 3.51Å; I847-W867 HydrophobicContact CD1-CZ2 3.44Å; I847-W867 VanDerWaalsContact CD1-CZ2 3.44Å; I847-I871 PolarHBondContact N-O 2.6Å; I847-T873 PolarHBondContact O-N 3Å; I847-T873 VanDerWaalsContact O-N 3.08Å; I847-T873 PolarHBondContact O-OG1 3.46Å
848	C	85.2	Confident	80	Confident	26 Å²	26	26 Å²	26	18%	0.176	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.8	-178.5	-56.8	0	0	0	0	111.2	M820 E822 Q846	M820-C848 PolarHBondContact O-N 3.36Å; E822-C848 PolarHBondContact N-O 3.17Å; Q846-C848 PolarHBondContact NE2-SG 3.17Å; Q846-C848 VanDerWaalsContact NE2-SG 3.39Å
849	P	82.5	Confident	80.4	Confident	6 Å²	6	21.6 Å²	21.6	4%	0.039	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-53.8	144.3	169.8	-24.4	33	0	0	0	112.3	H439 L859 T873	H439-P849 HydrophobicContact CB-CG 4.21Å; P849-L859 HydrophobicContact CB-CD2 4.35Å; P849-L859 HydrophobicContact CG-CD2 3.89Å; P849-T873 WeakPolarHBondContact CD-O 3.3Å; P849-T873 WeakPolarHBondContact CD-OG1 3.31Å; P849-T873 WeakPolarHBondContact CG-O 3.46Å
850	S	75.3	Confident	80.7	Confident	22 Å²	22	20.2 Å²	20.2	15%	0.154	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-59.1	133.7	173.6	174.7	0	0	0	0	111.9	E822 S852 R853	E822-S850 WeakPolarHBondContact OE2-CB 3.37Å; E822-S850 PolarHBondContact OE2-N 3.27Å; S850-S852 WeakPolarHBondContact CB-OG 3.23Å; S850-S852 PolarHBondContact O-N 3.01Å; S850-S852 PolarHBondContact OG-N 3.29Å; S850-S852 PolarHBondContact OG-OG 2.79Å; S850-R853 VanDerWaalsContact O-CB 3.3Å; S850-R853 WeakPolarHBondContact O-CB 3.41Å; S850-R853 WeakPolarHBondContact O-CG 3.33Å; S850-R853 PolarHBondContact O-N 3.23Å
851	P	69.9	Low	81	Confident	109 Å²	109	20.2 Å²	20.2	71%	0.708	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-5	170.7	-26.1	35.6	0	0	0	115.5
852	S	65.7	Low	81.4	Confident	46 Å²	46	19.6 Å²	19.6	32%	0.322	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-19.1	166.7	62.2	0	0	0	0	113.6	S850 A854 Q1339	S850-S852 WeakPolarHBondContact CB-OG 3.23Å; S850-S852 PolarHBondContact O-N 3.01Å; S850-S852 PolarHBondContact OG-N 3.29Å; S850-S852 PolarHBondContact OG-OG 2.79Å; S852-A854 PolarHBondContact O-N 2.75Å; S852-Q1339 PolarHBondContact OG-OE1 3.19Å
853	R	72.5	Confident	81.8	Confident	17 Å²	17	20.3 Å²	20.3	6%	0.064	13%	0.125	C	C	.	.			trans	-83	56.6	-177	-62.9	170.6	165.2	-86.5	16	111.9	Q447 E822 S850 D855 S856 S857 N858	Q447-R853 WeakPolarHBondContact CG-O 3.41Å; E822-R853 IonicContact OE1-CZ 3.38Å; E822-R853 IonicContact OE1-NE 2.97Å; E822-R853 PolarHBondContact OE1-NE 3.13Å; E822-R853 IonicContact OE1-NH2 3.19Å; E822-R853 PolarHBondContact OE1-NH2 3.08Å; E822-R853 WeakPolarHBondContact OE2-CD 3.37Å; E822-R853 IonicContact OE2-CZ 2.7Å; E822-R853 IonicContact OE2-NE 2.72Å; E822-R853 PolarHBondContact OE2-NE 3.23Å; E822-R853 IonicContact OE2-NH2 3.17Å; S850-R853 VanDerWaalsContact O-CB 3.3Å; S850-R853 WeakPolarHBondContact O-CB 3.41Å; S850-R853 WeakPolarHBondContact O-CG 3.33Å; S850-R853 PolarHBondContact O-N 3.23Å; R853-D855 PolarHBondContact O-N 2.98Å; R853-D855 VanDerWaalsContact O-N 3.17Å; R853-S856 PolarHBondContact O-N 2.93Å; R853-S856 VanDerWaalsContact O-N 3.08Å; R853-S857 WeakPolarHBondContact CD-O 3.49Å; R853-S857 WeakPolarHBondContact CG-OG 3.43Å; R853-S857 VanDerWaalsContact NH1-C 3.33Å; R853-S857 PolarHBondContact NH1-O 3.41Å; R853-S857 PolarHBondContact NH1-OG 3.44Å; R853-N858 VanDerWaalsContact CZ-O 3.27Å; R853-N858 VanDerWaalsContact NH1-C 3.26Å; R853-N858 PolarHBondContact NH1-O 2.95Å; R853-N858 PolarHBondContact NH2-O 2.93Å; R853-N858 VanDerWaalsContact NH2-O 3.09Å
854	A	67.6	Low	82	Confident	6 Å²	6	19.7 Å²	19.7	5%	0.05	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.4	-179.8	0	0	0	0	0	113.3	Q447 L448 S852 S856	Q447-A854 WeakPolarHBondContact CB-O 3.22Å; Q447-A854 PolarHBondContact N-O 3.39Å; L448-A854 HydrophobicContact CD1-CB 3.84Å; L448-A854 HydrophobicContact CG-CB 4.04Å; S852-A854 PolarHBondContact O-N 2.75Å; A854-S856 PolarHBondContact O-N 2.81Å
855	D	67.7	Low	82.1	Confident	56 Å²	56	19.8 Å²	19.8	30%	0.299	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	6.4	175.9	63.7	-15.8	0	0	0	114.3	R853 S857	R853-D855 PolarHBondContact O-N 2.98Å; R853-D855 VanDerWaalsContact O-N 3.17Å; D855-S857 PolarHBondContact O-N 3.21Å; D855-S857 WeakPolarHBondContact OD1-CB 3.35Å; D855-S857 PolarHBondContact OD1-N 2.62Å; D855-S857 PolarHBondContact OD1-OG 3.49Å; D855-S857 VanDerWaalsContact OD2-CB 3.32Å; D855-S857 WeakPolarHBondContact OD2-CB 3.07Å; D855-S857 PolarHBondContact OD2-OG 2.97Å
856	S	80.4	Confident	81.8	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.007	13%	0.126	C	C	.	.			trans	58.4	19.1	-169.9	-64.3	0	0	0	0	114	E445 D446 Q447 R853 A854 N875 Q877 T878	E445-S856 PolarHBondContact O-OG 3.44Å; D446-S856 WeakPolarHBondContact CA-OG 3.38Å; Q447-S856 WeakPolarHBondContact CG-OG 3.45Å; Q447-S856 PolarHBondContact NE2-OG 2.79Å; R853-S856 PolarHBondContact O-N 2.93Å; R853-S856 VanDerWaalsContact O-N 3.08Å; A854-S856 PolarHBondContact O-N 2.81Å; S856-N875 VanDerWaalsContact C-ND2 3.34Å; S856-N875 VanDerWaalsContact O-CB 3.26Å; S856-N875 WeakPolarHBondContact O-CB 3.37Å; S856-N875 PolarHBondContact O-ND2 2.89Å; S856-Q877 PolarHBondContact OG-NE2 3.22Å; S856-T878 VanDerWaalsContact CB-OG1 3.24Å; S856-T878 WeakPolarHBondContact CB-OG1 3.32Å; S856-T878 WeakPolarHBondContact O-CB 3.37Å; S856-T878 PolarHBondContact O-OG1 3.32Å
857	S	78.8	Confident	81.4	Confident	21 Å²	21	20.8 Å²	20.8	15%	0.147	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-60.9	152.2	175.1	59.3	0	0	0	0	112.1	R853 D855 N875	R853-S857 WeakPolarHBondContact CD-O 3.49Å; R853-S857 WeakPolarHBondContact CG-OG 3.43Å; R853-S857 VanDerWaalsContact NH1-C 3.33Å; R853-S857 PolarHBondContact NH1-O 3.41Å; R853-S857 PolarHBondContact NH1-OG 3.44Å; D855-S857 PolarHBondContact O-N 3.21Å; D855-S857 WeakPolarHBondContact OD1-CB 3.35Å; D855-S857 PolarHBondContact OD1-N 2.62Å; D855-S857 PolarHBondContact OD1-OG 3.49Å; D855-S857 VanDerWaalsContact OD2-CB 3.32Å; D855-S857 WeakPolarHBondContact OD2-CB 3.07Å; D855-S857 PolarHBondContact OD2-OG 2.97Å; S857-N875 PolarHBondContact O-ND2 2.99Å
858	N	85.1	Confident	81.1	Confident	16 Å²	16	20.8 Å²	20.8	9%	0.086	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-103	151.8	-174	-79.6	-48	0	0	0	113.7	R853 L874 N875 I882	R853-N858 VanDerWaalsContact CZ-O 3.27Å; R853-N858 VanDerWaalsContact NH1-C 3.26Å; R853-N858 PolarHBondContact NH1-O 2.95Å; R853-N858 PolarHBondContact NH2-O 2.93Å; R853-N858 VanDerWaalsContact NH2-O 3.09Å; N858-L874 HydrophobicContact CB-CD2 4.27Å; N858-L874 WeakPolarHBondContact OD1-CA 3.01Å; N858-N875 PolarHBondContact ND2-O 2.76Å; N858-N875 WeakPolarHBondContact OD1-CB 3.41Å; N858-N875 PolarHBondContact OD1-N 3.02Å; N858-I882 HydrophobicContact CB-CB 3.91Å; N858-I882 HydrophobicContact CB-CG1 4.4Å; N858-I882 HydrophobicContact CB-CG2 3.56Å
859	L	85.3	Confident	81.3	Confident	5 Å²	5	19.6 Å²	19.6	3%	0.026	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-81.9	148	163.7	74.7	162.5	0	0	0	110.2	E822 I847 P849 P861 I864 V872 L874 I882	E822-L859 HydrophobicContact CB-CD1 4.46Å; E822-L859 HydrophobicContact CG-CB 4.29Å; E822-L859 HydrophobicContact CG-CD1 4.24Å; I847-L859 HydrophobicContact CG2-CD1 3.98Å; P849-L859 HydrophobicContact CB-CD2 4.35Å; P849-L859 HydrophobicContact CG-CD2 3.89Å; L859-P861 WeakPolarHBondContact O-CD 3.39Å; L859-I864 HydrophobicContact CD1-CG1 4.15Å; L859-V872 HydrophobicContact CD1-CG1 4.32Å; L859-V872 HydrophobicContact CG-CG1 4.43Å; L859-L874 HydrophobicContact CD2-CD2 3.83Å; L859-L874 HydrophobicContact CG-CD2 4.48Å; L859-L874 WeakPolarHBondContact O-CD2 3.36Å; L859-I882 WeakPolarHBondContact O-CG2 3.44Å
860	N	86.4	Confident	81.9	Confident	13 Å²	13	19.3 Å²	19.3	7%	0.07	12%	0.117	C	C	.	.			trans	-75.1	114.9	-179.8	-172.1	-45.7	0	0	0	109.8	L862 D863 I882 R1442	N860-L862 VanDerWaalsContact C-N 3.28Å; N860-L862 PolarHBondContact O-N 2.93Å; N860-L862 WeakPolarHBondContact OD1-CB 3.27Å; N860-L862 PolarHBondContact OD1-N 3Å; N860-D863 PolarHBondContact O-N 3.06Å; N860-I882 HydrophobicContact CB-CD1 4.04Å; N860-R1442 PolarHBondContact ND2-NH1 2.75Å; N860-R1442 PolarHBondContact OD1-NH1 2.81Å
861	P	92.3	Very high	82.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-22.7	-170.4	30.4	-37.3	0	0	0	112.9	L859 D863 I864 W865 V872 L874	L859-P861 WeakPolarHBondContact O-CD 3.39Å; P861-D863 VanDerWaalsContact C-N 3.26Å; P861-D863 PolarHBondContact O-N 3.45Å; P861-I864 WeakPolarHBondContact O-CA 3.47Å; P861-I864 WeakPolarHBondContact O-CB 3.38Å; P861-I864 PolarHBondContact O-N 3.39Å; P861-W865 HydrophobicContact CB-CD2 4.06Å; P861-W865 HydrophobicContact CB-CE3 4.06Å; P861-W865 HydrophobicContact CB-CH2 3.65Å; P861-W865 HydrophobicContact CB-CZ2 3.63Å; P861-W865 HydrophobicContact CB-CZ3 3.85Å; P861-W865 HydrophobicContact CG-CE3 4.28Å; P861-W865 HydrophobicContact CG-CH2 3.7Å; P861-W865 HydrophobicContact CG-CZ2 4.21Å; P861-W865 HydrophobicContact CG-CZ3 3.72Å; P861-W865 PolarHBondContact O-N 2.81Å; P861-V872 HydrophobicContact CB-CB 4.45Å; P861-V872 HydrophobicContact CB-CG1 4Å; P861-L874 HydrophobicContact CB-CD1 4.5Å; P861-L874 HydrophobicContact CG-CD1 4.3Å
862	L	90	Very high	84.1	Confident	3 Å²	3	13.2 Å²	13.2	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-65.8	-29.2	177	-69.6	159.9	0	0	0	112.3	N860 I864 W865 A866 L885 F889 H966 L1005 L1007 R1442	N860-L862 VanDerWaalsContact C-N 3.28Å; N860-L862 PolarHBondContact O-N 2.93Å; N860-L862 WeakPolarHBondContact OD1-CB 3.27Å; N860-L862 PolarHBondContact OD1-N 3Å; L862-I864 PolarHBondContact O-N 3.32Å; L862-W865 HydrophobicContact CD2-CE3 3.88Å; L862-W865 HydrophobicContact CD2-CZ3 4.43Å; L862-W865 HydrophobicContact CG-CE3 4.15Å; L862-W865 HydrophobicContact CG-CZ3 4.49Å; L862-W865 PolarHBondContact O-N 2.87Å; L862-A866 WeakPolarHBondContact O-CB 3.44Å; L862-A866 PolarHBondContact O-N 3.11Å; L862-L885 HydrophobicContact CD1-CD1 4.44Å; L862-L885 HydrophobicContact CD1-CD2 4.46Å; L862-F889 HydrophobicContact CD2-CD2 4.19Å; L862-F889 HydrophobicContact CD2-CE2 4.34Å; L862-H966 HydrophobicContact CD1-CB 3.82Å; L862-L1005 VanDerWaalsContact CD2-O 3.32Å; L862-L1005 WeakPolarHBondContact CD2-O 3.19Å; L862-L1007 HydrophobicContact CD1-CD1 4.15Å; L862-R1442 VanDerWaalsContact CB-NH2 3.3Å
863	D	83.6	Confident	85.5	Confident	52 Å²	52	11 Å²	11	28%	0.278	6%	0.061	S	C	.	.	H	α-helix	trans	-65.5	-20	173.7	-62.6	-25.1	0	0	0	111.7	N860 P861 W867 R1442	N860-D863 PolarHBondContact O-N 3.06Å; P861-D863 VanDerWaalsContact C-N 3.26Å; P861-D863 PolarHBondContact O-N 3.45Å; D863-W867 VanDerWaalsContact O-CD1 3.3Å; D863-W867 PolarHBondContact O-NE1 2.9Å; D863-W867 VanDerWaalsContact O-NE1 3.11Å; D863-R1442 WeakPolarHBondContact OD1-CD 3Å; D863-R1442 IonicContact OD1-CZ 3.88Å; D863-R1442 IonicContact OD1-NE 2.61Å; D863-R1442 IonicContact OD1-NH1 2.94Å; D863-R1442 PolarHBondContact OD1-NH1 2.72Å; D863-R1442 IonicContact OD2-NH1 3.85Å
864	I	88.8	Confident	86.5	Confident	10 Å²	10	10.4 Å²	10.4	5%	0.051	6%	0.059	C	C	.	.	H	α-helix	trans	-98	-42	177.9	-54.3	-47.6	0	0	0	111.6	A825 I829 I847 L859 P861 L862 A866 W867 G868 G869 V872	A825-I864 HydrophobicContact CB-CD1 4.29Å; I829-I864 HydrophobicContact CD1-CD1 4.3Å; I847-I864 HydrophobicContact CD1-CB 4.34Å; I847-I864 HydrophobicContact CD1-CD1 3.86Å; I847-I864 HydrophobicContact CD1-CG1 4.09Å; I847-I864 HydrophobicContact CD1-CG2 3.36Å; I847-I864 HydrophobicContact CG1-CG2 4.16Å; L859-I864 HydrophobicContact CD1-CG1 4.15Å; P861-I864 WeakPolarHBondContact O-CA 3.47Å; P861-I864 WeakPolarHBondContact O-CB 3.38Å; P861-I864 PolarHBondContact O-N 3.39Å; L862-I864 PolarHBondContact O-N 3.32Å; I864-A866 PolarHBondContact O-N 3.44Å; I864-W867 HydrophobicContact CD1-CZ2 4.12Å; I864-W867 HydrophobicContact CG2-CH2 4.37Å; I864-W867 HydrophobicContact CG2-CZ2 3.84Å; I864-W867 PolarHBondContact O-N 3.13Å; I864-W867 PolarHBondContact O-NE1 3.12Å; I864-G868 PolarHBondContact O-N 2.84Å; I864-G869 PolarHBondContact O-N 3.41Å; I864-V872 HydrophobicContact CB-CG1 4.27Å; I864-V872 HydrophobicContact CB-CG2 3.91Å; I864-V872 HydrophobicContact CG1-CG1 4.14Å; I864-V872 HydrophobicContact CG2-CG1 4.47Å; I864-V872 HydrophobicContact CG2-CG2 3.48Å; I864-V872 VanDerWaalsContact CG2-CG2 3.48Å
865	W	91.3	Very high	87.6	Confident	2 Å²	2	10.1 Å²	10.1	1%	0.008	6%	0.057	C	C	.	.	H	α-helix	trans	-64.7	-28.7	176.8	-62.6	-25.6	0	0	0	112.5	Y434 P861 L862 W867 G868 G869 F889 F890 L1005	Y434-W865 HydrophobicContact CD1-CB 4.1Å; Y434-W865 AromaticContact CD1-CD1 3.24Å; Y434-W865 AromaticContact CD1-CG 3.74Å; Y434-W865 HydrophobicContact CD1-CG 3.74Å; Y434-W865 AromaticContact CD1-NE1 3.83Å; Y434-W865 HydrophobicContact CE1-CB 3.63Å; Y434-W865 AromaticContact CE1-CD1 3.62Å; Y434-W865 AromaticContact CE1-CG 3.82Å; Y434-W865 HydrophobicContact CE1-CG 3.82Å; Y434-W865 HydrophobicContact CG-CG 4.31Å; Y434-W865 PolarHBondContact OH-O 2.78Å; P861-W865 HydrophobicContact CB-CD2 4.06Å; P861-W865 HydrophobicContact CB-CE3 4.06Å; P861-W865 HydrophobicContact CB-CH2 3.65Å; P861-W865 HydrophobicContact CB-CZ2 3.63Å; P861-W865 HydrophobicContact CB-CZ3 3.85Å; P861-W865 HydrophobicContact CG-CE3 4.28Å; P861-W865 HydrophobicContact CG-CH2 3.7Å; P861-W865 HydrophobicContact CG-CZ2 4.21Å; P861-W865 HydrophobicContact CG-CZ3 3.72Å; P861-W865 PolarHBondContact O-N 2.81Å; L862-W865 HydrophobicContact CD2-CE3 3.88Å; L862-W865 HydrophobicContact CD2-CZ3 4.43Å; L862-W865 HydrophobicContact CG-CE3 4.15Å; L862-W865 HydrophobicContact CG-CZ3 4.49Å; L862-W865 PolarHBondContact O-N 2.87Å; W865-W867 PolarHBondContact O-N 3.1Å; W865-G868 PolarHBondContact O-N 3.46Å; W865-G869 VanDerWaalsContact CD1-O 3.3Å; W865-F889 HydrophobicContact CD2-CE1 4.3Å; W865-F889 HydrophobicContact CD2-CE2 4.29Å; W865-F889 HydrophobicContact CD2-CZ 4.15Å; W865-F889 HydrophobicContact CE3-CD1 4.04Å; W865-F889 AromaticContact CE3-CD2 3.55Å; W865-F889 HydrophobicContact CE3-CD2 3.55Å; W865-F889 HydrophobicContact CE3-CE1 4.07Å; W865-F889 AromaticContact CE3-CE2 3.58Å; W865-F889 HydrophobicContact CE3-CE2 3.58Å; W865-F889 AromaticContact CE3-CG 3.8Å; W865-F889 HydrophobicContact CE3-CG 3.8Å; W865-F889 AromaticContact CE3-CZ 3.85Å; W865-F889 HydrophobicContact CE3-CZ 3.85Å; W865-F889 HydrophobicContact CH2-CB 4.01Å; W865-F889 AromaticContact CH2-CD1 3.8Å; W865-F889 HydrophobicContact CH2-CD1 3.8Å; W865-F889 HydrophobicContact CH2-CD2 4.43Å; W865-F889 HydrophobicContact CH2-CE1 4.39Å; W865-F889 AromaticContact CH2-CG 3.84Å; W865-F889 HydrophobicContact CH2-CG 3.84Å; W865-F889 HydrophobicContact CZ2-CD1 4.37Å; W865-F889 HydrophobicContact CZ3-CB 3.61Å; W865-F889 AromaticContact CZ3-CD1 3.63Å; W865-F889 HydrophobicContact CZ3-CD1 3.63Å; W865-F889 AromaticContact CZ3-CD2 3.46Å; W865-F889 HydrophobicContact CZ3-CD2 3.46Å; W865-F889 VanDerWaalsContact CZ3-CD2 3.46Å; W865-F889 HydrophobicContact CZ3-CE1 4.13Å; W865-F889 AromaticContact CZ3-CE2 3.98Å; W865-F889 HydrophobicContact CZ3-CE2 3.98Å; W865-F889 AromaticContact CZ3-CG 3.28Å; W865-F889 HydrophobicContact CZ3-CG 3.28Å; W865-F889 HydrophobicContact CZ3-CZ 4.29Å; W865-F890 HydrophobicContact CH2-CD2 4.26Å; W865-F890 AromaticContact CH2-CE2 3.62Å; W865-F890 HydrophobicContact CH2-CE2 3.62Å; W865-F890 HydrophobicContact CH2-CZ 4.2Å; W865-F890 HydrophobicContact CZ2-CD2 4.49Å; W865-F890 AromaticContact CZ2-CE2 3.45Å; W865-F890 HydrophobicContact CZ2-CE2 3.45Å; W865-F890 VanDerWaalsContact CZ2-CE2 3.45Å; W865-F890 AromaticContact CZ2-CZ 3.71Å; W865-F890 HydrophobicContact CZ2-CZ 3.71Å; W865-L1005 HydrophobicContact CB-CD2 4.32Å
866	A	84.8	Confident	88.8	Confident	16 Å²	16	10 Å²	10	13%	0.132	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-17.1	175.3	0	0	0	0	0	115.7	L862 I864 Y905 I968	L862-A866 WeakPolarHBondContact O-CB 3.44Å; L862-A866 PolarHBondContact O-N 3.11Å; I864-A866 PolarHBondContact O-N 3.44Å; A866-Y905 VanDerWaalsContact O-CE1 3.27Å; A866-Y905 WeakPolarHBondContact O-CE1 3.39Å; A866-Y905 PolarHBondContact O-OH 3.13Å; A866-I968 HydrophobicContact CB-CG2 3.95Å
867	W	84.3	Confident	89	Confident	10 Å²	10	11.9 Å²	11.9	4%	0.038	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	9	172.5	54.2	-91.8	0	0	0	113.4	M820 I829 L836 V837 T840 I845 I847 D863 I864 W865	M820-W867 HydrophobicContact CE-CH2 4.46Å; I829-W867 HydrophobicContact CD1-CZ2 4.22Å; I829-W867 HydrophobicContact CG1-CG 4.45Å; I829-W867 HydrophobicContact CG1-CZ2 4.27Å; I829-W867 VanDerWaalsContact CG1-NE1 3.34Å; L836-W867 HydrophobicContact CD1-CE3 4.39Å; L836-W867 HydrophobicContact CD1-CH2 4.18Å; L836-W867 HydrophobicContact CD1-CZ3 3.82Å; L836-W867 HydrophobicContact CD2-CD2 3.73Å; L836-W867 HydrophobicContact CD2-CE3 3.58Å; L836-W867 HydrophobicContact CD2-CG 4.46Å; L836-W867 HydrophobicContact CD2-CH2 3.67Å; L836-W867 HydrophobicContact CD2-CZ2 3.84Å; L836-W867 HydrophobicContact CD2-CZ3 3.56Å; L836-W867 HydrophobicContact CG-CD2 4.15Å; L836-W867 HydrophobicContact CG-CE3 3.49Å; L836-W867 VanDerWaalsContact CG-CE3 3.49Å; L836-W867 HydrophobicContact CG-CH2 3.98Å; L836-W867 HydrophobicContact CG-CZ3 3.41Å; L836-W867 VanDerWaalsContact CG-CZ3 3.41Å; V837-W867 HydrophobicContact CG2-CB 3.8Å; V837-W867 WeakPolarHBondContact CG2-O 3.19Å; T840-W867 HydrophobicContact CG2-CE3 3.54Å; T840-W867 HydrophobicContact CG2-CZ3 3.35Å; T840-W867 PolarHBondContact OG1-O 2.81Å; I845-W867 HydrophobicContact CD1-CZ3 4.25Å; I847-W867 HydrophobicContact CD1-CH2 3.51Å; I847-W867 HydrophobicContact CD1-CZ2 3.44Å; I847-W867 VanDerWaalsContact CD1-CZ2 3.44Å; D863-W867 VanDerWaalsContact O-CD1 3.3Å; D863-W867 PolarHBondContact O-NE1 2.9Å; D863-W867 VanDerWaalsContact O-NE1 3.11Å; I864-W867 HydrophobicContact CD1-CZ2 4.12Å; I864-W867 HydrophobicContact CG2-CH2 4.37Å; I864-W867 HydrophobicContact CG2-CZ2 3.84Å; I864-W867 PolarHBondContact O-N 3.13Å; I864-W867 PolarHBondContact O-NE1 3.12Å; W865-W867 PolarHBondContact O-N 3.1Å
868	G	86.3	Confident	89.3	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.1	7.8	170.9	0	0	0	0	0	116.8	T840 I864 W865 Q870 K901	T840-G868 VanDerWaalsContact CB-O 3.31Å; T840-G868 WeakPolarHBondContact CB-O 3.26Å; T840-G868 PolarHBondContact OG1-O 3.17Å; I864-G868 PolarHBondContact O-N 2.84Å; W865-G868 PolarHBondContact O-N 3.46Å; G868-Q870 PolarHBondContact O-N 2.8Å; G868-K901 WeakPolarHBondContact O-CE 3.35Å; G868-K901 PolarHBondContact O-NZ 2.93Å
869	G	89.2	Confident	89.3	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.084	C	C	.	.			trans	-59.4	128.6	176.3	0	0	0	0	0	111.8	Y434 I864 W865	Y434-G869 WeakPolarHBondContact CD1-O 3.42Å; I864-G869 PolarHBondContact O-N 3.41Å; W865-G869 VanDerWaalsContact CD1-O 3.3Å
870	Q	94.4	Very high	89.3	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.094	C	C	.	.			trans	-86	-51.7	-168.5	-57.5	93.7	-27.3	0	0	114	T431 Y433 I435 T840 S843 L844 G868	T431-Q870 PolarHBondContact O-NE2 2.69Å; T431-Q870 VanDerWaalsContact O-NE2 3.08Å; Y433-Q870 WeakPolarHBondContact O-CB 3.47Å; Y433-Q870 WeakPolarHBondContact O-CG 3.49Å; I435-Q870 HydrophobicContact CG1-CB 4.42Å; I435-Q870 PolarHBondContact N-O 2.94Å; T840-Q870 PolarHBondContact O-NE2 3.2Å; S843-Q870 PolarHBondContact O-NE2 3.37Å; L844-Q870 HydrophobicContact CD2-CB 4.18Å; L844-Q870 HydrophobicContact CD2-CG 4.01Å; G868-Q870 PolarHBondContact O-N 2.8Å
871	I	95.7	Very high	89.4	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	98.1	-169.9	-62.9	169	0	0	0	106.8	I435 Y467 I514 I817 I845 Q846 I847 T873	I435-I871 HydrophobicContact CB-CG1 4.32Å; I435-I871 HydrophobicContact CD1-CD1 4.43Å; I435-I871 HydrophobicContact CD1-CG1 3.98Å; Y467-I871 HydrophobicContact CD1-CG2 4.01Å; Y467-I871 HydrophobicContact CD2-CD1 4.03Å; Y467-I871 HydrophobicContact CD2-CG1 4.42Å; Y467-I871 HydrophobicContact CD2-CG2 3.65Å; Y467-I871 HydrophobicContact CE1-CG2 4.16Å; Y467-I871 HydrophobicContact CE2-CD1 4.23Å; Y467-I871 HydrophobicContact CE2-CG2 3.82Å; Y467-I871 HydrophobicContact CG-CG2 3.79Å; I514-I871 HydrophobicContact CD1-CD1 4.3Å; I817-I871 HydrophobicContact CD1-CD1 4.35Å; I845-I871 PolarHBondContact O-N 3.39Å; I845-I871 VanDerWaalsContact O-N 3.16Å; Q846-I871 CarbonylContact C-O 3.55Å; Q846-I871 WeakPolarHBondContact CA-O 3.34Å; Q846-I871 HydrophobicContact CB-CB 4.28Å; Q846-I871 HydrophobicContact CB-CG2 4.06Å; Q846-I871 HydrophobicContact CG-CG2 3.94Å; I847-I871 PolarHBondContact N-O 2.6Å; I871-T873 HydrophobicContact CG2-CG2 3.89Å
872	V	95.5	Very high	89.3	Confident	3 Å²	3	17.2 Å²	17.2	2%	0.018	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	97.3	-177.9	-168.6	0	0	0	0	107.2	L859 P861 I864 L874	L859-V872 HydrophobicContact CD1-CG1 4.32Å; L859-V872 HydrophobicContact CG-CG1 4.43Å; P861-V872 HydrophobicContact CB-CB 4.45Å; P861-V872 HydrophobicContact CB-CG1 4Å; I864-V872 HydrophobicContact CB-CG1 4.27Å; I864-V872 HydrophobicContact CB-CG2 3.91Å; I864-V872 HydrophobicContact CG1-CG1 4.14Å; I864-V872 HydrophobicContact CG2-CG1 4.47Å; I864-V872 HydrophobicContact CG2-CG2 3.48Å; I864-V872 VanDerWaalsContact CG2-CG2 3.48Å; V872-L874 PolarHBondContact O-N 2.62Å
873	T	94.6	Very high	89.4	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.3	-167.5	70.4	0	0	0	0	110.2	Y467 Q846 I847 P849 I871	Y467-T873 HydrophobicContact CD1-CG2 3.85Å; Y467-T873 HydrophobicContact CE1-CG2 3.58Å; Q846-T873 HydrophobicContact CG-CG2 4.15Å; I847-T873 PolarHBondContact O-N 3Å; I847-T873 VanDerWaalsContact O-N 3.08Å; I847-T873 PolarHBondContact O-OG1 3.46Å; P849-T873 WeakPolarHBondContact CD-O 3.3Å; P849-T873 WeakPolarHBondContact CD-OG1 3.31Å; P849-T873 WeakPolarHBondContact CG-O 3.46Å; I871-T873 HydrophobicContact CG2-CG2 3.89Å
874	L	93.6	Very high	89.9	Confident	4 Å²	4	16 Å²	16	2%	0.021	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.7	-176.8	-58.2	178.8	0	0	0	111.3	S437 S438 H439 N858 L859 P861 V872 Y876 M883 A886	S437-L874 PolarHBondContact O-N 2.81Å; S438-L874 CarbonylContact C-O 3.55Å; S438-L874 WeakPolarHBondContact CA-O 3.37Å; H439-L874 PolarHBondContact N-O 3.33Å; N858-L874 HydrophobicContact CB-CD2 4.27Å; N858-L874 WeakPolarHBondContact OD1-CA 3.01Å; L859-L874 HydrophobicContact CD2-CD2 3.83Å; L859-L874 HydrophobicContact CG-CD2 4.48Å; L859-L874 WeakPolarHBondContact O-CD2 3.36Å; P861-L874 HydrophobicContact CB-CD1 4.5Å; P861-L874 HydrophobicContact CG-CD1 4.3Å; V872-L874 PolarHBondContact O-N 2.62Å; L874-Y876 HydrophobicContact CB-CD2 4.26Å; L874-Y876 HydrophobicContact CB-CE2 4.24Å; L874-Y876 VanDerWaalsContact O-CD2 3.31Å; L874-Y876 WeakPolarHBondContact O-CD2 3.42Å; L874-Y876 PolarHBondContact O-N 2.98Å; L874-Y876 VanDerWaalsContact O-N 3.13Å; L874-M883 HydrophobicContact CB-CE 3.86Å; L874-M883 HydrophobicContact CD1-CE 4.28Å; L874-A886 HydrophobicContact CD1-CB 3.62Å
875	N	91.5	Very high	90.2	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	9%	0.093	C	C	.	.			trans	-71.8	98.9	169.5	-59.9	-54.1	0	0	0	108.7	H439 Q447 S856 S857 N858 Q877 T878 M883	H439-N875 PolarHBondContact ND1-OD1 3.3Å; Q447-N875 PolarHBondContact NE2-OD1 3.49Å; S856-N875 VanDerWaalsContact C-ND2 3.34Å; S856-N875 VanDerWaalsContact O-CB 3.26Å; S856-N875 WeakPolarHBondContact O-CB 3.37Å; S856-N875 PolarHBondContact O-ND2 2.89Å; S857-N875 PolarHBondContact O-ND2 2.99Å; N858-N875 PolarHBondContact ND2-O 2.76Å; N858-N875 WeakPolarHBondContact OD1-CB 3.41Å; N858-N875 PolarHBondContact OD1-N 3.02Å; N875-Q877 VanDerWaalsContact C-N 3.25Å; N875-Q877 VanDerWaalsContact CA-OE1 3.25Å; N875-Q877 PolarHBondContact O-N 3.13Å; N875-T878 PolarHBondContact O-N 2.91Å; N875-M883 VanDerWaalsContact O-CE 3.24Å; N875-M883 WeakPolarHBondContact O-CE 3.13Å
876	Y	91.9	Very high	90.5	Very high	52 Å²	52	15.5 Å²	15.5	20%	0.204	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.2	-174.3	-90.7	-140.3	0	0	0	113.6	S437 A460 S463 C465 L874 T878 M883	S437-Y876 VanDerWaalsContact O-CE2 3.28Å; S437-Y876 WeakPolarHBondContact O-CE2 3.08Å; A460-Y876 HydrophobicContact CB-CD1 3.82Å; A460-Y876 HydrophobicContact CB-CE1 4.17Å; S463-Y876 WeakPolarHBondContact OG-CE1 3.38Å; C465-Y876 HydrophobicContact CB-CE1 3.7Å; C465-Y876 VanDerWaalsContact SG-CZ 3.6Å; C465-Y876 PolarHBondContact SG-OH 2.65Å; C465-Y876 VanDerWaalsContact SG-OH 3.34Å; L874-Y876 HydrophobicContact CB-CD2 4.26Å; L874-Y876 HydrophobicContact CB-CE2 4.24Å; L874-Y876 VanDerWaalsContact O-CD2 3.31Å; L874-Y876 WeakPolarHBondContact O-CD2 3.42Å; L874-Y876 PolarHBondContact O-N 2.98Å; L874-Y876 VanDerWaalsContact O-N 3.13Å; Y876-T878 VanDerWaalsContact C-N 3.26Å; Y876-T878 PolarHBondContact O-N 3.32Å; Y876-M883 HydrophobicContact CD2-CE 3.95Å; Y876-M883 HydrophobicContact CD2-SD 4.12Å; Y876-M883 HydrophobicContact CE2-CE 4.49Å; Y876-M883 HydrophobicContact CE2-SD 4.37Å; Y876-M883 HydrophobicContact CG-SD 4.41Å
877	Q	86	Confident	90.9	Very high	41 Å²	41	18.6 Å²	18.6	19%	0.192	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.9	174.3	72.1	-82.6	35.7	0	0	113.5	L444 E445 S856 N875 A879	L444-Q877 WeakPolarHBondContact O-CB 3.37Å; E445-Q877 VanDerWaalsContact O-CG 3.29Å; E445-Q877 WeakPolarHBondContact O-CG 3.18Å; E445-Q877 PolarHBondContact O-NE2 3.46Å; S856-Q877 PolarHBondContact OG-NE2 3.22Å; N875-Q877 VanDerWaalsContact C-N 3.25Å; N875-Q877 VanDerWaalsContact CA-OE1 3.25Å; N875-Q877 PolarHBondContact O-N 3.13Å; Q877-A879 PolarHBondContact O-N 3.21Å
878	T	85.6	Confident	91.5	Very high	41 Å²	41	18.4 Å²	18.4	25%	0.252	11%	0.112	S	C	.	.			trans	-91.4	89.3	-177.9	-51.5	0	0	0	0	110.5	S856 N875 Y876 M883	S856-T878 VanDerWaalsContact CB-OG1 3.24Å; S856-T878 WeakPolarHBondContact CB-OG1 3.32Å; S856-T878 WeakPolarHBondContact O-CB 3.37Å; S856-T878 PolarHBondContact O-OG1 3.32Å; N875-T878 PolarHBondContact O-N 2.91Å; Y876-T878 VanDerWaalsContact C-N 3.26Å; Y876-T878 PolarHBondContact O-N 3.32Å; T878-M883 WeakPolarHBondContact O-CB 3.37Å
879	A	84.5	Confident	92	Very high	54 Å²	54	18.4 Å²	18.4	45%	0.446	11%	0.113	S	C	.	.			trans	-65.7	169.9	174.3	0	0	0	0	0	113.1	Q877	Q877-A879 PolarHBondContact O-N 3.21Å
880	G	84.3	Confident	92.4	Very high	24 Å²	24	19.4 Å²	19.4	25%	0.247	12%	0.117	C	C	.	.	S	Bend	trans	105.4	-169.9	-175.7	0	0	0	0	0	113.6	I882 M883 D884	G880-I882 VanDerWaalsContact C-N 3.34Å; G880-I882 PolarHBondContact O-N 3.02Å; G880-M883 PolarHBondContact O-N 2.96Å; G880-D884 PolarHBondContact O-N 3.11Å
881	L	89.2	Confident	92.4	Very high	32 Å²	32	21 Å²	21	17%	0.168	13%	0.13	C	C	.	.	H	α-helix	trans	-43.1	-51.3	-163.6	175.6	62.8	0	0	0	114.5	M883 D884 L885 D1435	L881-M883 VanDerWaalsContact C-N 3.35Å; L881-M883 PolarHBondContact O-N 3.43Å; L881-D884 WeakPolarHBondContact O-CB 3.44Å; L881-D884 PolarHBondContact O-N 3.4Å; L881-L885 HydrophobicContact CD1-CD1 4.01Å; L881-L885 HydrophobicContact CD1-CG 4.07Å; L881-L885 HydrophobicContact CG-CD1 4.06Å; L881-L885 VanDerWaalsContact O-CG 3.25Å; L881-L885 WeakPolarHBondContact O-CG 3.16Å; L881-L885 PolarHBondContact O-N 3.3Å; L881-D1435 HydrophobicContact CD2-CB 4.17Å
882	I	90.7	Very high	92.4	Very high	17 Å²	17	21.1 Å²	21.1	9%	0.087	13%	0.13	C	C	.	.	H	α-helix	trans	-68.1	-35.4	-174.3	-53.5	-56.3	0	0	0	112.2	N858 L859 N860 G880 L885 A886	N858-I882 HydrophobicContact CB-CB 3.91Å; N858-I882 HydrophobicContact CB-CG1 4.4Å; N858-I882 HydrophobicContact CB-CG2 3.56Å; L859-I882 WeakPolarHBondContact O-CG2 3.44Å; N860-I882 HydrophobicContact CB-CD1 4.04Å; G880-I882 VanDerWaalsContact C-N 3.34Å; G880-I882 PolarHBondContact O-N 3.02Å; I882-L885 HydrophobicContact CD1-CD1 4.43Å; I882-A886 PolarHBondContact O-N 2.84Å; I882-A886 VanDerWaalsContact O-N 3.09Å
883	M	92.1	Very high	92.4	Very high	19 Å²	19	21 Å²	21	9%	0.094	13%	0.13	C	C	.	.	H	α-helix	trans	-76.7	-32.5	176.1	-164.7	54.6	52.7	0	0	111.7	L874 N875 Y876 T878 G880 L881 A886 T887	L874-M883 HydrophobicContact CB-CE 3.86Å; L874-M883 HydrophobicContact CD1-CE 4.28Å; N875-M883 VanDerWaalsContact O-CE 3.24Å; N875-M883 WeakPolarHBondContact O-CE 3.13Å; Y876-M883 HydrophobicContact CD2-CE 3.95Å; Y876-M883 HydrophobicContact CD2-SD 4.12Å; Y876-M883 HydrophobicContact CE2-CE 4.49Å; Y876-M883 HydrophobicContact CE2-SD 4.37Å; Y876-M883 HydrophobicContact CG-SD 4.41Å; T878-M883 WeakPolarHBondContact O-CB 3.37Å; G880-M883 PolarHBondContact O-N 2.96Å; L881-M883 VanDerWaalsContact C-N 3.35Å; L881-M883 PolarHBondContact O-N 3.43Å; M883-A886 PolarHBondContact O-N 2.93Å; M883-A886 HydrophobicContact SD-CB 4.46Å; M883-T887 VanDerWaalsContact O-CB 3.26Å; M883-T887 WeakPolarHBondContact O-CB 3.5Å; M883-T887 PolarHBondContact O-N 3.45Å; M883-T887 PolarHBondContact O-OG1 3.01Å
884	D	94.4	Very high	92.4	Very high	9 Å²	9	21.8 Å²	21.8	5%	0.048	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-43.6	170.6	-62.6	-26.8	0	0	0	111.5	G880 L881 T887 G888 R1009 Q1025	G880-D884 PolarHBondContact O-N 3.11Å; L881-D884 WeakPolarHBondContact O-CB 3.44Å; L881-D884 PolarHBondContact O-N 3.4Å; D884-T887 PolarHBondContact O-N 3.21Å; D884-G888 PolarHBondContact O-N 3.28Å; D884-R1009 VanDerWaalsContact CG-NH1 3.34Å; D884-R1009 IonicContact OD2-CZ 3.63Å; D884-R1009 VanDerWaalsContact OD2-CZ 3.23Å; D884-R1009 IonicContact OD2-NH1 3.18Å; D884-R1009 PolarHBondContact OD2-NH1 2.97Å; D884-R1009 IonicContact OD2-NH2 3.73Å; D884-R1009 PolarHBondContact OD2-NH2 2.96Å; D884-Q1025 PolarHBondContact OD1-NE2 3.33Å; D884-Q1025 PolarHBondContact OD2-NE2 2.64Å
885	L	95.2	Very high	92.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-43.5	176.1	-68.6	170.4	0	0	0	111.2	L862 L881 I882 F889 H966 L1007 T1027	L862-L885 HydrophobicContact CD1-CD1 4.44Å; L862-L885 HydrophobicContact CD1-CD2 4.46Å; L881-L885 HydrophobicContact CD1-CD1 4.01Å; L881-L885 HydrophobicContact CD1-CG 4.07Å; L881-L885 HydrophobicContact CG-CD1 4.06Å; L881-L885 VanDerWaalsContact O-CG 3.25Å; L881-L885 WeakPolarHBondContact O-CG 3.16Å; L881-L885 PolarHBondContact O-N 3.3Å; I882-L885 HydrophobicContact CD1-CD1 4.43Å; L885-F889 VanDerWaalsContact O-CB 3.23Å; L885-F889 WeakPolarHBondContact O-CB 3.44Å; L885-F889 PolarHBondContact O-N 2.93Å; L885-H966 HydrophobicContact CD2-CB 3.62Å; L885-H966 VanDerWaalsContact CD2-CG 3.49Å; L885-L1007 HydrophobicContact CB-CD1 4.11Å; L885-L1007 HydrophobicContact CD2-CD1 3.79Å; L885-L1007 VanDerWaalsContact O-CD1 3.31Å; L885-L1007 WeakPolarHBondContact O-CD1 3.36Å; L885-T1027 HydrophobicContact CD2-CG2 4.11Å
886	A	95.7	Very high	92.8	Very high	3 Å²	3	22.2 Å²	22.2	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-47.5	176	0	0	0	0	0	112	L874 I882 M883 G888 F889 F890	L874-A886 HydrophobicContact CD1-CB 3.62Å; I882-A886 PolarHBondContact O-N 2.84Å; I882-A886 VanDerWaalsContact O-N 3.09Å; M883-A886 PolarHBondContact O-N 2.93Å; M883-A886 HydrophobicContact SD-CB 4.46Å; A886-G888 PolarHBondContact O-N 2.99Å; A886-F889 PolarHBondContact O-N 2.8Å; A886-F890 VanDerWaalsContact O-CD2 3.3Å; A886-F890 WeakPolarHBondContact O-CD2 3.4Å; A886-F890 PolarHBondContact O-N 3.24Å
887	T	95.2	Very high	93.1	Very high	80 Å²	80	19.8 Å²	19.8	49%	0.491	13%	0.133	S	C	.	.	H	α-helix	trans	-62.8	-42.6	179.2	-57	0	0	0	0	111.3	M883 D884 A891	M883-T887 VanDerWaalsContact O-CB 3.26Å; M883-T887 WeakPolarHBondContact O-CB 3.5Å; M883-T887 PolarHBondContact O-N 3.45Å; M883-T887 PolarHBondContact O-OG1 3.01Å; D884-T887 PolarHBondContact O-N 3.21Å; T887-A891 WeakPolarHBondContact O-CB 3.45Å; T887-A891 PolarHBondContact O-N 3.2Å
888	G	95.6	Very high	93.7	Very high	6 Å²	6	17.9 Å²	17.9	6%	0.062	12%	0.124	C	C	.	.	H	α-helix	trans	-63.1	-46.9	173.6	0	0	0	0	0	112.2	D884 A886 F890 A891 T1027 P1029	D884-G888 PolarHBondContact O-N 3.28Å; A886-G888 PolarHBondContact O-N 2.99Å; G888-F890 PolarHBondContact O-N 3.17Å; G888-A891 WeakPolarHBondContact O-CB 3.19Å; G888-A891 PolarHBondContact O-N 3.38Å; G888-T1027 WeakPolarHBondContact CA-O 3.48Å; G888-P1029 VanDerWaalsContact O-CD 3.32Å; G888-P1029 WeakPolarHBondContact O-CD 3.39Å; G888-P1029 WeakPolarHBondContact O-CG 3.29Å
889	F	97	Very high	94.2	Very high	1 Å²	1	16 Å²	16	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-44.4	178.6	-172	-82.6	0	0	0	112.8	Y434 L862 W865 L885 A886 R892 V899 L1005 L1007	Y434-F889 AromaticContact CD2-CE1 3.95Å; Y434-F889 HydrophobicContact CD2-CE1 3.95Å; Y434-F889 AromaticContact CD2-CZ 3.7Å; Y434-F889 HydrophobicContact CD2-CZ 3.7Å; Y434-F889 HydrophobicContact CE2-CZ 4.05Å; Y434-F889 HydrophobicContact CG-CE1 4.25Å; Y434-F889 HydrophobicContact CG-CZ 4.27Å; L862-F889 HydrophobicContact CD2-CD2 4.19Å; L862-F889 HydrophobicContact CD2-CE2 4.34Å; W865-F889 HydrophobicContact CD2-CE1 4.3Å; W865-F889 HydrophobicContact CD2-CE2 4.29Å; W865-F889 HydrophobicContact CD2-CZ 4.15Å; W865-F889 HydrophobicContact CE3-CD1 4.04Å; W865-F889 AromaticContact CE3-CD2 3.55Å; W865-F889 HydrophobicContact CE3-CD2 3.55Å; W865-F889 HydrophobicContact CE3-CE1 4.07Å; W865-F889 AromaticContact CE3-CE2 3.58Å; W865-F889 HydrophobicContact CE3-CE2 3.58Å; W865-F889 AromaticContact CE3-CG 3.8Å; W865-F889 HydrophobicContact CE3-CG 3.8Å; W865-F889 AromaticContact CE3-CZ 3.85Å; W865-F889 HydrophobicContact CE3-CZ 3.85Å; W865-F889 HydrophobicContact CH2-CB 4.01Å; W865-F889 AromaticContact CH2-CD1 3.8Å; W865-F889 HydrophobicContact CH2-CD1 3.8Å; W865-F889 HydrophobicContact CH2-CD2 4.43Å; W865-F889 HydrophobicContact CH2-CE1 4.39Å; W865-F889 AromaticContact CH2-CG 3.84Å; W865-F889 HydrophobicContact CH2-CG 3.84Å; W865-F889 HydrophobicContact CZ2-CD1 4.37Å; W865-F889 HydrophobicContact CZ3-CB 3.61Å; W865-F889 AromaticContact CZ3-CD1 3.63Å; W865-F889 HydrophobicContact CZ3-CD1 3.63Å; W865-F889 AromaticContact CZ3-CD2 3.46Å; W865-F889 HydrophobicContact CZ3-CD2 3.46Å; W865-F889 VanDerWaalsContact CZ3-CD2 3.46Å; W865-F889 HydrophobicContact CZ3-CE1 4.13Å; W865-F889 AromaticContact CZ3-CE2 3.98Å; W865-F889 HydrophobicContact CZ3-CE2 3.98Å; W865-F889 AromaticContact CZ3-CG 3.28Å; W865-F889 HydrophobicContact CZ3-CG 3.28Å; W865-F889 HydrophobicContact CZ3-CZ 4.29Å; L885-F889 VanDerWaalsContact O-CB 3.23Å; L885-F889 WeakPolarHBondContact O-CB 3.44Å; L885-F889 PolarHBondContact O-N 2.93Å; A886-F889 PolarHBondContact O-N 2.8Å; F889-R892 WeakPolarHBondContact O-CG 3.36Å; F889-R892 PolarHBondContact O-NE 3.02Å; F889-V899 HydrophobicContact CD1-CG2 4.42Å; F889-V899 HydrophobicContact CE1-CB 4.01Å; F889-V899 HydrophobicContact CE1-CG1 3.94Å; F889-V899 HydrophobicContact CE1-CG2 4.23Å; F889-V899 HydrophobicContact CZ-CG1 4.34Å; F889-L1005 HydrophobicContact CE2-CD2 3.87Å; F889-L1005 HydrophobicContact CZ-CD2 4.06Å; F889-L1007 HydrophobicContact CB-CD1 4.16Å; F889-L1007 HydrophobicContact CB-CD2 4.12Å; F889-L1007 HydrophobicContact CD2-CD2 4.03Å
890	F	97.4	Very high	94.7	Very high	20 Å²	20	14.7 Å²	14.7	9%	0.088	10%	0.097	C	C	.	.	H	α-helix	trans	-85.1	-2.6	178.6	-72.7	-67	0	0	0	114.4	I435 A436 W865 A886 G888 R892 A895 V899	I435-F890 WeakPolarHBondContact O-CZ 3.05Å; A436-F890 VanDerWaalsContact CA-CZ 3.5Å; A436-F890 HydrophobicContact CB-CD1 3.95Å; A436-F890 HydrophobicContact CB-CD2 3.91Å; A436-F890 HydrophobicContact CB-CE1 3.99Å; A436-F890 HydrophobicContact CB-CE2 3.93Å; A436-F890 HydrophobicContact CB-CG 3.94Å; A436-F890 HydrophobicContact CB-CZ 4Å; A436-F890 VanDerWaalsContact N-CZ 3.33Å; W865-F890 HydrophobicContact CH2-CD2 4.26Å; W865-F890 AromaticContact CH2-CE2 3.62Å; W865-F890 HydrophobicContact CH2-CE2 3.62Å; W865-F890 HydrophobicContact CH2-CZ 4.2Å; W865-F890 HydrophobicContact CZ2-CD2 4.49Å; W865-F890 AromaticContact CZ2-CE2 3.45Å; W865-F890 HydrophobicContact CZ2-CE2 3.45Å; W865-F890 VanDerWaalsContact CZ2-CE2 3.45Å; W865-F890 AromaticContact CZ2-CZ 3.71Å; W865-F890 HydrophobicContact CZ2-CZ 3.71Å; A886-F890 VanDerWaalsContact O-CD2 3.3Å; A886-F890 WeakPolarHBondContact O-CD2 3.4Å; A886-F890 PolarHBondContact O-N 3.24Å; G888-F890 PolarHBondContact O-N 3.17Å; F890-R892 PolarHBondContact O-N 3.36Å; F890-A895 VanDerWaalsContact O-CA 3.29Å; F890-A895 WeakPolarHBondContact O-CA 3.34Å; F890-V899 HydrophobicContact CD1-CG2 3.77Å; F890-V899 HydrophobicContact CE1-CG2 4.13Å
891	A	95.1	Very high	95.1	Very high	33 Å²	33	13.6 Å²	13.6	27%	0.273	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25	173.6	0	0	0	0	0	112.4	F415 T887 G888	F415-A891 HydrophobicContact CE2-CB 4.04Å; F415-A891 HydrophobicContact CZ-CB 4.32Å; T887-A891 WeakPolarHBondContact O-CB 3.45Å; T887-A891 PolarHBondContact O-N 3.2Å; G888-A891 WeakPolarHBondContact O-CB 3.19Å; G888-A891 PolarHBondContact O-N 3.38Å
892	R	94.4	Very high	95.1	Very high	4 Å²	4	12.5 Å²	12.5	2%	0.015	8%	0.081	C	C	.	.	S	Bend	trans	-71.6	163.5	176.4	80.6	-175.5	103.3	180	10.4	112.3	H419 F889 F890 A895 V899 S1004 P1029 D1031 C1032	H419-R892 HydrophobicContact CB-CB 4.38Å; F889-R892 WeakPolarHBondContact O-CG 3.36Å; F889-R892 PolarHBondContact O-NE 3.02Å; F890-R892 PolarHBondContact O-N 3.36Å; R892-A895 PolarHBondContact O-N 2.81Å; R892-V899 HydrophobicContact CG-CG1 4.16Å; R892-V899 HydrophobicContact CG-CG2 3.75Å; R892-S1004 PolarHBondContact NH1-O 2.95Å; R892-S1004 PolarHBondContact NH2-O 2.9Å; R892-S1004 VanDerWaalsContact NH2-O 3.14Å; R892-P1029 HydrophobicContact CB-CG 4.43Å; R892-D1031 IonicContact NH1-OD2 3.94Å; R892-C1032 WeakPolarHBondContact CB-SG 3.47Å
893	N	96.6	Very high	94.6	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	58.7	48.7	177.2	-163.3	40.2	0	0	0	112.7	H419 Q421 V422 C423 Q424 M426 A895 C896 Y898	H419-N893 PolarHBondContact O-N 3.08Å; Q421-N893 CarbonylContact O-C 3.59Å; V422-N893 WeakPolarHBondContact CA-OD1 3.4Å; C423-N893 PolarHBondContact N-OD1 3.36Å; Q424-N893 WeakPolarHBondContact CB-OD1 3.32Å; Q424-N893 HydrophobicContact CG-CB 4.12Å; Q424-N893 PolarHBondContact N-OD1 2.96Å; M426-N893 PolarHBondContact SD-ND2 3.5Å; M426-N893 VanDerWaalsContact SD-ND2 3.35Å; N893-A895 PolarHBondContact O-N 3.33Å; N893-C896 PolarHBondContact ND2-SG 2.82Å; N893-C896 WeakPolarHBondContact O-CB 3.38Å; N893-C896 PolarHBondContact O-N 3.41Å; N893-C896 PolarHBondContact O-SG 2.9Å; N893-Y898 PolarHBondContact ND2-O 2.99Å
894	G	95.3	Very high	93.9	Very high	16 Å²	16	13.5 Å²	13.5	17%	0.165	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	72.6	10	177.3	0	0	0	0	0	114.7	H419 Q421 C896	H419-G894 PolarHBondContact O-N 2.95Å; Q421-G894 VanDerWaalsContact C-CA 3.47Å; Q421-G894 WeakPolarHBondContact O-CA 3.49Å; Q421-G894 PolarHBondContact O-N 2.88Å; G894-C896 PolarHBondContact O-N 3.46Å
895	A	96.2	Very high	93.1	Very high	12 Å²	12	13.1 Å²	13.1	10%	0.099	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	50.1	36.3	-165	0	0	0	0	0	113.4	F890 R892 N893 G897	F890-A895 VanDerWaalsContact O-CA 3.29Å; F890-A895 WeakPolarHBondContact O-CA 3.34Å; R892-A895 PolarHBondContact O-N 2.81Å; N893-A895 PolarHBondContact O-N 3.33Å; A895-G897 PolarHBondContact O-N 2.98Å
896	C	97.1	Very high	92.5	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.02	9%	0.091	C	C	.	.			trans	-77.2	-3.6	-175.7	74.2	0	0	0	0	114.2	V422 R466 S509 Y511 N893 G894 Y898	V422-C896 HydrophobicContact CG2-CB 4.12Å; R466-C896 WeakPolarHBondContact CD-O 3.16Å; S509-C896 VanDerWaalsContact CB-O 3.32Å; S509-C896 WeakPolarHBondContact CB-O 3.41Å; S509-C896 WeakPolarHBondContact OG-CA 3.28Å; S509-C896 WeakPolarHBondContact OG-CB 3.3Å; S509-C896 PolarHBondContact OG-O 2.82Å; Y511-C896 HydrophobicContact CD2-CB 3.88Å; Y511-C896 HydrophobicContact CE2-CB 4.36Å; N893-C896 PolarHBondContact ND2-SG 2.82Å; N893-C896 WeakPolarHBondContact O-CB 3.38Å; N893-C896 PolarHBondContact O-N 3.41Å; N893-C896 PolarHBondContact O-SG 2.9Å; G894-C896 PolarHBondContact O-N 3.46Å; C896-Y898 VanDerWaalsContact C-N 3.31Å; C896-Y898 PolarHBondContact O-N 2.91Å; C896-Y898 PolarHBondContact SG-O 2.83Å
897	G	97.2	Very high	91.2	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.01	11%	0.109	C	C	.	.	S	Bend	trans	81.7	0.9	-179.3	0	0	0	0	0	115.7	A436 G464 A895	A436-G897 PolarHBondContact N-O 3.27Å; G464-G897 WeakPolarHBondContact O-CA 3.38Å; A895-G897 PolarHBondContact O-N 2.98Å
898	Y	98.3	Very high	89.3	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.1	172.7	-77.1	-86.7	0	0	0	110.1	M426 I430 Y433 I435 R466 Y511 P512 P606 N893 C896	M426-Y898 HydrophobicContact CE-CG 4.36Å; I430-Y898 HydrophobicContact CD1-CE1 4.42Å; I430-Y898 HydrophobicContact CG1-CE1 4.21Å; Y433-Y898 HydrophobicContact CG-CD1 4.15Å; I435-Y898 HydrophobicContact CB-CE1 4.47Å; I435-Y898 HydrophobicContact CD1-CE1 3.75Å; I435-Y898 HydrophobicContact CG1-CD1 4.04Å; I435-Y898 HydrophobicContact CG1-CE1 3.67Å; I435-Y898 HydrophobicContact CG2-CE1 4.18Å; R466-Y898 HydrophobicContact CB-CD2 4.46Å; R466-Y898 HydrophobicContact CB-CE2 3.79Å; R466-Y898 HydrophobicContact CG-CD2 3.77Å; R466-Y898 HydrophobicContact CG-CE2 3.48Å; R466-Y898 VanDerWaalsContact CG-CE2 3.48Å; Y511-Y898 HydrophobicContact CG-CD2 4.32Å; P512-Y898 HydrophobicContact CG-CE2 4.23Å; P512-Y898 PolarHBondContact O-OH 3.23Å; P606-Y898 HydrophobicContact CB-CD1 4.48Å; P606-Y898 HydrophobicContact CG-CD1 4.04Å; P606-Y898 HydrophobicContact CG-CE1 4.25Å; P606-Y898 HydrophobicContact CG-CG 4.48Å; N893-Y898 PolarHBondContact ND2-O 2.99Å; C896-Y898 VanDerWaalsContact C-N 3.31Å; C896-Y898 PolarHBondContact O-N 2.91Å; C896-Y898 PolarHBondContact SG-O 2.83Å
899	V	97.4	Very high	87.1	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.018	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.6	176.1	175.4	0	0	0	0	109.2	Y433 Y434 F889 F890 R892	Y433-V899 CarbonylContact C-O 3.57Å; Y433-V899 VanDerWaalsContact CA-O 3.3Å; Y433-V899 WeakPolarHBondContact CA-O 3.28Å; Y434-V899 HydrophobicContact CD2-CG1 4.48Å; Y434-V899 PolarHBondContact N-O 3.28Å; Y434-V899 PolarHBondContact O-N 3.35Å; F889-V899 HydrophobicContact CD1-CG2 4.42Å; F889-V899 HydrophobicContact CE1-CB 4.01Å; F889-V899 HydrophobicContact CE1-CG1 3.94Å; F889-V899 HydrophobicContact CE1-CG2 4.23Å; F889-V899 HydrophobicContact CZ-CG1 4.34Å; F890-V899 HydrophobicContact CD1-CG2 3.77Å; F890-V899 HydrophobicContact CE1-CG2 4.13Å; R892-V899 HydrophobicContact CG-CG1 4.16Å; R892-V899 HydrophobicContact CG-CG2 3.75Å
900	L	94.9	Very high	84.6	Confident	25 Å²	25	25.8 Å²	25.8	13%	0.131	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.7	-178.6	-175.7	65.2	0	0	0	110.8	Q424 D425 Q428 H432 Y433	Q424-L900 HydrophobicContact CB-CB 4.31Å; D425-L900 HydrophobicContact CB-CD2 4.37Å; Q428-L900 HydrophobicContact CB-CD1 4.03Å; Q428-L900 HydrophobicContact CG-CD1 3.76Å; H432-L900 HydrophobicContact CB-CD1 4.29Å; Y433-L900 HydrophobicContact CD1-CB 4.07Å; Y433-L900 HydrophobicContact CD1-CD1 4.16Å; Y433-L900 HydrophobicContact CE1-CB 3.88Å; Y433-L900 HydrophobicContact CE1-CD1 3.68Å; Y433-L900 HydrophobicContact CE1-CG 4.36Å; Y433-L900 HydrophobicContact CE2-CD1 4.28Å
901	K	93	Very high	81.9	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.009	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-63.9	147.3	177.3	-70.7	175	-178.4	-177.5	0	111.6	T431 H432 Y434 T840 G868 R906	T431-K901 WeakPolarHBondContact O-CE 3.46Å; T431-K901 PolarHBondContact O-NZ 2.83Å; H432-K901 VanDerWaalsContact O-CB 3.26Å; H432-K901 WeakPolarHBondContact O-CB 3.49Å; H432-K901 VanDerWaalsContact O-CG 3.22Å; H432-K901 WeakPolarHBondContact O-CG 3.48Å; H432-K901 PolarHBondContact O-N 3.01Å; Y434-K901 HydrophobicContact CD1-CG 4.43Å; Y434-K901 HydrophobicContact CD2-CG 4.14Å; Y434-K901 HydrophobicContact CE1-CG 4.1Å; Y434-K901 HydrophobicContact CE2-CB 4.26Å; Y434-K901 HydrophobicContact CE2-CG 3.77Å; Y434-K901 HydrophobicContact CG-CG 4.47Å; T840-K901 PolarHBondContact O-NZ 2.89Å; G868-K901 WeakPolarHBondContact O-CE 3.35Å; G868-K901 PolarHBondContact O-NZ 2.93Å; K901-R906 HydrophobicContact CB-CG 3.85Å; K901-R906 WeakPolarHBondContact O-CD 3.18Å; K901-R906 PolarHBondContact O-NE 2.72Å
902	P	87.4	Confident	79.2	Confident	8 Å²	8	31.3 Å²	31.3	5%	0.052	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-53	149.1	168.6	-24.9	33	0	0	0	112.3	L904 Y905 S1004 L1005	P902-L904 PolarHBondContact O-N 2.73Å; P902-Y905 HydrophobicContact CB-CD2 3.93Å; P902-Y905 HydrophobicContact CB-CE2 4.09Å; P902-Y905 HydrophobicContact CG-CD2 3.99Å; P902-Y905 HydrophobicContact CG-CE2 3.93Å; P902-Y905 PolarHBondContact O-N 3.41Å; P902-S1004 VanDerWaalsContact CG-OG 3.26Å; P902-S1004 WeakPolarHBondContact CG-OG 3.47Å; P902-L1005 HydrophobicContact CG-CD2 4.45Å; P902-L1005 HydrophobicContact CG-CG 4.29Å
903	N	80.7	Confident	76.4	Confident	38 Å²	38	35.2 Å²	35.2	20%	0.203	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-53.7	-32.9	-177.3	-77.7	-51.7	0	0	0	113	Y905 R906 Q907 D928	N903-Y905 PolarHBondContact O-N 3.48Å; N903-Y905 VanDerWaalsContact O-N 3.13Å; N903-R906 PolarHBondContact O-N 2.98Å; N903-R906 PolarHBondContact OD1-NH2 2.75Å; N903-Q907 PolarHBondContact O-N 2.83Å; N903-D928 VanDerWaalsContact CB-OD2 3.28Å; N903-D928 WeakPolarHBondContact CB-OD2 3.21Å; N903-D928 PolarHBondContact N-OD2 3.17Å; N903-D928 VanDerWaalsContact ND2-CG 3.31Å; N903-D928 PolarHBondContact ND2-OD1 3.36Å; N903-D928 PolarHBondContact ND2-OD2 2.94Å
904	L	76.8	Confident	73.2	Confident	19 Å²	19	39.3 Å²	39.3	10%	0.099	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-55.3	-24.9	176.4	-179.9	55.1	0	0	0	115	P902 F911 F912 T929	P902-L904 PolarHBondContact O-N 2.73Å; L904-F911 HydrophobicContact CD1-CB 3.78Å; L904-F912 HydrophobicContact CD1-CD2 4.17Å; L904-F912 HydrophobicContact CD2-CD2 3.79Å; L904-F912 HydrophobicContact CD2-CE2 3.48Å; L904-F912 VanDerWaalsContact CD2-CE2 3.48Å; L904-F912 HydrophobicContact CG-CD2 3.88Å; L904-F912 HydrophobicContact CG-CE2 3.97Å; L904-T929 HydrophobicContact CB-CG2 4.46Å; L904-T929 HydrophobicContact CD2-CG2 4.17Å
905	Y	79.5	Confident	69.9	Low	1 Å²	1	47.1 Å²	47.1	0%	0.004	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-105.8	1	175.8	-48.7	-83	0	0	0	113.1	V837 A866 P902 N903 F912 L1002 L1005	V837-Y905 HydrophobicContact CG1-CD1 4.08Å; V837-Y905 HydrophobicContact CG2-CD1 4.3Å; V837-Y905 HydrophobicContact CG2-CE1 4.4Å; A866-Y905 VanDerWaalsContact O-CE1 3.27Å; A866-Y905 WeakPolarHBondContact O-CE1 3.39Å; A866-Y905 PolarHBondContact O-OH 3.13Å; P902-Y905 HydrophobicContact CB-CD2 3.93Å; P902-Y905 HydrophobicContact CB-CE2 4.09Å; P902-Y905 HydrophobicContact CG-CD2 3.99Å; P902-Y905 HydrophobicContact CG-CE2 3.93Å; P902-Y905 PolarHBondContact O-N 3.41Å; N903-Y905 PolarHBondContact O-N 3.48Å; N903-Y905 VanDerWaalsContact O-N 3.13Å; Y905-F912 AromaticContact CE1-CD2 4Å; Y905-F912 HydrophobicContact CE1-CD2 4Å; Y905-F912 AromaticContact CE1-CE2 3.55Å; Y905-F912 HydrophobicContact CE1-CE2 3.55Å; Y905-F912 HydrophobicContact CE1-CZ 4.31Å; Y905-F912 AromaticContact CZ-CE2 3.65Å; Y905-F912 WeakPolarHBondContact OH-CE2 3.25Å; Y905-L1002 HydrophobicContact CE2-CD2 4.36Å; Y905-L1005 HydrophobicContact CE2-CD1 4.04Å
