A0A087WTW0_HUMAN Loading...

E3 ubiquitin-protein ligase UHRF

Multi domain E3 ubiquitin ligase that also plays a role in DNA methylation and histone modifications.

AlphaFold DB , UniProt , Accession A0A087WTW0, Species HUMAN (Homo sapiens, Human), Gene UHRF1, Length 857 aa.

						>A0A087WTW0_HUMAN|A0A087WTW0|UHRF1
MPSFRGKKIRAAGSAAGSVCRAGAPGRTQVRAGSGPRTRFHRHPQPGHARRQTSCSRRPESADTMWIQVRTMDGRQTHTVDSLSRLTKVEELRRKIQELFHVEPGLQRLFYRGKQMEDGHTLFDYEVRLNDTIQLLVRQSLVLPHSTKERDSELSDTDSGCCLGQSESDKSSTHGEAAAETDSRPADEDMWDETELGLYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRDEPCSSTSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGEGSPMVDNPMRRKSGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRNDASEVVLAGERLRESKKKAKMASATSSSQRDWGKGMACVGRTKECTIVPSNHYGPIPGIPVGTMWRFRVQVSESGVHRPHVAGIHGRSNDGAYSLVLAGGYEDDVDHGNFFTYTGSGGRDLSGNKRTAEQSCDQKLTNTNRALALNCFAPINDQEGAEAKDWRSGKPVRVVRNVKGGKNSKYAPAEGNRYDGIYKVVKYWPEKGKSGFLVWRYLLRRDDDEPGPWTKEGKDRIKKLGLTMQYPEGYLEALANREREKENSKREEEEQQEGGFASPRTGKGKWKRKSAGGGPSRAGSPRRTSKKTKVEPYSLTAQQSSLIREDKSNAKLWNEVLASLKDRPASGSPFQLFLSKVEETFQCICCQELVFRPITTVCQHNVCKDCLDRSFRAQVFSCPACRYDLGRSYAMQVNQPLQTVLNQLFPGYGNGR
					

Structure Viewer

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(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	29.7	Very low	31.4	Very low	237 Å²	237	157.7 Å²	157.7	100%	1.167	80%	0.803	S	S	*	*				0	126.8	0	-85.3	-77.3	-176.9	0	0	107.8
2	P	47	Very low	31.4	Very low	115 Å²	115	152.7 Å²	152.7	75%	0.747	80%	0.803	S	S	*	*			trans	-86.1	174.7	-155.5	8.1	13.8	0	0	0	109.8
3	S	29.8	Very low	31.2	Very low	91 Å²	91	146.7 Å²	146.7	64%	0.636	80%	0.8	S	S	*	*				164.2	122.1	92.7	176.3	0	0	0	0	112.1
4	F	32.2	Very low	31.1	Very low	145 Å²	145	144.6 Å²	144.6	64%	0.636	80%	0.802	S	S	*	*				91.4	120.9	126.5	-80.8	-138.2	0	0	0	122.3
5	R	32.4	Very low	31.2	Very low	221 Å²	221	141.2 Å²	141.2	83%	0.834	80%	0.8	S	S	*	*				59.1	136.9	123.3	-61.1	-174.3	-176.8	175.8	-1.2	117.4
6	G	29.5	Very low	31.3	Very low	69 Å²	69	138.8 Å²	138.8	71%	0.711	80%	0.803	S	S	*	*			cis	147.5	152.7	9.6	0	0	0	0	0	110.3
7	K	31	Very low	31	Very low	187 Å²	187	135.4 Å²	135.4	81%	0.813	80%	0.804	S	S	*	*			trans	67.9	122.2	154	-77	-179.9	176.8	174	0	120.4
8	K	29.2	Very low	31	Very low	178 Å²	178	134.1 Å²	134.1	77%	0.774	80%	0.803	S	S	*	*				55.3	136	122.3	-58.4	-178.5	174	-175	0	116.5
9	I	28	Very low	31	Very low	162 Å²	162	133.5 Å²	133.5	83%	0.831	80%	0.8	S	S	*	*				-169.1	157.9	77.8	-85.8	170.5	0	0	0	110.5
10	R	27.1	Very low	30.8	Very low	233 Å²	233	132.5 Å²	132.5	88%	0.879	80%	0.798	S	S	*	*			trans	-64.8	175.4	-176.8	-65.4	166.5	155.1	-179.8	-7.7	116.6
11	A	30.1	Very low	30.7	Very low	97 Å²	97	137.8 Å²	137.8	80%	0.802	80%	0.804	S	S	*	*			trans	103.1	142.3	132.5	0	0	0	0	0	115.1
12	A	30.8	Very low	30.7	Very low	97 Å²	97	131.5 Å²	131.5	80%	0.802	79%	0.79	S	S	*	*			cis	-174.2	158.8	-6.4	0	0	0	0	0	109.5
13	G	28.5	Very low	29.7	Very low	75 Å²	75	129.9 Å²	129.9	77%	0.773	80%	0.795	S	S	*	*			trans	85.8	151.9	137.4	0	0	0	0	0	117.9
14	S	30.6	Very low	29.6	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	80%	0.803	S	S	*	*			cis	-177.5	163.3	-10	-150.5	0	0	0	0	108.9
15	A	32	Very low	30.6	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	81%	0.812	S	S	*	*			trans	75.1	149	148.4	0	0	0	0	0	119.9
16	A	33	Very low	30.3	Very low	103 Å²	103	122.4 Å²	122.4	85%	0.851	81%	0.808	S	S	*	*			cis	-177.4	161	-16.1	0	0	0	0	0	109.1
17	G	26.7	Very low	30.3	Very low	80 Å²	80	130.6 Å²	130.6	83%	0.825	82%	0.818	S	S	*	*			trans	115.2	144.1	146.5	0	0	0	0	0	116.4
18	S	30	Very low	30.1	Very low	112 Å²	112	126.9 Å²	126.9	78%	0.783	81%	0.811	S	S	*	*			cis	179.9	158.8	-38.7	178.8	0	0	0	0	106.3
19	V	31.7	Very low	30.1	Very low	123 Å²	123	126.9 Å²	126.9	75%	0.745	81%	0.813	S	S	*	*			trans	103.3	117.5	148.2	-163.4	0	0	0	0	121.2
20	C	27.6	Very low	30.2	Very low	113 Å²	113	124.6 Å²	124.6	76%	0.764	81%	0.807	S	S	*	*			trans	90.4	107.2	141.7	-79	0	0	0	0	125.7
21	R	27.9	Very low	30.2	Very low	244 Å²	244	124.9 Å²	124.9	92%	0.921	81%	0.808	S	S	*	*				11.3	134.8	127.7	-75.9	179.9	168.7	-169.2	-2.9	119.9
22	A	29	Very low	30.1	Very low	105 Å²	105	125.3 Å²	125.3	87%	0.868	81%	0.811	S	S	*	*				166.3	148.3	97.2	0	0	0	0	0	112.9
23	G	26.6	Very low	29.9	Very low	82 Å²	82	124.6 Å²	124.6	85%	0.845	81%	0.813	S	S	*	*			trans	103.7	91.7	147.2	0	0	0	0	0	119.1
24	A	27	Very low	29.9	Very low	97 Å²	97	126.8 Å²	126.8	80%	0.802	82%	0.817	S	S	*	*			trans	-88	-166.6	152	0	0	0	0	0	109.2
25	P	53.4	Low	29.6	Very low	130 Å²	130	124.8 Å²	124.8	84%	0.844	82%	0.815	S	S	*	*			cis	-135.6	-176.1	-19.6	31.4	-9.9	0	0	0	112.5
26	G	27.2	Very low	30.1	Very low	72 Å²	72	126.9 Å²	126.9	74%	0.742	82%	0.821	S	S	*	*			trans	170.9	87.4	160	0	0	0	0	0	120.9
27	R	28.5	Very low	30	Very low	241 Å²	241	132.3 Å²	132.3	91%	0.909	82%	0.819	S	S	*	*			trans	74.4	101	139	-77.2	-171.3	162.8	-169.2	-3.3	123.2
28	T	28	Very low	30.1	Very low	110 Å²	110	135.7 Å²	135.7	68%	0.675	82%	0.824	S	S	*	*				41.2	115.9	110.2	44.5	0	0	0	0	122.4
29	Q	29.5	Very low	30	Very low	177 Å²	177	140.2 Å²	140.2	83%	0.827	82%	0.824	S	S	*	*				76.6	145.6	99.2	-144	-175.7	44.7	0	0	120.3
30	V	28.5	Very low	29.8	Very low	115 Å²	115	141.9 Å²	141.9	70%	0.697	82%	0.822	S	S	*	*			trans	116.5	97.3	144.7	-168.4	0	0	0	0	116.9
31	R	28.1	Very low	29.8	Very low	239 Å²	239	144.5 Å²	144.5	90%	0.902	82%	0.822	S	S	*	*				44.3	141.4	111	-107.1	-179.2	-177.4	-164.2	0.6	121.7
32	A	28.5	Very low	29.8	Very low	105 Å²	105	143.2 Å²	143.2	87%	0.868	82%	0.817	S	S	*	*			trans	95.5	135.9	137.7	0	0	0	0	0	118.8
33	G	26.8	Very low	29.8	Very low	82 Å²	82	146.4 Å²	146.4	85%	0.845	81%	0.814	S	S	*	*			trans	162	120.4	166.6	0	0	0	0	0	112.9
34	S	27.2	Very low	30.3	Very low	121 Å²	121	148.5 Å²	148.5	85%	0.846	81%	0.812	S	S	*	*			trans	-118.5	139	-156.1	43.3	0	0	0	0	114
35	G	25.5	Very low	30.4	Very low	76 Å²	76	152 Å²	152	78%	0.784	81%	0.812	S	S	*	*			trans	64.3	178.8	150.1	0	0	0	0	0	119.1
36	P	42.3	Very low	29.8	Very low	137 Å²	137	152 Å²	152	89%	0.89	81%	0.813	S	S	*	*			cis	-134	-173.1	-3.6	39.4	-19.8	0	0	0	115.5
37	R	30.6	Very low	29.7	Very low	217 Å²	217	152.3 Å²	152.3	82%	0.819	82%	0.816	S	S	*	*			trans	-75.5	160.9	-173.8	-61.9	165.2	164.1	-170.1	-6.1	115.4
38	T	29	Very low	29.8	Very low	152 Å²	152	150.6 Å²	150.6	93%	0.933	82%	0.817	S	S	*	*			trans	-137.5	153	141.4	43.7	0	0	0	0	111.9
39	R	28	Very low	29.8	Very low	206 Å²	206	150.2 Å²	150.2	78%	0.777	83%	0.826	S	S	*	*			trans	-113.2	148.8	-156.5	-92	-170.4	160.9	171.4	-5.4	112.6
40	F	27.3	Very low	29.9	Very low	159 Å²	159	153.6 Å²	153.6	70%	0.697	83%	0.831	S	S	*	*			trans	41.9	133	137.5	-72	-94.2	0	0	0	122.4
41	H	27.5	Very low	29.8	Very low	167 Å²	167	159.7 Å²	159.7	77%	0.773	84%	0.841	S	S	*	*				-175.4	147.7	95	-102.1	-64.5	0	0	0	116.9
42	R	26.8	Very low	30	Very low	217 Å²	217	157 Å²	157	82%	0.819	84%	0.839	S	S	*	*			trans	-31.3	143	174	-66.7	171.3	175.3	-170.8	-4.4	123.3
43	H	30.4	Very low	29.9	Very low	173 Å²	173	158.8 Å²	158.8	80%	0.801	84%	0.839	S	S	*	*				10.8	151	128.7	-92.7	-52.3	0	0	0	121.6
44	P	36.4	Very low	29.9	Very low	125 Å²	125	159.9 Å²	159.9	81%	0.812	83%	0.834	S	S	*	*				-152.5	170.3	74.2	37.7	-15.6	0	0	0	118.7
45	Q	29.3	Very low	30.4	Very low	171 Å²	171	159.8 Å²	159.8	80%	0.799	83%	0.832	S	S	*	*			trans	-94.4	163.4	165	-101	-154.7	15.4	0	0	110
46	P	40.2	Very low	30.5	Very low	131 Å²	131	161.4 Å²	161.4	85%	0.851	83%	0.831	S	S	*	*				-159	176.9	72.5	39.6	-16.7	0	0	0	118.1
47	G	25.7	Very low	29.9	Very low	78 Å²	78	165.8 Å²	165.8	80%	0.804	83%	0.83	S	S	*	*			trans	148.6	110.7	153.4	0	0	0	0	0	117.7
48	H	30.6	Very low	29.8	Very low	204 Å²	204	166.7 Å²	166.7	94%	0.944	83%	0.833	S	S	*	*			trans	-82.2	143.5	176.7	-87.5	-79.3	0	0	0	114.2
49	A	26.9	Very low	30	Very low	103 Å²	103	165.3 Å²	165.3	85%	0.851	83%	0.827	S	S	*	*			trans	-156.2	130.4	145.9	0	0	0	0	0	111.8
50	R	33	Very low	30.4	Very low	248 Å²	248	164.5 Å²	164.5	94%	0.936	83%	0.832	S	S	*	*			trans	-79.1	138.4	175.5	-89.7	177.3	164.5	-162	-3.1	111.2
51	R	25.7	Very low	30.8	Very low	242 Å²	242	162.7 Å²	162.7	91%	0.913	84%	0.839	S	S	*	*			trans	-165.8	146.4	135.8	-110.4	172.8	-173.9	-129	2.3	112.1
52	Q	32.5	Very low	31.4	Very low	183 Å²	183	158.7 Å²	158.7	86%	0.855	84%	0.835	S	S	*	*			trans	-51.4	140.4	-177	-64.1	155.3	-28	0	0	113.1
53	T	26.7	Very low	32.4	Very low	142 Å²	142	156.1 Å²	156.1	87%	0.871	84%	0.838	S	S	*	*			trans	-153.2	148.8	145.1	37.4	0	0	0	0	111.4
54	S	27.1	Very low	33.6	Very low	105 Å²	105	152.8 Å²	152.8	73%	0.734	83%	0.829	S	S	*	*			trans	-52.9	153.8	-173	44.8	0	0	0	0	117.1	S56	S54-S56 PolarHBondContact O-N 3.37Å
55	C	37.1	Very low	35.7	Very low	120 Å²	120	147.6 Å²	147.6	81%	0.811	80%	0.795	S	S	*	*			trans	-37.6	121.6	159	-164.1	0	0	0	0	113
56	S	27	Very low	38.2	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	77%	0.772	S	S	*	*			trans	-141.5	103	154.7	59	0	0	0	0	108.2	S54 R58	S54-S56 PolarHBondContact O-N 3.37Å; S56-R58 PolarHBondContact O-N 3.4Å
57	R	30.6	Very low	40.6	Very low	229 Å²	229	137.3 Å²	137.3	86%	0.864	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-50.3	132.3	170.3	-71.2	175.1	172.3	-172.1	-4	109.6
58	R	27.8	Very low	43.5	Very low	236 Å²	236	136.5 Å²	136.5	89%	0.891	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-70.1	131.6	158.7	-73.3	-176.8	176.7	-171.3	-1.7	107.5	S56	S56-R58 PolarHBondContact O-N 3.4Å
59	P	33.9	Very low	46.3	Very low	124 Å²	124	126.8 Å²	126.8	81%	0.805	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-69.6	137.7	173.7	-7.7	23.5	0	0	0	109.6
60	E	35.3	Very low	49.1	Very low	188 Å²	188	127.3 Å²	127.3	88%	0.879	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-55.4	144.5	168.7	-69.3	165	146.5	0	0	110.6	A62	E60-A62 PolarHBondContact O-N 2.94Å
61	S	35.6	Very low	51.6	Low	121 Å²	121	116.2 Å²	116.2	85%	0.846	60%	0.602	S	S	*	*			trans	-62.3	115.8	-179.2	54.1	0	0	0	0	111.2
62	A	40.1	Very low	54	Low	83 Å²	83	109.3 Å²	109.3	69%	0.686	58%	0.581	S	S	*	*			trans	-62.9	141.3	175.5	0	0	0	0	0	112.2	E60 T64	E60-A62 PolarHBondContact O-N 2.94Å; A62-T64 PolarHBondContact O-N 3.06Å