906	R	81.1	Confident	66.8	Low	37 Å²	37	54.9 Å²	54.9	14%	0.14	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-16.5	-177.4	-62.3	-164.9	-68.7	120.7	-2.8	114.3	H432 R841 K901 N903	H432-R906 HydrophobicContact CB-CG 4.11Å; R841-R906 PolarHBondContact NE-O 3.19Å; R841-R906 PolarHBondContact NH2-O 3.28Å; K901-R906 HydrophobicContact CB-CG 3.85Å; K901-R906 WeakPolarHBondContact O-CD 3.18Å; K901-R906 PolarHBondContact O-NE 2.72Å; N903-R906 PolarHBondContact O-N 2.98Å; N903-R906 PolarHBondContact OD1-NH2 2.75Å
907	Q	68.5	Low	63.5	Low	88 Å²	88	60.1 Å²	60.1	41%	0.411	31%	0.306	S	S	.	.	S	Bend	trans	-106.3	164.7	179.9	-66.8	-176.8	-19.1	0	0	112.2	R841 N903 S909	R841-Q907 PolarHBondContact NH1-O 2.97Å; N903-Q907 PolarHBondContact O-N 2.83Å; Q907-S909 VanDerWaalsContact C-N 3.27Å; Q907-S909 PolarHBondContact O-N 2.66Å
908	Y	55.8	Low	60.1	Low	114 Å²	114	64.1 Å²	64.1	45%	0.447	33%	0.327	S	S	.	.	S	Bend	trans	-83.3	1	-177.5	-119.6	-60.9	0	0	0	113.9	F600 R841	F600-Y908 HydrophobicContact CE1-CE2 4.01Å; F600-Y908 VanDerWaalsContact CE1-OH 3.25Å; F600-Y908 WeakPolarHBondContact CE1-OH 3.11Å; F600-Y908 HydrophobicContact CE2-CE2 4.4Å; F600-Y908 AromaticContact CZ-CE2 3.64Å; F600-Y908 HydrophobicContact CZ-CE2 3.64Å; F600-Y908 AromaticContact CZ-CZ 3.9Å; F600-Y908 WeakPolarHBondContact CZ-OH 3.15Å; R841-Y908 VanDerWaalsContact NH1-CE2 3.33Å
909	S	49	Very low	56.7	Low	70 Å²	70	71.8 Å²	71.8	49%	0.49	37%	0.367	S	S	.	.			trans	-102.2	53.5	-175.4	42.6	0	0	0	0	112.4	Q907 F911	Q907-S909 VanDerWaalsContact C-N 3.27Å; Q907-S909 PolarHBondContact O-N 2.66Å; S909-F911 PolarHBondContact O-N 3.4Å; S909-F911 VanDerWaalsContact O-N 3.13Å
910	S	44.2	Very low	53.3	Low	48 Å²	48	78.2 Å²	78.2	34%	0.336	40%	0.401	S	S	.	.			trans	-67.6	105.7	-172.7	-48.5	0	0	0	0	113.4	F912	S910-F912 PolarHBondContact O-N 3.16Å
911	F	41.5	Very low	50	Low	90 Å²	90	85.2 Å²	85.2	40%	0.395	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-4.6	171.6	-91.5	-100.6	0	0	0	114.4	L904 S909 T913 I922 R925	L904-F911 HydrophobicContact CD1-CB 3.78Å; S909-F911 PolarHBondContact O-N 3.4Å; S909-F911 VanDerWaalsContact O-N 3.13Å; F911-T913 VanDerWaalsContact C-N 3.32Å; F911-T913 PolarHBondContact O-N 3.29Å; F911-I922 HydrophobicContact CE2-CD1 4.45Å; F911-I922 HydrophobicContact CZ-CD1 4.31Å; F911-I922 HydrophobicContact CZ-CG2 4.12Å; F911-R925 HydrophobicContact CZ-CG 4.25Å
912	F	39.2	Very low	47.1	Very low	78 Å²	78	89.3 Å²	89.3	34%	0.342	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	12.8	-170.2	-99.9	-69.2	0	0	0	116.4	L904 Y905 S910 P914	L904-F912 HydrophobicContact CD1-CD2 4.17Å; L904-F912 HydrophobicContact CD2-CD2 3.79Å; L904-F912 HydrophobicContact CD2-CE2 3.48Å; L904-F912 VanDerWaalsContact CD2-CE2 3.48Å; L904-F912 HydrophobicContact CG-CD2 3.88Å; L904-F912 HydrophobicContact CG-CE2 3.97Å; Y905-F912 AromaticContact CE1-CD2 4Å; Y905-F912 HydrophobicContact CE1-CD2 4Å; Y905-F912 AromaticContact CE1-CE2 3.55Å; Y905-F912 HydrophobicContact CE1-CE2 3.55Å; Y905-F912 HydrophobicContact CE1-CZ 4.31Å; Y905-F912 AromaticContact CZ-CE2 3.65Å; Y905-F912 WeakPolarHBondContact OH-CE2 3.25Å; S910-F912 PolarHBondContact O-N 3.16Å; F912-P914 WeakPolarHBondContact O-CD 3.43Å
913	T	34.3	Very low	44.6	Very low	87 Å²	87	95.4 Å²	95.4	53%	0.534	50%	0.497	S	S	.	.			trans	-99.7	106.1	168.5	50.4	0	0	0	0	110.6	F911 Y915	F911-T913 VanDerWaalsContact C-N 3.32Å; F911-T913 PolarHBondContact O-N 3.29Å; T913-Y915 PolarHBondContact O-N 3.32Å
914	P	29.1	Very low	42.6	Very low	85 Å²	85	101.1 Å²	101.1	55%	0.552	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	12.6	-170.3	-21.5	34.9	0	0	0	116.9	F912 N1456	F912-P914 WeakPolarHBondContact O-CD 3.43Å; P914-N1456 PolarHBondContact O-ND2 3.27Å
915	Y	27.9	Very low	41.2	Very low	181 Å²	181	105.8 Å²	105.8	71%	0.71	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	-3.4	-161.3	-79	-73.6	0	0	0	117.3	T913	T913-Y915 PolarHBondContact O-N 3.32Å
916	K	29.5	Very low	39.8	Very low	175 Å²	175	107 Å²	107	76%	0.761	55%	0.547	S	S	*	.			trans	-136.9	29.8	-178.1	-72.4	-168.5	176.4	177.1	0	116.4	N918	K916-N918 PolarHBondContact O-N 3.02Å
917	S	28.9	Very low	38.4	Very low	112 Å²	112	110 Å²	110	78%	0.783	57%	0.571	S	S	*	*			trans	-75.7	52.6	173.7	-175.9	0	0	0	0	113.6
918	N	26	Very low	38	Very low	86 Å²	86	108 Å²	108	46%	0.46	56%	0.563	S	S	.	*	S	Bend	trans	-137	14.9	-174.8	-120.3	-10.3	0	0	0	114.1	K916 E1460 K1463	K916-N918 PolarHBondContact O-N 3.02Å; N918-E1460 PolarHBondContact ND2-OE1 3.46Å; N918-E1460 PolarHBondContact ND2-OE2 2.91Å; N918-K1463 PolarHBondContact ND2-NZ 2.9Å
919	L	26.7	Very low	38.3	Very low	160 Å²	160	103.3 Å²	103.3	84%	0.838	55%	0.546	S	S	*	.	S	Bend	trans	-132	4	-175.2	-90	169.6	0	0	0	115.5
920	L	25.8	Very low	39.2	Very low	139 Å²	139	101.5 Å²	101.5	73%	0.728	53%	0.532	S	S	*	.			trans	-136	131.4	173.9	-69.7	172.4	0	0	0	110.4	I922	L920-I922 HydrophobicContact CB-CD1 3.92Å; L920-I922 HydrophobicContact CB-CG1 3.6Å; L920-I922 HydrophobicContact CD1-CD1 4.07Å; L920-I922 PolarHBondContact O-N 2.88Å
921	N	25.3	Very low	40.6	Very low	171 Å²	171	99.5 Å²	99.5	91%	0.914	52%	0.518	S	S	*	.			trans	-77.5	60.3	176.2	-69.6	-37.8	0	0	0	111	T923	N921-T923 PolarHBondContact O-N 2.83Å
922	I	31.8	Very low	42.7	Very low	88 Å²	88	97.2 Å²	97.2	45%	0.451	51%	0.509	S	S	.	.			trans	-79.3	91	-175.7	-52.4	-177	0	0	0	110.1	F911 L920 E924	F911-I922 HydrophobicContact CE2-CD1 4.45Å; F911-I922 HydrophobicContact CZ-CD1 4.31Å; F911-I922 HydrophobicContact CZ-CG2 4.12Å; L920-I922 HydrophobicContact CB-CD1 3.92Å; L920-I922 HydrophobicContact CB-CG1 3.6Å; L920-I922 HydrophobicContact CD1-CD1 4.07Å; L920-I922 PolarHBondContact O-N 2.88Å; I922-E924 WeakPolarHBondContact CG2-O 3.34Å
923	T	34.6	Very low	44.8	Very low	137 Å²	137	95 Å²	95	84%	0.84	50%	0.502	S	S	*	.			trans	-71.9	-16	165.3	42.7	0	0	0	0	112.8	N921	N921-T923 PolarHBondContact O-N 2.83Å
924	E	39.8	Very low	47.5	Very low	157 Å²	157	91 Å²	91	73%	0.734	48%	0.477	S	S	*	.			trans	-115.4	94.7	-173.3	-67.6	176.9	-172	0	0	111.2	I922	I922-E924 WeakPolarHBondContact CG2-O 3.34Å
925	R	46.9	Very low	50.4	Low	117 Å²	117	91 Å²	91	44%	0.442	47%	0.466	S	S	.	.			trans	-67.7	137	159.6	-71.1	-173.8	-179.4	-159	-2.2	108.3	F911	F911-R925 HydrophobicContact CZ-CG 4.25Å
926	P	49.9	Very low	53.5	Low	27 Å²	27	82.5 Å²	82.5	18%	0.175	43%	0.433	C	S	.	.			trans	-52.5	139.7	173	-26	34.2	0	0	0	110.9	D928 T929	P926-D928 PolarHBondContact O-N 3.44Å; P926-D928 VanDerWaalsContact O-N 3.14Å; P926-T929 PolarHBondContact O-N 3.05Å; P926-T929 PolarHBondContact O-OG1 3.19Å
927	P	52.1	Low	56.5	Low	99 Å²	99	75.8 Å²	75.8	64%	0.643	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-55.8	-36.7	-172.2	19.6	-31.5	0	0	0	112.7	T929 T930	P927-T929 PolarHBondContact O-N 3.05Å; P927-T930 WeakPolarHBondContact O-CB 3.49Å; P927-T930 PolarHBondContact O-N 3.49Å; P927-T930 PolarHBondContact O-OG1 2.7Å
928	D	59.4	Low	59.6	Low	48 Å²	48	70.4 Å²	70.4	26%	0.257	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-49.1	-23.7	172.1	-45.5	33.2	0	0	0	114.6	N903 P926	N903-D928 VanDerWaalsContact CB-OD2 3.28Å; N903-D928 WeakPolarHBondContact CB-OD2 3.21Å; N903-D928 PolarHBondContact N-OD2 3.17Å; N903-D928 VanDerWaalsContact ND2-CG 3.31Å; N903-D928 PolarHBondContact ND2-OD1 3.36Å; N903-D928 PolarHBondContact ND2-OD2 2.94Å; P926-D928 PolarHBondContact O-N 3.44Å; P926-D928 VanDerWaalsContact O-N 3.14Å
929	T	62.5	Low	62.7	Low	14 Å²	14	66.5 Å²	66.5	9%	0.086	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-113.2	8.4	-172.6	70.1	0	0	0	0	113	L904 P926 P927 P931 Q1001 L1002	L904-T929 HydrophobicContact CB-CG2 4.46Å; L904-T929 HydrophobicContact CD2-CG2 4.17Å; P926-T929 PolarHBondContact O-N 3.05Å; P926-T929 PolarHBondContact O-OG1 3.19Å; P927-T929 PolarHBondContact O-N 3.05Å; T929-P931 WeakPolarHBondContact O-CD 3.23Å; T929-Q1001 PolarHBondContact O-NE2 3.08Å; T929-L1002 HydrophobicContact CG2-CD1 4.39Å
930	T	68.3	Low	65.8	Low	32 Å²	32	58.9 Å²	58.9	20%	0.196	31%	0.305	C	S	.	.	S	Bend	trans	-70.4	124.1	171.6	57.2	0	0	0	0	109.2	P927 Q932 T1065	P927-T930 WeakPolarHBondContact O-CB 3.49Å; P927-T930 PolarHBondContact O-N 3.49Å; P927-T930 PolarHBondContact O-OG1 2.7Å; T930-Q932 PolarHBondContact O-N 2.87Å; T930-T1065 HydrophobicContact CG2-CG2 4.2Å
931	P	73.6	Confident	68.9	Low	7 Å²	7	52.2 Å²	52.2	5%	0.045	27%	0.271	C	S	.	.			trans	-64.6	138.3	-179.2	-18.4	30.2	0	0	0	110.7	T929 V1000 R1064	T929-P931 WeakPolarHBondContact O-CD 3.23Å; P931-V1000 WeakPolarHBondContact CA-O 3.21Å; P931-R1064 HydrophobicContact CB-CB 4.28Å; P931-R1064 WeakPolarHBondContact O-CB 3.4Å; P931-R1064 PolarHBondContact O-N 3.46Å
932	Q	84.3	Confident	71.9	Confident	41 Å²	41	44.7 Å²	44.7	19%	0.192	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	147	-179.2	-73.3	165.2	-34.3	0	0	110.7	T930 V1000 F1030 I1061 T1062 T1063	T930-Q932 PolarHBondContact O-N 2.87Å; Q932-V1000 PolarHBondContact N-O 3.26Å; Q932-V1000 PolarHBondContact O-N 2.99Å; Q932-F1030 HydrophobicContact CB-CE1 4.16Å; Q932-F1030 HydrophobicContact CB-CZ 4.09Å; Q932-I1061 HydrophobicContact CB-CG2 4.28Å; Q932-I1061 HydrophobicContact CG-CG2 4.47Å; Q932-T1062 CarbonylContact C-O 3.4Å; Q932-T1062 WeakPolarHBondContact CA-O 3.39Å; Q932-T1063 HydrophobicContact CG-CG2 3.96Å
933	V	84.9	Confident	74.5	Confident	32 Å²	32	42 Å²	42	19%	0.194	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117.9	173.6	-179.9	0	0	0	0	108.3	E997 F998 I1061 T1062	V933-E997 HydrophobicContact CG1-CG 3.8Å; V933-F998 WeakPolarHBondContact CA-O 3.48Å; V933-I1061 WeakPolarHBondContact O-CA 3.28Å; V933-T1062 PolarHBondContact N-O 3.04Å; V933-T1062 PolarHBondContact O-N 3.38Å
934	L	91.3	Very high	77	Confident	2 Å²	2	36 Å²	36	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.4	172.1	167.2	65.3	0	0	0	108.5	I965 E997 F998 V1008 F1030 L1033 I1059 I1061	L934-I965 HydrophobicContact CD2-CD1 4.15Å; L934-E997 CarbonylContact O-C 3.57Å; L934-E997 WeakPolarHBondContact O-CA 3.45Å; L934-F998 HydrophobicContact CB-CB 4.38Å; L934-F998 HydrophobicContact CD2-CD2 4.44Å; L934-F998 PolarHBondContact N-O 3.46Å; L934-F998 PolarHBondContact O-N 2.69Å; L934-V1008 HydrophobicContact CD2-CG2 3.82Å; L934-F1030 HydrophobicContact CB-CE2 3.7Å; L934-F1030 HydrophobicContact CB-CZ 4.03Å; L934-F1030 HydrophobicContact CD2-CD2 4.37Å; L934-F1030 HydrophobicContact CD2-CE2 3.91Å; L934-F1030 HydrophobicContact CG-CE2 4.34Å; L934-L1033 HydrophobicContact CD1-CD1 4.45Å; L934-L1033 HydrophobicContact CD2-CD1 4.4Å; L934-I1059 HydrophobicContact CD1-CG2 3.93Å; L934-I1061 HydrophobicContact CD1-CG1 3.91Å
935	R	88.4	Confident	79.2	Confident	86 Å²	86	31 Å²	31	33%	0.325	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.1	160.6	-169.5	176.5	-62.7	139.8	13.6	108.7	T995 F996 E997 T1060 R1079	R935-T995 HydrophobicContact CG-CG2 3.8Å; R935-F996 WeakPolarHBondContact CA-O 2.99Å; R935-F996 WeakPolarHBondContact CG-O 3.31Å; R935-E997 IonicContact CZ-OE2 3.53Å; R935-E997 VanDerWaalsContact CZ-OE2 3.29Å; R935-E997 IonicContact NE-OE2 3.56Å; R935-E997 PolarHBondContact NE-OE2 3.2Å; R935-E997 IonicContact NH2-OE2 2.75Å; R935-E997 PolarHBondContact NH2-OE2 3.2Å; R935-T1060 PolarHBondContact N-O 2.85Å; R935-T1060 PolarHBondContact O-N 3.11Å; R935-R1079 VanDerWaalsContact NH2-NH2 3.1Å
936	L	92.9	Very high	80.8	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	119.4	-177.8	174.9	70.4	0	0	0	108.4	I938 V963 F996 F1010 V1057 H1058 I1059	L936-I938 HydrophobicContact CD1-CD1 4.39Å; L936-I938 HydrophobicContact CD2-CD1 4.06Å; L936-I938 HydrophobicContact CG-CD1 4.05Å; L936-V963 HydrophobicContact CD2-CB 4.21Å; L936-V963 HydrophobicContact CD2-CG1 3.6Å; L936-V963 HydrophobicContact CD2-CG2 3.7Å; L936-F996 PolarHBondContact N-O 3.06Å; L936-F996 PolarHBondContact O-N 2.75Å; L936-F1010 HydrophobicContact CD1-CE1 4.04Å; L936-F1010 HydrophobicContact CD1-CZ 4.17Å; L936-F1010 HydrophobicContact CD2-CE1 3.77Å; L936-F1010 HydrophobicContact CD2-CZ 4.13Å; L936-F1010 HydrophobicContact CG-CE1 4.48Å; L936-V1057 HydrophobicContact CD1-CB 4Å; L936-V1057 HydrophobicContact CD1-CG1 4.49Å; L936-V1057 HydrophobicContact CD1-CG2 4.24Å; L936-H1058 CarbonylContact C-O 3.57Å; L936-H1058 WeakPolarHBondContact CA-O 3.28Å; L936-I1059 HydrophobicContact CD1-CD1 4.41Å; L936-I1059 HydrophobicContact CD1-CG1 3.73Å
937	K	92.2	Very high	82.3	Confident	34 Å²	34	27.7 Å²	27.7	15%	0.148	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.9	170.3	-176.8	-169.1	-176.8	-158.2	0	109.3	V939 E993 D994 T995 V1057 H1058	K937-V939 HydrophobicContact CD-CG2 4.19Å; K937-V939 HydrophobicContact CG-CG2 4.34Å; K937-E993 VanDerWaalsContact CE-CD 3.5Å; K937-E993 WeakPolarHBondContact CE-O 3.39Å; K937-E993 VanDerWaalsContact CE-OE1 3.23Å; K937-E993 WeakPolarHBondContact CE-OE1 3.31Å; K937-E993 WeakPolarHBondContact CE-OE2 2.88Å; K937-E993 IonicContact NZ-OE1 3.19Å; K937-E993 PolarHBondContact NZ-OE1 2.7Å; K937-E993 IonicContact NZ-OE2 3.08Å; K937-E993 PolarHBondContact NZ-OE2 3.28Å; K937-D994 CarbonylContact C-O 3.33Å; K937-D994 VanDerWaalsContact CA-O 3.3Å; K937-D994 WeakPolarHBondContact CA-O 3.3Å; K937-D994 WeakPolarHBondContact CG-O 3.17Å; K937-T995 HydrophobicContact CB-CG2 4.45Å; K937-V1057 CarbonylContact O-C 3.56Å; K937-V1057 VanDerWaalsContact O-CA 3.26Å; K937-V1057 WeakPolarHBondContact O-CA 3.36Å; K937-V1057 WeakPolarHBondContact O-CB 3.41Å; K937-H1058 HydrophobicContact CB-CB 4.21Å; K937-H1058 PolarHBondContact N-O 3.27Å; K937-H1058 PolarHBondContact O-N 3.47Å
938	I	93.9	Very high	83.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114	169.8	-52.1	-55.5	0	0	0	106.8	L936 V961 V963 T977 F992 E993 D994 F996 F1010 V1057	L936-I938 HydrophobicContact CD1-CD1 4.39Å; L936-I938 HydrophobicContact CD2-CD1 4.06Å; L936-I938 HydrophobicContact CG-CD1 4.05Å; I938-V961 HydrophobicContact CD1-CG1 4.44Å; I938-V961 HydrophobicContact CG1-CG1 4.49Å; I938-V961 HydrophobicContact CG2-CB 4.27Å; I938-V961 HydrophobicContact CG2-CG2 4.04Å; I938-V963 HydrophobicContact CD1-CG2 3.99Å; I938-V963 HydrophobicContact CG1-CG2 4.39Å; I938-T977 HydrophobicContact CB-CG2 3.97Å; I938-T977 HydrophobicContact CG1-CG2 4.03Å; I938-T977 HydrophobicContact CG2-CG2 4.13Å; I938-F992 HydrophobicContact CB-CB 4.41Å; I938-F992 HydrophobicContact CG2-CB 4.07Å; I938-F992 HydrophobicContact CG2-CD2 3.68Å; I938-F992 HydrophobicContact CG2-CE2 4.42Å; I938-F992 HydrophobicContact CG2-CG 4.02Å; I938-E993 CarbonylContact O-C 3.58Å; I938-E993 WeakPolarHBondContact O-CA 3.39Å; I938-E993 PolarHBondContact O-N 2.65Å; I938-D994 PolarHBondContact N-O 3.08Å; I938-D994 PolarHBondContact O-N 3.16Å; I938-F996 HydrophobicContact CG1-CD2 4.32Å; I938-F996 HydrophobicContact CG1-CE2 3.74Å; I938-F1010 HydrophobicContact CD1-CD1 4.27Å; I938-F1010 HydrophobicContact CD1-CE1 4.07Å; I938-V1057 HydrophobicContact CD1-CG1 3.66Å
939	V	91.7	Very high	83.8	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.018	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-64.7	-173.8	-174.8	0	0	0	0	109.2	E341 K937 F992 E993 F1037 F1056	E341-V939 HydrophobicContact CB-CG1 3.91Å; E341-V939 HydrophobicContact CG-CG1 3.76Å; K937-V939 HydrophobicContact CD-CG2 4.19Å; K937-V939 HydrophobicContact CG-CG2 4.34Å; V939-F992 PolarHBondContact O-N 3.34Å; V939-E993 WeakPolarHBondContact CG1-OE1 3.3Å; V939-E993 PolarHBondContact O-N 2.85Å; V939-F1037 HydrophobicContact CG2-CE1 4.46Å; V939-F1056 HydrophobicContact CB-CD1 3.79Å; V939-F1056 HydrophobicContact CB-CE1 4.44Å; V939-F1056 HydrophobicContact CB-CG 4.47Å; V939-F1056 WeakPolarHBondContact CB-O 3.49Å; V939-F1056 HydrophobicContact CG1-CD1 3.75Å; V939-F1056 HydrophobicContact CG1-CE1 4.14Å; V939-F1056 HydrophobicContact CG2-CD1 4.31Å; V939-F1056 PolarHBondContact N-O 3.25Å
940	S	92	Very high	84.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	171.4	-177.1	56.2	0	0	0	0	111.9	R339 E341 Q942 A990 F1056	R339-S940 PolarHBondContact NH2-OG 3.04Å; E341-S940 WeakPolarHBondContact OE1-CB 3.42Å; E341-S940 PolarHBondContact OE1-OG 3.24Å; S940-Q942 PolarHBondContact OG-NE2 2.86Å; S940-A990 CarbonylContact C-O 3.59Å; S940-A990 WeakPolarHBondContact CA-O 3.48Å; S940-A990 WeakPolarHBondContact CB-O 3.43Å; S940-F1056 PolarHBondContact N-O 2.8Å; S940-F1056 PolarHBondContact O-N 3.26Å
941	A	91.8	Very high	84.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	143.6	172	0	0	0	0	0	111.6	L944 N989 A990 F992 T1054 L1055	A941-L944 HydrophobicContact CB-CD1 3.79Å; A941-L944 HydrophobicContact CB-CD2 4.16Å; A941-L944 HydrophobicContact CB-CG 4.05Å; A941-N989 CarbonylContact O-C 3.54Å; A941-N989 VanDerWaalsContact O-CA 3.29Å; A941-N989 WeakPolarHBondContact O-CA 3.45Å; A941-A990 HydrophobicContact CB-CB 4.35Å; A941-A990 PolarHBondContact N-O 3.33Å; A941-A990 PolarHBondContact O-N 3Å; A941-F992 HydrophobicContact CB-CE2 3.79Å; A941-F992 HydrophobicContact CB-CZ 4.49Å; A941-T1054 CarbonylContact C-O 3.49Å; A941-T1054 VanDerWaalsContact CA-O 3.27Å; A941-T1054 WeakPolarHBondContact CA-O 3.47Å; A941-L1055 HydrophobicContact CB-CD2 3.5Å; A941-L1055 VanDerWaalsContact CB-CD2 3.5Å
942	Q	87.9	Confident	83.7	Confident	12 Å²	12	34.8 Å²	34.8	6%	0.056	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.5	-172.5	-59.9	70.4	52.9	0	0	110.5	R339 S940 L944 Y988 N989 A1053 T1054	R339-Q942 VanDerWaalsContact NH2-NE2 3.17Å; S940-Q942 PolarHBondContact OG-NE2 2.86Å; Q942-L944 VanDerWaalsContact C-N 3.28Å; Q942-L944 PolarHBondContact O-N 3.17Å; Q942-Y988 WeakPolarHBondContact CA-O 3.34Å; Q942-N989 PolarHBondContact NE2-OD1 3.36Å; Q942-A1053 WeakPolarHBondContact O-CA 3.31Å; Q942-T1054 PolarHBondContact N-O 3.22Å; Q942-T1054 PolarHBondContact O-N 2.89Å; Q942-T1054 VanDerWaalsContact O-N 3.13Å; Q942-T1054 PolarHBondContact OE1-O 3.28Å; Q942-T1054 PolarHBondContact OE1-OG1 2.76Å
943	Q	85.8	Confident	82	Confident	33 Å²	33	43.4 Å²	43.4	15%	0.154	22%	0.221	C	C	.	.			trans	46.2	44.2	173.7	-60.9	-139.1	33.6	0	0	115.4	S300 L301 S302 P945 G987 Y988 L1052 A1053	S300-Q943 PolarHBondContact O-NE2 2.95Å; L301-Q943 VanDerWaalsContact C-NE2 3.25Å; S302-Q943 VanDerWaalsContact N-NE2 3.13Å; Q943-P945 VanDerWaalsContact O-CD 3.31Å; Q943-P945 WeakPolarHBondContact O-CD 3.21Å; Q943-G987 CarbonylContact C-O 3.58Å; Q943-G987 PolarHBondContact N-O 3.38Å; Q943-Y988 PolarHBondContact N-O 3.4Å; Q943-L1052 HydrophobicContact CB-CB 4.17Å; Q943-L1052 HydrophobicContact CG-CB 4.15Å; Q943-L1052 VanDerWaalsContact NE2-CD1 3.33Å; Q943-A1053 VanDerWaalsContact O-CB 3.31Å; Q943-A1053 WeakPolarHBondContact O-CB 3.37Å
944	L	87.9	Confident	80.9	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.052	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-68	117.7	172.9	-63.6	-176.8	0	0	0	109.9	A941 Q942 I957 P959 G987 V1012 I1023 L1042	A941-L944 HydrophobicContact CB-CD1 3.79Å; A941-L944 HydrophobicContact CB-CD2 4.16Å; A941-L944 HydrophobicContact CB-CG 4.05Å; Q942-L944 VanDerWaalsContact C-N 3.28Å; Q942-L944 PolarHBondContact O-N 3.17Å; L944-I957 HydrophobicContact CB-CD1 3.74Å; L944-P959 HydrophobicContact CD1-CB 3.58Å; L944-P959 HydrophobicContact CD1-CG 3.82Å; L944-G987 PolarHBondContact N-O 3.31Å; L944-V1012 HydrophobicContact CD1-CG1 3.81Å; L944-V1012 HydrophobicContact CD2-CG1 4.03Å; L944-I1023 HydrophobicContact CB-CG2 4.1Å; L944-I1023 HydrophobicContact CD2-CG2 4.13Å; L944-L1042 HydrophobicContact CD2-CD1 3.49Å; L944-L1042 VanDerWaalsContact CD2-CD1 3.49Å
945	P	85	Confident	79.6	Confident	52 Å²	52	50 Å²	50	34%	0.338	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-72.3	160	176.2	31.7	-36.9	0	0	0	111.3	Q943 I1023 I1050	Q943-P945 VanDerWaalsContact O-CD 3.31Å; Q943-P945 WeakPolarHBondContact O-CD 3.21Å; P945-I1023 HydrophobicContact CG-CG2 4.13Å; P945-I1050 HydrophobicContact CG-CD1 4.48Å; P945-I1050 HydrophobicContact CG-CG2 3.94Å
946	K	80.8	Confident	78.8	Confident	68 Å²	68	49.7 Å²	49.7	30%	0.296	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-65.5	138.3	168.9	-172.9	172.4	-179.4	169.2	0	110.5	R948 S952 G954 I957	K946-R948 PolarHBondContact O-N 3.25Å; K946-S952 WeakPolarHBondContact CE-OG 3.36Å; K946-S952 PolarHBondContact NZ-O 3.08Å; K946-S952 PolarHBondContact NZ-OG 3.31Å; K946-G954 PolarHBondContact NZ-O 2.76Å; K946-I957 HydrophobicContact CB-CG2 4.33Å; K946-I957 HydrophobicContact CG-CG2 4.18Å
947	P	80.9	Confident	78.3	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.039	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-52.7	136.8	179.3	-28.3	33.2	0	0	0	114	G949 S950 D1014 A1017 D1020 F1022 I1023	P947-G949 PolarHBondContact O-N 2.69Å; P947-S950 PolarHBondContact O-N 2.93Å; P947-D1014 HydrophobicContact CG-CB 3.81Å; P947-A1017 HydrophobicContact CG-CB 4.47Å; P947-D1020 VanDerWaalsContact CB-O 3.24Å; P947-D1020 WeakPolarHBondContact CB-O 3.4Å; P947-F1022 WeakPolarHBondContact CA-O 3.38Å; P947-F1022 WeakPolarHBondContact CB-O 3.48Å; P947-I1023 HydrophobicContact CG-CG1 3.82Å
948	R	74.7	Confident	78	Confident	144 Å²	144	50.6 Å²	50.6	54%	0.543	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	102	-179.2	-78.2	177.8	168.1	173.6	-7.9	110.7	K946 D1045	K946-R948 PolarHBondContact O-N 3.25Å; R948-D1045 IonicContact CZ-OD1 2.69Å; R948-D1045 IonicContact NH1-OD1 2.69Å; R948-D1045 PolarHBondContact NH1-OD1 3.11Å
949	G	68.6	Low	77.9	Confident	48 Å²	48	50.6 Å²	50.6	50%	0.495	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	101	6.6	-179.2	0	0	0	0	0	115.1	P947 V951	P947-G949 PolarHBondContact O-N 2.69Å; G949-V951 PolarHBondContact O-N 3.02Å
950	S	73	Confident	77.9	Confident	16 Å²	16	51.8 Å²	51.8	11%	0.112	28%	0.281	C	S	.	.			trans	-67.7	123.2	170.8	173.3	0	0	0	0	111.3	P947 S952 I1018	P947-S950 PolarHBondContact O-N 2.93Å; S950-S952 VanDerWaalsContact C-N 3.35Å; S950-S952 PolarHBondContact OG-OG 2.83Å; S950-I1018 WeakPolarHBondContact CA-O 3.47Å
951	V	68.6	Low	78	Confident	114 Å²	114	51.8 Å²	51.8	69%	0.691	28%	0.281	S	S	*	.			trans	-92.6	10.3	-173.2	-146.6	0	0	0	0	112.9	G949 I1018	G949-V951 PolarHBondContact O-N 3.02Å; V951-I1018 PolarHBondContact N-O 2.8Å
952	S	60.6	Low	78.1	Confident	27 Å²	27	52.1 Å²	52.1	19%	0.189	28%	0.283	C	S	.	.			trans	-66.5	143.7	-174	64.4	0	0	0	0	113.3	K946 S950 G954	K946-S952 WeakPolarHBondContact CE-OG 3.36Å; K946-S952 PolarHBondContact NZ-O 3.08Å; K946-S952 PolarHBondContact NZ-OG 3.31Å; S950-S952 VanDerWaalsContact C-N 3.35Å; S950-S952 PolarHBondContact OG-OG 2.83Å; S952-G954 PolarHBondContact O-N 2.95Å; S952-G954 VanDerWaalsContact O-N 3.08Å
953	K	49.8	Very low	78.5	Confident	222 Å²	222	51.5 Å²	51.5	97%	0.965	28%	0.28	S	S	*	.	S	Bend	trans	-78	85.9	175	-79.2	-175.4	174	177.3	0	111.5
954	G	60.5	Low	78.8	Confident	37 Å²	37	50.6 Å²	50.6	38%	0.381	28%	0.276	S	S	.	.	S	Bend	trans	148.2	166.6	171.8	0	0	0	0	0	113.4	K946 S952	K946-G954 PolarHBondContact NZ-O 2.76Å; S952-G954 PolarHBondContact O-N 2.95Å; S952-G954 VanDerWaalsContact O-N 3.08Å
955	D	64.5	Low	79.1	Confident	135 Å²	135	50.1 Å²	50.1	72%	0.722	27%	0.273	S	S	*	.	S	Bend	trans	-95.1	-2.4	178	-60.4	-32.6	0	0	0	113
956	T	71.4	Confident	79.5	Confident	81 Å²	81	47.8 Å²	47.8	50%	0.497	26%	0.258	S	S	.	.			trans	-75.2	131.8	172.5	-44.7	0	0	0	0	110.1
957	I	82.1	Confident	79.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	24%	0.244	C	C	.	.			trans	-115.8	157.5	167.2	54.1	164.8	0	0	0	109.4	L944 K946 P959 S986 I1023	L944-I957 HydrophobicContact CB-CD1 3.74Å; K946-I957 HydrophobicContact CB-CG2 4.33Å; K946-I957 HydrophobicContact CG-CG2 4.18Å; I957-P959 WeakPolarHBondContact O-CD 3.39Å; I957-S986 WeakPolarHBondContact O-CB 3.48Å; I957-S986 PolarHBondContact O-OG 3.1Å; I957-I1023 HydrophobicContact CD1-CD1 3.74Å
958	E	86.3	Confident	79.8	Confident	52 Å²	52	45.1 Å²	45.1	24%	0.243	25%	0.247	C	C	.	.			trans	-119.2	80.2	176.2	-68.3	-173.5	-136.6	0	0	109.3	T979 A982 D1014 D1015 H1016	E958-T979 HydrophobicContact CB-CG2 3.99Å; E958-T979 VanDerWaalsContact O-CG2 3.29Å; E958-T979 WeakPolarHBondContact O-CG2 3.37Å; E958-A982 HydrophobicContact CG-CB 3.91Å; E958-D1014 PolarHBondContact N-OD1 3.05Å; E958-D1015 PolarHBondContact O-N 2.94Å; E958-H1016 IonicContact OE1-CD2 3.6Å; E958-H1016 PolarHBondContact OE1-CD2 3.24Å; E958-H1016 IonicContact OE2-CD2 3.01Å; E958-H1016 IonicContact OE2-NE2 2.7Å
959	P	91.1	Very high	79.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	148	-168.2	30.6	-34.4	0	0	0	112.2	L944 I957 A980 S986 A990 F992 V1012 L1013 I1023	L944-P959 HydrophobicContact CD1-CB 3.58Å; L944-P959 HydrophobicContact CD1-CG 3.82Å; I957-P959 WeakPolarHBondContact O-CD 3.39Å; P959-A980 HydrophobicContact CG-CB 4.08Å; P959-A980 PolarHBondContact O-N 3.13Å; P959-S986 WeakPolarHBondContact CD-OG 3.33Å; P959-A990 HydrophobicContact CG-CB 3.78Å; P959-F992 HydrophobicContact CG-CZ 4.42Å; P959-F992 WeakPolarHBondContact O-CE1 3.46Å; P959-V1012 HydrophobicContact CB-CG1 4.34Å; P959-L1013 CarbonylContact C-O 3.58Å; P959-L1013 VanDerWaalsContact CA-O 3.26Å; P959-L1013 WeakPolarHBondContact CA-O 3.35Å; P959-I1023 HydrophobicContact CB-CD1 4.1Å
960	Y	92.7	Very high	80	Confident	28 Å²	28	38.5 Å²	38.5	11%	0.11	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.6	162.5	68.2	-81.3	0	0	0	110.4	V962 R976 L1013 D1015	Y960-V962 HydrophobicContact CD2-CG2 3.89Å; Y960-V962 HydrophobicContact CE2-CG2 3.55Å; Y960-R976 HydrophobicContact CD2-CB 4.33Å; Y960-L1013 HydrophobicContact CD1-CB 4.07Å; Y960-L1013 VanDerWaalsContact CD1-O 3.3Å; Y960-L1013 WeakPolarHBondContact CD1-O 3.27Å; Y960-L1013 HydrophobicContact CE1-CB 3.52Å; Y960-L1013 HydrophobicContact CE2-CB 4.06Å; Y960-L1013 HydrophobicContact CE2-CD1 3.92Å; Y960-L1013 PolarHBondContact N-O 2.96Å; Y960-L1013 PolarHBondContact O-N 3.12Å; Y960-D1015 HydrophobicContact CD1-CB 3.75Å; Y960-D1015 HydrophobicContact CE1-CB 3.84Å; Y960-D1015 WeakPolarHBondContact CE1-OD1 3.48Å
961	V	94.8	Very high	80.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129	178.2	-175.2	0	0	0	0	109.5	I938 V963 R976 T977 F992 V1011 V1012 L1055	I938-V961 HydrophobicContact CD1-CG1 4.44Å; I938-V961 HydrophobicContact CG1-CG1 4.49Å; I938-V961 HydrophobicContact CG2-CB 4.27Å; I938-V961 HydrophobicContact CG2-CG2 4.04Å; V961-V963 HydrophobicContact CG1-CG2 4.38Å; V961-R976 CarbonylContact O-C 3.37Å; V961-R976 WeakPolarHBondContact O-CA 3.5Å; V961-T977 HydrophobicContact CB-CG2 3.94Å; V961-T977 PolarHBondContact N-OG1 3.45Å; V961-T977 PolarHBondContact O-N 2.99Å; V961-F992 HydrophobicContact CG2-CD2 4.45Å; V961-F992 HydrophobicContact CG2-CE1 4.33Å; V961-F992 HydrophobicContact CG2-CE2 3.95Å; V961-F992 HydrophobicContact CG2-CZ 3.88Å; V961-V1011 CarbonylContact C-O 3.5Å; V961-V1011 WeakPolarHBondContact CA-O 3.24Å; V961-V1012 HydrophobicContact CG2-CG2 4.42Å; V961-L1055 HydrophobicContact CG1-CD1 3.88Å; V961-L1055 HydrophobicContact CG2-CD1 4.38Å; V961-L1055 HydrophobicContact CG2-CD2 3.9Å
962	V	93.9	Very high	81.2	Confident	7 Å²	7	32.6 Å²	32.6	4%	0.042	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.8	167	-174	0	0	0	0	108.3	Y960 E964 E974 R976 V1011 L1013	Y960-V962 HydrophobicContact CD2-CG2 3.89Å; Y960-V962 HydrophobicContact CE2-CG2 3.55Å; V962-E964 HydrophobicContact CG1-CG 3.88Å; V962-E974 HydrophobicContact CG1-CG 3.83Å; V962-R976 HydrophobicContact CG2-CB 4.02Å; V962-V1011 HydrophobicContact CB-CB 4.41Å; V962-V1011 PolarHBondContact N-O 3.01Å; V962-V1011 PolarHBondContact O-N 3.03Å; V962-L1013 HydrophobicContact CG2-CD1 3.91Å
963	V	95.1	Very high	82.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.5	171.3	-178.7	0	0	0	0	108.3	L936 I938 V961 E974 Q975 F996 F998 V1008 R1009 F1010	L936-V963 HydrophobicContact CD2-CB 4.21Å; L936-V963 HydrophobicContact CD2-CG1 3.6Å; L936-V963 HydrophobicContact CD2-CG2 3.7Å; I938-V963 HydrophobicContact CD1-CG2 3.99Å; I938-V963 HydrophobicContact CG1-CG2 4.39Å; V961-V963 HydrophobicContact CG1-CG2 4.38Å; V963-E974 WeakPolarHBondContact O-CA 3.37Å; V963-Q975 PolarHBondContact N-O 3.43Å; V963-Q975 PolarHBondContact O-N 3.34Å; V963-F996 HydrophobicContact CB-CD2 4.26Å; V963-F996 HydrophobicContact CB-CE2 4.4Å; V963-F996 HydrophobicContact CG2-CD2 3.94Å; V963-F996 HydrophobicContact CG2-CE2 3.83Å; V963-F998 HydrophobicContact CB-CE2 4.3Å; V963-F998 HydrophobicContact CB-CZ 4.06Å; V963-F998 HydrophobicContact CG1-CE2 3.78Å; V963-F998 HydrophobicContact CG1-CZ 3.79Å; V963-V1008 HydrophobicContact CG1-CG1 3.98Å; V963-R1009 WeakPolarHBondContact CA-O 3.34Å; V963-F1010 HydrophobicContact CG2-CD1 4.18Å; V963-F1010 HydrophobicContact CG2-CE1 4.44Å
964	E	93.4	Very high	84	Confident	13 Å²	13	22.9 Å²	22.9	6%	0.061	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.8	180	-48.6	179.6	160.4	0	0	109.5	V962 H966 A973 R1009 K1091 W1439	V962-E964 HydrophobicContact CG1-CG 3.88Å; E964-H966 WeakPolarHBondContact CB-NE2 3.4Å; E964-H966 IonicContact OE2-CD2 3.65Å; E964-H966 IonicContact OE2-CE1 2.64Å; E964-H966 IonicContact OE2-NE2 3.44Å; E964-H966 PolarHBondContact OE2-NE2 3.33Å; E964-A973 CarbonylContact C-O 3.57Å; E964-A973 WeakPolarHBondContact CA-O 3.33Å; E964-R1009 HydrophobicContact CB-CB 4.3Å; E964-R1009 PolarHBondContact N-O 2.79Å; E964-R1009 PolarHBondContact O-N 2.98Å; E964-R1009 WeakPolarHBondContact OE2-CD 3.37Å; E964-R1009 IonicContact OE2-NE 2.69Å; E964-K1091 IonicContact OE1-NZ 2.85Å; E964-K1091 PolarHBondContact OE1-NZ 3.44Å; E964-K1091 IonicContact OE2-NZ 3.69Å; E964-W1439 HydrophobicContact CB-CH2 4.35Å
965	I	93	Very high	85.2	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.9	169.1	-46.9	-61.3	0	0	0	107.6	L934 D971 C972 A973 F998 V1000 L1007 V1008 W1439	L934-I965 HydrophobicContact CD2-CD1 4.15Å; I965-D971 WeakPolarHBondContact CB-O 3.28Å; I965-D971 WeakPolarHBondContact CG2-O 3.31Å; I965-C972 WeakPolarHBondContact O-CA 3.38Å; I965-A973 HydrophobicContact CB-CB 4.46Å; I965-A973 HydrophobicContact CG1-CB 4.33Å; I965-A973 PolarHBondContact N-O 3Å; I965-A973 PolarHBondContact O-N 3.07Å; I965-F998 HydrophobicContact CD1-CB 4.35Å; I965-F998 HydrophobicContact CD1-CD1 4.03Å; I965-F998 HydrophobicContact CD1-CD2 4.11Å; I965-F998 HydrophobicContact CD1-CE1 4.26Å; I965-F998 HydrophobicContact CD1-CE2 4.34Å; I965-F998 HydrophobicContact CD1-CG 3.93Å; I965-F998 HydrophobicContact CD1-CZ 4.4Å; I965-F998 HydrophobicContact CG1-CB 4.21Å; I965-F998 HydrophobicContact CG1-CD1 3.41Å; I965-F998 VanDerWaalsContact CG1-CD1 3.41Å; I965-F998 HydrophobicContact CG1-CD2 4.4Å; I965-F998 HydrophobicContact CG1-CE1 3.71Å; I965-F998 HydrophobicContact CG1-CG 3.79Å; I965-F998 HydrophobicContact CG1-CZ 4.32Å; I965-V1000 HydrophobicContact CG2-CG2 4.12Å; I965-L1007 WeakPolarHBondContact CA-O 3.39Å; I965-V1008 HydrophobicContact CD1-CB 4.4Å; I965-V1008 HydrophobicContact CD1-CG1 4.14Å; I965-V1008 HydrophobicContact CD1-CG2 3.8Å; I965-W1439 VanDerWaalsContact O-CH2 3.31Å; I965-W1439 WeakPolarHBondContact O-CH2 3.48Å
966	H	92.5	Very high	86.4	Confident	3 Å²	3	20.9 Å²	20.9	1%	0.014	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	104.8	177.9	-70.1	-103.8	0	0	0	109.2	L862 L885 E964 A1006 L1007 W1439	L862-H966 HydrophobicContact CD1-CB 3.82Å; L885-H966 HydrophobicContact CD2-CB 3.62Å; L885-H966 VanDerWaalsContact CD2-CG 3.49Å; E964-H966 WeakPolarHBondContact CB-NE2 3.4Å; E964-H966 IonicContact OE2-CD2 3.65Å; E964-H966 IonicContact OE2-CE1 2.64Å; E964-H966 IonicContact OE2-NE2 3.44Å; E964-H966 PolarHBondContact OE2-NE2 3.33Å; H966-A1006 CarbonylContact O-C 3.55Å; H966-L1007 HydrophobicContact CB-CB 4.42Å; H966-L1007 PolarHBondContact N-O 3.34Å; H966-L1007 PolarHBondContact O-N 2.95Å; H966-W1439 AromaticContact CE1-CE3 3.72Å; H966-W1439 AromaticContact CE1-CZ3 3.45Å; H966-W1439 VanDerWaalsContact CE1-CZ3 3.45Å; H966-W1439 WeakPolarHBondContact CE1-CZ3 3.44Å; H966-W1439 AromaticContact ND1-CZ3 3.66Å; H966-W1439 AromaticContact NE2-CZ3 3.76Å
967	G	87.8	Confident	87.2	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.01	8%	0.082	C	C	.	.	S	Bend	trans	-143.8	-151	178	0	0	0	0	0	111.8	L1005 R1442	G967-L1005 WeakPolarHBondContact CA-O 3.49Å; G967-R1442 PolarHBondContact O-NE 2.96Å; G967-R1442 PolarHBondContact O-NH2 3.06Å
968	I	81.3	Confident	87.4	Confident	17 Å²	17	21.9 Å²	21.9	9%	0.087	11%	0.111	C	C	.	.	S	Bend	trans	-53.2	152.5	163	49.6	169.1	0	0	0	110.1	A866 V970 D971 Q1001 L1002 L1005	A866-I968 HydrophobicContact CB-CG2 3.95Å; I968-V970 VanDerWaalsContact C-N 3.26Å; I968-V970 HydrophobicContact CB-CG1 4.22Å; I968-V970 HydrophobicContact CD1-CG1 3.41Å; I968-V970 VanDerWaalsContact CD1-CG1 3.41Å; I968-V970 HydrophobicContact CG1-CG1 3.64Å; I968-V970 PolarHBondContact O-N 3.49Å; I968-V970 VanDerWaalsContact O-N 3.08Å; I968-D971 HydrophobicContact CG1-CB 4.24Å; I968-D971 WeakPolarHBondContact CG1-OD2 3.22Å; I968-D971 PolarHBondContact O-N 3.45Å; I968-Q1001 HydrophobicContact CD1-CB 4.44Å; I968-L1002 HydrophobicContact CD1-CB 3.59Å; I968-L1002 HydrophobicContact CD1-CD2 4.2Å; I968-L1002 HydrophobicContact CG1-CB 4.13Å; I968-L1002 HydrophobicContact CG2-CD2 4.13Å; I968-L1005 HydrophobicContact CG2-CD1 4.08Å
969	P	74.9	Confident	87.6	Confident	21 Å²	21	20.8 Å²	20.8	14%	0.136	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-54.4	-38.1	-167.2	-29.4	36.9	0	0	0	114.5	D971 C972 R1442 T1445 G1446	P969-D971 PolarHBondContact O-N 3.32Å; P969-C972 WeakPolarHBondContact O-CB 3.44Å; P969-C972 PolarHBondContact O-N 2.71Å; P969-R1442 HydrophobicContact CB-CG 4.23Å; P969-R1442 HydrophobicContact CG-CG 4.44Å; P969-T1445 HydrophobicContact CB-CG2 4.22Å; P969-T1445 HydrophobicContact CG-CG2 4.38Å; P969-G1446 VanDerWaalsContact CB-CA 3.47Å; P969-G1446 WeakPolarHBondContact O-CA 3.37Å
970	V	72.3	Confident	87.3	Confident	31 Å²	31	20.9 Å²	20.9	19%	0.188	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-52.9	-34.7	172.5	39.7	0	0	0	0	114.4	I968 Q1001 L1450	I968-V970 VanDerWaalsContact C-N 3.26Å; I968-V970 HydrophobicContact CB-CG1 4.22Å; I968-V970 HydrophobicContact CD1-CG1 3.41Å; I968-V970 VanDerWaalsContact CD1-CG1 3.41Å; I968-V970 HydrophobicContact CG1-CG1 3.64Å; I968-V970 PolarHBondContact O-N 3.49Å; I968-V970 VanDerWaalsContact O-N 3.08Å; V970-Q1001 HydrophobicContact CG2-CB 4.17Å; V970-L1450 HydrophobicContact CB-CD1 4.23Å; V970-L1450 HydrophobicContact CB-CD2 4.2Å; V970-L1450 HydrophobicContact CB-CG 3.98Å; V970-L1450 HydrophobicContact CG2-CD1 3.8Å; V970-L1450 HydrophobicContact CG2-CD2 3.47Å; V970-L1450 VanDerWaalsContact CG2-CD2 3.47Å; V970-L1450 HydrophobicContact CG2-CG 3.69Å
971	D	81.9	Confident	86.3	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.021	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-89.6	-6.6	-175.1	-68.7	-12.6	0	0	0	113	I965 I968 P969 A973 Q1001 L1002	I965-D971 WeakPolarHBondContact CB-O 3.28Å; I965-D971 WeakPolarHBondContact CG2-O 3.31Å; I968-D971 HydrophobicContact CG1-CB 4.24Å; I968-D971 WeakPolarHBondContact CG1-OD2 3.22Å; I968-D971 PolarHBondContact O-N 3.45Å; P969-D971 PolarHBondContact O-N 3.32Å; D971-A973 PolarHBondContact O-N 3.25Å; D971-Q1001 WeakPolarHBondContact OD1-CB 3.48Å; D971-Q1001 PolarHBondContact OD1-N 2.77Å; D971-Q1001 PolarHBondContact OD2-N 3.22Å; D971-Q1001 VanDerWaalsContact OD2-N 3.08Å; D971-L1002 PolarHBondContact OD2-N 3.4Å
972	C	84.3	Confident	84.8	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.02	16%	0.16	C	C	.	.			trans	-71.2	125.4	-178.7	-62.1	0	0	0	0	110.5	I965 P969 W1439 R1442 L1443	I965-C972 WeakPolarHBondContact O-CA 3.38Å; P969-C972 WeakPolarHBondContact O-CB 3.44Å; P969-C972 PolarHBondContact O-N 2.71Å; C972-W1439 HydrophobicContact CB-CH2 4.24Å; C972-W1439 HydrophobicContact CB-CZ3 4.32Å; C972-R1442 PolarHBondContact SG-NE 3.49Å; C972-L1443 HydrophobicContact CB-CD1 4.35Å; C972-L1443 WeakPolarHBondContact O-CD1 3.22Å
973	A	84.2	Confident	83.1	Confident	8 Å²	8	28.9 Å²	28.9	7%	0.066	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	154.3	-176.8	0	0	0	0	0	111.5	E964 I965 D971 F998 W1439	E964-A973 CarbonylContact C-O 3.57Å; E964-A973 WeakPolarHBondContact CA-O 3.33Å; I965-A973 HydrophobicContact CB-CB 4.46Å; I965-A973 HydrophobicContact CG1-CB 4.33Å; I965-A973 PolarHBondContact N-O 3Å; I965-A973 PolarHBondContact O-N 3.07Å; D971-A973 PolarHBondContact O-N 3.25Å; A973-F998 HydrophobicContact CB-CD1 3.81Å; A973-F998 HydrophobicContact CB-CE1 4.01Å; A973-W1439 WeakPolarHBondContact O-CH2 3.47Å
974	E	86.9	Confident	80.7	Confident	37 Å²	37	31.1 Å²	31.1	17%	0.173	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	136.7	-178.2	172.4	-177.6	-178	0	0	111	V962 V963 K1091 W1439	V962-E974 HydrophobicContact CG1-CG 3.83Å; V963-E974 WeakPolarHBondContact O-CA 3.37Å; E974-K1091 VanDerWaalsContact OE1-CE 3.3Å; E974-K1091 WeakPolarHBondContact OE1-CE 3.34Å; E974-K1091 WeakPolarHBondContact OE2-CE 3.48Å; E974-K1091 WeakPolarHBondContact OE2-CG 3.28Å; E974-W1439 HydrophobicContact CB-CZ2 3.69Å; E974-W1439 PolarHBondContact OE2-NE1 3.29Å
975	Q	84.8	Confident	78.8	Confident	29 Å²	29	32 Å²	32	14%	0.136	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.6	170.4	-66.1	177.5	83.1	0	0	109.2	V963 F996 E997 F998	V963-Q975 PolarHBondContact N-O 3.43Å; V963-Q975 PolarHBondContact O-N 3.34Å; Q975-F996 HydrophobicContact CB-CB 4.43Å; Q975-F996 HydrophobicContact CB-CD1 3.65Å; Q975-F996 HydrophobicContact CB-CD2 4.23Å; Q975-F996 HydrophobicContact CB-CE1 3.94Å; Q975-F996 HydrophobicContact CB-CE2 4.47Å; Q975-F996 HydrophobicContact CB-CG 3.84Å; Q975-F996 HydrophobicContact CB-CZ 4.35Å; Q975-F996 HydrophobicContact CG-CD1 4.35Å; Q975-E997 PolarHBondContact NE2-O 3.46Å; Q975-F998 HydrophobicContact CB-CE1 4.36Å; Q975-F998 HydrophobicContact CB-CZ 3.9Å; Q975-F998 HydrophobicContact CG-CE1 3.96Å; Q975-F998 HydrophobicContact CG-CZ 3.94Å; Q975-F998 VanDerWaalsContact NE2-CZ 3.26Å
976	R	88.7	Confident	77.3	Confident	100 Å²	100	32.4 Å²	32.4	38%	0.377	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	150.1	174.9	79.5	169.5	-129.1	169.3	6.8	111.2	Y960 V961 V962 T979 D1015	Y960-R976 HydrophobicContact CD2-CB 4.33Å; V961-R976 CarbonylContact O-C 3.37Å; V961-R976 WeakPolarHBondContact O-CA 3.5Å; V962-R976 HydrophobicContact CG2-CB 4.02Å; R976-T979 PolarHBondContact NH2-OG1 3.23Å; R976-D1015 IonicContact NH1-OD1 2.8Å; R976-D1015 IonicContact NH2-OD1 3.37Å; R976-D1015 IonicContact NH2-OD2 3.53Å; R976-D1015 PolarHBondContact NH2-OD2 3.48Å
977	T	89.8	Confident	76	Confident	4 Å²	4	32.7 Å²	32.7	3%	0.025	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-70.5	168.5	171.3	64.5	0	0	0	0	111.1	I938 V961 F992 D994 F996	I938-T977 HydrophobicContact CB-CG2 3.97Å; I938-T977 HydrophobicContact CG1-CG2 4.03Å; I938-T977 HydrophobicContact CG2-CG2 4.13Å; V961-T977 HydrophobicContact CB-CG2 3.94Å; V961-T977 PolarHBondContact N-OG1 3.45Å; V961-T977 PolarHBondContact O-N 2.99Å; T977-F992 HydrophobicContact CG2-CB 4.15Å; T977-F992 HydrophobicContact CG2-CD1 4.12Å; T977-F992 HydrophobicContact CG2-CG 4.22Å; T977-F992 WeakPolarHBondContact OG1-CD1 3.45Å; T977-D994 VanDerWaalsContact CA-OD2 3.26Å; T977-D994 WeakPolarHBondContact CA-OD2 3.43Å; T977-D994 HydrophobicContact CG2-CB 4.12Å; T977-F996 HydrophobicContact CG2-CE2 4.19Å; T977-F996 HydrophobicContact CG2-CZ 3.77Å
978	V	86.6	Confident	75.5	Confident	100 Å²	100	35.4 Å²	35.4	61%	0.606	22%	0.217	S	C	*	.	P	Polyproline II helix	trans	-61.6	149	151.7	-174	0	0	0	0	108.8	D994	V978-D994 PolarHBondContact N-OD2 3.22Å
979	T	89	Confident	75.4	Confident	29 Å²	29	36.8 Å²	36.8	18%	0.178	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.8	130.6	174.5	-44.5	0	0	0	0	109.4	E958 R976 D1015	E958-T979 HydrophobicContact CB-CG2 3.99Å; E958-T979 VanDerWaalsContact O-CG2 3.29Å; E958-T979 WeakPolarHBondContact O-CG2 3.37Å; R976-T979 PolarHBondContact NH2-OG1 3.23Å; T979-D1015 HydrophobicContact CG2-CB 3.6Å; T979-D1015 PolarHBondContact OG1-OD2 3.23Å
980	A	85.2	Confident	76	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.025	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-64.7	135.5	-179.6	0	0	0	0	0	110.2	P959 A982 A990 F992	P959-A980 HydrophobicContact CG-CB 4.08Å; P959-A980 PolarHBondContact O-N 3.13Å; A980-A982 PolarHBondContact O-N 2.83Å; A980-A990 HydrophobicContact CB-CB 3.87Å; A980-F992 HydrophobicContact CB-CD1 4.28Å; A980-F992 HydrophobicContact CB-CE1 3.73Å; A980-F992 HydrophobicContact CB-CZ 4.17Å
981	P	72.7	Confident	76.6	Confident	109 Å²	109	37.1 Å²	37.1	71%	0.708	22%	0.224	S	C	*	.	P	Polyproline II helix	trans	-67.8	131.6	-170.1	25.8	-34.4	0	0	0	112.5	G983	P981-G983 PolarHBondContact O-N 3.08Å
982	A	61.9	Low	76.8	Confident	59 Å²	59	37.9 Å²	37.9	49%	0.488	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-54.4	123.7	178.3	0	0	0	0	0	112.6	E958 A980	E958-A982 HydrophobicContact CG-CB 3.91Å; A980-A982 PolarHBondContact O-N 2.83Å
983	G	58.5	Low	76.8	Confident	35 Å²	35	38.8 Å²	38.8	36%	0.361	23%	0.231	S	C	.	.	S	Bend	trans	-168.6	173.9	178.7	0	0	0	0	0	113.3	P981 A985 S986	P981-G983 PolarHBondContact O-N 3.08Å; G983-A985 PolarHBondContact O-N 2.8Å; G983-S986 WeakPolarHBondContact O-CB 3.5Å; G983-S986 PolarHBondContact O-N 3.21Å
984	S	45.1	Very low	76.8	Confident	46 Å²	46	38.7 Å²	38.7	32%	0.322	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	18	-175.9	-172.8	0	0	0	0	115.2	K309	K309-S984 PolarHBondContact NZ-O 2.82Å; K309-S984 VanDerWaalsContact NZ-O 3.13Å; K309-S984 PolarHBondContact NZ-OG 3.01Å; K309-S984 VanDerWaalsContact NZ-OG 3.09Å
985	A	53.8	Low	76.8	Confident	33 Å²	33	37.7 Å²	37.7	27%	0.273	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-147.7	5.3	176.4	0	0	0	0	0	113.9	G983 G987 Y988 N989	G983-A985 PolarHBondContact O-N 2.8Å; A985-G987 PolarHBondContact O-N 3.37Å; A985-Y988 WeakPolarHBondContact O-CA 3.25Å; A985-Y988 PolarHBondContact O-N 3.06Å; A985-N989 PolarHBondContact O-N 2.97Å
986	S	62	Low	76.9	Confident	9 Å²	9	36.5 Å²	36.5	6%	0.063	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-39.1	-163.2	-168.2	0	0	0	0	115.5	I957 P959 G983 A990	I957-S986 WeakPolarHBondContact O-CB 3.48Å; I957-S986 PolarHBondContact O-OG 3.1Å; P959-S986 WeakPolarHBondContact CD-OG 3.33Å; G983-S986 WeakPolarHBondContact O-CB 3.5Å; G983-S986 PolarHBondContact O-N 3.21Å; S986-A990 WeakPolarHBondContact O-CB 3.21Å
987	G	64.8	Low	76.6	Confident	8 Å²	8	32.7 Å²	32.7	8%	0.082	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-14.7	173.2	0	0	0	0	0	115	Q943 L944 A985	Q943-G987 CarbonylContact C-O 3.58Å; Q943-G987 PolarHBondContact N-O 3.38Å; L944-G987 PolarHBondContact N-O 3.31Å; A985-G987 PolarHBondContact O-N 3.37Å
988	Y	76.3	Confident	76.3	Confident	59 Å²	59	32.5 Å²	32.5	23%	0.231	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-39.4	-171.6	-60.2	-69.4	0	0	0	113.2	I304 H305 Q942 Q943 A985	I304-Y988 WeakPolarHBondContact CG2-OH 3.44Å; H305-Y988 HydrophobicContact CB-CD1 3.6Å; H305-Y988 HydrophobicContact CB-CD2 4.23Å; H305-Y988 HydrophobicContact CB-CE1 3.73Å; H305-Y988 HydrophobicContact CB-CE2 4.34Å; H305-Y988 HydrophobicContact CB-CG 3.84Å; H305-Y988 AromaticContact CE1-CD2 3.95Å; H305-Y988 AromaticContact CG-CD1 4Å; H305-Y988 AromaticContact CG-CD2 3.97Å; H305-Y988 AromaticContact CG-CG 3.7Å; H305-Y988 WeakPolarHBondContact ND1-CB 3.1Å; H305-Y988 AromaticContact ND1-CD1 3.91Å; H305-Y988 AromaticContact ND1-CD2 3.08Å; H305-Y988 WeakPolarHBondContact ND1-CD2 3.42Å; H305-Y988 AromaticContact ND1-CE2 3.69Å; H305-Y988 AromaticContact ND1-CG 3.18Å; Q942-Y988 WeakPolarHBondContact CA-O 3.34Å; Q943-Y988 PolarHBondContact N-O 3.4Å; A985-Y988 WeakPolarHBondContact O-CA 3.25Å; A985-Y988 PolarHBondContact O-N 3.06Å
989	N	80.4	Confident	75.9	Confident	45 Å²	45	29.4 Å²	29.4	24%	0.241	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	86.3	168.8	-166.9	37.3	0	0	0	109.9	A941 Q942 A985	A941-N989 CarbonylContact O-C 3.54Å; A941-N989 VanDerWaalsContact O-CA 3.29Å; A941-N989 WeakPolarHBondContact O-CA 3.45Å; Q942-N989 PolarHBondContact NE2-OD1 3.36Å; A985-N989 PolarHBondContact O-N 2.97Å
990	A	86.6	Confident	75.7	Confident	3 Å²	3	28 Å²	28	3%	0.025	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	141.5	172.8	0	0	0	0	0	110	S940 A941 P959 A980 S986 F992	S940-A990 CarbonylContact C-O 3.59Å; S940-A990 WeakPolarHBondContact CA-O 3.48Å; S940-A990 WeakPolarHBondContact CB-O 3.43Å; A941-A990 HydrophobicContact CB-CB 4.35Å; A941-A990 PolarHBondContact N-O 3.33Å; A941-A990 PolarHBondContact O-N 3Å; P959-A990 HydrophobicContact CG-CB 3.78Å; A980-A990 HydrophobicContact CB-CB 3.87Å; S986-A990 WeakPolarHBondContact O-CB 3.21Å; A990-F992 HydrophobicContact CB-CE2 3.86Å; A990-F992 HydrophobicContact CB-CZ 3.76Å
991	I	85.4	Confident	75.4	Confident	57 Å²	57	30.5 Å²	30.5	29%	0.292	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.8	177.2	-59.2	178.8	0	0	0	108.8	E993	I991-E993 HydrophobicContact CG2-CG 4.07Å
992	F	86.1	Confident	75.9	Confident	20 Å²	20	25.6 Å²	25.6	9%	0.088	16%	0.159	C	C	.	.			trans	-122.8	-45.6	-174.4	-57.5	-78.6	0	0	0	112.9	I938 V939 A941 P959 V961 T977 A980 A990 D994	I938-F992 HydrophobicContact CB-CB 4.41Å; I938-F992 HydrophobicContact CG2-CB 4.07Å; I938-F992 HydrophobicContact CG2-CD2 3.68Å; I938-F992 HydrophobicContact CG2-CE2 4.42Å; I938-F992 HydrophobicContact CG2-CG 4.02Å; V939-F992 PolarHBondContact O-N 3.34Å; A941-F992 HydrophobicContact CB-CE2 3.79Å; A941-F992 HydrophobicContact CB-CZ 4.49Å; P959-F992 HydrophobicContact CG-CZ 4.42Å; P959-F992 WeakPolarHBondContact O-CE1 3.46Å; V961-F992 HydrophobicContact CG2-CD2 4.45Å; V961-F992 HydrophobicContact CG2-CE1 4.33Å; V961-F992 HydrophobicContact CG2-CE2 3.95Å; V961-F992 HydrophobicContact CG2-CZ 3.88Å; T977-F992 HydrophobicContact CG2-CB 4.15Å; T977-F992 HydrophobicContact CG2-CD1 4.12Å; T977-F992 HydrophobicContact CG2-CG 4.22Å; T977-F992 WeakPolarHBondContact OG1-CD1 3.45Å; A980-F992 HydrophobicContact CB-CD1 4.28Å; A980-F992 HydrophobicContact CB-CE1 3.73Å; A980-F992 HydrophobicContact CB-CZ 4.17Å; A990-F992 HydrophobicContact CB-CE2 3.86Å; A990-F992 HydrophobicContact CB-CZ 3.76Å; F992-D994 PolarHBondContact O-N 2.85Å
993	E	83.4	Confident	77.1	Confident	22 Å²	22	22.9 Å²	22.9	10%	0.103	14%	0.137	C	C	.	.			trans	56.7	3.2	-176.8	-75.2	-71.4	102.2	0	0	117.1	P236 K937 I938 V939 I991	P236-E993 WeakPolarHBondContact CB-OE2 3.45Å; P236-E993 HydrophobicContact CG-CB 3.82Å; P236-E993 HydrophobicContact CG-CG 4.08Å; K937-E993 VanDerWaalsContact CE-CD 3.5Å; K937-E993 WeakPolarHBondContact CE-O 3.39Å; K937-E993 VanDerWaalsContact CE-OE1 3.23Å; K937-E993 WeakPolarHBondContact CE-OE1 3.31Å; K937-E993 WeakPolarHBondContact CE-OE2 2.88Å; K937-E993 IonicContact NZ-OE1 3.19Å; K937-E993 PolarHBondContact NZ-OE1 2.7Å; K937-E993 IonicContact NZ-OE2 3.08Å; K937-E993 PolarHBondContact NZ-OE2 3.28Å; I938-E993 CarbonylContact O-C 3.58Å; I938-E993 WeakPolarHBondContact O-CA 3.39Å; I938-E993 PolarHBondContact O-N 2.65Å; V939-E993 WeakPolarHBondContact CG1-OE1 3.3Å; V939-E993 PolarHBondContact O-N 2.85Å; I991-E993 HydrophobicContact CG2-CG 4.07Å
994	D	85.2	Confident	78.6	Confident	6 Å²	6	22 Å²	22	3%	0.032	13%	0.125	C	C	.	.			trans	-72.2	137.6	-176.4	-95.2	-42.9	0	0	0	113.8	N212 K937 I938 T977 V978 F992 F996	N212-D994 PolarHBondContact ND2-OD1 3.03Å; K937-D994 CarbonylContact C-O 3.33Å; K937-D994 VanDerWaalsContact CA-O 3.3Å; K937-D994 WeakPolarHBondContact CA-O 3.3Å; K937-D994 WeakPolarHBondContact CG-O 3.17Å; I938-D994 PolarHBondContact N-O 3.08Å; I938-D994 PolarHBondContact O-N 3.16Å; T977-D994 VanDerWaalsContact CA-OD2 3.26Å; T977-D994 WeakPolarHBondContact CA-OD2 3.43Å; T977-D994 HydrophobicContact CG2-CB 4.12Å; V978-D994 PolarHBondContact N-OD2 3.22Å; F992-D994 PolarHBondContact O-N 2.85Å; D994-F996 HydrophobicContact CB-CE1 4.22Å; D994-F996 HydrophobicContact CB-CZ 4.21Å
995	T	85.8	Confident	80.8	Confident	15 Å²	15	20 Å²	20	9%	0.092	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.9	178.9	-53.1	0	0	0	0	112.8	L211 N212 R935 K937	L211-T995 HydrophobicContact CB-CG2 4.31Å; L211-T995 HydrophobicContact CD1-CG2 4.3Å; L211-T995 WeakPolarHBondContact CD1-O 3.27Å; N212-T995 PolarHBondContact OD1-N 2.98Å; R935-T995 HydrophobicContact CG-CG2 3.8Å; K937-T995 HydrophobicContact CB-CG2 4.45Å
996	F	86.9	Confident	82.6	Confident	5 Å²	5	18.4 Å²	18.4	2%	0.022	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150.6	175.4	-51.6	-41.8	0	0	0	111.8	R935 L936 I938 V963 Q975 T977 D994 F998	R935-F996 WeakPolarHBondContact CA-O 2.99Å; R935-F996 WeakPolarHBondContact CG-O 3.31Å; L936-F996 PolarHBondContact N-O 3.06Å; L936-F996 PolarHBondContact O-N 2.75Å; I938-F996 HydrophobicContact CG1-CD2 4.32Å; I938-F996 HydrophobicContact CG1-CE2 3.74Å; V963-F996 HydrophobicContact CB-CD2 4.26Å; V963-F996 HydrophobicContact CB-CE2 4.4Å; V963-F996 HydrophobicContact CG2-CD2 3.94Å; V963-F996 HydrophobicContact CG2-CE2 3.83Å; Q975-F996 HydrophobicContact CB-CB 4.43Å; Q975-F996 HydrophobicContact CB-CD1 3.65Å; Q975-F996 HydrophobicContact CB-CD2 4.23Å; Q975-F996 HydrophobicContact CB-CE1 3.94Å; Q975-F996 HydrophobicContact CB-CE2 4.47Å; Q975-F996 HydrophobicContact CB-CG 3.84Å; Q975-F996 HydrophobicContact CB-CZ 4.35Å; Q975-F996 HydrophobicContact CG-CD1 4.35Å; T977-F996 HydrophobicContact CG2-CE2 4.19Å; T977-F996 HydrophobicContact CG2-CZ 3.77Å; D994-F996 HydrophobicContact CB-CE1 4.22Å; D994-F996 HydrophobicContact CB-CZ 4.21Å; F996-F998 HydrophobicContact CB-CD2 4.22Å; F996-F998 HydrophobicContact CB-CE2 3.61Å; F996-F998 HydrophobicContact CB-CZ 4.24Å; F996-F998 HydrophobicContact CD2-CE2 4.38Å; F996-F998 HydrophobicContact CG-CE2 4.33Å
997	E	82.9	Confident	84.3	Confident	19 Å²	19	18 Å²	18	9%	0.089	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	127.6	172.7	-168.9	158.9	91.8	0	0	107.9	L211 V933 L934 R935 Q975 R1079 Q1087	L211-E997 HydrophobicContact CD1-CB 4.23Å; V933-E997 HydrophobicContact CG1-CG 3.8Å; L934-E997 CarbonylContact O-C 3.57Å; L934-E997 WeakPolarHBondContact O-CA 3.45Å; R935-E997 IonicContact CZ-OE2 3.53Å; R935-E997 VanDerWaalsContact CZ-OE2 3.29Å; R935-E997 IonicContact NE-OE2 3.56Å; R935-E997 PolarHBondContact NE-OE2 3.2Å; R935-E997 IonicContact NH2-OE2 2.75Å; R935-E997 PolarHBondContact NH2-OE2 3.2Å; Q975-E997 PolarHBondContact NE2-O 3.46Å; E997-R1079 VanDerWaalsContact CD-NH2 3.33Å; E997-R1079 IonicContact OE1-CZ 2.68Å; E997-R1079 IonicContact OE1-NE 3.65Å; E997-R1079 IonicContact OE1-NH2 3.87Å; E997-R1079 PolarHBondContact OE1-NH2 2.87Å; E997-R1079 IonicContact OE2-NH2 3.84Å; E997-R1079 PolarHBondContact OE2-NH2 2.69Å; E997-Q1087 PolarHBondContact O-NE2 3.12Å
998	F	84.7	Confident	85.9	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	152.3	-178	-64.1	-84.1	0	0	0	109.9	V933 L934 V963 I965 A973 Q975 F996	V933-F998 WeakPolarHBondContact CA-O 3.48Å; L934-F998 HydrophobicContact CB-CB 4.38Å; L934-F998 HydrophobicContact CD2-CD2 4.44Å; L934-F998 PolarHBondContact N-O 3.46Å; L934-F998 PolarHBondContact O-N 2.69Å; V963-F998 HydrophobicContact CB-CE2 4.3Å; V963-F998 HydrophobicContact CB-CZ 4.06Å; V963-F998 HydrophobicContact CG1-CE2 3.78Å; V963-F998 HydrophobicContact CG1-CZ 3.79Å; I965-F998 HydrophobicContact CD1-CB 4.35Å; I965-F998 HydrophobicContact CD1-CD1 4.03Å; I965-F998 HydrophobicContact CD1-CD2 4.11Å; I965-F998 HydrophobicContact CD1-CE1 4.26Å; I965-F998 HydrophobicContact CD1-CE2 4.34Å; I965-F998 HydrophobicContact CD1-CG 3.93Å; I965-F998 HydrophobicContact CD1-CZ 4.4Å; I965-F998 HydrophobicContact CG1-CB 4.21Å; I965-F998 HydrophobicContact CG1-CD1 3.41Å; I965-F998 VanDerWaalsContact CG1-CD1 3.41Å; I965-F998 HydrophobicContact CG1-CD2 4.4Å; I965-F998 HydrophobicContact CG1-CE1 3.71Å; I965-F998 HydrophobicContact CG1-CG 3.79Å; I965-F998 HydrophobicContact CG1-CZ 4.32Å; A973-F998 HydrophobicContact CB-CD1 3.81Å; A973-F998 HydrophobicContact CB-CE1 4.01Å; Q975-F998 HydrophobicContact CB-CE1 4.36Å; Q975-F998 HydrophobicContact CB-CZ 3.9Å; Q975-F998 HydrophobicContact CG-CE1 3.96Å; Q975-F998 HydrophobicContact CG-CZ 3.94Å; Q975-F998 VanDerWaalsContact NE2-CZ 3.26Å; F996-F998 HydrophobicContact CB-CD2 4.22Å; F996-F998 HydrophobicContact CB-CE2 3.61Å; F996-F998 HydrophobicContact CB-CZ 4.24Å; F996-F998 HydrophobicContact CD2-CE2 4.38Å; F996-F998 HydrophobicContact CG-CE2 4.33Å
999	C	78.1	Confident	86.9	Confident	36 Å²	36	15.4 Å²	15.4	24%	0.243	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.8	174.9	-171.4	0	0	0	0	108.2	W1080	C999-W1080 HydrophobicContact CB-CZ2 3.75Å
1000	V	83.9	Confident	87.7	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	124.4	-176.4	177.4	0	0	0	0	108.7	P931 Q932 I965 A1006 F1030	P931-V1000 WeakPolarHBondContact CA-O 3.21Å; Q932-V1000 PolarHBondContact N-O 3.26Å; Q932-V1000 PolarHBondContact O-N 2.99Å; I965-V1000 HydrophobicContact CG2-CG2 4.12Å; V1000-A1006 HydrophobicContact CG1-CB 3.58Å; V1000-F1030 HydrophobicContact CB-CD2 4.34Å; V1000-F1030 HydrophobicContact CB-CE2 3.9Å; V1000-F1030 HydrophobicContact CB-CZ 4.19Å; V1000-F1030 HydrophobicContact CG1-CD2 4.23Å; V1000-F1030 HydrophobicContact CG1-CE2 4.26Å; V1000-F1030 HydrophobicContact CG2-CD2 3.89Å; V1000-F1030 HydrophobicContact CG2-CE2 3.5Å; V1000-F1030 HydrophobicContact CG2-CZ 4.26Å
1001	Q	78.7	Confident	88.1	Confident	55 Å²	55	13.7 Å²	13.7	26%	0.257	7%	0.073	S	C	.	.	S	Bend	trans	-93.4	-23.4	-174.8	-176.3	51.8	81.2	0	0	112.1	T929 I968 V970 D971	T929-Q1001 PolarHBondContact O-NE2 3.08Å; I968-Q1001 HydrophobicContact CD1-CB 4.44Å; V970-Q1001 HydrophobicContact CG2-CB 4.17Å; D971-Q1001 WeakPolarHBondContact OD1-CB 3.48Å; D971-Q1001 PolarHBondContact OD1-N 2.77Å; D971-Q1001 PolarHBondContact OD2-N 3.22Å; D971-Q1001 VanDerWaalsContact OD2-N 3.08Å
1002	L	82.9	Confident	88.6	Confident	5 Å²	5	11 Å²	11	3%	0.026	6%	0.059	C	C	.	.			trans	-144.4	80.7	175.1	-173.9	62.2	0	0	0	111.2	Y905 T929 I968 D971 S1004 L1005 A1006	Y905-L1002 HydrophobicContact CE2-CD2 4.36Å; T929-L1002 HydrophobicContact CG2-CD1 4.39Å; I968-L1002 HydrophobicContact CD1-CB 3.59Å; I968-L1002 HydrophobicContact CD1-CD2 4.2Å; I968-L1002 HydrophobicContact CG1-CB 4.13Å; I968-L1002 HydrophobicContact CG2-CD2 4.13Å; D971-L1002 PolarHBondContact OD2-N 3.4Å; L1002-S1004 WeakPolarHBondContact CD1-OG 3.47Å; L1002-S1004 PolarHBondContact O-N 2.87Å; L1002-S1004 VanDerWaalsContact O-N 3.11Å; L1002-L1005 HydrophobicContact CD2-CB 4.21Å; L1002-L1005 HydrophobicContact CD2-CD1 3.82Å; L1002-L1005 HydrophobicContact CD2-CG 3.99Å; L1002-L1005 HydrophobicContact CG-CB 4.37Å; L1002-L1005 HydrophobicContact CG-CG 4.45Å; L1002-L1005 PolarHBondContact O-N 3.46Å; L1002-A1006 PolarHBondContact O-N 3.45Å
1003	G	87.5	Confident	88.9	Confident	3 Å²	3	11.1 Å²	11.1	3%	0.031	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-50.4	-38.4	-177.2	0	0	0	0	0	113.9	L1005 A1006 F1030	G1003-L1005 VanDerWaalsContact C-N 3.26Å; G1003-L1005 PolarHBondContact O-N 3.21Å; G1003-L1005 VanDerWaalsContact O-N 3.16Å; G1003-A1006 PolarHBondContact O-N 3.49Å; G1003-F1030 WeakPolarHBondContact O-CB 3.01Å
1004	S	89.6	Confident	89.1	Confident	17 Å²	17	10.3 Å²	10.3	12%	0.119	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-62.5	-25.3	-178.6	49.4	0	0	0	0	115.4	R892 P902 L1002 D1031	R892-S1004 PolarHBondContact NH1-O 2.95Å; R892-S1004 PolarHBondContact NH2-O 2.9Å; R892-S1004 VanDerWaalsContact NH2-O 3.14Å; P902-S1004 VanDerWaalsContact CG-OG 3.26Å; P902-S1004 WeakPolarHBondContact CG-OG 3.47Å; L1002-S1004 WeakPolarHBondContact CD1-OG 3.47Å; L1002-S1004 PolarHBondContact O-N 2.87Å; L1002-S1004 VanDerWaalsContact O-N 3.11Å; S1004-D1031 WeakPolarHBondContact CA-OD2 3.36Å; S1004-D1031 WeakPolarHBondContact CB-OD2 3.46Å; S1004-D1031 PolarHBondContact N-OD1 2.96Å
1005	L	91.1	Very high	89.2	Confident	2 Å²	2	12.9 Å²	12.9	1%	0.01	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-101.8	-3.7	169.4	-67.8	-171.1	0	0	0	114	Y434 L862 W865 F889 P902 Y905 G967 I968 L1002 G1003	Y434-L1005 HydrophobicContact CE2-CD2 3.88Å; L862-L1005 VanDerWaalsContact CD2-O 3.32Å; L862-L1005 WeakPolarHBondContact CD2-O 3.19Å; W865-L1005 HydrophobicContact CB-CD2 4.32Å; F889-L1005 HydrophobicContact CE2-CD2 3.87Å; F889-L1005 HydrophobicContact CZ-CD2 4.06Å; P902-L1005 HydrophobicContact CG-CD2 4.45Å; P902-L1005 HydrophobicContact CG-CG 4.29Å; Y905-L1005 HydrophobicContact CE2-CD1 4.04Å; G967-L1005 WeakPolarHBondContact CA-O 3.49Å; I968-L1005 HydrophobicContact CG2-CD1 4.08Å; L1002-L1005 HydrophobicContact CD2-CB 4.21Å; L1002-L1005 HydrophobicContact CD2-CD1 3.82Å; L1002-L1005 HydrophobicContact CD2-CG 3.99Å; L1002-L1005 HydrophobicContact CG-CB 4.37Å; L1002-L1005 HydrophobicContact CG-CG 4.45Å; L1002-L1005 PolarHBondContact O-N 3.46Å; G1003-L1005 VanDerWaalsContact C-N 3.26Å; G1003-L1005 PolarHBondContact O-N 3.21Å; G1003-L1005 VanDerWaalsContact O-N 3.16Å
1006	A	93.3	Very high	88.9	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.			trans	-86	140	178.4	0	0	0	0	0	112.4	H966 V1000 L1002 G1003 F1030	H966-A1006 CarbonylContact O-C 3.55Å; V1000-A1006 HydrophobicContact CG1-CB 3.58Å; L1002-A1006 PolarHBondContact O-N 3.45Å; G1003-A1006 PolarHBondContact O-N 3.49Å; A1006-F1030 HydrophobicContact CB-CB 3.91Å; A1006-F1030 HydrophobicContact CB-CD2 4.48Å; A1006-F1030 HydrophobicContact CB-CG 4.42Å; A1006-F1030 WeakPolarHBondContact O-CB 3.32Å; A1006-F1030 PolarHBondContact O-N 3.25Å
1007	L	97.4	Very high	88.4	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.9	171.6	-51.6	177.9	0	0	0	108.6	L862 L885 F889 I965 H966 T1027 P1029	L862-L1007 HydrophobicContact CD1-CD1 4.15Å; L885-L1007 HydrophobicContact CB-CD1 4.11Å; L885-L1007 HydrophobicContact CD2-CD1 3.79Å; L885-L1007 VanDerWaalsContact O-CD1 3.31Å; L885-L1007 WeakPolarHBondContact O-CD1 3.36Å; F889-L1007 HydrophobicContact CB-CD1 4.16Å; F889-L1007 HydrophobicContact CB-CD2 4.12Å; F889-L1007 HydrophobicContact CD2-CD2 4.03Å; I965-L1007 WeakPolarHBondContact CA-O 3.39Å; H966-L1007 HydrophobicContact CB-CB 4.42Å; H966-L1007 PolarHBondContact N-O 3.34Å; H966-L1007 PolarHBondContact O-N 2.95Å; L1007-T1027 HydrophobicContact CB-CG2 4.15Å; L1007-T1027 HydrophobicContact CD1-CG2 4.21Å; L1007-P1029 HydrophobicContact CD2-CB 3.93Å; L1007-P1029 HydrophobicContact CD2-CG 3.96Å
1008	V	97.4	Very high	87.9	Confident	1 Å²	1	23 Å²	23	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.3	171.3	-175.9	0	0	0	0	108.3	L934 V963 I965 F1010 V1028 F1030 L1033	L934-V1008 HydrophobicContact CD2-CG2 3.82Å; V963-V1008 HydrophobicContact CG1-CG1 3.98Å; I965-V1008 HydrophobicContact CD1-CB 4.4Å; I965-V1008 HydrophobicContact CD1-CG1 4.14Å; I965-V1008 HydrophobicContact CD1-CG2 3.8Å; V1008-F1010 HydrophobicContact CG1-CD2 4.49Å; V1008-F1010 HydrophobicContact CG1-CE2 3.85Å; V1008-F1010 HydrophobicContact CG1-CZ 4.06Å; V1008-V1028 PolarHBondContact N-O 2.85Å; V1008-V1028 PolarHBondContact O-N 2.8Å; V1008-F1030 HydrophobicContact CG2-CD2 4.08Å; V1008-L1033 HydrophobicContact CB-CD1 4.44Å; V1008-L1033 HydrophobicContact CG2-CD1 3.78Å
1009	R	97.1	Very high	87.4	Confident	13 Å²	13	24.3 Å²	24.3	5%	0.049	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.6	-179.7	175.1	177.4	177.2	87.5	-9.4	110	D884 V963 E964 V1011 N1026 T1027	D884-R1009 VanDerWaalsContact CG-NH1 3.34Å; D884-R1009 IonicContact OD2-CZ 3.63Å; D884-R1009 VanDerWaalsContact OD2-CZ 3.23Å; D884-R1009 IonicContact OD2-NH1 3.18Å; D884-R1009 PolarHBondContact OD2-NH1 2.97Å; D884-R1009 IonicContact OD2-NH2 3.73Å; D884-R1009 PolarHBondContact OD2-NH2 2.96Å; V963-R1009 WeakPolarHBondContact CA-O 3.34Å; E964-R1009 HydrophobicContact CB-CB 4.3Å; E964-R1009 PolarHBondContact N-O 2.79Å; E964-R1009 PolarHBondContact O-N 2.98Å; E964-R1009 WeakPolarHBondContact OE2-CD 3.37Å; E964-R1009 IonicContact OE2-NE 2.69Å; R1009-V1011 HydrophobicContact CG-CG2 3.82Å; R1009-N1026 CarbonylContact C-O 3.58Å; R1009-N1026 WeakPolarHBondContact CA-O 3.23Å; R1009-T1027 HydrophobicContact CB-CG2 4.25Å; R1009-T1027 PolarHBondContact NH1-OG1 3.34Å
1010	F	97.7	Very high	87.4	Confident	1 Å²	1	23 Å²	23	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	132	170.4	-57.3	-99.9	0	0	0	107.8	I414 L936 I938 V963 V1008 Q1025 N1026 V1040 L1055 V1057	I414-F1010 HydrophobicContact CD1-CE2 3.68Å; I414-F1010 HydrophobicContact CD1-CZ 3.67Å; L936-F1010 HydrophobicContact CD1-CE1 4.04Å; L936-F1010 HydrophobicContact CD1-CZ 4.17Å; L936-F1010 HydrophobicContact CD2-CE1 3.77Å; L936-F1010 HydrophobicContact CD2-CZ 4.13Å; L936-F1010 HydrophobicContact CG-CE1 4.48Å; I938-F1010 HydrophobicContact CD1-CD1 4.27Å; I938-F1010 HydrophobicContact CD1-CE1 4.07Å; V963-F1010 HydrophobicContact CG2-CD1 4.18Å; V963-F1010 HydrophobicContact CG2-CE1 4.44Å; V1008-F1010 HydrophobicContact CG1-CD2 4.49Å; V1008-F1010 HydrophobicContact CG1-CE2 3.85Å; V1008-F1010 HydrophobicContact CG1-CZ 4.06Å; F1010-Q1025 CarbonylContact O-C 3.6Å; F1010-Q1025 WeakPolarHBondContact O-CA 3.46Å; F1010-Q1025 WeakPolarHBondContact O-CB 3.16Å; F1010-N1026 PolarHBondContact N-O 3.04Å; F1010-N1026 PolarHBondContact O-N 2.96Å; F1010-V1040 HydrophobicContact CD2-CG1 4.03Å; F1010-V1040 HydrophobicContact CE1-CG2 4.31Å; F1010-V1040 HydrophobicContact CE2-CG1 4.38Å; F1010-V1040 HydrophobicContact CE2-CG2 4.34Å; F1010-V1040 HydrophobicContact CG-CG1 4.32Å; F1010-V1040 HydrophobicContact CZ-CG2 4.18Å; F1010-L1055 HydrophobicContact CB-CD1 3.87Å; F1010-L1055 HydrophobicContact CD1-CD1 3.78Å; F1010-L1055 HydrophobicContact CG-CD1 4.14Å; F1010-V1057 HydrophobicContact CE1-CG1 4.11Å
1011	V	95.7	Very high	87.5	Confident	10 Å²	10	24.9 Å²	24.9	6%	0.061	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.4	174.4	-167.4	0	0	0	0	108.6	V961 V962 R1009 L1013 F1022	V961-V1011 CarbonylContact C-O 3.5Å; V961-V1011 WeakPolarHBondContact CA-O 3.24Å; V962-V1011 HydrophobicContact CB-CB 4.41Å; V962-V1011 PolarHBondContact N-O 3.01Å; V962-V1011 PolarHBondContact O-N 3.03Å; R1009-V1011 HydrophobicContact CG-CG2 3.82Å; V1011-L1013 HydrophobicContact CG1-CD1 4.24Å; V1011-L1013 HydrophobicContact CG1-CG 4.15Å; V1011-F1022 HydrophobicContact CG1-CD2 4.18Å; V1011-F1022 HydrophobicContact CG1-CE2 3.98Å
1012	V	94.9	Very high	88.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.2	179.6	-165.2	0	0	0	0	108.9	L944 P959 V961 I1023 G1024 L1042 L1055	L944-V1012 HydrophobicContact CD1-CG1 3.81Å; L944-V1012 HydrophobicContact CD2-CG1 4.03Å; P959-V1012 HydrophobicContact CB-CG1 4.34Å; V961-V1012 HydrophobicContact CG2-CG2 4.42Å; V1012-I1023 HydrophobicContact CB-CB 4.16Å; V1012-I1023 HydrophobicContact CB-CG2 4.44Å; V1012-I1023 HydrophobicContact CG1-CB 4.2Å; V1012-I1023 HydrophobicContact CG1-CD1 4.04Å; V1012-I1023 HydrophobicContact CG1-CG2 4.34Å; V1012-I1023 WeakPolarHBondContact O-CB 3.32Å; V1012-I1023 PolarHBondContact O-N 3.22Å; V1012-G1024 PolarHBondContact N-O 3.02Å; V1012-G1024 PolarHBondContact O-N 3.49Å; V1012-L1042 HydrophobicContact CG2-CD1 3.81Å; V1012-L1042 HydrophobicContact CG2-CD2 3.84Å; V1012-L1055 HydrophobicContact CG2-CD1 4.31Å; V1012-L1055 HydrophobicContact CG2-CD2 3.84Å; V1012-L1055 HydrophobicContact CG2-CG 4.39Å
1013	L	91.9	Very high	88.4	Confident	23 Å²	23	24 Å²	24	12%	0.12	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.6	-170.6	-70.4	157.8	0	0	0	110	P959 Y960 V962 V1011 D1021 F1022	P959-L1013 CarbonylContact C-O 3.58Å; P959-L1013 VanDerWaalsContact CA-O 3.26Å; P959-L1013 WeakPolarHBondContact CA-O 3.35Å; Y960-L1013 HydrophobicContact CD1-CB 4.07Å; Y960-L1013 VanDerWaalsContact CD1-O 3.3Å; Y960-L1013 WeakPolarHBondContact CD1-O 3.27Å; Y960-L1013 HydrophobicContact CE1-CB 3.52Å; Y960-L1013 HydrophobicContact CE2-CB 4.06Å; Y960-L1013 HydrophobicContact CE2-CD1 3.92Å; Y960-L1013 PolarHBondContact N-O 2.96Å; Y960-L1013 PolarHBondContact O-N 3.12Å; V962-L1013 HydrophobicContact CG2-CD1 3.91Å; V1011-L1013 HydrophobicContact CG1-CD1 4.24Å; V1011-L1013 HydrophobicContact CG1-CG 4.15Å; L1013-D1021 CarbonylContact C-O 3.59Å; L1013-D1021 WeakPolarHBondContact CA-O 3.25Å; L1013-D1021 HydrophobicContact CD2-CB 4.23Å; L1013-F1022 HydrophobicContact CD2-CB 4.49Å
1014	D	88.9	Confident	88.8	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.032	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.3	175.9	-179.2	10.1	0	0	0	110.1	P947 E958 H1016 A1017 D1021 I1023	P947-D1014 HydrophobicContact CG-CB 3.81Å; E958-D1014 PolarHBondContact N-OD1 3.05Å; D1014-H1016 PolarHBondContact O-N 2.9Å; D1014-H1016 VanDerWaalsContact O-N 3.16Å; D1014-H1016 PolarHBondContact OD1-N 2.62Å; D1014-A1017 HydrophobicContact CB-CB 3.91Å; D1014-A1017 PolarHBondContact O-N 3.38Å; D1014-D1021 PolarHBondContact N-O 3.47Å; D1014-I1023 HydrophobicContact CB-CD1 4.11Å; D1014-I1023 HydrophobicContact CB-CG1 4.47Å
1015	D	85.7	Confident	89.1	Confident	59 Å²	59	23.2 Å²	23.2	32%	0.316	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-13.4	-173.1	-141.6	16.2	0	0	0	112.1	E958 Y960 R976 T979	E958-D1015 PolarHBondContact O-N 2.94Å; Y960-D1015 HydrophobicContact CD1-CB 3.75Å; Y960-D1015 HydrophobicContact CE1-CB 3.84Å; Y960-D1015 WeakPolarHBondContact CE1-OD1 3.48Å; R976-D1015 IonicContact NH1-OD1 2.8Å; R976-D1015 IonicContact NH2-OD1 3.37Å; R976-D1015 IonicContact NH2-OD2 3.53Å; R976-D1015 PolarHBondContact NH2-OD2 3.48Å; T979-D1015 HydrophobicContact CG2-CB 3.6Å; T979-D1015 PolarHBondContact OG1-OD2 3.23Å
1016	H	80.3	Confident	89.3	Confident	117 Å²	117	24.2 Å²	24.2	54%	0.542	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	16.8	-177.9	-75.6	6.6	0	0	0	114.1	E958 D1014	E958-H1016 IonicContact OE1-CD2 3.6Å; E958-H1016 PolarHBondContact OE1-CD2 3.24Å; E958-H1016 IonicContact OE2-CD2 3.01Å; E958-H1016 IonicContact OE2-NE2 2.7Å; D1014-H1016 PolarHBondContact O-N 2.9Å; D1014-H1016 VanDerWaalsContact O-N 3.16Å; D1014-H1016 PolarHBondContact OD1-N 2.62Å
1017	A	77	Confident	89.5	Confident	26 Å²	26	24.5 Å²	24.5	22%	0.215	13%	0.134	C	C	.	.			trans	-66.8	141.5	175.1	0	0	0	0	0	113.9	P947 D1014 D1020 D1021	P947-A1017 HydrophobicContact CG-CB 4.47Å; D1014-A1017 HydrophobicContact CB-CB 3.91Å; D1014-A1017 PolarHBondContact O-N 3.38Å; A1017-D1020 WeakPolarHBondContact CB-O 3.34Å; A1017-D1021 HydrophobicContact CB-CB 4.09Å
1018	I	72.1	Confident	89.5	Confident	110 Å²	110	24.6 Å²	24.6	56%	0.564	13%	0.134	S	C	*	.	S	Bend	trans	-105.2	106.1	170.5	-59	174.9	0	0	0	108	S950 V951	S950-I1018 WeakPolarHBondContact CA-O 3.47Å; V951-I1018 PolarHBondContact N-O 2.8Å
1019	G	74.7	Confident	89.5	Confident	26 Å²	26	24.6 Å²	24.6	27%	0.268	13%	0.134	S	C	.	.	S	Bend	trans	123.3	-98.3	178.4	0	0	0	0	0	112.2	R1429	G1019-R1429 PolarHBondContact O-NH2 3.25Å
1020	D	77.6	Confident	89.4	Confident	9 Å²	9	24.1 Å²	24.1	5%	0.048	13%	0.132	C	C	.	.			trans	-106.9	138.8	168	-157.6	-34.6	0	0	0	109.1	P947 A1017 F1022 R1428 R1432	P947-D1020 VanDerWaalsContact CB-O 3.24Å; P947-D1020 WeakPolarHBondContact CB-O 3.4Å; A1017-D1020 WeakPolarHBondContact CB-O 3.34Å; D1020-F1022 WeakPolarHBondContact OD1-CB 3.42Å; D1020-F1022 PolarHBondContact OD1-N 2.99Å; D1020-R1428 IonicContact OD2-CZ 3.88Å; D1020-R1428 IonicContact OD2-NE 3.69Å; D1020-R1428 IonicContact OD2-NH1 2.65Å; D1020-R1428 PolarHBondContact OD2-NH1 2.77Å; D1020-R1432 IonicContact OD1-NH2 3.29Å; D1020-R1432 PolarHBondContact OD1-NH2 3.44Å; D1020-R1432 IonicContact OD2-NH2 2.86Å
1021	D	86.9	Confident	89.1	Confident	40 Å²	40	27.3 Å²	27.3	21%	0.214	15%	0.149	C	C	.	.			trans	-103	-11.6	-176.6	53	-2.3	0	0	0	112.8	L1013 D1014 A1017 I1023 R1432	L1013-D1021 CarbonylContact C-O 3.59Å; L1013-D1021 WeakPolarHBondContact CA-O 3.25Å; L1013-D1021 HydrophobicContact CD2-CB 4.23Å; D1014-D1021 PolarHBondContact N-O 3.47Å; A1017-D1021 HydrophobicContact CB-CB 4.09Å; D1021-I1023 PolarHBondContact O-N 2.98Å; D1021-R1432 VanDerWaalsContact CG-NH1 3.28Å; D1021-R1432 IonicContact OD1-CZ 2.78Å; D1021-R1432 IonicContact OD1-NH1 3.79Å; D1021-R1432 PolarHBondContact OD1-NH1 2.69Å; D1021-R1432 IonicContact OD1-NH2 2.76Å; D1021-R1432 PolarHBondContact OD1-NH2 3.06Å; D1021-R1432 IonicContact OD2-NH1 3.83Å; D1021-R1432 PolarHBondContact OD2-NH1 3.19Å; D1021-R1432 VanDerWaalsContact OD2-NH1 3.08Å
1022	F	89.7	Confident	89.1	Confident	33 Å²	33	26.9 Å²	26.9	15%	0.145	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.8	-173.7	-177.3	-86.2	0	0	0	112.7	P947 V1011 L1013 D1020 G1024 Q1025 D1045	P947-F1022 WeakPolarHBondContact CA-O 3.38Å; P947-F1022 WeakPolarHBondContact CB-O 3.48Å; V1011-F1022 HydrophobicContact CG1-CD2 4.18Å; V1011-F1022 HydrophobicContact CG1-CE2 3.98Å; L1013-F1022 HydrophobicContact CD2-CB 4.49Å; D1020-F1022 WeakPolarHBondContact OD1-CB 3.42Å; D1020-F1022 PolarHBondContact OD1-N 2.99Å; F1022-G1024 VanDerWaalsContact CE1-CA 3.46Å; F1022-G1024 VanDerWaalsContact CZ-C 3.43Å; F1022-Q1025 HydrophobicContact CE2-CB 4.09Å; F1022-Q1025 HydrophobicContact CE2-CG 4.34Å; F1022-Q1025 HydrophobicContact CZ-CB 3.95Å; F1022-Q1025 HydrophobicContact CZ-CG 3.87Å; F1022-D1045 HydrophobicContact CD1-CB 4.16Å; F1022-D1045 HydrophobicContact CE1-CB 3.93Å; F1022-D1045 VanDerWaalsContact CE1-N 3.3Å
1023	I	91	Very high	89.1	Confident	8 Å²	8	27.6 Å²	27.6	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-50.3	174	-63.6	169.3	0	0	0	110.5	L944 P945 P947 I957 P959 V1012 D1014 D1021 I1050	L944-I1023 HydrophobicContact CB-CG2 4.1Å; L944-I1023 HydrophobicContact CD2-CG2 4.13Å; P945-I1023 HydrophobicContact CG-CG2 4.13Å; P947-I1023 HydrophobicContact CG-CG1 3.82Å; I957-I1023 HydrophobicContact CD1-CD1 3.74Å; P959-I1023 HydrophobicContact CB-CD1 4.1Å; V1012-I1023 HydrophobicContact CB-CB 4.16Å; V1012-I1023 HydrophobicContact CB-CG2 4.44Å; V1012-I1023 HydrophobicContact CG1-CB 4.2Å; V1012-I1023 HydrophobicContact CG1-CD1 4.04Å; V1012-I1023 HydrophobicContact CG1-CG2 4.34Å; V1012-I1023 WeakPolarHBondContact O-CB 3.32Å; V1012-I1023 PolarHBondContact O-N 3.22Å; D1014-I1023 HydrophobicContact CB-CD1 4.11Å; D1014-I1023 HydrophobicContact CB-CG1 4.47Å; D1021-I1023 PolarHBondContact O-N 2.98Å; I1023-I1050 VanDerWaalsContact O-CD1 3.29Å; I1023-I1050 WeakPolarHBondContact O-CD1 3.44Å
1024	G	93.9	Very high	89.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	167.7	-176.6	0	0	0	0	0	114.2	V1012 F1022 R1043	V1012-G1024 PolarHBondContact N-O 3.02Å; V1012-G1024 PolarHBondContact O-N 3.49Å; F1022-G1024 VanDerWaalsContact CE1-CA 3.46Å; F1022-G1024 VanDerWaalsContact CZ-C 3.43Å; G1024-R1043 CarbonylContact C-O 3.54Å; G1024-R1043 WeakPolarHBondContact CA-O 3.2Å
1025	Q	95.8	Very high	89.4	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.019	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	161.7	176.9	66.4	86	15.6	0	0	112.4	D884 F1010 F1022 T1027 R1043	D884-Q1025 PolarHBondContact OD1-NE2 3.33Å; D884-Q1025 PolarHBondContact OD2-NE2 2.64Å; F1010-Q1025 CarbonylContact O-C 3.6Å; F1010-Q1025 WeakPolarHBondContact O-CA 3.46Å; F1010-Q1025 WeakPolarHBondContact O-CB 3.16Å; F1022-Q1025 HydrophobicContact CE2-CB 4.09Å; F1022-Q1025 HydrophobicContact CE2-CG 4.34Å; F1022-Q1025 HydrophobicContact CZ-CB 3.95Å; F1022-Q1025 HydrophobicContact CZ-CG 3.87Å; Q1025-T1027 PolarHBondContact OE1-OG1 3.49Å; Q1025-R1043 PolarHBondContact N-O 2.93Å; Q1025-R1043 WeakPolarHBondContact O-CA 3.31Å; Q1025-R1043 WeakPolarHBondContact O-CB 3.3Å; Q1025-R1043 PolarHBondContact O-N 3.45Å
1026	N	97.1	Very high	89.8	Confident	22 Å²	22	27.5 Å²	27.5	12%	0.118	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	145.8	155.9	-167.6	-3.7	0	0	0	109.4	R1009 F1010 V1040 R1041	R1009-N1026 CarbonylContact C-O 3.58Å; R1009-N1026 WeakPolarHBondContact CA-O 3.23Å; F1010-N1026 PolarHBondContact N-O 3.04Å; F1010-N1026 PolarHBondContact O-N 2.96Å; N1026-V1040 HydrophobicContact CB-CG1 3.71Å; N1026-R1041 PolarHBondContact ND2-O 3.15Å
1027	T	97.6	Very high	90.5	Very high	7 Å²	7	22.8 Å²	22.8	4%	0.043	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	113.9	-174.5	-55.6	0	0	0	0	109.5	L885 G888 L1007 R1009 Q1025	L885-T1027 HydrophobicContact CD2-CG2 4.11Å; G888-T1027 WeakPolarHBondContact CA-O 3.48Å; L1007-T1027 HydrophobicContact CB-CG2 4.15Å; L1007-T1027 HydrophobicContact CD1-CG2 4.21Å; R1009-T1027 HydrophobicContact CB-CG2 4.25Å; R1009-T1027 PolarHBondContact NH1-OG1 3.34Å; Q1025-T1027 PolarHBondContact OE1-OG1 3.49Å
1028	V	97.4	Very high	91.4	Very high	2 Å²	2	22 Å²	22	1%	0.012	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.6	-171.8	-178.4	0	0	0	0	110.1	I414 F415 V1008 C1032 L1033	I414-V1028 HydrophobicContact CG2-CG2 4.29Å; F415-V1028 HydrophobicContact CD2-CG1 4.03Å; V1008-V1028 PolarHBondContact N-O 2.85Å; V1008-V1028 PolarHBondContact O-N 2.8Å; V1028-C1032 HydrophobicContact CG1-CB 4.4Å; V1028-L1033 HydrophobicContact CB-CD2 4.09Å; V1028-L1033 HydrophobicContact CG1-CD2 3.67Å; V1028-L1033 HydrophobicContact CG1-CG 4.38Å
1029	P	96.9	Very high	92.5	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	141.7	173	-22.1	33.8	0	0	0	112.2	G888 R892 L1007 D1031 C1032 L1033	G888-P1029 VanDerWaalsContact O-CD 3.32Å; G888-P1029 WeakPolarHBondContact O-CD 3.39Å; G888-P1029 WeakPolarHBondContact O-CG 3.29Å; R892-P1029 HydrophobicContact CB-CG 4.43Å; L1007-P1029 HydrophobicContact CD2-CB 3.93Å; L1007-P1029 HydrophobicContact CD2-CG 3.96Å; P1029-D1031 PolarHBondContact O-N 3.03Å; P1029-C1032 HydrophobicContact CB-CB 4.18Å; P1029-C1032 HydrophobicContact CG-CB 4.47Å; P1029-C1032 WeakPolarHBondContact O-CA 3.36Å; P1029-C1032 WeakPolarHBondContact O-CB 3.33Å; P1029-C1032 PolarHBondContact O-N 3.29Å; P1029-L1033 PolarHBondContact O-N 2.99Å
1030	F	95.3	Very high	93.6	Very high	4 Å²	4	15.8 Å²	15.8	2%	0.018	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-58.4	-46.1	-175.9	-170.2	-79.8	0	0	0	112.3	Q932 L934 V1000 G1003 A1006 V1008 C1032 L1033 I1061	Q932-F1030 HydrophobicContact CB-CE1 4.16Å; Q932-F1030 HydrophobicContact CB-CZ 4.09Å; L934-F1030 HydrophobicContact CB-CE2 3.7Å; L934-F1030 HydrophobicContact CB-CZ 4.03Å; L934-F1030 HydrophobicContact CD2-CD2 4.37Å; L934-F1030 HydrophobicContact CD2-CE2 3.91Å; L934-F1030 HydrophobicContact CG-CE2 4.34Å; V1000-F1030 HydrophobicContact CB-CD2 4.34Å; V1000-F1030 HydrophobicContact CB-CE2 3.9Å; V1000-F1030 HydrophobicContact CB-CZ 4.19Å; V1000-F1030 HydrophobicContact CG1-CD2 4.23Å; V1000-F1030 HydrophobicContact CG1-CE2 4.26Å; V1000-F1030 HydrophobicContact CG2-CD2 3.89Å; V1000-F1030 HydrophobicContact CG2-CE2 3.5Å; V1000-F1030 HydrophobicContact CG2-CZ 4.26Å; G1003-F1030 WeakPolarHBondContact O-CB 3.01Å; A1006-F1030 HydrophobicContact CB-CB 3.91Å; A1006-F1030 HydrophobicContact CB-CD2 4.48Å; A1006-F1030 HydrophobicContact CB-CG 4.42Å; A1006-F1030 WeakPolarHBondContact O-CB 3.32Å; A1006-F1030 PolarHBondContact O-N 3.25Å; V1008-F1030 HydrophobicContact CG2-CD2 4.08Å; F1030-C1032 PolarHBondContact O-N 2.98Å; F1030-C1032 VanDerWaalsContact O-N 3.11Å; F1030-L1033 HydrophobicContact CD2-CD1 4.24Å; F1030-L1033 HydrophobicContact CG-CD1 4.4Å; F1030-L1033 WeakPolarHBondContact O-CB 3.49Å; F1030-L1033 WeakPolarHBondContact O-CG 3.39Å; F1030-L1033 PolarHBondContact O-N 3.11Å; F1030-L1033 VanDerWaalsContact O-N 3.11Å; F1030-I1061 HydrophobicContact CE1-CD1 4.13Å; F1030-I1061 HydrophobicContact CE1-CG2 4.01Å; F1030-I1061 HydrophobicContact CZ-CD1 4.27Å; F1030-I1061 HydrophobicContact CZ-CG1 4.42Å; F1030-I1061 HydrophobicContact CZ-CG2 4.05Å
1031	D	91.1	Very high	94.4	Very high	68 Å²	68	21.8 Å²	21.8	36%	0.364	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	-61.1	-17.9	175.7	-60.4	-3.3	0	0	0	113.7	R892 S1004 P1029	R892-D1031 IonicContact NH1-OD2 3.94Å; S1004-D1031 WeakPolarHBondContact CA-OD2 3.36Å; S1004-D1031 WeakPolarHBondContact CB-OD2 3.46Å; S1004-D1031 PolarHBondContact N-OD1 2.96Å; P1029-D1031 PolarHBondContact O-N 3.03Å
1032	C	95.5	Very high	94.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-97.9	4.1	-179.6	-59	0	0	0	0	113.1	F415 N416 R892 V1028 P1029 F1030	F415-C1032 HydrophobicContact CD2-CB 4.24Å; F415-C1032 HydrophobicContact CE2-CB 3.98Å; F415-C1032 HydrophobicContact CZ-CB 4.38Å; N416-C1032 WeakPolarHBondContact CB-O 3.23Å; N416-C1032 PolarHBondContact N-O 3.08Å; R892-C1032 WeakPolarHBondContact CB-SG 3.47Å; V1028-C1032 HydrophobicContact CG1-CB 4.4Å; P1029-C1032 HydrophobicContact CB-CB 4.18Å; P1029-C1032 HydrophobicContact CG-CB 4.47Å; P1029-C1032 WeakPolarHBondContact O-CA 3.36Å; P1029-C1032 WeakPolarHBondContact O-CB 3.33Å; P1029-C1032 PolarHBondContact O-N 3.29Å; F1030-C1032 PolarHBondContact O-N 2.98Å; F1030-C1032 VanDerWaalsContact O-N 3.11Å
1033	L	95.2	Very high	95.1	Very high	16 Å²	16	22.8 Å²	22.8	8%	0.084	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-78.8	134.6	175.6	-63.4	172.4	0	0	0	111.5	I414 L934 V1008 V1028 P1029 F1030 I1061	I414-L1033 HydrophobicContact CD1-CD2 3.71Å; I414-L1033 HydrophobicContact CG1-CD2 3.73Å; L934-L1033 HydrophobicContact CD1-CD1 4.45Å; L934-L1033 HydrophobicContact CD2-CD1 4.4Å; V1008-L1033 HydrophobicContact CB-CD1 4.44Å; V1008-L1033 HydrophobicContact CG2-CD1 3.78Å; V1028-L1033 HydrophobicContact CB-CD2 4.09Å; V1028-L1033 HydrophobicContact CG1-CD2 3.67Å; V1028-L1033 HydrophobicContact CG1-CG 4.38Å; P1029-L1033 PolarHBondContact O-N 2.99Å; F1030-L1033 HydrophobicContact CD2-CD1 4.24Å; F1030-L1033 HydrophobicContact CG-CD1 4.4Å; F1030-L1033 WeakPolarHBondContact O-CB 3.49Å; F1030-L1033 WeakPolarHBondContact O-CG 3.39Å; F1030-L1033 PolarHBondContact O-N 3.11Å; F1030-L1033 VanDerWaalsContact O-N 3.11Å; L1033-I1061 HydrophobicContact CB-CD1 3.98Å; L1033-I1061 HydrophobicContact CD1-CD1 4.23Å
1034	L	93.3	Very high	95.1	Very high	41 Å²	41	22.7 Å²	22.7	22%	0.215	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-96.5	148.3	165.4	-65.9	-178.9	0	0	0	112.1	I414 N416 R1038 I1059	I414-L1034 PolarHBondContact O-N 3.4Å; I414-L1034 VanDerWaalsContact O-N 3.08Å; N416-L1034 HydrophobicContact CB-CD1 4.43Å; N416-L1034 HydrophobicContact CB-CD2 3.75Å; N416-L1034 HydrophobicContact CB-CG 3.86Å; L1034-R1038 VanDerWaalsContact CB-CZ 3.48Å; L1034-R1038 VanDerWaalsContact CD1-NH1 3.34Å; L1034-I1059 WeakPolarHBondContact O-CG2 3.29Å
1035	T	93	Very high	94.6	Very high	44 Å²	44	24.7 Å²	24.7	27%	0.27	12%	0.115	S	C	.	.	P	Polyproline II helix	trans	-77.2	164.7	174.2	44.8	0	0	0	0	113	Q369 R1038 I1059	Q369-T1035 PolarHBondContact O-OG1 3.06Å; Q369-T1035 VanDerWaalsContact O-OG1 3.14Å; Q369-T1035 PolarHBondContact OE1-O 3.18Å; Q369-T1035 VanDerWaalsContact OE1-O 3.08Å; T1035-R1038 PolarHBondContact O-NE 3.16Å; T1035-R1038 PolarHBondContact O-NH2 2.79Å; T1035-R1038 VanDerWaalsContact O-NH2 3.14Å; T1035-I1059 WeakPolarHBondContact CA-O 3.36Å
1036	G	93.8	Very high	94.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91.1	-160.4	177.1	0	0	0	0	0	114	E368 H1058 I1059	E368-G1036 WeakPolarHBondContact O-CA 3.48Å; E368-G1036 PolarHBondContact O-N 3Å; G1036-H1058 WeakPolarHBondContact O-CA 3.17Å; G1036-I1059 PolarHBondContact N-O 2.87Å; G1036-I1059 PolarHBondContact O-N 3.48Å
1037	F	95.8	Very high	93.6	Very high	18 Å²	18	27.7 Å²	27.7	8%	0.079	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.1	177.1	-71.2	-77.9	0	0	0	110.6	I345 F364 E368 Q369 L407 V939 F1056 V1057 H1058	I345-F1037 HydrophobicContact CD1-CD1 3.55Å; I345-F1037 HydrophobicContact CD1-CD2 4.11Å; I345-F1037 HydrophobicContact CD1-CE1 3.4Å; I345-F1037 HydrophobicContact CD1-CE2 3.98Å; I345-F1037 HydrophobicContact CD1-CG 3.91Å; I345-F1037 HydrophobicContact CD1-CZ 3.63Å; I345-F1037 HydrophobicContact CG1-CE1 4.07Å; I345-F1037 HydrophobicContact CG1-CE2 4.02Å; I345-F1037 HydrophobicContact CG1-CZ 3.77Å; I345-F1037 HydrophobicContact CG2-CD2 4.2Å; I345-F1037 HydrophobicContact CG2-CE2 4.12Å; F364-F1037 HydrophobicContact CE2-CD2 4.22Å; E368-F1037 HydrophobicContact CG-CD2 3.84Å; E368-F1037 HydrophobicContact CG-CE2 3.8Å; Q369-F1037 PolarHBondContact NE2-O 3.07Å; Q369-F1037 PolarHBondContact OE1-O 3.38Å; L407-F1037 HydrophobicContact CD2-CB 4.3Å; V939-F1037 HydrophobicContact CG2-CE1 4.46Å; F1037-F1056 HydrophobicContact CB-CE2 3.89Å; F1037-F1056 HydrophobicContact CB-CZ 3.88Å; F1037-F1056 HydrophobicContact CD1-CE1 4.09Å; F1037-F1056 HydrophobicContact CD1-CE2 4.31Å; F1037-F1056 AromaticContact CD1-CZ 3.68Å; F1037-F1056 HydrophobicContact CD1-CZ 3.68Å; F1037-F1056 HydrophobicContact CG-CZ 4.08Å; F1037-V1057 WeakPolarHBondContact CA-O 3.31Å; F1037-H1058 HydrophobicContact CD1-CB 3.91Å; F1037-H1058 AromaticContact CD1-CD2 3.91Å; F1037-H1058 AromaticContact CD2-CD2 3.79Å; F1037-H1058 HydrophobicContact CE1-CB 3.81Å; F1037-H1058 AromaticContact CE1-CD2 3.74Å; F1037-H1058 AromaticContact CE2-CD2 3.61Å; F1037-H1058 AromaticContact CG-CD2 3.93Å; F1037-H1058 HydrophobicContact CZ-CB 4.45Å; F1037-H1058 AromaticContact CZ-CD2 3.58Å
1038	R	96.3	Very high	93.2	Very high	9 Å²	9	32.6 Å²	32.6	3%	0.034	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.4	-171.2	-59.8	-62.9	175	172.7	-17.7	111.7	Q369 E411 C412 D413 I414 L1034 T1035 V1057 I1059	Q369-R1038 VanDerWaalsContact OE1-CZ 3.24Å; Q369-R1038 VanDerWaalsContact OE1-NE 3.14Å; E411-R1038 PolarHBondContact O-NH1 2.82Å; C412-R1038 VanDerWaalsContact O-CA 3.29Å; C412-R1038 WeakPolarHBondContact O-CA 3.35Å; C412-R1038 WeakPolarHBondContact O-CD 3.26Å; D413-R1038 WeakPolarHBondContact O-CD 3.44Å; D413-R1038 PolarHBondContact O-NH1 2.85Å; D413-R1038 VanDerWaalsContact O-NH1 3.08Å; I414-R1038 HydrophobicContact CB-CB 4.1Å; L1034-R1038 VanDerWaalsContact CB-CZ 3.48Å; L1034-R1038 VanDerWaalsContact CD1-NH1 3.34Å; T1035-R1038 PolarHBondContact O-NE 3.16Å; T1035-R1038 PolarHBondContact O-NH2 2.79Å; T1035-R1038 VanDerWaalsContact O-NH2 3.14Å; R1038-V1057 HydrophobicContact CB-CG2 4.18Å; R1038-V1057 PolarHBondContact N-O 2.98Å; R1038-V1057 PolarHBondContact O-N 2.67Å; R1038-I1059 HydrophobicContact CB-CD1 4.43Å; R1038-I1059 HydrophobicContact CG-CD1 4.31Å
1039	H	95.4	Very high	92.9	Very high	6 Å²	6	37 Å²	37	3%	0.028	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.5	166.3	-75	98.1	0	0	0	111.4	R339 L407 C412 I414 L1055 F1056	R339-H1039 PolarHBondContact NH1-NE2 3.02Å; L407-H1039 PolarHBondContact O-ND1 2.89Å; C412-H1039 PolarHBondContact O-N 3.12Å; I414-H1039 PolarHBondContact N-O 2.89Å; H1039-L1055 CarbonylContact C-O 3.22Å; H1039-L1055 VanDerWaalsContact CA-O 3.26Å; H1039-L1055 WeakPolarHBondContact CA-O 3.41Å; H1039-F1056 AromaticContact CD2-CD2 3.78Å; H1039-F1056 AromaticContact CE1-CD2 3.4Å; H1039-F1056 WeakPolarHBondContact CE1-CD2 3.39Å; H1039-F1056 AromaticContact CE1-CE2 3.8Å; H1039-F1056 AromaticContact ND1-CD2 3.78Å; H1039-F1056 AromaticContact NE2-CD2 3.39Å; H1039-F1056 WeakPolarHBondContact NE2-CD2 3.47Å; H1039-F1056 AromaticContact NE2-CG 3.74Å
1040	V	96.4	Very high	92.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	104.2	175.1	-169.6	0	0	0	0	108.1	I414 F1010 N1026 L1042 T1054 L1055 V1057	I414-V1040 HydrophobicContact CB-CG2 4.21Å; I414-V1040 HydrophobicContact CD1-CG2 3.6Å; I414-V1040 HydrophobicContact CG2-CB 4.39Å; I414-V1040 HydrophobicContact CG2-CG1 4.32Å; I414-V1040 HydrophobicContact CG2-CG2 4.1Å; F1010-V1040 HydrophobicContact CD2-CG1 4.03Å; F1010-V1040 HydrophobicContact CE1-CG2 4.31Å; F1010-V1040 HydrophobicContact CE2-CG1 4.38Å; F1010-V1040 HydrophobicContact CE2-CG2 4.34Å; F1010-V1040 HydrophobicContact CG-CG1 4.32Å; F1010-V1040 HydrophobicContact CZ-CG2 4.18Å; N1026-V1040 HydrophobicContact CB-CG1 3.71Å; V1040-L1042 PolarHBondContact O-N 3.46Å; V1040-T1054 CarbonylContact O-C 3.56Å; V1040-T1054 VanDerWaalsContact O-CA 3.3Å; V1040-T1054 WeakPolarHBondContact O-CA 3.36Å; V1040-L1055 HydrophobicContact CB-CB 4.1Å; V1040-L1055 HydrophobicContact CG2-CB 4.38Å; V1040-L1055 PolarHBondContact N-O 2.85Å; V1040-L1055 PolarHBondContact O-N 3.49Å; V1040-V1057 HydrophobicContact CG2-CG1 4.17Å; V1040-V1057 HydrophobicContact CG2-CG2 3.79Å
1041	R	94.9	Very high	92.2	Very high	135 Å²	135	43.4 Å²	43.4	51%	0.509	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	126.8	175.2	-68.3	-177.9	-87.2	-176.2	-5.8	109.8	D413 N1026 T1054	D413-R1041 IonicContact OD2-CZ 3.71Å; D413-R1041 IonicContact OD2-NE 3.86Å; D413-R1041 PolarHBondContact OD2-NE 3.33Å; D413-R1041 IonicContact OD2-NH2 2.77Å; D413-R1041 PolarHBondContact OD2-NH2 3.28Å; N1026-R1041 PolarHBondContact ND2-O 3.15Å; R1041-T1054 HydrophobicContact CG-CG2 4.11Å
1042	L	95.9	Very high	91.9	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	154.3	-175.2	-67.6	171.6	0	0	0	112.5	L944 V1012 V1040 I1050 A1053 L1055	L944-L1042 HydrophobicContact CD2-CD1 3.49Å; L944-L1042 VanDerWaalsContact CD2-CD1 3.49Å; V1012-L1042 HydrophobicContact CG2-CD1 3.81Å; V1012-L1042 HydrophobicContact CG2-CD2 3.84Å; V1040-L1042 PolarHBondContact O-N 3.46Å; L1042-I1050 HydrophobicContact CB-CD1 4.28Å; L1042-I1050 PolarHBondContact O-N 2.98Å; L1042-A1053 HydrophobicContact CB-CB 4.23Å; L1042-A1053 HydrophobicContact CD1-CB 4.25Å; L1042-A1053 PolarHBondContact N-O 2.93Å; L1042-L1055 HydrophobicContact CD1-CD2 4.35Å; L1042-L1055 HydrophobicContact CD1-CG 4.45Å; L1042-L1055 HydrophobicContact CD2-CD1 4.38Å; L1042-L1055 HydrophobicContact CD2-CG 4.14Å; L1042-L1055 HydrophobicContact CG-CG 4.5Å
1043	R	94.7	Very high	91.7	Very high	92 Å²	92	43.6 Å²	43.6	35%	0.347	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155.5	177.9	-63.8	173.2	176.2	-88.6	0.1	111.1	G1024 Q1025 G1047 E1048 I1050	G1024-R1043 CarbonylContact C-O 3.54Å; G1024-R1043 WeakPolarHBondContact CA-O 3.2Å; Q1025-R1043 PolarHBondContact N-O 2.93Å; Q1025-R1043 WeakPolarHBondContact O-CA 3.31Å; Q1025-R1043 WeakPolarHBondContact O-CB 3.3Å; Q1025-R1043 PolarHBondContact O-N 3.45Å; R1043-G1047 WeakPolarHBondContact CD-O 3.4Å; R1043-G1047 PolarHBondContact NH1-O 2.94Å; R1043-E1048 CarbonylContact C-O 3.53Å; R1043-E1048 WeakPolarHBondContact CA-O 3.31Å; R1043-E1048 WeakPolarHBondContact CB-O 3.34Å; R1043-I1050 WeakPolarHBondContact O-CD1 3.48Å
1044	S	91.6	Very high	91.6	Very high	7 Å²	7	43.4 Å²	43.4	5%	0.049	23%	0.231	C	C	.	.			trans	-69.9	177.4	175.1	62.6	0	0	0	0	112.9	T1046 G1047 E1048	S1044-T1046 PolarHBondContact O-N 3.39Å; S1044-T1046 PolarHBondContact OG-N 3.34Å; S1044-T1046 PolarHBondContact OG-OG1 3.35Å; S1044-G1047 PolarHBondContact O-N 3.23Å; S1044-G1047 PolarHBondContact OG-N 2.82Å; S1044-E1048 PolarHBondContact N-O 3.29Å; S1044-E1048 WeakPolarHBondContact OG-CB 3.4Å; S1044-E1048 PolarHBondContact OG-N 2.79Å; S1044-E1048 PolarHBondContact OG-O 3.36Å
1045	D	84.7	Confident	91.7	Very high	41 Å²	41	41.5 Å²	41.5	22%	0.219	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.6	165.2	56.8	-35.2	0	0	0	112.8	R948 F1022	R948-D1045 IonicContact CZ-OD1 2.69Å; R948-D1045 IonicContact NH1-OD1 2.69Å; R948-D1045 PolarHBondContact NH1-OD1 3.11Å; F1022-D1045 HydrophobicContact CD1-CB 4.16Å; F1022-D1045 HydrophobicContact CE1-CB 3.93Å; F1022-D1045 VanDerWaalsContact CE1-N 3.3Å
1046	T	85.1	Confident	91.8	Very high	70 Å²	70	39.4 Å²	39.4	43%	0.429	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	0.2	172.3	49.6	0	0	0	0	114.1	S1044 E1048	S1044-T1046 PolarHBondContact O-N 3.39Å; S1044-T1046 PolarHBondContact OG-N 3.34Å; S1044-T1046 PolarHBondContact OG-OG1 3.35Å; T1046-E1048 VanDerWaalsContact C-N 3.27Å; T1046-E1048 PolarHBondContact O-N 2.94Å; T1046-E1048 PolarHBondContact OG1-OE2 2.97Å
1047	G	85.6	Confident	92	Very high	20 Å²	20	39.3 Å²	39.3	21%	0.206	21%	0.207	C	C	.	.	S	Bend	trans	77.5	1.1	-178.3	0	0	0	0	0	115.5	R1043 S1044	R1043-G1047 WeakPolarHBondContact CD-O 3.4Å; R1043-G1047 PolarHBondContact NH1-O 2.94Å; S1044-G1047 PolarHBondContact O-N 3.23Å; S1044-G1047 PolarHBondContact OG-N 2.82Å
1048	E	89.3	Confident	91.9	Very high	109 Å²	109	40 Å²	40	51%	0.509	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-72.5	141.4	177.5	-60	173.6	116.1	0	0	110.9	R1043 S1044 T1046 I1050	R1043-E1048 CarbonylContact C-O 3.53Å; R1043-E1048 WeakPolarHBondContact CA-O 3.31Å; R1043-E1048 WeakPolarHBondContact CB-O 3.34Å; S1044-E1048 PolarHBondContact N-O 3.29Å; S1044-E1048 WeakPolarHBondContact OG-CB 3.4Å; S1044-E1048 PolarHBondContact OG-N 2.79Å; S1044-E1048 PolarHBondContact OG-O 3.36Å; T1046-E1048 VanDerWaalsContact C-N 3.27Å; T1046-E1048 PolarHBondContact O-N 2.94Å; T1046-E1048 PolarHBondContact OG1-OE2 2.97Å; E1048-I1050 PolarHBondContact O-N 3.45Å
1049	P	91.5	Very high	91.9	Very high	95 Å²	95	39.6 Å²	39.6	62%	0.617	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61	129.2	176	-21.6	33.4	0	0	0	112.2	P1051	P1049-P1051 WeakPolarHBondContact O-CD 3.14Å
1050	I	91.9	Very high	91.7	Very high	29 Å²	29	41.7 Å²	41.7	15%	0.149	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.6	172.9	-59.6	173.9	0	0	0	107.8	P945 I1023 L1042 R1043 E1048 L1052 A1053	P945-I1050 HydrophobicContact CG-CD1 4.48Å; P945-I1050 HydrophobicContact CG-CG2 3.94Å; I1023-I1050 VanDerWaalsContact O-CD1 3.29Å; I1023-I1050 WeakPolarHBondContact O-CD1 3.44Å; L1042-I1050 HydrophobicContact CB-CD1 4.28Å; L1042-I1050 PolarHBondContact O-N 2.98Å; R1043-I1050 WeakPolarHBondContact O-CD1 3.48Å; E1048-I1050 PolarHBondContact O-N 3.45Å; I1050-L1052 PolarHBondContact O-N 3.15Å; I1050-A1053 HydrophobicContact CB-CB 3.9Å; I1050-A1053 HydrophobicContact CG2-CB 3.45Å; I1050-A1053 VanDerWaalsContact CG2-CB 3.45Å; I1050-A1053 PolarHBondContact O-N 2.94Å
1051	P	85.5	Confident	91.4	Very high	109 Å²	109	43.7 Å²	43.7	71%	0.708	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	129.4	-179.5	-25.7	35.2	0	0	0	112.2	P1049 A1053	P1049-P1051 WeakPolarHBondContact O-CD 3.14Å; P1051-A1053 PolarHBondContact O-N 3.06Å
1052	L	84.4	Confident	90.8	Very high	71 Å²	71	40.7 Å²	40.7	37%	0.372	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	63.2	-7.3	175.4	-47.2	179.5	0	0	0	116.6	P299 Q943 I1050 T1054	P299-L1052 WeakPolarHBondContact O-CD1 3.48Å; Q943-L1052 HydrophobicContact CB-CB 4.17Å; Q943-L1052 HydrophobicContact CG-CB 4.15Å; Q943-L1052 VanDerWaalsContact NE2-CD1 3.33Å; I1050-L1052 PolarHBondContact O-N 3.15Å; L1052-T1054 PolarHBondContact O-N 3.2Å
1053	A	91.4	Very high	89.7	Confident	1 Å²	1	44 Å²	44	1%	0.008	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.1	-177.8	0	0	0	0	0	111.8	Q942 Q943 L1042 I1050 P1051	Q942-A1053 WeakPolarHBondContact O-CA 3.31Å; Q943-A1053 VanDerWaalsContact O-CB 3.31Å; Q943-A1053 WeakPolarHBondContact O-CB 3.37Å; L1042-A1053 HydrophobicContact CB-CB 4.23Å; L1042-A1053 HydrophobicContact CD1-CB 4.25Å; L1042-A1053 PolarHBondContact N-O 2.93Å; I1050-A1053 HydrophobicContact CB-CB 3.9Å; I1050-A1053 HydrophobicContact CG2-CB 3.45Å; I1050-A1053 VanDerWaalsContact CG2-CB 3.45Å; I1050-A1053 PolarHBondContact O-N 2.94Å; P1051-A1053 PolarHBondContact O-N 3.06Å
1054	T	93.6	Very high	88	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.1	-177.8	52.2	0	0	0	0	112.5	A941 Q942 V1040 R1041 L1052	A941-T1054 CarbonylContact C-O 3.49Å; A941-T1054 VanDerWaalsContact CA-O 3.27Å; A941-T1054 WeakPolarHBondContact CA-O 3.47Å; Q942-T1054 PolarHBondContact N-O 3.22Å; Q942-T1054 PolarHBondContact O-N 2.89Å; Q942-T1054 VanDerWaalsContact O-N 3.13Å; Q942-T1054 PolarHBondContact OE1-O 3.28Å; Q942-T1054 PolarHBondContact OE1-OG1 2.76Å; V1040-T1054 CarbonylContact O-C 3.56Å; V1040-T1054 VanDerWaalsContact O-CA 3.3Å; V1040-T1054 WeakPolarHBondContact O-CA 3.36Å; R1041-T1054 HydrophobicContact CG-CG2 4.11Å; L1052-T1054 PolarHBondContact O-N 3.2Å
1055	L	95.5	Very high	85.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	146.9	154.2	-52.6	178.9	0	0	0	109.1	A941 V961 F1010 V1012 H1039 V1040 L1042 V1057	A941-L1055 HydrophobicContact CB-CD2 3.5Å; A941-L1055 VanDerWaalsContact CB-CD2 3.5Å; V961-L1055 HydrophobicContact CG1-CD1 3.88Å; V961-L1055 HydrophobicContact CG2-CD1 4.38Å; V961-L1055 HydrophobicContact CG2-CD2 3.9Å; F1010-L1055 HydrophobicContact CB-CD1 3.87Å; F1010-L1055 HydrophobicContact CD1-CD1 3.78Å; F1010-L1055 HydrophobicContact CG-CD1 4.14Å; V1012-L1055 HydrophobicContact CG2-CD1 4.31Å; V1012-L1055 HydrophobicContact CG2-CD2 3.84Å; V1012-L1055 HydrophobicContact CG2-CG 4.39Å; H1039-L1055 CarbonylContact C-O 3.22Å; H1039-L1055 VanDerWaalsContact CA-O 3.26Å; H1039-L1055 WeakPolarHBondContact CA-O 3.41Å; V1040-L1055 HydrophobicContact CB-CB 4.1Å; V1040-L1055 HydrophobicContact CG2-CB 4.38Å; V1040-L1055 PolarHBondContact N-O 2.85Å; V1040-L1055 PolarHBondContact O-N 3.49Å; L1042-L1055 HydrophobicContact CD1-CD2 4.35Å; L1042-L1055 HydrophobicContact CD1-CG 4.45Å; L1042-L1055 HydrophobicContact CD2-CD1 4.38Å; L1042-L1055 HydrophobicContact CD2-CG 4.14Å; L1042-L1055 HydrophobicContact CG-CG 4.5Å; L1055-V1057 HydrophobicContact CB-CG1 4.09Å
1056	F	95.4	Very high	83.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.7	165.5	-174.2	-130.4	0	0	0	108.5	E341 I342 I345 L407 V939 S940 F1037 H1039	E341-F1056 HydrophobicContact CG-CD1 4.01Å; E341-F1056 HydrophobicContact CG-CE1 4.09Å; I342-F1056 HydrophobicContact CG1-CE1 4.2Å; I342-F1056 HydrophobicContact CG1-CZ 4.39Å; I345-F1056 HydrophobicContact CD1-CE1 3.74Å; I345-F1056 HydrophobicContact CD1-CZ 3.73Å; L407-F1056 HydrophobicContact CD1-CE2 4.34Å; L407-F1056 HydrophobicContact CD1-CZ 4.1Å; L407-F1056 HydrophobicContact CD2-CE2 4.38Å; V939-F1056 HydrophobicContact CB-CD1 3.79Å; V939-F1056 HydrophobicContact CB-CE1 4.44Å; V939-F1056 HydrophobicContact CB-CG 4.47Å; V939-F1056 WeakPolarHBondContact CB-O 3.49Å; V939-F1056 HydrophobicContact CG1-CD1 3.75Å; V939-F1056 HydrophobicContact CG1-CE1 4.14Å; V939-F1056 HydrophobicContact CG2-CD1 4.31Å; V939-F1056 PolarHBondContact N-O 3.25Å; S940-F1056 PolarHBondContact N-O 2.8Å; S940-F1056 PolarHBondContact O-N 3.26Å; F1037-F1056 HydrophobicContact CB-CE2 3.89Å; F1037-F1056 HydrophobicContact CB-CZ 3.88Å; F1037-F1056 HydrophobicContact CD1-CE1 4.09Å; F1037-F1056 HydrophobicContact CD1-CE2 4.31Å; F1037-F1056 AromaticContact CD1-CZ 3.68Å; F1037-F1056 HydrophobicContact CD1-CZ 3.68Å; F1037-F1056 HydrophobicContact CG-CZ 4.08Å; H1039-F1056 AromaticContact CD2-CD2 3.78Å; H1039-F1056 AromaticContact CE1-CD2 3.4Å; H1039-F1056 WeakPolarHBondContact CE1-CD2 3.39Å; H1039-F1056 AromaticContact CE1-CE2 3.8Å; H1039-F1056 AromaticContact ND1-CD2 3.78Å; H1039-F1056 AromaticContact NE2-CD2 3.39Å; H1039-F1056 WeakPolarHBondContact NE2-CD2 3.47Å; H1039-F1056 AromaticContact NE2-CG 3.74Å