63	D	49.2	Very low	55.8	Low	164 Å²	164	105.3 Å²	105.3	88%	0.877	57%	0.565	S	S	*	*			trans	-53.4	97.9	166.1	-96.7	-28.7	0	0	0	110.6
64	T	55.5	Low	57.8	Low	102 Å²	102	99.7 Å²	99.7	63%	0.626	54%	0.535	S	S	*	.			trans	-89.4	111	173.4	50.2	0	0	0	0	110.2	A62	A62-T64 PolarHBondContact O-N 3.06Å
65	M	80.6	Confident	59.8	Low	17 Å²	17	104.8 Å²	104.8	8%	0.084	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	151.5	171.3	170.8	177.2	158.6	0	0	110.6	I67 S82 L83 R85 V127 R128 L129	M65-I67 HydrophobicContact CE-CG2 3.36Å; M65-S82 PolarHBondContact O-N 3.19Å; M65-L83 WeakPolarHBondContact CA-O 3.3Å; M65-L83 WeakPolarHBondContact CB-O 3.17Å; M65-L83 PolarHBondContact N-O 2.76Å; M65-L83 WeakPolarHBondContact O-CB 3.4Å; M65-L83 PolarHBondContact O-N 3.01Å; M65-R85 HydrophobicContact SD-CG 4.31Å; M65-V127 HydrophobicContact CE-CB 4.36Å; M65-V127 HydrophobicContact CE-CG1 3.86Å; M65-V127 WeakPolarHBondContact CE-O 3.31Å; M65-R128 VanDerWaalsContact CE-O 3.29Å; M65-R128 WeakPolarHBondContact CE-O 3.15Å; M65-L129 HydrophobicContact CB-CD1 4.48Å; M65-L129 HydrophobicContact CG-CB 4.2Å; M65-L129 HydrophobicContact CG-CD1 4.46Å
66	W	81.8	Confident	61.5	Low	86 Å²	86	104 Å²	104	33%	0.326	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.2	172.1	62.7	-91	0	0	0	110.4	Q68 T79 V80 D81 L129 N130	W66-Q68 HydrophobicContact CZ3-CG 3.98Å; W66-T79 HydrophobicContact CB-CG2 4.25Å; W66-T79 HydrophobicContact CD2-CG2 4.19Å; W66-T79 HydrophobicContact CE3-CG2 3.56Å; W66-T79 HydrophobicContact CZ3-CG2 4.19Å; W66-V80 VanDerWaalsContact CA-O 3.29Å; W66-V80 WeakPolarHBondContact CA-O 3.49Å; W66-D81 HydrophobicContact CB-CB 4.15Å; W66-L129 HydrophobicContact CZ2-CD2 4.36Å; W66-N130 HydrophobicContact CE3-CB 4.4Å; W66-N130 HydrophobicContact CH2-CB 3.57Å; W66-N130 WeakPolarHBondContact CH2-OD1 3.29Å; W66-N130 HydrophobicContact CZ2-CB 3.87Å; W66-N130 HydrophobicContact CZ3-CB 3.84Å; W66-N130 WeakPolarHBondContact CZ3-OD1 3.35Å; W66-N130 PolarHBondContact O-N 3.47Å
67	I	89.8	Confident	64.3	Low	0 Å²	0	102 Å²	102	0%	0	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	163.4	-179.2	68.4	-177.9	0	0	0	110.2	M65 V69 T79 V80 L83 L92 V127 I133	M65-I67 HydrophobicContact CE-CG2 3.36Å; I67-V69 HydrophobicContact CD1-CG2 4.5Å; I67-T79 WeakPolarHBondContact O-CA 3.5Å; I67-V80 HydrophobicContact CG1-CB 4.03Å; I67-V80 PolarHBondContact N-O 3.19Å; I67-V80 PolarHBondContact O-N 2.83Å; I67-L83 HydrophobicContact CB-CD1 4.31Å; I67-L83 HydrophobicContact CD1-CD1 3.5Å; I67-L83 VanDerWaalsContact CD1-CD1 3.5Å; I67-L83 HydrophobicContact CG1-CD1 3.47Å; I67-L83 VanDerWaalsContact CG1-CD1 3.47Å; I67-L83 HydrophobicContact CG2-CD1 4.1Å; I67-L92 HydrophobicContact CD1-CD1 3.74Å; I67-L92 HydrophobicContact CD1-CD2 3.95Å; I67-V127 HydrophobicContact CG2-CG1 3.9Å; I67-I133 HydrophobicContact CD1-CD1 3.47Å; I67-I133 VanDerWaalsContact CD1-CD1 3.47Å; I67-I133 HydrophobicContact CD1-CG1 4.29Å
68	Q	86.9	Confident	66.9	Low	60 Å²	60	94.8 Å²	94.8	28%	0.28	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.8	171.8	-63.8	-172.1	-24.4	0	0	109.5	W66 T77 D131 T132 I133	W66-Q68 HydrophobicContact CZ3-CG 3.98Å; Q68-T77 HydrophobicContact CB-CG2 4.36Å; Q68-D131 PolarHBondContact N-O 3.29Å; Q68-T132 HydrophobicContact CB-CG2 4.32Å; Q68-T132 CarbonylContact O-C 3.55Å; Q68-T132 VanDerWaalsContact O-CA 3.24Å; Q68-T132 WeakPolarHBondContact O-CA 3.3Å; Q68-I133 PolarHBondContact O-N 2.81Å
69	V	88.4	Confident	69.7	Low	0 Å²	0	87 Å²	87	0%	0	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.2	169.9	177.2	0	0	0	0	107.2	I67 T77 H78 V80 I96 F100 I133 L135	I67-V69 HydrophobicContact CD1-CG2 4.5Å; V69-T77 CarbonylContact O-C 3.57Å; V69-T77 VanDerWaalsContact O-CA 3.27Å; V69-T77 WeakPolarHBondContact O-CA 3.28Å; V69-H78 PolarHBondContact N-O 2.79Å; V69-H78 PolarHBondContact O-N 3.45Å; V69-V80 HydrophobicContact CB-CG2 4.27Å; V69-V80 HydrophobicContact CG2-CG2 3.55Å; V69-I96 HydrophobicContact CB-CD1 4.46Å; V69-I96 HydrophobicContact CG1-CD1 3.96Å; V69-I96 HydrophobicContact CG1-CG1 4.27Å; V69-I96 HydrophobicContact CG2-CD1 3.73Å; V69-I96 HydrophobicContact CG2-CG1 3.97Å; V69-F100 HydrophobicContact CB-CE2 3.78Å; V69-F100 HydrophobicContact CB-CZ 3.98Å; V69-F100 HydrophobicContact CG1-CD2 4.44Å; V69-F100 HydrophobicContact CG1-CE2 3.67Å; V69-F100 HydrophobicContact CG1-CZ 3.82Å; V69-F100 WeakPolarHBondContact O-CZ 3.23Å; V69-I133 CarbonylContact C-O 3.55Å; V69-I133 VanDerWaalsContact CA-O 3.29Å; V69-I133 WeakPolarHBondContact CA-O 3.36Å; V69-I133 HydrophobicContact CG2-CB 4.4Å; V69-L135 HydrophobicContact CG1-CB 3.84Å; V69-L135 HydrophobicContact CG1-CD2 4.45Å
70	R	86.9	Confident	72.2	Confident	115 Å²	115	81.2 Å²	81.2	43%	0.434	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.3	-178.4	-178.3	174.6	-173.7	-152.4	-2.8	109.9	G74 Q76 T77 T132 I133 Q134 L135	R70-G74 VanDerWaalsContact NH2-CA 3.3Å; R70-G74 PolarHBondContact NH2-O 3.14Å; R70-Q76 WeakPolarHBondContact CA-O 3.1Å; R70-T77 HydrophobicContact CB-CG2 4.25Å; R70-T77 WeakPolarHBondContact CG-OG1 3.33Å; R70-T132 HydrophobicContact CB-CG2 3.72Å; R70-I133 PolarHBondContact N-O 2.99Å; R70-Q134 CarbonylContact O-C 3.58Å; R70-Q134 WeakPolarHBondContact O-CA 3.44Å; R70-L135 PolarHBondContact O-N 3.03Å
71	T	84.5	Confident	74.3	Confident	15 Å²	15	77 Å²	77	9%	0.092	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.3	173	42.2	0	0	0	0	111.8	D73 G74 R75 Q76 F100 L135	T71-D73 WeakPolarHBondContact CB-OD1 3.34Å; T71-D73 PolarHBondContact O-N 2.58Å; T71-D73 PolarHBondContact OG1-OD1 3.35Å; T71-G74 VanDerWaalsContact O-CA 3.31Å; T71-G74 WeakPolarHBondContact O-CA 3.5Å; T71-G74 PolarHBondContact O-N 3.44Å; T71-R75 PolarHBondContact OG1-N 3.26Å; T71-Q76 HydrophobicContact CG2-CB 4.07Å; T71-Q76 PolarHBondContact N-O 3Å; T71-Q76 PolarHBondContact OG1-N 3.01Å; T71-Q76 PolarHBondContact OG1-O 3.33Å; T71-F100 HydrophobicContact CG2-CD1 4.08Å; T71-F100 HydrophobicContact CG2-CE1 3.97Å; T71-L135 CarbonylContact C-O 3.59Å; T71-L135 WeakPolarHBondContact CA-O 3.15Å; T71-L135 HydrophobicContact CG2-CD2 4.44Å
72	M	76.5	Confident	76.3	Confident	96 Å²	96	74.8 Å²	74.8	47%	0.473	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.2	-177.3	-82.9	-65.6	-71.9	0	0	114.1	G74 Q134 L135 L136	M72-G74 PolarHBondContact O-N 3.1Å; M72-Q134 HydrophobicContact CG-CB 4.41Å; M72-Q134 HydrophobicContact SD-CB 3.62Å; M72-Q134 HydrophobicContact SD-CG 4.12Å; M72-Q134 PolarHBondContact SD-OE1 3.29Å; M72-Q134 VanDerWaalsContact SD-OE1 3.37Å; M72-L135 PolarHBondContact N-O 3.28Å; M72-L136 HydrophobicContact CB-CD1 4.03Å; M72-L136 HydrophobicContact CG-CB 3.76Å; M72-L136 HydrophobicContact CG-CD1 3.98Å; M72-L136 HydrophobicContact CG-CG 4.49Å
73	D	69.7	Low	78.3	Confident	100 Å²	100	71 Å²	71	54%	0.535	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.7	172.9	67	-9.7	0	0	0	112.7	T71 R75	T71-D73 WeakPolarHBondContact CB-OD1 3.34Å; T71-D73 PolarHBondContact O-N 2.58Å; T71-D73 PolarHBondContact OG1-OD1 3.35Å; D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 HydrophobicContact CB-CG 4.34Å; D73-R75 PolarHBondContact O-N 2.91Å; D73-R75 PolarHBondContact OD1-N 3.46Å; D73-R75 WeakPolarHBondContact OD2-CD 3.33Å; D73-R75 WeakPolarHBondContact OD2-CG 3.33Å; D73-R75 IonicContact OD2-NE 2.74Å
74	G	69.4	Low	79.8	Confident	23 Å²	23	65.7 Å²	65.7	24%	0.237	34%	0.336	C	S	.	.	S	Bend	trans	73.5	9.1	176.5	0	0	0	0	0	115.4	R70 T71 M72	R70-G74 VanDerWaalsContact NH2-CA 3.3Å; R70-G74 PolarHBondContact NH2-O 3.14Å; T71-G74 VanDerWaalsContact O-CA 3.31Å; T71-G74 WeakPolarHBondContact O-CA 3.5Å; T71-G74 PolarHBondContact O-N 3.44Å; M72-G74 PolarHBondContact O-N 3.1Å
75	R	69.8	Low	80.7	Confident	212 Å²	212	67.2 Å²	67.2	80%	0.8	33%	0.33	S	S	*	.	S	Bend	trans	-83.2	-30.4	-170.9	-66.8	-173.2	-172.8	-174	0.3	114.3	T71 D73	T71-R75 PolarHBondContact OG1-N 3.26Å; D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 HydrophobicContact CB-CG 4.34Å; D73-R75 PolarHBondContact O-N 2.91Å; D73-R75 PolarHBondContact OD1-N 3.46Å; D73-R75 WeakPolarHBondContact OD2-CD 3.33Å; D73-R75 WeakPolarHBondContact OD2-CG 3.33Å; D73-R75 IonicContact OD2-NE 2.74Å
76	Q	73	Confident	80.5	Confident	103 Å²	103	72.8 Å²	72.8	48%	0.481	36%	0.359	S	S	.	.			trans	-129	133	-178.9	-69.2	179.8	-6.8	0	0	111.2	R70 T71 F100	R70-Q76 WeakPolarHBondContact CA-O 3.1Å; T71-Q76 HydrophobicContact CG2-CB 4.07Å; T71-Q76 PolarHBondContact N-O 3Å; T71-Q76 PolarHBondContact OG1-N 3.01Å; T71-Q76 PolarHBondContact OG1-O 3.33Å; Q76-F100 HydrophobicContact CB-CE1 4.09Å
77	T	85.5	Confident	80.7	Confident	68 Å²	68	69 Å²	69	42%	0.417	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	126.8	174.8	-53.4	0	0	0	0	109	Q68 V69 R70	Q68-T77 HydrophobicContact CB-CG2 4.36Å; V69-T77 CarbonylContact O-C 3.57Å; V69-T77 VanDerWaalsContact O-CA 3.27Å; V69-T77 WeakPolarHBondContact O-CA 3.28Å; R70-T77 HydrophobicContact CB-CG2 4.25Å; R70-T77 WeakPolarHBondContact CG-OG1 3.33Å
78	H	85.3	Confident	80.6	Confident	77 Å²	77	73.2 Å²	73.2	36%	0.356	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.4	175.4	-71.8	-88.7	0	0	0	110.9	V69 F100	V69-H78 PolarHBondContact N-O 2.79Å; V69-H78 PolarHBondContact O-N 3.45Å; H78-F100 HydrophobicContact CB-CE2 3.67Å; H78-F100 HydrophobicContact CB-CZ 3.64Å; H78-F100 AromaticContact CD2-CE1 3.6Å; H78-F100 AromaticContact CD2-CZ 3.54Å; H78-F100 AromaticContact CG-CZ 3.97Å
79	T	86.3	Confident	80.7	Confident	72 Å²	72	70.4 Å²	70.4	44%	0.442	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.2	173.3	-57.7	0	0	0	0	109.2	W66 I67	W66-T79 HydrophobicContact CB-CG2 4.25Å; W66-T79 HydrophobicContact CD2-CG2 4.19Å; W66-T79 HydrophobicContact CE3-CG2 3.56Å; W66-T79 HydrophobicContact CZ3-CG2 4.19Å; I67-T79 WeakPolarHBondContact O-CA 3.5Å
80	V	86.3	Confident	80.6	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.018	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.9	171.4	-170.3	0	0	0	0	107.6	W66 I67 V69 L83 L92 K95 I96 L99	W66-V80 VanDerWaalsContact CA-O 3.29Å; W66-V80 WeakPolarHBondContact CA-O 3.49Å; I67-V80 HydrophobicContact CG1-CB 4.03Å; I67-V80 PolarHBondContact N-O 3.19Å; I67-V80 PolarHBondContact O-N 2.83Å; V69-V80 HydrophobicContact CB-CG2 4.27Å; V69-V80 HydrophobicContact CG2-CG2 3.55Å; V80-L83 HydrophobicContact CB-CD1 4.2Å; V80-L83 HydrophobicContact CG1-CD1 3.99Å; V80-L83 HydrophobicContact CG1-CD2 4.2Å; V80-L83 HydrophobicContact CG1-CG 4.26Å; V80-L92 HydrophobicContact CG1-CD1 4.08Å; V80-K95 HydrophobicContact CG1-CB 3.87Å; V80-K95 HydrophobicContact CG1-CD 3.91Å; V80-I96 HydrophobicContact CG2-CG1 4.36Å; V80-L99 HydrophobicContact CB-CD1 4.31Å; V80-L99 HydrophobicContact CG1-CD1 4.36Å; V80-L99 HydrophobicContact CG2-CD1 3.74Å
81	D	78.9	Confident	80.5	Confident	100 Å²	100	72.8 Å²	72.8	54%	0.535	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	178.8	-179.8	67.9	32.3	0	0	0	112.7	W66 L83 K95	W66-D81 HydrophobicContact CB-CB 4.15Å; D81-L83 VanDerWaalsContact C-N 3.32Å; D81-L83 PolarHBondContact O-N 3.21Å; D81-K95 PolarHBondContact O-NZ 2.76Å
82	S	78.4	Confident	80.7	Confident	75 Å²	75	72 Å²	72	52%	0.524	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.1	37.6	175.7	-46.9	0	0	0	0	113.3	M65 K95	M65-S82 PolarHBondContact O-N 3.19Å; S82-K95 PolarHBondContact O-NZ 3.2Å
83	L	81.2	Confident	81.3	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.016	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	152.4	176.8	-59.8	169.5	0	0	0	110.3	M65 I67 V80 D81 T87 L92 K95 L122	M65-L83 WeakPolarHBondContact CA-O 3.3Å; M65-L83 WeakPolarHBondContact CB-O 3.17Å; M65-L83 PolarHBondContact N-O 2.76Å; M65-L83 WeakPolarHBondContact O-CB 3.4Å; M65-L83 PolarHBondContact O-N 3.01Å; I67-L83 HydrophobicContact CB-CD1 4.31Å; I67-L83 HydrophobicContact CD1-CD1 3.5Å; I67-L83 VanDerWaalsContact CD1-CD1 3.5Å; I67-L83 HydrophobicContact CG1-CD1 3.47Å; I67-L83 VanDerWaalsContact CG1-CD1 3.47Å; I67-L83 HydrophobicContact CG2-CD1 4.1Å; V80-L83 HydrophobicContact CB-CD1 4.2Å; V80-L83 HydrophobicContact CG1-CD1 3.99Å; V80-L83 HydrophobicContact CG1-CD2 4.2Å; V80-L83 HydrophobicContact CG1-CG 4.26Å; D81-L83 VanDerWaalsContact C-N 3.32Å; D81-L83 PolarHBondContact O-N 3.21Å; L83-T87 HydrophobicContact CD2-CG2 3.87Å; L83-L92 HydrophobicContact CD1-CD1 4.28Å; L83-L92 HydrophobicContact CD2-CD1 4.33Å; L83-K95 HydrophobicContact CD2-CD 3.72Å; L83-L122 HydrophobicContact CB-CD1 4.29Å; L83-L122 HydrophobicContact CD1-CD1 4.14Å
84	S	81.3	Confident	82.2	Confident	53 Å²	53	69.6 Å²	69.6	37%	0.371	34%	0.34	S	S	.	.			trans	-113.3	163.5	165.9	78.8	0	0	0	0	110.8	L86 T87	S84-L86 PolarHBondContact O-N 2.8Å; S84-L86 PolarHBondContact OG-N 3.29Å; S84-T87 PolarHBondContact N-OG1 2.91Å; S84-T87 WeakPolarHBondContact O-CB 3.29Å; S84-T87 PolarHBondContact O-N 2.73Å; S84-T87 PolarHBondContact O-OG1 2.71Å; S84-T87 PolarHBondContact OG-N 3.39Å; S84-T87 PolarHBondContact OG-OG1 3.33Å
85	R	73.8	Confident	83	Confident	134 Å²	134	70.5 Å²	70.5	51%	0.506	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.8	173.5	-63.1	-172.3	73.9	170.4	-2.1	112.6	M65 F123	M65-R85 HydrophobicContact SD-CG 4.31Å; R85-F123 HydrophobicContact CB-CB 4.32Å; R85-F123 HydrophobicContact CB-CD2 4.46Å; R85-F123 WeakPolarHBondContact O-CB 3.44Å; R85-F123 PolarHBondContact O-N 3.41Å
86	L	78.1	Confident	83.9	Confident	133 Å²	133	60.4 Å²	60.4	70%	0.696	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	2.6	178.5	-60.6	174.8	0	0	0	113.2	S84 K88 T121	S84-L86 PolarHBondContact O-N 2.8Å; S84-L86 PolarHBondContact OG-N 3.29Å; L86-K88 PolarHBondContact O-N 2.85Å; L86-T121 WeakPolarHBondContact O-CG2 3.41Å
87	T	84.4	Confident	84.5	Confident	6 Å²	6	58 Å²	58	4%	0.037	29%	0.288	C	S	.	.			trans	-61	129.2	177	-46	0	0	0	0	109	L83 S84 E91 T121 L122	L83-T87 HydrophobicContact CD2-CG2 3.87Å; S84-T87 PolarHBondContact N-OG1 2.91Å; S84-T87 WeakPolarHBondContact O-CB 3.29Å; S84-T87 PolarHBondContact O-N 2.73Å; S84-T87 PolarHBondContact O-OG1 2.71Å; S84-T87 PolarHBondContact OG-N 3.39Å; S84-T87 PolarHBondContact OG-OG1 3.33Å; T87-E91 HydrophobicContact CG2-CB 4.05Å; T87-E91 HydrophobicContact CG2-CG 3.78Å; T87-T121 CarbonylContact O-C 3.5Å; T87-T121 VanDerWaalsContact O-CA 3.28Å; T87-T121 WeakPolarHBondContact O-CA 3.37Å; T87-L122 PolarHBondContact O-N 3.05Å
88	K	88.7	Confident	84.4	Confident	90 Å²	90	61 Å²	61	39%	0.391	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-77	153.3	177	-68.1	-176.9	176.4	-175	0	111.6	L86 E90 E91 L92 H120 T121	L86-K88 PolarHBondContact O-N 2.85Å; K88-E90 VanDerWaalsContact C-N 3.26Å; K88-E90 HydrophobicContact CB-CG 3.85Å; K88-E90 HydrophobicContact CD-CG 4.38Å; K88-E90 WeakPolarHBondContact CD-OE1 3.47Å; K88-E90 IonicContact NZ-OE1 3.19Å; K88-E90 PolarHBondContact O-N 2.89Å; K88-E91 WeakPolarHBondContact O-CB 3.49Å; K88-E91 PolarHBondContact O-N 3.24Å; K88-E91 VanDerWaalsContact O-N 3.12Å; K88-L92 PolarHBondContact O-N 2.99Å; K88-H120 CarbonylContact C-O 3.51Å; K88-H120 VanDerWaalsContact CA-O 3.27Å; K88-H120 WeakPolarHBondContact CA-O 3.5Å; K88-T121 HydrophobicContact CG-CG2 4.19Å
89	V	88.1	Confident	84.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.8	-36.7	178	178.7	0	0	0	0	111.6	E91 L92 R93 L109 M116 E117 H120 Y125	V89-E91 VanDerWaalsContact C-N 3.29Å; V89-E91 PolarHBondContact O-N 3.28Å; V89-L92 WeakPolarHBondContact O-CB 3.31Å; V89-L92 PolarHBondContact O-N 3.42Å; V89-R93 WeakPolarHBondContact O-CG 3.47Å; V89-R93 PolarHBondContact O-N 2.88Å; V89-L109 HydrophobicContact CG1-CD1 4.27Å; V89-M116 HydrophobicContact CG1-CB 3.87Å; V89-M116 HydrophobicContact CG2-CB 4.12Å; V89-M116 HydrophobicContact CG2-CE 3.92Å; V89-E117 VanDerWaalsContact CB-O 3.25Å; V89-E117 WeakPolarHBondContact CB-O 3.18Å; V89-E117 WeakPolarHBondContact CG2-O 3.47Å; V89-H120 HydrophobicContact CG2-CB 4.5Å; V89-H120 WeakPolarHBondContact CG2-O 3.43Å; V89-H120 PolarHBondContact N-O 2.95Å; V89-Y125 HydrophobicContact CG2-CD2 4.23Å; V89-Y125 HydrophobicContact CG2-CE2 3.76Å
90	E	87.2	Confident	84.1	Confident	90 Å²	90	58 Å²	58	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-38.2	175.1	66.3	-166.6	175.3	0	0	112.7	K88 R93 R94 D118	K88-E90 VanDerWaalsContact C-N 3.26Å; K88-E90 HydrophobicContact CB-CG 3.85Å; K88-E90 HydrophobicContact CD-CG 4.38Å; K88-E90 WeakPolarHBondContact CD-OE1 3.47Å; K88-E90 IonicContact NZ-OE1 3.19Å; K88-E90 PolarHBondContact O-N 2.89Å; E90-R93 PolarHBondContact O-N 2.86Å; E90-R94 PolarHBondContact O-N 3.35Å; E90-D118 HydrophobicContact CB-CB 4.31Å
91	E	85.2	Confident	83.8	Confident	75 Å²	75	65.8 Å²	65.8	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-74.4	-36.4	177.1	173.7	165.2	-144.9	0	0	111.6	T87 K88 V89 R94 K95	T87-E91 HydrophobicContact CG2-CB 4.05Å; T87-E91 HydrophobicContact CG2-CG 3.78Å; K88-E91 WeakPolarHBondContact O-CB 3.49Å; K88-E91 PolarHBondContact O-N 3.24Å; K88-E91 VanDerWaalsContact O-N 3.12Å; V89-E91 VanDerWaalsContact C-N 3.29Å; V89-E91 PolarHBondContact O-N 3.28Å; E91-R94 PolarHBondContact O-N 2.96Å; E91-R94 IonicContact OE1-NH2 3.29Å; E91-R94 PolarHBondContact OE1-NH2 3.22Å; E91-K95 PolarHBondContact O-N 2.88Å
92	L	88.8	Confident	84	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-41.9	171.2	174.8	62	0	0	0	111.3	I67 V80 L83 K88 V89 R94 K95 I96 L109 M116 L122 I133	I67-L92 HydrophobicContact CD1-CD1 3.74Å; I67-L92 HydrophobicContact CD1-CD2 3.95Å; V80-L92 HydrophobicContact CG1-CD1 4.08Å; L83-L92 HydrophobicContact CD1-CD1 4.28Å; L83-L92 HydrophobicContact CD2-CD1 4.33Å; K88-L92 PolarHBondContact O-N 2.99Å; V89-L92 WeakPolarHBondContact O-CB 3.31Å; V89-L92 PolarHBondContact O-N 3.42Å; L92-R94 VanDerWaalsContact C-N 3.31Å; L92-R94 PolarHBondContact O-N 2.89Å; L92-K95 PolarHBondContact O-N 3.47Å; L92-I96 HydrophobicContact CD1-CD1 3.95Å; L92-I96 HydrophobicContact CD1-CG1 4.14Å; L92-I96 HydrophobicContact CD2-CD1 4.3Å; L92-I96 HydrophobicContact CG-CD1 3.77Å; L92-I96 HydrophobicContact CG-CG1 4.37Å; L92-I96 VanDerWaalsContact O-CG1 3.31Å; L92-I96 WeakPolarHBondContact O-CG1 3.27Å; L92-I96 PolarHBondContact O-N 2.84Å; L92-L109 HydrophobicContact CD2-CD1 4Å; L92-L109 HydrophobicContact CG-CD1 4.22Å; L92-M116 HydrophobicContact CD2-CE 4.36Å; L92-L122 HydrophobicContact CD2-CD2 3.79Å; L92-I133 HydrophobicContact CD2-CD1 3.54Å
93	R	88.6	Confident	84.1	Confident	16 Å²	16	63.6 Å²	63.6	6%	0.06	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-38.6	177.1	-72.4	170	-177.9	-84.7	-4.5	112.6	V89 E90 I96 Q97 P104 Q107 L109 M116 D118	V89-R93 WeakPolarHBondContact O-CG 3.47Å; V89-R93 PolarHBondContact O-N 2.88Å; E90-R93 PolarHBondContact O-N 2.86Å; R93-I96 PolarHBondContact O-N 2.82Å; R93-Q97 PolarHBondContact O-N 3.3Å; R93-P104 HydrophobicContact CB-CB 4.13Å; R93-P104 PolarHBondContact NH1-O 3.47Å; R93-Q107 VanDerWaalsContact CA-OE1 3.27Å; R93-Q107 PolarHBondContact NH1-O 3.41Å; R93-Q107 PolarHBondContact O-NE2 2.89Å; R93-Q107 PolarHBondContact O-OE1 3.46Å; R93-L109 HydrophobicContact CG-CD1 3.71Å; R93-L109 HydrophobicContact CG-CG 4.43Å; R93-M116 PolarHBondContact NH2-O 3.12Å; R93-D118 WeakPolarHBondContact CD-OD1 3.43Å; R93-D118 IonicContact CZ-OD1 2.81Å; R93-D118 IonicContact NE-OD1 3.87Å; R93-D118 PolarHBondContact NE-OD1 2.81Å; R93-D118 IonicContact NE-OD2 3.53Å
94	R	87.4	Confident	84.2	Confident	128 Å²	128	65.3 Å²	65.3	48%	0.483	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-43.8	174.2	-176.1	174.3	58.8	-139.9	-2	111.8	E90 E91 L92 I96 Q97 E98	E90-R94 PolarHBondContact O-N 3.35Å; E91-R94 PolarHBondContact O-N 2.96Å; E91-R94 IonicContact OE1-NH2 3.29Å; E91-R94 PolarHBondContact OE1-NH2 3.22Å; L92-R94 VanDerWaalsContact C-N 3.31Å; L92-R94 PolarHBondContact O-N 2.89Å; R94-I96 VanDerWaalsContact C-N 3.32Å; R94-I96 PolarHBondContact O-N 2.65Å; R94-Q97 WeakPolarHBondContact O-CB 3.45Å; R94-Q97 PolarHBondContact O-N 3.14Å; R94-E98 PolarHBondContact O-N 3.48Å