1057	V	96.7	Very high	81.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	157.7	-171.7	-56.6	0	0	0	0	111.1	I414 L936 K937 I938 F1010 F1037 R1038 V1040 L1055 I1059	I414-V1057 HydrophobicContact CD1-CG2 4.48Å; L936-V1057 HydrophobicContact CD1-CB 4Å; L936-V1057 HydrophobicContact CD1-CG1 4.49Å; L936-V1057 HydrophobicContact CD1-CG2 4.24Å; K937-V1057 CarbonylContact O-C 3.56Å; K937-V1057 VanDerWaalsContact O-CA 3.26Å; K937-V1057 WeakPolarHBondContact O-CA 3.36Å; K937-V1057 WeakPolarHBondContact O-CB 3.41Å; I938-V1057 HydrophobicContact CD1-CG1 3.66Å; F1010-V1057 HydrophobicContact CE1-CG1 4.11Å; F1037-V1057 WeakPolarHBondContact CA-O 3.31Å; R1038-V1057 HydrophobicContact CB-CG2 4.18Å; R1038-V1057 PolarHBondContact N-O 2.98Å; R1038-V1057 PolarHBondContact O-N 2.67Å; V1040-V1057 HydrophobicContact CG2-CG1 4.17Å; V1040-V1057 HydrophobicContact CG2-CG2 3.79Å; L1055-V1057 HydrophobicContact CB-CG1 4.09Å; V1057-I1059 HydrophobicContact CG2-CD1 4Å; V1057-I1059 HydrophobicContact CG2-CG1 4.08Å
1058	H	94.9	Very high	78.7	Confident	31 Å²	31	60.3 Å²	60.3	14%	0.144	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.5	169.1	178	-89	0	0	0	110.3	E368 L936 K937 G1036 F1037 T1060	E368-H1058 IonicContact OE1-CD2 3.92Å; E368-H1058 IonicContact OE1-CE1 2.66Å; E368-H1058 IonicContact OE1-NE2 3.33Å; E368-H1058 PolarHBondContact OE1-NE2 3.27Å; L936-H1058 CarbonylContact C-O 3.57Å; L936-H1058 WeakPolarHBondContact CA-O 3.28Å; K937-H1058 HydrophobicContact CB-CB 4.21Å; K937-H1058 PolarHBondContact N-O 3.27Å; K937-H1058 PolarHBondContact O-N 3.47Å; G1036-H1058 WeakPolarHBondContact O-CA 3.17Å; F1037-H1058 HydrophobicContact CD1-CB 3.91Å; F1037-H1058 AromaticContact CD1-CD2 3.91Å; F1037-H1058 AromaticContact CD2-CD2 3.79Å; F1037-H1058 HydrophobicContact CE1-CB 3.81Å; F1037-H1058 AromaticContact CE1-CD2 3.74Å; F1037-H1058 AromaticContact CE2-CD2 3.61Å; F1037-H1058 AromaticContact CG-CD2 3.93Å; F1037-H1058 HydrophobicContact CZ-CB 4.45Å; F1037-H1058 AromaticContact CZ-CD2 3.58Å; H1058-T1060 PolarHBondContact CE1-OG1 3.39Å
1059	I	95	Very high	76	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.8	-170.4	-62.2	175	0	0	0	110.1	I414 L934 L936 L1034 T1035 G1036 R1038 V1057 I1061	I414-I1059 HydrophobicContact CD1-CD1 3.55Å; I414-I1059 HydrophobicContact CG1-CD1 3.66Å; L934-I1059 HydrophobicContact CD1-CG2 3.93Å; L936-I1059 HydrophobicContact CD1-CD1 4.41Å; L936-I1059 HydrophobicContact CD1-CG1 3.73Å; L1034-I1059 WeakPolarHBondContact O-CG2 3.29Å; T1035-I1059 WeakPolarHBondContact CA-O 3.36Å; G1036-I1059 PolarHBondContact N-O 2.87Å; G1036-I1059 PolarHBondContact O-N 3.48Å; R1038-I1059 HydrophobicContact CB-CD1 4.43Å; R1038-I1059 HydrophobicContact CG-CD1 4.31Å; V1057-I1059 HydrophobicContact CG2-CD1 4Å; V1057-I1059 HydrophobicContact CG2-CG1 4.08Å; I1059-I1061 HydrophobicContact CG2-CD1 4.45Å; I1059-I1061 HydrophobicContact CG2-CG1 4.21Å
1060	T	92	Very high	73.1	Confident	49 Å²	49	63.3 Å²	63.3	30%	0.301	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.2	169.1	-44.3	0	0	0	0	109.4	R935 H1058 T1062	R935-T1060 PolarHBondContact N-O 2.85Å; R935-T1060 PolarHBondContact O-N 3.11Å; H1058-T1060 PolarHBondContact CE1-OG1 3.39Å; T1060-T1062 HydrophobicContact CG2-CG2 4.37Å
1061	I	89.8	Confident	70.3	Confident	42 Å²	42	70 Å²	70	22%	0.215	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.4	175.9	-59.6	173.7	0	0	0	107.8	Q932 V933 L934 F1030 L1033 I1059	Q932-I1061 HydrophobicContact CB-CG2 4.28Å; Q932-I1061 HydrophobicContact CG-CG2 4.47Å; V933-I1061 WeakPolarHBondContact O-CA 3.28Å; L934-I1061 HydrophobicContact CD1-CG1 3.91Å; F1030-I1061 HydrophobicContact CE1-CD1 4.13Å; F1030-I1061 HydrophobicContact CE1-CG2 4.01Å; F1030-I1061 HydrophobicContact CZ-CD1 4.27Å; F1030-I1061 HydrophobicContact CZ-CG1 4.42Å; F1030-I1061 HydrophobicContact CZ-CG2 4.05Å; L1033-I1061 HydrophobicContact CB-CD1 3.98Å; L1033-I1061 HydrophobicContact CD1-CD1 4.23Å; I1059-I1061 HydrophobicContact CG2-CD1 4.45Å; I1059-I1061 HydrophobicContact CG2-CG1 4.21Å
1062	T	83.4	Confident	67.9	Low	73 Å²	73	69.4 Å²	69.4	45%	0.448	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.4	175.1	59	0	0	0	0	111.7	Q932 V933 T1060	Q932-T1062 CarbonylContact C-O 3.4Å; Q932-T1062 WeakPolarHBondContact CA-O 3.39Å; V933-T1062 PolarHBondContact N-O 3.04Å; V933-T1062 PolarHBondContact O-N 3.38Å; T1060-T1062 HydrophobicContact CG2-CG2 4.37Å
1063	T	72.4	Confident	65.6	Low	70 Å²	70	71.5 Å²	71.5	43%	0.429	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	145.2	172.4	49.2	0	0	0	0	110.7	Q932 T1065	Q932-T1063 HydrophobicContact CG-CG2 3.96Å; T1063-T1065 PolarHBondContact O-N 3.23Å; T1063-T1065 PolarHBondContact OG1-OG1 3.05Å
1064	R	58.1	Low	63	Low	137 Å²	137	74.2 Å²	74.2	52%	0.517	42%	0.419	S	S	.	.			trans	-84.9	43.4	179.9	-157	-163.6	75.3	-177.4	4.4	112.7	P931	P931-R1064 HydrophobicContact CB-CB 4.28Å; P931-R1064 WeakPolarHBondContact O-CB 3.4Å; P931-R1064 PolarHBondContact O-N 3.46Å
1065	T	46.6	Very low	60.5	Low	69 Å²	69	74.9 Å²	74.9	42%	0.423	43%	0.428	S	S	.	.			trans	-109.8	139.7	-172.6	46.8	0	0	0	0	112.2	T930 T1063 N1067	T930-T1065 HydrophobicContact CG2-CG2 4.2Å; T1063-T1065 PolarHBondContact O-N 3.23Å; T1063-T1065 PolarHBondContact OG1-OG1 3.05Å; T1065-N1067 PolarHBondContact O-N 3.28Å
1066	D	37.3	Very low	57.8	Low	107 Å²	107	78.3 Å²	78.3	57%	0.572	45%	0.446	S	S	*	.			trans	-69.9	83.5	-164.5	-56.6	-54.7	0	0	0	114.3	S1068	D1066-S1068 PolarHBondContact O-N 3.18Å; D1066-S1068 VanDerWaalsContact O-N 3.12Å
1067	N	37.1	Very low	54.9	Low	157 Å²	157	81.3 Å²	81.3	84%	0.84	46%	0.461	S	S	*	.			trans	-68.7	108.4	173.7	-96.2	7.6	0	0	0	111.7	T1065 H1069	T1065-N1067 PolarHBondContact O-N 3.28Å; N1067-H1069 VanDerWaalsContact C-N 3.3Å; N1067-H1069 PolarHBondContact O-N 3.5Å
1068	S	30.3	Very low	52.2	Low	102 Å²	102	84.3 Å²	84.3	71%	0.713	48%	0.475	S	S	*	.			trans	-84	39.9	-165.2	47.2	0	0	0	0	115.5	D1066	D1066-S1068 PolarHBondContact O-N 3.18Å; D1066-S1068 VanDerWaalsContact O-N 3.12Å
1069	H	33.5	Very low	49.7	Very low	178 Å²	178	86.3 Å²	86.3	82%	0.824	48%	0.481	S	S	*	.	S	Bend	trans	-130.6	114.5	175.7	-75.2	-55.2	0	0	0	114.3	N1067 E1071	N1067-H1069 VanDerWaalsContact C-N 3.3Å; N1067-H1069 PolarHBondContact O-N 3.5Å; H1069-E1071 VanDerWaalsContact C-N 3.34Å; H1069-E1071 PolarHBondContact O-N 3.22Å
1070	G	31.4	Very low	47.3	Very low	89 Å²	89	88.8 Å²	88.8	92%	0.918	49%	0.491	S	S	*	.	S	Bend	trans	76.5	-54	149.3	0	0	0	0	0	118.5
1071	E	32.1	Very low	45	Very low	171 Å²	171	87.6 Å²	87.6	80%	0.799	48%	0.481	S	S	*	.	S	Bend	trans	-115.2	149.1	-156.3	-60.7	-155.9	141.8	0	0	115.7	H1069 N1073	H1069-E1071 VanDerWaalsContact C-N 3.34Å; H1069-E1071 PolarHBondContact O-N 3.22Å; E1071-N1073 VanDerWaalsContact C-N 3.28Å; E1071-N1073 PolarHBondContact O-N 2.76Å
1072	T	34.9	Very low	42.8	Very low	95 Å²	95	88.9 Å²	88.9	58%	0.583	49%	0.494	S	S	*	.			trans	-81.7	60.8	-165.7	58.6	0	0	0	0	114.2	T1074 G1075	T1072-T1074 PolarHBondContact O-N 2.9Å; T1072-G1075 PolarHBondContact O-N 3.33Å
1073	N	35.5	Very low	41.1	Very low	116 Å²	116	87.7 Å²	87.7	62%	0.62	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-5	172.6	-96.2	-43.6	0	0	0	114	E1071 G1075 L1076	E1071-N1073 VanDerWaalsContact C-N 3.28Å; E1071-N1073 PolarHBondContact O-N 2.76Å; N1073-G1075 PolarHBondContact O-N 3.17Å; N1073-L1076 HydrophobicContact CB-CD1 4.38Å; N1073-L1076 WeakPolarHBondContact O-CB 3.43Å; N1073-L1076 PolarHBondContact O-N 3.24Å; N1073-L1076 WeakPolarHBondContact OD1-CD1 3.45Å
1074	T	37.8	Very low	40	Very low	58 Å²	58	85.1 Å²	85.1	36%	0.356	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-11.1	169.6	64.7	0	0	0	0	114.1	T1072 L1076 R1128	T1072-T1074 PolarHBondContact O-N 2.9Å; T1074-L1076 VanDerWaalsContact C-N 3.35Å; T1074-R1128 PolarHBondContact O-NH2 3.49Å
1075	G	40.2	Very low	39.4	Very low	26 Å²	26	84.8 Å²	84.8	27%	0.268	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-36	165.1	0	0	0	0	0	113.6	T1072 N1073 L1077 H1078 R1079	T1072-G1075 PolarHBondContact O-N 3.33Å; N1073-G1075 PolarHBondContact O-N 3.17Å; G1075-L1077 PolarHBondContact O-N 2.96Å; G1075-H1078 PolarHBondContact O-N 3.41Å; G1075-R1079 WeakPolarHBondContact O-CB 3.29Å; G1075-R1079 PolarHBondContact O-N 3.28Å
1076	L	38.7	Very low	39.5	Very low	72 Å²	72	82.4 Å²	82.4	38%	0.377	45%	0.447	S	S	.	.	H	α-helix	trans	-61.2	-38.7	-175	-72.5	169	0	0	0	113.1	N1073 T1074 R1079 W1080	N1073-L1076 HydrophobicContact CB-CD1 4.38Å; N1073-L1076 WeakPolarHBondContact O-CB 3.43Å; N1073-L1076 PolarHBondContact O-N 3.24Å; N1073-L1076 WeakPolarHBondContact OD1-CD1 3.45Å; T1074-L1076 VanDerWaalsContact C-N 3.35Å; L1076-R1079 PolarHBondContact O-N 3.08Å; L1076-W1080 VanDerWaalsContact O-CB 3.32Å; L1076-W1080 WeakPolarHBondContact O-CB 3.47Å; L1076-W1080 PolarHBondContact O-N 3.23Å
1077	L	36.5	Very low	40.2	Very low	63 Å²	63	78.6 Å²	78.6	33%	0.33	43%	0.426	S	S	.	.	H	α-helix	trans	-67.6	-45.5	180	-116.2	69	0	0	0	112.8	G1075 R1079 R1081	G1075-L1077 PolarHBondContact O-N 2.96Å; L1077-R1079 VanDerWaalsContact C-N 3.33Å; L1077-R1081 WeakPolarHBondContact O-CD 3.28Å; L1077-R1081 VanDerWaalsContact O-CG 3.26Å; L1077-R1081 WeakPolarHBondContact O-CG 3.38Å; L1077-R1081 PolarHBondContact O-N 3.01Å
1078	H	39.1	Very low	41.2	Very low	63 Å²	63	72 Å²	72	29%	0.292	39%	0.391	S	S	.	.	H	α-helix	trans	-64.5	-40.4	173	-85.6	-111.3	0	0	0	111.7	G1075 S1082 S1121 N1125 R1128	G1075-H1078 PolarHBondContact O-N 3.41Å; H1078-S1082 WeakPolarHBondContact O-CB 3.46Å; H1078-S1082 PolarHBondContact O-N 3.38Å; H1078-S1082 VanDerWaalsContact O-N 3.12Å; H1078-S1121 PolarHBondContact CE1-OG 3.28Å; H1078-S1121 PolarHBondContact ND1-OG 3Å; H1078-S1121 PolarHBondContact NE2-O 3.03Å; H1078-S1121 PolarHBondContact NE2-OG 3.43Å; H1078-N1125 PolarHBondContact NE2-ND2 2.95Å; H1078-N1125 PolarHBondContact NE2-OD1 3.39Å; H1078-R1128 PolarHBondContact CD2-NH1 2.79Å; H1078-R1128 PolarHBondContact CD2-NH2 3.01Å; H1078-R1128 VanDerWaalsContact CD2-NH2 3.3Å
1079	R	42.5	Very low	42.8	Very low	73 Å²	73	70.4 Å²	70.4	28%	0.275	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-46	179.7	-172.6	-175.5	103.3	158.7	11.2	111.2	R935 E997 G1075 L1076 L1077 R1083	R935-R1079 VanDerWaalsContact NH2-NH2 3.1Å; E997-R1079 VanDerWaalsContact CD-NH2 3.33Å; E997-R1079 IonicContact OE1-CZ 2.68Å; E997-R1079 IonicContact OE1-NE 3.65Å; E997-R1079 IonicContact OE1-NH2 3.87Å; E997-R1079 PolarHBondContact OE1-NH2 2.87Å; E997-R1079 IonicContact OE2-NH2 3.84Å; E997-R1079 PolarHBondContact OE2-NH2 2.69Å; G1075-R1079 WeakPolarHBondContact O-CB 3.29Å; G1075-R1079 PolarHBondContact O-N 3.28Å; L1076-R1079 PolarHBondContact O-N 3.08Å; L1077-R1079 VanDerWaalsContact C-N 3.33Å; R1079-R1083 WeakPolarHBondContact O-CB 3.39Å; R1079-R1083 VanDerWaalsContact O-CD 3.26Å; R1079-R1083 WeakPolarHBondContact O-CD 3.24Å; R1079-R1083 WeakPolarHBondContact O-CG 3.44Å; R1079-R1083 PolarHBondContact O-N 3.09Å
1080	W	44.4	Very low	44.7	Very low	55 Å²	55	63 Å²	63	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-53.4	179.3	-179	75.8	0	0	0	111.6	C999 L1076 S1082 R1083 N1084	C999-W1080 HydrophobicContact CB-CZ2 3.75Å; L1076-W1080 VanDerWaalsContact O-CB 3.32Å; L1076-W1080 WeakPolarHBondContact O-CB 3.47Å; L1076-W1080 PolarHBondContact O-N 3.23Å; W1080-S1082 PolarHBondContact O-N 2.82Å; W1080-R1083 PolarHBondContact O-N 2.88Å; W1080-N1084 PolarHBondContact O-N 2.57Å
1081	R	43.8	Very low	46.9	Very low	23 Å²	23	60.2 Å²	60.2	9%	0.087	30%	0.301	C	S	.	.	H	α-helix	trans	-54.4	-51.1	-179.4	-66	168	-177.4	168.9	-4.2	110.8	L1077 R1083 N1084 T1117 L1120 D1124	L1077-R1081 WeakPolarHBondContact O-CD 3.28Å; L1077-R1081 VanDerWaalsContact O-CG 3.26Å; L1077-R1081 WeakPolarHBondContact O-CG 3.38Å; L1077-R1081 PolarHBondContact O-N 3.01Å; R1081-R1083 PolarHBondContact O-N 2.86Å; R1081-N1084 PolarHBondContact O-N 3.36Å; R1081-T1117 VanDerWaalsContact C-CG2 3.44Å; R1081-T1117 HydrophobicContact CB-CG2 3.96Å; R1081-T1117 WeakPolarHBondContact O-CG2 3.26Å; R1081-T1117 PolarHBondContact O-OG1 3.49Å; R1081-L1120 VanDerWaalsContact NH1-C 3.26Å; R1081-L1120 PolarHBondContact NH1-O 3.19Å; R1081-D1124 IonicContact CZ-OD1 3.92Å; R1081-D1124 IonicContact CZ-OD2 3.9Å; R1081-D1124 IonicContact NH1-OD1 2.91Å; R1081-D1124 PolarHBondContact NH1-OD1 3.4Å; R1081-D1124 IonicContact NH1-OD2 3.45Å; R1081-D1124 PolarHBondContact NH1-OD2 2.86Å; R1081-D1124 IonicContact NH2-OD1 2.57Å; R1081-D1124 PolarHBondContact NH2-OD1 2.95Å; R1081-D1124 IonicContact NH2-OD2 2.69Å; R1081-D1124 PolarHBondContact NH2-OD2 2.87Å
1082	S	42.5	Very low	48.9	Very low	70 Å²	70	58.2 Å²	58.2	49%	0.49	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-11	178.5	-169.4	0	0	0	0	115.6	H1078 W1080	H1078-S1082 WeakPolarHBondContact O-CB 3.46Å; H1078-S1082 PolarHBondContact O-N 3.38Å; H1078-S1082 VanDerWaalsContact O-N 3.12Å; W1080-S1082 PolarHBondContact O-N 2.82Å
1083	R	48.9	Very low	50.7	Low	48 Å²	48	54 Å²	54	18%	0.181	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-8.8	-175.7	-73.5	176.7	-178.7	-168.9	-0.8	114.7	N207 R1079 W1080 R1081 R1085	N207-R1083 PolarHBondContact ND2-O 2.87Å; N207-R1083 WeakPolarHBondContact OD1-CG 3.38Å; R1079-R1083 WeakPolarHBondContact O-CB 3.39Å; R1079-R1083 VanDerWaalsContact O-CD 3.26Å; R1079-R1083 WeakPolarHBondContact O-CD 3.24Å; R1079-R1083 WeakPolarHBondContact O-CG 3.44Å; R1079-R1083 PolarHBondContact O-N 3.09Å; W1080-R1083 PolarHBondContact O-N 2.88Å; R1081-R1083 PolarHBondContact O-N 2.86Å; R1083-R1085 PolarHBondContact O-N 2.99Å
1084	N	48.5	Very low	52.3	Low	16 Å²	16	49.8 Å²	49.8	9%	0.086	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	0.6	-178.7	-96.1	29.5	0	0	0	116.2	W1080 R1081 Q1086 Q1087	W1080-N1084 PolarHBondContact O-N 2.57Å; R1081-N1084 PolarHBondContact O-N 3.36Å; N1084-Q1086 PolarHBondContact O-N 3.04Å; N1084-Q1087 PolarHBondContact OD1-OE1 2.9Å
1085	R	46	Very low	53.6	Low	129 Å²	129	47.5 Å²	47.5	49%	0.487	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-17.8	175.8	-72	175.9	157.2	171.4	-5.6	116.2	R1083 E1114	R1083-R1085 PolarHBondContact O-N 2.99Å; R1085-E1114 HydrophobicContact CG-CG 4.5Å; R1085-E1114 IonicContact CZ-OE1 2.84Å; R1085-E1114 IonicContact NE-OE1 2.69Å; R1085-E1114 PolarHBondContact NE-OE1 3.43Å; R1085-E1114 IonicContact NH2-OE1 2.8Å; R1085-E1114 PolarHBondContact NH2-OE1 2.91Å
1086	Q	47.8	Very low	55	Low	19 Å²	19	48.4 Å²	48.4	9%	0.089	24%	0.237	C	C	.	.	S	Bend	trans	-125.7	-21.1	-167.1	-69	179.9	-17.3	0	0	116.4	S203 T204 N207 N1084 L1088	S203-Q1086 PolarHBondContact O-NE2 2.87Å; T204-Q1086 VanDerWaalsContact O-CD 3.29Å; T204-Q1086 PolarHBondContact O-NE2 3.11Å; T204-Q1086 PolarHBondContact O-OE1 3.35Å; N207-Q1086 VanDerWaalsContact CG-OE1 3.28Å; N207-Q1086 PolarHBondContact ND2-OE1 2.91Å; N1084-Q1086 PolarHBondContact O-N 3.04Å; Q1086-L1088 PolarHBondContact O-N 3.11Å; Q1086-L1088 VanDerWaalsContact O-N 3.13Å
1087	Q	52.6	Low	56.3	Low	27 Å²	27	45.9 Å²	45.9	13%	0.126	22%	0.224	C	C	.	.	S	Bend	trans	-67.3	-10.4	177.6	-75.5	178.4	-14.2	0	0	113.5	E997 N1084	E997-Q1087 PolarHBondContact O-NE2 3.12Å; N1084-Q1087 PolarHBondContact OD1-OE1 2.9Å
1088	L	58	Low	57.7	Low	20 Å²	20	43.1 Å²	43.1	11%	0.105	21%	0.21	C	C	.	.			trans	-113.2	58	-172.1	-59	176.1	0	0	0	111.4	Q1086 L1109 C1113 L1443 Q1447	Q1086-L1088 PolarHBondContact O-N 3.11Å; Q1086-L1088 VanDerWaalsContact O-N 3.13Å; L1088-L1109 HydrophobicContact CB-CD2 4.05Å; L1088-L1109 HydrophobicContact CD1-CD2 4.27Å; L1088-L1109 HydrophobicContact CD1-CG 4.22Å; L1088-C1113 HydrophobicContact CD1-CB 4.35Å; L1088-C1113 WeakPolarHBondContact CD1-SG 3.33Å; L1088-L1443 HydrophobicContact CD2-CD1 3.88Å; L1088-L1443 HydrophobicContact CD2-CD2 4.2Å; L1088-L1443 HydrophobicContact CD2-CG 4Å; L1088-Q1447 HydrophobicContact CD1-CG 3.83Å; L1088-Q1447 HydrophobicContact CD2-CG 3.61Å; L1088-Q1447 HydrophobicContact CG-CG 4.38Å
1089	Q	64.7	Low	59.4	Low	67 Å²	67	41.7 Å²	41.7	31%	0.313	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-90.2	116.8	164.6	-69.1	-168.5	92.4	0	0	108.8
1090	L	72.7	Confident	60.8	Low	24 Å²	24	43.1 Å²	43.1	13%	0.126	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-72.5	129.7	167.8	-65	171.1	0	0	0	108	F1102 A1106 N1440 L1443 L1444	L1090-F1102 HydrophobicContact CB-CB 4.34Å; L1090-F1102 HydrophobicContact CD1-CB 4.07Å; L1090-F1102 HydrophobicContact CD1-CD1 4.1Å; L1090-F1102 WeakPolarHBondContact CD1-O 3.44Å; L1090-A1106 HydrophobicContact CD1-CB 4.12Å; L1090-N1440 WeakPolarHBondContact CA-OD1 3.38Å; L1090-N1440 HydrophobicContact CD2-CB 3.79Å; L1090-L1443 HydrophobicContact CD2-CB 4.25Å; L1090-L1443 HydrophobicContact CD2-CD2 3.75Å; L1090-L1443 HydrophobicContact CD2-CG 4.48Å; L1090-L1443 HydrophobicContact CG-CD2 4.5Å; L1090-L1444 HydrophobicContact CD1-CD1 4.4Å; L1090-L1444 HydrophobicContact CD1-CD2 4.33Å; L1090-L1444 HydrophobicContact CD1-CG 4.48Å; L1090-L1444 HydrophobicContact CD2-CD1 4.43Å; L1090-L1444 HydrophobicContact CD2-CD2 4.49Å; L1090-L1444 HydrophobicContact CD2-CG 4.07Å
1091	K	77.5	Confident	62	Low	29 Å²	29	42.6 Å²	42.6	13%	0.126	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-60	142.2	178.2	-74.1	-176.5	179.5	-177	0	110.4	E964 E974 V1093 N1436 W1439 N1440	E964-K1091 IonicContact OE1-NZ 2.85Å; E964-K1091 PolarHBondContact OE1-NZ 3.44Å; E964-K1091 IonicContact OE2-NZ 3.69Å; E974-K1091 VanDerWaalsContact OE1-CE 3.3Å; E974-K1091 WeakPolarHBondContact OE1-CE 3.34Å; E974-K1091 WeakPolarHBondContact OE2-CE 3.48Å; E974-K1091 WeakPolarHBondContact OE2-CG 3.28Å; K1091-V1093 PolarHBondContact O-N 3.01Å; K1091-N1436 HydrophobicContact CB-CB 4Å; K1091-N1436 HydrophobicContact CD-CB 4.4Å; K1091-N1436 VanDerWaalsContact CD-OD1 3.28Å; K1091-N1436 WeakPolarHBondContact CD-OD1 3.25Å; K1091-W1439 HydrophobicContact CD-CB 4.39Å; K1091-W1439 VanDerWaalsContact CD-CD1 3.46Å; K1091-W1439 HydrophobicContact CD-CG 3.95Å; K1091-W1439 VanDerWaalsContact CG-CD1 3.5Å; K1091-W1439 HydrophobicContact CG-CG 4.43Å; K1091-N1440 PolarHBondContact N-OD1 2.99Å; K1091-N1440 PolarHBondContact O-ND2 3.21Å
1092	K	74.8	Confident	63.3	Low	129 Å²	129	41.8 Å²	41.8	56%	0.561	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-66.2	125.4	168.1	-164.5	-178	179.2	-172.8	0	108.6	D1099 N1436	K1092-D1099 WeakPolarHBondContact CE-OD2 3.4Å; K1092-D1099 VanDerWaalsContact CG-OD1 3.3Å; K1092-D1099 WeakPolarHBondContact CG-OD1 3.12Å; K1092-D1099 VanDerWaalsContact CG-OD2 3.32Å; K1092-D1099 WeakPolarHBondContact CG-OD2 3.27Å; K1092-N1436 PolarHBondContact O-ND2 3.32Å
1093	V	72.6	Confident	64.8	Low	6 Å²	6	46.1 Å²	46.1	4%	0.036	22%	0.222	C	C	.	.			trans	-81.7	-24.9	176	176.8	0	0	0	0	110.1	K1091 V1095 F1098 D1099 F1102 V1433 N1436 V1437	K1091-V1093 PolarHBondContact O-N 3.01Å; V1093-V1095 HydrophobicContact CG1-CB 4.38Å; V1093-V1095 HydrophobicContact CG1-CG2 4.49Å; V1093-V1095 PolarHBondContact O-N 2.99Å; V1093-F1098 HydrophobicContact CB-CB 3.87Å; V1093-F1098 HydrophobicContact CG1-CB 3.77Å; V1093-F1098 HydrophobicContact CG1-CD2 4.13Å; V1093-F1098 HydrophobicContact CG1-CG 4.12Å; V1093-F1098 HydrophobicContact CG2-CB 4.15Å; V1093-D1099 WeakPolarHBondContact CA-OD1 3.48Å; V1093-D1099 PolarHBondContact N-OD1 3.37Å; V1093-F1102 HydrophobicContact CG2-CD2 3.78Å; V1093-F1102 HydrophobicContact CG2-CE2 3.78Å; V1093-V1433 HydrophobicContact CG1-CG1 3.77Å; V1093-N1436 HydrophobicContact CG2-CB 4.35Å; V1093-V1437 HydrophobicContact CB-CG2 4.37Å; V1093-V1437 HydrophobicContact CG1-CG2 3.62Å; V1093-V1437 HydrophobicContact CG2-CG2 3.74Å
1094	G	68.7	Low	65.8	Low	29 Å²	29	46.6 Å²	46.6	30%	0.299	24%	0.236	S	C	.	.	S	Bend	trans	84.5	-4.2	176.9	0	0	0	0	0	113.7	D1099 R1402	G1094-D1099 WeakPolarHBondContact CA-OD2 3.39Å; G1094-D1099 PolarHBondContact N-OD1 2.94Å; G1094-D1099 PolarHBondContact N-OD2 3.23Å; G1094-R1402 PolarHBondContact O-NH1 3.37Å; G1094-R1402 PolarHBondContact O-NH2 3.37Å
1095	V	65.5	Low	66.7	Low	10 Å²	10	46.6 Å²	46.6	6%	0.061	24%	0.236	C	C	.	.	S	Bend	trans	-105.9	121.8	173.6	180	0	0	0	0	107.5	V1093 T1097 F1098 D1099 L1395 I1399 V1433	V1093-V1095 HydrophobicContact CG1-CB 4.38Å; V1093-V1095 HydrophobicContact CG1-CG2 4.49Å; V1093-V1095 PolarHBondContact O-N 2.99Å; V1095-T1097 VanDerWaalsContact C-N 3.35Å; V1095-T1097 PolarHBondContact O-N 2.76Å; V1095-F1098 HydrophobicContact CB-CD2 4.07Å; V1095-F1098 HydrophobicContact CG1-CD2 4.05Å; V1095-F1098 PolarHBondContact O-N 3.43Å; V1095-F1098 VanDerWaalsContact O-N 3.09Å; V1095-D1099 PolarHBondContact O-N 3.48Å; V1095-L1395 HydrophobicContact CG1-CD1 3.51Å; V1095-I1399 HydrophobicContact CG1-CG1 4.28Å; V1095-V1433 HydrophobicContact CG2-CG1 4.19Å
1096	S	69.2	Low	67.9	Low	45 Å²	45	41.8 Å²	41.8	32%	0.315	22%	0.224	S	C	.	.	H	α-helix	trans	-55.9	-41.2	-163.8	48.5	0	0	0	0	114.6	D1099 E1100	S1096-D1099 PolarHBondContact O-N 3.11Å; S1096-E1100 WeakPolarHBondContact O-CB 3.4Å; S1096-E1100 PolarHBondContact O-N 3.5Å
1097	T	67	Low	68.9	Low	19 Å²	19	45 Å²	45	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-40	178.8	48.1	0	0	0	0	112.9	V1095 I1101 L1395	V1095-T1097 VanDerWaalsContact C-N 3.35Å; V1095-T1097 PolarHBondContact O-N 2.76Å; T1097-I1101 WeakPolarHBondContact O-CD1 3.48Å; T1097-I1101 VanDerWaalsContact O-CG1 3.27Å; T1097-I1101 WeakPolarHBondContact O-CG1 3.33Å; T1097-I1101 PolarHBondContact O-N 3.08Å; T1097-L1395 HydrophobicContact CG2-CB 4.33Å; T1097-L1395 WeakPolarHBondContact OG1-CD1 3.01Å
1098	F	65.6	Low	69.5	Low	5 Å²	5	46 Å²	46	2%	0.022	25%	0.253	C	S	.	.	H	α-helix	trans	-69.5	-42.7	172.9	-75.9	-68.4	0	0	0	111.4	V1093 V1095 E1100 I1101 F1102 L1334 L1395 V1437	V1093-F1098 HydrophobicContact CB-CB 3.87Å; V1093-F1098 HydrophobicContact CG1-CB 3.77Å; V1093-F1098 HydrophobicContact CG1-CD2 4.13Å; V1093-F1098 HydrophobicContact CG1-CG 4.12Å; V1093-F1098 HydrophobicContact CG2-CB 4.15Å; V1095-F1098 HydrophobicContact CB-CD2 4.07Å; V1095-F1098 HydrophobicContact CG1-CD2 4.05Å; V1095-F1098 PolarHBondContact O-N 3.43Å; V1095-F1098 VanDerWaalsContact O-N 3.09Å; F1098-E1100 VanDerWaalsContact C-N 3.32Å; F1098-E1100 PolarHBondContact O-N 3.29Å; F1098-I1101 PolarHBondContact O-N 3.04Å; F1098-F1102 HydrophobicContact CB-CD2 4.36Å; F1098-F1102 HydrophobicContact CB-CE2 4.33Å; F1098-F1102 HydrophobicContact CD1-CE2 4.13Å; F1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; F1098-F1102 PolarHBondContact O-N 2.89Å; F1098-L1334 HydrophobicContact CE1-CB 4.15Å; F1098-L1334 HydrophobicContact CE1-CD1 4.31Å; F1098-L1334 HydrophobicContact CE1-CD2 4.01Å; F1098-L1334 HydrophobicContact CE1-CG 4.37Å; F1098-L1334 HydrophobicContact CZ-CB 4.42Å; F1098-L1334 HydrophobicContact CZ-CD2 4.34Å; F1098-L1395 HydrophobicContact CD2-CD1 3.97Å; F1098-L1395 HydrophobicContact CE2-CD1 3.7Å; F1098-L1395 HydrophobicContact CE2-CD2 3.9Å; F1098-L1395 HydrophobicContact CE2-CG 4.49Å; F1098-L1395 HydrophobicContact CZ-CD2 4.11Å; F1098-V1437 HydrophobicContact CD1-CG2 4.25Å; F1098-V1437 HydrophobicContact CE1-CG2 4.37Å; F1098-V1437 HydrophobicContact CG-CG2 4.42Å
1099	D	75	Confident	69.8	Low	33 Å²	33	45.2 Å²	45.2	18%	0.176	25%	0.249	C	C	.	.	H	α-helix	trans	-60.4	-39.6	176.6	-74.2	-12.8	0	0	0	111.4	K1092 V1093 G1094 V1095 S1096 K1103	K1092-D1099 WeakPolarHBondContact CE-OD2 3.4Å; K1092-D1099 VanDerWaalsContact CG-OD1 3.3Å; K1092-D1099 WeakPolarHBondContact CG-OD1 3.12Å; K1092-D1099 VanDerWaalsContact CG-OD2 3.32Å; K1092-D1099 WeakPolarHBondContact CG-OD2 3.27Å; V1093-D1099 WeakPolarHBondContact CA-OD1 3.48Å; V1093-D1099 PolarHBondContact N-OD1 3.37Å; G1094-D1099 WeakPolarHBondContact CA-OD2 3.39Å; G1094-D1099 PolarHBondContact N-OD1 2.94Å; G1094-D1099 PolarHBondContact N-OD2 3.23Å; V1095-D1099 PolarHBondContact O-N 3.48Å; S1096-D1099 PolarHBondContact O-N 3.11Å; D1099-K1103 WeakPolarHBondContact O-CB 3.49Å; D1099-K1103 PolarHBondContact O-N 3.3Å
1100	E	70.9	Confident	70	Confident	103 Å²	103	47 Å²	47	48%	0.481	25%	0.253	S	S	.	.	H	α-helix	trans	-63	-47.5	173.2	-86.9	-171.9	-155	0	0	112.8	S1096 F1098 K1103 A1104 R1391	S1096-E1100 WeakPolarHBondContact O-CB 3.4Å; S1096-E1100 PolarHBondContact O-N 3.5Å; F1098-E1100 VanDerWaalsContact C-N 3.32Å; F1098-E1100 PolarHBondContact O-N 3.29Å; E1100-K1103 PolarHBondContact O-N 3.26Å; E1100-A1104 PolarHBondContact O-N 2.93Å; E1100-R1391 IonicContact OE2-CZ 2.7Å; E1100-R1391 IonicContact OE2-NE 3.81Å; E1100-R1391 IonicContact OE2-NH2 2.73Å; E1100-R1391 PolarHBondContact OE2-NH2 3.43Å
1101	I	68.9	Low	69.5	Low	44 Å²	44	51.5 Å²	51.5	23%	0.226	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-54.7	-179.8	-69.8	164.7	0	0	0	109.7	T1097 F1098 K1103 A1104 T1105 L1327	T1097-I1101 WeakPolarHBondContact O-CD1 3.48Å; T1097-I1101 VanDerWaalsContact O-CG1 3.27Å; T1097-I1101 WeakPolarHBondContact O-CG1 3.33Å; T1097-I1101 PolarHBondContact O-N 3.08Å; F1098-I1101 PolarHBondContact O-N 3.04Å; I1101-K1103 VanDerWaalsContact C-N 3.34Å; I1101-K1103 PolarHBondContact O-N 3.22Å; I1101-A1104 WeakPolarHBondContact O-CB 3.48Å; I1101-A1104 PolarHBondContact O-N 3.38Å; I1101-A1104 VanDerWaalsContact O-N 3.16Å; I1101-T1105 PolarHBondContact O-N 3.47Å; I1101-T1105 PolarHBondContact O-OG1 3.17Å; I1101-T1105 VanDerWaalsContact O-OG1 3.05Å; I1101-L1327 HydrophobicContact CG2-CD1 3.81Å; I1101-L1327 HydrophobicContact CG2-CD2 3.85Å
1102	F	71.5	Confident	68.6	Low	6 Å²	6	50.9 Å²	50.9	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-67.2	-32.6	-178.8	-68.1	-56.7	0	0	0	112.6	L1090 V1093 F1098 T1105 A1106 L1327 V1437 N1440 L1444	L1090-F1102 HydrophobicContact CB-CB 4.34Å; L1090-F1102 HydrophobicContact CD1-CB 4.07Å; L1090-F1102 HydrophobicContact CD1-CD1 4.1Å; L1090-F1102 WeakPolarHBondContact CD1-O 3.44Å; V1093-F1102 HydrophobicContact CG2-CD2 3.78Å; V1093-F1102 HydrophobicContact CG2-CE2 3.78Å; F1098-F1102 HydrophobicContact CB-CD2 4.36Å; F1098-F1102 HydrophobicContact CB-CE2 4.33Å; F1098-F1102 HydrophobicContact CD1-CE2 4.13Å; F1098-F1102 WeakPolarHBondContact O-CD2 3.36Å; F1098-F1102 PolarHBondContact O-N 2.89Å; F1102-T1105 PolarHBondContact O-N 3.14Å; F1102-A1106 VanDerWaalsContact O-CB 3.27Å; F1102-A1106 WeakPolarHBondContact O-CB 3.25Å; F1102-A1106 PolarHBondContact O-N 2.94Å; F1102-L1327 HydrophobicContact CD1-CD2 4.42Å; F1102-L1327 HydrophobicContact CE1-CD2 4.1Å; F1102-V1437 HydrophobicContact CE2-CG2 4.32Å; F1102-N1440 HydrophobicContact CD1-CB 3.88Å; F1102-N1440 HydrophobicContact CD2-CB 4.42Å; F1102-N1440 WeakPolarHBondContact CD2-ND2 3.45Å; F1102-N1440 HydrophobicContact CE1-CB 3.58Å; F1102-N1440 HydrophobicContact CE2-CB 4.16Å; F1102-N1440 HydrophobicContact CG-CB 4.29Å; F1102-N1440 HydrophobicContact CZ-CB 3.74Å; F1102-L1444 HydrophobicContact CD1-CD1 4.19Å; F1102-L1444 HydrophobicContact CE1-CD1 4.07Å
1103	K	75.3	Confident	68.1	Low	161 Å²	161	45.1 Å²	45.1	70%	0.7	25%	0.248	S	C	*	.	H	α-helix	trans	-63.8	-39.1	172.2	-178.9	179.7	178.6	-175.7	0	112.1	D1099 E1100 I1101	D1099-K1103 WeakPolarHBondContact O-CB 3.49Å; D1099-K1103 PolarHBondContact O-N 3.3Å; E1100-K1103 PolarHBondContact O-N 3.26Å; I1101-K1103 VanDerWaalsContact C-N 3.34Å; I1101-K1103 PolarHBondContact O-N 3.22Å
1104	A	69.9	Low	67.6	Low	57 Å²	57	48.2 Å²	48.2	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-55.2	172.7	0	0	0	0	0	110.4	E1100 I1101 A1106 T1107 T1108	E1100-A1104 PolarHBondContact O-N 2.93Å; I1101-A1104 WeakPolarHBondContact O-CB 3.48Å; I1101-A1104 PolarHBondContact O-N 3.38Å; I1101-A1104 VanDerWaalsContact O-N 3.16Å; A1104-A1106 VanDerWaalsContact C-N 3.28Å; A1104-A1106 PolarHBondContact O-N 3.49Å; A1104-T1107 PolarHBondContact O-N 2.84Å; A1104-T1107 PolarHBondContact O-OG1 3.48Å; A1104-T1108 PolarHBondContact O-OG1 3.39Å
1105	T	67.4	Low	67.2	Low	17 Å²	17	48.5 Å²	48.5	10%	0.104	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-37.2	-179.4	-44.5	0	0	0	0	112.9	I1101 F1102 T1107 T1108 L1109 L1444	I1101-T1105 PolarHBondContact O-N 3.47Å; I1101-T1105 PolarHBondContact O-OG1 3.17Å; I1101-T1105 VanDerWaalsContact O-OG1 3.05Å; F1102-T1105 PolarHBondContact O-N 3.14Å; T1105-T1107 VanDerWaalsContact C-N 3.28Å; T1105-T1107 PolarHBondContact O-N 2.99Å; T1105-T1108 PolarHBondContact O-N 3.07Å; T1105-L1109 VanDerWaalsContact O-CB 3.22Å; T1105-L1109 WeakPolarHBondContact O-CB 3.28Å; T1105-L1109 PolarHBondContact O-N 3.2Å; T1105-L1444 HydrophobicContact CG2-CD1 4.01Å; T1105-L1444 HydrophobicContact CG2-CD2 3.51Å; T1105-L1444 HydrophobicContact CG2-CG 4.44Å
1106	A	70	Confident	67	Low	28 Å²	28	49.2 Å²	49.2	23%	0.231	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-33.9	176.9	0	0	0	0	0	113.5	L1090 F1102 A1104 R1110	L1090-A1106 HydrophobicContact CD1-CB 4.12Å; F1102-A1106 VanDerWaalsContact O-CB 3.27Å; F1102-A1106 WeakPolarHBondContact O-CB 3.25Å; F1102-A1106 PolarHBondContact O-N 2.94Å; A1104-A1106 VanDerWaalsContact C-N 3.28Å; A1104-A1106 PolarHBondContact O-N 3.49Å; A1106-R1110 PolarHBondContact O-N 3.18Å
1107	T	69.5	Low	66.6	Low	86 Å²	86	48.3 Å²	48.3	53%	0.528	25%	0.25	S	S	.	.	H	α-helix	trans	-69.9	-46.8	179.3	60.7	0	0	0	0	111.6	A1104 T1105 R1110 Q1111	A1104-T1107 PolarHBondContact O-N 2.84Å; A1104-T1107 PolarHBondContact O-OG1 3.48Å; T1105-T1107 VanDerWaalsContact C-N 3.28Å; T1105-T1107 PolarHBondContact O-N 2.99Å; T1107-R1110 PolarHBondContact O-N 3.09Å; T1107-Q1111 PolarHBondContact O-N 3.35Å
1108	T	65.4	Low	66.2	Low	47 Å²	47	50.8 Å²	50.8	29%	0.288	27%	0.269	S	S	.	.	H	α-helix	trans	-69.9	-38.3	177.9	-14.2	0	0	0	0	112.1	A1104 T1105 R1110 Q1111 V1112 L1320	A1104-T1108 PolarHBondContact O-OG1 3.39Å; T1105-T1108 PolarHBondContact O-N 3.07Å; T1108-R1110 VanDerWaalsContact C-N 3.27Å; T1108-R1110 PolarHBondContact O-N 3.38Å; T1108-Q1111 WeakPolarHBondContact O-CB 3.43Å; T1108-Q1111 PolarHBondContact O-N 3.19Å; T1108-V1112 WeakPolarHBondContact O-CB 3.31Å; T1108-V1112 PolarHBondContact O-N 2.98Å; T1108-L1320 HydrophobicContact CG2-CB 4.47Å; T1108-L1320 HydrophobicContact CG2-CD1 3.89Å; T1108-L1320 HydrophobicContact CG2-CD2 3.8Å; T1108-L1320 HydrophobicContact CG2-CG 4.24Å
1109	L	64.5	Low	65.9	Low	5 Å²	5	51.4 Å²	51.4	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-57	-41.3	174.5	-178.3	65.8	0	0	0	111.7	L1088 T1105 V1112 C1113 L1444 Q1447	L1088-L1109 HydrophobicContact CB-CD2 4.05Å; L1088-L1109 HydrophobicContact CD1-CD2 4.27Å; L1088-L1109 HydrophobicContact CD1-CG 4.22Å; T1105-L1109 VanDerWaalsContact O-CB 3.22Å; T1105-L1109 WeakPolarHBondContact O-CB 3.28Å; T1105-L1109 PolarHBondContact O-N 3.2Å; L1109-V1112 WeakPolarHBondContact O-CB 3.49Å; L1109-V1112 PolarHBondContact O-N 3.33Å; L1109-C1113 PolarHBondContact O-N 2.98Å; L1109-C1113 PolarHBondContact O-SG 3.02Å; L1109-L1444 HydrophobicContact CD1-CD2 4.48Å; L1109-L1444 HydrophobicContact CD2-CD2 4Å; L1109-Q1447 HydrophobicContact CD1-CB 3.79Å; L1109-Q1447 HydrophobicContact CD1-CG 4.11Å
1110	R	67.8	Low	65.2	Low	104 Å²	104	50.9 Å²	50.9	39%	0.392	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-46.5	176.5	-177.5	177.6	-71.3	173.9	-4.6	112	S203 A1106 T1107 T1108 V1112 C1113 E1114	S203-R1110 PolarHBondContact OG-NH2 2.84Å; S203-R1110 VanDerWaalsContact OG-NH2 3.08Å; A1106-R1110 PolarHBondContact O-N 3.18Å; T1107-R1110 PolarHBondContact O-N 3.09Å; T1108-R1110 VanDerWaalsContact C-N 3.27Å; T1108-R1110 PolarHBondContact O-N 3.38Å; R1110-V1112 VanDerWaalsContact C-N 3.3Å; R1110-V1112 PolarHBondContact O-N 3.1Å; R1110-C1113 PolarHBondContact O-N 3.3Å; R1110-E1114 WeakPolarHBondContact O-CG 3.46Å; R1110-E1114 PolarHBondContact O-N 2.9Å; R1110-E1114 VanDerWaalsContact O-N 3.14Å
1111	Q	62.7	Low	64.5	Low	119 Å²	119	47 Å²	47	56%	0.556	25%	0.254	S	S	*	.	H	α-helix	trans	-59.1	-43.5	176.2	-65.9	168.8	-37.7	0	0	111.1	T1107 T1108 C1113 E1114 L1115	T1107-Q1111 PolarHBondContact O-N 3.35Å; T1108-Q1111 WeakPolarHBondContact O-CB 3.43Å; T1108-Q1111 PolarHBondContact O-N 3.19Å; Q1111-C1113 PolarHBondContact O-N 3.28Å; Q1111-E1114 PolarHBondContact O-N 3.44Å; Q1111-L1115 PolarHBondContact O-N 3.44Å
1112	V	58.9	Low	64.1	Low	16 Å²	16	48 Å²	48	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-42.1	176.7	140.7	0	0	0	0	112.9	T1108 L1109 R1110 L1115 R1116 F1317 L1320 M1451	T1108-V1112 WeakPolarHBondContact O-CB 3.31Å; T1108-V1112 PolarHBondContact O-N 2.98Å; L1109-V1112 WeakPolarHBondContact O-CB 3.49Å; L1109-V1112 PolarHBondContact O-N 3.33Å; R1110-V1112 VanDerWaalsContact C-N 3.3Å; R1110-V1112 PolarHBondContact O-N 3.1Å; V1112-L1115 PolarHBondContact O-N 3.31Å; V1112-R1116 PolarHBondContact O-N 3.14Å; V1112-F1317 HydrophobicContact CB-CD2 4.37Å; V1112-F1317 HydrophobicContact CB-CE2 3.68Å; V1112-F1317 HydrophobicContact CB-CZ 4.33Å; V1112-F1317 HydrophobicContact CG1-CE2 3.49Å; V1112-F1317 VanDerWaalsContact CG1-CE2 3.49Å; V1112-F1317 HydrophobicContact CG1-CZ 3.64Å; V1112-F1317 HydrophobicContact CG2-CD2 3.52Å; V1112-F1317 HydrophobicContact CG2-CE2 3.31Å; V1112-F1317 HydrophobicContact CG2-CG 4.46Å; V1112-F1317 HydrophobicContact CG2-CZ 4.12Å; V1112-L1320 HydrophobicContact CB-CD2 4.07Å; V1112-L1320 HydrophobicContact CG2-CD2 3.43Å; V1112-L1320 VanDerWaalsContact CG2-CD2 3.43Å; V1112-M1451 HydrophobicContact CG1-CG 4.24Å; V1112-M1451 HydrophobicContact CG1-SD 3.9Å
1113	C	63.2	Low	63.6	Low	7 Å²	7	48.6 Å²	48.6	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-72.8	-26.8	177.6	-63.9	0	0	0	0	113.3	L1088 L1109 R1110 Q1111 T1117	L1088-C1113 HydrophobicContact CD1-CB 4.35Å; L1088-C1113 WeakPolarHBondContact CD1-SG 3.33Å; L1109-C1113 PolarHBondContact O-N 2.98Å; L1109-C1113 PolarHBondContact O-SG 3.02Å; R1110-C1113 PolarHBondContact O-N 3.3Å; Q1111-C1113 PolarHBondContact O-N 3.28Å; C1113-T1117 WeakPolarHBondContact O-CB 3.36Å; C1113-T1117 PolarHBondContact O-N 2.82Å; C1113-T1117 PolarHBondContact O-OG1 3.49Å
1114	E	62.5	Low	62.8	Low	71 Å²	71	41.7 Å²	41.7	33%	0.332	24%	0.238	S	C	.	.	H	α-helix	trans	-71.1	-36.9	169.7	-67.1	-174.4	137.3	0	0	112	R1085 R1110 Q1111 T1117 S1118	R1085-E1114 HydrophobicContact CG-CG 4.5Å; R1085-E1114 IonicContact CZ-OE1 2.84Å; R1085-E1114 IonicContact NE-OE1 2.69Å; R1085-E1114 PolarHBondContact NE-OE1 3.43Å; R1085-E1114 IonicContact NH2-OE1 2.8Å; R1085-E1114 PolarHBondContact NH2-OE1 2.91Å; R1110-E1114 WeakPolarHBondContact O-CG 3.46Å; R1110-E1114 PolarHBondContact O-N 2.9Å; R1110-E1114 VanDerWaalsContact O-N 3.14Å; Q1111-E1114 PolarHBondContact O-N 3.44Å; E1114-T1117 WeakPolarHBondContact O-CB 3.41Å; E1114-T1117 PolarHBondContact O-N 3.06Å; E1114-S1118 PolarHBondContact O-N 3.19Å; E1114-S1118 VanDerWaalsContact O-N 3.07Å
1115	L	60.9	Low	62.3	Low	35 Å²	35	42.2 Å²	42.2	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-51.6	173.7	-171.4	72.4	0	0	0	111.5	Q1111 V1112 T1117 S1118 V1119 L1310 A1313 F1317	Q1111-L1115 PolarHBondContact O-N 3.44Å; V1112-L1115 PolarHBondContact O-N 3.31Å; L1115-T1117 PolarHBondContact O-N 3.27Å; L1115-S1118 WeakPolarHBondContact O-CB 3.37Å; L1115-S1118 PolarHBondContact O-N 3.18Å; L1115-V1119 WeakPolarHBondContact O-CG2 3.41Å; L1115-V1119 PolarHBondContact O-N 3.3Å; L1115-L1310 HydrophobicContact CD1-CD1 4.11Å; L1115-A1313 HydrophobicContact CD1-CB 3.52Å; L1115-A1313 HydrophobicContact CD2-CB 3.58Å; L1115-A1313 WeakPolarHBondContact CD2-O 3.37Å; L1115-A1313 HydrophobicContact CG-CB 4.16Å; L1115-F1317 HydrophobicContact CD2-CD2 3.62Å; L1115-F1317 HydrophobicContact CD2-CE2 4.09Å
1116	R	61	Low	62.1	Low	25 Å²	25	43 Å²	43	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-47.1	-47.5	173.7	168.1	158	171	-156.3	7	112.5	V1112 V1119 L1120 L1450 M1451 L1454	V1112-R1116 PolarHBondContact O-N 3.14Å; R1116-V1119 PolarHBondContact O-N 3.34Å; R1116-L1120 HydrophobicContact CG-CD1 3.74Å; R1116-L1120 HydrophobicContact CG-CG 4.48Å; R1116-L1120 WeakPolarHBondContact O-CB 3.35Å; R1116-L1120 WeakPolarHBondContact O-CG 3.42Å; R1116-L1120 PolarHBondContact O-N 3.07Å; R1116-L1450 VanDerWaalsContact NH1-CD1 3.3Å; R1116-M1451 HydrophobicContact CB-CE 3.61Å; R1116-M1451 HydrophobicContact CB-SD 3.68Å; R1116-M1451 WeakPolarHBondContact CD-SD 3.47Å; R1116-M1451 HydrophobicContact CG-CE 3.97Å; R1116-M1451 HydrophobicContact CG-SD 4.06Å; R1116-L1454 HydrophobicContact CB-CD2 3.88Å; R1116-L1454 HydrophobicContact CG-CD2 3.89Å
1117	T	60.2	Low	61.8	Low	26 Å²	26	45 Å²	45	16%	0.16	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-44.3	-179.7	-70.8	0	0	0	0	111.8	R1081 C1113 E1114 L1115 S1121	R1081-T1117 VanDerWaalsContact C-CG2 3.44Å; R1081-T1117 HydrophobicContact CB-CG2 3.96Å; R1081-T1117 WeakPolarHBondContact O-CG2 3.26Å; R1081-T1117 PolarHBondContact O-OG1 3.49Å; C1113-T1117 WeakPolarHBondContact O-CB 3.36Å; C1113-T1117 PolarHBondContact O-N 2.82Å; C1113-T1117 PolarHBondContact O-OG1 3.49Å; E1114-T1117 WeakPolarHBondContact O-CB 3.41Å; E1114-T1117 PolarHBondContact O-N 3.06Å; L1115-T1117 PolarHBondContact O-N 3.27Å; T1117-S1121 WeakPolarHBondContact O-CB 3.45Å; T1117-S1121 PolarHBondContact O-N 3.33Å
1118	S	59.7	Low	61.4	Low	71 Å²	71	45 Å²	45	50%	0.497	23%	0.227	S	C	.	.	H	α-helix	trans	-65.9	-45.9	178	-167.7	0	0	0	0	112.5	E1114 L1115 S1121 S1122	E1114-S1118 PolarHBondContact O-N 3.19Å; E1114-S1118 VanDerWaalsContact O-N 3.07Å; L1115-S1118 WeakPolarHBondContact O-CB 3.37Å; L1115-S1118 PolarHBondContact O-N 3.18Å; S1118-S1121 PolarHBondContact O-N 3.44Å; S1118-S1122 WeakPolarHBondContact O-CB 3.43Å; S1118-S1122 PolarHBondContact O-N 3.24Å; S1118-S1122 PolarHBondContact O-OG 3.04Å
1119	V	58.8	Low	61.2	Low	18 Å²	18	49.7 Å²	49.7	11%	0.109	25%	0.25	C	C	.	.	H	α-helix	trans	-60.4	-55.7	177.3	171.9	0	0	0	0	110.7	L1115 R1116 S1121 S1122 F1123 L1310 L1454	L1115-V1119 WeakPolarHBondContact O-CG2 3.41Å; L1115-V1119 PolarHBondContact O-N 3.3Å; R1116-V1119 PolarHBondContact O-N 3.34Å; V1119-S1121 VanDerWaalsContact C-N 3.32Å; V1119-S1121 PolarHBondContact O-N 2.71Å; V1119-S1122 WeakPolarHBondContact O-CA 3.5Å; V1119-S1122 WeakPolarHBondContact O-CB 3.41Å; V1119-S1122 PolarHBondContact O-N 2.97Å; V1119-F1123 HydrophobicContact CG1-CD2 4.12Å; V1119-F1123 HydrophobicContact CG1-CE2 3.45Å; V1119-F1123 VanDerWaalsContact CG1-CE2 3.45Å; V1119-F1123 HydrophobicContact CG1-CZ 3.75Å; V1119-F1123 PolarHBondContact O-N 2.91Å; V1119-F1123 VanDerWaalsContact O-N 3.12Å; V1119-L1310 HydrophobicContact CG2-CD1 3.63Å; V1119-L1454 HydrophobicContact CB-CD2 4.38Å; V1119-L1454 HydrophobicContact CG1-CD1 4.36Å; V1119-L1454 HydrophobicContact CG1-CD2 4.34Å
1120	L	60.1	Low	61.2	Low	22 Å²	22	49.5 Å²	49.5	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-38.1	179.4	-74.2	174	0	0	0	112.8	R1081 R1116 S1122 F1123 D1124 L1454	R1081-L1120 VanDerWaalsContact NH1-C 3.26Å; R1081-L1120 PolarHBondContact NH1-O 3.19Å; R1116-L1120 HydrophobicContact CG-CD1 3.74Å; R1116-L1120 HydrophobicContact CG-CG 4.48Å; R1116-L1120 WeakPolarHBondContact O-CB 3.35Å; R1116-L1120 WeakPolarHBondContact O-CG 3.42Å; R1116-L1120 PolarHBondContact O-N 3.07Å; L1120-S1122 PolarHBondContact O-N 3.5Å; L1120-F1123 PolarHBondContact O-N 2.85Å; L1120-D1124 PolarHBondContact O-N 3.42Å; L1120-D1124 VanDerWaalsContact O-N 3.17Å; L1120-L1454 HydrophobicContact CD1-CD1 4.23Å; L1120-L1454 HydrophobicContact CD2-CD1 3.46Å; L1120-L1454 VanDerWaalsContact CD2-CD1 3.46Å; L1120-L1454 HydrophobicContact CG-CD1 3.62Å
1121	S	57.3	Low	60.7	Low	21 Å²	21	46.7 Å²	46.7	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-28.4	174.4	-179.2	0	0	0	0	112.4	H1078 T1117 S1118 V1119 N1125	H1078-S1121 PolarHBondContact CE1-OG 3.28Å; H1078-S1121 PolarHBondContact ND1-OG 3Å; H1078-S1121 PolarHBondContact NE2-O 3.03Å; H1078-S1121 PolarHBondContact NE2-OG 3.43Å; T1117-S1121 WeakPolarHBondContact O-CB 3.45Å; T1117-S1121 PolarHBondContact O-N 3.33Å; S1118-S1121 PolarHBondContact O-N 3.44Å; V1119-S1121 VanDerWaalsContact C-N 3.32Å; V1119-S1121 PolarHBondContact O-N 2.71Å; S1121-N1125 WeakPolarHBondContact O-CB 3.26Å; S1121-N1125 PolarHBondContact O-N 3.36Å; S1121-N1125 PolarHBondContact O-ND2 3Å; S1121-N1125 VanDerWaalsContact O-ND2 3.13Å
1122	S	58.7	Low	60.4	Low	66 Å²	66	44.2 Å²	44.2	46%	0.462	24%	0.241	S	C	.	.	H	α-helix	trans	-75.7	-40.3	178.6	-58.8	0	0	0	0	111.2	S1118 V1119 L1120 N1125 F1126	S1118-S1122 WeakPolarHBondContact O-CB 3.43Å; S1118-S1122 PolarHBondContact O-N 3.24Å; S1118-S1122 PolarHBondContact O-OG 3.04Å; V1119-S1122 WeakPolarHBondContact O-CA 3.5Å; V1119-S1122 WeakPolarHBondContact O-CB 3.41Å; V1119-S1122 PolarHBondContact O-N 2.97Å; L1120-S1122 PolarHBondContact O-N 3.5Å; S1122-N1125 PolarHBondContact O-N 2.86Å; S1122-F1126 PolarHBondContact O-N 3.07Å
1123	F	61.9	Low	60.2	Low	19 Å²	19	48.5 Å²	48.5	8%	0.083	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-42.5	173.5	-61.4	-34.3	0	0	0	112.9	V1119 L1120 N1125 F1126 R1127 M1172 W1461	V1119-F1123 HydrophobicContact CG1-CD2 4.12Å; V1119-F1123 HydrophobicContact CG1-CE2 3.45Å; V1119-F1123 VanDerWaalsContact CG1-CE2 3.45Å; V1119-F1123 HydrophobicContact CG1-CZ 3.75Å; V1119-F1123 PolarHBondContact O-N 2.91Å; V1119-F1123 VanDerWaalsContact O-N 3.12Å; L1120-F1123 PolarHBondContact O-N 2.85Å; F1123-N1125 PolarHBondContact O-N 3.35Å; F1123-F1126 PolarHBondContact O-N 2.79Å; F1123-R1127 PolarHBondContact O-N 2.9Å; F1123-M1172 HydrophobicContact CE1-CE 4.41Å; F1123-W1461 HydrophobicContact CB-CZ2 4.27Å; F1123-W1461 AromaticContact CD1-CD2 3.61Å; F1123-W1461 HydrophobicContact CD1-CD2 3.61Å; F1123-W1461 AromaticContact CD1-CE2 3.52Å; F1123-W1461 AromaticContact CD1-CE3 3.71Å; F1123-W1461 HydrophobicContact CD1-CE3 3.71Å; F1123-W1461 HydrophobicContact CD1-CG 4.3Å; F1123-W1461 AromaticContact CD1-CH2 3.62Å; F1123-W1461 HydrophobicContact CD1-CH2 3.62Å; F1123-W1461 AromaticContact CD1-CZ2 3.53Å; F1123-W1461 HydrophobicContact CD1-CZ2 3.53Å; F1123-W1461 AromaticContact CD1-CZ3 3.71Å; F1123-W1461 HydrophobicContact CD1-CZ3 3.71Å; F1123-W1461 AromaticContact CE1-CD2 3.53Å; F1123-W1461 HydrophobicContact CE1-CD2 3.53Å; F1123-W1461 AromaticContact CE1-CE2 3.98Å; F1123-W1461 AromaticContact CE1-CE3 3.37Å; F1123-W1461 HydrophobicContact CE1-CE3 3.37Å; F1123-W1461 HydrophobicContact CE1-CG 4.09Å; F1123-W1461 HydrophobicContact CE1-CH2 4.09Å; F1123-W1461 HydrophobicContact CE1-CZ2 4.24Å; F1123-W1461 AromaticContact CE1-CZ3 3.66Å; F1123-W1461 HydrophobicContact CE1-CZ3 3.66Å; F1123-W1461 HydrophobicContact CG-CD2 4.39Å; F1123-W1461 HydrophobicContact CG-CZ2 4.22Å; F1123-W1461 HydrophobicContact CZ-CB 4.41Å; F1123-W1461 HydrophobicContact CZ-CD2 4.25Å; F1123-W1461 HydrophobicContact CZ-CE3 4.3Å; F1123-W1461 HydrophobicContact CZ-CG 4.35Å
1124	D	58.8	Low	59.5	Low	15 Å²	15	51.4 Å²	51.4	8%	0.08	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-41.8	174.1	-84.4	32.4	0	0	0	112.2	R1081 L1120 F1126 R1127 R1128	R1081-D1124 IonicContact CZ-OD1 3.92Å; R1081-D1124 IonicContact CZ-OD2 3.9Å; R1081-D1124 IonicContact NH1-OD1 2.91Å; R1081-D1124 PolarHBondContact NH1-OD1 3.4Å; R1081-D1124 IonicContact NH1-OD2 3.45Å; R1081-D1124 PolarHBondContact NH1-OD2 2.86Å; R1081-D1124 IonicContact NH2-OD1 2.57Å; R1081-D1124 PolarHBondContact NH2-OD1 2.95Å; R1081-D1124 IonicContact NH2-OD2 2.69Å; R1081-D1124 PolarHBondContact NH2-OD2 2.87Å; L1120-D1124 PolarHBondContact O-N 3.42Å; L1120-D1124 VanDerWaalsContact O-N 3.17Å; D1124-F1126 VanDerWaalsContact C-N 3.33Å; D1124-F1126 PolarHBondContact O-N 3.32Å; D1124-R1127 PolarHBondContact O-N 3.04Å; D1124-R1128 WeakPolarHBondContact O-CG 3.47Å; D1124-R1128 PolarHBondContact O-N 3.37Å
1125	N	59	Low	58.9	Low	68 Å²	68	51.7 Å²	51.7	36%	0.364	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-39.3	177	-75.7	-24.9	0	0	0	111.5	H1078 S1121 S1122 F1123 R1128 L1129	H1078-N1125 PolarHBondContact NE2-ND2 2.95Å; H1078-N1125 PolarHBondContact NE2-OD1 3.39Å; S1121-N1125 WeakPolarHBondContact O-CB 3.26Å; S1121-N1125 PolarHBondContact O-N 3.36Å; S1121-N1125 PolarHBondContact O-ND2 3Å; S1121-N1125 VanDerWaalsContact O-ND2 3.13Å; S1122-N1125 PolarHBondContact O-N 2.86Å; F1123-N1125 PolarHBondContact O-N 3.35Å; N1125-R1128 PolarHBondContact O-N 3.05Å; N1125-L1129 WeakPolarHBondContact O-CG 3.47Å; N1125-L1129 PolarHBondContact O-N 2.78Å
1126	F	62.6	Low	58.6	Low	34 Å²	34	54.7 Å²	54.7	15%	0.149	32%	0.315	C	S	.	.	H	α-helix	trans	-64.4	-46.1	174.4	-176	-89.2	0	0	0	112	S1122 F1123 D1124 R1128 L1129 C1130 M1139 C1142 W1461	S1122-F1126 PolarHBondContact O-N 3.07Å; F1123-F1126 PolarHBondContact O-N 2.79Å; D1124-F1126 VanDerWaalsContact C-N 3.33Å; D1124-F1126 PolarHBondContact O-N 3.32Å; F1126-R1128 VanDerWaalsContact C-N 3.28Å; F1126-R1128 PolarHBondContact O-N 3.02Å; F1126-L1129 PolarHBondContact O-N 3.29Å; F1126-L1129 VanDerWaalsContact O-N 3.15Å; F1126-C1130 WeakPolarHBondContact CE1-SG 3.42Å; F1126-C1130 PolarHBondContact O-N 3.41Å; F1126-C1130 PolarHBondContact O-SG 3.07Å; F1126-M1139 HydrophobicContact CD1-CE 3.82Å; F1126-M1139 HydrophobicContact CD1-SD 3.76Å; F1126-M1139 HydrophobicContact CE1-CE 3.34Å; F1126-M1139 HydrophobicContact CE1-SD 3.39Å; F1126-M1139 WeakPolarHBondContact CE1-SD 3.37Å; F1126-M1139 HydrophobicContact CE2-CE 4.29Å; F1126-M1139 HydrophobicContact CG-CE 4.48Å; F1126-M1139 HydrophobicContact CZ-CE 3.61Å; F1126-M1139 HydrophobicContact CZ-SD 4.23Å; F1126-C1142 HydrophobicContact CE1-CB 4.27Å; F1126-W1461 HydrophobicContact CB-CH2 3.97Å; F1126-W1461 HydrophobicContact CB-CZ2 4.11Å; F1126-W1461 AromaticContact CD1-CH2 3.83Å; F1126-W1461 HydrophobicContact CD1-CH2 3.83Å; F1126-W1461 AromaticContact CD1-CZ2 3.74Å; F1126-W1461 HydrophobicContact CD1-CZ2 3.74Å; F1126-W1461 HydrophobicContact CD2-CH2 4.39Å; F1126-W1461 HydrophobicContact CE1-CH2 4.48Å; F1126-W1461 HydrophobicContact CE1-CZ2 4.5Å; F1126-W1461 AromaticContact CG-CH2 3.78Å; F1126-W1461 HydrophobicContact CG-CH2 3.78Å; F1126-W1461 HydrophobicContact CG-CZ2 4.05Å
1127	R	64.1	Low	58.3	Low	71 Å²	71	55 Å²	55	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-55	-43.4	175	-77.1	-174.3	164.9	131	-8.4	111.9	F1123 D1124 C1130 G1131 L1137	F1123-R1127 PolarHBondContact O-N 2.9Å; D1124-R1127 PolarHBondContact O-N 3.04Å; R1127-C1130 CarbonylContact O-C 3.55Å; R1127-C1130 WeakPolarHBondContact O-CA 2.88Å; R1127-C1130 WeakPolarHBondContact O-CB 3.01Å; R1127-C1130 PolarHBondContact O-N 3.07Å; R1127-C1130 VanDerWaalsContact O-N 3.12Å; R1127-G1131 PolarHBondContact O-N 3Å; R1127-L1137 VanDerWaalsContact CZ-O 3.25Å; R1127-L1137 PolarHBondContact NE-O 2.93Å; R1127-L1137 PolarHBondContact NH2-O 3.46Å
1128	R	61.2	Low	58.4	Low	85 Å²	85	55.6 Å²	55.6	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-37	177	-69.7	169.7	-174.7	172.6	3.2	113.6	T1074 H1078 D1124 N1125 F1126 C1130 G1131	T1074-R1128 PolarHBondContact O-NH2 3.49Å; H1078-R1128 PolarHBondContact CD2-NH1 2.79Å; H1078-R1128 PolarHBondContact CD2-NH2 3.01Å; H1078-R1128 VanDerWaalsContact CD2-NH2 3.3Å; D1124-R1128 WeakPolarHBondContact O-CG 3.47Å; D1124-R1128 PolarHBondContact O-N 3.37Å; N1125-R1128 PolarHBondContact O-N 3.05Å; F1126-R1128 VanDerWaalsContact C-N 3.28Å; F1126-R1128 PolarHBondContact O-N 3.02Å; R1128-C1130 PolarHBondContact O-N 2.78Å; R1128-G1131 PolarHBondContact O-N 3.42Å