95	K	86.8	Confident	83.9	Confident	43 Å²	43	66 Å²	66	19%	0.187	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-35.3	174.4	-71.5	-176.1	167.1	-162.4	0	112.8	V80 D81 S82 L83 E91 L92 E98 L99	V80-K95 HydrophobicContact CG1-CB 3.87Å; V80-K95 HydrophobicContact CG1-CD 3.91Å; D81-K95 PolarHBondContact O-NZ 2.76Å; S82-K95 PolarHBondContact O-NZ 3.2Å; L83-K95 HydrophobicContact CD2-CD 3.72Å; E91-K95 PolarHBondContact O-N 2.88Å; L92-K95 PolarHBondContact O-N 3.47Å; K95-E98 PolarHBondContact O-N 3Å; K95-L99 WeakPolarHBondContact O-CG 3.23Å; K95-L99 PolarHBondContact O-N 3.26Å
96	I	87.9	Confident	84.3	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-34.7	174.9	-69.6	171.1	0	0	0	111.1	V69 V80 L92 R93 R94 E98 L99 F100 Q107 L109 L135	V69-I96 HydrophobicContact CB-CD1 4.46Å; V69-I96 HydrophobicContact CG1-CD1 3.96Å; V69-I96 HydrophobicContact CG1-CG1 4.27Å; V69-I96 HydrophobicContact CG2-CD1 3.73Å; V69-I96 HydrophobicContact CG2-CG1 3.97Å; V80-I96 HydrophobicContact CG2-CG1 4.36Å; L92-I96 HydrophobicContact CD1-CD1 3.95Å; L92-I96 HydrophobicContact CD1-CG1 4.14Å; L92-I96 HydrophobicContact CD2-CD1 4.3Å; L92-I96 HydrophobicContact CG-CD1 3.77Å; L92-I96 HydrophobicContact CG-CG1 4.37Å; L92-I96 VanDerWaalsContact O-CG1 3.31Å; L92-I96 WeakPolarHBondContact O-CG1 3.27Å; L92-I96 PolarHBondContact O-N 2.84Å; R93-I96 PolarHBondContact O-N 2.82Å; R94-I96 VanDerWaalsContact C-N 3.32Å; R94-I96 PolarHBondContact O-N 2.65Å; I96-E98 VanDerWaalsContact C-N 3.32Å; I96-E98 PolarHBondContact O-N 2.81Å; I96-L99 PolarHBondContact O-N 2.82Å; I96-F100 HydrophobicContact CG2-CB 4.34Å; I96-F100 HydrophobicContact CG2-CD2 3.79Å; I96-F100 HydrophobicContact CG2-CG 4.33Å; I96-F100 WeakPolarHBondContact O-CB 3.18Å; I96-F100 PolarHBondContact O-N 3.03Å; I96-Q107 HydrophobicContact CG2-CG 4.48Å; I96-L109 HydrophobicContact CD1-CD1 3.72Å; I96-L109 HydrophobicContact CD1-CD2 3.44Å; I96-L109 VanDerWaalsContact CD1-CD2 3.44Å; I96-L109 HydrophobicContact CD1-CG 4.23Å; I96-L135 HydrophobicContact CG2-CD1 4.27Å; I96-L135 HydrophobicContact CG2-CD2 3.76Å
97	Q	87.3	Confident	84.5	Confident	52 Å²	52	56.2 Å²	56.2	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-42.4	173.5	179.3	-177.5	17.3	0	0	111.1	R93 R94 L99 H101 V102 E103 P104	R93-Q97 PolarHBondContact O-N 3.3Å; R94-Q97 WeakPolarHBondContact O-CB 3.45Å; R94-Q97 PolarHBondContact O-N 3.14Å; Q97-L99 VanDerWaalsContact C-N 3.31Å; Q97-L99 PolarHBondContact O-N 2.8Å; Q97-H101 WeakPolarHBondContact O-CA 3.09Å; Q97-H101 PolarHBondContact O-N 3.35Å; Q97-V102 WeakPolarHBondContact CA-O 3.2Å; Q97-V102 WeakPolarHBondContact CB-O 2.93Å; Q97-V102 WeakPolarHBondContact CG-O 3.11Å; Q97-E103 PolarHBondContact NE2-OE1 3.16Å; Q97-E103 PolarHBondContact NE2-OE2 3.38Å; Q97-P104 HydrophobicContact CB-CG 4.41Å; Q97-P104 VanDerWaalsContact CD-CD 3.46Å
98	E	82.1	Confident	84.6	Confident	132 Å²	132	59.5 Å²	59.5	62%	0.617	29%	0.292	S	S	*	.	H	α-helix	trans	-63.3	-35.7	176.9	-69.1	171.6	-171.1	0	0	112.5	R94 K95 I96 H101	R94-E98 PolarHBondContact O-N 3.48Å; K95-E98 PolarHBondContact O-N 3Å; I96-E98 VanDerWaalsContact C-N 3.32Å; I96-E98 PolarHBondContact O-N 2.81Å; E98-H101 PolarHBondContact O-CE1 2.71Å
99	L	83.1	Confident	84.5	Confident	68 Å²	68	55.2 Å²	55.2	36%	0.356	27%	0.274	S	S	.	.	H	α-helix	trans	-92	-34.6	-174.2	-68.5	169.5	0	0	0	114.7	V80 K95 I96 Q97	V80-L99 HydrophobicContact CB-CD1 4.31Å; V80-L99 HydrophobicContact CG1-CD1 4.36Å; V80-L99 HydrophobicContact CG2-CD1 3.74Å; K95-L99 WeakPolarHBondContact O-CG 3.23Å; K95-L99 PolarHBondContact O-N 3.26Å; I96-L99 PolarHBondContact O-N 2.82Å; Q97-L99 VanDerWaalsContact C-N 3.31Å; Q97-L99 PolarHBondContact O-N 2.8Å
100	F	82.4	Confident	84.3	Confident	17 Å²	17	57.1 Å²	57.1	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-108.9	-6.1	-177.1	-70.4	-96.7	0	0	0	113.1	V69 T71 Q76 H78 I96 V102 L135	V69-F100 HydrophobicContact CB-CE2 3.78Å; V69-F100 HydrophobicContact CB-CZ 3.98Å; V69-F100 HydrophobicContact CG1-CD2 4.44Å; V69-F100 HydrophobicContact CG1-CE2 3.67Å; V69-F100 HydrophobicContact CG1-CZ 3.82Å; V69-F100 WeakPolarHBondContact O-CZ 3.23Å; T71-F100 HydrophobicContact CG2-CD1 4.08Å; T71-F100 HydrophobicContact CG2-CE1 3.97Å; Q76-F100 HydrophobicContact CB-CE1 4.09Å; H78-F100 HydrophobicContact CB-CE2 3.67Å; H78-F100 HydrophobicContact CB-CZ 3.64Å; H78-F100 AromaticContact CD2-CE1 3.6Å; H78-F100 AromaticContact CD2-CZ 3.54Å; H78-F100 AromaticContact CG-CZ 3.97Å; I96-F100 HydrophobicContact CG2-CB 4.34Å; I96-F100 HydrophobicContact CG2-CD2 3.79Å; I96-F100 HydrophobicContact CG2-CG 4.33Å; I96-F100 WeakPolarHBondContact O-CB 3.18Å; I96-F100 PolarHBondContact O-N 3.03Å; F100-V102 VanDerWaalsContact C-N 3.26Å; F100-V102 HydrophobicContact CB-CG2 4.18Å; F100-V102 PolarHBondContact O-N 3.4Å; F100-L135 HydrophobicContact CB-CD2 4.03Å; F100-L135 HydrophobicContact CD1-CD2 3.89Å; F100-L135 HydrophobicContact CD2-CD2 4.24Å; F100-L135 HydrophobicContact CE1-CD2 4.39Å; F100-L135 HydrophobicContact CG-CD2 3.79Å
101	H	81.1	Confident	84.1	Confident	166 Å²	166	53.4 Å²	53.4	77%	0.769	26%	0.264	S	S	*	.			trans	55.8	36.7	-177.7	-53.5	-57.7	0	0	0	113.9	Q97 E98	Q97-H101 WeakPolarHBondContact O-CA 3.09Å; Q97-H101 PolarHBondContact O-N 3.35Å; E98-H101 PolarHBondContact O-CE1 2.71Å
102	V	82.8	Confident	83.7	Confident	17 Å²	17	56.9 Å²	56.9	10%	0.103	27%	0.274	C	S	.	.			trans	-111.7	127.2	177.3	-177.9	0	0	0	0	109.2	Q97 F100 L106 Q107 V137	Q97-V102 WeakPolarHBondContact CA-O 3.2Å; Q97-V102 WeakPolarHBondContact CB-O 2.93Å; Q97-V102 WeakPolarHBondContact CG-O 3.11Å; F100-V102 VanDerWaalsContact C-N 3.26Å; F100-V102 HydrophobicContact CB-CG2 4.18Å; F100-V102 PolarHBondContact O-N 3.4Å; V102-L106 HydrophobicContact CG1-CB 3.96Å; V102-Q107 HydrophobicContact CB-CG 4.02Å; V102-Q107 HydrophobicContact CG1-CG 3.65Å; V102-Q107 PolarHBondContact O-NE2 3.26Å; V102-V137 HydrophobicContact CG1-CB 4.46Å; V102-V137 HydrophobicContact CG1-CG1 3.74Å; V102-V137 HydrophobicContact CG1-CG2 4.13Å; V102-V137 HydrophobicContact CG2-CG1 4.14Å; V102-V137 HydrophobicContact CG2-CG2 3.74Å
103	E	80.1	Confident	82.5	Confident	112 Å²	112	60 Å²	60	52%	0.523	31%	0.306	S	S	.	.			trans	-58.6	137.3	176	-74.2	-59.3	131.8	0	0	112.1	Q97 G105 L106 Q107	Q97-E103 PolarHBondContact NE2-OE1 3.16Å; Q97-E103 PolarHBondContact NE2-OE2 3.38Å; E103-G105 PolarHBondContact O-N 3.45Å; E103-L106 HydrophobicContact CB-CD1 4.31Å; E103-L106 HydrophobicContact CB-CG 4.34Å; E103-L106 WeakPolarHBondContact O-CA 3.47Å; E103-L106 WeakPolarHBondContact O-CB 3.14Å; E103-L106 PolarHBondContact O-N 3.41Å; E103-Q107 WeakPolarHBondContact O-CG 3.48Å; E103-Q107 PolarHBondContact O-N 2.69Å
104	P	82.5	Confident	81.7	Confident	39 Å²	39	65.6 Å²	65.6	25%	0.253	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-51.1	-35.2	-176.6	-31.5	36.8	0	0	0	114.8	R93 Q97 L106 Q107	R93-P104 HydrophobicContact CB-CB 4.13Å; R93-P104 PolarHBondContact NH1-O 3.47Å; Q97-P104 HydrophobicContact CB-CG 4.41Å; Q97-P104 VanDerWaalsContact CD-CD 3.46Å; P104-L106 VanDerWaalsContact C-N 3.27Å; P104-L106 PolarHBondContact O-N 3.33Å; P104-Q107 PolarHBondContact O-N 2.73Å
105	G	76.4	Confident	81.5	Confident	69 Å²	69	62.8 Å²	62.8	71%	0.711	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-70.9	-18	177.3	0	0	0	0	0	114.7	E103	E103-G105 PolarHBondContact O-N 3.45Å
106	L	80.7	Confident	81.4	Confident	57 Å²	57	60.7 Å²	60.7	30%	0.298	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-97.5	-11	175.3	-59.6	179.1	0	0	0	112.6	V102 E103 P104 R138	V102-L106 HydrophobicContact CG1-CB 3.96Å; E103-L106 HydrophobicContact CB-CD1 4.31Å; E103-L106 HydrophobicContact CB-CG 4.34Å; E103-L106 WeakPolarHBondContact O-CA 3.47Å; E103-L106 WeakPolarHBondContact O-CB 3.14Å; E103-L106 PolarHBondContact O-N 3.41Å; P104-L106 VanDerWaalsContact C-N 3.27Å; P104-L106 PolarHBondContact O-N 3.33Å; L106-R138 HydrophobicContact CD2-CB 4.38Å; L106-R138 PolarHBondContact O-N 3.22Å
107	Q	84.1	Confident	81.1	Confident	3 Å²	3	65 Å²	65	1%	0.014	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.2	175.8	-58.9	175.1	24.8	0	0	110	R93 I96 V102 E103 P104 L135	R93-Q107 VanDerWaalsContact CA-OE1 3.27Å; R93-Q107 PolarHBondContact NH1-O 3.41Å; R93-Q107 PolarHBondContact O-NE2 2.89Å; R93-Q107 PolarHBondContact O-OE1 3.46Å; I96-Q107 HydrophobicContact CG2-CG 4.48Å; V102-Q107 HydrophobicContact CB-CG 4.02Å; V102-Q107 HydrophobicContact CG1-CG 3.65Å; V102-Q107 PolarHBondContact O-NE2 3.26Å; E103-Q107 WeakPolarHBondContact O-CG 3.48Å; E103-Q107 PolarHBondContact O-N 2.69Å; P104-Q107 PolarHBondContact O-N 2.73Å; Q107-L135 HydrophobicContact CB-CD1 3.71Å; Q107-L135 HydrophobicContact CG-CD1 3.88Å
108	R	84.8	Confident	80.7	Confident	76 Å²	76	66.7 Å²	66.7	29%	0.287	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	114.4	161.8	-81.6	180	173	-170.1	-7	107.7	F110 L136 R138	R108-F110 HydrophobicContact CB-CE2 3.77Å; R108-F110 HydrophobicContact CB-CZ 4.28Å; R108-L136 HydrophobicContact CB-CB 4.01Å; R108-L136 HydrophobicContact CB-CD2 4.38Å; R108-L136 PolarHBondContact N-O 3.22Å; R108-L136 PolarHBondContact O-N 3.28Å; R108-R138 VanDerWaalsContact CZ-CZ 3.46Å; R108-R138 VanDerWaalsContact NH2-NH1 3.15Å
109	L	86.7	Confident	80.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.9	-178.3	-58.2	180	0	0	0	109.2	V89 L92 R93 I96 Q115 M116 I133 Q134 L135	V89-L109 HydrophobicContact CG1-CD1 4.27Å; L92-L109 HydrophobicContact CD2-CD1 4Å; L92-L109 HydrophobicContact CG-CD1 4.22Å; R93-L109 HydrophobicContact CG-CD1 3.71Å; R93-L109 HydrophobicContact CG-CG 4.43Å; I96-L109 HydrophobicContact CD1-CD1 3.72Å; I96-L109 HydrophobicContact CD1-CD2 3.44Å; I96-L109 VanDerWaalsContact CD1-CD2 3.44Å; I96-L109 HydrophobicContact CD1-CG 4.23Å; L109-Q115 CarbonylContact O-C 3.49Å; L109-Q115 WeakPolarHBondContact O-CA 3.42Å; L109-M116 HydrophobicContact CB-CB 4.07Å; L109-M116 HydrophobicContact CB-CG 4.39Å; L109-M116 HydrophobicContact CB-SD 4.15Å; L109-M116 PolarHBondContact O-N 2.87Å; L109-I133 HydrophobicContact CB-CG2 3.97Å; L109-I133 HydrophobicContact CD2-CG2 4.28Å; L109-Q134 CarbonylContact C-O 3.55Å; L109-Q134 WeakPolarHBondContact CA-O 3.42Å; L109-L135 HydrophobicContact CD2-CB 4.25Å; L109-L135 HydrophobicContact CD2-CD1 3.64Å