1129	L	60.5	Low	58.7	Low	145 Å²	145	52.3 Å²	52.3	76%	0.759	30%	0.301	S	S	*	.	H	α-helix	trans	-65.9	-30.8	171.4	-72.5	168.6	0	0	0	111.4	N1125 F1126 G1131	N1125-L1129 WeakPolarHBondContact O-CG 3.47Å; N1125-L1129 PolarHBondContact O-N 2.78Å; F1126-L1129 PolarHBondContact O-N 3.29Å; F1126-L1129 VanDerWaalsContact O-N 3.15Å; L1129-G1131 PolarHBondContact O-N 2.93Å
1130	C	64.7	Low	59.1	Low	2 Å²	2	52.9 Å²	52.9	1%	0.014	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	5.6	168.5	-63.3	0	0	0	0	114.1	F1126 R1127 R1128 E1132 C1142 R1149	F1126-C1130 WeakPolarHBondContact CE1-SG 3.42Å; F1126-C1130 PolarHBondContact O-N 3.41Å; F1126-C1130 PolarHBondContact O-SG 3.07Å; R1127-C1130 CarbonylContact O-C 3.55Å; R1127-C1130 WeakPolarHBondContact O-CA 2.88Å; R1127-C1130 WeakPolarHBondContact O-CB 3.01Å; R1127-C1130 PolarHBondContact O-N 3.07Å; R1127-C1130 VanDerWaalsContact O-N 3.12Å; R1128-C1130 PolarHBondContact O-N 2.78Å; C1130-E1132 PolarHBondContact O-N 2.78Å; C1130-C1142 HydrophobicContact CB-CB 3.87Å; C1130-R1149 VanDerWaalsContact O-CZ 3.22Å; C1130-R1149 PolarHBondContact O-NH1 3.3Å; C1130-R1149 PolarHBondContact O-NH2 3.44Å
1131	G	57.4	Low	59.8	Low	44 Å²	44	56.5 Å²	56.5	45%	0.454	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-24	160	0	0	0	0	0	117.4	R1127 R1128 L1129	R1127-G1131 PolarHBondContact O-N 3Å; R1128-G1131 PolarHBondContact O-N 3.42Å; L1129-G1131 PolarHBondContact O-N 2.93Å
1132	E	57.4	Low	60.3	Low	68 Å²	68	55.6 Å²	55.6	32%	0.318	31%	0.313	S	S	.	.			trans	-91	147.9	177.9	-78	70.9	-146.7	0	0	113.3	C1130 L1137 R1149	C1130-E1132 PolarHBondContact O-N 2.78Å; E1132-L1137 HydrophobicContact CB-CD1 3.94Å; E1132-L1137 HydrophobicContact CG-CD1 3.91Å; E1132-R1149 IonicContact OE1-CZ 2.65Å; E1132-R1149 IonicContact OE1-NH2 3.23Å; E1132-R1149 PolarHBondContact OE1-NH2 3.21Å; E1132-R1149 IonicContact OE2-NH2 3.85Å; E1132-R1149 PolarHBondContact OE2-NH2 2.97Å
1133	T	53.4	Low	61	Low	106 Å²	106	52.5 Å²	52.5	65%	0.65	29%	0.291	S	S	*	.			trans	-131.1	-8.8	-174.9	54.2	0	0	0	0	114.9
1134	S	49.4	Very low	61.5	Low	68 Å²	68	58 Å²	58	48%	0.476	31%	0.312	S	S	.	.	S	Bend	trans	-117	-8.1	-164.7	53	0	0	0	0	116
1135	T	50.2	Low	62.2	Low	77 Å²	77	58.4 Å²	58.4	47%	0.472	32%	0.317	S	S	.	.	S	Bend	trans	-142.2	148.3	175.5	55	0	0	0	0	111.6	L1137	T1135-L1137 PolarHBondContact O-N 3.41Å
1136	P	54.8	Low	63	Low	97 Å²	97	56.4 Å²	56.4	63%	0.63	31%	0.306	S	S	*	.			trans	-80.6	63.6	-178.3	33.7	-36.9	0	0	0	112.6
1137	L	53.9	Low	63.6	Low	33 Å²	33	55.3 Å²	55.3	17%	0.173	30%	0.303	C	S	.	.			trans	-50.1	140.3	176.9	-66.7	-178.2	0	0	0	112.7	R1127 E1132 T1135 Q1141	R1127-L1137 VanDerWaalsContact CZ-O 3.25Å; R1127-L1137 PolarHBondContact NE-O 2.93Å; R1127-L1137 PolarHBondContact NH2-O 3.46Å; E1132-L1137 HydrophobicContact CB-CD1 3.94Å; E1132-L1137 HydrophobicContact CG-CD1 3.91Å; T1135-L1137 PolarHBondContact O-N 3.41Å; L1137-Q1141 HydrophobicContact CB-CB 4.03Å; L1137-Q1141 HydrophobicContact CD2-CB 4.09Å; L1137-Q1141 HydrophobicContact CG-CB 4.44Å
1138	S	63.4	Low	64.2	Low	37 Å²	37	56 Å²	56	26%	0.259	32%	0.315	S	S	.	.			trans	-63.3	159.7	169.9	61.4	0	0	0	0	111.4	N1140 Q1141 C1142	S1138-N1140 PolarHBondContact O-N 3.45Å; S1138-Q1141 PolarHBondContact O-N 3.49Å; S1138-Q1141 VanDerWaalsContact OG-CD 3.25Å; S1138-Q1141 VanDerWaalsContact OG-CG 3.32Å; S1138-Q1141 WeakPolarHBondContact OG-CG 3.47Å; S1138-Q1141 PolarHBondContact OG-N 2.97Å; S1138-Q1141 PolarHBondContact OG-OE1 2.83Å; S1138-C1142 PolarHBondContact O-N 3.25Å
1139	M	65.1	Low	64.8	Low	2 Å²	2	56.2 Å²	56.2	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-37.3	177.5	-174.4	52.5	164.5	0	0	110.9	F1126 Q1141 C1142 I1143 P1173 W1461 Q1464 A1465	F1126-M1139 HydrophobicContact CD1-CE 3.82Å; F1126-M1139 HydrophobicContact CD1-SD 3.76Å; F1126-M1139 HydrophobicContact CE1-CE 3.34Å; F1126-M1139 HydrophobicContact CE1-SD 3.39Å; F1126-M1139 WeakPolarHBondContact CE1-SD 3.37Å; F1126-M1139 HydrophobicContact CE2-CE 4.29Å; F1126-M1139 HydrophobicContact CG-CE 4.48Å; F1126-M1139 HydrophobicContact CZ-CE 3.61Å; F1126-M1139 HydrophobicContact CZ-SD 4.23Å; M1139-Q1141 VanDerWaalsContact C-N 3.34Å; M1139-Q1141 PolarHBondContact O-N 2.62Å; M1139-C1142 PolarHBondContact O-N 2.64Å; M1139-I1143 HydrophobicContact CE-CD1 3.96Å; M1139-I1143 HydrophobicContact CE-CG1 4.19Å; M1139-I1143 HydrophobicContact CG-CD1 4.03Å; M1139-I1143 HydrophobicContact CG-CG1 4.49Å; M1139-I1143 WeakPolarHBondContact O-CG1 3.5Å; M1139-I1143 PolarHBondContact O-N 3.07Å; M1139-I1143 HydrophobicContact SD-CD1 4.21Å; M1139-I1143 HydrophobicContact SD-CG1 4.16Å; M1139-P1173 HydrophobicContact CE-CG 3.96Å; M1139-W1461 HydrophobicContact CB-CD2 4.3Å; M1139-W1461 HydrophobicContact CB-CG 4.15Å; M1139-W1461 HydrophobicContact CE-CD2 4.17Å; M1139-W1461 HydrophobicContact CE-CE3 3.87Å; M1139-W1461 HydrophobicContact CE-CH2 3.23Å; M1139-W1461 HydrophobicContact CE-CZ2 3.54Å; M1139-W1461 HydrophobicContact CE-CZ3 3.4Å; M1139-W1461 VanDerWaalsContact CE-CZ3 3.4Å; M1139-W1461 HydrophobicContact CG-CD2 3.98Å; M1139-W1461 HydrophobicContact CG-CE3 4.42Å; M1139-W1461 HydrophobicContact CG-CG 4.29Å; M1139-W1461 HydrophobicContact CG-CZ2 4.37Å; M1139-W1461 HydrophobicContact SD-CD2 4.06Å; M1139-W1461 HydrophobicContact SD-CE3 4.37Å; M1139-W1461 HydrophobicContact SD-CH2 3.78Å; M1139-W1461 HydrophobicContact SD-CZ2 3.36Å; M1139-W1461 WeakPolarHBondContact SD-CZ2 3.36Å; M1139-W1461 HydrophobicContact SD-CZ3 4.26Å; M1139-Q1464 HydrophobicContact CB-CB 3.96Å; M1139-Q1464 HydrophobicContact CG-CB 4.47Å; M1139-A1465 HydrophobicContact CE-CB 3.77Å; M1139-A1465 HydrophobicContact CG-CB 3.87Å
1140	N	67.8	Low	65.4	Low	30 Å²	30	50.3 Å²	50.3	16%	0.16	29%	0.285	C	S	.	.	H	α-helix	trans	-52.2	-47.4	169.5	-79	-22.9	0	0	0	112.8	S1138 R1144 Q1464 S1468	S1138-N1140 PolarHBondContact O-N 3.45Å; N1140-R1144 WeakPolarHBondContact O-CB 3.36Å; N1140-R1144 WeakPolarHBondContact O-CD 3.37Å; N1140-R1144 WeakPolarHBondContact O-CG 3.08Å; N1140-R1144 PolarHBondContact O-N 3.37Å; N1140-R1144 VanDerWaalsContact O-N 3.11Å; N1140-Q1464 WeakPolarHBondContact OD1-CB 3.31Å; N1140-Q1464 PolarHBondContact OD1-O 3.25Å; N1140-S1468 WeakPolarHBondContact CA-OG 3.31Å; N1140-S1468 WeakPolarHBondContact CB-OG 3.5Å; N1140-S1468 VanDerWaalsContact OD1-CB 3.3Å; N1140-S1468 WeakPolarHBondContact OD1-CB 3.31Å; N1140-S1468 PolarHBondContact OD1-OG 3.32Å
1141	Q	73.4	Confident	66	Low	99 Å²	99	51.9 Å²	51.9	46%	0.463	30%	0.298	S	S	.	.	H	α-helix	trans	-70.3	-41.2	178.5	-75.5	158.8	-35.9	0	0	112.6	L1137 S1138 M1139 I1143 R1144 A1145	L1137-Q1141 HydrophobicContact CB-CB 4.03Å; L1137-Q1141 HydrophobicContact CD2-CB 4.09Å; L1137-Q1141 HydrophobicContact CG-CB 4.44Å; S1138-Q1141 PolarHBondContact O-N 3.49Å; S1138-Q1141 VanDerWaalsContact OG-CD 3.25Å; S1138-Q1141 VanDerWaalsContact OG-CG 3.32Å; S1138-Q1141 WeakPolarHBondContact OG-CG 3.47Å; S1138-Q1141 PolarHBondContact OG-N 2.97Å; S1138-Q1141 PolarHBondContact OG-OE1 2.83Å; M1139-Q1141 VanDerWaalsContact C-N 3.34Å; M1139-Q1141 PolarHBondContact O-N 2.62Å; Q1141-I1143 PolarHBondContact O-N 2.9Å; Q1141-R1144 PolarHBondContact O-N 2.65Å; Q1141-A1145 WeakPolarHBondContact O-CB 3.31Å; Q1141-A1145 PolarHBondContact O-N 3.32Å
1142	C	69.5	Low	67	Low	2 Å²	2	54.2 Å²	54.2	1%	0.014	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-42.9	177.3	-69.1	0	0	0	0	112.5	F1126 C1130 S1138 M1139 A1145 L1146	F1126-C1142 HydrophobicContact CE1-CB 4.27Å; C1130-C1142 HydrophobicContact CB-CB 3.87Å; S1138-C1142 PolarHBondContact O-N 3.25Å; M1139-C1142 PolarHBondContact O-N 2.64Å; C1142-A1145 PolarHBondContact O-N 2.84Å; C1142-L1146 WeakPolarHBondContact O-CB 3.44Å; C1142-L1146 PolarHBondContact O-N 3.24Å
1143	I	71.6	Confident	67.9	Low	1 Å²	1	54.1 Å²	54.1	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-40	176	-68.3	174.3	0	0	0	111.2	M1139 Q1141 L1146 S1147 M1164 A1465 T1472 L1474	M1139-I1143 HydrophobicContact CE-CD1 3.96Å; M1139-I1143 HydrophobicContact CE-CG1 4.19Å; M1139-I1143 HydrophobicContact CG-CD1 4.03Å; M1139-I1143 HydrophobicContact CG-CG1 4.49Å; M1139-I1143 WeakPolarHBondContact O-CG1 3.5Å; M1139-I1143 PolarHBondContact O-N 3.07Å; M1139-I1143 HydrophobicContact SD-CD1 4.21Å; M1139-I1143 HydrophobicContact SD-CG1 4.16Å; Q1141-I1143 PolarHBondContact O-N 2.9Å; I1143-L1146 PolarHBondContact O-N 2.84Å; I1143-S1147 VanDerWaalsContact O-CB 3.25Å; I1143-S1147 WeakPolarHBondContact O-CB 3.46Å; I1143-S1147 PolarHBondContact O-N 2.85Å; I1143-M1164 HydrophobicContact CD1-SD 4.24Å; I1143-A1465 VanDerWaalsContact CD1-CA 3.47Å; I1143-A1465 HydrophobicContact CD1-CB 3.88Å; I1143-T1472 HydrophobicContact CG2-CG2 4.41Å; I1143-L1474 HydrophobicContact CG2-CD1 3.79Å
1144	R	73.9	Confident	68.7	Low	134 Å²	134	52.5 Å²	52.5	51%	0.506	29%	0.294	S	S	.	.	H	α-helix	trans	-64.6	-46.8	175.1	-71.2	170.3	-159.9	-158.4	3.7	111.7	N1140 Q1141 L1146 S1147 T1148 S1468 T1472	N1140-R1144 WeakPolarHBondContact O-CB 3.36Å; N1140-R1144 WeakPolarHBondContact O-CD 3.37Å; N1140-R1144 WeakPolarHBondContact O-CG 3.08Å; N1140-R1144 PolarHBondContact O-N 3.37Å; N1140-R1144 VanDerWaalsContact O-N 3.11Å; Q1141-R1144 PolarHBondContact O-N 2.65Å; R1144-L1146 VanDerWaalsContact C-N 3.33Å; R1144-L1146 PolarHBondContact O-N 3.25Å; R1144-S1147 PolarHBondContact O-N 2.8Å; R1144-T1148 PolarHBondContact O-N 2.83Å; R1144-T1148 PolarHBondContact O-OG1 2.74Å; R1144-S1468 PolarHBondContact NE-OG 3.06Å; R1144-T1472 HydrophobicContact CG-CG2 4.01Å
1145	A	73.5	Confident	69.7	Low	23 Å²	23	51.4 Å²	51.4	19%	0.19	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-40.5	177.4	0	0	0	0	0	112.3	Q1141 C1142 R1149	Q1141-A1145 WeakPolarHBondContact O-CB 3.31Å; Q1141-A1145 PolarHBondContact O-N 3.32Å; C1142-A1145 PolarHBondContact O-N 2.84Å; A1145-R1149 WeakPolarHBondContact O-CG 3.35Å; A1145-R1149 PolarHBondContact O-N 3.47Å; A1145-R1149 VanDerWaalsContact O-N 3.14Å
1146	L	74.5	Confident	70.7	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.141	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-51.4	171.6	178.9	64.9	0	0	0	111.4	C1142 I1143 R1144 T1148 R1149 I1150 L1175	C1142-L1146 WeakPolarHBondContact O-CB 3.44Å; C1142-L1146 PolarHBondContact O-N 3.24Å; I1143-L1146 PolarHBondContact O-N 2.84Å; R1144-L1146 VanDerWaalsContact C-N 3.33Å; R1144-L1146 PolarHBondContact O-N 3.25Å; L1146-T1148 PolarHBondContact O-N 2.96Å; L1146-R1149 PolarHBondContact O-N 3.32Å; L1146-I1150 HydrophobicContact CD1-CD1 4.12Å; L1146-I1150 HydrophobicContact CD1-CG1 4.47Å; L1146-I1150 HydrophobicContact CG-CD1 3.94Å; L1146-I1150 WeakPolarHBondContact O-CG1 3.49Å; L1146-I1150 PolarHBondContact O-N 2.82Å; L1146-L1175 HydrophobicContact CD2-CD1 3.89Å; L1146-L1175 HydrophobicContact CD2-CD2 4.07Å
1147	S	75.7	Confident	71.3	Confident	11 Å²	11	48.1 Å²	48.1	8%	0.077	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-46.6	177.5	165.5	0	0	0	0	112.1	I1143 R1144 R1149 I1150 A1151 W1160 T1472	I1143-S1147 VanDerWaalsContact O-CB 3.25Å; I1143-S1147 WeakPolarHBondContact O-CB 3.46Å; I1143-S1147 PolarHBondContact O-N 2.85Å; R1144-S1147 PolarHBondContact O-N 2.8Å; S1147-R1149 VanDerWaalsContact C-N 3.32Å; S1147-R1149 PolarHBondContact O-N 3.47Å; S1147-I1150 PolarHBondContact O-N 3.41Å; S1147-I1150 VanDerWaalsContact O-N 3.17Å; S1147-A1151 WeakPolarHBondContact O-CB 3.18Å; S1147-A1151 PolarHBondContact O-N 3.39Å; S1147-W1160 WeakPolarHBondContact OG-CH2 3.45Å; S1147-T1472 WeakPolarHBondContact OG-CB 3.48Å
1148	T	77.2	Confident	71.9	Confident	85 Å²	85	52 Å²	52	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-59.4	-41.8	177	-57.3	0	0	0	0	111.3	R1144 L1146 A1151 T1152	R1144-T1148 PolarHBondContact O-N 2.83Å; R1144-T1148 PolarHBondContact O-OG1 2.74Å; L1146-T1148 PolarHBondContact O-N 2.96Å; T1148-A1151 WeakPolarHBondContact O-CB 3.3Å; T1148-A1151 PolarHBondContact O-N 2.64Å; T1148-T1152 WeakPolarHBondContact O-CG2 3.42Å; T1148-T1152 PolarHBondContact O-N 3.08Å; T1148-T1152 PolarHBondContact O-OG1 3Å
1149	R	73.6	Confident	72	Confident	89 Å²	89	55.7 Å²	55.7	34%	0.336	31%	0.311	S	S	.	.	H	α-helix	trans	-69.3	-32	177.1	-70.2	-171.3	-136.8	109.6	2.8	113.5	C1130 E1132 A1145 L1146 S1147 T1152 S1153	C1130-R1149 VanDerWaalsContact O-CZ 3.22Å; C1130-R1149 PolarHBondContact O-NH1 3.3Å; C1130-R1149 PolarHBondContact O-NH2 3.44Å; E1132-R1149 IonicContact OE1-CZ 2.65Å; E1132-R1149 IonicContact OE1-NH2 3.23Å; E1132-R1149 PolarHBondContact OE1-NH2 3.21Å; E1132-R1149 IonicContact OE2-NH2 3.85Å; E1132-R1149 PolarHBondContact OE2-NH2 2.97Å; A1145-R1149 WeakPolarHBondContact O-CG 3.35Å; A1145-R1149 PolarHBondContact O-N 3.47Å; A1145-R1149 VanDerWaalsContact O-N 3.14Å; L1146-R1149 PolarHBondContact O-N 3.32Å; S1147-R1149 VanDerWaalsContact C-N 3.32Å; S1147-R1149 PolarHBondContact O-N 3.47Å; R1149-T1152 WeakPolarHBondContact CA-OG1 3.08Å; R1149-T1152 PolarHBondContact O-OG1 3.19Å; R1149-T1152 VanDerWaalsContact O-OG1 3.07Å; R1149-S1153 WeakPolarHBondContact O-CB 3.31Å; R1149-S1153 PolarHBondContact O-N 3.4Å; R1149-S1153 PolarHBondContact O-OG 3.19Å
1150	I	74	Confident	72.5	Confident	21 Å²	21	55.9 Å²	55.9	11%	0.108	31%	0.311	C	S	.	.	H	α-helix	trans	-70.4	-43.5	172.1	-59.4	166	0	0	0	109.4	L1146 S1147 T1152 S1153 F1154 W1160 L1474	L1146-I1150 HydrophobicContact CD1-CD1 4.12Å; L1146-I1150 HydrophobicContact CD1-CG1 4.47Å; L1146-I1150 HydrophobicContact CG-CD1 3.94Å; L1146-I1150 WeakPolarHBondContact O-CG1 3.49Å; L1146-I1150 PolarHBondContact O-N 2.82Å; S1147-I1150 PolarHBondContact O-N 3.41Å; S1147-I1150 VanDerWaalsContact O-N 3.17Å; I1150-T1152 PolarHBondContact O-N 3.17Å; I1150-S1153 CarbonylContact O-C 3.55Å; I1150-S1153 WeakPolarHBondContact O-CA 3.26Å; I1150-S1153 PolarHBondContact O-N 3.3Å; I1150-F1154 HydrophobicContact CG2-CD2 3.95Å; I1150-F1154 PolarHBondContact O-N 3.48Å; I1150-W1160 HydrophobicContact CB-CD2 4.28Å; I1150-W1160 HydrophobicContact CB-CG 4.43Å; I1150-W1160 HydrophobicContact CG2-CB 3.71Å; I1150-W1160 HydrophobicContact CG2-CD2 3.61Å; I1150-W1160 HydrophobicContact CG2-CE3 4.36Å; I1150-W1160 HydrophobicContact CG2-CG 3.31Å; I1150-L1474 HydrophobicContact CD1-CD2 4.12Å
1151	A	76.6	Confident	72.5	Confident	35 Å²	35	56 Å²	56	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-59.3	-43.9	175.9	0	0	0	0	0	112.9	S1147 T1148 S1153 G1155 W1160	S1147-A1151 WeakPolarHBondContact O-CB 3.18Å; S1147-A1151 PolarHBondContact O-N 3.39Å; T1148-A1151 WeakPolarHBondContact O-CB 3.3Å; T1148-A1151 PolarHBondContact O-N 2.64Å; A1151-S1153 PolarHBondContact O-N 2.64Å; A1151-G1155 WeakPolarHBondContact O-CA 3.46Å; A1151-G1155 PolarHBondContact O-N 2.9Å; A1151-W1160 HydrophobicContact CB-CZ2 3.8Å
1152	T	78.5	Confident	72.1	Confident	93 Å²	93	53 Å²	53	57%	0.571	30%	0.302	S	S	*	.	H	α-helix	trans	-68.6	-14.8	175	54.7	0	0	0	0	113.6	T1148 R1149 I1150	T1148-T1152 WeakPolarHBondContact O-CG2 3.42Å; T1148-T1152 PolarHBondContact O-N 3.08Å; T1148-T1152 PolarHBondContact O-OG1 3Å; R1149-T1152 WeakPolarHBondContact CA-OG1 3.08Å; R1149-T1152 PolarHBondContact O-OG1 3.19Å; R1149-T1152 VanDerWaalsContact O-OG1 3.07Å; I1150-T1152 PolarHBondContact O-N 3.17Å
1153	S	75.8	Confident	72	Confident	66 Å²	66	55 Å²	55	46%	0.462	31%	0.309	S	S	.	.	H	α-helix	trans	-100.9	-27.2	179.9	-54.3	0	0	0	0	113.4	R1149 I1150 A1151	R1149-S1153 WeakPolarHBondContact O-CB 3.31Å; R1149-S1153 PolarHBondContact O-N 3.4Å; R1149-S1153 PolarHBondContact O-OG 3.19Å; I1150-S1153 CarbonylContact O-C 3.55Å; I1150-S1153 WeakPolarHBondContact O-CA 3.26Å; I1150-S1153 PolarHBondContact O-N 3.3Å; A1151-S1153 PolarHBondContact O-N 2.64Å
1154	F	69.8	Low	71.6	Confident	73 Å²	73	55.2 Å²	55.2	32%	0.32	31%	0.31	S	S	.	.	H	α-helix	trans	-133.7	-4.5	-169.8	-66.6	-76.8	0	0	0	115.2	I1150 M1159 P1161 L1192	I1150-F1154 HydrophobicContact CG2-CD2 3.95Å; I1150-F1154 PolarHBondContact O-N 3.48Å; F1154-M1159 WeakPolarHBondContact O-CB 3.45Å; F1154-P1161 HydrophobicContact CD1-CG 4.23Å; F1154-P1161 HydrophobicContact CD2-CG 4Å; F1154-P1161 HydrophobicContact CE1-CG 3.88Å; F1154-P1161 HydrophobicContact CE2-CG 3.64Å; F1154-P1161 HydrophobicContact CG-CG 4.3Å; F1154-P1161 HydrophobicContact CZ-CG 3.58Å; F1154-L1192 HydrophobicContact CE2-CD1 3.72Å; F1154-L1192 HydrophobicContact CE2-CD2 4.4Å; F1154-L1192 HydrophobicContact CE2-CG 3.89Å; F1154-L1192 HydrophobicContact CZ-CD1 3.64Å; F1154-L1192 HydrophobicContact CZ-CG 3.75Å
1155	G	72	Confident	71	Confident	44 Å²	44	52.4 Å²	52.4	45%	0.454	30%	0.299	S	S	.	.			trans	73.7	-125.7	-178.2	0	0	0	0	0	112.7	A1151 W1160	A1151-G1155 WeakPolarHBondContact O-CA 3.46Å; A1151-G1155 PolarHBondContact O-N 2.9Å; G1155-W1160 PolarHBondContact O-NE1 2.98Å
1156	S	70.3	Confident	70	Confident	60 Å²	60	52.4 Å²	52.4	42%	0.42	30%	0.296	S	S	.	.	S	Bend	trans	-56.1	145.1	-173.2	-160.1	0	0	0	0	112.4	D1158 M1159 W1160	S1156-D1158 PolarHBondContact O-N 2.9Å; S1156-D1158 PolarHBondContact OG-OD2 3.35Å; S1156-M1159 PolarHBondContact O-N 3.16Å; S1156-W1160 PolarHBondContact O-NE1 3.26Å
1157	P	66.6	Low	69	Low	46 Å²	46	56.2 Å²	56.2	30%	0.299	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-50.4	-25.2	172.7	-29	36.6	0	0	0	115.5	M1159 W1160	P1157-M1159 VanDerWaalsContact C-N 3.32Å; P1157-W1160 HydrophobicContact CB-CD2 4.32Å; P1157-W1160 HydrophobicContact CB-CE3 4.29Å; P1157-W1160 HydrophobicContact CB-CH2 4.11Å; P1157-W1160 HydrophobicContact CB-CZ2 4.16Å; P1157-W1160 HydrophobicContact CB-CZ3 4.16Å; P1157-W1160 HydrophobicContact CG-CH2 3.95Å; P1157-W1160 HydrophobicContact CG-CZ2 3.86Å; P1157-W1160 HydrophobicContact CG-CZ3 4.49Å
1158	D	68.3	Low	67.5	Low	115 Å²	115	59.7 Å²	59.7	62%	0.615	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-75.9	-18.1	179.4	-42	-69.8	0	0	0	113.6	S1156	S1156-D1158 PolarHBondContact O-N 2.9Å; S1156-D1158 PolarHBondContact OG-OD2 3.35Å
1159	M	65.5	Low	66	Low	114 Å²	114	62.8 Å²	62.8	56%	0.562	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-99.5	4.4	177.4	-65.3	-163	72.5	0	0	113.2	F1154 S1156 P1157 P1161	F1154-M1159 WeakPolarHBondContact O-CB 3.45Å; S1156-M1159 PolarHBondContact O-N 3.16Å; P1157-M1159 VanDerWaalsContact C-N 3.32Å; M1159-P1161 WeakPolarHBondContact O-CD 3.48Å
1160	W	75.5	Confident	64.9	Low	6 Å²	6	59.6 Å²	59.6	2%	0.023	33%	0.329	C	S	.	.			trans	-73.4	119	-176.8	-69.7	3.5	0	0	0	110.9	S1147 I1150 A1151 G1155 S1156 P1157 V1162 T1472 L1474	S1147-W1160 WeakPolarHBondContact OG-CH2 3.45Å; I1150-W1160 HydrophobicContact CB-CD2 4.28Å; I1150-W1160 HydrophobicContact CB-CG 4.43Å; I1150-W1160 HydrophobicContact CG2-CB 3.71Å; I1150-W1160 HydrophobicContact CG2-CD2 3.61Å; I1150-W1160 HydrophobicContact CG2-CE3 4.36Å; I1150-W1160 HydrophobicContact CG2-CG 3.31Å; A1151-W1160 HydrophobicContact CB-CZ2 3.8Å; G1155-W1160 PolarHBondContact O-NE1 2.98Å; S1156-W1160 PolarHBondContact O-NE1 3.26Å; P1157-W1160 HydrophobicContact CB-CD2 4.32Å; P1157-W1160 HydrophobicContact CB-CE3 4.29Å; P1157-W1160 HydrophobicContact CB-CH2 4.11Å; P1157-W1160 HydrophobicContact CB-CZ2 4.16Å; P1157-W1160 HydrophobicContact CB-CZ3 4.16Å; P1157-W1160 HydrophobicContact CG-CH2 3.95Å; P1157-W1160 HydrophobicContact CG-CZ2 3.86Å; P1157-W1160 HydrophobicContact CG-CZ3 4.49Å; W1160-V1162 PolarHBondContact O-N 2.81Å; W1160-T1472 WeakPolarHBondContact CH2-O 3.21Å; W1160-T1472 WeakPolarHBondContact CZ3-O 3.36Å; W1160-L1474 HydrophobicContact CE3-CD2 3.7Å; W1160-L1474 HydrophobicContact CE3-CG 4.08Å; W1160-L1474 HydrophobicContact CZ3-CB 4.5Å; W1160-L1474 HydrophobicContact CZ3-CD2 3.9Å; W1160-L1474 HydrophobicContact CZ3-CG 3.73Å
1161	P	67	Low	63.8	Low	32 Å²	32	63.4 Å²	63.4	21%	0.208	35%	0.346	C	S	.	.	S	Bend	trans	-69	-6.5	-177.4	30.2	-37.4	0	0	0	113.2	F1154 M1159 I1177 Q1178	F1154-P1161 HydrophobicContact CD1-CG 4.23Å; F1154-P1161 HydrophobicContact CD2-CG 4Å; F1154-P1161 HydrophobicContact CE1-CG 3.88Å; F1154-P1161 HydrophobicContact CE2-CG 3.64Å; F1154-P1161 HydrophobicContact CG-CG 4.3Å; F1154-P1161 HydrophobicContact CZ-CG 3.58Å; M1159-P1161 WeakPolarHBondContact O-CD 3.48Å; P1161-I1177 CarbonylContact O-C 3.59Å; P1161-I1177 VanDerWaalsContact O-CA 3.31Å; P1161-I1177 WeakPolarHBondContact O-CA 3.49Å; P1161-I1177 WeakPolarHBondContact O-CG2 3.5Å; P1161-Q1178 PolarHBondContact O-N 3.33Å
1162	V	65.7	Low	62.4	Low	36 Å²	36	63.8 Å²	63.8	22%	0.218	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	117.7	177.9	-171.7	0	0	0	0	108.7	W1160 L1175 E1176 I1177	W1160-V1162 PolarHBondContact O-N 2.81Å; V1162-L1175 HydrophobicContact CG1-CB 3.75Å; V1162-L1175 HydrophobicContact CG1-CD2 3.87Å; V1162-L1175 HydrophobicContact CG1-CG 4.31Å; V1162-E1176 WeakPolarHBondContact CA-O 3.48Å; V1162-I1177 HydrophobicContact CG2-CG1 4.3Å
1163	R	66.2	Low	60.9	Low	45 Å²	45	60.4 Å²	60.4	17%	0.17	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	153.1	164.7	-76.7	-88.1	-174.6	148.2	-2.6	108.6	E1176 Q1178 G1473 L1474 L1475 I1476	R1163-E1176 PolarHBondContact N-O 2.94Å; R1163-E1176 PolarHBondContact O-N 3.36Å; R1163-Q1178 HydrophobicContact CG-CG 4.22Å; R1163-G1473 PolarHBondContact NH1-O 3.28Å; R1163-L1474 CarbonylContact C-O 3.51Å; R1163-L1474 WeakPolarHBondContact CA-O 3.37Å; R1163-L1474 WeakPolarHBondContact CB-O 3.38Å; R1163-L1474 WeakPolarHBondContact CD-O 3.4Å; R1163-L1475 PolarHBondContact NH1-O 3.01Å; R1163-I1476 HydrophobicContact CB-CD1 3.63Å; R1163-I1476 HydrophobicContact CB-CG1 3.76Å; R1163-I1476 HydrophobicContact CG-CD1 3.88Å; R1163-I1476 HydrophobicContact CG-CG1 3.79Å
1164	M	62.5	Low	59.9	Low	4 Å²	4	59.7 Å²	59.7	2%	0.02	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.2	160.7	-154.9	-161.4	84.3	0	0	108.3	I1143 I1166 P1173 H1174 L1175 S1469 L1474 L1475 I1476	I1143-M1164 HydrophobicContact CD1-SD 4.24Å; M1164-I1166 HydrophobicContact CE-CG1 4.21Å; M1164-P1173 HydrophobicContact CE-CB 3.43Å; M1164-P1173 VanDerWaalsContact CE-CB 3.43Å; M1164-P1173 HydrophobicContact CG-CB 4.25Å; M1164-P1173 HydrophobicContact SD-CB 3.4Å; M1164-P1173 WeakPolarHBondContact SD-CB 3.12Å; M1164-H1174 CarbonylContact C-O 3.45Å; M1164-H1174 WeakPolarHBondContact CA-O 3.15Å; M1164-H1174 VanDerWaalsContact CG-O 3.31Å; M1164-H1174 WeakPolarHBondContact CG-O 3.37Å; M1164-L1175 HydrophobicContact CB-CD2 3.99Å; M1164-L1175 HydrophobicContact CG-CD2 4Å; M1164-S1469 WeakPolarHBondContact CE-OG 3.4Å; M1164-L1474 HydrophobicContact CB-CB 3.9Å; M1164-L1474 PolarHBondContact N-O 2.87Å; M1164-L1475 HydrophobicContact CE-CD1 4.4Å; M1164-L1475 VanDerWaalsContact O-CA 3.26Å; M1164-L1475 WeakPolarHBondContact O-CA 3.21Å; M1164-I1476 PolarHBondContact O-N 3.17Å
1165	R	61.3	Low	59.3	Low	75 Å²	75	60 Å²	60	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.5	176.2	-164.8	166.7	-166.4	166.1	4.3	109.1	H1174 E1176 I1476	R1165-H1174 PolarHBondContact N-O 2.79Å; R1165-H1174 PolarHBondContact O-N 3.44Å; R1165-H1174 PolarHBondContact O-ND1 3.05Å; R1165-E1176 WeakPolarHBondContact CD-OE2 3.34Å; R1165-E1176 IonicContact CZ-OE2 2.66Å; R1165-E1176 IonicContact NE-OE2 2.73Å; R1165-E1176 IonicContact NH1-OE1 3.87Å; R1165-E1176 IonicContact NH1-OE2 2.62Å; R1165-E1176 PolarHBondContact NH1-OE2 2.75Å; R1165-I1476 HydrophobicContact CG-CB 4.36Å
1166	I	53.5	Low	58.7	Low	24 Å²	24	61.4 Å²	61.4	12%	0.123	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.1	163.4	-63.8	158	0	0	0	105.7	M1164 K1466 L1475	M1164-I1166 HydrophobicContact CE-CG1 4.21Å; I1166-K1466 HydrophobicContact CD1-CB 3.73Å; I1166-K1466 HydrophobicContact CD1-CD 4Å; I1166-K1466 HydrophobicContact CD1-CG 3.54Å; I1166-K1466 HydrophobicContact CG1-CG 4.18Å; I1166-L1475 HydrophobicContact CB-CD1 4.11Å; I1166-L1475 HydrophobicContact CD1-CD1 3.58Å; I1166-L1475 HydrophobicContact CD1-CD2 3.7Å; I1166-L1475 HydrophobicContact CD1-CG 4.33Å; I1166-L1475 HydrophobicContact CG1-CD1 3.6Å
1167	R	54.2	Low	58.2	Low	106 Å²	106	64 Å²	64	40%	0.4	32%	0.319	S	S	.	.			trans	-78.2	128.5	171.5	-68.9	-175.3	176.8	-145	-13.4	108.5	E1169 D1170 E1171 H1174	R1167-E1169 VanDerWaalsContact C-N 3.26Å; R1167-E1169 PolarHBondContact O-N 3.1Å; R1167-D1170 HydrophobicContact CB-CB 3.63Å; R1167-D1170 PolarHBondContact O-N 3.16Å; R1167-D1170 VanDerWaalsContact O-N 3.08Å; R1167-E1171 PolarHBondContact O-N 3.34Å; R1167-H1174 WeakPolarHBondContact CG-CE1 3.36Å; R1167-H1174 PolarHBondContact NE-CD2 3.04Å; R1167-H1174 PolarHBondContact NE-CE1 2.85Å; R1167-H1174 VanDerWaalsContact NE-CE1 3.28Å; R1167-H1174 PolarHBondContact NE-NE2 2.83Å; R1167-H1174 PolarHBondContact NH2-CD2 3.05Å; R1167-H1174 PolarHBondContact NH2-NE2 3.47Å
1168	P	43.4	Very low	57.8	Low	84 Å²	84	65 Å²	65	55%	0.545	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-37.2	-174.9	28.5	-37.5	0	0	0	111.7	D1170 L1478	P1168-D1170 VanDerWaalsContact C-N 3.27Å; P1168-D1170 PolarHBondContact O-N 3.07Å; P1168-L1478 HydrophobicContact CB-CD2 4.15Å; P1168-L1478 HydrophobicContact CG-CD1 4.37Å; P1168-L1478 HydrophobicContact CG-CD2 3.67Å
1169	E	45.7	Very low	56.8	Low	150 Å²	150	67.2 Å²	67.2	70%	0.701	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-18.5	178.6	-65.7	158.8	-113.8	0	0	113.3	R1167 K1311	R1167-E1169 VanDerWaalsContact C-N 3.26Å; R1167-E1169 PolarHBondContact O-N 3.1Å; E1169-K1311 PolarHBondContact O-NZ 3.03Å
1170	D	51.4	Low	55.7	Low	22 Å²	22	65.5 Å²	65.5	12%	0.118	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	-11.1	-154.1	-104.9	6.2	0	0	0	114.4	R1167 P1168 M1172 L1307 K1311	R1167-D1170 HydrophobicContact CB-CB 3.63Å; R1167-D1170 PolarHBondContact O-N 3.16Å; R1167-D1170 VanDerWaalsContact O-N 3.08Å; P1168-D1170 VanDerWaalsContact C-N 3.27Å; P1168-D1170 PolarHBondContact O-N 3.07Å; D1170-M1172 PolarHBondContact O-N 3.23Å; D1170-L1307 HydrophobicContact CB-CD2 3.67Å; D1170-L1307 VanDerWaalsContact CG-CB 3.48Å; D1170-L1307 WeakPolarHBondContact O-CD2 3.25Å; D1170-L1307 WeakPolarHBondContact OD1-CB 3.36Å; D1170-L1307 VanDerWaalsContact OD1-CD2 3.24Å; D1170-L1307 WeakPolarHBondContact OD1-CD2 3.48Å; D1170-L1307 WeakPolarHBondContact OD2-CB 3.32Å; D1170-K1311 IonicContact OD1-NZ 3.01Å; D1170-K1311 PolarHBondContact OD1-NZ 3.48Å
1171	E	50.4	Low	54.1	Low	102 Å²	102	73.5 Å²	73.5	48%	0.477	37%	0.366	S	S	.	.			trans	58.5	-16	176.5	-64.3	-114.4	103	0	0	117.5	R1167 I1462 K1466	R1167-E1171 PolarHBondContact O-N 3.34Å; E1171-I1462 HydrophobicContact CB-CG2 4.24Å; E1171-K1466 IonicContact OE1-NZ 3.42Å; E1171-K1466 PolarHBondContact OE1-NZ 2.8Å; E1171-K1466 IonicContact OE2-NZ 3.95Å; E1171-K1466 PolarHBondContact OE2-NZ 3.08Å
1172	M	46.4	Very low	52.6	Low	43 Å²	43	78 Å²	78	21%	0.212	40%	0.398	C	S	.	.			trans	-80.3	147.6	-174.2	-72.3	-138.2	91.7	0	0	113.8	F1123 D1170 L1307 L1310 W1461 I1462	F1123-M1172 HydrophobicContact CE1-CE 4.41Å; D1170-M1172 PolarHBondContact O-N 3.23Å; M1172-L1307 HydrophobicContact CG-CD1 3.84Å; M1172-L1307 HydrophobicContact CG-CD2 4.14Å; M1172-L1307 HydrophobicContact SD-CD1 3.65Å; M1172-L1310 HydrophobicContact SD-CD2 4.5Å; M1172-W1461 HydrophobicContact CE-CE3 4.31Å; M1172-W1461 HydrophobicContact CE-CZ3 4.34Å; M1172-I1462 HydrophobicContact CE-CD1 4.04Å; M1172-I1462 HydrophobicContact CE-CG1 3.61Å; M1172-I1462 HydrophobicContact CG-CD1 4.2Å; M1172-I1462 HydrophobicContact CG-CG1 4.23Å
1173	P	48.4	Very low	51.3	Low	22 Å²	22	79.3 Å²	79.3	14%	0.143	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.7	171.5	31.7	-38.2	0	0	0	112.1	M1139 M1164 W1461 A1465	M1139-P1173 HydrophobicContact CE-CG 3.96Å; M1164-P1173 HydrophobicContact CE-CB 3.43Å; M1164-P1173 VanDerWaalsContact CE-CB 3.43Å; M1164-P1173 HydrophobicContact CG-CB 4.25Å; M1164-P1173 HydrophobicContact SD-CB 3.4Å; M1164-P1173 WeakPolarHBondContact SD-CB 3.12Å; P1173-W1461 HydrophobicContact CG-CZ3 3.98Å; P1173-A1465 HydrophobicContact CB-CB 3.79Å; P1173-A1465 HydrophobicContact CG-CB 3.53Å
1174	H	54.9	Low	49.6	Very low	51 Å²	51	83.7 Å²	83.7	24%	0.236	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.6	162.6	73.8	-49.8	0	0	0	111.4	M1164 R1165 R1167	M1164-H1174 CarbonylContact C-O 3.45Å; M1164-H1174 WeakPolarHBondContact CA-O 3.15Å; M1164-H1174 VanDerWaalsContact CG-O 3.31Å; M1164-H1174 WeakPolarHBondContact CG-O 3.37Å; R1165-H1174 PolarHBondContact N-O 2.79Å; R1165-H1174 PolarHBondContact O-N 3.44Å; R1165-H1174 PolarHBondContact O-ND1 3.05Å; R1167-H1174 WeakPolarHBondContact CG-CE1 3.36Å; R1167-H1174 PolarHBondContact NE-CD2 3.04Å; R1167-H1174 PolarHBondContact NE-CE1 2.85Å; R1167-H1174 VanDerWaalsContact NE-CE1 3.28Å; R1167-H1174 PolarHBondContact NE-NE2 2.83Å; R1167-H1174 PolarHBondContact NH2-CD2 3.05Å; R1167-H1174 PolarHBondContact NH2-NE2 3.47Å
1175	L	56.6	Low	48	Very low	79 Å²	79	86.4 Å²	86.4	41%	0.414	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.7	178.4	-68.5	168	0	0	0	109.4	L1146 V1162 M1164	L1146-L1175 HydrophobicContact CD2-CD1 3.89Å; L1146-L1175 HydrophobicContact CD2-CD2 4.07Å; V1162-L1175 HydrophobicContact CG1-CB 3.75Å; V1162-L1175 HydrophobicContact CG1-CD2 3.87Å; V1162-L1175 HydrophobicContact CG1-CG 4.31Å; M1164-L1175 HydrophobicContact CB-CD2 3.99Å; M1164-L1175 HydrophobicContact CG-CD2 4Å
1176	E	58	Low	46.6	Very low	73 Å²	73	90.3 Å²	90.3	34%	0.341	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.6	-178.6	-179.4	168.8	-133.2	0	0	109.2	V1162 R1163 R1165	V1162-E1176 WeakPolarHBondContact CA-O 3.48Å; R1163-E1176 PolarHBondContact N-O 2.94Å; R1163-E1176 PolarHBondContact O-N 3.36Å; R1165-E1176 WeakPolarHBondContact CD-OE2 3.34Å; R1165-E1176 IonicContact CZ-OE2 2.66Å; R1165-E1176 IonicContact NE-OE2 2.73Å; R1165-E1176 IonicContact NH1-OE1 3.87Å; R1165-E1176 IonicContact NH1-OE2 2.62Å; R1165-E1176 PolarHBondContact NH1-OE2 2.75Å
1177	I	60	Low	45.5	Very low	115 Å²	115	95 Å²	95	59%	0.59	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.2	177.4	-60.8	174.6	0	0	0	108.3	P1161 V1162 N1179	P1161-I1177 CarbonylContact O-C 3.59Å; P1161-I1177 VanDerWaalsContact O-CA 3.31Å; P1161-I1177 WeakPolarHBondContact O-CA 3.49Å; P1161-I1177 WeakPolarHBondContact O-CG2 3.5Å; V1162-I1177 HydrophobicContact CG2-CG1 4.3Å; I1177-N1179 PolarHBondContact O-N 2.72Å; I1177-N1179 VanDerWaalsContact O-N 3.08Å
1178	Q	59	Low	44.3	Very low	68 Å²	68	92.6 Å²	92.6	32%	0.318	55%	0.554	S	S	.	*			trans	-75	98.9	176.7	-84.9	-166.3	-34.5	0	0	111.3	P1161 R1163 S1180	P1161-Q1178 PolarHBondContact O-N 3.33Å; R1163-Q1178 HydrophobicContact CG-CG 4.22Å; Q1178-S1180 PolarHBondContact O-N 2.87Å
1179	N	46.9	Very low	43.8	Very low	161 Å²	161	99.5 Å²	99.5	86%	0.861	57%	0.571	S	S	*	*			trans	-78.4	64.7	171.7	-78.2	-16.6	0	0	0	111.7	I1177	I1177-N1179 PolarHBondContact O-N 2.72Å; I1177-N1179 VanDerWaalsContact O-N 3.08Å
1180	S	43.5	Very low	43	Very low	77 Å²	77	97.4 Å²	97.4	54%	0.538	57%	0.57	S	S	.	*			trans	-148	51.3	-178.8	57.5	0	0	0	0	114.2	Q1178	Q1178-S1180 PolarHBondContact O-N 2.87Å
1181	F	41.5	Very low	42.2	Very low	174 Å²	174	100.4 Å²	100.4	76%	0.763	59%	0.593	S	S	*	*			trans	-99.8	65.8	161	-87.2	-82.6	0	0	0	110.7	G1183	F1181-G1183 VanDerWaalsContact C-N 3.25Å; F1181-G1183 PolarHBondContact O-N 2.82Å; F1181-G1183 VanDerWaalsContact O-N 3.11Å
1182	S	34.8	Very low	41.2	Very low	127 Å²	127	101.7 Å²	101.7	89%	0.888	60%	0.602	S	S	*	*			trans	-83.8	65.1	173.1	56.1	0	0	0	0	111
1183	G	37.9	Very low	40.5	Very low	63 Å²	63	103.6 Å²	103.6	65%	0.649	62%	0.62	S	S	*	*			trans	-143.1	116.4	179	0	0	0	0	0	111.1	F1181 G1185	F1181-G1183 VanDerWaalsContact C-N 3.25Å; F1181-G1183 PolarHBondContact O-N 2.82Å; F1181-G1183 VanDerWaalsContact O-N 3.11Å; G1183-G1185 PolarHBondContact O-N 3.07Å
1184	S	31.6	Very low	39.5	Very low	137 Å²	137	107.7 Å²	107.7	96%	0.958	65%	0.645	S	S	*	*			trans	-85.5	91.8	-173.4	55	0	0	0	0	112.5
1185	G	29.1	Very low	38.3	Very low	61 Å²	61	113.1 Å²	113.1	63%	0.629	67%	0.674	S	S	*	*			trans	176.1	148.4	169.1	0	0	0	0	0	113.4	G1183	G1183-G1185 PolarHBondContact O-N 3.07Å
1186	L	32.4	Very low	37.2	Very low	157 Å²	157	111.9 Å²	111.9	82%	0.822	68%	0.681	S	S	*	*			trans	60.6	104.6	171.6	-47.6	176.2	0	0	0	114.2
1187	S	29.6	Very low	35.9	Very low	123 Å²	123	116 Å²	116	86%	0.86	71%	0.705	S	S	*	*			cis	46.8	53.3	44.9	90	0	0	0	0	114.3
1188	G	29.9	Very low	34.6	Very low	55 Å²	55	115.6 Å²	115.6	57%	0.567	71%	0.71	S	S	*	*			trans	163.5	46.9	167.8	0	0	0	0	0	120.4
1189	Y	31.7	Very low	33.1	Very low	230 Å²	230	119.7 Å²	119.7	90%	0.902	73%	0.733	S	S	*	*			trans	-137.6	143	158.3	-77.4	-70.4	0	0	0	111.7
1190	P	29.9	Very low	32.5	Very low	105 Å²	105	116.8 Å²	116.8	68%	0.682	73%	0.725	S	S	*	*			trans	-80.7	170.6	-173.3	34	-36.5	0	0	0	113
1191	S	32.9	Very low	31.9	Very low	85 Å²	85	121 Å²	121	59%	0.594	74%	0.736	S	S	*	*			trans	-61.6	155.3	172.6	51.4	0	0	0	0	112.7	S1193	S1191-S1193 PolarHBondContact O-N 2.97Å; S1191-S1193 PolarHBondContact OG-OG 3.4Å
1192	L	30.6	Very low	31.5	Very low	129 Å²	129	121.2 Å²	121.2	68%	0.675	74%	0.739	S	S	*	*	S	Bend	trans	-70.9	51.8	-178.8	-148.9	171.4	0	0	0	112	F1154	F1154-L1192 HydrophobicContact CE2-CD1 3.72Å; F1154-L1192 HydrophobicContact CE2-CD2 4.4Å; F1154-L1192 HydrophobicContact CE2-CG 3.89Å; F1154-L1192 HydrophobicContact CZ-CD1 3.64Å; F1154-L1192 HydrophobicContact CZ-CG 3.75Å
1193	S	30.6	Very low	31.4	Very low	83 Å²	83	118.5 Å²	118.5	58%	0.58	73%	0.731	S	S	*	*	S	Bend	trans	-154.4	19.1	-161.8	68.9	0	0	0	0	115.2	S1191	S1191-S1193 PolarHBondContact O-N 2.97Å; S1191-S1193 PolarHBondContact OG-OG 3.4Å
1194	T	29.2	Very low	31.3	Very low	109 Å²	109	121 Å²	121	67%	0.669	73%	0.734	S	S	*	*			trans	-161.7	123.5	169.4	17.2	0	0	0	0	111.2
1195	L	29.7	Very low	31.1	Very low	164 Å²	164	123.1 Å²	123.1	86%	0.859	73%	0.733	S	S	*	*			trans	-148.3	142.4	158.2	-145.1	81.2	0	0	0	108.4
1196	G	31.8	Very low	31.2	Very low	54 Å²	54	123.9 Å²	123.9	56%	0.557	74%	0.741	S	S	*	*			trans	88.6	118.9	-162	0	0	0	0	0	111
1197	D	31.4	Very low	31.1	Very low	158 Å²	158	122 Å²	122	85%	0.845	74%	0.741	S	S	*	*			cis	-138.7	170	6.2	-76	-49.3	0	0	0	110.9
1198	P	32.8	Very low	31.1	Very low	107 Å²	107	120.7 Å²	120.7	70%	0.695	73%	0.732	S	S	*	*			trans	-106.5	166.4	-151.6	40.2	-37.5	0	0	0	118.5
1199	I	28.1	Very low	30.9	Very low	154 Å²	154	125 Å²	125	79%	0.79	74%	0.741	S	S	*	*			trans	89.8	138.6	154.8	-69.7	151.7	0	0	0	120.9
1200	S	32.9	Very low	30.7	Very low	101 Å²	101	119.8 Å²	119.8	71%	0.706	73%	0.733	S	S	*	*			trans	97.2	84.1	156.8	64.3	0	0	0	0	123.5
1201	H	31.8	Very low	30.5	Very low	164 Å²	164	125.3 Å²	125.3	76%	0.759	74%	0.741	S	S	*	*				45.5	126.4	121.6	-76.1	-82.8	0	0	0	125.4
1202	H	33.8	Very low	30.2	Very low	180 Å²	180	127.9 Å²	127.9	83%	0.833	75%	0.748	S	S	*	*			trans	57.6	150	159.4	-58.4	-76.8	0	0	0	117.6
1203	G	32.6	Very low	29.9	Very low	69 Å²	69	126.6 Å²	126.6	71%	0.711	75%	0.75	S	S	*	*			cis	161.9	164	-1.2	0	0	0	0	0	109.8
1204	T	34	Very low	29.7	Very low	117 Å²	117	128 Å²	128	72%	0.718	76%	0.759	S	S	*	*			cis	-166.3	128.1	-8.9	-68.2	0	0	0	0	110.4
1205	L	28.9	Very low	29.5	Very low	180 Å²	180	130.3 Å²	130.3	94%	0.942	77%	0.767	S	S	*	*			trans	59.8	137.8	164.4	-65.4	169.3	0	0	0	121.6
1206	G	30.9	Very low	29.2	Very low	77 Å²	77	133 Å²	133	79%	0.794	77%	0.766	S	S	*	*			trans	166.7	159.8	171.1	0	0	0	0	0	113.9
1207	S	30.9	Very low	29.1	Very low	118 Å²	118	140.5 Å²	140.5	83%	0.825	78%	0.783	S	S	*	*			trans	-160.1	176.6	-175.1	69.4	0	0	0	0	111.7
1208	S	28.2	Very low	28.8	Very low	95 Å²	95	138 Å²	138	66%	0.664	78%	0.778	S	S	*	*			cis	-161.4	172.1	14.7	-149.7	0	0	0	0	114.8
1209	L	26.6	Very low	28.9	Very low	145 Å²	145	138 Å²	138	76%	0.759	78%	0.778	S	S	*	*			trans	48.9	126.7	153.8	-74.7	164.6	0	0	0	123.5
1210	T	27.3	Very low	28.8	Very low	121 Å²	121	136 Å²	136	74%	0.742	78%	0.778	S	S	*	*			trans	87.7	121.7	137.4	51.5	0	0	0	0	125
1211	R	25.8	Very low	28.9	Very low	222 Å²	222	137.2 Å²	137.2	84%	0.838	78%	0.783	S	S	*	*			trans	76.6	114.9	136.4	-77	-175	172.7	-179.3	-1	122.8
1212	N	25.3	Very low	28.6	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	78%	0.782	S	S	*	*			trans	90.8	139.4	131	-70	9.1	0	0	0	122.2
1213	S	25.7	Very low	28.5	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	79%	0.785	S	S	*	*			trans	64.4	102.2	150.7	48	0	0	0	0	121.8
1214	S	25.3	Very low	28.2	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	79%	0.794	S	S	*	*				82.4	144.3	117.3	-55.1	0	0	0	0	122.2
1215	L	26.5	Very low	27.9	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	80%	0.803	S	S	*	*			trans	87.4	118.7	160.5	-65.3	168.7	0	0	0	120.8
1216	R	23.4	Very low	27.9	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	79%	0.793	S	S	*	*			trans	1.5	135.4	151.3	-58.3	175.9	175.8	-171.7	-3.3	119.3
1217	F	28.1	Very low	27.9	Very low	211 Å²	211	143.1 Å²	143.1	93%	0.925	80%	0.795	S	S	*	*				-160.2	160.3	106	-102.2	-72	0	0	0	111.5
1218	S	25.9	Very low	27.8	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	79%	0.791	S	S	*	*			trans	-111.4	179.2	175.7	54.8	0	0	0	0	109.2
1219	P	35.8	Very low	27.7	Very low	107 Å²	107	145.2 Å²	145.2	70%	0.695	80%	0.797	S	S	*	*			cis	-143.3	172.7	15.5	43.8	-24.1	0	0	0	119
1220	S	25.8	Very low	27.7	Very low	113 Å²	113	145.2 Å²	145.2	79%	0.79	80%	0.796	S	S	*	*			trans	26	162.3	138.5	-51.1	0	0	0	0	124.1
1221	P	35.1	Very low	27.6	Very low	127 Å²	127	147.4 Å²	147.4	83%	0.825	80%	0.802	S	S	*	*			cis	-133.9	167.7	-4.5	39.2	-22.5	0	0	0	116.9
1222	G	25.6	Very low	27.7	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	80%	0.798	S	S	*	*			trans	102	101.6	133.5	0	0	0	0	0	120.7
1223	L	30	Very low	28	Very low	172 Å²	172	140.8 Å²	140.8	90%	0.901	80%	0.799	S	S	*	*			trans	175.3	135.4	134.8	-101.1	161.4	0	0	0	110.4	R1225	L1223-R1225 PolarHBondContact O-N 3.35Å
1224	H	26.7	Very low	28.1	Very low	196 Å²	196	147.4 Å²	147.4	91%	0.907	81%	0.808	S	S	*	*			trans	-74.9	122.6	173.6	-81.4	-111.5	0	0	0	110.8
1225	R	28.6	Very low	28.4	Very low	239 Å²	239	150.1 Å²	150.1	90%	0.902	81%	0.813	S	S	*	*			trans	-134.6	153.7	165	-85.4	-168.5	170.8	-163.2	-2.4	110.8	L1223	L1223-R1225 PolarHBondContact O-N 3.35Å
1226	S	28.1	Very low	28.3	Very low	104 Å²	104	152 Å²	152	73%	0.727	81%	0.814	S	S	*	*			trans	-66	151.9	-167.5	-44.7	0	0	0	0	114.7	S1228	S1226-S1228 PolarHBondContact O-N 2.75Å; S1226-S1228 VanDerWaalsContact O-N 3.13Å
1227	P	32.1	Very low	28.6	Very low	128 Å²	128	148.4 Å²	148.4	83%	0.831	81%	0.811	S	S	*	*			trans	-77.9	96	176.4	31.3	-34.4	0	0	0	112.2	L1229	P1227-L1229 PolarHBondContact O-N 3.27Å
1228	S	27.4	Very low	28.6	Very low	107 Å²	107	144.9 Å²	144.9	75%	0.748	80%	0.802	S	S	*	*			trans	-67.2	119	173	-57.3	0	0	0	0	112	S1226	S1226-S1228 PolarHBondContact O-N 2.75Å; S1226-S1228 VanDerWaalsContact O-N 3.13Å
1229	L	27.4	Very low	28.9	Very low	150 Å²	150	152 Å²	152	79%	0.785	81%	0.813	S	S	*	*			trans	-89	108.7	173.5	-74.8	172.4	0	0	0	111.1	P1227	P1227-L1229 PolarHBondContact O-N 3.27Å
1230	I	26	Very low	28.6	Very low	145 Å²	145	157.5 Å²	157.5	74%	0.744	82%	0.82	S	S	*	*			trans	-85.3	129.2	175	-59.7	175	0	0	0	109.8
1231	L	25.7	Very low	28.7	Very low	167 Å²	167	159.3 Å²	159.3	87%	0.874	82%	0.82	S	S	*	*			trans	-132.5	96.4	174.4	-90.7	165.3	0	0	0	110.2
1232	S	27	Very low	28.4	Very low	107 Å²	107	162.7 Å²	162.7	75%	0.748	82%	0.822	S	S	*	*			trans	-92.6	128.7	-174.6	-49.1	0	0	0	0	112.9
1233	P	31.2	Very low	28.5	Very low	116 Å²	116	164 Å²	164	75%	0.753	82%	0.82	S	S	*	*			trans	-106.5	121.4	177	35.1	-28	0	0	0	114.4
1234	R	28.2	Very low	28.4	Very low	240 Å²	240	161.2 Å²	161.2	91%	0.906	81%	0.814	S	S	*	*			trans	65.4	133.5	163.2	-59.5	175.3	172.1	163.2	-3.8	116
1235	L	31.4	Very low	28.5	Very low	168 Å²	168	156.8 Å²	156.8	88%	0.88	81%	0.805	S	S	*	*				-158	156.8	71.9	-91.3	164.6	0	0	0	112
1236	F	25.5	Very low	28.5	Very low	198 Å²	198	155 Å²	155	87%	0.868	80%	0.804	S	S	*	*			trans	-155.9	126.2	168.3	-160.9	-84.6	0	0	0	110.4
1237	L	29.5	Very low	28.5	Very low	146 Å²	146	154.6 Å²	154.6	76%	0.764	80%	0.802	S	S	*	*			trans	-159.7	143.9	168.9	-115.5	170.9	0	0	0	112
1238	N	28.4	Very low	28.5	Very low	138 Å²	138	155.3 Å²	155.3	74%	0.738	80%	0.797	S	S	*	*			trans	62.8	99.4	165.5	-69.6	-33.7	0	0	0	120.3
1239	R	31.6	Very low	28.6	Very low	252 Å²	252	158 Å²	158	95%	0.951	80%	0.803	S	S	*	*				-154.4	150.2	102.7	-107	177.7	-169.4	-169	4.2	114.2
1240	R	29.9	Very low	28.8	Very low	223 Å²	223	159.2 Å²	159.2	84%	0.842	81%	0.805	S	S	*	*			trans	-59.4	146.3	-166	-77.1	172.7	172.8	178.1	-3.1	119.2
1241	L	26.5	Very low	28.9	Very low	151 Å²	151	159.6 Å²	159.6	79%	0.791	81%	0.808	S	S	*	*			trans	58.9	115.1	131.3	-59.3	168	0	0	0	121.6
1242	K	29.7	Very low	29.2	Very low	199 Å²	199	156.9 Å²	156.9	87%	0.865	80%	0.803	S	S	*	*				-177.8	129.8	98.9	-100.9	-176.6	177.6	-177.3	0	115
1243	S	27.8	Very low	29.2	Very low	99 Å²	99	156.5 Å²	156.5	69%	0.692	81%	0.807	S	S	*	*			trans	43.5	126.5	147.1	57.8	0	0	0	0	124.4
1244	S	28.4	Very low	29	Very low	112 Å²	112	156.6 Å²	156.6	78%	0.783	81%	0.81	S	S	*	*			trans	66.5	145.3	140.4	58.6	0	0	0	0	121.8
1245	S	27	Very low	29.1	Very low	103 Å²	103	150.1 Å²	150.1	72%	0.72	81%	0.808	S	S	*	*			cis	-168.1	170.3	-18.6	54.8	0	0	0	0	111.7
1246	K	30.7	Very low	28.7	Very low	201 Å²	201	150.4 Å²	150.4	87%	0.874	81%	0.809	S	S	*	*			trans	82.6	109.8	172	-60.2	-173.3	175.5	-176.4	0	119.6
1247	S	27.1	Very low	28.6	Very low	97 Å²	97	146.5 Å²	146.5	68%	0.678	81%	0.807	S	S	*	*			trans	-71.4	158.7	147.3	46.6	0	0	0	0	110.1
1248	I	32.1	Very low	28.3	Very low	142 Å²	142	145.8 Å²	145.8	73%	0.728	80%	0.802	S	S	*	*			cis	73.3	118	42.3	-55.8	171.1	0	0	0	113.1	E1250	I1248-E1250 HydrophobicContact CG2-CG 4.02Å
1249	D	29.2	Very low	28	Very low	164 Å²	164	147 Å²	147	88%	0.877	81%	0.809	S	S	*	*			trans	-102.2	140.8	149.4	-81	-45.2	0	0	0	108.2
1250	E	32.7	Very low	27.7	Very low	175 Å²	175	140.9 Å²	140.9	82%	0.818	80%	0.799	S	S	*	*			trans	-125.2	156.5	168.4	-84	-163	145.5	0	0	109.2	I1248	I1248-E1250 HydrophobicContact CG2-CG 4.02Å
1251	D	26.9	Very low	27.4	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	80%	0.803	S	S	*	*			trans	-140.9	110.1	156.4	-155.7	-10.1	0	0	0	110.3
1252	S	33.2	Very low	27.4	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	80%	0.8	S	S	*	*			trans	-168.1	77.1	179.6	-84.6	0	0	0	0	112.1	S1254	S1252-S1254 PolarHBondContact O-N 2.94Å
1253	A	25.9	Very low	27.3	Very low	100 Å²	100	130.7 Å²	130.7	83%	0.826	79%	0.791	S	S	*	*			trans	-77	120.1	179.4	0	0	0	0	0	113.6
1254	S	26.5	Very low	27.3	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	80%	0.8	S	S	*	*			trans	-159.9	65.3	160.3	69.8	0	0	0	0	115.2	S1252	S1252-S1254 PolarHBondContact O-N 2.94Å
1255	A	31	Very low	27.3	Very low	103 Å²	103	132.7 Å²	132.7	85%	0.851	79%	0.794	S	S	*	*			trans	-160.3	122.3	155.6	0	0	0	0	0	111.3
1256	L	22	Very low	27.5	Very low	174 Å²	174	136.2 Å²	136.2	91%	0.911	81%	0.805	S	S	*	*			trans	-109.8	115	163.2	-87	169.2	0	0	0	108.7
1257	S	24.1	Very low	27.5	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	80%	0.8	S	S	*	*				-153	146.8	128.7	-163	0	0	0	0	109.2
1258	I	22.9	Very low	27.8	Very low	131 Å²	131	132.7 Å²	132.7	67%	0.672	81%	0.805	S	S	*	*			trans	-88.7	148.6	175.9	-66	158.3	0	0	0	108	V1260	I1258-V1260 HydrophobicContact CG2-CG2 4.24Å
1259	D	23.5	Very low	27.8	Very low	164 Å²	164	131.2 Å²	131.2	88%	0.877	81%	0.808	S	S	*	*			trans	-152.9	142.9	136	-111.8	-33.5	0	0	0	110.6
1260	V	23.6	Very low	28	Very low	123 Å²	123	128 Å²	128	75%	0.745	80%	0.799	S	S	*	*			trans	-147.9	118.5	-173.2	175.7	0	0	0	0	111.1	I1258	I1258-V1260 HydrophobicContact CG2-CG2 4.24Å
1261	M	24.8	Very low	28.2	Very low	187 Å²	187	125.1 Å²	125.1	92%	0.921	79%	0.793	S	S	*	*			trans	-167.4	146	145.3	-80.7	-134.5	-89.1	0	0	104.6
1262	G	26.3	Very low	28.7	Very low	71 Å²	71	126.3 Å²	126.3	73%	0.732	79%	0.793	S	S	*	*			cis	150.3	170.5	26.8	0	0	0	0	0	104.7
1263	C	27.3	Very low	28.6	Very low	101 Å²	101	125.2 Å²	125.2	68%	0.682	79%	0.786	S	S	*	*			cis	-163.7	159.5	-1.7	-132.2	0	0	0	0	109.8
1264	H	28.7	Very low	28.9	Very low	187 Å²	187	126.1 Å²	126.1	87%	0.866	78%	0.781	S	S	*	*			trans	73.9	144.1	164	-59.3	19.7	0	0	0	118.2
1265	G	28.4	Very low	29.2	Very low	65 Å²	65	129.5 Å²	129.5	67%	0.67	78%	0.783	S	S	*	*			cis	179	-170.5	-4.5	0	0	0	0	0	116.8
1266	N	30	Very low	29	Very low	178 Å²	178	133.1 Å²	133.1	95%	0.952	78%	0.782	S	S	*	*			trans	75.3	125.6	176.1	-61.8	-4.3	0	0	0	118.2
1267	G	31.7	Very low	29.4	Very low	73 Å²	73	134 Å²	134	75%	0.753	78%	0.782	S	S	*	*			trans	156.4	33.9	174	0	0	0	0	0	120
1268	N	32.9	Very low	29.6	Very low	150 Å²	150	134 Å²	134	80%	0.802	78%	0.781	S	S	*	*			trans	36.5	113.9	158.4	-65.4	10	0	0	0	122
1269	S	32.1	Very low	30.2	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	79%	0.787	S	S	*	*				36.4	142.8	121.3	67.7	0	0	0	0	121.3
1270	S	33.8	Very low	30.4	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	79%	0.785	S	S	*	*			cis	-164.2	142.7	35.7	68.1	0	0	0	0	112.4
1271	T	36.7	Very low	30.7	Very low	113 Å²	113	132.3 Å²	132.3	69%	0.693	79%	0.786	S	S	*	*				70.9	122.9	97.8	70	0	0	0	0	121.6
1272	H	36.9	Very low	31	Very low	179 Å²	179	128.3 Å²	128.3	83%	0.829	78%	0.776	S	S	*	*			trans	60.8	168.5	147.3	-77.3	-82.7	0	0	0	121.2
1273	S	31	Very low	31.4	Very low	87 Å²	87	130.3 Å²	130.3	61%	0.608	77%	0.774	S	S	*	*				-175.8	167.1	-57.6	58.3	0	0	0	0	112.6
1274	V	33	Very low	31.7	Very low	119 Å²	119	131.7 Å²	131.7	72%	0.721	78%	0.775	S	S	*	*			trans	94.4	131.3	152.4	169.7	0	0	0	0	122
1275	Q	32.3	Very low	32.1	Very low	188 Å²	188	128.4 Å²	128.4	88%	0.879	76%	0.763	S	S	*	*			trans	73.3	161.9	154.8	-88.7	164.2	-29.9	0	0	124.9
1276	E	26.4	Very low	32.3	Very low	179 Å²	179	131.2 Å²	131.2	84%	0.836	76%	0.762	S	S	*	*			trans	-99	149.2	-163.4	-59.1	175.2	123.7	0	0	113.4	S1278	E1276-S1278 PolarHBondContact O-N 2.85Å
1277	H	30.5	Very low	32.1	Very low	194 Å²	194	127.1 Å²	127.1	90%	0.898	75%	0.753	S	S	*	*			trans	32	78.7	164.5	-74	-67.6	0	0	0	119.1
1278	S	28.8	Very low	31.9	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	76%	0.758	S	S	*	*			trans	-147.7	149.5	143.1	-78.6	0	0	0	0	110	E1276	E1276-S1278 PolarHBondContact O-N 2.85Å
1279	P	34.7	Very low	31.5	Very low	123 Å²	123	139.1 Å²	139.1	80%	0.799	76%	0.764	S	S	*	*			trans	-125	116.4	-149.2	35.1	-17.5	0	0	0	117.2
1280	T	28.7	Very low	31.6	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	76%	0.761	S	S	*	*			trans	-141.4	118.6	151.7	40.5	0	0	0	0	107.2
1281	V	30.5	Very low	31.2	Very low	127 Å²	127	139.4 Å²	139.4	77%	0.77	76%	0.763	S	S	*	*				62.3	113.1	78.7	179	0	0	0	0	113.8
1282	S	30.9	Very low	30.7	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	77%	0.766	S	S	*	*			trans	69.2	149.8	167.2	80.5	0	0	0	0	116.9
1283	T	33.8	Very low	30.1	Very low	112 Å²	112	140.2 Å²	140.2	69%	0.687	76%	0.762	S	S	*	*			cis	-165.7	153.6	-19.7	18	0	0	0	0	109.2
1284	N	34.7	Very low	29.9	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	76%	0.764	S	S	*	*			trans	66.9	152.2	154.7	-60.5	-18.6	0	0	0	118.4