110	F	83.9	Confident	79.9	Confident	40 Å²	40	62.4 Å²	62.4	18%	0.175	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.1	176.8	-62.3	-91.7	0	0	0	110.3	R108 K114 Q115 I133 Q134 L136	R108-F110 HydrophobicContact CB-CE2 3.77Å; R108-F110 HydrophobicContact CB-CZ 4.28Å; F110-K114 CarbonylContact C-O 3.46Å; F110-K114 WeakPolarHBondContact CA-O 3.37Å; F110-Q115 HydrophobicContact CD1-CB 3.96Å; F110-Q115 HydrophobicContact CD1-CG 4.42Å; F110-Q115 HydrophobicContact CE1-CB 3.71Å; F110-Q115 HydrophobicContact CE1-CG 3.99Å; F110-Q115 HydrophobicContact CZ-CB 4.47Å; F110-Q115 HydrophobicContact CZ-CG 4.27Å; F110-I133 CarbonylContact O-C 3.58Å; F110-Q134 HydrophobicContact CB-CB 4.19Å; F110-Q134 PolarHBondContact N-O 3.14Å; F110-Q134 PolarHBondContact O-N 3.03Å; F110-L136 HydrophobicContact CD2-CB 4.4Å; F110-L136 HydrophobicContact CE2-CB 3.86Å; F110-L136 HydrophobicContact CE2-CD2 4.09Å
111	Y	83	Confident	80	Confident	11 Å²	11	62.6 Å²	62.6	4%	0.043	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.2	172.9	179.9	-109.5	0	0	0	109.1	G113 K114 Y125 V127 D131 I133	Y111-G113 PolarHBondContact O-N 3.19Å; Y111-K114 PolarHBondContact N-O 2.79Å; Y111-K114 WeakPolarHBondContact O-CB 3.43Å; Y111-K114 PolarHBondContact O-N 3.23Å; Y111-Y125 WeakPolarHBondContact CD1-O 3.43Å; Y111-Y125 WeakPolarHBondContact CE1-O 3.37Å; Y111-V127 HydrophobicContact CD1-CG2 3.68Å; Y111-V127 HydrophobicContact CD2-CG2 4.32Å; Y111-V127 HydrophobicContact CE1-CB 4.45Å; Y111-V127 HydrophobicContact CE1-CG2 3.86Å; Y111-V127 HydrophobicContact CE2-CG2 4.49Å; Y111-V127 HydrophobicContact CG-CG2 3.92Å; Y111-D131 HydrophobicContact CE2-CB 3.72Å; Y111-D131 VanDerWaalsContact OH-CG 3.32Å; Y111-D131 PolarHBondContact OH-OD2 2.81Å; Y111-I133 HydrophobicContact CD2-CG1 4.08Å
112	R	77.1	Confident	80	Confident	148 Å²	148	54.7 Å²	54.7	56%	0.558	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	40.2	-173.8	-60.3	-176.5	179.9	169.6	7.7	113.8	K114	R112-K114 PolarHBondContact O-N 3.08Å
113	G	64.6	Low	79.8	Confident	65 Å²	65	58.3 Å²	58.3	67%	0.67	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-3.6	-179.3	0	0	0	0	0	115.3	Y111	Y111-G113 PolarHBondContact O-N 3.19Å
114	K	71.4	Confident	79.4	Confident	135 Å²	135	56.9 Å²	56.9	59%	0.587	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.2	173.3	-63.1	-173.4	177.5	-174.5	0	110.4	F110 Y111 R112	F110-K114 CarbonylContact C-O 3.46Å; F110-K114 WeakPolarHBondContact CA-O 3.37Å; Y111-K114 PolarHBondContact N-O 2.79Å; Y111-K114 WeakPolarHBondContact O-CB 3.43Å; Y111-K114 PolarHBondContact O-N 3.23Å; R112-K114 PolarHBondContact O-N 3.08Å
115	Q	83.8	Confident	78.9	Confident	68 Å²	68	56.2 Å²	56.2	32%	0.318	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.2	170.9	-168.8	178.7	-61.1	0	0	109.1	L109 F110	L109-Q115 CarbonylContact O-C 3.49Å; L109-Q115 WeakPolarHBondContact O-CA 3.42Å; F110-Q115 HydrophobicContact CD1-CB 3.96Å; F110-Q115 HydrophobicContact CD1-CG 4.42Å; F110-Q115 HydrophobicContact CE1-CB 3.71Å; F110-Q115 HydrophobicContact CE1-CG 3.99Å; F110-Q115 HydrophobicContact CZ-CB 4.47Å; F110-Q115 HydrophobicContact CZ-CG 4.27Å
116	M	84.5	Confident	79	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.2	177.9	-56	174.9	69.5	0	0	110	V89 L92 R93 L109 L122 Y125 V127 I133	V89-M116 HydrophobicContact CG1-CB 3.87Å; V89-M116 HydrophobicContact CG2-CB 4.12Å; V89-M116 HydrophobicContact CG2-CE 3.92Å; L92-M116 HydrophobicContact CD2-CE 4.36Å; R93-M116 PolarHBondContact NH2-O 3.12Å; L109-M116 HydrophobicContact CB-CB 4.07Å; L109-M116 HydrophobicContact CB-CG 4.39Å; L109-M116 HydrophobicContact CB-SD 4.15Å; L109-M116 PolarHBondContact O-N 2.87Å; M116-L122 HydrophobicContact CE-CD2 3.67Å; M116-Y125 HydrophobicContact CB-CE1 4.4Å; M116-Y125 HydrophobicContact CB-CE2 4.26Å; M116-Y125 HydrophobicContact CE-CD2 3.95Å; M116-Y125 HydrophobicContact CE-CE2 4.49Å; M116-Y125 HydrophobicContact CE-CG 4.25Å; M116-Y125 HydrophobicContact CG-CD1 4.18Å; M116-Y125 HydrophobicContact CG-CD2 4.42Å; M116-Y125 HydrophobicContact CG-CE1 4.21Å; M116-Y125 HydrophobicContact CG-CE2 4.45Å; M116-Y125 HydrophobicContact CG-CG 4.3Å; M116-V127 HydrophobicContact CE-CG2 4.28Å; M116-I133 HydrophobicContact CE-CD1 3.91Å; M116-I133 HydrophobicContact SD-CD1 3.7Å; M116-I133 HydrophobicContact SD-CG1 4.19Å; M116-I133 HydrophobicContact SD-CG2 3.84Å
117	E	81.6	Confident	78.9	Confident	91 Å²	91	55.8 Å²	55.8	43%	0.425	28%	0.283	S	S	.	.			trans	-108.6	151.3	-176	-59.9	-168.5	167.8	0	0	112.2	V89 Y125	V89-E117 VanDerWaalsContact CB-O 3.25Å; V89-E117 WeakPolarHBondContact CB-O 3.18Å; V89-E117 WeakPolarHBondContact CG2-O 3.47Å; E117-Y125 PolarHBondContact N-OH 3.49Å
118	D	79.3	Confident	78.6	Confident	87 Å²	87	62.2 Å²	62.2	47%	0.465	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	152.9	178.9	-63.1	-18.8	0	0	0	110.5	E90 R93 H120	E90-D118 HydrophobicContact CB-CB 4.31Å; R93-D118 WeakPolarHBondContact CD-OD1 3.43Å; R93-D118 IonicContact CZ-OD1 2.81Å; R93-D118 IonicContact NE-OD1 3.87Å; R93-D118 PolarHBondContact NE-OD1 2.81Å; R93-D118 IonicContact NE-OD2 3.53Å; D118-H120 VanDerWaalsContact C-N 3.29Å; D118-H120 PolarHBondContact O-N 3.2Å
119	G	70.5	Confident	78.3	Confident	49 Å²	49	63 Å²	63	51%	0.505	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-20	-172.7	0	0	0	0	0	115.3
120	H	76.4	Confident	77.9	Confident	60 Å²	60	66.6 Å²	66.6	28%	0.278	34%	0.336	S	S	.	.			trans	-93.9	160.3	174.9	-67.2	-73.2	0	0	0	112.7	K88 V89 D118 Y125	K88-H120 CarbonylContact C-O 3.51Å; K88-H120 VanDerWaalsContact CA-O 3.27Å; K88-H120 WeakPolarHBondContact CA-O 3.5Å; V89-H120 HydrophobicContact CG2-CB 4.5Å; V89-H120 WeakPolarHBondContact CG2-O 3.43Å; V89-H120 PolarHBondContact N-O 2.95Å; D118-H120 VanDerWaalsContact C-N 3.29Å; D118-H120 PolarHBondContact O-N 3.2Å; H120-Y125 HydrophobicContact CB-CD2 4.46Å; H120-Y125 HydrophobicContact CB-CE2 3.51Å
121	T	85.9	Confident	77.9	Confident	22 Å²	22	66 Å²	66	14%	0.135	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-104.3	160.8	179.7	67.9	0	0	0	0	112.7	L86 T87 K88 F123 D124 Y125	L86-T121 WeakPolarHBondContact O-CG2 3.41Å; T87-T121 CarbonylContact O-C 3.5Å; T87-T121 VanDerWaalsContact O-CA 3.28Å; T87-T121 WeakPolarHBondContact O-CA 3.37Å; K88-T121 HydrophobicContact CG-CG2 4.19Å; T121-F123 PolarHBondContact O-N 3.03Å; T121-D124 PolarHBondContact N-OD2 3.39Å; T121-D124 WeakPolarHBondContact O-CB 3.06Å; T121-D124 PolarHBondContact O-N 2.7Å; T121-D124 PolarHBondContact OG1-N 2.67Å; T121-D124 PolarHBondContact OG1-OD1 3.46Å; T121-D124 PolarHBondContact OG1-OD2 3.41Å; T121-Y125 WeakPolarHBondContact O-CD2 3.46Å
122	L	80.6	Confident	78.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.7	173.1	-63.5	-176	0	0	0	112.7	L83 T87 L92 M116 E126 V127 I133	L83-L122 HydrophobicContact CB-CD1 4.29Å; L83-L122 HydrophobicContact CD1-CD1 4.14Å; T87-L122 PolarHBondContact O-N 3.05Å; L92-L122 HydrophobicContact CD2-CD2 3.79Å; M116-L122 HydrophobicContact CE-CD2 3.67Å; L122-E126 PolarHBondContact O-N 3.41Å; L122-V127 HydrophobicContact CB-CB 4.23Å; L122-V127 HydrophobicContact CD2-CG2 4.3Å; L122-V127 PolarHBondContact O-N 3.09Å; L122-I133 HydrophobicContact CD2-CD1 4.47Å
123	F	77.7	Confident	78.7	Confident	92 Å²	92	61.3 Å²	61.3	40%	0.404	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-39.8	173.8	-178.8	-94.9	0	0	0	112.5	R85 T121 Y125 E126	R85-F123 HydrophobicContact CB-CB 4.32Å; R85-F123 HydrophobicContact CB-CD2 4.46Å; R85-F123 WeakPolarHBondContact O-CB 3.44Å; R85-F123 PolarHBondContact O-N 3.41Å; T121-F123 PolarHBondContact O-N 3.03Å; F123-Y125 PolarHBondContact O-N 2.92Å; F123-E126 WeakPolarHBondContact O-CA 3.46Å; F123-E126 PolarHBondContact O-N 3.05Å
124	D	71.9	Confident	79.7	Confident	82 Å²	82	62.3 Å²	62.3	44%	0.439	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.2	-178.7	-57.1	-39.1	0	0	0	112	T121	T121-D124 PolarHBondContact N-OD2 3.39Å; T121-D124 WeakPolarHBondContact O-CB 3.06Å; T121-D124 PolarHBondContact O-N 2.7Å; T121-D124 PolarHBondContact OG1-N 2.67Å; T121-D124 PolarHBondContact OG1-OD1 3.46Å; T121-D124 PolarHBondContact OG1-OD2 3.41Å
125	Y	71.5	Confident	80.5	Confident	25 Å²	25	55.9 Å²	55.9	10%	0.098	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	3.7	173.1	-64.7	-82	0	0	0	113.5	V89 Y111 M116 E117 H120 T121 F123 V127	V89-Y125 HydrophobicContact CG2-CD2 4.23Å; V89-Y125 HydrophobicContact CG2-CE2 3.76Å; Y111-Y125 WeakPolarHBondContact CD1-O 3.43Å; Y111-Y125 WeakPolarHBondContact CE1-O 3.37Å; M116-Y125 HydrophobicContact CB-CE1 4.4Å; M116-Y125 HydrophobicContact CB-CE2 4.26Å; M116-Y125 HydrophobicContact CE-CD2 3.95Å; M116-Y125 HydrophobicContact CE-CE2 4.49Å; M116-Y125 HydrophobicContact CE-CG 4.25Å; M116-Y125 HydrophobicContact CG-CD1 4.18Å; M116-Y125 HydrophobicContact CG-CD2 4.42Å; M116-Y125 HydrophobicContact CG-CE1 4.21Å; M116-Y125 HydrophobicContact CG-CE2 4.45Å; M116-Y125 HydrophobicContact CG-CG 4.3Å; E117-Y125 PolarHBondContact N-OH 3.49Å; H120-Y125 HydrophobicContact CB-CD2 4.46Å; H120-Y125 HydrophobicContact CB-CE2 3.51Å; T121-Y125 WeakPolarHBondContact O-CD2 3.46Å; F123-Y125 PolarHBondContact O-N 2.92Å; Y125-V127 PolarHBondContact O-N 3.36Å
126	E	79.6	Confident	80.6	Confident	118 Å²	118	55.6 Å²	55.6	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	31.8	-176.5	-55.8	-178.1	172.8	0	0	114.2	L122 F123 R128	L122-E126 PolarHBondContact O-N 3.41Å; F123-E126 WeakPolarHBondContact O-CA 3.46Å; F123-E126 PolarHBondContact O-N 3.05Å; E126-R128 PolarHBondContact O-N 3.27Å
127	V	77.8	Confident	80.6	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.			trans	-66.9	127.6	178	-174.3	0	0	0	0	108.8	M65 I67 Y111 M116 L122 Y125 D131 I133	M65-V127 HydrophobicContact CE-CB 4.36Å; M65-V127 HydrophobicContact CE-CG1 3.86Å; M65-V127 WeakPolarHBondContact CE-O 3.31Å; I67-V127 HydrophobicContact CG2-CG1 3.9Å; Y111-V127 HydrophobicContact CD1-CG2 3.68Å; Y111-V127 HydrophobicContact CD2-CG2 4.32Å; Y111-V127 HydrophobicContact CE1-CB 4.45Å; Y111-V127 HydrophobicContact CE1-CG2 3.86Å; Y111-V127 HydrophobicContact CE2-CG2 4.49Å; Y111-V127 HydrophobicContact CG-CG2 3.92Å; M116-V127 HydrophobicContact CE-CG2 4.28Å; L122-V127 HydrophobicContact CB-CB 4.23Å; L122-V127 HydrophobicContact CD2-CG2 4.3Å; L122-V127 PolarHBondContact O-N 3.09Å; Y125-V127 PolarHBondContact O-N 3.36Å; V127-D131 HydrophobicContact CG1-CB 4.12Å; V127-I133 HydrophobicContact CG1-CD1 4.43Å
128	R	78.4	Confident	80.3	Confident	137 Å²	137	60.6 Å²	60.6	52%	0.517	31%	0.306	S	S	.	.			trans	-106.3	167.4	178.8	-56.6	-177.6	-65.2	-179.4	1.8	111.1	M65 E126 N130 D131	M65-R128 VanDerWaalsContact CE-O 3.29Å; M65-R128 WeakPolarHBondContact CE-O 3.15Å; E126-R128 PolarHBondContact O-N 3.27Å; R128-N130 PolarHBondContact O-N 3.37Å; R128-D131 WeakPolarHBondContact CA-OD2 3.33Å; R128-D131 WeakPolarHBondContact CB-OD2 3.43Å; R128-D131 PolarHBondContact N-OD2 2.85Å; R128-D131 IonicContact NE-OD2 3.96Å; R128-D131 VanDerWaalsContact O-CB 3.28Å; R128-D131 WeakPolarHBondContact O-CB 3.34Å; R128-D131 PolarHBondContact O-N 3.38Å; R128-D131 VanDerWaalsContact O-N 3.14Å
129	L	78.7	Confident	79.1	Confident	94 Å²	94	64.8 Å²	64.8	49%	0.492	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	134.9	175.9	-172.6	140	0	0	0	110.3	M65 W66 D131	M65-L129 HydrophobicContact CB-CD1 4.48Å; M65-L129 HydrophobicContact CG-CB 4.2Å; M65-L129 HydrophobicContact CG-CD1 4.46Å; W66-L129 HydrophobicContact CZ2-CD2 4.36Å; L129-D131 PolarHBondContact O-N 3.06Å
130	N	78.1	Confident	77.7	Confident	74 Å²	74	66.6 Å²	66.6	40%	0.396	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	12.9	-176.5	-170.2	37.5	0	0	0	115.6	W66 R128	W66-N130 HydrophobicContact CE3-CB 4.4Å; W66-N130 HydrophobicContact CH2-CB 3.57Å; W66-N130 WeakPolarHBondContact CH2-OD1 3.29Å; W66-N130 HydrophobicContact CZ2-CB 3.87Å; W66-N130 HydrophobicContact CZ3-CB 3.84Å; W66-N130 WeakPolarHBondContact CZ3-OD1 3.35Å; W66-N130 PolarHBondContact O-N 3.47Å; R128-N130 PolarHBondContact O-N 3.37Å
131	D	84.6	Confident	75.9	Confident	29 Å²	29	71.7 Å²	71.7	16%	0.155	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-73.7	151.5	172	-81.2	-17.1	0	0	0	111.9	Q68 Y111 V127 R128 L129	Q68-D131 PolarHBondContact N-O 3.29Å; Y111-D131 HydrophobicContact CE2-CB 3.72Å; Y111-D131 VanDerWaalsContact OH-CG 3.32Å; Y111-D131 PolarHBondContact OH-OD2 2.81Å; V127-D131 HydrophobicContact CG1-CB 4.12Å; R128-D131 WeakPolarHBondContact CA-OD2 3.33Å; R128-D131 WeakPolarHBondContact CB-OD2 3.43Å; R128-D131 PolarHBondContact N-OD2 2.85Å; R128-D131 IonicContact NE-OD2 3.96Å; R128-D131 VanDerWaalsContact O-CB 3.28Å; R128-D131 WeakPolarHBondContact O-CB 3.34Å; R128-D131 PolarHBondContact O-N 3.38Å; R128-D131 VanDerWaalsContact O-N 3.14Å; L129-D131 PolarHBondContact O-N 3.06Å
132	T	86	Confident	73.7	Confident	60 Å²	60	76 Å²	76	37%	0.368	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.6	179.6	-49.1	0	0	0	0	112	Q68 R70	Q68-T132 HydrophobicContact CB-CG2 4.32Å; Q68-T132 CarbonylContact O-C 3.55Å; Q68-T132 VanDerWaalsContact O-CA 3.24Å; Q68-T132 WeakPolarHBondContact O-CA 3.3Å; R70-T132 HydrophobicContact CB-CG2 3.72Å
133	I	89.3	Confident	71.5	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.8	169.9	-61.7	-179.8	0	0	0	108.7	I67 Q68 V69 R70 L92 L109 F110 Y111 M116 L122 V127	I67-I133 HydrophobicContact CD1-CD1 3.47Å; I67-I133 VanDerWaalsContact CD1-CD1 3.47Å; I67-I133 HydrophobicContact CD1-CG1 4.29Å; Q68-I133 PolarHBondContact O-N 2.81Å; V69-I133 CarbonylContact C-O 3.55Å; V69-I133 VanDerWaalsContact CA-O 3.29Å; V69-I133 WeakPolarHBondContact CA-O 3.36Å; V69-I133 HydrophobicContact CG2-CB 4.4Å; R70-I133 PolarHBondContact N-O 2.99Å; L92-I133 HydrophobicContact CD2-CD1 3.54Å; L109-I133 HydrophobicContact CB-CG2 3.97Å; L109-I133 HydrophobicContact CD2-CG2 4.28Å; F110-I133 CarbonylContact O-C 3.58Å; Y111-I133 HydrophobicContact CD2-CG1 4.08Å; M116-I133 HydrophobicContact CE-CD1 3.91Å; M116-I133 HydrophobicContact SD-CD1 3.7Å; M116-I133 HydrophobicContact SD-CG1 4.19Å; M116-I133 HydrophobicContact SD-CG2 3.84Å; L122-I133 HydrophobicContact CD2-CD1 4.47Å; V127-I133 HydrophobicContact CG1-CD1 4.43Å
134	Q	86.6	Confident	69.4	Low	85 Å²	85	84.9 Å²	84.9	40%	0.397	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.5	177.9	-67.4	173.9	-18.5	0	0	111	R70 M72 L109 F110	R70-Q134 CarbonylContact O-C 3.58Å; R70-Q134 WeakPolarHBondContact O-CA 3.44Å; M72-Q134 HydrophobicContact CG-CB 4.41Å; M72-Q134 HydrophobicContact SD-CB 3.62Å; M72-Q134 HydrophobicContact SD-CG 4.12Å; M72-Q134 PolarHBondContact SD-OE1 3.29Å; M72-Q134 VanDerWaalsContact SD-OE1 3.37Å; L109-Q134 CarbonylContact C-O 3.55Å; L109-Q134 WeakPolarHBondContact CA-O 3.42Å; F110-Q134 HydrophobicContact CB-CB 4.19Å; F110-Q134 PolarHBondContact N-O 3.14Å; F110-Q134 PolarHBondContact O-N 3.03Å
135	L	88.3	Confident	67.3	Low	1 Å²	1	89.6 Å²	89.6	1%	0.005	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	116.4	177.2	172.5	64.5	0	0	0	109.9	V69 R70 T71 M72 I96 F100 Q107 L109 V137	V69-L135 HydrophobicContact CG1-CB 3.84Å; V69-L135 HydrophobicContact CG1-CD2 4.45Å; R70-L135 PolarHBondContact O-N 3.03Å; T71-L135 CarbonylContact C-O 3.59Å; T71-L135 WeakPolarHBondContact CA-O 3.15Å; T71-L135 HydrophobicContact CG2-CD2 4.44Å; M72-L135 PolarHBondContact N-O 3.28Å; I96-L135 HydrophobicContact CG2-CD1 4.27Å; I96-L135 HydrophobicContact CG2-CD2 3.76Å; F100-L135 HydrophobicContact CB-CD2 4.03Å; F100-L135 HydrophobicContact CD1-CD2 3.89Å; F100-L135 HydrophobicContact CD2-CD2 4.24Å; F100-L135 HydrophobicContact CE1-CD2 4.39Å; F100-L135 HydrophobicContact CG-CD2 3.79Å; Q107-L135 HydrophobicContact CB-CD1 3.71Å; Q107-L135 HydrophobicContact CG-CD1 3.88Å; L109-L135 HydrophobicContact CD2-CB 4.25Å; L109-L135 HydrophobicContact CD2-CD1 3.64Å; L135-V137 HydrophobicContact CD2-CG2 4.33Å; L135-V137 HydrophobicContact CG-CG2 4.18Å
136	L	85	Confident	65.2	Low	61 Å²	61	92.9 Å²	92.9	32%	0.319	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.1	166.6	-178.2	72.3	0	0	0	109	M72 R108 F110	M72-L136 HydrophobicContact CB-CD1 4.03Å; M72-L136 HydrophobicContact CG-CB 3.76Å; M72-L136 HydrophobicContact CG-CD1 3.98Å; M72-L136 HydrophobicContact CG-CG 4.49Å; R108-L136 HydrophobicContact CB-CB 4.01Å; R108-L136 HydrophobicContact CB-CD2 4.38Å; R108-L136 PolarHBondContact N-O 3.22Å; R108-L136 PolarHBondContact O-N 3.28Å; F110-L136 HydrophobicContact CD2-CB 4.4Å; F110-L136 HydrophobicContact CE2-CB 3.86Å; F110-L136 HydrophobicContact CE2-CD2 4.09Å
137	V	84.9	Confident	62.7	Low	71 Å²	71	94.1 Å²	94.1	43%	0.43	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.1	176.2	-176.3	0	0	0	0	108.9	V102 L135	V102-V137 HydrophobicContact CG1-CB 4.46Å; V102-V137 HydrophobicContact CG1-CG1 3.74Å; V102-V137 HydrophobicContact CG1-CG2 4.13Å; V102-V137 HydrophobicContact CG2-CG1 4.14Å; V102-V137 HydrophobicContact CG2-CG2 3.74Å; L135-V137 HydrophobicContact CD2-CG2 4.33Å; L135-V137 HydrophobicContact CG-CG2 4.18Å
138	R	75.1	Confident	60.5	Low	125 Å²	125	103.6 Å²	103.6	47%	0.472	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-79.4	132.8	173.2	-60.5	-176.8	93.8	174.8	1.5	109.4	L106 R108 S140	L106-R138 HydrophobicContact CD2-CB 4.38Å; L106-R138 PolarHBondContact O-N 3.22Å; R108-R138 VanDerWaalsContact CZ-CZ 3.46Å; R108-R138 VanDerWaalsContact NH2-NH1 3.15Å; R138-S140 PolarHBondContact O-N 2.95Å
139	Q	54.9	Low	58.2	Low	176 Å²	176	106.6 Å²	106.6	82%	0.822	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-71.3	126.8	168.5	-70.1	178.7	-5.8	0	0	108.8	L141	Q139-L141 PolarHBondContact O-N 2.95Å
140	S	41.5	Very low	55.8	Low	87 Å²	87	112.6 Å²	112.6	61%	0.608	58%	0.579	S	S	*	*			trans	-72.2	108.5	170.2	-173.1	0	0	0	0	108.2	R138 V142	R138-S140 PolarHBondContact O-N 2.95Å; S140-V142 PolarHBondContact O-N 2.96Å
141	L	38.6	Very low	53.4	Low	167 Å²	167	115 Å²	115	87%	0.874	59%	0.592	S	S	*	*			trans	-79.7	109.9	168.7	-73.8	169.9	0	0	0	107.8	Q139	Q139-L141 PolarHBondContact O-N 2.95Å
142	V	39.2	Very low	50.8	Low	111 Å²	111	118.8 Å²	118.8	67%	0.673	62%	0.62	S	S	*	*			trans	-109.9	134.3	165.9	-173.6	0	0	0	0	108	S140	S140-V142 PolarHBondContact O-N 2.96Å
143	L	33.4	Very low	48.2	Very low	156 Å²	156	124.1 Å²	124.1	82%	0.817	64%	0.641	S	S	*	*			trans	113	145.7	160	-59.7	176.9	0	0	0	116.7
144	P	33.5	Very low	45.6	Very low	124 Å²	124	131.1 Å²	131.1	81%	0.805	68%	0.678	S	S	*	*			cis	-127	158.6	15.1	35.9	-17.9	0	0	0	117
145	H	28.8	Very low	42.9	Very low	180 Å²	180	131.7 Å²	131.7	83%	0.833	69%	0.691	S	S	*	*			trans	-76.9	124.7	166.8	-115.7	-46.3	0	0	0	110.9
146	S	26.9	Very low	40.1	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	73%	0.727	S	S	*	*			trans	10	119.2	148.6	58.2	0	0	0	0	119.7
147	T	27.2	Very low	37.5	Very low	144 Å²	144	142.2 Å²	142.2	88%	0.883	75%	0.753	S	S	*	*			trans	-108.3	121.1	140.6	41	0	0	0	0	108.9
148	K	32.3	Very low	34.7	Very low	198 Å²	198	145.1 Å²	145.1	86%	0.861	77%	0.766	S	S	*	*			trans	-58.8	137.8	171.4	-66.6	171.6	173.6	177.4	0	110
149	E	28.5	Very low	32.7	Very low	200 Å²	200	144.2 Å²	144.2	94%	0.935	78%	0.779	S	S	*	*			trans	-151.2	165.3	136.1	-78.1	-150.1	148.2	0	0	109.7
150	R	29.8	Very low	31.3	Very low	220 Å²	220	139.2 Å²	139.2	83%	0.83	77%	0.774	S	S	*	*			trans	-102.2	162.3	-139.9	-105.8	179	-179.9	-171.9	-0.8	114.2
151	D	27.2	Very low	30.7	Very low	126 Å²	126	140.6 Å²	140.6	67%	0.674	78%	0.783	S	S	*	*			trans	64.9	115.8	144.8	-55.7	-17	0	0	0	119.9
152	S	29.8	Very low	30	Very low	108 Å²	108	138.2 Å²	138.2	76%	0.755	78%	0.779	S	S	*	*				156.4	102.3	102.5	-64.1	0	0	0	0	112
153	E	31.6	Very low	29.4	Very low	171 Å²	171	141.3 Å²	141.3	80%	0.799	79%	0.791	S	S	*	*				59	123.6	124.1	-80.2	-165.9	155.6	0	0	124