1285	N	35.5	Very low	29.6	Very low	117 Å²	117	139.9 Å²	139.9	63%	0.626	77%	0.766	S	S	*	*			cis	-159.7	149.7	-22	-109.1	-23.2	0	0	0	112.9
1286	I	33	Very low	29.3	Very low	125 Å²	125	136 Å²	136	64%	0.641	76%	0.759	S	S	*	*			trans	42.6	114.9	138.2	-56.6	163.6	0	0	0	117.8
1287	A	26.6	Very low	29.3	Very low	91 Å²	91	132.6 Å²	132.6	75%	0.752	76%	0.755	S	S	*	*			cis	86.9	161.3	31.6	0	0	0	0	0	117.1
1288	R	27.7	Very low	29	Very low	231 Å²	231	127.8 Å²	127.8	87%	0.872	74%	0.743	S	S	*	*			trans	96.2	121.3	-176.2	-59.6	172.2	-174.9	-158.9	1.1	113
1289	R	24.7	Very low	28.8	Very low	244 Å²	244	129.8 Å²	129.8	92%	0.921	74%	0.743	S	S	*	*				98.2	153.9	56.5	-94.9	-157.6	166.8	-172.3	-3	111.6
1290	P	33.8	Very low	28.3	Very low	111 Å²	111	129 Å²	129	72%	0.721	74%	0.74	S	S	*	*			trans	-126.6	-174.6	-132.6	44	-31.6	0	0	0	116
1291	S	24.3	Very low	28.1	Very low	104 Å²	104	127.9 Å²	127.9	73%	0.727	74%	0.738	S	S	*	*			trans	126.9	114.5	152.2	66.6	0	0	0	0	116.7
1292	I	26.3	Very low	27.8	Very low	145 Å²	145	132.3 Å²	132.3	74%	0.744	75%	0.748	S	S	*	*				70.7	105.3	101.8	-49	166.8	0	0	0	115.8
1293	H	25.8	Very low	27.7	Very low	164 Å²	164	132.8 Å²	132.8	76%	0.759	75%	0.751	S	S	*	*				172	127.5	115.3	-101.9	-65.3	0	0	0	117.1
1294	S	26.6	Very low	27.5	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	75%	0.745	S	S	*	*			trans	56.2	123.1	136.7	68.9	0	0	0	0	126.1
1295	S	26.4	Very low	27.3	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	72%	0.723	S	S	*	*			trans	63.4	146.5	130	61.9	0	0	0	0	122.3
1296	S	26.4	Very low	27.4	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	74%	0.736	S	S	*	*			cis	-173.9	168.5	-4.6	48	0	0	0	0	114.4
1297	S	25.5	Very low	27.6	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	71%	0.711	S	S	*	*			trans	89.8	151.1	159.7	92.5	0	0	0	0	116.8
1298	S	24.5	Very low	28.3	Very low	93 Å²	93	126.9 Å²	126.9	65%	0.65	70%	0.695	S	S	*	*			cis	-152.8	148.3	20.4	-85.8	0	0	0	0	115.7
1299	I	23.6	Very low	29.1	Very low	158 Å²	158	123.5 Å²	123.5	81%	0.81	69%	0.687	S	S	*	*			trans	54.6	116.4	143.1	-55	162.7	0	0	0	120.5
1300	S	24.3	Very low	29.9	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	66%	0.655	S	S	*	*				174.1	167.6	117.9	52.7	0	0	0	0	114.4
1301	S	26	Very low	30.5	Very low	111 Å²	111	113 Å²	113	78%	0.776	64%	0.639	S	S	*	*			trans	72.6	138	173.6	79.7	0	0	0	0	119.5
1302	F	24.1	Very low	31.8	Very low	220 Å²	220	114.5 Å²	114.5	97%	0.965	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-102.7	121	162.3	-95.6	-112.1	0	0	0	107.1
1303	S	28.5	Very low	32.7	Very low	113 Å²	113	108.5 Å²	108.5	79%	0.79	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-99.9	146.9	-176	50.9	0	0	0	0	115
1304	V	28.5	Very low	33.7	Very low	91 Å²	91	102.5 Å²	102.5	55%	0.552	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-53.9	157.6	157.2	-178.6	0	0	0	0	109.8
1305	G	31	Very low	35	Very low	25 Å²	25	100.8 Å²	100.8	26%	0.258	57%	0.567	S	S	.	*			trans	129.2	19.8	178.8	0	0	0	0	0	116.7	D1308 K1309	G1305-D1308 WeakPolarHBondContact CA-OD2 3.44Å; G1305-K1309 WeakPolarHBondContact O-CD 3.42Å
1306	R	37.9	Very low	36.3	Very low	233 Å²	233	100.5 Å²	100.5	88%	0.879	55%	0.554	S	S	*	*	S	Bend	trans	-98.1	-40.3	165.5	-77.9	-168.9	178.8	-175	1.2	113.1	L1310	R1306-L1310 PolarHBondContact O-N 2.89Å
1307	L	38.3	Very low	37.4	Very low	26 Å²	26	96 Å²	96	14%	0.136	52%	0.52	C	S	.	.	H	α-helix	trans	-81	-27.5	176.5	-145.5	81.1	0	0	0	113	D1170 M1172 K1309 L1310 K1311	D1170-L1307 HydrophobicContact CB-CD2 3.67Å; D1170-L1307 VanDerWaalsContact CG-CB 3.48Å; D1170-L1307 WeakPolarHBondContact O-CD2 3.25Å; D1170-L1307 WeakPolarHBondContact OD1-CB 3.36Å; D1170-L1307 VanDerWaalsContact OD1-CD2 3.24Å; D1170-L1307 WeakPolarHBondContact OD1-CD2 3.48Å; D1170-L1307 WeakPolarHBondContact OD2-CB 3.32Å; M1172-L1307 HydrophobicContact CG-CD1 3.84Å; M1172-L1307 HydrophobicContact CG-CD2 4.14Å; M1172-L1307 HydrophobicContact SD-CD1 3.65Å; L1307-K1309 PolarHBondContact O-N 3.1Å; L1307-L1310 HydrophobicContact CD1-CB 4Å; L1307-L1310 HydrophobicContact CD1-CD2 3.61Å; L1307-L1310 HydrophobicContact CD1-CG 4.41Å; L1307-L1310 HydrophobicContact CG-CB 4.23Å; L1307-L1310 HydrophobicContact CG-CD2 4.49Å; L1307-L1310 CarbonylContact O-C 3.44Å; L1307-L1310 WeakPolarHBondContact O-CA 3.3Å; L1307-L1310 PolarHBondContact O-N 3.03Å; L1307-K1311 HydrophobicContact CD2-CD 4.36Å; L1307-K1311 HydrophobicContact CD2-CG 4.38Å; L1307-K1311 HydrophobicContact CG-CG 4.41Å; L1307-K1311 WeakPolarHBondContact O-CB 3.19Å; L1307-K1311 PolarHBondContact O-N 3.05Å
1308	D	40.6	Very low	38.8	Very low	77 Å²	77	95.4 Å²	95.4	41%	0.412	51%	0.506	S	S	.	.	H	α-helix	trans	-59.9	-34.9	170.4	-51.8	-69.8	0	0	0	111.7	G1305 K1312	G1305-D1308 WeakPolarHBondContact CA-OD2 3.44Å; D1308-K1312 WeakPolarHBondContact O-CA 3.49Å; D1308-K1312 WeakPolarHBondContact O-CB 3.43Å; D1308-K1312 PolarHBondContact O-N 2.85Å
1309	K	44	Very low	40.6	Very low	159 Å²	159	95.7 Å²	95.7	69%	0.691	50%	0.5	S	S	*	.	H	α-helix	trans	-72.5	-28.6	172.5	-66.4	-178	-176.8	176.8	0	112.3	G1305 L1307 A1313	G1305-K1309 WeakPolarHBondContact O-CD 3.42Å; L1307-K1309 PolarHBondContact O-N 3.1Å; K1309-A1313 WeakPolarHBondContact O-CB 3.39Å; K1309-A1313 PolarHBondContact O-N 3.02Å; K1309-A1313 VanDerWaalsContact O-N 3.08Å
1310	L	42.5	Very low	41.9	Very low	47 Å²	47	88.9 Å²	88.9	25%	0.246	47%	0.465	C	S	.	.	H	α-helix	trans	-76.4	-53.2	172.1	-170.5	67	0	0	0	111.4	L1115 V1119 M1172 R1306 L1307 K1312 A1313 V1314	L1115-L1310 HydrophobicContact CD1-CD1 4.11Å; V1119-L1310 HydrophobicContact CG2-CD1 3.63Å; M1172-L1310 HydrophobicContact SD-CD2 4.5Å; R1306-L1310 PolarHBondContact O-N 2.89Å; L1307-L1310 HydrophobicContact CD1-CB 4Å; L1307-L1310 HydrophobicContact CD1-CD2 3.61Å; L1307-L1310 HydrophobicContact CD1-CG 4.41Å; L1307-L1310 HydrophobicContact CG-CB 4.23Å; L1307-L1310 HydrophobicContact CG-CD2 4.49Å; L1307-L1310 CarbonylContact O-C 3.44Å; L1307-L1310 WeakPolarHBondContact O-CA 3.3Å; L1307-L1310 PolarHBondContact O-N 3.03Å; L1310-K1312 PolarHBondContact O-N 2.79Å; L1310-A1313 CarbonylContact O-C 3.45Å; L1310-A1313 WeakPolarHBondContact O-CA 3.38Å; L1310-A1313 PolarHBondContact O-N 2.7Å; L1310-A1313 VanDerWaalsContact O-N 3.1Å; L1310-V1314 HydrophobicContact CD1-CG2 4.32Å; L1310-V1314 HydrophobicContact CG-CG2 4.17Å; L1310-V1314 VanDerWaalsContact O-CB 3.24Å; L1310-V1314 WeakPolarHBondContact O-CB 3.32Å; L1310-V1314 WeakPolarHBondContact O-CG2 3.29Å; L1310-V1314 PolarHBondContact O-N 2.98Å
1311	K	44.7	Very low	43.4	Very low	89 Å²	89	84.5 Å²	84.5	39%	0.387	43%	0.434	S	S	.	.	H	α-helix	trans	-53.2	-47.4	173.1	-76.2	166.4	165.7	165.3	0	112.1	E1169 D1170 L1307 V1314 S1315	E1169-K1311 PolarHBondContact O-NZ 3.03Å; D1170-K1311 IonicContact OD1-NZ 3.01Å; D1170-K1311 PolarHBondContact OD1-NZ 3.48Å; L1307-K1311 HydrophobicContact CD2-CD 4.36Å; L1307-K1311 HydrophobicContact CD2-CG 4.38Å; L1307-K1311 HydrophobicContact CG-CG 4.41Å; L1307-K1311 WeakPolarHBondContact O-CB 3.19Å; L1307-K1311 PolarHBondContact O-N 3.05Å; K1311-V1314 CarbonylContact O-C 3.55Å; K1311-V1314 PolarHBondContact O-N 3.2Å; K1311-S1315 WeakPolarHBondContact O-CB 3.29Å; K1311-S1315 PolarHBondContact O-N 3.04Å
1312	K	51.7	Low	45.2	Very low	135 Å²	135	82.7 Å²	82.7	59%	0.587	41%	0.413	S	S	*	.	H	α-helix	trans	-62.2	-47.8	173.3	178.2	166.7	173.9	165.9	0	110.7	D1308 L1310 V1314 S1315 E1316	D1308-K1312 WeakPolarHBondContact O-CA 3.49Å; D1308-K1312 WeakPolarHBondContact O-CB 3.43Å; D1308-K1312 PolarHBondContact O-N 2.85Å; L1310-K1312 PolarHBondContact O-N 2.79Å; K1312-V1314 PolarHBondContact O-N 2.87Å; K1312-S1315 PolarHBondContact O-N 3.42Å; K1312-E1316 WeakPolarHBondContact CE-OE1 2.99Å; K1312-E1316 HydrophobicContact CG-CG 4.3Å; K1312-E1316 IonicContact NZ-OE1 2.73Å; K1312-E1316 VanDerWaalsContact O-CB 3.31Å; K1312-E1316 WeakPolarHBondContact O-CB 3.39Å; K1312-E1316 VanDerWaalsContact O-CG 3.25Å; K1312-E1316 WeakPolarHBondContact O-CG 3.32Å; K1312-E1316 PolarHBondContact O-N 3.16Å
1313	A	45.2	Very low	47	Very low	18 Å²	18	75.4 Å²	75.4	15%	0.149	39%	0.389	C	S	.	.	H	α-helix	trans	-69	-20.3	178.5	0	0	0	0	0	113.7	L1115 K1309 L1310 F1317	L1115-A1313 HydrophobicContact CD1-CB 3.52Å; L1115-A1313 HydrophobicContact CD2-CB 3.58Å; L1115-A1313 WeakPolarHBondContact CD2-O 3.37Å; L1115-A1313 HydrophobicContact CG-CB 4.16Å; K1309-A1313 WeakPolarHBondContact O-CB 3.39Å; K1309-A1313 PolarHBondContact O-N 3.02Å; K1309-A1313 VanDerWaalsContact O-N 3.08Å; L1310-A1313 CarbonylContact O-C 3.45Å; L1310-A1313 WeakPolarHBondContact O-CA 3.38Å; L1310-A1313 PolarHBondContact O-N 2.7Å; L1310-A1313 VanDerWaalsContact O-N 3.1Å; A1313-F1317 WeakPolarHBondContact O-CB 3.21Å; A1313-F1317 PolarHBondContact O-N 3.19Å
1314	V	48	Very low	48.4	Very low	39 Å²	39	70.2 Å²	70.2	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-81.8	-35	172.3	166.6	0	0	0	0	111.3	L1310 K1311 K1312 F1317 E1318 L1455	L1310-V1314 HydrophobicContact CD1-CG2 4.32Å; L1310-V1314 HydrophobicContact CG-CG2 4.17Å; L1310-V1314 VanDerWaalsContact O-CB 3.24Å; L1310-V1314 WeakPolarHBondContact O-CB 3.32Å; L1310-V1314 WeakPolarHBondContact O-CG2 3.29Å; L1310-V1314 PolarHBondContact O-N 2.98Å; K1311-V1314 CarbonylContact O-C 3.55Å; K1311-V1314 PolarHBondContact O-N 3.2Å; K1312-V1314 PolarHBondContact O-N 2.87Å; V1314-F1317 VanDerWaalsContact C-CB 3.45Å; V1314-F1317 VanDerWaalsContact CA-CB 3.46Å; V1314-F1317 CarbonylContact O-C 3.58Å; V1314-F1317 WeakPolarHBondContact O-CA 3.3Å; V1314-F1317 WeakPolarHBondContact O-CB 3.48Å; V1314-F1317 PolarHBondContact O-N 3.32Å; V1314-E1318 WeakPolarHBondContact O-CG 3.49Å; V1314-E1318 PolarHBondContact O-N 2.88Å; V1314-L1455 HydrophobicContact CG1-CD1 4.01Å
1315	S	54.4	Low	50	Low	56 Å²	56	69.4 Å²	69.4	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-76	-41.3	171.4	-171.8	0	0	0	0	110.9	K1311 K1312 F1317 E1318 N1319	K1311-S1315 WeakPolarHBondContact O-CB 3.29Å; K1311-S1315 PolarHBondContact O-N 3.04Å; K1312-S1315 PolarHBondContact O-N 3.42Å; S1315-F1317 PolarHBondContact O-N 3.25Å; S1315-E1318 PolarHBondContact O-N 3.43Å; S1315-N1319 WeakPolarHBondContact O-CB 3.45Å; S1315-N1319 VanDerWaalsContact O-CG 3.3Å; S1315-N1319 PolarHBondContact O-N 3.16Å; S1315-N1319 PolarHBondContact O-ND2 2.85Å; S1315-N1319 PolarHBondContact OG-ND2 2.69Å
1316	E	52.2	Low	51.7	Low	102 Å²	102	71.2 Å²	71.2	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-57.3	-29.9	164.7	-71.7	170	173	0	0	111	K1312 L1320	K1312-E1316 WeakPolarHBondContact CE-OE1 2.99Å; K1312-E1316 HydrophobicContact CG-CG 4.3Å; K1312-E1316 IonicContact NZ-OE1 2.73Å; K1312-E1316 VanDerWaalsContact O-CB 3.31Å; K1312-E1316 WeakPolarHBondContact O-CB 3.39Å; K1312-E1316 VanDerWaalsContact O-CG 3.25Å; K1312-E1316 WeakPolarHBondContact O-CG 3.32Å; K1312-E1316 PolarHBondContact O-N 3.16Å; E1316-L1320 WeakPolarHBondContact O-CB 3.35Å; E1316-L1320 PolarHBondContact O-N 2.9Å
1317	F	49.6	Very low	52.8	Low	9 Å²	9	61 Å²	61	4%	0.039	31%	0.31	C	S	.	.	H	α-helix	trans	-68.3	-52	174.8	-141.8	-101.9	0	0	0	113.4	V1112 L1115 A1313 V1314 S1315 N1319 L1320 I1321 M1451	V1112-F1317 HydrophobicContact CB-CD2 4.37Å; V1112-F1317 HydrophobicContact CB-CE2 3.68Å; V1112-F1317 HydrophobicContact CB-CZ 4.33Å; V1112-F1317 HydrophobicContact CG1-CE2 3.49Å; V1112-F1317 VanDerWaalsContact CG1-CE2 3.49Å; V1112-F1317 HydrophobicContact CG1-CZ 3.64Å; V1112-F1317 HydrophobicContact CG2-CD2 3.52Å; V1112-F1317 HydrophobicContact CG2-CE2 3.31Å; V1112-F1317 HydrophobicContact CG2-CG 4.46Å; V1112-F1317 HydrophobicContact CG2-CZ 4.12Å; L1115-F1317 HydrophobicContact CD2-CD2 3.62Å; L1115-F1317 HydrophobicContact CD2-CE2 4.09Å; A1313-F1317 WeakPolarHBondContact O-CB 3.21Å; A1313-F1317 PolarHBondContact O-N 3.19Å; V1314-F1317 VanDerWaalsContact C-CB 3.45Å; V1314-F1317 VanDerWaalsContact CA-CB 3.46Å; V1314-F1317 CarbonylContact O-C 3.58Å; V1314-F1317 WeakPolarHBondContact O-CA 3.3Å; V1314-F1317 WeakPolarHBondContact O-CB 3.48Å; V1314-F1317 PolarHBondContact O-N 3.32Å; S1315-F1317 PolarHBondContact O-N 3.25Å; F1317-N1319 VanDerWaalsContact C-N 3.35Å; F1317-L1320 PolarHBondContact O-N 3.37Å; F1317-I1321 HydrophobicContact CD1-CD1 3.7Å; F1317-I1321 HydrophobicContact CD1-CG1 4.36Å; F1317-I1321 HydrophobicContact CE1-CD1 3.59Å; F1317-I1321 HydrophobicContact CE1-CG1 4.34Å; F1317-I1321 VanDerWaalsContact O-CB 3.23Å; F1317-I1321 WeakPolarHBondContact O-CB 3.32Å; F1317-I1321 WeakPolarHBondContact O-CG1 3.36Å; F1317-I1321 PolarHBondContact O-N 2.89Å; F1317-M1451 HydrophobicContact CE1-CB 3.6Å; F1317-M1451 HydrophobicContact CE1-CE 3.69Å; F1317-M1451 HydrophobicContact CE1-CG 4.39Å; F1317-M1451 HydrophobicContact CE1-SD 4.4Å; F1317-M1451 HydrophobicContact CE2-CE 4Å; F1317-M1451 HydrophobicContact CE2-SD 4.26Å; F1317-M1451 HydrophobicContact CZ-CB 3.59Å; F1317-M1451 HydrophobicContact CZ-CE 3.14Å; F1317-M1451 HydrophobicContact CZ-CG 3.87Å; F1317-M1451 HydrophobicContact CZ-SD 3.5Å; F1317-M1451 WeakPolarHBondContact CZ-SD 3.3Å
1318	E	56.2	Low	53.8	Low	97 Å²	97	61.8 Å²	61.8	45%	0.453	32%	0.315	S	S	.	.	H	α-helix	trans	-67.5	-39.9	179.6	-71.5	169.4	153.5	0	0	110.2	V1314 S1315 I1321 E1322 L1455	V1314-E1318 WeakPolarHBondContact O-CG 3.49Å; V1314-E1318 PolarHBondContact O-N 2.88Å; S1315-E1318 PolarHBondContact O-N 3.43Å; E1318-I1321 PolarHBondContact O-N 3.39Å; E1318-E1322 WeakPolarHBondContact O-CB 3.36Å; E1318-E1322 PolarHBondContact O-N 3.34Å; E1318-L1455 HydrophobicContact CG-CD2 4.2Å
1319	N	60.8	Low	54.9	Low	99 Å²	99	64.8 Å²	64.8	53%	0.529	32%	0.324	S	S	.	.	H	α-helix	trans	-66	-38.2	172.7	-74.2	-60.2	0	0	0	112.4	S1315 F1317 S1323	S1315-N1319 WeakPolarHBondContact O-CB 3.45Å; S1315-N1319 VanDerWaalsContact O-CG 3.3Å; S1315-N1319 PolarHBondContact O-N 3.16Å; S1315-N1319 PolarHBondContact O-ND2 2.85Å; S1315-N1319 PolarHBondContact OG-ND2 2.69Å; F1317-N1319 VanDerWaalsContact C-N 3.35Å; N1319-S1323 VanDerWaalsContact O-CB 3.31Å; N1319-S1323 WeakPolarHBondContact O-CB 3.46Å; N1319-S1323 PolarHBondContact O-N 3.03Å; N1319-S1323 PolarHBondContact O-OG 3.39Å
1320	L	51.9	Low	55.8	Low	15 Å²	15	61.2 Å²	61.2	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-71.2	-41.6	171.7	-178	64.2	0	0	0	111.3	T1108 V1112 E1316 F1317 E1322 S1323 C1324	T1108-L1320 HydrophobicContact CG2-CB 4.47Å; T1108-L1320 HydrophobicContact CG2-CD1 3.89Å; T1108-L1320 HydrophobicContact CG2-CD2 3.8Å; T1108-L1320 HydrophobicContact CG2-CG 4.24Å; V1112-L1320 HydrophobicContact CB-CD2 4.07Å; V1112-L1320 HydrophobicContact CG2-CD2 3.43Å; V1112-L1320 VanDerWaalsContact CG2-CD2 3.43Å; E1316-L1320 WeakPolarHBondContact O-CB 3.35Å; E1316-L1320 PolarHBondContact O-N 2.9Å; F1317-L1320 PolarHBondContact O-N 3.37Å; L1320-E1322 PolarHBondContact O-N 3.32Å; L1320-S1323 CarbonylContact O-C 3.54Å; L1320-S1323 WeakPolarHBondContact O-CB 3.37Å; L1320-S1323 PolarHBondContact O-N 3.23Å; L1320-S1323 VanDerWaalsContact O-N 3.11Å; L1320-C1324 WeakPolarHBondContact O-CB 3.28Å; L1320-C1324 PolarHBondContact O-N 3.41Å; L1320-C1324 PolarHBondContact O-SG 3.45Å; L1320-C1324 VanDerWaalsContact O-SG 3.37Å
1321	I	55	Low	56.7	Low	14 Å²	14	59.2 Å²	59.2	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-41.4	175.6	-84	-178.6	0	0	0	109.5	F1317 E1318 C1324 K1325 T1448 M1451	F1317-I1321 HydrophobicContact CD1-CD1 3.7Å; F1317-I1321 HydrophobicContact CD1-CG1 4.36Å; F1317-I1321 HydrophobicContact CE1-CD1 3.59Å; F1317-I1321 HydrophobicContact CE1-CG1 4.34Å; F1317-I1321 VanDerWaalsContact O-CB 3.23Å; F1317-I1321 WeakPolarHBondContact O-CB 3.32Å; F1317-I1321 WeakPolarHBondContact O-CG1 3.36Å; F1317-I1321 PolarHBondContact O-N 2.89Å; E1318-I1321 PolarHBondContact O-N 3.39Å; I1321-C1324 PolarHBondContact O-N 2.88Å; I1321-K1325 HydrophobicContact CG2-CD 3.74Å; I1321-K1325 VanDerWaalsContact CG2-CE 3.4Å; I1321-K1325 HydrophobicContact CG2-CG 4.41Å; I1321-K1325 VanDerWaalsContact CG2-NZ 3.31Å; I1321-K1325 VanDerWaalsContact O-CB 3.27Å; I1321-K1325 WeakPolarHBondContact O-CB 3.16Å; I1321-K1325 WeakPolarHBondContact O-CD 3.48Å; I1321-K1325 WeakPolarHBondContact O-CG 3.27Å; I1321-K1325 PolarHBondContact O-N 2.76Å; I1321-T1448 HydrophobicContact CG1-CG2 4.25Å; I1321-T1448 HydrophobicContact CG2-CG2 4.03Å; I1321-M1451 HydrophobicContact CD1-CB 4.25Å
1322	E	64.8	Low	57.1	Low	73 Å²	73	58.9 Å²	58.9	34%	0.341	31%	0.307	S	S	.	.	H	α-helix	trans	-77.3	-26.6	176.2	-160.7	53.1	-137.6	0	0	112.7	E1318 L1320 K1325 T1326 K1329	E1318-E1322 WeakPolarHBondContact O-CB 3.36Å; E1318-E1322 PolarHBondContact O-N 3.34Å; L1320-E1322 PolarHBondContact O-N 3.32Å; E1322-K1325 WeakPolarHBondContact OE2-CD 3.16Å; E1322-T1326 VanDerWaalsContact O-CB 3.31Å; E1322-T1326 WeakPolarHBondContact O-CB 3.27Å; E1322-T1326 VanDerWaalsContact O-CG2 3.28Å; E1322-T1326 WeakPolarHBondContact O-CG2 3.35Å; E1322-T1326 PolarHBondContact O-N 2.96Å; E1322-T1326 PolarHBondContact O-OG1 3.03Å; E1322-K1329 IonicContact OE1-NZ 2.8Å; E1322-K1329 PolarHBondContact OE1-NZ 3.49Å; E1322-K1329 IonicContact OE2-NZ 3.55Å
1323	S	61.7	Low	57.4	Low	66 Å²	66	57 Å²	57	46%	0.462	30%	0.297	S	S	.	.	H	α-helix	trans	-67.3	-40.3	168.2	-60.7	0	0	0	0	112.2	N1319 L1320 T1326 L1327	N1319-S1323 VanDerWaalsContact O-CB 3.31Å; N1319-S1323 WeakPolarHBondContact O-CB 3.46Å; N1319-S1323 PolarHBondContact O-N 3.03Å; N1319-S1323 PolarHBondContact O-OG 3.39Å; L1320-S1323 CarbonylContact O-C 3.54Å; L1320-S1323 WeakPolarHBondContact O-CB 3.37Å; L1320-S1323 PolarHBondContact O-N 3.23Å; L1320-S1323 VanDerWaalsContact O-N 3.11Å; S1323-T1326 WeakPolarHBondContact CA-OG1 3.19Å; S1323-T1326 PolarHBondContact O-OG1 2.82Å; S1323-T1326 VanDerWaalsContact O-OG1 3.06Å; S1323-L1327 WeakPolarHBondContact O-CB 3.22Å; S1323-L1327 PolarHBondContact O-N 3.14Å
1324	C	57.4	Low	58	Low	4 Å²	4	56.4 Å²	56.4	3%	0.027	29%	0.291	C	S	.	.	H	α-helix	trans	-69.1	-46.4	173.2	-72.3	0	0	0	0	110.4	L1320 I1321 T1326 L1327 I1328	L1320-C1324 WeakPolarHBondContact O-CB 3.28Å; L1320-C1324 PolarHBondContact O-N 3.41Å; L1320-C1324 PolarHBondContact O-SG 3.45Å; L1320-C1324 VanDerWaalsContact O-SG 3.37Å; I1321-C1324 PolarHBondContact O-N 2.88Å; C1324-T1326 VanDerWaalsContact C-N 3.34Å; C1324-T1326 PolarHBondContact O-N 3.13Å; C1324-L1327 CarbonylContact O-C 3.58Å; C1324-L1327 PolarHBondContact O-N 3.27Å; C1324-I1328 WeakPolarHBondContact O-CB 3.43Å; C1324-I1328 WeakPolarHBondContact O-CD1 3.47Å; C1324-I1328 WeakPolarHBondContact O-CG1 3.34Å; C1324-I1328 PolarHBondContact O-N 3.31Å
1325	K	61.9	Low	58.4	Low	75 Å²	75	57.4 Å²	57.4	33%	0.326	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-37.9	174.6	-74.7	164.9	175.8	170	0	111.8	I1321 E1322 I1328 K1329 T1448	I1321-K1325 HydrophobicContact CG2-CD 3.74Å; I1321-K1325 VanDerWaalsContact CG2-CE 3.4Å; I1321-K1325 HydrophobicContact CG2-CG 4.41Å; I1321-K1325 VanDerWaalsContact CG2-NZ 3.31Å; I1321-K1325 VanDerWaalsContact O-CB 3.27Å; I1321-K1325 WeakPolarHBondContact O-CB 3.16Å; I1321-K1325 WeakPolarHBondContact O-CD 3.48Å; I1321-K1325 WeakPolarHBondContact O-CG 3.27Å; I1321-K1325 PolarHBondContact O-N 2.76Å; E1322-K1325 WeakPolarHBondContact OE2-CD 3.16Å; K1325-I1328 PolarHBondContact O-N 2.67Å; K1325-K1329 VanDerWaalsContact O-CB 3.24Å; K1325-K1329 WeakPolarHBondContact O-CB 3.24Å; K1325-K1329 WeakPolarHBondContact O-CD 3.46Å; K1325-K1329 WeakPolarHBondContact O-CG 3.45Å; K1325-K1329 PolarHBondContact O-N 3.45Å; K1325-T1448 HydrophobicContact CG-CG2 4.2Å
1326	T	66.7	Low	58.6	Low	63 Å²	63	57.8 Å²	57.8	39%	0.387	29%	0.291	S	S	.	.	H	α-helix	trans	-70	-38.4	175.1	46.6	0	0	0	0	111.8	E1322 S1323 C1324 I1328 K1329 Q1330	E1322-T1326 VanDerWaalsContact O-CB 3.31Å; E1322-T1326 WeakPolarHBondContact O-CB 3.27Å; E1322-T1326 VanDerWaalsContact O-CG2 3.28Å; E1322-T1326 WeakPolarHBondContact O-CG2 3.35Å; E1322-T1326 PolarHBondContact O-N 2.96Å; E1322-T1326 PolarHBondContact O-OG1 3.03Å; S1323-T1326 WeakPolarHBondContact CA-OG1 3.19Å; S1323-T1326 PolarHBondContact O-OG1 2.82Å; S1323-T1326 VanDerWaalsContact O-OG1 3.06Å; C1324-T1326 VanDerWaalsContact C-N 3.34Å; C1324-T1326 PolarHBondContact O-N 3.13Å; T1326-I1328 VanDerWaalsContact C-N 3.35Å; T1326-K1329 PolarHBondContact O-N 3.08Å; T1326-Q1330 WeakPolarHBondContact O-CB 3.49Å; T1326-Q1330 WeakPolarHBondContact O-CG 2.92Å; T1326-Q1330 PolarHBondContact O-N 3.23Å
1327	L	61.2	Low	58.8	Low	17 Å²	17	55.5 Å²	55.5	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-37.7	170	-176	61.7	0	0	0	112.4	I1101 F1102 S1323 C1324 Q1330 G1331 L1334 L1441 L1444	I1101-L1327 HydrophobicContact CG2-CD1 3.81Å; I1101-L1327 HydrophobicContact CG2-CD2 3.85Å; F1102-L1327 HydrophobicContact CD1-CD2 4.42Å; F1102-L1327 HydrophobicContact CE1-CD2 4.1Å; S1323-L1327 WeakPolarHBondContact O-CB 3.22Å; S1323-L1327 PolarHBondContact O-N 3.14Å; C1324-L1327 CarbonylContact O-C 3.58Å; C1324-L1327 PolarHBondContact O-N 3.27Å; L1327-Q1330 CarbonylContact O-C 3.49Å; L1327-Q1330 PolarHBondContact O-N 3.28Å; L1327-G1331 PolarHBondContact O-N 2.68Å; L1327-L1334 HydrophobicContact CD1-CD1 3.89Å; L1327-L1441 HydrophobicContact CG-CD2 4.38Å; L1327-L1444 HydrophobicContact CD2-CD1 4.11Å
1328	I	60	Low	59.4	Low	44 Å²	44	55.3 Å²	55.3	23%	0.226	28%	0.279	C	S	.	.	H	α-helix	trans	-72.7	-39	176.7	-68.3	159.2	0	0	0	111.4	C1324 K1325 T1326 Q1330 G1331 P1332 L1441 L1444 T1445	C1324-I1328 WeakPolarHBondContact O-CB 3.43Å; C1324-I1328 WeakPolarHBondContact O-CD1 3.47Å; C1324-I1328 WeakPolarHBondContact O-CG1 3.34Å; C1324-I1328 PolarHBondContact O-N 3.31Å; K1325-I1328 PolarHBondContact O-N 2.67Å; T1326-I1328 VanDerWaalsContact C-N 3.35Å; I1328-Q1330 VanDerWaalsContact C-N 3.28Å; I1328-Q1330 PolarHBondContact O-N 3.1Å; I1328-G1331 WeakPolarHBondContact O-CA 3.36Å; I1328-G1331 PolarHBondContact O-N 2.9Å; I1328-P1332 WeakPolarHBondContact O-CD 3.2Å; I1328-L1441 HydrophobicContact CG1-CD2 4.2Å; I1328-L1444 HydrophobicContact CD1-CB 4.22Å; I1328-T1445 WeakPolarHBondContact CD1-OG1 3.49Å
1329	K	63.5	Low	59.5	Low	140 Å²	140	52 Å²	52	61%	0.609	26%	0.263	S	S	*	.	H	α-helix	trans	-62.9	-34.4	170.1	-73.3	161.4	-175.2	175.6	0	111.4	E1322 K1325 T1326 G1331	E1322-K1329 IonicContact OE1-NZ 2.8Å; E1322-K1329 PolarHBondContact OE1-NZ 3.49Å; E1322-K1329 IonicContact OE2-NZ 3.55Å; K1325-K1329 VanDerWaalsContact O-CB 3.24Å; K1325-K1329 WeakPolarHBondContact O-CB 3.24Å; K1325-K1329 WeakPolarHBondContact O-CD 3.46Å; K1325-K1329 WeakPolarHBondContact O-CG 3.45Å; K1325-K1329 PolarHBondContact O-N 3.45Å; T1326-K1329 PolarHBondContact O-N 3.08Å; K1329-G1331 VanDerWaalsContact C-N 3.32Å
1330	Q	63.7	Low	59.4	Low	83 Å²	83	52.3 Å²	52.3	39%	0.388	26%	0.261	S	S	.	.	H	α-helix	trans	-76.4	-17.3	168.2	-72.3	-178.2	12	0	0	112.8	T1326 L1327 I1328 Y1333 L1334	T1326-Q1330 WeakPolarHBondContact O-CB 3.49Å; T1326-Q1330 WeakPolarHBondContact O-CG 2.92Å; T1326-Q1330 PolarHBondContact O-N 3.23Å; L1327-Q1330 CarbonylContact O-C 3.49Å; L1327-Q1330 PolarHBondContact O-N 3.28Å; I1328-Q1330 VanDerWaalsContact C-N 3.28Å; I1328-Q1330 PolarHBondContact O-N 3.1Å; Q1330-Y1333 CarbonylContact O-C 3.51Å; Q1330-Y1333 WeakPolarHBondContact O-CA 3.24Å; Q1330-Y1333 WeakPolarHBondContact O-CB 3.02Å; Q1330-Y1333 PolarHBondContact O-N 2.66Å; Q1330-L1334 HydrophobicContact CB-CD1 4.17Å; Q1330-L1334 HydrophobicContact CB-CG 4.32Å; Q1330-L1334 WeakPolarHBondContact O-CG 3.22Å; Q1330-L1334 PolarHBondContact O-N 2.73Å
1331	G	59.7	Low	59.6	Low	5 Å²	5	52.9 Å²	52.9	5%	0.052	27%	0.265	C	S	.	.	H	α-helix	trans	-49.4	-49.4	-178.7	0	0	0	0	0	114.1	L1327 I1328 K1329 Y1333 L1334 R1335	L1327-G1331 PolarHBondContact O-N 2.68Å; I1328-G1331 WeakPolarHBondContact O-CA 3.36Å; I1328-G1331 PolarHBondContact O-N 2.9Å; K1329-G1331 VanDerWaalsContact C-N 3.32Å; G1331-Y1333 PolarHBondContact O-N 3.23Å; G1331-L1334 PolarHBondContact O-N 3.25Å; G1331-R1335 WeakPolarHBondContact O-CB 3.39Å; G1331-R1335 PolarHBondContact O-N 3.08Å
1332	P	54.8	Low	59.6	Low	82 Å²	82	53 Å²	53	53%	0.532	27%	0.266	S	S	.	.	H	α-helix	trans	-58.2	-43.2	171.2	-27.7	35.8	0	0	0	113.7	I1328 R1335 V1336	I1328-P1332 WeakPolarHBondContact O-CD 3.2Å; P1332-R1335 PolarHBondContact O-N 3.33Å; P1332-V1336 VanDerWaalsContact O-CB 3.3Å; P1332-V1336 WeakPolarHBondContact O-CB 3.38Å; P1332-V1336 VanDerWaalsContact O-CG2 3.23Å; P1332-V1336 WeakPolarHBondContact O-CG2 3.46Å; P1332-V1336 PolarHBondContact O-N 2.99Å
1333	Y	57.2	Low	59.2	Low	97 Å²	97	52.9 Å²	52.9	38%	0.38	26%	0.262	S	S	.	.	H	α-helix	trans	-67.1	-38.1	176.8	168.4	-111.4	0	0	0	112.5	Q1330 G1331 V1336 K1337	Q1330-Y1333 CarbonylContact O-C 3.51Å; Q1330-Y1333 WeakPolarHBondContact O-CA 3.24Å; Q1330-Y1333 WeakPolarHBondContact O-CB 3.02Å; Q1330-Y1333 PolarHBondContact O-N 2.66Å; G1331-Y1333 PolarHBondContact O-N 3.23Å; Y1333-V1336 PolarHBondContact O-N 3.28Å; Y1333-K1337 HydrophobicContact CE1-CD 4.3Å; Y1333-K1337 HydrophobicContact CE2-CD 3.95Å; Y1333-K1337 HydrophobicContact CE2-CG 4.18Å; Y1333-K1337 WeakPolarHBondContact O-CB 3.04Å; Y1333-K1337 PolarHBondContact O-N 2.86Å; Y1333-K1337 VanDerWaalsContact OH-CE 3.29Å; Y1333-K1337 WeakPolarHBondContact OH-CE 3.2Å; Y1333-K1337 PolarHBondContact OH-NZ 3.04Å
1334	L	57.5	Low	59	Low	4 Å²	4	53.9 Å²	53.9	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-42.7	175.1	-66.3	171.1	0	0	0	111.2	F1098 L1327 Q1330 G1331 K1337 L1338 F1392	F1098-L1334 HydrophobicContact CE1-CB 4.15Å; F1098-L1334 HydrophobicContact CE1-CD1 4.31Å; F1098-L1334 HydrophobicContact CE1-CD2 4.01Å; F1098-L1334 HydrophobicContact CE1-CG 4.37Å; F1098-L1334 HydrophobicContact CZ-CB 4.42Å; F1098-L1334 HydrophobicContact CZ-CD2 4.34Å; L1327-L1334 HydrophobicContact CD1-CD1 3.89Å; Q1330-L1334 HydrophobicContact CB-CD1 4.17Å; Q1330-L1334 HydrophobicContact CB-CG 4.32Å; Q1330-L1334 WeakPolarHBondContact O-CG 3.22Å; Q1330-L1334 PolarHBondContact O-N 2.73Å; G1331-L1334 PolarHBondContact O-N 3.25Å; L1334-K1337 PolarHBondContact O-N 2.62Å; L1334-L1338 WeakPolarHBondContact O-CB 3.5Å; L1334-L1338 PolarHBondContact O-N 2.87Å; L1334-F1392 HydrophobicContact CD2-CE1 3.99Å
1335	R	57.4	Low	58.6	Low	61 Å²	61	54.3 Å²	54.3	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-41.6	172.7	-172.9	-176.1	-76.9	173.8	-0.4	111	E822 G1331 P1332 L1338 Q1339 T1438	E822-R1335 IonicContact OE1-NH1 2.8Å; G1331-R1335 WeakPolarHBondContact O-CB 3.39Å; G1331-R1335 PolarHBondContact O-N 3.08Å; P1332-R1335 PolarHBondContact O-N 3.33Å; R1335-L1338 PolarHBondContact O-N 3.05Å; R1335-Q1339 WeakPolarHBondContact O-CB 3.42Å; R1335-Q1339 WeakPolarHBondContact O-CG 3.45Å; R1335-Q1339 PolarHBondContact O-N 3.25Å; R1335-T1438 PolarHBondContact NH2-OG1 3.37Å
1336	V	57.8	Low	58.1	Low	64 Å²	64	52.1 Å²	52.1	39%	0.388	26%	0.261	S	S	.	.	H	α-helix	trans	-67.3	-39.9	176	166.8	0	0	0	0	111.9	P1332 Y1333 Q1339 Q1340	P1332-V1336 VanDerWaalsContact O-CB 3.3Å; P1332-V1336 WeakPolarHBondContact O-CB 3.38Å; P1332-V1336 VanDerWaalsContact O-CG2 3.23Å; P1332-V1336 WeakPolarHBondContact O-CG2 3.46Å; P1332-V1336 PolarHBondContact O-N 2.99Å; Y1333-V1336 PolarHBondContact O-N 3.28Å; V1336-Q1339 PolarHBondContact O-N 3.1Å; V1336-Q1340 HydrophobicContact CG1-CG 4.4Å; V1336-Q1340 WeakPolarHBondContact O-CB 3.39Å; V1336-Q1340 VanDerWaalsContact O-CG 3.28Å; V1336-Q1340 WeakPolarHBondContact O-CG 3.01Å; V1336-Q1340 PolarHBondContact O-N 2.74Å
1337	K	57.3	Low	57.5	Low	53 Å²	53	52.5 Å²	52.5	23%	0.23	26%	0.261	C	S	.	.	H	α-helix	trans	-68	-34.8	173.2	-92.9	-168.4	166.2	176.6	0	112.2	Y1333 L1334 Q1340 T1341	Y1333-K1337 HydrophobicContact CE1-CD 4.3Å; Y1333-K1337 HydrophobicContact CE2-CD 3.95Å; Y1333-K1337 HydrophobicContact CE2-CG 4.18Å; Y1333-K1337 WeakPolarHBondContact O-CB 3.04Å; Y1333-K1337 PolarHBondContact O-N 2.86Å; Y1333-K1337 VanDerWaalsContact OH-CE 3.29Å; Y1333-K1337 WeakPolarHBondContact OH-CE 3.2Å; Y1333-K1337 PolarHBondContact OH-NZ 3.04Å; L1334-K1337 PolarHBondContact O-N 2.62Å; K1337-Q1340 PolarHBondContact O-N 2.81Å; K1337-T1341 WeakPolarHBondContact O-CB 3.24Å; K1337-T1341 PolarHBondContact O-N 3.42Å; K1337-T1341 PolarHBondContact O-OG1 3.39Å
1338	L	60.7	Low	57.1	Low	6 Å²	6	53.7 Å²	53.7	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-45.9	171.4	-170.7	68.4	0	0	0	111.1	L1334 R1335 Q1340 T1341 Q1342 M1430 V1433 A1434	L1334-L1338 WeakPolarHBondContact O-CB 3.5Å; L1334-L1338 PolarHBondContact O-N 2.87Å; R1335-L1338 PolarHBondContact O-N 3.05Å; L1338-Q1340 PolarHBondContact O-N 3.19Å; L1338-T1341 PolarHBondContact O-N 2.95Å; L1338-T1341 VanDerWaalsContact O-N 3.14Å; L1338-Q1342 WeakPolarHBondContact O-CB 3.48Å; L1338-Q1342 WeakPolarHBondContact O-CG 3.43Å; L1338-Q1342 PolarHBondContact O-N 3.27Å; L1338-M1430 HydrophobicContact CD1-SD 4.48Å; L1338-V1433 HydrophobicContact CD1-CG1 3.83Å; L1338-V1433 HydrophobicContact CD2-CG1 4.05Å; L1338-A1434 VanDerWaalsContact CD2-CA 3.49Å; L1338-A1434 HydrophobicContact CD2-CB 3.58Å
1339	Q	57.9	Low	56.5	Low	28 Å²	28	54.7 Å²	54.7	13%	0.131	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-38.4	174	-77.8	-178.2	-14.3	0	0	112.9	S852 R1335 V1336 T1341 Q1342 R1343	S852-Q1339 PolarHBondContact OG-OE1 3.19Å; R1335-Q1339 WeakPolarHBondContact O-CB 3.42Å; R1335-Q1339 WeakPolarHBondContact O-CG 3.45Å; R1335-Q1339 PolarHBondContact O-N 3.25Å; V1336-Q1339 PolarHBondContact O-N 3.1Å; Q1339-T1341 VanDerWaalsContact C-N 3.33Å; Q1339-Q1342 PolarHBondContact O-N 3.27Å; Q1339-R1343 WeakPolarHBondContact O-CB 3.44Å; Q1339-R1343 PolarHBondContact O-N 3.19Å
1340	Q	58.9	Low	55.8	Low	105 Å²	105	49.9 Å²	49.9	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-39.8	172.2	-78.2	174.9	-18.1	0	0	111.1	V1336 K1337 L1338 R1343 T1344	V1336-Q1340 HydrophobicContact CG1-CG 4.4Å; V1336-Q1340 WeakPolarHBondContact O-CB 3.39Å; V1336-Q1340 VanDerWaalsContact O-CG 3.28Å; V1336-Q1340 WeakPolarHBondContact O-CG 3.01Å; V1336-Q1340 PolarHBondContact O-N 2.74Å; K1337-Q1340 PolarHBondContact O-N 2.81Å; L1338-Q1340 PolarHBondContact O-N 3.19Å; Q1340-R1343 PolarHBondContact O-N 3.2Å; Q1340-T1344 PolarHBondContact O-N 3.08Å; Q1340-T1344 PolarHBondContact O-OG1 3.33Å
1341	T	56	Low	55.5	Low	26 Å²	26	50.1 Å²	50.1	16%	0.16	26%	0.264	C	S	.	.	H	α-helix	trans	-72.1	-39.3	178.5	-47.8	0	0	0	0	111.6	K1337 L1338 Q1339 R1343 A1345 I1399	K1337-T1341 WeakPolarHBondContact O-CB 3.24Å; K1337-T1341 PolarHBondContact O-N 3.42Å; K1337-T1341 PolarHBondContact O-OG1 3.39Å; L1338-T1341 PolarHBondContact O-N 2.95Å; L1338-T1341 VanDerWaalsContact O-N 3.14Å; Q1339-T1341 VanDerWaalsContact C-N 3.33Å; T1341-R1343 VanDerWaalsContact C-N 3.32Å; T1341-A1345 WeakPolarHBondContact O-CB 3.48Å; T1341-A1345 PolarHBondContact O-N 2.73Å; T1341-I1399 HydrophobicContact CG2-CB 4.04Å; T1341-I1399 HydrophobicContact CG2-CD1 4.07Å; T1341-I1399 HydrophobicContact CG2-CG2 3.5Å
1342	Q	55.9	Low	55.3	Low	18 Å²	18	53.6 Å²	53.6	8%	0.084	28%	0.278	C	S	.	.	H	α-helix	trans	-55.8	-46.1	167	-77.4	166.7	-28.8	0	0	110.8	L1338 Q1339 A1345 L1346 M1430	L1338-Q1342 WeakPolarHBondContact O-CB 3.48Å; L1338-Q1342 WeakPolarHBondContact O-CG 3.43Å; L1338-Q1342 PolarHBondContact O-N 3.27Å; Q1339-Q1342 PolarHBondContact O-N 3.27Å; Q1342-A1345 PolarHBondContact O-N 3.19Å; Q1342-L1346 WeakPolarHBondContact O-CB 3.32Å; Q1342-L1346 PolarHBondContact O-N 3.16Å; Q1342-M1430 HydrophobicContact CG-CG 3.49Å; Q1342-M1430 VanDerWaalsContact CG-CG 3.49Å; Q1342-M1430 PolarHBondContact NE2-O 3.2Å
1343	R	55.4	Low	54.8	Low	69 Å²	69	52.7 Å²	52.7	26%	0.26	27%	0.268	S	S	.	.	H	α-helix	trans	-68.1	-42.7	-179.7	-164.1	178.1	-167.8	174.9	9	112.7	Q1339 Q1340 T1341 A1345 L1346 D1347	Q1339-R1343 WeakPolarHBondContact O-CB 3.44Å; Q1339-R1343 PolarHBondContact O-N 3.19Å; Q1340-R1343 PolarHBondContact O-N 3.2Å; T1341-R1343 VanDerWaalsContact C-N 3.32Å; R1343-A1345 VanDerWaalsContact C-N 3.27Å; R1343-A1345 PolarHBondContact O-N 3.39Å; R1343-L1346 CarbonylContact O-C 3.56Å; R1343-L1346 WeakPolarHBondContact O-CA 3.49Å; R1343-L1346 WeakPolarHBondContact O-CB 3.32Å; R1343-L1346 PolarHBondContact O-N 3.14Å; R1343-D1347 WeakPolarHBondContact O-CB 3.28Å; R1343-D1347 PolarHBondContact O-N 3.24Å
1344	T	58	Low	54.5	Low	87 Å²	87	54.6 Å²	54.6	53%	0.534	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-35.8	173.3	-56.4	0	0	0	0	111.8	Q1340 A1348	Q1340-T1344 PolarHBondContact O-N 3.08Å; Q1340-T1344 PolarHBondContact O-OG1 3.33Å; T1344-A1348 VanDerWaalsContact O-CB 3.31Å; T1344-A1348 WeakPolarHBondContact O-CB 3.31Å; T1344-A1348 PolarHBondContact O-N 3.16Å
1345	A	49.9	Very low	54.1	Low	14 Å²	14	56 Å²	56	12%	0.116	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-35.6	171.5	0	0	0	0	0	112.4	T1341 Q1342 R1343 Y1349 Y1426 W1427	T1341-A1345 WeakPolarHBondContact O-CB 3.48Å; T1341-A1345 PolarHBondContact O-N 2.73Å; Q1342-A1345 PolarHBondContact O-N 3.19Å; R1343-A1345 VanDerWaalsContact C-N 3.27Å; R1343-A1345 PolarHBondContact O-N 3.39Å; A1345-Y1349 VanDerWaalsContact O-CB 3.32Å; A1345-Y1349 WeakPolarHBondContact O-CB 3.42Å; A1345-Y1349 PolarHBondContact O-N 2.98Å; A1345-Y1426 HydrophobicContact CB-CE1 4.38Å; A1345-W1427 HydrophobicContact CB-CH2 4.25Å
1346	L	50.6	Low	53.4	Low	28 Å²	28	57 Å²	57	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-68.4	-47	176.3	-173.7	63.9	0	0	0	111.1	Q1342 R1343 A1348 Y1349 T1350 W1427	Q1342-L1346 WeakPolarHBondContact O-CB 3.32Å; Q1342-L1346 PolarHBondContact O-N 3.16Å; R1343-L1346 CarbonylContact O-C 3.56Å; R1343-L1346 WeakPolarHBondContact O-CA 3.49Å; R1343-L1346 WeakPolarHBondContact O-CB 3.32Å; R1343-L1346 PolarHBondContact O-N 3.14Å; L1346-A1348 VanDerWaalsContact C-N 3.32Å; L1346-A1348 PolarHBondContact O-N 2.99Å; L1346-Y1349 CarbonylContact O-C 3.53Å; L1346-Y1349 WeakPolarHBondContact O-CA 3.41Å; L1346-Y1349 WeakPolarHBondContact O-CB 3.44Å; L1346-Y1349 PolarHBondContact O-N 3.31Å; L1346-T1350 HydrophobicContact CD1-CG2 4.48Å; L1346-T1350 HydrophobicContact CG-CG2 4.49Å; L1346-T1350 PolarHBondContact O-N 2.8Å; L1346-T1350 PolarHBondContact O-OG1 2.66Å; L1346-W1427 HydrophobicContact CB-CH2 3.71Å; L1346-W1427 HydrophobicContact CB-CZ2 4.13Å; L1346-W1427 HydrophobicContact CD1-CH2 4Å; L1346-W1427 HydrophobicContact CD1-CZ2 3.67Å; L1346-W1427 HydrophobicContact CG-CH2 4.45Å
1347	D	53.7	Low	52.8	Low	71 Å²	71	62 Å²	62	38%	0.38	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-37.3	178.2	-64.5	-26.4	0	0	0	111.1	R1343 T1350 T1351	R1343-D1347 WeakPolarHBondContact O-CB 3.28Å; R1343-D1347 PolarHBondContact O-N 3.24Å; D1347-T1350 WeakPolarHBondContact CA-OG1 3.46Å; D1347-T1350 PolarHBondContact O-OG1 2.7Å; D1347-T1351 VanDerWaalsContact O-CB 3.22Å; D1347-T1351 WeakPolarHBondContact O-CB 3.45Å; D1347-T1351 PolarHBondContact O-N 2.92Å; D1347-T1351 PolarHBondContact O-OG1 3.49Å
1348	A	53.6	Low	52.3	Low	42 Å²	42	62.2 Å²	62.2	35%	0.347	33%	0.333	S	S	.	.	H	α-helix	trans	-66.4	-37.8	171.4	0	0	0	0	0	112.4	T1344 L1346 F1352	T1344-A1348 VanDerWaalsContact O-CB 3.31Å; T1344-A1348 WeakPolarHBondContact O-CB 3.31Å; T1344-A1348 PolarHBondContact O-N 3.16Å; L1346-A1348 VanDerWaalsContact C-N 3.32Å; L1346-A1348 PolarHBondContact O-N 2.99Å; A1348-F1352 WeakPolarHBondContact O-CB 3.48Å; A1348-F1352 PolarHBondContact O-N 2.76Å
1349	Y	46.6	Very low	51.2	Low	65 Å²	65	68.5 Å²	68.5	26%	0.255	38%	0.375	S	S	.	.	H	α-helix	trans	-73.7	-39.7	178.1	175.9	-109.8	0	0	0	113	A1345 L1346 F1352 L1353 T1423	A1345-Y1349 VanDerWaalsContact O-CB 3.32Å; A1345-Y1349 WeakPolarHBondContact O-CB 3.42Å; A1345-Y1349 PolarHBondContact O-N 2.98Å; L1346-Y1349 CarbonylContact O-C 3.53Å; L1346-Y1349 WeakPolarHBondContact O-CA 3.41Å; L1346-Y1349 WeakPolarHBondContact O-CB 3.44Å; L1346-Y1349 PolarHBondContact O-N 3.31Å; Y1349-F1352 HydrophobicContact CD2-CD1 4.27Å; Y1349-F1352 HydrophobicContact CE2-CD1 4.36Å; Y1349-F1352 WeakPolarHBondContact O-CB 3.47Å; Y1349-F1352 PolarHBondContact O-N 3.5Å; Y1349-L1353 HydrophobicContact CD1-CD1 4.24Å; Y1349-L1353 HydrophobicContact CE1-CD1 3.56Å; Y1349-L1353 HydrophobicContact CE1-CG 4.13Å; Y1349-L1353 HydrophobicContact CE2-CD1 4.4Å; Y1349-L1353 HydrophobicContact CE2-CD2 4.2Å; Y1349-L1353 HydrophobicContact CE2-CG 4.14Å; Y1349-L1353 WeakPolarHBondContact O-CG 3.44Å; Y1349-L1353 PolarHBondContact O-N 3.3Å; Y1349-T1423 HydrophobicContact CD2-CG2 4.48Å; Y1349-T1423 HydrophobicContact CE2-CG2 3.53Å
1350	T	48.7	Very low	50.3	Low	39 Å²	39	71.6 Å²	71.6	24%	0.239	40%	0.4	C	S	.	.	H	α-helix	trans	-67.6	-41.2	173	53.2	0	0	0	0	110.7	L1346 D1347 F1352 L1353 E1354	L1346-T1350 HydrophobicContact CD1-CG2 4.48Å; L1346-T1350 HydrophobicContact CG-CG2 4.49Å; L1346-T1350 PolarHBondContact O-N 2.8Å; L1346-T1350 PolarHBondContact O-OG1 2.66Å; D1347-T1350 WeakPolarHBondContact CA-OG1 3.46Å; D1347-T1350 PolarHBondContact O-OG1 2.7Å; T1350-F1352 VanDerWaalsContact C-N 3.26Å; T1350-F1352 PolarHBondContact O-N 3.17Å; T1350-L1353 PolarHBondContact O-N 2.92Å; T1350-L1353 VanDerWaalsContact O-N 3.13Å; T1350-E1354 WeakPolarHBondContact O-CG 3.48Å; T1350-E1354 PolarHBondContact O-N 3.22Å
1351	T	58.7	Low	49.6	Very low	89 Å²	89	70.1 Å²	70.1	55%	0.546	40%	0.401	S	S	.	.	H	α-helix	trans	-57.9	-39	171.1	-58.5	0	0	0	0	111.7	D1347 G1355	D1347-T1351 VanDerWaalsContact O-CB 3.22Å; D1347-T1351 WeakPolarHBondContact O-CB 3.45Å; D1347-T1351 PolarHBondContact O-N 2.92Å; D1347-T1351 PolarHBondContact O-OG1 3.49Å; T1351-G1355 PolarHBondContact O-N 3.49Å
1352	F	54.3	Low	49	Very low	78 Å²	78	75.5 Å²	75.5	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-63.7	-49.3	172.3	169.1	-103	0	0	0	112	A1348 Y1349 T1350 E1354 G1355 L1356 L1369	A1348-F1352 WeakPolarHBondContact O-CB 3.48Å; A1348-F1352 PolarHBondContact O-N 2.76Å; Y1349-F1352 HydrophobicContact CD2-CD1 4.27Å; Y1349-F1352 HydrophobicContact CE2-CD1 4.36Å; Y1349-F1352 WeakPolarHBondContact O-CB 3.47Å; Y1349-F1352 PolarHBondContact O-N 3.5Å; T1350-F1352 VanDerWaalsContact C-N 3.26Å; T1350-F1352 PolarHBondContact O-N 3.17Å; F1352-E1354 VanDerWaalsContact C-N 3.33Å; F1352-E1354 PolarHBondContact O-N 3.36Å; F1352-G1355 CarbonylContact O-C 3.57Å; F1352-G1355 WeakPolarHBondContact O-CA 3.31Å; F1352-G1355 PolarHBondContact O-N 3.39Å; F1352-G1355 VanDerWaalsContact O-N 3.1Å; F1352-L1356 HydrophobicContact CD1-CD1 4.38Å; F1352-L1356 HydrophobicContact CE1-CD1 3.78Å; F1352-L1356 HydrophobicContact CE1-CG 4.35Å; F1352-L1356 HydrophobicContact CE2-CD2 4.23Å; F1352-L1356 HydrophobicContact CE2-CG 4.47Å; F1352-L1356 HydrophobicContact CZ-CD1 3.93Å; F1352-L1356 HydrophobicContact CZ-CD2 4.18Å; F1352-L1356 HydrophobicContact CZ-CG 4.24Å; F1352-L1356 WeakPolarHBondContact O-CG 3.31Å; F1352-L1356 PolarHBondContact O-N 2.72Å; F1352-L1369 HydrophobicContact CB-CD1 4.1Å; F1352-L1369 HydrophobicContact CD2-CD1 3.84Å; F1352-L1369 HydrophobicContact CG-CD1 4.45Å
1353	L	45.1	Very low	48.5	Very low	62 Å²	62	78.3 Å²	78.3	33%	0.325	45%	0.45	S	S	.	.	H	α-helix	trans	-63.5	-33.3	178	-70.1	-175.6	0	0	0	113.6	Y1349 T1350 L1356	Y1349-L1353 HydrophobicContact CD1-CD1 4.24Å; Y1349-L1353 HydrophobicContact CE1-CD1 3.56Å; Y1349-L1353 HydrophobicContact CE1-CG 4.13Å; Y1349-L1353 HydrophobicContact CE2-CD1 4.4Å; Y1349-L1353 HydrophobicContact CE2-CD2 4.2Å; Y1349-L1353 HydrophobicContact CE2-CG 4.14Å; Y1349-L1353 WeakPolarHBondContact O-CG 3.44Å; Y1349-L1353 PolarHBondContact O-N 3.3Å; T1350-L1353 PolarHBondContact O-N 2.92Å; T1350-L1353 VanDerWaalsContact O-N 3.13Å; L1353-L1356 HydrophobicContact CD2-CD1 4.15Å; L1353-L1356 PolarHBondContact O-N 2.77Å
1354	E	50.6	Low	48.2	Very low	138 Å²	138	78.1 Å²	78.1	65%	0.645	46%	0.457	S	S	*	.	H	α-helix	trans	-71.7	-37.2	171.8	-70	-167.6	149.9	0	0	111.3	T1350 F1352 L1356 K1357	T1350-E1354 WeakPolarHBondContact O-CG 3.48Å; T1350-E1354 PolarHBondContact O-N 3.22Å; F1352-E1354 VanDerWaalsContact C-N 3.33Å; F1352-E1354 PolarHBondContact O-N 3.36Å; E1354-L1356 VanDerWaalsContact C-N 3.27Å; E1354-L1356 PolarHBondContact O-N 2.82Å; E1354-K1357 WeakPolarHBondContact O-CB 3.45Å; E1354-K1357 PolarHBondContact O-N 3.14Å
1355	G	49.2	Very low	47.6	Very low	32 Å²	32	75.6 Å²	75.6	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-57.6	-36.3	169.2	0	0	0	0	0	113.4	T1351 F1352 K1357 A1358	T1351-G1355 PolarHBondContact O-N 3.49Å; F1352-G1355 CarbonylContact O-C 3.57Å; F1352-G1355 WeakPolarHBondContact O-CA 3.31Å; F1352-G1355 PolarHBondContact O-N 3.39Å; F1352-G1355 VanDerWaalsContact O-N 3.1Å; G1355-K1357 PolarHBondContact O-N 2.8Å; G1355-A1358 PolarHBondContact O-N 3.42Å
1356	L	43.7	Very low	47.4	Very low	83 Å²	83	79.2 Å²	79.2	44%	0.435	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.1	174.1	-63.6	-176.6	0	0	0	113.9	F1352 L1353 E1354 H1362	F1352-L1356 HydrophobicContact CD1-CD1 4.38Å; F1352-L1356 HydrophobicContact CE1-CD1 3.78Å; F1352-L1356 HydrophobicContact CE1-CG 4.35Å; F1352-L1356 HydrophobicContact CE2-CD2 4.23Å; F1352-L1356 HydrophobicContact CE2-CG 4.47Å; F1352-L1356 HydrophobicContact CZ-CD1 3.93Å; F1352-L1356 HydrophobicContact CZ-CD2 4.18Å; F1352-L1356 HydrophobicContact CZ-CG 4.24Å; F1352-L1356 WeakPolarHBondContact O-CG 3.31Å; F1352-L1356 PolarHBondContact O-N 2.72Å; L1353-L1356 HydrophobicContact CD2-CD1 4.15Å; L1353-L1356 PolarHBondContact O-N 2.77Å; E1354-L1356 VanDerWaalsContact C-N 3.27Å; E1354-L1356 PolarHBondContact O-N 2.82Å; L1356-H1362 VanDerWaalsContact CD2-CE1 3.43Å; L1356-H1362 WeakPolarHBondContact CD2-CE1 3.42Å
1357	K	44.4	Very low	47.3	Very low	169 Å²	169	81.5 Å²	81.5	74%	0.735	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.2	177.1	-67.3	173.3	-175.3	172	0	113.1	E1354 G1355	E1354-K1357 WeakPolarHBondContact O-CB 3.45Å; E1354-K1357 PolarHBondContact O-N 3.14Å; G1355-K1357 PolarHBondContact O-N 2.8Å
1358	A	46.4	Very low	46.8	Very low	57 Å²	57	85 Å²	85	47%	0.471	49%	0.491	S	S	.	.	S	Bend	trans	-91.6	117.1	175.4	0	0	0	0	0	110.6	G1355 S1360	G1355-A1358 PolarHBondContact O-N 3.42Å; A1358-S1360 PolarHBondContact O-N 2.8Å
1359	P	38	Very low	46.2	Very low	138 Å²	138	85.6 Å²	85.6	90%	0.896	49%	0.488	S	S	*	.	S	Bend	trans	-79.4	56	-174.7	33.3	-37	0	0	0	113.2
1360	S	38.8	Very low	46.1	Very low	94 Å²	94	86.4 Å²	86.4	66%	0.657	50%	0.5	S	S	*	.	S	Bend	trans	-156.8	116.1	171.1	53.7	0	0	0	0	114.8	A1358	A1358-S1360 PolarHBondContact O-N 2.8Å
1361	S	43.5	Very low	45.9	Very low	74 Å²	74	87.6 Å²	87.6	52%	0.517	51%	0.51	S	S	.	.			trans	61.6	85.4	164.7	68.8	0	0	0	0	118.2	A1363 T1364	S1361-A1363 PolarHBondContact O-N 3.35Å; S1361-A1363 VanDerWaalsContact O-N 3.1Å; S1361-T1364 WeakPolarHBondContact CB-OG1 3.41Å; S1361-T1364 PolarHBondContact O-N 3.45Å; S1361-T1364 VanDerWaalsContact O-N 3.07Å; S1361-T1364 WeakPolarHBondContact OG-CB 3.38Å; S1361-T1364 PolarHBondContact OG-OG1 3.44Å
1362	H	44.4	Very low	45.2	Very low	138 Å²	138	87.3 Å²	87.3	64%	0.639	51%	0.512	S	S	*	.	H	α-helix	trans	-46.4	-39.6	171.8	-111.8	-60.1	0	0	0	114.6	L1356 T1364 A1365	L1356-H1362 VanDerWaalsContact CD2-CE1 3.43Å; L1356-H1362 WeakPolarHBondContact CD2-CE1 3.42Å; H1362-T1364 VanDerWaalsContact C-N 3.32Å; H1362-T1364 PolarHBondContact O-N 2.86Å; H1362-A1365 PolarHBondContact O-N 3.21Å
1363	A	45.8	Very low	44.4	Very low	77 Å²	77	86 Å²	86	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-63.6	-34.4	-177.9	0	0	0	0	0	113.3	S1361 I1366 S1367	S1361-A1363 PolarHBondContact O-N 3.35Å; S1361-A1363 VanDerWaalsContact O-N 3.1Å; A1363-I1366 PolarHBondContact O-N 2.84Å; A1363-S1367 PolarHBondContact O-N 2.91Å
1364	T	48.4	Very low	44.3	Very low	66 Å²	66	87 Å²	87	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-71.5	-33.1	-176.3	-45.2	0	0	0	0	111.7	S1361 H1362 K1368	S1361-T1364 WeakPolarHBondContact CB-OG1 3.41Å; S1361-T1364 PolarHBondContact O-N 3.45Å; S1361-T1364 VanDerWaalsContact O-N 3.07Å; S1361-T1364 WeakPolarHBondContact OG-CB 3.38Å; S1361-T1364 PolarHBondContact OG-OG1 3.44Å; H1362-T1364 VanDerWaalsContact C-N 3.32Å; H1362-T1364 PolarHBondContact O-N 2.86Å; T1364-K1368 WeakPolarHBondContact O-CG 3.39Å; T1364-K1368 PolarHBondContact O-N 3.41Å
1365	A	44.6	Very low	43.7	Very low	33 Å²	33	83 Å²	83	27%	0.273	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-44.7	176	0	0	0	0	0	111.9	H1362 S1367 K1368 L1369	H1362-A1365 PolarHBondContact O-N 3.21Å; A1365-S1367 PolarHBondContact O-N 2.9Å; A1365-K1368 PolarHBondContact O-N 3.09Å; A1365-L1369 PolarHBondContact O-N 3.34Å
1366	I	45.9	Very low	43.2	Very low	90 Å²	90	83.7 Å²	83.7	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-40.5	-179.3	-61.8	171.1	0	0	0	111.1	A1363 L1369 T1370	A1363-I1366 PolarHBondContact O-N 2.84Å; I1366-L1369 PolarHBondContact O-N 3.49Å; I1366-T1370 PolarHBondContact O-N 3.03Å; I1366-T1370 VanDerWaalsContact O-N 3.14Å; I1366-T1370 PolarHBondContact O-OG1 3.17Å
1367	S	48.5	Very low	42.9	Very low	76 Å²	76	82.9 Å²	82.9	53%	0.531	52%	0.516	S	S	.	.	H	α-helix	trans	-61.8	-39.4	173.6	177.4	0	0	0	0	113.2	A1363 A1365 T1370 S1371	A1363-S1367 PolarHBondContact O-N 2.91Å; A1365-S1367 PolarHBondContact O-N 2.9Å; S1367-T1370 PolarHBondContact O-OG1 2.56Å; S1367-S1371 PolarHBondContact O-N 3.24Å; S1367-S1371 PolarHBondContact O-OG 3.12Å
1368	K	44.4	Very low	42.6	Very low	145 Å²	145	79.2 Å²	79.2	63%	0.63	51%	0.508	S	S	*	.	H	α-helix	trans	-70.5	-33.3	174.8	-74.5	-178.4	177	-178.3	0	112.8	T1364 A1365 S1371 S1372	T1364-K1368 WeakPolarHBondContact O-CG 3.39Å; T1364-K1368 PolarHBondContact O-N 3.41Å; A1365-K1368 PolarHBondContact O-N 3.09Å; K1368-S1371 WeakPolarHBondContact CA-OG 3.15Å; K1368-S1371 PolarHBondContact O-OG 3.11Å; K1368-S1372 WeakPolarHBondContact O-CB 3.41Å; K1368-S1372 PolarHBondContact O-N 3.31Å
1369	L	40	Very low	42.2	Very low	54 Å²	54	80 Å²	80	28%	0.283	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-46.2	175	-100.7	139.7	0	0	0	112.5	F1352 A1365 I1366 S1371 S1372 A1373	F1352-L1369 HydrophobicContact CB-CD1 4.1Å; F1352-L1369 HydrophobicContact CD2-CD1 3.84Å; F1352-L1369 HydrophobicContact CG-CD1 4.45Å; A1365-L1369 PolarHBondContact O-N 3.34Å; I1366-L1369 PolarHBondContact O-N 3.49Å; L1369-S1371 PolarHBondContact O-N 2.94Å; L1369-S1372 PolarHBondContact O-N 3.26Å; L1369-A1373 VanDerWaalsContact O-CB 3.31Å; L1369-A1373 WeakPolarHBondContact O-CB 3.38Å; L1369-A1373 PolarHBondContact O-N 3.43Å
1370	T	44.5	Very low	42	Very low	83 Å²	83	78.1 Å²	78.1	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-35.5	177.9	38.5	0	0	0	0	113.2	I1366 S1367 T1374	I1366-T1370 PolarHBondContact O-N 3.03Å; I1366-T1370 VanDerWaalsContact O-N 3.14Å; I1366-T1370 PolarHBondContact O-OG1 3.17Å; S1367-T1370 PolarHBondContact O-OG1 2.56Å; T1370-T1374 PolarHBondContact O-N 3.2Å; T1370-T1374 PolarHBondContact O-OG1 2.91Å
1371	S	45.7	Very low	41.7	Very low	64 Å²	64	84.1 Å²	84.1	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-74.2	-34.1	174.7	47.5	0	0	0	0	113.3	S1367 K1368 L1369 T1374 A1375	S1367-S1371 PolarHBondContact O-N 3.24Å; S1367-S1371 PolarHBondContact O-OG 3.12Å; K1368-S1371 WeakPolarHBondContact CA-OG 3.15Å; K1368-S1371 PolarHBondContact O-OG 3.11Å; L1369-S1371 PolarHBondContact O-N 2.94Å; S1371-T1374 WeakPolarHBondContact CA-OG1 3.38Å; S1371-T1374 PolarHBondContact O-OG1 3.39Å; S1371-T1374 VanDerWaalsContact O-OG1 3.07Å; S1371-A1375 WeakPolarHBondContact O-CB 3.49Å; S1371-A1375 PolarHBondContact O-N 3.02Å; S1371-A1375 VanDerWaalsContact O-N 3.07Å