154	L	33.8	Very low	29	Very low	148 Å²	148	137.1 Å²	137.1	78%	0.775	79%	0.785	S	S	*	*			trans	78.2	140.3	139.3	-56.5	167.6	0	0	0	117.8
155	S	30.3	Very low	28.7	Very low	97 Å²	97	140.1 Å²	140.1	68%	0.678	79%	0.788	S	S	*	*			cis	-171	145.4	-0.9	47.6	0	0	0	0	109.4
156	D	30.2	Very low	28.7	Very low	143 Å²	143	136 Å²	136	77%	0.765	78%	0.78	S	S	*	*			trans	21.4	153.7	144.1	-63.7	-32.8	0	0	0	125.8
157	T	30.8	Very low	28.7	Very low	139 Å²	139	141.1 Å²	141.1	85%	0.853	79%	0.793	S	S	*	*			trans	78	153.8	153.8	67	0	0	0	0	117.2
158	D	25.5	Very low	28.9	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	78%	0.784	S	S	*	*			cis	176.5	146.1	-21	174.2	27.1	0	0	0	102.3
159	S	32.2	Very low	28.7	Very low	105 Å²	105	135.4 Å²	135.4	73%	0.734	77%	0.774	S	S	*	*			trans	51.7	143.8	152.5	-69.6	0	0	0	0	122.5
160	G	25.3	Very low	29	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	76%	0.764	S	S	*	*			trans	129.9	106.8	136.4	0	0	0	0	0	116.7
161	C	29.4	Very low	28.9	Very low	116 Å²	116	128.6 Å²	128.6	78%	0.784	76%	0.762	S	S	*	*			trans	-38	148.6	153.5	53.8	0	0	0	0	115
162	C	23.5	Very low	29.1	Very low	117 Å²	117	127.2 Å²	127.2	79%	0.791	76%	0.762	S	S	*	*				173	135.5	116.9	-81.5	0	0	0	0	112.4
163	L	28.6	Very low	29.1	Very low	177 Å²	177	128 Å²	128	93%	0.927	76%	0.763	S	S	*	*			trans	-14.7	148.8	154	-60.4	159.3	0	0	0	119.2
164	G	24.1	Very low	28.8	Very low	68 Å²	68	128.3 Å²	128.3	70%	0.701	76%	0.764	S	S	*	*			trans	150.9	108.6	136.7	0	0	0	0	0	118.3
165	Q	26.1	Very low	28.4	Very low	186 Å²	186	124 Å²	124	87%	0.869	76%	0.755	S	S	*	*			trans	75.5	109.1	136	-64.6	177.4	-6.6	0	0	118
166	S	30.3	Very low	28.3	Very low	94 Å²	94	128.4 Å²	128.4	66%	0.657	77%	0.765	S	S	*	*				72.9	120.6	67.7	75.3	0	0	0	0	113.7
167	E	25.4	Very low	28	Very low	203 Å²	203	126.5 Å²	126.5	95%	0.949	77%	0.769	S	S	*	*			trans	-136	133.3	141.7	-68.5	-154.5	142.7	0	0	109.1
168	S	32.6	Very low	27.9	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	77%	0.77	S	S	*	*			trans	-122.1	156.6	179.9	-30.7	0	0	0	0	106.8
169	D	28.6	Very low	27.9	Very low	124 Å²	124	122.8 Å²	122.8	66%	0.663	77%	0.771	S	S	*	*			trans	156	149.6	136.8	-84.7	-12.3	0	0	0	109.2
170	K	34.1	Very low	28.1	Very low	164 Å²	164	127.2 Å²	127.2	71%	0.713	78%	0.78	S	S	*	*			cis	-174.7	144.3	-12.1	-107	167.2	-172	132.4	0	103.2
171	S	27.8	Very low	28	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	78%	0.781	S	S	*	*				150.8	145.4	102	52.5	0	0	0	0	106.3
172	S	32.2	Very low	28	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	78%	0.778	S	S	*	*			cis	-173.3	137.6	5.1	42.2	0	0	0	0	110.9
173	T	29.2	Very low	28.3	Very low	125 Å²	125	130.5 Å²	130.5	77%	0.767	78%	0.779	S	S	*	*			trans	54.9	138.7	136.1	52.7	0	0	0	0	121
174	H	26	Very low	28.3	Very low	177 Å²	177	130.5 Å²	130.5	82%	0.819	77%	0.766	S	S	*	*			cis	-162.9	147.4	40.4	-149.1	-79.5	0	0	0	112
175	G	24.9	Very low	28.6	Very low	57 Å²	57	132.8 Å²	132.8	59%	0.588	77%	0.769	S	S	*	*			trans	-78.3	179.7	167.2	0	0	0	0	0	112.6
176	E	27	Very low	29	Very low	191 Å²	191	128.8 Å²	128.8	89%	0.893	77%	0.767	S	S	*	*			cis	-163.3	170.1	32.6	-79.2	-178.9	120	0	0	111.2
177	A	24.4	Very low	29.2	Very low	103 Å²	103	131.6 Å²	131.6	85%	0.851	78%	0.775	S	S	*	*			trans	86.8	132.4	142.8	0	0	0	0	0	121.9
178	A	29.2	Very low	29.7	Very low	105 Å²	105	127.6 Å²	127.6	87%	0.868	76%	0.757	S	S	*	*			trans	-54.5	143.3	-179.3	0	0	0	0	0	116.8
179	A	25.6	Very low	30	Very low	89 Å²	89	130.9 Å²	130.9	74%	0.736	77%	0.766	S	S	*	*			trans	-152.3	129.3	142	0	0	0	0	0	108.5	T181	A179-T181 PolarHBondContact O-N 2.79Å
180	E	35.2	Very low	30.8	Very low	197 Å²	197	131.4 Å²	131.4	92%	0.921	77%	0.767	S	S	*	*			trans	-51.1	134.3	164.3	-69.1	-176.9	137.7	0	0	109.8
181	T	24.8	Very low	31.4	Very low	125 Å²	125	128.5 Å²	128.5	77%	0.767	75%	0.751	S	S	*	*			trans	-151.9	100.9	158.4	-3.8	0	0	0	0	109.6	A179 S183	A179-T181 PolarHBondContact O-N 2.79Å; T181-S183 PolarHBondContact O-N 3.47Å; T181-S183 PolarHBondContact O-OG 3.2Å
182	D	29.1	Very low	32.5	Very low	135 Å²	135	129.3 Å²	129.3	72%	0.722	75%	0.746	S	S	*	*			trans	-45.6	114.6	162.7	-162.6	15	0	0	0	109.9	R184	D182-R184 IonicContact OD2-NE 3.94Å
183	S	28.3	Very low	33.7	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	75%	0.747	S	S	*	*			trans	-117.7	89.3	172.3	12.2	0	0	0	0	108.7	T181	T181-S183 PolarHBondContact O-N 3.47Å; T181-S183 PolarHBondContact O-OG 3.2Å
184	R	29.5	Very low	35.2	Very low	176 Å²	176	127 Å²	127	66%	0.664	72%	0.718	S	S	*	*			trans	-60.8	146.2	167.4	-65.1	-177.1	-177	-173.6	-1.1	110.4	D182 E188	D182-R184 IonicContact OD2-NE 3.94Å; R184-E188 IonicContact NH1-OE2 3.35Å
185	P	31.1	Very low	36.8	Very low	117 Å²	117	127.1 Å²	127.1	76%	0.76	72%	0.719	S	S	*	*			trans	-66.1	133.6	167.3	-9.3	24.7	0	0	0	109.7	D187	P185-D187 PolarHBondContact O-N 3.18Å
186	A	33	Very low	38.6	Very low	101 Å²	101	130.8 Å²	130.8	84%	0.835	72%	0.724	S	S	*	*	S	Bend	trans	-69	93	173.5	0	0	0	0	0	110.2
187	D	34.7	Very low	40.4	Very low	154 Å²	154	121.9 Å²	121.9	82%	0.824	68%	0.684	S	S	*	*			trans	-171.4	29.3	153.5	-102	-16.1	0	0	0	112.7	P185	P185-D187 PolarHBondContact O-N 3.18Å
188	E	36.1	Very low	43	Very low	119 Å²	119	121 Å²	121	56%	0.556	66%	0.664	S	S	*	*			trans	-96.4	2.3	180	-81.4	-151.9	136.8	0	0	115.9	R184	R184-E188 IonicContact NH1-OE2 3.35Å
189	D	39.2	Very low	45.7	Very low	165 Å²	165	116.6 Å²	116.6	88%	0.882	63%	0.625	S	S	*	*	S	Bend	trans	-109.9	65.7	-175.4	-71.9	-32.8	0	0	0	113.3
190	M	45.6	Very low	48.7	Very low	136 Å²	136	117.4 Å²	117.4	67%	0.67	61%	0.612	S	S	*	*	S	Bend	trans	-165	36.6	158.7	-136.3	172.3	61.3	0	0	116.4
191	W	46.8	Very low	51.2	Low	103 Å²	103	111.6 Å²	111.6	39%	0.39	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.3	115.4	-179.1	-52.6	90.3	0	0	0	111.5	T224 K226 I247	W191-T224 HydrophobicContact CB-CG2 4.47Å; W191-K226 HydrophobicContact CE3-CB 4.34Å; W191-K226 HydrophobicContact CE3-CG 4.45Å; W191-K226 HydrophobicContact CH2-CB 4.23Å; W191-K226 HydrophobicContact CH2-CD 3.8Å; W191-K226 HydrophobicContact CH2-CG 3.58Å; W191-K226 HydrophobicContact CZ3-CB 3.53Å; W191-K226 HydrophobicContact CZ3-CD 3.93Å; W191-K226 HydrophobicContact CZ3-CG 3.4Å; W191-K226 VanDerWaalsContact CZ3-CG 3.4Å; W191-I247 HydrophobicContact CH2-CD1 4Å; W191-I247 HydrophobicContact CZ3-CD1 3.72Å
192	D	51.7	Low	54.1	Low	129 Å²	129	110.1 Å²	110.1	69%	0.69	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.4	128.8	175.5	-70.3	-38.1	0	0	0	110.5	T194 R225	D192-T194 PolarHBondContact O-N 3.2Å; D192-T194 PolarHBondContact O-OG1 2.72Å; D192-T194 VanDerWaalsContact O-OG1 3.09Å; D192-R225 PolarHBondContact O-N 3.13Å
193	E	56.1	Low	57	Low	149 Å²	149	104.1 Å²	104.1	70%	0.696	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	128.3	168.7	-69.6	-167.7	154.3	0	0	109.4	R222	E193-R222 WeakPolarHBondContact OE1-CD 3.47Å
194	T	61.1	Low	60	Low	24 Å²	24	100.2 Å²	100.2	15%	0.147	51%	0.513	C	S	.	.			trans	-133.2	126	-168.3	-66.7	0	0	0	0	110.5	D192 L196 V223 R225	D192-T194 PolarHBondContact O-N 3.2Å; D192-T194 PolarHBondContact O-OG1 2.72Å; D192-T194 VanDerWaalsContact O-OG1 3.09Å; T194-L196 HydrophobicContact CG2-CB 3.47Å; T194-L196 VanDerWaalsContact CG2-CB 3.47Å; T194-L196 HydrophobicContact CG2-CD1 3.74Å; T194-L196 HydrophobicContact CG2-CG 3.66Å; T194-L196 PolarHBondContact O-N 2.84Å; T194-V223 PolarHBondContact N-O 2.74Å; T194-R225 HydrophobicContact CG2-CB 4.4Å; T194-R225 WeakPolarHBondContact OG1-CB 3.41Å
195	E	58.6	Low	63	Low	180 Å²	180	91.8 Å²	91.8	84%	0.841	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-1.2	175.4	-64.4	-173.2	167.5	0	0	113.8	G197 K200	E195-G197 VanDerWaalsContact C-N 3.27Å; E195-G197 PolarHBondContact O-N 2.95Å; E195-K200 PolarHBondContact O-NZ 3.13Å
196	L	63.2	Low	66	Low	134 Å²	134	86.2 Å²	86.2	70%	0.702	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	0.8	-173.4	-59.6	166.8	0	0	0	114.6	T194	T194-L196 HydrophobicContact CG2-CB 3.47Å; T194-L196 VanDerWaalsContact CG2-CB 3.47Å; T194-L196 HydrophobicContact CG2-CD1 3.74Å; T194-L196 HydrophobicContact CG2-CG 3.66Å; T194-L196 PolarHBondContact O-N 2.84Å
197	G	65.1	Low	68.9	Low	4 Å²	4	81.4 Å²	81.4	4%	0.041	41%	0.406	C	S	.	.	S	Bend	trans	-66	146.4	173.6	0	0	0	0	0	112.9	E195 Y199 K200	E195-G197 VanDerWaalsContact C-N 3.27Å; E195-G197 PolarHBondContact O-N 2.95Å; G197-Y199 VanDerWaalsContact C-N 3.28Å; G197-K200 PolarHBondContact O-NZ 2.82Å
198	L	79.9	Confident	71.6	Confident	85 Å²	85	77.4 Å²	77.4	45%	0.445	38%	0.379	S	S	.	.	S	Bend	trans	-60.4	-38.8	172.1	-76.2	163.8	0	0	0	111.4	Y248 P347	L198-Y248 PolarHBondContact N-OH 3.24Å; L198-P347 HydrophobicContact CD1-CB 4.27Å
199	Y	86.1	Confident	74.2	Confident	12 Å²	12	74 Å²	74	5%	0.047	36%	0.364	C	S	.	.	S	Bend	trans	-102.5	133.3	177.6	-52.6	-64.1	0	0	0	110.3	G197 E203 V205 Y248 V268 R269 A270	G197-Y199 VanDerWaalsContact C-N 3.28Å; Y199-E203 VanDerWaalsContact CA-OE2 3.31Å; Y199-E203 WeakPolarHBondContact CA-OE2 3.26Å; Y199-V205 HydrophobicContact CD1-CG1 4.18Å; Y199-V205 HydrophobicContact CG-CG1 4.03Å; Y199-Y248 HydrophobicContact CD2-CE1 4.24Å; Y199-Y248 HydrophobicContact CD2-CE2 4.16Å; Y199-Y248 AromaticContact CD2-CZ 3.83Å; Y199-Y248 PolarHBondContact N-OH 2.9Å; Y199-Y248 WeakPolarHBondContact O-CE1 3.35Å; Y199-V268 HydrophobicContact CD2-CB 4.41Å; Y199-V268 HydrophobicContact CD2-CG1 3.75Å; Y199-V268 HydrophobicContact CE2-CB 4.5Å; Y199-V268 HydrophobicContact CE2-CG1 4.14Å; Y199-V268 VanDerWaalsContact CE2-O 3.3Å; Y199-V268 WeakPolarHBondContact CE2-O 3.31Å; Y199-V268 HydrophobicContact CG-CG1 4.43Å; Y199-R269 WeakPolarHBondContact OH-CA 3.37Å; Y199-A270 HydrophobicContact CE1-CB 3.99Å
200	K	86.8	Confident	76.3	Confident	107 Å²	107	70.4 Å²	70.4	47%	0.465	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-90.7	159	-175.8	-58.4	-52.1	-176.3	-162.4	0	111.7	E195 G197 N202 E203 V220	E195-K200 PolarHBondContact O-NZ 3.13Å; G197-K200 PolarHBondContact O-NZ 2.82Å; K200-N202 PolarHBondContact O-N 2.87Å; K200-E203 PolarHBondContact N-OE2 3.03Å; K200-E203 WeakPolarHBondContact O-CB 3.37Å; K200-E203 PolarHBondContact O-N 2.94Å; K200-V220 WeakPolarHBondContact O-CB 3.45Å