1372	S	42.8	Very low	41.3	Very low	82 Å²	82	84.9 Å²	84.9	57%	0.573	51%	0.506	S	S	*	.	H	α-helix	trans	-69.7	-43.7	173.2	-172.9	0	0	0	0	112.5	K1368 L1369 T1374 A1375 A1376	K1368-S1372 WeakPolarHBondContact O-CB 3.41Å; K1368-S1372 PolarHBondContact O-N 3.31Å; L1369-S1372 PolarHBondContact O-N 3.26Å; S1372-T1374 PolarHBondContact O-N 3.18Å; S1372-A1375 PolarHBondContact O-N 2.9Å; S1372-A1376 PolarHBondContact O-N 2.86Å
1373	A	38.8	Very low	40.9	Very low	51 Å²	51	82.8 Å²	82.8	42%	0.421	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-40.7	177.5	0	0	0	0	0	112.3	L1369 T1377	L1369-A1373 VanDerWaalsContact O-CB 3.31Å; L1369-A1373 WeakPolarHBondContact O-CB 3.38Å; L1369-A1373 PolarHBondContact O-N 3.43Å; A1373-T1377 PolarHBondContact O-N 3.45Å
1374	T	41	Very low	40.2	Very low	82 Å²	82	82.8 Å²	82.8	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-45.3	174.2	42.8	0	0	0	0	111.6	T1370 S1371 S1372 A1376 T1377 T1378	T1370-T1374 PolarHBondContact O-N 3.2Å; T1370-T1374 PolarHBondContact O-OG1 2.91Å; S1371-T1374 WeakPolarHBondContact CA-OG1 3.38Å; S1371-T1374 PolarHBondContact O-OG1 3.39Å; S1371-T1374 VanDerWaalsContact O-OG1 3.07Å; S1372-T1374 PolarHBondContact O-N 3.18Å; T1374-A1376 VanDerWaalsContact C-N 3.3Å; T1374-A1376 PolarHBondContact O-N 2.73Å; T1374-T1377 PolarHBondContact O-N 2.85Å; T1374-T1377 PolarHBondContact O-OG1 2.83Å; T1374-T1378 PolarHBondContact O-N 3.24Å; T1374-T1378 PolarHBondContact O-OG1 3.36Å
1375	A	39.7	Very low	39.3	Very low	56 Å²	56	84.3 Å²	84.3	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-56.8	-39.4	176.8	0	0	0	0	0	113.5	S1371 S1372 T1377 T1378 S1379	S1371-A1375 WeakPolarHBondContact O-CB 3.49Å; S1371-A1375 PolarHBondContact O-N 3.02Å; S1371-A1375 VanDerWaalsContact O-N 3.07Å; S1372-A1375 PolarHBondContact O-N 2.9Å; A1375-T1377 VanDerWaalsContact C-N 3.35Å; A1375-T1377 PolarHBondContact O-N 3.37Å; A1375-T1378 PolarHBondContact O-N 3.05Å; A1375-S1379 PolarHBondContact O-N 3.4Å
1376	A	37.3	Very low	38.7	Very low	46 Å²	46	92.1 Å²	92.1	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-60.9	-41.6	173.8	0	0	0	0	0	112.1	S1372 T1374 T1378 S1379 L1380	S1372-A1376 PolarHBondContact O-N 2.86Å; T1374-A1376 VanDerWaalsContact C-N 3.3Å; T1374-A1376 PolarHBondContact O-N 2.73Å; A1376-T1378 PolarHBondContact O-N 3.44Å; A1376-S1379 PolarHBondContact O-N 3.46Å; A1376-L1380 PolarHBondContact O-N 2.78Å
1377	T	37.6	Very low	37.9	Very low	65 Å²	65	90.8 Å²	90.8	40%	0.399	55%	0.547	S	S	.	.	H	α-helix	trans	-68.8	-29.3	175.8	64.1	0	0	0	0	113.7	A1373 T1374 A1375 R1381	A1373-T1377 PolarHBondContact O-N 3.45Å; T1374-T1377 PolarHBondContact O-N 2.85Å; T1374-T1377 PolarHBondContact O-OG1 2.83Å; A1375-T1377 VanDerWaalsContact C-N 3.35Å; A1375-T1377 PolarHBondContact O-N 3.37Å; T1377-R1381 PolarHBondContact O-N 3.38Å
1378	T	38.2	Very low	37.1	Very low	92 Å²	92	95.2 Å²	95.2	56%	0.564	57%	0.565	S	S	*	*	H	α-helix	trans	-72.8	-43.1	174.4	-14	0	0	0	0	111.7	T1374 A1375 A1376 L1380 R1381 S1382	T1374-T1378 PolarHBondContact O-N 3.24Å; T1374-T1378 PolarHBondContact O-OG1 3.36Å; A1375-T1378 PolarHBondContact O-N 3.05Å; A1376-T1378 PolarHBondContact O-N 3.44Å; T1378-L1380 PolarHBondContact O-N 3Å; T1378-R1381 WeakPolarHBondContact O-CB 3.49Å; T1378-R1381 PolarHBondContact O-N 3.16Å; T1378-R1381 VanDerWaalsContact O-N 3.08Å; T1378-S1382 PolarHBondContact O-N 2.98Å
1379	S	37.6	Very low	36.4	Very low	75 Å²	75	91 Å²	91	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-62.5	-41.8	-180	-175.3	0	0	0	0	112.2	A1375 A1376 R1381 S1382 S1383	A1375-S1379 PolarHBondContact O-N 3.4Å; A1376-S1379 PolarHBondContact O-N 3.46Å; S1379-R1381 PolarHBondContact O-N 3.45Å; S1379-S1382 PolarHBondContact O-N 2.89Å; S1379-S1382 PolarHBondContact O-OG 3.35Å; S1379-S1383 PolarHBondContact O-OG 3.2Å
1380	L	34.3	Very low	36.6	Very low	97 Å²	97	95.2 Å²	95.2	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-63	-27.2	173.7	-81.6	164.6	0	0	0	113.6	A1376 T1378	A1376-L1380 PolarHBondContact O-N 2.78Å; T1378-L1380 PolarHBondContact O-N 3Å
1381	R	33.4	Very low	36.3	Very low	220 Å²	220	98.8 Å²	98.8	83%	0.83	58%	0.579	S	S	*	*	H	α-helix	trans	-73.8	-27.5	176.3	-111.2	-179	177	-175.4	-0.8	113.3	T1377 T1378 S1379	T1377-R1381 PolarHBondContact O-N 3.38Å; T1378-R1381 WeakPolarHBondContact O-CB 3.49Å; T1378-R1381 PolarHBondContact O-N 3.16Å; T1378-R1381 VanDerWaalsContact O-N 3.08Å; S1379-R1381 PolarHBondContact O-N 3.45Å
1382	S	34.5	Very low	35.8	Very low	91 Å²	91	98.1 Å²	98.1	64%	0.636	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-8.4	179.3	43.8	0	0	0	0	115.1	T1378 S1379	T1378-S1382 PolarHBondContact O-N 2.98Å; S1379-S1382 PolarHBondContact O-N 2.89Å; S1379-S1382 PolarHBondContact O-OG 3.35Å
1383	S	35.5	Very low	35.7	Very low	93 Å²	93	95.8 Å²	95.8	65%	0.65	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	0.4	-175.6	-56.1	0	0	0	0	114.9	S1379	S1379-S1383 PolarHBondContact O-OG 3.2Å
1384	I	32.6	Very low	36	Very low	78 Å²	78	95.9 Å²	95.9	40%	0.4	56%	0.555	S	S	.	*			trans	-118.2	89	-174.6	-57.2	175.2	0	0	0	109.3	E1389	I1384-E1389 HydrophobicContact CG2-CB 3.84Å; I1384-E1389 HydrophobicContact CG2-CG 4.48Å; I1384-E1389 WeakPolarHBondContact CG2-OE2 3.34Å
1385	S	28.7	Very low	36	Very low	97 Å²	97	92.6 Å²	92.6	68%	0.678	53%	0.534	S	S	*	.			trans	-146.7	53.7	179.4	70.1	0	0	0	0	114.3
1386	H	31.7	Very low	36.2	Very low	198 Å²	198	91.9 Å²	91.9	92%	0.917	52%	0.524	S	S	*	.	S	Bend	trans	-168.5	128.5	147.7	-86	-21.6	0	0	0	110.7
1387	G	29.8	Very low	36.7	Very low	62 Å²	62	92.8 Å²	92.8	64%	0.639	53%	0.528	S	S	*	.	S	Bend	trans	73.3	110.5	162.6	0	0	0	0	0	118.8	E1389	G1387-E1389 PolarHBondContact O-N 3.11Å
1388	N	30.5	Very low	37.1	Very low	168 Å²	168	92 Å²	92	90%	0.898	52%	0.52	S	S	*	.	S	Bend	trans	64.5	16.9	153.3	-61.4	-7.1	0	0	0	120.9
1389	E	31.4	Very low	37.5	Very low	58 Å²	58	88 Å²	88	27%	0.271	50%	0.495	S	S	.	.			trans	-96.8	16.3	-179	-78.2	-142.8	122.1	0	0	117.6	I1384 G1387 R1391 F1392	I1384-E1389 HydrophobicContact CG2-CB 3.84Å; I1384-E1389 HydrophobicContact CG2-CG 4.48Å; I1384-E1389 WeakPolarHBondContact CG2-OE2 3.34Å; G1387-E1389 PolarHBondContact O-N 3.11Å; E1389-R1391 VanDerWaalsContact C-N 3.27Å; E1389-R1391 PolarHBondContact O-N 3.24Å; E1389-R1391 VanDerWaalsContact O-N 3.1Å; E1389-F1392 PolarHBondContact O-N 3Å
1390	T	42.4	Very low	38	Very low	142 Å²	142	86.6 Å²	86.6	87%	0.871	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.3	-174.3	52.8	0	0	0	0	115.4
1391	R	38.5	Very low	38.8	Very low	157 Å²	157	91.1 Å²	91.1	59%	0.592	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-24.2	176	-97.1	-178.7	158	158.4	-6.8	114.4	E1100 E1389	E1100-R1391 IonicContact OE2-CZ 2.7Å; E1100-R1391 IonicContact OE2-NE 3.81Å; E1100-R1391 IonicContact OE2-NH2 2.73Å; E1100-R1391 PolarHBondContact OE2-NH2 3.43Å; E1389-R1391 VanDerWaalsContact C-N 3.27Å; E1389-R1391 PolarHBondContact O-N 3.24Å; E1389-R1391 VanDerWaalsContact O-N 3.1Å
1392	F	35.6	Very low	39.4	Very low	50 Å²	50	85.5 Å²	85.5	22%	0.219	47%	0.474	C	S	.	.	H	α-helix	trans	-87.9	-30.7	-169.9	-75.4	-69.7	0	0	0	114.3	L1334 E1389 S1394 L1395	L1334-F1392 HydrophobicContact CD2-CE1 3.99Å; E1389-F1392 PolarHBondContact O-N 3Å; F1392-S1394 PolarHBondContact O-N 3.43Å; F1392-L1395 WeakPolarHBondContact O-CB 3.36Å; F1392-L1395 PolarHBondContact O-N 3.48Å
1393	G	40	Very low	39.9	Very low	33 Å²	33	82.7 Å²	82.7	34%	0.34	45%	0.453	S	S	.	.	H	α-helix	trans	-62.8	-24.4	172.2	0	0	0	0	0	113.8	T1396 S1397	G1393-T1396 PolarHBondContact O-OG1 3.48Å; G1393-S1397 PolarHBondContact O-N 2.71Å
1394	S	45.4	Very low	40.4	Very low	53 Å²	53	81.8 Å²	81.8	37%	0.371	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-47.7	173.6	-178.3	0	0	0	0	111.7	F1392 T1396 S1397 E1398	F1392-S1394 PolarHBondContact O-N 3.43Å; S1394-T1396 PolarHBondContact O-N 3.06Å; S1394-S1397 PolarHBondContact O-N 3.1Å; S1394-S1397 VanDerWaalsContact O-N 3.08Å; S1394-S1397 PolarHBondContact O-OG 2.77Å; S1394-E1398 WeakPolarHBondContact O-CB 3.36Å; S1394-E1398 PolarHBondContact O-N 2.76Å
1395	L	41.4	Very low	41	Very low	13 Å²	13	80.4 Å²	80.4	7%	0.068	44%	0.441	C	S	.	.	H	α-helix	trans	-54.7	-49.1	-175.9	170.9	60.2	0	0	0	113	V1095 T1097 F1098 F1392 E1398 I1399	V1095-L1395 HydrophobicContact CG1-CD1 3.51Å; T1097-L1395 HydrophobicContact CG2-CB 4.33Å; T1097-L1395 WeakPolarHBondContact OG1-CD1 3.01Å; F1098-L1395 HydrophobicContact CD2-CD1 3.97Å; F1098-L1395 HydrophobicContact CE2-CD1 3.7Å; F1098-L1395 HydrophobicContact CE2-CD2 3.9Å; F1098-L1395 HydrophobicContact CE2-CG 4.49Å; F1098-L1395 HydrophobicContact CZ-CD2 4.11Å; F1392-L1395 WeakPolarHBondContact O-CB 3.36Å; F1392-L1395 PolarHBondContact O-N 3.48Å; L1395-E1398 PolarHBondContact O-N 2.73Å; L1395-I1399 HydrophobicContact CD1-CD1 3.59Å; L1395-I1399 HydrophobicContact CD1-CG1 4.18Å; L1395-I1399 HydrophobicContact CG-CD1 4.3Å; L1395-I1399 WeakPolarHBondContact O-CG1 3.18Å; L1395-I1399 PolarHBondContact O-N 3.17Å
1396	T	43.3	Very low	41.6	Very low	41 Å²	41	79.3 Å²	79.3	25%	0.252	43%	0.425	S	S	.	.	H	α-helix	trans	-69.5	-32.4	179	40.9	0	0	0	0	112.4	G1393 S1394 S1400	G1393-T1396 PolarHBondContact O-OG1 3.48Å; S1394-T1396 PolarHBondContact O-N 3.06Å; T1396-S1400 WeakPolarHBondContact O-CB 3.4Å; T1396-S1400 PolarHBondContact O-N 3.03Å; T1396-S1400 PolarHBondContact O-OG 3.42Å; T1396-S1400 VanDerWaalsContact O-OG 3.07Å
1397	S	48.6	Very low	42.1	Very low	66 Å²	66	74.7 Å²	74.7	46%	0.462	41%	0.406	S	S	.	.	H	α-helix	trans	-71.4	-39.6	175	74.7	0	0	0	0	112.9	G1393 S1394 R1401	G1393-S1397 PolarHBondContact O-N 2.71Å; S1394-S1397 PolarHBondContact O-N 3.1Å; S1394-S1397 VanDerWaalsContact O-N 3.08Å; S1394-S1397 PolarHBondContact O-OG 2.77Å; S1397-R1401 VanDerWaalsContact O-CB 3.27Å; S1397-R1401 WeakPolarHBondContact O-CB 3.45Å; S1397-R1401 PolarHBondContact O-N 3.31Å
1398	E	46	Very low	42.5	Very low	47 Å²	47	75.3 Å²	75.3	22%	0.22	40%	0.401	C	S	.	.	H	α-helix	trans	-69.2	-43.7	179.8	176.5	64.2	-169.3	0	0	111.5	S1394 L1395 R1402	S1394-E1398 WeakPolarHBondContact O-CB 3.36Å; S1394-E1398 PolarHBondContact O-N 2.76Å; L1395-E1398 PolarHBondContact O-N 2.73Å; E1398-R1402 WeakPolarHBondContact O-CG 3.28Å; E1398-R1402 PolarHBondContact O-N 2.85Å; E1398-R1402 IonicContact OE1-CZ 2.77Å; E1398-R1402 IonicContact OE1-NE 3.15Å; E1398-R1402 PolarHBondContact OE1-NE 2.79Å; E1398-R1402 IonicContact OE1-NH2 3.64Å; E1398-R1402 PolarHBondContact OE1-NH2 2.72Å
1399	I	46.2	Very low	42.7	Very low	9 Å²	9	72.9 Å²	72.9	5%	0.046	38%	0.384	C	S	.	.	H	α-helix	trans	-64.2	-52.8	175.3	-64	170.1	0	0	0	109.8	V1095 T1341 L1395 R1401 R1402 V1403 M1430	V1095-I1399 HydrophobicContact CG1-CG1 4.28Å; T1341-I1399 HydrophobicContact CG2-CB 4.04Å; T1341-I1399 HydrophobicContact CG2-CD1 4.07Å; T1341-I1399 HydrophobicContact CG2-CG2 3.5Å; L1395-I1399 HydrophobicContact CD1-CD1 3.59Å; L1395-I1399 HydrophobicContact CD1-CG1 4.18Å; L1395-I1399 HydrophobicContact CG-CD1 4.3Å; L1395-I1399 WeakPolarHBondContact O-CG1 3.18Å; L1395-I1399 PolarHBondContact O-N 3.17Å; I1399-R1401 VanDerWaalsContact C-N 3.28Å; I1399-R1401 PolarHBondContact O-N 3.11Å; I1399-R1402 WeakPolarHBondContact O-CA 3.47Å; I1399-R1402 PolarHBondContact O-N 3.04Å; I1399-V1403 HydrophobicContact CG2-CG2 4.26Å; I1399-V1403 WeakPolarHBondContact O-CG2 3.35Å; I1399-V1403 PolarHBondContact O-N 3.33Å; I1399-M1430 HydrophobicContact CG2-CE 4.22Å
1400	S	48	Very low	42.9	Very low	46 Å²	46	75.7 Å²	75.7	32%	0.322	40%	0.401	S	S	.	.	H	α-helix	trans	-54.6	-42.4	178.9	-69.5	0	0	0	0	112.5	T1396 R1402 V1403 T1404	T1396-S1400 WeakPolarHBondContact O-CB 3.4Å; T1396-S1400 PolarHBondContact O-N 3.03Å; T1396-S1400 PolarHBondContact O-OG 3.42Å; T1396-S1400 VanDerWaalsContact O-OG 3.07Å; S1400-R1402 VanDerWaalsContact C-N 3.3Å; S1400-R1402 PolarHBondContact O-N 3.18Å; S1400-V1403 PolarHBondContact O-N 2.84Å; S1400-T1404 PolarHBondContact O-N 3.05Å; S1400-T1404 PolarHBondContact O-OG1 2.77Å
1401	R	51.6	Low	42.6	Very low	192 Å²	192	74.9 Å²	74.9	73%	0.725	39%	0.391	S	S	*	.	H	α-helix	trans	-58.2	-39.5	175.7	178.6	178.1	169.4	136.5	2.1	112.5	S1397 I1399 S1405	S1397-R1401 VanDerWaalsContact O-CB 3.27Å; S1397-R1401 WeakPolarHBondContact O-CB 3.45Å; S1397-R1401 PolarHBondContact O-N 3.31Å; I1399-R1401 VanDerWaalsContact C-N 3.28Å; I1399-R1401 PolarHBondContact O-N 3.11Å; R1401-S1405 PolarHBondContact O-N 3.43Å
1402	R	46.4	Very low	42.6	Very low	102 Å²	102	71.8 Å²	71.8	39%	0.385	39%	0.394	S	S	.	.	H	α-helix	trans	-75.1	-30	177.8	-68.3	-177.3	-170.9	-165.8	9.5	113.7	G1094 E1398 I1399 S1400 S1405 H1406	G1094-R1402 PolarHBondContact O-NH1 3.37Å; G1094-R1402 PolarHBondContact O-NH2 3.37Å; E1398-R1402 WeakPolarHBondContact O-CG 3.28Å; E1398-R1402 PolarHBondContact O-N 2.85Å; E1398-R1402 IonicContact OE1-CZ 2.77Å; E1398-R1402 IonicContact OE1-NE 3.15Å; E1398-R1402 PolarHBondContact OE1-NE 2.79Å; E1398-R1402 IonicContact OE1-NH2 3.64Å; E1398-R1402 PolarHBondContact OE1-NH2 2.72Å; I1399-R1402 WeakPolarHBondContact O-CA 3.47Å; I1399-R1402 PolarHBondContact O-N 3.04Å; S1400-R1402 VanDerWaalsContact C-N 3.3Å; S1400-R1402 PolarHBondContact O-N 3.18Å; R1402-S1405 WeakPolarHBondContact CA-OG 3.07Å; R1402-S1405 PolarHBondContact O-OG 2.85Å; R1402-H1406 PolarHBondContact O-N 3.34Å
1403	V	45.4	Very low	42.3	Very low	32 Å²	32	75.2 Å²	75.2	19%	0.194	41%	0.414	C	S	.	.	H	α-helix	trans	-62.2	-49.1	169.7	-173.3	0	0	0	0	109.4	I1399 S1400 S1405 I1407 Y1426	I1399-V1403 HydrophobicContact CG2-CG2 4.26Å; I1399-V1403 WeakPolarHBondContact O-CG2 3.35Å; I1399-V1403 PolarHBondContact O-N 3.33Å; S1400-V1403 PolarHBondContact O-N 2.84Å; V1403-S1405 PolarHBondContact O-N 2.69Å; V1403-I1407 HydrophobicContact CG1-CD1 3.78Å; V1403-I1407 VanDerWaalsContact O-CG1 3.32Å; V1403-I1407 WeakPolarHBondContact O-CG1 3.24Å; V1403-I1407 PolarHBondContact O-N 3.31Å; V1403-Y1426 HydrophobicContact CG2-CE2 4.33Å; V1403-Y1426 VanDerWaalsContact CG2-OH 3.31Å; V1403-Y1426 WeakPolarHBondContact CG2-OH 3.1Å
1404	T	44.8	Very low	41.9	Very low	73 Å²	73	80.3 Å²	80.3	45%	0.448	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-36.6	-179.4	-43.3	0	0	0	0	113.2	S1400 S1408	S1400-T1404 PolarHBondContact O-N 3.05Å; S1400-T1404 PolarHBondContact O-OG1 2.77Å; T1404-S1408 PolarHBondContact O-N 2.88Å; T1404-S1408 PolarHBondContact O-OG 3.25Å
1405	S	45.5	Very low	41.3	Very low	49 Å²	49	90 Å²	90	34%	0.343	46%	0.462	S	S	.	.	H	α-helix	trans	-66.5	-47.2	-179.4	62.7	0	0	0	0	112.8	R1401 R1402 V1403 S1408 E1409	R1401-S1405 PolarHBondContact O-N 3.43Å; R1402-S1405 WeakPolarHBondContact CA-OG 3.07Å; R1402-S1405 PolarHBondContact O-OG 2.85Å; V1403-S1405 PolarHBondContact O-N 2.69Å; S1405-S1408 VanDerWaalsContact O-CB 3.28Å; S1405-S1408 WeakPolarHBondContact O-CB 3.35Å; S1405-S1408 PolarHBondContact O-N 3.26Å; S1405-S1408 VanDerWaalsContact O-N 3.08Å; S1405-E1409 PolarHBondContact O-N 3.23Å
1406	H	41.3	Very low	40.8	Very low	74 Å²	74	96.2 Å²	96.2	34%	0.343	50%	0.496	S	S	.	.	H	α-helix	trans	-71.1	-33.4	-179.4	-77.3	-34	0	0	0	113.1	R1402 S1408 E1409 D1410 R1429	R1402-H1406 PolarHBondContact O-N 3.34Å; H1406-S1408 PolarHBondContact O-N 3.17Å; H1406-E1409 IonicContact CE1-OE2 2.7Å; H1406-E1409 PolarHBondContact CE1-OE2 2.86Å; H1406-E1409 IonicContact CG-OE2 2.7Å; H1406-E1409 IonicContact ND1-OE2 3.9Å; H1406-E1409 PolarHBondContact ND1-OE2 2.75Å; H1406-E1409 PolarHBondContact O-N 2.77Å; H1406-D1410 PolarHBondContact O-N 3.23Å; H1406-R1429 PolarHBondContact NE2-NH1 2.75Å
1407	I	41.1	Very low	40.2	Very low	101 Å²	101	102.6 Å²	102.6	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-25.3	170.7	-67	172	0	0	0	111.5	V1403 N1411	V1403-I1407 HydrophobicContact CG1-CD1 3.78Å; V1403-I1407 VanDerWaalsContact O-CG1 3.32Å; V1403-I1407 WeakPolarHBondContact O-CG1 3.24Å; V1403-I1407 PolarHBondContact O-N 3.31Å; I1407-N1411 PolarHBondContact O-ND2 2.67Å
1408	S	38.8	Very low	39.1	Very low	75 Å²	75	106.7 Å²	106.7	52%	0.524	54%	0.542	S	S	.	.	H	α-helix	trans	-79.5	-36.7	176.4	-53.4	0	0	0	0	112.9	T1404 S1405 H1406	T1404-S1408 PolarHBondContact O-N 2.88Å; T1404-S1408 PolarHBondContact O-OG 3.25Å; S1405-S1408 VanDerWaalsContact O-CB 3.28Å; S1405-S1408 WeakPolarHBondContact O-CB 3.35Å; S1405-S1408 PolarHBondContact O-N 3.26Å; S1405-S1408 VanDerWaalsContact O-N 3.08Å; H1406-S1408 PolarHBondContact O-N 3.17Å
1409	E	35	Very low	38.5	Very low	117 Å²	117	108.6 Å²	108.6	55%	0.547	56%	0.557	S	S	.	*	H	α-helix	trans	-73.8	-39	-177.9	-69.3	171.1	147.1	0	0	112.6	S1405 H1406 N1411 S1412	S1405-E1409 PolarHBondContact O-N 3.23Å; H1406-E1409 IonicContact CE1-OE2 2.7Å; H1406-E1409 PolarHBondContact CE1-OE2 2.86Å; H1406-E1409 IonicContact CG-OE2 2.7Å; H1406-E1409 IonicContact ND1-OE2 3.9Å; H1406-E1409 PolarHBondContact ND1-OE2 2.75Å; H1406-E1409 PolarHBondContact O-N 2.77Å; E1409-N1411 PolarHBondContact O-N 2.81Å; E1409-S1412 PolarHBondContact O-N 2.7Å; E1409-S1412 PolarHBondContact O-OG 2.78Å
1410	D	35.9	Very low	38.1	Very low	118 Å²	118	114.3 Å²	114.3	63%	0.631	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-7.1	178.7	-81	-16.7	0	0	0	114.1	H1406	H1406-D1410 PolarHBondContact O-N 3.23Å
1411	N	36.2	Very low	37.6	Very low	124 Å²	124	116.3 Å²	116.3	66%	0.663	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-9.8	-178.4	-87	-79.8	0	0	0	114.8	I1407 E1409	I1407-N1411 PolarHBondContact O-ND2 2.67Å; E1409-N1411 PolarHBondContact O-N 2.81Å
1412	S	37.3	Very low	36.7	Very low	93 Å²	93	108.6 Å²	108.6	65%	0.65	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-27.3	-178.8	53.9	0	0	0	0	114.6	E1409	E1409-S1412 PolarHBondContact O-N 2.7Å; E1409-S1412 PolarHBondContact O-OG 2.78Å
1413	D	30.4	Very low	36.4	Very low	121 Å²	121	106.2 Å²	106.2	65%	0.647	58%	0.58	S	S	*	*	S	Bend	trans	-122.4	133.3	-171	-76.6	-71.7	0	0	0	113.5
1414	N	31.1	Very low	36.7	Very low	141 Å²	141	106.9 Å²	106.9	75%	0.754	59%	0.586	S	S	*	*			trans	68.7	90.7	178.2	-57.4	-70.3	0	0	0	117.8	N1416	N1414-N1416 PolarHBondContact O-N 3.39Å
1415	R	32.8	Very low	37.1	Very low	255 Å²	255	105.5 Å²	105.5	96%	0.962	58%	0.576	S	S	*	*	S	Bend	trans	-71.2	-10.5	158.5	-79.4	-174.5	172.9	175.6	-1.4	114.7
1416	N	31.1	Very low	37.5	Very low	145 Å²	145	105.5 Å²	105.5	78%	0.775	57%	0.569	S	S	*	*	S	Bend	trans	-120.1	66.2	-171.3	-72.7	-1.3	0	0	0	113.2	N1414	N1414-N1416 PolarHBondContact O-N 3.39Å
1417	K	30	Very low	38.1	Very low	175 Å²	175	105.1 Å²	105.1	76%	0.761	56%	0.564	S	S	*	*			trans	-164.2	108.9	154.6	-112.3	163.2	-172.5	177.1	0	111.8	T1419	K1417-T1419 VanDerWaalsContact C-N 3.34Å; K1417-T1419 PolarHBondContact O-N 2.84Å
1418	T	27.1	Very low	39	Very low	152 Å²	152	103.9 Å²	103.9	93%	0.933	55%	0.553	S	S	*	*			trans	-81.2	75.3	175.6	49.6	0	0	0	0	110.9
1419	T	32.8	Very low	40.1	Very low	87 Å²	87	105.2 Å²	105.2	53%	0.534	55%	0.547	S	S	.	.			trans	-135	129.8	176.9	48.6	0	0	0	0	111.8	K1417 T1421	K1417-T1419 VanDerWaalsContact C-N 3.34Å; K1417-T1419 PolarHBondContact O-N 2.84Å; T1419-T1421 PolarHBondContact O-N 3.01Å; T1419-T1421 PolarHBondContact OG1-OG1 3.33Å
1420	T	38.1	Very low	41.3	Very low	129 Å²	129	100.7 Å²	100.7	79%	0.791	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	23.4	-177.9	34.9	0	0	0	0	115
1421	T	37.2	Very low	42.6	Very low	88 Å²	88	97.9 Å²	97.9	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-81.4	-36.8	-167	45.2	0	0	0	0	114.6	T1419 T1423 S1424	T1419-T1421 PolarHBondContact O-N 3.01Å; T1419-T1421 PolarHBondContact OG1-OG1 3.33Å; T1421-T1423 PolarHBondContact O-N 3.36Å; T1421-S1424 WeakPolarHBondContact O-CB 3.36Å; T1421-S1424 PolarHBondContact O-N 3.44Å
1422	G	32.5	Very low	44.2	Very low	30 Å²	30	96 Å²	96	31%	0.309	50%	0.499	S	S	.	.	H	α-helix	trans	-61.9	-45.5	-174	0	0	0	0	0	113.3	S1424 I1425	G1422-S1424 VanDerWaalsContact C-N 3.27Å; G1422-S1424 PolarHBondContact O-N 2.82Å; G1422-I1425 WeakPolarHBondContact O-CB 3.35Å; G1422-I1425 PolarHBondContact O-N 3.37Å; G1422-I1425 VanDerWaalsContact O-N 3.07Å
1423	T	39.7	Very low	45.6	Very low	51 Å²	51	92.5 Å²	92.5	31%	0.313	47%	0.473	S	S	.	.	H	α-helix	trans	-65.9	-28.3	-178.3	50.9	0	0	0	0	112.8	Y1349 T1421 I1425 Y1426 W1427	Y1349-T1423 HydrophobicContact CD2-CG2 4.48Å; Y1349-T1423 HydrophobicContact CE2-CG2 3.53Å; T1421-T1423 PolarHBondContact O-N 3.36Å; T1423-I1425 VanDerWaalsContact C-N 3.28Å; T1423-I1425 PolarHBondContact O-N 3.1Å; T1423-Y1426 PolarHBondContact O-N 2.97Å; T1423-W1427 PolarHBondContact O-N 3.13Å
1424	S	51.7	Low	47.2	Very low	46 Å²	46	87.7 Å²	87.7	32%	0.322	45%	0.451	S	S	.	.	H	α-helix	trans	-60.8	-33.9	172.9	-174.4	0	0	0	0	112.9	T1421 G1422 R1428	T1421-S1424 WeakPolarHBondContact O-CB 3.36Å; T1421-S1424 PolarHBondContact O-N 3.44Å; G1422-S1424 VanDerWaalsContact C-N 3.27Å; G1422-S1424 PolarHBondContact O-N 2.82Å; S1424-R1428 WeakPolarHBondContact O-CB 3.44Å; S1424-R1428 PolarHBondContact O-N 3.4Å; S1424-R1428 PolarHBondContact OG-NE 2.98Å; S1424-R1428 PolarHBondContact OG-NH2 3.07Å
1425	I	53.2	Low	49.1	Very low	45 Å²	45	82.5 Å²	82.5	23%	0.231	42%	0.423	C	S	.	.	H	α-helix	trans	-71.4	-42	-176.8	-58.3	173.7	0	0	0	110.7	G1422 T1423 R1428 R1429	G1422-I1425 WeakPolarHBondContact O-CB 3.35Å; G1422-I1425 PolarHBondContact O-N 3.37Å; G1422-I1425 VanDerWaalsContact O-N 3.07Å; T1423-I1425 VanDerWaalsContact C-N 3.28Å; T1423-I1425 PolarHBondContact O-N 3.1Å; I1425-R1428 PolarHBondContact O-N 2.94Å; I1425-R1429 WeakPolarHBondContact O-CG 3.31Å; I1425-R1429 PolarHBondContact O-N 2.91Å
1426	Y	53.6	Low	51.2	Low	49 Å²	49	72 Å²	72	19%	0.192	39%	0.386	C	S	.	.	H	α-helix	trans	-62	-47.2	175.9	173.8	-95.6	0	0	0	111.6	A1345 V1403 T1423 R1429 M1430	A1345-Y1426 HydrophobicContact CB-CE1 4.38Å; V1403-Y1426 HydrophobicContact CG2-CE2 4.33Å; V1403-Y1426 VanDerWaalsContact CG2-OH 3.31Å; V1403-Y1426 WeakPolarHBondContact CG2-OH 3.1Å; T1423-Y1426 PolarHBondContact O-N 2.97Å; Y1426-R1429 PolarHBondContact O-N 3.01Å; Y1426-M1430 HydrophobicContact CE2-CE 4.06Å; Y1426-M1430 PolarHBondContact O-N 3.41Å; Y1426-M1430 VanDerWaalsContact OH-CE 3.31Å; Y1426-M1430 WeakPolarHBondContact OH-CE 3.16Å
1427	W	54.8	Low	53.1	Low	65 Å²	65	65.3 Å²	65.3	25%	0.246	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-41.7	177.5	-69.9	118.8	0	0	0	112.4	A1345 L1346 T1423 R1429 M1430 S1431	A1345-W1427 HydrophobicContact CB-CH2 4.25Å; L1346-W1427 HydrophobicContact CB-CH2 3.71Å; L1346-W1427 HydrophobicContact CB-CZ2 4.13Å; L1346-W1427 HydrophobicContact CD1-CH2 4Å; L1346-W1427 HydrophobicContact CD1-CZ2 3.67Å; L1346-W1427 HydrophobicContact CG-CH2 4.45Å; T1423-W1427 PolarHBondContact O-N 3.13Å; W1427-R1429 PolarHBondContact O-N 2.66Å; W1427-M1430 PolarHBondContact O-N 3.49Å; W1427-S1431 PolarHBondContact O-N 3.15Å
1428	R	59.1	Low	55.1	Low	75 Å²	75	57.9 Å²	57.9	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-56.4	-48.8	171.7	-91.3	-178.3	-94.9	-179.1	-21.3	112.3	D1020 S1424 I1425 M1430 S1431 R1432	D1020-R1428 IonicContact OD2-CZ 3.88Å; D1020-R1428 IonicContact OD2-NE 3.69Å; D1020-R1428 IonicContact OD2-NH1 2.65Å; D1020-R1428 PolarHBondContact OD2-NH1 2.77Å; S1424-R1428 WeakPolarHBondContact O-CB 3.44Å; S1424-R1428 PolarHBondContact O-N 3.4Å; S1424-R1428 PolarHBondContact OG-NE 2.98Å; S1424-R1428 PolarHBondContact OG-NH2 3.07Å; I1425-R1428 PolarHBondContact O-N 2.94Å; R1428-M1430 VanDerWaalsContact C-N 3.3Å; R1428-M1430 PolarHBondContact O-N 3.15Å; R1428-S1431 PolarHBondContact O-N 3.33Å; R1428-R1432 WeakPolarHBondContact O-CG 3.49Å; R1428-R1432 PolarHBondContact O-N 2.99Å; R1428-R1432 VanDerWaalsContact O-N 3.11Å
1429	R	62.6	Low	57.6	Low	104 Å²	104	51.2 Å²	51.2	39%	0.392	28%	0.277	S	S	.	.	H	α-helix	trans	-57.8	-43.5	176.2	-75	179.1	177.2	-179.4	1.2	111.3	G1019 H1406 I1425 Y1426 W1427 R1432 V1433	G1019-R1429 PolarHBondContact O-NH2 3.25Å; H1406-R1429 PolarHBondContact NE2-NH1 2.75Å; I1425-R1429 WeakPolarHBondContact O-CG 3.31Å; I1425-R1429 PolarHBondContact O-N 2.91Å; Y1426-R1429 PolarHBondContact O-N 3.01Å; W1427-R1429 PolarHBondContact O-N 2.66Å; R1429-R1432 PolarHBondContact O-N 3.44Å; R1429-V1433 WeakPolarHBondContact O-CG2 3.21Å; R1429-V1433 PolarHBondContact O-N 2.76Å; R1429-V1433 VanDerWaalsContact O-N 3.16Å
1430	M	60.3	Low	59.8	Low	21 Å²	21	47.1 Å²	47.1	10%	0.103	25%	0.252	C	S	.	.	H	α-helix	trans	-73.6	-24.9	-178.7	-157.6	62	75.3	0	0	113.9	L1338 Q1342 I1399 Y1426 W1427 R1428 V1433 A1434	L1338-M1430 HydrophobicContact CD1-SD 4.48Å; Q1342-M1430 HydrophobicContact CG-CG 3.49Å; Q1342-M1430 VanDerWaalsContact CG-CG 3.49Å; Q1342-M1430 PolarHBondContact NE2-O 3.2Å; I1399-M1430 HydrophobicContact CG2-CE 4.22Å; Y1426-M1430 HydrophobicContact CE2-CE 4.06Å; Y1426-M1430 PolarHBondContact O-N 3.41Å; Y1426-M1430 VanDerWaalsContact OH-CE 3.31Å; Y1426-M1430 WeakPolarHBondContact OH-CE 3.16Å; W1427-M1430 PolarHBondContact O-N 3.49Å; R1428-M1430 VanDerWaalsContact C-N 3.3Å; R1428-M1430 PolarHBondContact O-N 3.15Å; M1430-V1433 HydrophobicContact SD-CB 4.4Å; M1430-V1433 HydrophobicContact SD-CG2 4.45Å; M1430-A1434 PolarHBondContact O-N 3.47Å
1431	S	63.7	Low	61.5	Low	60 Å²	60	41.7 Å²	41.7	42%	0.42	22%	0.218	S	C	.	.	H	α-helix	trans	-65.5	-52.2	166.3	-170.2	0	0	0	0	110.5	W1427 R1428 V1433 A1434 D1435	W1427-S1431 PolarHBondContact O-N 3.15Å; R1428-S1431 PolarHBondContact O-N 3.33Å; S1431-V1433 PolarHBondContact O-N 3.05Å; S1431-V1433 VanDerWaalsContact O-N 3.1Å; S1431-A1434 CarbonylContact O-C 3.46Å; S1431-A1434 WeakPolarHBondContact O-CA 3.27Å; S1431-A1434 WeakPolarHBondContact O-CB 3.48Å; S1431-A1434 PolarHBondContact O-N 3.24Å; S1431-D1435 VanDerWaalsContact C-OD2 3.22Å; S1431-D1435 PolarHBondContact O-N 2.83Å; S1431-D1435 PolarHBondContact OG-OD2 3.38Å
1432	R	68.7	Low	63.2	Low	84 Å²	84	38.2 Å²	38.2	32%	0.317	20%	0.195	S	C	.	.	H	α-helix	trans	-55.2	-34.7	179.8	-63.6	-178.3	-161.2	-172	2.1	113.1	D1020 D1021 R1428 R1429 D1435 N1436	D1020-R1432 IonicContact OD1-NH2 3.29Å; D1020-R1432 PolarHBondContact OD1-NH2 3.44Å; D1020-R1432 IonicContact OD2-NH2 2.86Å; D1021-R1432 VanDerWaalsContact CG-NH1 3.28Å; D1021-R1432 IonicContact OD1-CZ 2.78Å; D1021-R1432 IonicContact OD1-NH1 3.79Å; D1021-R1432 PolarHBondContact OD1-NH1 2.69Å; D1021-R1432 IonicContact OD1-NH2 2.76Å; D1021-R1432 PolarHBondContact OD1-NH2 3.06Å; D1021-R1432 IonicContact OD2-NH1 3.83Å; D1021-R1432 PolarHBondContact OD2-NH1 3.19Å; D1021-R1432 VanDerWaalsContact OD2-NH1 3.08Å; R1428-R1432 WeakPolarHBondContact O-CG 3.49Å; R1428-R1432 PolarHBondContact O-N 2.99Å; R1428-R1432 VanDerWaalsContact O-N 3.11Å; R1429-R1432 PolarHBondContact O-N 3.44Å; R1432-D1435 PolarHBondContact O-N 3.5Å; R1432-N1436 VanDerWaalsContact O-CB 3.25Å; R1432-N1436 WeakPolarHBondContact O-CB 3.23Å; R1432-N1436 PolarHBondContact O-N 3.06Å; R1432-N1436 PolarHBondContact O-OD1 3Å
1433	V	66.5	Low	65.2	Low	19 Å²	19	36.9 Å²	36.9	12%	0.115	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-47.8	172.4	172.7	0	0	0	0	110.9	V1093 V1095 L1338 R1429 M1430 S1431 V1437	V1093-V1433 HydrophobicContact CG1-CG1 3.77Å; V1095-V1433 HydrophobicContact CG2-CG1 4.19Å; L1338-V1433 HydrophobicContact CD1-CG1 3.83Å; L1338-V1433 HydrophobicContact CD2-CG1 4.05Å; R1429-V1433 WeakPolarHBondContact O-CG2 3.21Å; R1429-V1433 PolarHBondContact O-N 2.76Å; R1429-V1433 VanDerWaalsContact O-N 3.16Å; M1430-V1433 HydrophobicContact SD-CB 4.4Å; M1430-V1433 HydrophobicContact SD-CG2 4.45Å; S1431-V1433 PolarHBondContact O-N 3.05Å; S1431-V1433 VanDerWaalsContact O-N 3.1Å; V1433-V1437 VanDerWaalsContact O-CG2 3.29Å; V1433-V1437 WeakPolarHBondContact O-CG2 3.42Å; V1433-V1437 PolarHBondContact O-N 3.19Å; V1433-V1437 VanDerWaalsContact O-N 3.07Å
1434	A	65.7	Low	66.6	Low	21 Å²	21	34.5 Å²	34.5	17%	0.174	17%	0.166	C	C	.	.	H	α-helix	trans	-68.9	-38	178	0	0	0	0	0	113.1	L1338 M1430 S1431 T1438	L1338-A1434 VanDerWaalsContact CD2-CA 3.49Å; L1338-A1434 HydrophobicContact CD2-CB 3.58Å; M1430-A1434 PolarHBondContact O-N 3.47Å; S1431-A1434 CarbonylContact O-C 3.46Å; S1431-A1434 WeakPolarHBondContact O-CA 3.27Å; S1431-A1434 WeakPolarHBondContact O-CB 3.48Å; S1431-A1434 PolarHBondContact O-N 3.24Å; A1434-T1438 VanDerWaalsContact O-CB 3.29Å; A1434-T1438 WeakPolarHBondContact O-CB 3.37Å; A1434-T1438 PolarHBondContact O-N 2.84Å; A1434-T1438 PolarHBondContact O-OG1 3.03Å
1435	D	69.6	Low	67.4	Low	31 Å²	31	34.1 Å²	34.1	17%	0.166	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-44.7	176.3	-64.9	-50.1	0	0	0	110.9	L881 S1431 R1432 T1438 W1439	L881-D1435 HydrophobicContact CD2-CB 4.17Å; S1431-D1435 VanDerWaalsContact C-OD2 3.22Å; S1431-D1435 PolarHBondContact O-N 2.83Å; S1431-D1435 PolarHBondContact OG-OD2 3.38Å; R1432-D1435 PolarHBondContact O-N 3.5Å; D1435-T1438 WeakPolarHBondContact O-CB 3.41Å; D1435-T1438 PolarHBondContact O-N 3.06Å; D1435-W1439 WeakPolarHBondContact O-CB 3.22Å; D1435-W1439 PolarHBondContact O-N 3.44Å
1436	N	77	Confident	68	Low	36 Å²	36	32 Å²	32	19%	0.193	15%	0.151	C	C	.	.	H	α-helix	trans	-68.2	-38.5	177.9	-71.4	2.5	0	0	0	112.5	K1091 K1092 V1093 R1432 T1438 N1440	K1091-N1436 HydrophobicContact CB-CB 4Å; K1091-N1436 HydrophobicContact CD-CB 4.4Å; K1091-N1436 VanDerWaalsContact CD-OD1 3.28Å; K1091-N1436 WeakPolarHBondContact CD-OD1 3.25Å; K1092-N1436 PolarHBondContact O-ND2 3.32Å; V1093-N1436 HydrophobicContact CG2-CB 4.35Å; R1432-N1436 VanDerWaalsContact O-CB 3.25Å; R1432-N1436 WeakPolarHBondContact O-CB 3.23Å; R1432-N1436 PolarHBondContact O-N 3.06Å; R1432-N1436 PolarHBondContact O-OD1 3Å; N1436-T1438 VanDerWaalsContact C-N 3.33Å; N1436-N1440 WeakPolarHBondContact O-CB 2.82Å; N1436-N1440 PolarHBondContact O-N 2.81Å; N1436-N1440 PolarHBondContact O-ND2 3.4Å; N1436-N1440 PolarHBondContact O-OD1 3.24Å
1437	V	70.9	Confident	68.6	Low	3 Å²	3	30.1 Å²	30.1	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-43.3	170.7	169.8	0	0	0	0	110.7	V1093 F1098 F1102 V1433 N1440 L1441	V1093-V1437 HydrophobicContact CB-CG2 4.37Å; V1093-V1437 HydrophobicContact CG1-CG2 3.62Å; V1093-V1437 HydrophobicContact CG2-CG2 3.74Å; F1098-V1437 HydrophobicContact CD1-CG2 4.25Å; F1098-V1437 HydrophobicContact CE1-CG2 4.37Å; F1098-V1437 HydrophobicContact CG-CG2 4.42Å; F1102-V1437 HydrophobicContact CE2-CG2 4.32Å; V1433-V1437 VanDerWaalsContact O-CG2 3.29Å; V1433-V1437 WeakPolarHBondContact O-CG2 3.42Å; V1433-V1437 PolarHBondContact O-N 3.19Å; V1433-V1437 VanDerWaalsContact O-N 3.07Å; V1437-N1440 PolarHBondContact O-N 3.03Å; V1437-L1441 HydrophobicContact CG1-CD1 3.99Å; V1437-L1441 WeakPolarHBondContact O-CG 3.31Å; V1437-L1441 PolarHBondContact O-N 2.8Å
1438	T	71.8	Confident	69	Low	19 Å²	19	27.8 Å²	27.8	12%	0.117	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-45.8	179.7	-66.2	0	0	0	0	112.1	R1335 A1434 D1435 N1436 L1441 R1442	R1335-T1438 PolarHBondContact NH2-OG1 3.37Å; A1434-T1438 VanDerWaalsContact O-CB 3.29Å; A1434-T1438 WeakPolarHBondContact O-CB 3.37Å; A1434-T1438 PolarHBondContact O-N 2.84Å; A1434-T1438 PolarHBondContact O-OG1 3.03Å; D1435-T1438 WeakPolarHBondContact O-CB 3.41Å; D1435-T1438 PolarHBondContact O-N 3.06Å; N1436-T1438 VanDerWaalsContact C-N 3.33Å; T1438-L1441 PolarHBondContact O-N 3.45Å; T1438-R1442 WeakPolarHBondContact O-CB 3.02Å; T1438-R1442 PolarHBondContact O-N 3.4Å
1439	W	80.2	Confident	69.3	Low	13 Å²	13	28 Å²	28	5%	0.049	14%	0.141	C	C	.	.	H	α-helix	trans	-56.3	-49.7	174	176.7	-103.1	0	0	0	111.6	E964 I965 H966 C972 A973 E974 K1091 D1435 L1441 R1442 L1443	E964-W1439 HydrophobicContact CB-CH2 4.35Å; I965-W1439 VanDerWaalsContact O-CH2 3.31Å; I965-W1439 WeakPolarHBondContact O-CH2 3.48Å; H966-W1439 AromaticContact CE1-CE3 3.72Å; H966-W1439 AromaticContact CE1-CZ3 3.45Å; H966-W1439 VanDerWaalsContact CE1-CZ3 3.45Å; H966-W1439 WeakPolarHBondContact CE1-CZ3 3.44Å; H966-W1439 AromaticContact ND1-CZ3 3.66Å; H966-W1439 AromaticContact NE2-CZ3 3.76Å; C972-W1439 HydrophobicContact CB-CH2 4.24Å; C972-W1439 HydrophobicContact CB-CZ3 4.32Å; A973-W1439 WeakPolarHBondContact O-CH2 3.47Å; E974-W1439 HydrophobicContact CB-CZ2 3.69Å; E974-W1439 PolarHBondContact OE2-NE1 3.29Å; K1091-W1439 HydrophobicContact CD-CB 4.39Å; K1091-W1439 VanDerWaalsContact CD-CD1 3.46Å; K1091-W1439 HydrophobicContact CD-CG 3.95Å; K1091-W1439 VanDerWaalsContact CG-CD1 3.5Å; K1091-W1439 HydrophobicContact CG-CG 4.43Å; D1435-W1439 WeakPolarHBondContact O-CB 3.22Å; D1435-W1439 PolarHBondContact O-N 3.44Å; W1439-L1441 PolarHBondContact O-N 2.82Å; W1439-R1442 PolarHBondContact O-N 3.19Å; W1439-L1443 WeakPolarHBondContact O-CB 3.4Å; W1439-L1443 PolarHBondContact O-N 3.48Å
1440	N	78.6	Confident	69.3	Low	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-43.9	179.4	-73.4	-5.7	0	0	0	112.5	L1090 K1091 F1102 N1436 V1437 L1444	L1090-N1440 WeakPolarHBondContact CA-OD1 3.38Å; L1090-N1440 HydrophobicContact CD2-CB 3.79Å; K1091-N1440 PolarHBondContact N-OD1 2.99Å; K1091-N1440 PolarHBondContact O-ND2 3.21Å; F1102-N1440 HydrophobicContact CD1-CB 3.88Å; F1102-N1440 HydrophobicContact CD2-CB 4.42Å; F1102-N1440 WeakPolarHBondContact CD2-ND2 3.45Å; F1102-N1440 HydrophobicContact CE1-CB 3.58Å; F1102-N1440 HydrophobicContact CE2-CB 4.16Å; F1102-N1440 HydrophobicContact CG-CB 4.29Å; F1102-N1440 HydrophobicContact CZ-CB 3.74Å; N1436-N1440 WeakPolarHBondContact O-CB 2.82Å; N1436-N1440 PolarHBondContact O-N 2.81Å; N1436-N1440 PolarHBondContact O-ND2 3.4Å; N1436-N1440 PolarHBondContact O-OD1 3.24Å; V1437-N1440 PolarHBondContact O-N 3.03Å; N1440-L1444 WeakPolarHBondContact O-CB 3.4Å; N1440-L1444 VanDerWaalsContact O-CG 3.24Å; N1440-L1444 WeakPolarHBondContact O-CG 3.31Å; N1440-L1444 PolarHBondContact O-N 2.79Å
1441	L	73.2	Confident	69.3	Low	16 Å²	16	23.7 Å²	23.7	8%	0.084	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-43.7	176.4	-71.6	170.6	0	0	0	111.6	L1327 I1328 V1437 T1438 W1439 L1444 T1445	L1327-L1441 HydrophobicContact CG-CD2 4.38Å; I1328-L1441 HydrophobicContact CG1-CD2 4.2Å; V1437-L1441 HydrophobicContact CG1-CD1 3.99Å; V1437-L1441 WeakPolarHBondContact O-CG 3.31Å; V1437-L1441 PolarHBondContact O-N 2.8Å; T1438-L1441 PolarHBondContact O-N 3.45Å; W1439-L1441 PolarHBondContact O-N 2.82Å; L1441-L1444 PolarHBondContact O-N 2.78Å; L1441-T1445 PolarHBondContact O-N 2.95Å; L1441-T1445 PolarHBondContact O-OG1 3.34Å; L1441-T1445 VanDerWaalsContact O-OG1 3.04Å
1442	R	72.8	Confident	69.4	Low	15 Å²	15	22.3 Å²	22.3	6%	0.057	12%	0.115	C	C	.	.	H	α-helix	trans	-67.1	-39	178.9	-179.6	156.3	157.5	-176.1	-18.6	112.9	N860 L862 D863 G967 P969 C972 T1438 W1439 L1444 T1445 G1446	N860-R1442 PolarHBondContact ND2-NH1 2.75Å; N860-R1442 PolarHBondContact OD1-NH1 2.81Å; L862-R1442 VanDerWaalsContact CB-NH2 3.3Å; D863-R1442 WeakPolarHBondContact OD1-CD 3Å; D863-R1442 IonicContact OD1-CZ 3.88Å; D863-R1442 IonicContact OD1-NE 2.61Å; D863-R1442 IonicContact OD1-NH1 2.94Å; D863-R1442 PolarHBondContact OD1-NH1 2.72Å; D863-R1442 IonicContact OD2-NH1 3.85Å; G967-R1442 PolarHBondContact O-NE 2.96Å; G967-R1442 PolarHBondContact O-NH2 3.06Å; P969-R1442 HydrophobicContact CB-CG 4.23Å; P969-R1442 HydrophobicContact CG-CG 4.44Å; C972-R1442 PolarHBondContact SG-NE 3.49Å; T1438-R1442 WeakPolarHBondContact O-CB 3.02Å; T1438-R1442 PolarHBondContact O-N 3.4Å; W1439-R1442 PolarHBondContact O-N 3.19Å; R1442-L1444 VanDerWaalsContact C-N 3.34Å; R1442-L1444 PolarHBondContact O-N 2.91Å; R1442-T1445 PolarHBondContact O-N 2.96Å; R1442-G1446 PolarHBondContact O-N 3.2Å
1443	L	74.8	Confident	69	Low	2 Å²	2	22.4 Å²	22.4	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-42.9	172.7	-165.5	71.3	0	0	0	111.4	C972 L1088 L1090 W1439 Q1447	C972-L1443 HydrophobicContact CB-CD1 4.35Å; C972-L1443 WeakPolarHBondContact O-CD1 3.22Å; L1088-L1443 HydrophobicContact CD2-CD1 3.88Å; L1088-L1443 HydrophobicContact CD2-CD2 4.2Å; L1088-L1443 HydrophobicContact CD2-CG 4Å; L1090-L1443 HydrophobicContact CD2-CB 4.25Å; L1090-L1443 HydrophobicContact CD2-CD2 3.75Å; L1090-L1443 HydrophobicContact CD2-CG 4.48Å; L1090-L1443 HydrophobicContact CG-CD2 4.5Å; W1439-L1443 WeakPolarHBondContact O-CB 3.4Å; W1439-L1443 PolarHBondContact O-N 3.48Å; L1443-Q1447 WeakPolarHBondContact O-CG 3.49Å; L1443-Q1447 PolarHBondContact O-N 3.39Å; L1443-Q1447 VanDerWaalsContact O-N 3.07Å
1444	L	69.2	Low	68.7	Low	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-66.6	-39.1	175.6	-71.3	169.1	0	0	0	112.5	L1090 F1102 T1105 L1109 L1327 I1328 N1440 L1441 R1442 T1448	L1090-L1444 HydrophobicContact CD1-CD1 4.4Å; L1090-L1444 HydrophobicContact CD1-CD2 4.33Å; L1090-L1444 HydrophobicContact CD1-CG 4.48Å; L1090-L1444 HydrophobicContact CD2-CD1 4.43Å; L1090-L1444 HydrophobicContact CD2-CD2 4.49Å; L1090-L1444 HydrophobicContact CD2-CG 4.07Å; F1102-L1444 HydrophobicContact CD1-CD1 4.19Å; F1102-L1444 HydrophobicContact CE1-CD1 4.07Å; T1105-L1444 HydrophobicContact CG2-CD1 4.01Å; T1105-L1444 HydrophobicContact CG2-CD2 3.51Å; T1105-L1444 HydrophobicContact CG2-CG 4.44Å; L1109-L1444 HydrophobicContact CD1-CD2 4.48Å; L1109-L1444 HydrophobicContact CD2-CD2 4Å; L1327-L1444 HydrophobicContact CD2-CD1 4.11Å; I1328-L1444 HydrophobicContact CD1-CB 4.22Å; N1440-L1444 WeakPolarHBondContact O-CB 3.4Å; N1440-L1444 VanDerWaalsContact O-CG 3.24Å; N1440-L1444 WeakPolarHBondContact O-CG 3.31Å; N1440-L1444 PolarHBondContact O-N 2.79Å; L1441-L1444 PolarHBondContact O-N 2.78Å; R1442-L1444 VanDerWaalsContact C-N 3.34Å; R1442-L1444 PolarHBondContact O-N 2.91Å; L1444-T1448 VanDerWaalsContact O-CB 3.27Å; L1444-T1448 WeakPolarHBondContact O-CB 3.43Å; L1444-T1448 PolarHBondContact O-N 2.73Å; L1444-T1448 PolarHBondContact O-OG1 2.7Å
1445	T	69	Low	68.6	Low	37 Å²	37	22.6 Å²	22.6	23%	0.227	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-53.1	173.1	-61.1	0	0	0	0	110.8	P969 I1328 L1441 R1442 Q1447 T1448 E1449	P969-T1445 HydrophobicContact CB-CG2 4.22Å; P969-T1445 HydrophobicContact CG-CG2 4.38Å; I1328-T1445 WeakPolarHBondContact CD1-OG1 3.49Å; L1441-T1445 PolarHBondContact O-N 2.95Å; L1441-T1445 PolarHBondContact O-OG1 3.34Å; L1441-T1445 VanDerWaalsContact O-OG1 3.04Å; R1442-T1445 PolarHBondContact O-N 2.96Å; T1445-Q1447 VanDerWaalsContact C-N 3.35Å; T1445-Q1447 PolarHBondContact O-N 2.87Å; T1445-T1448 CarbonylContact O-C 3.56Å; T1445-T1448 WeakPolarHBondContact O-CA 3.22Å; T1445-T1448 WeakPolarHBondContact O-CB 3.47Å; T1445-T1448 PolarHBondContact O-N 2.73Å; T1445-E1449 HydrophobicContact CG2-CG 4.4Å; T1445-E1449 WeakPolarHBondContact CG2-OE1 3.37Å; T1445-E1449 WeakPolarHBondContact O-CG 3.4Å; T1445-E1449 PolarHBondContact O-N 2.73Å
1446	G	65.6	Low	68.3	Low	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-37.9	-178.1	0	0	0	0	0	114.5	P969 R1442 L1450	P969-G1446 VanDerWaalsContact CB-CA 3.47Å; P969-G1446 WeakPolarHBondContact O-CA 3.37Å; R1442-G1446 PolarHBondContact O-N 3.2Å; G1446-L1450 WeakPolarHBondContact O-CB 3.47Å; G1446-L1450 WeakPolarHBondContact O-CG 3.45Å; G1446-L1450 PolarHBondContact O-N 3.39Å; G1446-L1450 VanDerWaalsContact O-N 3.1Å
1447	Q	66.9	Low	67.5	Low	10 Å²	10	26.9 Å²	26.9	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-68.6	-42.5	170.2	-63.7	-49	-55.7	0	0	111.3	L1088 L1109 L1443 T1445 E1449 L1450 M1451	L1088-Q1447 HydrophobicContact CD1-CG 3.83Å; L1088-Q1447 HydrophobicContact CD2-CG 3.61Å; L1088-Q1447 HydrophobicContact CG-CG 4.38Å; L1109-Q1447 HydrophobicContact CD1-CB 3.79Å; L1109-Q1447 HydrophobicContact CD1-CG 4.11Å; L1443-Q1447 WeakPolarHBondContact O-CG 3.49Å; L1443-Q1447 PolarHBondContact O-N 3.39Å; L1443-Q1447 VanDerWaalsContact O-N 3.07Å; T1445-Q1447 VanDerWaalsContact C-N 3.35Å; T1445-Q1447 PolarHBondContact O-N 2.87Å; Q1447-E1449 VanDerWaalsContact C-N 3.28Å; Q1447-E1449 PolarHBondContact O-N 3.04Å; Q1447-L1450 PolarHBondContact O-N 3.07Å; Q1447-M1451 WeakPolarHBondContact O-CB 3.44Å; Q1447-M1451 WeakPolarHBondContact O-CG 3.23Å; Q1447-M1451 PolarHBondContact O-N 3.42Å
1448	T	63.6	Low	67	Low	16 Å²	16	27.6 Å²	27.6	10%	0.098	14%	0.143	C	C	.	.	H	α-helix	trans	-57.7	-38.7	175.9	-60	0	0	0	0	112.5	I1321 K1325 L1444 T1445 M1451 T1452	I1321-T1448 HydrophobicContact CG1-CG2 4.25Å; I1321-T1448 HydrophobicContact CG2-CG2 4.03Å; K1325-T1448 HydrophobicContact CG-CG2 4.2Å; L1444-T1448 VanDerWaalsContact O-CB 3.27Å; L1444-T1448 WeakPolarHBondContact O-CB 3.43Å; L1444-T1448 PolarHBondContact O-N 2.73Å; L1444-T1448 PolarHBondContact O-OG1 2.7Å; T1445-T1448 CarbonylContact O-C 3.56Å; T1445-T1448 WeakPolarHBondContact O-CA 3.22Å; T1445-T1448 WeakPolarHBondContact O-CB 3.47Å; T1445-T1448 PolarHBondContact O-N 2.73Å; T1448-M1451 PolarHBondContact O-N 2.7Å; T1448-T1452 WeakPolarHBondContact O-CB 3.27Å; T1448-T1452 PolarHBondContact O-N 2.63Å; T1448-T1452 PolarHBondContact O-OG1 3.49Å
1449	E	64.7	Low	66.7	Low	80 Å²	80	30.6 Å²	30.6	37%	0.374	16%	0.159	S	C	.	.	H	α-helix	trans	-64.9	-58	175	-71.9	168.2	175.8	0	0	112	T1445 Q1447 M1451 T1452 L1453	T1445-E1449 HydrophobicContact CG2-CG 4.4Å; T1445-E1449 WeakPolarHBondContact CG2-OE1 3.37Å; T1445-E1449 WeakPolarHBondContact O-CG 3.4Å; T1445-E1449 PolarHBondContact O-N 2.73Å; Q1447-E1449 VanDerWaalsContact C-N 3.28Å; Q1447-E1449 PolarHBondContact O-N 3.04Å; E1449-M1451 PolarHBondContact O-N 3.39Å; E1449-T1452 PolarHBondContact O-N 2.79Å; E1449-L1453 WeakPolarHBondContact O-CG 3.28Å; E1449-L1453 PolarHBondContact O-N 3.44Å
1450	L	61.9	Low	65.9	Low	31 Å²	31	33.1 Å²	33.1	16%	0.162	17%	0.171	C	C	.	.	H	α-helix	trans	-49.7	-30.6	174.5	-79.6	173	0	0	0	113.1	V970 R1116 G1446 Q1447 L1454	V970-L1450 HydrophobicContact CB-CD1 4.23Å; V970-L1450 HydrophobicContact CB-CD2 4.2Å; V970-L1450 HydrophobicContact CB-CG 3.98Å; V970-L1450 HydrophobicContact CG2-CD1 3.8Å; V970-L1450 HydrophobicContact CG2-CD2 3.47Å; V970-L1450 VanDerWaalsContact CG2-CD2 3.47Å; V970-L1450 HydrophobicContact CG2-CG 3.69Å; R1116-L1450 VanDerWaalsContact NH1-CD1 3.3Å; G1446-L1450 WeakPolarHBondContact O-CB 3.47Å; G1446-L1450 WeakPolarHBondContact O-CG 3.45Å; G1446-L1450 PolarHBondContact O-N 3.39Å; G1446-L1450 VanDerWaalsContact O-N 3.1Å; Q1447-L1450 PolarHBondContact O-N 3.07Å; L1450-L1454 PolarHBondContact O-N 3.19Å
1451	M	61.9	Low	65.1	Low	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-93.9	-30.8	-170.7	-69.4	-76.2	21.1	0	0	112.7	V1112 R1116 F1317 I1321 Q1447 T1448 E1449 L1453 L1454 L1455	V1112-M1451 HydrophobicContact CG1-CG 4.24Å; V1112-M1451 HydrophobicContact CG1-SD 3.9Å; R1116-M1451 HydrophobicContact CB-CE 3.61Å; R1116-M1451 HydrophobicContact CB-SD 3.68Å; R1116-M1451 WeakPolarHBondContact CD-SD 3.47Å; R1116-M1451 HydrophobicContact CG-CE 3.97Å; R1116-M1451 HydrophobicContact CG-SD 4.06Å; F1317-M1451 HydrophobicContact CE1-CB 3.6Å; F1317-M1451 HydrophobicContact CE1-CE 3.69Å; F1317-M1451 HydrophobicContact CE1-CG 4.39Å; F1317-M1451 HydrophobicContact CE1-SD 4.4Å; F1317-M1451 HydrophobicContact CE2-CE 4Å; F1317-M1451 HydrophobicContact CE2-SD 4.26Å; F1317-M1451 HydrophobicContact CZ-CB 3.59Å; F1317-M1451 HydrophobicContact CZ-CE 3.14Å; F1317-M1451 HydrophobicContact CZ-CG 3.87Å; F1317-M1451 HydrophobicContact CZ-SD 3.5Å; F1317-M1451 WeakPolarHBondContact CZ-SD 3.3Å; I1321-M1451 HydrophobicContact CD1-CB 4.25Å; Q1447-M1451 WeakPolarHBondContact O-CB 3.44Å; Q1447-M1451 WeakPolarHBondContact O-CG 3.23Å; Q1447-M1451 PolarHBondContact O-N 3.42Å; T1448-M1451 PolarHBondContact O-N 2.7Å; E1449-M1451 PolarHBondContact O-N 3.39Å; M1451-L1453 VanDerWaalsContact C-N 3.34Å; M1451-L1454 HydrophobicContact CE-CB 3.71Å; M1451-L1454 HydrophobicContact CE-CD2 3.4Å; M1451-L1454 HydrophobicContact CE-CG 4.19Å; M1451-L1455 PolarHBondContact O-N 3.1Å
1452	T	64.1	Low	64.7	Low	32 Å²	32	35.1 Å²	35.1	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-65	-39.9	162.3	-53.6	0	0	0	0	110.6	T1448 E1449 L1454 L1455 N1456	T1448-T1452 WeakPolarHBondContact O-CB 3.27Å; T1448-T1452 PolarHBondContact O-N 2.63Å; T1448-T1452 PolarHBondContact O-OG1 3.49Å; E1449-T1452 PolarHBondContact O-N 2.79Å; T1452-L1454 PolarHBondContact O-N 3.26Å; T1452-L1455 PolarHBondContact O-N 3.47Å; T1452-N1456 PolarHBondContact O-N 2.95Å
1453	L	61.8	Low	64.4	Low	86 Å²	86	38 Å²	38	45%	0.45	19%	0.192	S	C	.	.	H	α-helix	trans	-60.4	-43.8	174.7	-73.1	170.9	0	0	0	112.1	E1449 M1451 L1455 N1456 E1457	E1449-L1453 WeakPolarHBondContact O-CG 3.28Å; E1449-L1453 PolarHBondContact O-N 3.44Å; M1451-L1453 VanDerWaalsContact C-N 3.34Å; L1453-L1455 VanDerWaalsContact C-N 3.33Å; L1453-L1455 PolarHBondContact O-N 3.28Å; L1453-N1456 PolarHBondContact O-N 2.92Å; L1453-E1457 WeakPolarHBondContact O-CG 3.4Å; L1453-E1457 PolarHBondContact O-N 3.04Å
1454	L	58.6	Low	64	Low	13 Å²	13	39.5 Å²	39.5	7%	0.068	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-39	176.3	-176	71.1	0	0	0	112.6	R1116 V1119 L1120 L1450 M1451 T1452 E1457 S1458	R1116-L1454 HydrophobicContact CB-CD2 3.88Å; R1116-L1454 HydrophobicContact CG-CD2 3.89Å; V1119-L1454 HydrophobicContact CB-CD2 4.38Å; V1119-L1454 HydrophobicContact CG1-CD1 4.36Å; V1119-L1454 HydrophobicContact CG1-CD2 4.34Å; L1120-L1454 HydrophobicContact CD1-CD1 4.23Å; L1120-L1454 HydrophobicContact CD2-CD1 3.46Å; L1120-L1454 VanDerWaalsContact CD2-CD1 3.46Å; L1120-L1454 HydrophobicContact CG-CD1 3.62Å; L1450-L1454 PolarHBondContact O-N 3.19Å; M1451-L1454 HydrophobicContact CE-CB 3.71Å; M1451-L1454 HydrophobicContact CE-CD2 3.4Å; M1451-L1454 HydrophobicContact CE-CG 4.19Å; T1452-L1454 PolarHBondContact O-N 3.26Å; L1454-E1457 PolarHBondContact O-N 3.24Å; L1454-S1458 VanDerWaalsContact O-CB 3.31Å; L1454-S1458 WeakPolarHBondContact O-CB 3.47Å; L1454-S1458 PolarHBondContact O-N 3.45Å; L1454-S1458 PolarHBondContact O-OG 2.98Å
1455	L	63.5	Low	63.8	Low	31 Å²	31	39.5 Å²	39.5	16%	0.162	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-46.9	177.6	-176.3	61	0	0	0	110.3	V1314 E1318 M1451 T1452 L1453 S1458 N1459	V1314-L1455 HydrophobicContact CG1-CD1 4.01Å; E1318-L1455 HydrophobicContact CG-CD2 4.2Å; M1451-L1455 PolarHBondContact O-N 3.1Å; T1452-L1455 PolarHBondContact O-N 3.47Å; L1453-L1455 VanDerWaalsContact C-N 3.33Å; L1453-L1455 PolarHBondContact O-N 3.28Å; L1455-S1458 PolarHBondContact O-N 3.16Å; L1455-N1459 VanDerWaalsContact O-CG 3.24Å; L1455-N1459 PolarHBondContact O-N 3.14Å; L1455-N1459 PolarHBondContact O-ND2 3.4Å
1456	N	64.4	Low	63.6	Low	44 Å²	44	40 Å²	40	24%	0.235	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-46.3	174.8	-69.6	-0.4	0	0	0	112.2	P914 T1452 L1453 S1458 N1459 E1460	P914-N1456 PolarHBondContact O-ND2 3.27Å; T1452-N1456 PolarHBondContact O-N 2.95Å; L1453-N1456 PolarHBondContact O-N 2.92Å; N1456-S1458 VanDerWaalsContact C-N 3.3Å; N1456-S1458 PolarHBondContact O-N 3.49Å; N1456-N1459 PolarHBondContact O-N 3.46Å; N1456-E1460 PolarHBondContact O-N 3.08Å
1457	E	60.7	Low	63.8	Low	113 Å²	113	44.1 Å²	44.1	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-57.5	-42.7	174.8	-78.5	-173.1	165.7	0	0	111.5	L1453 L1454 W1461	L1453-E1457 WeakPolarHBondContact O-CG 3.4Å; L1453-E1457 PolarHBondContact O-N 3.04Å; L1454-E1457 PolarHBondContact O-N 3.24Å; E1457-W1461 VanDerWaalsContact O-CB 3.29Å; E1457-W1461 WeakPolarHBondContact O-CB 3.4Å; E1457-W1461 PolarHBondContact O-N 3.36Å
1458	S	60.5	Low	63.8	Low	17 Å²	17	43.7 Å²	43.7	12%	0.119	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-40.4	-178.5	-57.3	0	0	0	0	112.1	L1454 L1455 N1456 W1461 I1462	L1454-S1458 VanDerWaalsContact O-CB 3.31Å; L1454-S1458 WeakPolarHBondContact O-CB 3.47Å; L1454-S1458 PolarHBondContact O-N 3.45Å; L1454-S1458 PolarHBondContact O-OG 2.98Å; L1455-S1458 PolarHBondContact O-N 3.16Å; N1456-S1458 VanDerWaalsContact C-N 3.3Å; N1456-S1458 PolarHBondContact O-N 3.49Å; S1458-W1461 PolarHBondContact O-N 2.86Å; S1458-I1462 WeakPolarHBondContact O-CG1 3.48Å; S1458-I1462 PolarHBondContact O-N 3.07Å
1459	N	65.2	Low	64	Low	83 Å²	83	43 Å²	43	44%	0.444	21%	0.211	S	C	.	.	H	α-helix	trans	-67.9	-42.2	178	-68.8	-14.6	0	0	0	111.8	L1455 N1456 I1462 K1463	L1455-N1459 VanDerWaalsContact O-CG 3.24Å; L1455-N1459 PolarHBondContact O-N 3.14Å; L1455-N1459 PolarHBondContact O-ND2 3.4Å; N1456-N1459 PolarHBondContact O-N 3.46Å; N1459-I1462 PolarHBondContact O-N 3.09Å; N1459-K1463 WeakPolarHBondContact O-CB 3.42Å; N1459-K1463 PolarHBondContact O-N 3.26Å
1460	E	62.8	Low	64.3	Low	65 Å²	65	45 Å²	45	30%	0.304	22%	0.22	S	C	.	.	H	α-helix	trans	-68.1	-33	172.4	-78.4	-68.3	159.8	0	0	112.3	N918 N1456 K1463 Q1464	N918-E1460 PolarHBondContact ND2-OE1 3.46Å; N918-E1460 PolarHBondContact ND2-OE2 2.91Å; N1456-E1460 PolarHBondContact O-N 3.08Å; E1460-K1463 VanDerWaalsContact CD-NZ 3.31Å; E1460-K1463 PolarHBondContact O-N 3.05Å; E1460-K1463 IonicContact OE1-NZ 3.98Å; E1460-K1463 PolarHBondContact OE1-NZ 3.36Å; E1460-K1463 IonicContact OE2-NZ 3.56Å; E1460-K1463 PolarHBondContact OE2-NZ 3.21Å; E1460-Q1464 WeakPolarHBondContact O-CB 3.17Å; E1460-Q1464 VanDerWaalsContact O-CG 3.31Å; E1460-Q1464 WeakPolarHBondContact O-CG 3.41Å; E1460-Q1464 PolarHBondContact O-N 3.19Å
1461	W	62.6	Low	64.9	Low	31 Å²	31	47.2 Å²	47.2	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-41.1	173.8	-155.9	90.5	0	0	0	112	F1123 F1126 M1139 M1172 P1173 E1457 S1458 A1465	F1123-W1461 HydrophobicContact CB-CZ2 4.27Å; F1123-W1461 AromaticContact CD1-CD2 3.61Å; F1123-W1461 HydrophobicContact CD1-CD2 3.61Å; F1123-W1461 AromaticContact CD1-CE2 3.52Å; F1123-W1461 AromaticContact CD1-CE3 3.71Å; F1123-W1461 HydrophobicContact CD1-CE3 3.71Å; F1123-W1461 HydrophobicContact CD1-CG 4.3Å; F1123-W1461 AromaticContact CD1-CH2 3.62Å; F1123-W1461 HydrophobicContact CD1-CH2 3.62Å; F1123-W1461 AromaticContact CD1-CZ2 3.53Å; F1123-W1461 HydrophobicContact CD1-CZ2 3.53Å; F1123-W1461 AromaticContact CD1-CZ3 3.71Å; F1123-W1461 HydrophobicContact CD1-CZ3 3.71Å; F1123-W1461 AromaticContact CE1-CD2 3.53Å; F1123-W1461 HydrophobicContact CE1-CD2 3.53Å; F1123-W1461 AromaticContact CE1-CE2 3.98Å; F1123-W1461 AromaticContact CE1-CE3 3.37Å; F1123-W1461 HydrophobicContact CE1-CE3 3.37Å; F1123-W1461 HydrophobicContact CE1-CG 4.09Å; F1123-W1461 HydrophobicContact CE1-CH2 4.09Å; F1123-W1461 HydrophobicContact CE1-CZ2 4.24Å; F1123-W1461 AromaticContact CE1-CZ3 3.66Å; F1123-W1461 HydrophobicContact CE1-CZ3 3.66Å; F1123-W1461 HydrophobicContact CG-CD2 4.39Å; F1123-W1461 HydrophobicContact CG-CZ2 4.22Å; F1123-W1461 HydrophobicContact CZ-CB 4.41Å; F1123-W1461 HydrophobicContact CZ-CD2 4.25Å; F1123-W1461 HydrophobicContact CZ-CE3 4.3Å; F1123-W1461 HydrophobicContact CZ-CG 4.35Å; F1126-W1461 HydrophobicContact CB-CH2 3.97Å; F1126-W1461 HydrophobicContact CB-CZ2 4.11Å; F1126-W1461 AromaticContact CD1-CH2 3.83Å; F1126-W1461 HydrophobicContact CD1-CH2 3.83Å; F1126-W1461 AromaticContact CD1-CZ2 3.74Å; F1126-W1461 HydrophobicContact CD1-CZ2 3.74Å; F1126-W1461 HydrophobicContact CD2-CH2 4.39Å; F1126-W1461 HydrophobicContact CE1-CH2 4.48Å; F1126-W1461 HydrophobicContact CE1-CZ2 4.5Å; F1126-W1461 AromaticContact CG-CH2 3.78Å; F1126-W1461 HydrophobicContact CG-CH2 3.78Å; F1126-W1461 HydrophobicContact CG-CZ2 4.05Å; M1139-W1461 HydrophobicContact CB-CD2 4.3Å; M1139-W1461 HydrophobicContact CB-CG 4.15Å; M1139-W1461 HydrophobicContact CE-CD2 4.17Å; M1139-W1461 HydrophobicContact CE-CE3 3.87Å; M1139-W1461 HydrophobicContact CE-CH2 3.23Å; M1139-W1461 HydrophobicContact CE-CZ2 3.54Å; M1139-W1461 HydrophobicContact CE-CZ3 3.4Å; M1139-W1461 VanDerWaalsContact CE-CZ3 3.4Å; M1139-W1461 HydrophobicContact CG-CD2 3.98Å; M1139-W1461 HydrophobicContact CG-CE3 4.42Å; M1139-W1461 HydrophobicContact CG-CG 4.29Å; M1139-W1461 HydrophobicContact CG-CZ2 4.37Å; M1139-W1461 HydrophobicContact SD-CD2 4.06Å; M1139-W1461 HydrophobicContact SD-CE3 4.37Å; M1139-W1461 HydrophobicContact SD-CH2 3.78Å; M1139-W1461 HydrophobicContact SD-CZ2 3.36Å; M1139-W1461 WeakPolarHBondContact SD-CZ2 3.36Å; M1139-W1461 HydrophobicContact SD-CZ3 4.26Å; M1172-W1461 HydrophobicContact CE-CE3 4.31Å; M1172-W1461 HydrophobicContact CE-CZ3 4.34Å; P1173-W1461 HydrophobicContact CG-CZ3 3.98Å; E1457-W1461 VanDerWaalsContact O-CB 3.29Å; E1457-W1461 WeakPolarHBondContact O-CB 3.4Å; E1457-W1461 PolarHBondContact O-N 3.36Å; S1458-W1461 PolarHBondContact O-N 2.86Å; W1461-A1465 VanDerWaalsContact O-CB 3.31Å; W1461-A1465 WeakPolarHBondContact O-CB 3.4Å; W1461-A1465 PolarHBondContact O-N 2.77Å
1462	I	63.3	Low	65.3	Low	28 Å²	28	48.1 Å²	48.1	14%	0.144	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-53.3	171.3	-73.3	165.3	0	0	0	110	E1171 M1172 S1458 N1459 A1465 K1466	E1171-I1462 HydrophobicContact CB-CG2 4.24Å; M1172-I1462 HydrophobicContact CE-CD1 4.04Å; M1172-I1462 HydrophobicContact CE-CG1 3.61Å; M1172-I1462 HydrophobicContact CG-CD1 4.2Å; M1172-I1462 HydrophobicContact CG-CG1 4.23Å; S1458-I1462 WeakPolarHBondContact O-CG1 3.48Å; S1458-I1462 PolarHBondContact O-N 3.07Å; N1459-I1462 PolarHBondContact O-N 3.09Å; I1462-A1465 WeakPolarHBondContact O-CA 3.42Å; I1462-A1465 WeakPolarHBondContact O-CB 3.27Å; I1462-A1465 PolarHBondContact O-N 2.83Å; I1462-A1465 VanDerWaalsContact O-N 3.07Å; I1462-K1466 WeakPolarHBondContact O-CG 3.34Å; I1462-K1466 PolarHBondContact O-N 3.23Å
1463	K	67.7	Low	65.6	Low	76 Å²	76	47.8 Å²	47.8	33%	0.33	25%	0.252	S	S	.	.	H	α-helix	trans	-57.3	-52.8	-179.1	173.4	178.2	151.6	-134.6	0	112.7	N918 N1459 E1460 A1465 K1466 E1467	N918-K1463 PolarHBondContact ND2-NZ 2.9Å; N1459-K1463 WeakPolarHBondContact O-CB 3.42Å; N1459-K1463 PolarHBondContact O-N 3.26Å; E1460-K1463 VanDerWaalsContact CD-NZ 3.31Å; E1460-K1463 PolarHBondContact O-N 3.05Å; E1460-K1463 IonicContact OE1-NZ 3.98Å; E1460-K1463 PolarHBondContact OE1-NZ 3.36Å; E1460-K1463 IonicContact OE2-NZ 3.56Å; E1460-K1463 PolarHBondContact OE2-NZ 3.21Å; K1463-A1465 PolarHBondContact O-N 2.9Å; K1463-K1466 PolarHBondContact O-N 3.1Å; K1463-E1467 WeakPolarHBondContact CE-OE1 3.28Å; K1463-E1467 VanDerWaalsContact CG-OE1 3.31Å; K1463-E1467 WeakPolarHBondContact CG-OE1 3.48Å; K1463-E1467 WeakPolarHBondContact O-CG 3.41Å; K1463-E1467 PolarHBondContact O-N 3.18Å
1464	Q	66	Low	65.9	Low	33 Å²	33	43.7 Å²	43.7	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-55.3	-38.2	174.5	-73.7	-176.6	20.1	0	0	111.7	M1139 N1140 E1460 K1466 E1467 S1468	M1139-Q1464 HydrophobicContact CB-CB 3.96Å; M1139-Q1464 HydrophobicContact CG-CB 4.47Å; N1140-Q1464 WeakPolarHBondContact OD1-CB 3.31Å; N1140-Q1464 PolarHBondContact OD1-O 3.25Å; E1460-Q1464 WeakPolarHBondContact O-CB 3.17Å; E1460-Q1464 VanDerWaalsContact O-CG 3.31Å; E1460-Q1464 WeakPolarHBondContact O-CG 3.41Å; E1460-Q1464 PolarHBondContact O-N 3.19Å; Q1464-K1466 PolarHBondContact O-N 3.18Å; Q1464-E1467 PolarHBondContact O-N 2.76Å; Q1464-S1468 PolarHBondContact O-N 3.01Å
1465	A	64.2	Low	66.3	Low	1 Å²	1	44.3 Å²	44.3	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-37.2	178.2	0	0	0	0	0	113.2	M1139 I1143 P1173 W1461 I1462 K1463 S1469	M1139-A1465 HydrophobicContact CE-CB 3.77Å; M1139-A1465 HydrophobicContact CG-CB 3.87Å; I1143-A1465 VanDerWaalsContact CD1-CA 3.47Å; I1143-A1465 HydrophobicContact CD1-CB 3.88Å; P1173-A1465 HydrophobicContact CB-CB 3.79Å; P1173-A1465 HydrophobicContact CG-CB 3.53Å; W1461-A1465 VanDerWaalsContact O-CB 3.31Å; W1461-A1465 WeakPolarHBondContact O-CB 3.4Å; W1461-A1465 PolarHBondContact O-N 2.77Å; I1462-A1465 WeakPolarHBondContact O-CA 3.42Å; I1462-A1465 WeakPolarHBondContact O-CB 3.27Å; I1462-A1465 PolarHBondContact O-N 2.83Å; I1462-A1465 VanDerWaalsContact O-N 3.07Å; K1463-A1465 PolarHBondContact O-N 2.9Å; A1465-S1469 WeakPolarHBondContact O-CB 3.45Å; A1465-S1469 PolarHBondContact O-N 3.2Å; A1465-S1469 PolarHBondContact O-OG 3.07Å
1466	K	64.9	Low	66	Low	46 Å²	46	44.5 Å²	44.5	20%	0.2	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-52.1	171.7	-49.5	-171.2	-164.5	165.5	0	110.9	I1166 E1171 I1462 K1463 Q1464 S1468 S1469 Q1470	I1166-K1466 HydrophobicContact CD1-CB 3.73Å; I1166-K1466 HydrophobicContact CD1-CD 4Å; I1166-K1466 HydrophobicContact CD1-CG 3.54Å; I1166-K1466 HydrophobicContact CG1-CG 4.18Å; E1171-K1466 IonicContact OE1-NZ 3.42Å; E1171-K1466 PolarHBondContact OE1-NZ 2.8Å; E1171-K1466 IonicContact OE2-NZ 3.95Å; E1171-K1466 PolarHBondContact OE2-NZ 3.08Å; I1462-K1466 WeakPolarHBondContact O-CG 3.34Å; I1462-K1466 PolarHBondContact O-N 3.23Å; K1463-K1466 PolarHBondContact O-N 3.1Å; Q1464-K1466 PolarHBondContact O-N 3.18Å; K1466-S1468 PolarHBondContact O-N 3.29Å; K1466-S1469 PolarHBondContact O-N 3.44Å; K1466-S1469 PolarHBondContact O-OG 3.07Å; K1466-Q1470 WeakPolarHBondContact O-CG 3.34Å; K1466-Q1470 PolarHBondContact O-N 3Å
1467	E	71	Confident	65.3	Low	88 Å²	88	50.9 Å²	50.9	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-58.1	-51.6	-175.9	-69.6	170.5	179.9	0	0	112.4	K1463 Q1464 Q1470 A1471	K1463-E1467 WeakPolarHBondContact CE-OE1 3.28Å; K1463-E1467 VanDerWaalsContact CG-OE1 3.31Å; K1463-E1467 WeakPolarHBondContact CG-OE1 3.48Å; K1463-E1467 WeakPolarHBondContact O-CG 3.41Å; K1463-E1467 PolarHBondContact O-N 3.18Å; Q1464-E1467 PolarHBondContact O-N 2.76Å; E1467-Q1470 PolarHBondContact O-N 3.48Å; E1467-A1471 WeakPolarHBondContact O-CB 3.29Å; E1467-A1471 PolarHBondContact O-N 3.48Å
1468	S	67.2	Low	64.5	Low	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-77.4	-21.5	-179.7	-77.3	0	0	0	0	114.5	N1140 R1144 Q1464 K1466 T1472	N1140-S1468 WeakPolarHBondContact CA-OG 3.31Å; N1140-S1468 WeakPolarHBondContact CB-OG 3.5Å; N1140-S1468 VanDerWaalsContact OD1-CB 3.3Å; N1140-S1468 WeakPolarHBondContact OD1-CB 3.31Å; N1140-S1468 PolarHBondContact OD1-OG 3.32Å; R1144-S1468 PolarHBondContact NE-OG 3.06Å; Q1464-S1468 PolarHBondContact O-N 3.01Å; K1466-S1468 PolarHBondContact O-N 3.29Å; S1468-T1472 WeakPolarHBondContact O-CB 3.38Å; S1468-T1472 VanDerWaalsContact O-CG2 3.28Å; S1468-T1472 WeakPolarHBondContact O-CG2 3.41Å; S1468-T1472 PolarHBondContact O-N 3.49Å; S1468-T1472 PolarHBondContact O-OG1 3.27Å
1469	S	66.8	Low	63	Low	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-76.5	-30.7	172.4	61.6	0	0	0	0	112.4	M1164 A1465 K1466 T1472 G1473 L1474 L1475	M1164-S1469 WeakPolarHBondContact CE-OG 3.4Å; A1465-S1469 WeakPolarHBondContact O-CB 3.45Å; A1465-S1469 PolarHBondContact O-N 3.2Å; A1465-S1469 PolarHBondContact O-OG 3.07Å; K1466-S1469 PolarHBondContact O-N 3.44Å; K1466-S1469 PolarHBondContact O-OG 3.07Å; S1469-T1472 PolarHBondContact O-OG1 3.24Å; S1469-G1473 PolarHBondContact O-N 2.97Å; S1469-L1474 PolarHBondContact O-N 2.69Å; S1469-L1475 PolarHBondContact O-N 3.04Å
1470	Q	70.9	Confident	61.4	Low	122 Å²	122	57.2 Å²	57.2	57%	0.57	30%	0.301	S	S	*	.	H	α-helix	trans	-65.5	-52.5	166.3	-70.8	173.2	2.9	0	0	110.4	K1466 E1467 T1472 G1473 L1475	K1466-Q1470 WeakPolarHBondContact O-CG 3.34Å; K1466-Q1470 PolarHBondContact O-N 3Å; E1467-Q1470 PolarHBondContact O-N 3.48Å; Q1470-T1472 VanDerWaalsContact C-N 3.25Å; Q1470-T1472 PolarHBondContact O-N 3.21Å; Q1470-G1473 PolarHBondContact O-N 3.39Å; Q1470-L1475 HydrophobicContact CG-CB 4.31Å; Q1470-L1475 HydrophobicContact CG-CD2 3.42Å; Q1470-L1475 VanDerWaalsContact CG-CD2 3.42Å; Q1470-L1475 HydrophobicContact CG-CG 4.48Å
1471	A	74.4	Confident	59.8	Low	78 Å²	78	59.3 Å²	59.3	65%	0.645	32%	0.323	S	S	*	.	H	α-helix	trans	-64.2	-25	-177.2	0	0	0	0	0	114.5	E1467	E1467-A1471 WeakPolarHBondContact O-CB 3.29Å; E1467-A1471 PolarHBondContact O-N 3.48Å
1472	T	70.7	Confident	58.1	Low	22 Å²	22	63.3 Å²	63.3	14%	0.135	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.2	174.6	52.4	0	0	0	0	113.8	I1143 R1144 S1147 W1160 S1468 S1469 Q1470 L1474	I1143-T1472 HydrophobicContact CG2-CG2 4.41Å; R1144-T1472 HydrophobicContact CG-CG2 4.01Å; S1147-T1472 WeakPolarHBondContact OG-CB 3.48Å; W1160-T1472 WeakPolarHBondContact CH2-O 3.21Å; W1160-T1472 WeakPolarHBondContact CZ3-O 3.36Å; S1468-T1472 WeakPolarHBondContact O-CB 3.38Å; S1468-T1472 VanDerWaalsContact O-CG2 3.28Å; S1468-T1472 WeakPolarHBondContact O-CG2 3.41Å; S1468-T1472 PolarHBondContact O-N 3.49Å; S1468-T1472 PolarHBondContact O-OG1 3.27Å; S1469-T1472 PolarHBondContact O-OG1 3.24Å; Q1470-T1472 VanDerWaalsContact C-N 3.25Å; Q1470-T1472 PolarHBondContact O-N 3.21Å; T1472-L1474 PolarHBondContact O-N 3.46Å
1473	G	70.1	Confident	56.8	Low	26 Å²	26	69.7 Å²	69.7	27%	0.268	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	3.6	-172.5	0	0	0	0	0	114.6	R1163 S1469 Q1470 L1475	R1163-G1473 PolarHBondContact NH1-O 3.28Å; S1469-G1473 PolarHBondContact O-N 2.97Å; Q1470-G1473 PolarHBondContact O-N 3.39Å; G1473-L1475 PolarHBondContact O-N 3.41Å
1474	L	69.1	Low	55	Low	0 Å²	0	71.5 Å²	71.5	0%	0	41%	0.405	C	S	.	.			trans	-60.5	-29.8	173.2	-88.4	171.8	0	0	0	112	I1143 I1150 W1160 R1163 M1164 S1469 T1472	I1143-L1474 HydrophobicContact CG2-CD1 3.79Å; I1150-L1474 HydrophobicContact CD1-CD2 4.12Å; W1160-L1474 HydrophobicContact CE3-CD2 3.7Å; W1160-L1474 HydrophobicContact CE3-CG 4.08Å; W1160-L1474 HydrophobicContact CZ3-CB 4.5Å; W1160-L1474 HydrophobicContact CZ3-CD2 3.9Å; W1160-L1474 HydrophobicContact CZ3-CG 3.73Å; R1163-L1474 CarbonylContact C-O 3.51Å; R1163-L1474 WeakPolarHBondContact CA-O 3.37Å; R1163-L1474 WeakPolarHBondContact CB-O 3.38Å; R1163-L1474 WeakPolarHBondContact CD-O 3.4Å; M1164-L1474 HydrophobicContact CB-CB 3.9Å; M1164-L1474 PolarHBondContact N-O 2.87Å; S1469-L1474 PolarHBondContact O-N 2.69Å; T1472-L1474 PolarHBondContact O-N 3.46Å
1475	L	66.3	Low	53.3	Low	26 Å²	26	76.4 Å²	76.4	14%	0.136	43%	0.433	C	S	.	.	B	Isolated β-bridge	trans	-72	142.5	-173.2	-168	65.1	0	0	0	114	R1163 M1164 I1166 S1469 Q1470 G1473	R1163-L1475 PolarHBondContact NH1-O 3.01Å; M1164-L1475 HydrophobicContact CE-CD1 4.4Å; M1164-L1475 VanDerWaalsContact O-CA 3.26Å; M1164-L1475 WeakPolarHBondContact O-CA 3.21Å; I1166-L1475 HydrophobicContact CB-CD1 4.11Å; I1166-L1475 HydrophobicContact CD1-CD1 3.58Å; I1166-L1475 HydrophobicContact CD1-CD2 3.7Å; I1166-L1475 HydrophobicContact CD1-CG 4.33Å; I1166-L1475 HydrophobicContact CG1-CD1 3.6Å; S1469-L1475 PolarHBondContact O-N 3.04Å; Q1470-L1475 HydrophobicContact CG-CB 4.31Å; Q1470-L1475 HydrophobicContact CG-CD2 3.42Å; Q1470-L1475 VanDerWaalsContact CG-CD2 3.42Å; Q1470-L1475 HydrophobicContact CG-CG 4.48Å; G1473-L1475 PolarHBondContact O-N 3.41Å
1476	I	56.4	Low	51.7	Low	35 Å²	35	79.7 Å²	79.7	18%	0.179	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-98.4	125.6	161.1	-65.9	171.4	0	0	0	109.5	R1163 M1164 R1165	R1163-I1476 HydrophobicContact CB-CD1 3.63Å; R1163-I1476 HydrophobicContact CB-CG1 3.76Å; R1163-I1476 HydrophobicContact CG-CD1 3.88Å; R1163-I1476 HydrophobicContact CG-CG1 3.79Å; M1164-I1476 PolarHBondContact O-N 3.17Å; R1165-I1476 HydrophobicContact CG-CB 4.36Å
1477	K	51.3	Low	50.2	Low	178 Å²	178	86.3 Å²	86.3	77%	0.774	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-70.6	145.2	163.1	-97.3	-173.1	171.8	-173.8	0	109.6
1478	L	43.2	Very low	48.3	Very low	77 Å²	77	87.8 Å²	87.8	40%	0.403	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-84.5	119.4	166.7	-93.9	87.2	0	0	0	110.1	P1168 T1480	P1168-L1478 HydrophobicContact CB-CD2 4.15Å; P1168-L1478 HydrophobicContact CG-CD1 4.37Å; P1168-L1478 HydrophobicContact CG-CD2 3.67Å; L1478-T1480 HydrophobicContact CD2-CG2 4.22Å
1479	D	29.8	Very low	46.5	Very low	148 Å²	148	93.2 Å²	93.2	79%	0.791	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-99.4	134.1	156.5	-59.6	-47.8	0	0	0	107.9
1480	T	31.3	Very low	45.2	Very low	121 Å²	121	98.5 Å²	98.5	74%	0.742	58%	0.579	S	S	*	*			trans	-134.8	111.5	-178.5	52	0	0	0	0	110.3	L1478	L1478-T1480 HydrophobicContact CD2-CG2 4.22Å
1481	S	28.2	Very low	43.2	Very low	109 Å²	109	99.5 Å²	99.5	76%	0.762	59%	0.594	S	S	*	*			trans	-152.6	142.9	-179.6	59.4	0	0	0	0	111.9
1482	S	28.1	Very low	41.1	Very low	114 Å²	114	100.3 Å²	100.3	80%	0.797	60%	0.595	S	S	*	*			trans	62.2	130.7	-179.5	70	0	0	0	0	115.8
1483	I	34.4	Very low	38.9	Very low	163 Å²	163	104.9 Å²	104.9	84%	0.836	63%	0.628	S	S	*	*				-147.5	154	69.2	-85.1	161.1	0	0	0	111.5
1484	T	30	Very low	36.9	Very low	113 Å²	113	109.9 Å²	109.9	69%	0.693	65%	0.648	S	S	*	*			trans	-93.2	173.1	176.2	54.5	0	0	0	0	110.9
1485	D	31.6	Very low	34.9	Very low	137 Å²	137	117.5 Å²	117.5	73%	0.733	68%	0.682	S	S	*	*			cis	-167.8	176.4	34.9	-101.2	-70.2	0	0	0	108.3
1486	S	30	Very low	33	Very low	70 Å²	70	122.9 Å²	122.9	49%	0.49	71%	0.71	S	S	.	*			cis	-173.6	165.5	-44.4	53.6	0	0	0	0	110.3
1487	H	33	Very low	31.5	Very low	185 Å²	185	129.6 Å²	129.6	86%	0.856	74%	0.741	S	S	*	*			trans	66.2	152.7	175.7	-51.2	-71	0	0	0	117.5
1488	S	31.9	Very low	30.2	Very low	119 Å²	119	127.9 Å²	127.9	83%	0.832	74%	0.74	S	S	*	*			cis	-137.9	-172.1	-1.5	61.4	0	0	0	0	111.6
1489	S	30	Very low	29.3	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	76%	0.757	S	S	*	*			trans	-131.4	-168	-154.5	67.9	0	0	0	0	115.3
1490	P	37.6	Very low	29.2	Very low	110 Å²	110	131.2 Å²	131.2	71%	0.714	76%	0.763	S	S	*	*				-135.6	179.9	-108	39.7	-18.6	0	0	0	117.1
1491	T	29.5	Very low	29.1	Very low	144 Å²	144	134.3 Å²	134.3	88%	0.883	77%	0.769	S	S	*	*			trans	171.1	152.9	151.5	24.5	0	0	0	0	109.1
1492	S	29.8	Very low	28.9	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	77%	0.774	S	S	*	*			cis	-166.7	139.3	-15.4	49.6	0	0	0	0	111.1
1493	S	26.2	Very low	28.7	Very low	118 Å²	118	137.3 Å²	137.3	83%	0.825	78%	0.776	S	S	*	*			trans	62.7	151	170.8	69.6	0	0	0	0	116.9
1494	D	26.8	Very low	28.3	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	77%	0.773	S	S	*	*			cis	-152.8	161.4	13.2	-160.3	18.3	0	0	0	112.7
1495	K	28.5	Very low	28	Very low	161 Å²	161	140 Å²	140	70%	0.7	78%	0.78	S	S	*	*			trans	71.1	118.2	161.8	-71.3	166.3	-172.3	164.9	0	124.4
1496	D	25.2	Very low	27.7	Very low	138 Å²	138	140 Å²	140	74%	0.738	79%	0.785	S	S	*	*				70.5	139.6	128.4	-64.2	-39.9	0	0	0	124.2
1497	Q	24.8	Very low	27.5	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	80%	0.795	S	S	*	*			trans	68.2	119.7	167.1	-67.5	177.9	53.2	0	0	115.5
1498	L	24.4	Very low	27.2	Very low	143 Å²	143	141.6 Å²	141.6	75%	0.749	80%	0.799	S	S	*	*			cis	-163.1	169.8	45	-102.7	137.4	0	0	0	112.9
1499	T	25.5	Very low	27	Very low	124 Å²	124	141.7 Å²	141.7	76%	0.761	80%	0.795	S	S	*	*			trans	46	130.7	154.5	50.4	0	0	0	0	121.6
1500	N	27.3	Very low	27	Very low	171 Å²	171	142.3 Å²	142.3	91%	0.914	79%	0.793	S	S	*	*			trans	-142.6	142.8	147.3	-118.2	-25.6	0	0	0	110.1
1501	E	28.2	Very low	26.6	Very low	186 Å²	186	143.7 Å²	143.7	87%	0.869	80%	0.795	S	S	*	*			trans	-89.3	170	-177.9	-66.3	-170.7	116.6	0	0	112.9
1502	L	25.1	Very low	26.6	Very low	167 Å²	167	145.9 Å²	145.9	87%	0.874	79%	0.792	S	S	*	*			trans	-94.1	98.4	176.6	-89.3	152.7	0	0	0	111.1
1503	S	22.6	Very low	27	Very low	119 Å²	119	145.9 Å²	145.9	83%	0.832	79%	0.79	S	S	*	*			trans	-81.9	121.9	163.5	-62.6	0	0	0	0	110.6
1504	I	27.1	Very low	27.1	Very low	151 Å²	151	147.3 Å²	147.3	77%	0.774	79%	0.787	S	S	*	*			trans	-133.3	119.8	160.5	-63.1	-178.1	0	0	0	107.9
1505	E	22.7	Very low	27.3	Very low	181 Å²	181	148 Å²	148	85%	0.846	79%	0.79	S	S	*	*			trans	-77.4	157.2	176.9	-58	177.1	117.9	0	0	111.8
1506	V	25.7	Very low	27.3	Very low	137 Å²	137	144.3 Å²	144.3	83%	0.83	78%	0.784	S	S	*	*			trans	-126.9	117.7	157.6	179.9	0	0	0	0	107.6
1507	P	26.4	Very low	27.5	Very low	108 Å²	108	143.9 Å²	143.9	70%	0.701	78%	0.782	S	S	*	*			trans	-79.6	148.1	-173.5	31.5	-35.4	0	0	0	112.5
1508	L	26.5	Very low	27.9	Very low	181 Å²	181	142.7 Å²	142.7	95%	0.948	78%	0.776	S	S	*	*			trans	-115.6	120.3	163.6	-80.6	167.8	0	0	0	108.8
1509	T	26.6	Very low	28.2	Very low	121 Å²	121	141.5 Å²	141.5	74%	0.742	77%	0.769	S	S	*	*			trans	-108.8	130.4	-177.2	47.5	0	0	0	0	111.7
1510	T	29.9	Very low	28.5	Very low	127 Å²	127	141.9 Å²	141.9	78%	0.779	77%	0.765	S	S	*	*			trans	169.1	111.3	130.1	39.5	0	0	0	0	107.9
1511	N	29.6	Very low	28.6	Very low	140 Å²	140	140.8 Å²	140.8	75%	0.749	75%	0.754	S	S	*	*				71	134.4	84	-86.2	-27.1	0	0	0	113.2
1512	K	30.4	Very low	28.6	Very low	190 Å²	190	137 Å²	137	83%	0.826	74%	0.74	S	S	*	*			cis	-156.3	-178.9	35.1	-118.2	174.7	176.8	-176.7	0	112
1513	P	37.2	Very low	28.9	Very low	94 Å²	94	135.9 Å²	135.9	61%	0.61	73%	0.73	S	S	*	*				-145.2	-152.9	-129.6	33.5	-4.2	0	0	0	115.8
1514	L	27.8	Very low	29.2	Very low	148 Å²	148	136.9 Å²	136.9	78%	0.775	72%	0.722	S	S	*	*			trans	78.1	156.1	160.7	-60.1	161.7	0	0	0	116
1515	I	31.2	Very low	29.4	Very low	146 Å²	146	134.6 Å²	134.6	75%	0.749	72%	0.715	S	S	*	*			cis	-154.4	157	14.1	-136.9	147.7	0	0	0	107.4
1516	S	28.3	Very low	29.8	Very low	82 Å²	82	131.8 Å²	131.8	57%	0.573	72%	0.715	S	S	*	*			cis	-170.7	-168.6	-17.1	49.9	0	0	0	0	109.7
1517	D	29.8	Very low	29.9	Very low	129 Å²	129	128.6 Å²	128.6	69%	0.69	70%	0.699	S	S	*	*			trans	70.9	166.2	160.1	-72.2	-82	0	0	0	117.9
1518	H	32.7	Very low	30.2	Very low	152 Å²	152	129.4 Å²	129.4	70%	0.704	70%	0.698	S	S	*	*			cis	-157.1	159.4	2.4	-137.4	47	0	0	0	107
1519	I	32.4	Very low	30.5	Very low	118 Å²	118	131.7 Å²	131.7	61%	0.605	69%	0.694	S	S	*	*			cis	-170.1	169.5	-27.3	-160.5	-178.7	0	0	0	107.8
1520	I	31.8	Very low	30.8	Very low	132 Å²	132	132 Å²	132	68%	0.677	70%	0.701	S	S	*	*			trans	70.2	128	163.9	-76.8	175.1	0	0	0	116.3
1521	Q	28.8	Very low	30.8	Very low	147 Å²	147	133.9 Å²	133.9	69%	0.687	71%	0.705	S	S	*	*			cis	-167.4	175	-2.1	-124.7	171	-82.5	0	0	107.4
1522	D	28.3	Very low	30.6	Very low	107 Å²	107	135.1 Å²	135.1	57%	0.572	71%	0.711	S	S	*	*			cis	-163.6	-178.2	-2.5	-152.6	-40.1	0	0	0	109.2
1523	H	31.9	Very low	30.8	Very low	143 Å²	143	133.2 Å²	133.2	66%	0.662	71%	0.709	S	S	*	*			trans	71.1	169.4	153.1	-73.7	16.7	0	0	0	118.9
1524	Q	29	Very low	30.1	Very low	141 Å²	141	135.8 Å²	135.8	66%	0.659	72%	0.723	S	S	*	*			cis	-167.7	153.2	-40.6	-93.6	-159.6	68.9	0	0	105.9
1525	T	30.6	Very low	30.1	Very low	103 Å²	103	133.4 Å²	133.4	63%	0.632	72%	0.719	S	S	*	*			cis	-165.5	143.3	-10.2	19.9	0	0	0	0	111.9
1526	S	30.9	Very low	29.9	Very low	122 Å²	122	133.7 Å²	133.7	85%	0.853	72%	0.722	S	S	*	*			trans	69.8	161.9	147.7	70.6	0	0	0	0	122.4
1527	S	28.4	Very low	29.9	Very low	70 Å²	70	137.9 Å²	137.9	49%	0.49	73%	0.732	S	S	.	*			trans	-164.1	167.7	-169.4	58.3	0	0	0	0	112.1
1528	N	32.9	Very low	29.9	Very low	125 Å²	125	138.6 Å²	138.6	67%	0.668	74%	0.735	S	S	*	*			trans	168.3	145.9	143.7	-100.2	-70.3	0	0	0	118.4
1529	R	32.6	Very low	29.7	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	73%	0.732	S	S	*	*			trans	28.4	139.1	146.8	-61.7	173.1	-179.3	-170.2	-0.9	121.6
1530	S	32.1	Very low	29.6	Very low	127 Å²	127	136.3 Å²	136.3	89%	0.888	74%	0.736	S	S	*	*				-173.7	-156.2	64.4	59.5	0	0	0	0	115.1
1531	L	29.3	Very low	29.5	Very low	166 Å²	166	135.7 Å²	135.7	87%	0.869	73%	0.734	S	S	*	*			trans	-93.2	153.2	-162.1	-86.7	160.6	0	0	0	116.3	I1533	L1531-I1533 PolarHBondContact O-N 3.36Å
1532	N	26.6	Very low	29.4	Very low	166 Å²	166	134.5 Å²	134.5	89%	0.888	73%	0.732	S	S	*	*			trans	-64.2	114	169.4	-91.5	-3.2	0	0	0	112.9
1533	I	33.1	Very low	29.2	Very low	150 Å²	150	136.1 Å²	136.1	77%	0.769	74%	0.741	S	S	*	*			trans	-125.4	153.2	146.6	-58.6	179.8	0	0	0	105.6	L1531 S1535	L1531-I1533 PolarHBondContact O-N 3.36Å; I1533-S1535 VanDerWaalsContact C-N 3.35Å; I1533-S1535 PolarHBondContact O-N 3.08Å
1534	T	24.3	Very low	28.8	Very low	148 Å²	148	135 Å²	135	91%	0.908	75%	0.749	S	S	*	*	S	Bend	trans	-66.9	76.9	-162	48.7	0	0	0	0	115.7
1535	S	26.3	Very low	28.9	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	76%	0.756	S	S	*	*	S	Bend	trans	-165.5	104.9	165.2	54	0	0	0	0	111.7	I1533	I1533-S1535 VanDerWaalsContact C-N 3.35Å; I1533-S1535 PolarHBondContact O-N 3.08Å
1536	N	27.8	Very low	28.8	Very low	152 Å²	152	137.2 Å²	137.2	81%	0.813	77%	0.766	S	S	*	*			trans	46.7	123.7	153.6	-59.3	7.6	0	0	0	122.9
1537	E	27.6	Very low	28.5	Very low	170 Å²	170	139.2 Å²	139.2	79%	0.794	76%	0.762	S	S	*	*			trans	77.5	102.2	137.3	-63.2	-179.1	157.3	0	0	124.2
1538	I	30.5	Very low	28.5	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	77%	0.772	S	S	*	*				71.5	89.3	123.8	-58.3	166.8	0	0	0	121.3
1539	S	28.4	Very low	28	Very low	93 Å²	93	141.5 Å²	141.5	65%	0.65	77%	0.768	S	S	*	*				84.3	146.7	125.8	82.1	0	0	0	0	125.5
1540	N	31.1	Very low	27.7	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	76%	0.761	S	S	*	*			trans	92.4	99.6	146	-67	-18	0	0	0	124.4
1541	N	28.5	Very low	27.4	Very low	119 Å²	119	138.2 Å²	138.2	64%	0.636	75%	0.752	S	S	*	*				92.3	133.6	119.4	-88.5	-13.8	0	0	0	126.2
1542	L	26.2	Very low	27.4	Very low	122 Å²	122	137 Å²	137	64%	0.639	74%	0.744	S	S	*	*			trans	82.1	118.4	141.6	-71.3	166.8	0	0	0	124
1543	N	24.9	Very low	27.5	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	74%	0.737	S	S	*	*			trans	33.2	112.6	132.8	-61.1	0.7	0	0	0	120.9
1544	S	24.3	Very low	27.4	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	74%	0.737	S	S	*	*				178.9	145.4	111.1	39.3	0	0	0	0	111.2
1545	T	30	Very low	27.7	Very low	133 Å²	133	135.5 Å²	135.5	82%	0.816	74%	0.736	S	S	*	*			trans	-132.5	119.1	168.3	48.8	0	0	0	0	109.6	Q1547	T1545-Q1547 PolarHBondContact O-N 3.46Å
1546	N	29.9	Very low	27.8	Very low	157 Å²	157	136 Å²	136	84%	0.84	74%	0.739	S	S	*	*			trans	-16.2	117.9	158.7	-48.3	0.8	0	0	0	112
1547	Q	24.6	Very low	28.3	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	73%	0.733	S	S	*	*			cis	62.7	128	23.2	-131.1	-159.1	-1.2	0	0	114.4	T1545	T1545-Q1547 PolarHBondContact O-N 3.46Å
1548	I	27	Very low	28.2	Very low	134 Å²	134	132.8 Å²	132.8	69%	0.687	73%	0.733	S	S	*	*			trans	75.2	140.2	157.4	-70.4	156.7	0	0	0	119.3
1549	D	23.3	Very low	27.8	Very low	109 Å²	109	130.8 Å²	130.8	58%	0.583	73%	0.731	S	S	*	*			cis	-174.1	159.8	-47.1	-119.8	-56.6	0	0	0	111.8
1550	H	25.5	Very low	28.2	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.727	73%	0.734	S	S	*	*			trans	63.5	171.2	155.7	-57	-10.2	0	0	0	116.2
1551	N	25.6	Very low	27.8	Very low	130 Å²	130	132.9 Å²	132.9	70%	0.695	74%	0.741	S	S	*	*			cis	-157.8	169.9	10.2	-145.8	-17.2	0	0	0	113
1552	I	29.3	Very low	27.5	Very low	139 Å²	139	133.9 Å²	133.9	71%	0.713	75%	0.745	S	S	*	*			trans	69.6	133	155.2	-65.7	155.7	0	0	0	115.8
1553	T	29.5	Very low	27.3	Very low	119 Å²	119	136.6 Å²	136.6	73%	0.73	75%	0.754	S	S	*	*			cis	-155.4	151.5	31	-22	0	0	0	0	113.9
1554	S	30.2	Very low	27.5	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	76%	0.758	S	S	*	*			trans	68	148	160.2	83.2	0	0	0	0	118.3
1555	K	31.6	Very low	27.8	Very low	205 Å²	205	137.7 Å²	137.7	89%	0.891	76%	0.756	S	S	*	*			cis	-119.5	177.2	3.9	-75.2	-175.8	176.8	-179.9	0	112.8
1556	S	27.9	Very low	27.9	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	76%	0.759	S	S	*	*			trans	-135.5	-169	-163.9	54.4	0	0	0	0	111
1557	P	37.8	Very low	28.1	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	75%	0.749	S	S	*	*				-138.6	-165.9	-58	38.5	-20.3	0	0	0	114.8
1558	L	27	Very low	28.2	Very low	150 Å²	150	137.9 Å²	137.9	79%	0.785	75%	0.746	S	S	*	*			trans	82.6	106.8	154.5	-67.1	165.4	0	0	0	121.8
1559	S	20.9	Very low	28.1	Very low	102 Å²	102	138.8 Å²	138.8	71%	0.713	75%	0.747	S	S	*	*				32.8	157.7	98.1	-51.3	0	0	0	0	121.8
1560	P	36.9	Very low	28.2	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	75%	0.754	S	S	*	*			cis	-143.2	-159.6	-27.3	37.8	-16.1	0	0	0	114.3
1561	L	22.8	Very low	28.1	Very low	157 Å²	157	138.1 Å²	138.1	82%	0.822	75%	0.752	S	S	*	*			trans	89.2	174.4	152.4	-80.5	168.1	0	0	0	121.3
1562	L	22.1	Very low	28.1	Very low	139 Å²	139	138.1 Å²	138.1	73%	0.728	75%	0.752	S	S	*	*			trans	-86.1	175.9	-148.2	-106.4	78.3	0	0	0	117.1
1563	E	21.5	Very low	27.8	Very low	179 Å²	179	137.1 Å²	137.1	84%	0.836	75%	0.753	S	S	*	*			trans	93.6	147.9	143.8	-93	167.2	-167	0	0	122.3
1564	I	30.6	Very low	27.7	Very low	160 Å²	160	138.7 Å²	138.7	82%	0.821	76%	0.756	S	S	*	*			trans	-108.1	129.8	-177.7	-68.2	167.1	0	0	0	104.8
1565	P	30.8	Very low	27.4	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	76%	0.756	S	S	*	*				-154.9	-178.9	81.9	40	-18.7	0	0	0	118
1566	R	30.9	Very low	27.5	Very low	231 Å²	231	136.6 Å²	136.6	87%	0.872	75%	0.746	S	S	*	*			trans	-67.3	177.2	158.7	-54.5	176.3	176.1	170.8	-2.7	110
1567	P	34.9	Very low	27.4	Very low	99 Å²	99	135.4 Å²	135.4	64%	0.643	74%	0.738	S	S	*	*			cis	-142	-172.2	9.2	42.2	-22.2	0	0	0	116
1568	N	26	Very low	27.1	Very low	130 Å²	130	137.1 Å²	137.1	70%	0.695	74%	0.742	S	S	*	*			trans	59	152.3	143.9	-74.9	10.6	0	0	0	120.1
1569	Q	25.3	Very low	27.2	Very low	153 Å²	153	137 Å²	137	72%	0.715	74%	0.741	S	S	*	*			cis	-168.5	173.8	-9.5	-121.2	172.3	-18.6	0	0	108.6
1570	V	24.5	Very low	27.6	Very low	122 Å²	122	136.5 Å²	136.5	74%	0.739	74%	0.737	S	S	*	*			trans	70.9	145.8	145.8	151.6	0	0	0	0	117.8
1571	L	24.1	Very low	27.3	Very low	129 Å²	129	136.1 Å²	136.1	68%	0.675	73%	0.733	S	S	*	*			cis	-175.1	163.4	-25.7	-157.9	70.3	0	0	0	108.1
1572	N	24.4	Very low	27.6	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	73%	0.73	S	S	*	*			trans	65.2	155.9	158.4	-72.5	-8.9	0	0	0	116.4
1573	T	24.7	Very low	27.7	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	73%	0.729	S	S	*	*			cis	-158.1	176.2	-7.9	13.4	0	0	0	0	107.1
1574	L	26.5	Very low	28.1	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	72%	0.722	S	S	*	*			cis	-151	-174.6	11.8	-135.2	164.7	0	0	0	109.7
1575	E	24.4	Very low	28	Very low	164 Å²	164	133.9 Å²	133.9	77%	0.766	72%	0.716	S	S	*	*			trans	-75.9	173.4	165.6	-116.6	179.7	-153.1	0	0	111.6
1576	P	33.9	Very low	27.6	Very low	106 Å²	106	133.9 Å²	133.9	69%	0.688	71%	0.714	S	S	*	*			cis	-154	159.2	49	42.7	-20.9	0	0	0	121.4
1577	S	26.3	Very low	27.6	Very low	83 Å²	83	128.9 Å²	128.9	58%	0.58	71%	0.71	S	S	*	*			trans	74.5	143	135.7	72.2	0	0	0	0	123.6
1578	N	29.5	Very low	27.6	Very low	142 Å²	142	129.4 Å²	129.4	76%	0.759	71%	0.713	S	S	*	*			trans	68.5	129	152.7	-59	-22.3	0	0	0	118
1579	L	30.1	Very low	27.5	Very low	148 Å²	148	129.2 Å²	129.2	78%	0.775	71%	0.712	S	S	*	*			cis	-152.8	178.5	0	-132.1	77.8	0	0	0	105.4
1580	S	30.2	Very low	27.6	Very low	90 Å²	90	132.9 Å²	132.9	63%	0.629	72%	0.719	S	S	*	*			cis	-177.7	161.3	-0.9	33.9	0	0	0	0	106.1
1581	T	29.9	Very low	27.6	Very low	103 Å²	103	131.4 Å²	131.4	63%	0.632	71%	0.714	S	S	*	*			cis	179.9	146.1	-18.2	35.7	0	0	0	0	104.1
1582	F	28.9	Very low	27.7	Very low	172 Å²	172	132.5 Å²	132.5	75%	0.754	72%	0.72	S	S	*	*			cis	-126.6	-165.6	0.9	-77.4	-69.4	0	0	0	107.6
1583	E	25	Very low	27.9	Very low	152 Å²	152	133.2 Å²	133.2	71%	0.71	72%	0.722	S	S	*	*			cis	64.4	148.5	25	-49.6	-161.2	112.6	0	0	115.5	H1585	E1583-H1585 IonicContact OE1-CE1 2.69Å; E1583-H1585 IonicContact OE1-ND1 3.54Å
1584	T	29.3	Very low	27.9	Very low	113 Å²	113	139 Å²	139	69%	0.693	73%	0.731	S	S	*	*			cis	-137	163.4	21.1	54.1	0	0	0	0	110.6
1585	H	27.8	Very low	28	Very low	150 Å²	150	137.5 Å²	137.5	69%	0.694	73%	0.734	S	S	*	*			cis	-167.6	179.7	-8.9	-97.7	-17.5	0	0	0	106.9	E1583	E1583-H1585 IonicContact OE1-CE1 2.69Å; E1583-H1585 IonicContact OE1-ND1 3.54Å
1586	T	23.6	Very low	28	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	74%	0.737	S	S	*	*			trans	-140.9	127.2	-177.1	38.1	0	0	0	0	115
1587	T	30	Very low	27.8	Very low	126 Å²	126	138.3 Å²	138.3	77%	0.773	74%	0.742	S	S	*	*			trans	64.1	171.6	162.4	75	0	0	0	0	116
1588	P	34.1	Very low	27.9	Very low	110 Å²	110	142.8 Å²	142.8	71%	0.714	75%	0.751	S	S	*	*				-147.4	138.6	73.3	37.8	-17.2	0	0	0	118
1589	N	25.5	Very low	27.7	Very low	126 Å²	126	142.8 Å²	142.8	67%	0.674	75%	0.751	S	S	*	*			trans	58.7	134.1	132.7	-77.9	-61.3	0	0	0	125.1
1590	R	26.7	Very low	27.5	Very low	229 Å²	229	142.8 Å²	142.8	86%	0.864	75%	0.751	S	S	*	*			trans	73.2	147.2	137.9	-70	173.7	-177.7	-174.1	-0.9	119.3
1591	S	25.2	Very low	27.2	Very low	91 Å²	91	142.7 Å²	142.7	64%	0.636	75%	0.75	S	S	*	*			cis	-172.6	158.4	-16.8	51.4	0	0	0	0	113.8
1592	L	25	Very low	26.9	Very low	153 Å²	153	142.5 Å²	142.5	80%	0.801	75%	0.753	S	S	*	*			trans	85.5	146.4	142.2	-118.5	75.3	0	0	0	121.1
1593	I	29.1	Very low	26.7	Very low	145 Å²	145	143.8 Å²	143.8	74%	0.744	75%	0.754	S	S	*	*			trans	93.2	102.2	156	-60.1	156.1	0	0	0	119.6
1594	R	25.2	Very low	26.8	Very low	238 Å²	238	144.7 Å²	144.7	90%	0.898	76%	0.756	S	S	*	*			trans	1.2	136	142.9	-58.4	170.6	174.6	166	-3.5	119.1
1595	S	28.8	Very low	26.6	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	76%	0.76	S	S	*	*				-165.1	164.2	105.9	44.1	0	0	0	0	111.9
1596	N	24.9	Very low	26.5	Very low	157 Å²	157	142.4 Å²	142.4	84%	0.84	76%	0.756	S	S	*	*			trans	-107.1	158.6	178.9	-67.2	-54.8	0	0	0	110.3
1597	V	28.8	Very low	26.7	Very low	130 Å²	130	141.7 Å²	141.7	79%	0.788	75%	0.751	S	S	*	*				171.5	118.9	112.6	156.3	0	0	0	0	112.9
1598	K	28.7	Very low	26.6	Very low	177 Å²	177	142.2 Å²	142.2	77%	0.77	75%	0.749	S	S	*	*			trans	21.4	128.8	145.7	-52.7	176.8	179.4	178.5	0	122.1
1599	N	25.5	Very low	26.3	Very low	142 Å²	142	142.7 Å²	142.7	76%	0.759	75%	0.745	S	S	*	*			trans	63.5	155.2	131.7	-56.1	7.3	0	0	0	118.8
1600	L	25.6	Very low	26.5	Very low	147 Å²	147	144.4 Å²	144.4	77%	0.77	75%	0.746	S	S	*	*			cis	-158.4	157.6	26.1	-131.8	139	0	0	0	111.8
1601	S	24.3	Very low	26.6	Very low	89 Å²	89	140.5 Å²	140.5	62%	0.622	74%	0.738	S	S	*	*			trans	36.9	113.8	154.2	57.6	0	0	0	0	123.4
1602	S	22.7	Very low	26.7	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	74%	0.741	S	S	*	*			trans	44.1	125.8	132.6	63.3	0	0	0	0	122.5
1603	Y	25.8	Very low	26.9	Very low	200 Å²	200	140.5 Å²	140.5	78%	0.784	74%	0.735	S	S	*	*				-176.6	144.6	102.8	-115.2	-94.7	0	0	0	113.9
1604	K	25.5	Very low	27	Very low	170 Å²	170	141 Å²	141	74%	0.739	74%	0.737	S	S	*	*			trans	29.8	135.3	152.1	-81.8	-176.7	-178	176.5	0	124
1605	V	25.9	Very low	27.2	Very low	129 Å²	129	134 Å²	134	78%	0.782	73%	0.726	S	S	*	*				70.2	139.6	128.8	170.5	0	0	0	0	118.4
1606	S	25	Very low	27.3	Very low	86 Å²	86	134.6 Å²	134.6	60%	0.601	72%	0.719	S	S	*	*			cis	-172.5	171	-16.1	-91.9	0	0	0	0	109.6
1607	T	28.6	Very low	27.5	Very low	110 Å²	110	134.4 Å²	134.4	68%	0.675	71%	0.713	S	S	*	*			trans	51.8	109.6	146.8	51.3	0	0	0	0	118.8
1608	D	27.1	Very low	27.7	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	71%	0.709	S	S	*	*				117.5	-178.4	80.9	-79.5	-9.7	0	0	0	108.7
1609	I	28.9	Very low	27.7	Very low	121 Å²	121	131.1 Å²	131.1	62%	0.621	71%	0.708	S	S	*	*			cis	-164.1	154.1	13.7	-139.3	157.4	0	0	0	111.7
1610	K	29.6	Very low	27.9	Very low	162 Å²	162	131.9 Å²	131.9	70%	0.704	71%	0.711	S	S	*	*			trans	74.2	159.6	151.3	-70.9	173.4	-165.7	174.1	0	122.3
1611	Q	28.4	Very low	28.1	Very low	147 Å²	147	130.3 Å²	130.3	69%	0.687	71%	0.707	S	S	*	*			cis	-178.4	170.3	-26.1	-106.4	-179.6	-27.8	0	0	108.2
1612	N	27.8	Very low	28.4	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	72%	0.717	S	S	*	*			cis	-141.3	-105.1	-14.6	-127.6	-2.3	0	0	0	109.1
1613	V	28.7	Very low	28.6	Very low	111 Å²	111	132.4 Å²	132.4	67%	0.673	71%	0.712	S	S	*	*			cis	-165.5	137.5	-13.7	82.9	0	0	0	0	112.6
1614	I	30.5	Very low	28.7	Very low	155 Å²	155	129.3 Å²	129.3	80%	0.795	72%	0.715	S	S	*	*			trans	57.4	139.8	155.8	-71.7	168.3	0	0	0	117.8
1615	S	29.8	Very low	28.7	Very low	93 Å²	93	127.7 Å²	127.7	65%	0.65	71%	0.713	S	S	*	*			cis	-176.8	166.6	-7.8	52.8	0	0	0	0	106.4
1616	N	30.6	Very low	28.7	Very low	134 Å²	134	125.3 Å²	125.3	72%	0.717	71%	0.707	S	S	*	*			cis	-166.2	176.8	-9.7	-101.5	24.5	0	0	0	104.6
1617	E	30.3	Very low	28.8	Very low	154 Å²	154	128.4 Å²	128.4	72%	0.72	72%	0.715	S	S	*	*			cis	-148.7	-149.8	-0.1	-130.8	166.2	-87.2	0	0	108
1618	T	31.4	Very low	28.5	Very low	116 Å²	116	129.6 Å²	129.6	71%	0.712	72%	0.722	S	S	*	*			cis	-156.4	-163.2	14.9	-22.5	0	0	0	0	110.3
1619	T	29.4	Very low	28.6	Very low	121 Å²	121	129.2 Å²	129.2	74%	0.742	73%	0.725	S	S	*	*			trans	-45.7	150	169.1	47.3	0	0	0	0	116.3
1620	I	30.7	Very low	28.4	Very low	159 Å²	159	130.3 Å²	130.3	82%	0.815	73%	0.732	S	S	*	*			cis	-129.5	155.2	49.3	-71.5	173.7	0	0	0	114.6
1621	T	29.3	Very low	28.5	Very low	114 Å²	114	130.5 Å²	130.5	70%	0.699	74%	0.739	S	S	*	*			trans	-64.8	158	-179.9	39.1	0	0	0	0	114.8
1622	T	29.4	Very low	28.3	Very low	134 Å²	134	129.5 Å²	129.5	82%	0.822	74%	0.739	S	S	*	*				-156.7	155.5	57.1	-56.2	0	0	0	0	113.3
1623	T	26.9	Very low	28.3	Very low	96 Å²	96	128.8 Å²	128.8	59%	0.589	74%	0.739	S	S	*	*			trans	-127.5	157.6	-163.1	-50.4	0	0	0	0	112.3	I1625	T1623-I1625 HydrophobicContact CG2-CB 4.47Å; T1623-I1625 HydrophobicContact CG2-CD1 3.37Å; T1623-I1625 HydrophobicContact CG2-CG1 3.75Å
1624	T	28.1	Very low	28.2	Very low	136 Å²	136	129 Å²	129	83%	0.834	74%	0.74	S	S	*	*			trans	157.9	105.7	153.9	-70.9	0	0	0	0	106.5
1625	I	26.9	Very low	28.1	Very low	135 Å²	135	129.1 Å²	129.1	69%	0.692	74%	0.737	S	S	*	*			cis	67.8	128.3	31.3	-55.6	-173.5	0	0	0	113.7	T1623	T1623-I1625 HydrophobicContact CG2-CB 4.47Å; T1623-I1625 HydrophobicContact CG2-CD1 3.37Å; T1623-I1625 HydrophobicContact CG2-CG1 3.75Å
1626	A	25	Very low	28	Very low	80 Å²	80	133.9 Å²	133.9	66%	0.661	75%	0.747	S	S	*	*			cis	-173.6	-167.2	-22.4	0	0	0	0	0	108.4
1627	I	28	Very low	27.6	Very low	150 Å²	150	131.6 Å²	131.6	77%	0.769	74%	0.742	S	S	*	*			trans	79.2	123.2	151.5	-62.9	151	0	0	0	118.4
1628	T	22.6	Very low	27.4	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	74%	0.744	S	S	*	*			trans	-106.6	132.7	157.8	48.4	0	0	0	0	110.1
1629	T	27.8	Very low	27.2	Very low	129 Å²	129	134 Å²	134	79%	0.791	75%	0.752	S	S	*	*			trans	-157.7	148.7	156.9	20.3	0	0	0	0	110.5
1630	N	25.7	Very low	27	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	75%	0.751	S	S	*	*			trans	-91.9	153	-179.7	-62.2	-5.1	0	0	0	112.2
1631	I	30.3	Very low	26.7	Very low	166 Å²	166	132.7 Å²	132.7	85%	0.851	75%	0.75	S	S	*	*			trans	-143.6	143	144.9	-54	-177.3	0	0	0	107.5
1632	D	25.5	Very low	26.6	Very low	126 Å²	126	131.6 Å²	131.6	67%	0.674	75%	0.748	S	S	*	*			trans	-96.7	-164.3	-177.4	-59	-95.7	0	0	0	110.8
1633	T	26.7	Very low	26.7	Very low	117 Å²	117	132 Å²	132	72%	0.718	74%	0.743	S	S	*	*			cis	-167.8	172	22.7	-24.1	0	0	0	0	111.5
1634	T	26.7	Very low	26.7	Very low	114 Å²	114	133.8 Å²	133.8	70%	0.699	75%	0.749	S	S	*	*			trans	77.1	148.1	153.5	55.4	0	0	0	0	122.6
1635	H	28.6	Very low	26.6	Very low	158 Å²	158	132.9 Å²	132.9	73%	0.731	74%	0.744	S	S	*	*			trans	67.8	135.3	173.2	-64.3	-78	0	0	0	117.1
1636	F	27.4	Very low	26.6	Very low	193 Å²	193	132.4 Å²	132.4	85%	0.846	75%	0.747	S	S	*	*			cis	-131.3	169.1	8.9	-120.3	-80.9	0	0	0	112.6
1637	S	23.8	Very low	26.8	Very low	87 Å²	87	134 Å²	134	61%	0.608	75%	0.748	S	S	*	*			trans	-128.1	168.4	174.6	57.5	0	0	0	0	112.6
1638	N	25.1	Very low	26.8	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	75%	0.746	S	S	*	*			trans	65.9	119.7	167.7	-60.4	-6.8	0	0	0	119.1
1639	M	27.3	Very low	27	Very low	177 Å²	177	131.6 Å²	131.6	87%	0.872	74%	0.741	S	S	*	*				-160.6	163.4	103.5	-104.2	-60.1	173	0	0	112.1
1640	N	25.4	Very low	27.1	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	74%	0.739	S	S	*	*			trans	-101.6	163.1	-163.6	-72.3	-36.9	0	0	0	114.9
1641	S	24.1	Very low	27	Very low	113 Å²	113	134 Å²	134	79%	0.79	74%	0.744	S	S	*	*			trans	68.3	152.9	155.4	68.1	0	0	0	0	116.4
1642	S	27.5	Very low	27.1	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	74%	0.741	S	S	*	*			cis	-162.8	154.4	38.9	-71.7	0	0	0	0	114.9
1643	I	31.1	Very low	27.1	Very low	142 Å²	142	133.2 Å²	133.2	73%	0.728	75%	0.747	S	S	*	*			trans	67.2	110.3	133.6	-67.4	169.6	0	0	0	121.1
1644	N	28	Very low	27.3	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	75%	0.753	S	S	*	*				58	110.6	127.6	-55.4	-1.4	0	0	0	123.8
1645	T	24.6	Very low	27.3	Very low	118 Å²	118	132.7 Å²	132.7	72%	0.724	76%	0.756	S	S	*	*				36.4	154.9	115.6	64	0	0	0	0	123.7
1646	T	28.3	Very low	27.3	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	76%	0.756	S	S	*	*			trans	79.7	153.5	163.1	78.3	0	0	0	0	118.5
1647	T	28.4	Very low	27.3	Very low	112 Å²	112	128.2 Å²	128.2	69%	0.687	75%	0.754	S	S	*	*			cis	-159.6	148.8	-44.8	32.6	0	0	0	0	110.3
1648	T	27.7	Very low	27.4	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	77%	0.767	S	S	*	*			trans	53.3	128.1	146.9	57.1	0	0	0	0	123.8
1649	T	26.8	Very low	27.6	Very low	119 Å²	119	134.1 Å²	134.1	73%	0.73	77%	0.774	S	S	*	*			trans	86	127.1	133.5	47.5	0	0	0	0	125.1
1650	T	29.9	Very low	27.5	Very low	120 Å²	120	133.4 Å²	133.4	74%	0.736	77%	0.773	S	S	*	*			trans	72.1	103.2	140.6	50.6	0	0	0	0	123.9
1651	K	25	Very low	27.8	Very low	203 Å²	203	132.3 Å²	132.3	88%	0.883	78%	0.776	S	S	*	*				55.6	158.8	126.6	-73.8	-174.9	177.4	-179.4	0	120.6
1652	P	32.4	Very low	27.8	Very low	120 Å²	120	133 Å²	133	78%	0.779	78%	0.781	S	S	*	*			cis	-124.7	-176.8	6.5	41.8	-26.9	0	0	0	115.8
1653	L	24.7	Very low	27.9	Very low	156 Å²	156	131.7 Å²	131.7	82%	0.817	78%	0.782	S	S	*	*			trans	-73.7	154.5	167.9	-75.7	155.9	0	0	0	111.3
1654	P	31.6	Very low	28.1	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	78%	0.777	S	S	*	*				-134.2	172.9	90.4	38.3	-27.5	0	0	0	114
1655	A	26.3	Very low	28.3	Very low	91 Å²	91	131.6 Å²	131.6	75%	0.752	78%	0.782	S	S	*	*			trans	-109.1	152.7	-171.4	0	0	0	0	0	114
1656	S	28	Very low	28.7	Very low	106 Å²	106	130 Å²	130	74%	0.741	78%	0.776	S	S	*	*			trans	-168.7	150.1	130.5	46.3	0	0	0	0	112.5
1657	N	26.6	Very low	29.1	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	77%	0.771	S	S	*	*			trans	49.6	98.6	154.4	-56.7	-13.8	0	0	0	120
1658	I	26.5	Very low	29.9	Very low	171 Å²	171	131.7 Å²	131.7	88%	0.877	77%	0.768	S	S	*	*				-169.3	124.3	126.5	-93.3	146.6	0	0	0	108.2
1659	M	28.6	Very low	30.3	Very low	184 Å²	184	135.2 Å²	135.2	91%	0.906	77%	0.768	S	S	*	*			trans	-165.7	109.9	143.1	-119.5	-171.1	-179.4	0	0	110.6
1660	N	25.7	Very low	30.7	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	76%	0.761	S	S	*	*			trans	-157.1	85.7	173.2	-155	8.8	0	0	0	110.1
1661	S	31.2	Very low	31.3	Very low	115 Å²	115	138.9 Å²	138.9	80%	0.804	76%	0.763	S	S	*	*			trans	-161.7	82.8	176.1	47.9	0	0	0	0	112.6
1662	S	25.8	Very low	31.9	Very low	127 Å²	127	136.4 Å²	136.4	89%	0.888	75%	0.753	S	S	*	*			trans	-80	131.3	167.3	50.4	0	0	0	0	110.9
1663	G	28.2	Very low	32.1	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	74%	0.738	S	S	*	*			trans	141.2	90.9	162.9	0	0	0	0	0	117.6
1664	N	35.1	Very low	32.6	Very low	117 Å²	117	134.7 Å²	134.7	63%	0.626	73%	0.733	S	S	*	*	S	Bend	trans	-166.2	-18.9	143.3	-109.3	-32.8	0	0	0	115.1	S1666 K1667	N1664-S1666 VanDerWaalsContact C-N 3.26Å; N1664-S1666 PolarHBondContact O-N 2.8Å; N1664-S1666 VanDerWaalsContact O-N 3.15Å; N1664-K1667 PolarHBondContact O-N 3.24Å
1665	L	33.5	Very low	33.2	Very low	156 Å²	156	132 Å²	132	82%	0.817	72%	0.722	S	S	*	*	H	α-helix	trans	-61.5	-23.4	-175.8	-80.9	161.5	0	0	0	115.6
1666	S	32.5	Very low	33.4	Very low	84 Å²	84	137.6 Å²	137.6	59%	0.587	72%	0.724	S	S	*	*	H	α-helix	trans	-71	-32	-179.6	52.7	0	0	0	0	114	N1664 N1670	N1664-S1666 VanDerWaalsContact C-N 3.26Å; N1664-S1666 PolarHBondContact O-N 2.8Å; N1664-S1666 VanDerWaalsContact O-N 3.15Å; S1666-N1670 PolarHBondContact O-N 3.03Å
1667	K	36.5	Very low	33.5	Very low	151 Å²	151	141.8 Å²	141.8	66%	0.657	73%	0.728	S	S	*	*	H	α-helix	trans	-73	-31.1	-177	-72.3	179.7	177.4	174.2	0	113.1	N1664	N1664-K1667 PolarHBondContact O-N 3.24Å
1668	I	45	Very low	33.8	Very low	123 Å²	123	146.4 Å²	146.4	63%	0.631	74%	0.741	S	S	*	*	H	α-helix	trans	-70.6	-45.7	178.4	-61.2	174.8	0	0	0	110.2	N1670 R1671 F1672	I1668-N1670 VanDerWaalsContact C-N 3.31Å; I1668-N1670 PolarHBondContact O-N 3.49Å; I1668-R1671 PolarHBondContact O-N 3.5Å; I1668-F1672 PolarHBondContact O-N 2.74Å
1669	R	35.6	Very low	34.2	Very low	190 Å²	190	145.2 Å²	145.2	72%	0.717	73%	0.734	S	S	*	*	H	α-helix	trans	-61	-37.1	-178.3	-160.1	171	-168.6	155	2.8	113	N1673	R1669-N1673 PolarHBondContact O-N 2.65Å
1670	N	37	Very low	34.5	Very low	111 Å²	111	143.1 Å²	143.1	59%	0.594	73%	0.725	S	S	*	*	H	α-helix	trans	-73.1	-31.7	179	-74.9	0.6	0	0	0	113.5	S1666 I1668 Q1674	S1666-N1670 PolarHBondContact O-N 3.03Å; I1668-N1670 VanDerWaalsContact C-N 3.31Å; I1668-N1670 PolarHBondContact O-N 3.49Å; N1670-Q1674 PolarHBondContact O-N 3.19Å
1671	R	40.5	Very low	35	Very low	206 Å²	206	142.1 Å²	142.1	78%	0.777	72%	0.718	S	S	*	*	H	α-helix	trans	-68.7	-39.8	173.7	-79.2	-172.7	170.4	-176.8	-3	112.1	I1668 Q1674 A1675	I1668-R1671 PolarHBondContact O-N 3.5Å; R1671-Q1674 PolarHBondContact O-N 3.3Å; R1671-A1675 PolarHBondContact O-N 2.74Å
1672	F	38.2	Very low	35.2	Very low	151 Å²	151	143.7 Å²	143.7	66%	0.662	71%	0.713	S	S	*	*	H	α-helix	trans	-62.5	-45.4	177.7	-154.9	-91.5	0	0	0	111.8	I1668 Q1674 A1675 W1676	I1668-F1672 PolarHBondContact O-N 2.74Å; F1672-Q1674 VanDerWaalsContact C-N 3.28Å; F1672-Q1674 PolarHBondContact O-N 3.49Å; F1672-A1675 PolarHBondContact O-N 3.28Å; F1672-W1676 PolarHBondContact O-N 2.74Å
1673	N	36.8	Very low	35.8	Very low	88 Å²	88	144.8 Å²	144.8	47%	0.471	70%	0.702	S	S	.	*	H	α-helix	trans	-68.3	-19.5	178.7	-75.5	-4.8	0	0	0	114.7	R1669	R1669-N1673 PolarHBondContact O-N 2.65Å
1674	Q	36.2	Very low	36.3	Very low	151 Å²	151	150.1 Å²	150.1	71%	0.706	70%	0.704	S	S	*	*	H	α-helix	trans	-84.1	-27.7	172.8	-77.6	-175.2	-31.6	0	0	112.9	N1670 R1671 F1672 W1676	N1670-Q1674 PolarHBondContact O-N 3.19Å; R1671-Q1674 PolarHBondContact O-N 3.3Å; F1672-Q1674 VanDerWaalsContact C-N 3.28Å; F1672-Q1674 PolarHBondContact O-N 3.49Å; Q1674-W1676 VanDerWaalsContact C-N 3.33Å
1675	A	42.9	Very low	36.4	Very low	73 Å²	73	152.4 Å²	152.4	60%	0.603	71%	0.709	S	S	*	*	H	α-helix	trans	-74	-23.4	174.4	0	0	0	0	0	113.1	R1671 F1672	R1671-A1675 PolarHBondContact O-N 2.74Å; F1672-A1675 PolarHBondContact O-N 3.28Å
1676	W	30.4	Very low	36.6	Very low	209 Å²	209	152.2 Å²	152.2	79%	0.792	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	6	-179.9	-163.6	14.6	0	0	0	114	F1672 Q1674	F1672-W1676 PolarHBondContact O-N 2.74Å; Q1674-W1676 VanDerWaalsContact C-N 3.33Å
1677	K	29.7	Very low	36.9	Very low	193 Å²	193	157.8 Å²	157.8	84%	0.839	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	22.9	172.4	-83.6	-167.7	170	-171.7	0	112.9
1678	K	34.2	Very low	37	Very low	248 Å²	248	158.5 Å²	158.5	100%	1.078	72%	0.715	S	S	*	*			trans	-126.8	0	163.4	-86.4	-167.9	168.8	-169.3	0	108.5

Retrieved 1,678 of 1,678 residues in 2052.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).