201	V	88	Confident	78.1	Confident	74 Å²	74	70.9 Å²	70.9	45%	0.448	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	139	172.4	177.7	0	0	0	0	109.5	E203 V221 V223	V201-E203 PolarHBondContact O-N 3.27Å; V201-V221 VanDerWaalsContact CG1-O 3.28Å; V201-V221 WeakPolarHBondContact CG1-O 3.39Å; V201-V223 HydrophobicContact CG2-CG2 4.22Å
202	N	86.9	Confident	79.8	Confident	95 Å²	95	68.6 Å²	68.6	51%	0.508	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	2.3	-172.3	-55.9	-48.2	0	0	0	116.4	K200 Q219 V220	K200-N202 PolarHBondContact O-N 2.87Å; N202-Q219 PolarHBondContact O-NE2 3.45Å; N202-V220 WeakPolarHBondContact CA-O 3.31Å; N202-V220 PolarHBondContact N-O 2.75Å
203	E	89.9	Confident	81.5	Confident	9 Å²	9	62.6 Å²	62.6	4%	0.042	32%	0.317	C	S	.	.			trans	-72.1	139	173.6	-168.9	172.2	175.4	0	0	111.5	Y199 K200 V201 V205 Q219 V220 P352	Y199-E203 VanDerWaalsContact CA-OE2 3.31Å; Y199-E203 WeakPolarHBondContact CA-OE2 3.26Å; K200-E203 PolarHBondContact N-OE2 3.03Å; K200-E203 WeakPolarHBondContact O-CB 3.37Å; K200-E203 PolarHBondContact O-N 2.94Å; V201-E203 PolarHBondContact O-N 3.27Å; E203-V205 HydrophobicContact CG-CG1 4.39Å; E203-Q219 WeakPolarHBondContact O-CA 3.36Å; E203-V220 PolarHBondContact O-N 2.98Å; E203-P352 HydrophobicContact CG-CB 4.32Å; E203-P352 WeakPolarHBondContact OE1-CA 3.28Å; E203-P352 WeakPolarHBondContact OE1-CB 3.4Å
204	Y	90.9	Very high	83.2	Confident	31 Å²	31	55.5 Å²	55.5	12%	0.122	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.5	173.8	-69.4	-85.6	0	0	0	110.6	Q219 R271 M353 N356 P357	Y204-Q219 HydrophobicContact CD1-CB 4.43Å; Y204-R271 VanDerWaalsContact O-CB 3.23Å; Y204-R271 WeakPolarHBondContact O-CB 3.36Å; Y204-R271 PolarHBondContact O-N 2.78Å; Y204-R271 VanDerWaalsContact O-N 3.14Å; Y204-M353 WeakPolarHBondContact CD2-O 3.27Å; Y204-M353 PolarHBondContact N-O 3.12Å; Y204-N356 HydrophobicContact CE2-CB 4.44Å; Y204-P357 HydrophobicContact CD1-CG 4.19Å; Y204-P357 HydrophobicContact CG-CG 4.08Å
205	V	92.6	Very high	84.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	142.9	-171.2	-66.5	0	0	0	0	111.4	Y199 E203 A218 V220 V250 V268 R269 R271	Y199-V205 HydrophobicContact CD1-CG1 4.18Å; Y199-V205 HydrophobicContact CG-CG1 4.03Å; E203-V205 HydrophobicContact CG-CG1 4.39Å; V205-A218 HydrophobicContact CG2-CB 4.37Å; V205-A218 PolarHBondContact N-O 2.93Å; V205-A218 CarbonylContact O-C 3.49Å; V205-A218 WeakPolarHBondContact O-CA 3.45Å; V205-A218 PolarHBondContact O-N 2.83Å; V205-V220 HydrophobicContact CB-CG2 4.32Å; V205-V220 HydrophobicContact CG1-CG2 3.69Å; V205-V220 HydrophobicContact CG2-CG2 3.64Å; V205-V250 HydrophobicContact CG2-CG1 4.19Å; V205-V268 HydrophobicContact CB-CG1 3.75Å; V205-V268 HydrophobicContact CG1-CG1 3.99Å; V205-V268 HydrophobicContact CG2-CG1 3.84Å; V205-R269 CarbonylContact C-O 3.42Å; V205-R269 WeakPolarHBondContact CA-O 3.37Å; V205-R269 VanDerWaalsContact CB-O 3.23Å; V205-R269 WeakPolarHBondContact CB-O 3.45Å; V205-R271 PolarHBondContact O-NH1 3.08Å
206	D	93.9	Very high	86.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.7	167	-71.7	-40.8	0	0	0	109	W215 F216 R269 R271 A272 R360	D206-W215 HydrophobicContact CB-CB 4.45Å; D206-W215 HydrophobicContact CB-CE3 3.88Å; D206-W215 WeakPolarHBondContact O-CZ3 3.4Å; D206-F216 WeakPolarHBondContact CA-O 3.32Å; D206-R269 HydrophobicContact CB-CG 3.98Å; D206-R269 PolarHBondContact N-O 2.79Å; D206-R269 PolarHBondContact O-N 3.02Å; D206-R271 IonicContact OD1-CZ 3.71Å; D206-R271 IonicContact OD1-NE 3.95Å; D206-R271 IonicContact OD1-NH1 3.65Å; D206-R271 PolarHBondContact OD1-NH1 2.92Å; D206-A272 WeakPolarHBondContact OD2-CB 3.22Å; D206-A272 PolarHBondContact OD2-N 2.63Å; D206-R360 VanDerWaalsContact CG-NH1 3.29Å; D206-R360 IonicContact OD1-CZ 3.21Å; D206-R360 IonicContact OD1-NH1 2.8Å; D206-R360 PolarHBondContact OD1-NH1 3.04Å; D206-R360 IonicContact OD1-NH2 2.89Å; D206-R360 PolarHBondContact OD1-NH2 3.4Å; D206-R360 IonicContact OD2-CZ 3.95Å; D206-R360 IonicContact OD2-NH1 3.03Å; D206-R360 PolarHBondContact OD2-NH1 3.31Å
207	A	93.2	Very high	87.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.3	178.6	0	0	0	0	0	109.9	F216 A218 V250 Y252 M263 D267	A207-F216 PolarHBondContact N-O 3.5Å; A207-F216 PolarHBondContact O-N 2.88Å; A207-A218 HydrophobicContact CB-CB 3.94Å; A207-V250 HydrophobicContact CB-CG2 4.16Å; A207-Y252 HydrophobicContact CB-CE1 3.9Å; A207-M263 HydrophobicContact CB-CE 4.37Å; A207-D267 CarbonylContact C-O 3.56Å; A207-D267 WeakPolarHBondContact CA-O 3.37Å
208	R	92.4	Very high	89.2	Confident	69 Å²	69	41 Å²	41	26%	0.26	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.4	-179.3	-175.3	169.8	64	175.5	2.4	110.7	A214 W215 M263 D267	R208-A214 CarbonylContact C-O 3.51Å; R208-A214 WeakPolarHBondContact CA-O 3.43Å; R208-W215 HydrophobicContact CB-CD2 3.81Å; R208-W215 HydrophobicContact CB-CE3 3.72Å; R208-W215 HydrophobicContact CB-CH2 3.88Å; R208-W215 HydrophobicContact CB-CZ2 3.97Å; R208-W215 HydrophobicContact CB-CZ3 3.74Å; R208-W215 HydrophobicContact CG-CD2 4.36Å; R208-W215 HydrophobicContact CG-CZ2 4.4Å; R208-M263 WeakPolarHBondContact O-CE 3.43Å; R208-D267 HydrophobicContact CB-CB 4.15Å; R208-D267 IonicContact CZ-OD1 3.91Å; R208-D267 PolarHBondContact N-O 2.86Å; R208-D267 IonicContact NE-OD1 3.56Å; R208-D267 PolarHBondContact NE-OD1 3Å; R208-D267 IonicContact NH2-OD1 3.89Å; R208-D267 PolarHBondContact NH2-OD1 3.28Å
209	D	89.4	Confident	89.8	Confident	47 Å²	47	38 Å²	38	25%	0.251	19%	0.193	S	C	.	.			trans	-73.2	124.5	167.6	-179.2	-74.9	0	0	0	109.5	N211 M212 G213 A214 F216	D209-N211 VanDerWaalsContact C-N 3.3Å; D209-N211 PolarHBondContact O-N 3.37Å; D209-N211 WeakPolarHBondContact OD1-CA 3.3Å; D209-N211 VanDerWaalsContact OD1-CB 3.31Å; D209-N211 WeakPolarHBondContact OD1-CB 3.2Å; D209-N211 PolarHBondContact OD1-N 2.98Å; D209-M212 HydrophobicContact CB-CG 3.79Å; D209-M212 HydrophobicContact CB-SD 4.28Å; D209-M212 WeakPolarHBondContact OD1-CG 3.49Å; D209-M212 PolarHBondContact OD1-N 3.07Å; D209-G213 WeakPolarHBondContact O-CA 3.37Å; D209-G213 PolarHBondContact O-N 3.45Å; D209-A214 PolarHBondContact N-O 2.82Å; D209-F216 HydrophobicContact CB-CD2 4.14Å; D209-F216 HydrophobicContact CB-CE2 3.84Å
210	T	83.9	Confident	90	Very high	91 Å²	91	37.5 Å²	37.5	56%	0.558	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-22.7	-175.6	47.7	0	0	0	0	113.7
211	N	82.6	Confident	90.2	Very high	146 Å²	146	35 Å²	35	78%	0.781	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-44.4	-175.5	-66.2	47.1	0	0	0	110.9	D209	D209-N211 VanDerWaalsContact C-N 3.3Å; D209-N211 PolarHBondContact O-N 3.37Å; D209-N211 WeakPolarHBondContact OD1-CA 3.3Å; D209-N211 VanDerWaalsContact OD1-CB 3.31Å; D209-N211 WeakPolarHBondContact OD1-CB 3.2Å; D209-N211 PolarHBondContact OD1-N 2.98Å
212	M	82.9	Confident	90.2	Very high	54 Å²	54	35.2 Å²	35.2	27%	0.266	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-19.2	179.5	65.3	-166.6	-71.2	0	0	113.5	D209 A214 F216 F301 Y303	D209-M212 HydrophobicContact CB-CG 3.79Å; D209-M212 HydrophobicContact CB-SD 4.28Å; D209-M212 WeakPolarHBondContact OD1-CG 3.49Å; D209-M212 PolarHBondContact OD1-N 3.07Å; M212-A214 VanDerWaalsContact C-N 3.26Å; M212-A214 HydrophobicContact CE-CB 3.59Å; M212-A214 HydrophobicContact CG-CB 3.75Å; M212-A214 PolarHBondContact O-N 3.3Å; M212-A214 HydrophobicContact SD-CB 4.09Å; M212-F216 HydrophobicContact CE-CE2 4.11Å; M212-F216 HydrophobicContact CE-CZ 3.68Å; M212-F216 HydrophobicContact CG-CE2 4.3Å; M212-F216 HydrophobicContact SD-CE2 3.5Å; M212-F216 VanDerWaalsContact SD-CE2 3.5Å; M212-F216 HydrophobicContact SD-CZ 3.46Å; M212-F216 WeakPolarHBondContact SD-CZ 3.46Å; M212-F301 HydrophobicContact CE-CB 3.98Å; M212-F301 HydrophobicContact CE-CD1 3.91Å; M212-F301 HydrophobicContact CE-CD2 3.32Å; M212-F301 HydrophobicContact CE-CE1 4.22Å; M212-F301 HydrophobicContact CE-CE2 3.67Å; M212-F301 HydrophobicContact CE-CG 3.46Å; M212-F301 VanDerWaalsContact CE-CG 3.46Å; M212-F301 HydrophobicContact CE-CZ 4.1Å; M212-Y303 WeakPolarHBondContact O-CE1 3Å
213	G	86.8	Confident	90.3	Very high	4 Å²	4	31.1 Å²	31.1	4%	0.041	16%	0.156	C	C	.	.			trans	75.8	9.6	-176	0	0	0	0	0	114.6	D209	D209-G213 WeakPolarHBondContact O-CA 3.37Å; D209-G213 PolarHBondContact O-N 3.45Å
214	A	93	Very high	90	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.			trans	-88.9	151.5	-179.5	0	0	0	0	0	111.8	R208 D209 M212 F216 F301 W302 Y303	R208-A214 CarbonylContact C-O 3.51Å; R208-A214 WeakPolarHBondContact CA-O 3.43Å; D209-A214 PolarHBondContact N-O 2.82Å; M212-A214 VanDerWaalsContact C-N 3.26Å; M212-A214 HydrophobicContact CE-CB 3.59Å; M212-A214 HydrophobicContact CG-CB 3.75Å; M212-A214 PolarHBondContact O-N 3.3Å; M212-A214 HydrophobicContact SD-CB 4.09Å; A214-F216 HydrophobicContact CB-CE2 3.85Å; A214-F216 HydrophobicContact CB-CZ 4.28Å; A214-F301 HydrophobicContact CB-CB 3.84Å; A214-W302 CarbonylContact C-O 3.56Å; A214-W302 VanDerWaalsContact CA-O 3.24Å; A214-W302 WeakPolarHBondContact CA-O 3.15Å; A214-Y303 HydrophobicContact CB-CD1 4.05Å; A214-Y303 HydrophobicContact CB-CE1 3.57Å
215	W	94.1	Very high	89.5	Confident	11 Å²	11	33.1 Å²	33.1	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.5	176	-66.6	91.2	0	0	0	110.9	D206 R208 D267 R269 M288 W302 D304	D206-W215 HydrophobicContact CB-CB 4.45Å; D206-W215 HydrophobicContact CB-CE3 3.88Å; D206-W215 WeakPolarHBondContact O-CZ3 3.4Å; R208-W215 HydrophobicContact CB-CD2 3.81Å; R208-W215 HydrophobicContact CB-CE3 3.72Å; R208-W215 HydrophobicContact CB-CH2 3.88Å; R208-W215 HydrophobicContact CB-CZ2 3.97Å; R208-W215 HydrophobicContact CB-CZ3 3.74Å; R208-W215 HydrophobicContact CG-CD2 4.36Å; R208-W215 HydrophobicContact CG-CZ2 4.4Å; W215-D267 WeakPolarHBondContact CZ3-O 3.39Å; W215-R269 VanDerWaalsContact CD1-NH2 3.33Å; W215-R269 VanDerWaalsContact CE2-CZ 3.46Å; W215-R269 HydrophobicContact CE3-CG 3.98Å; W215-R269 HydrophobicContact CH2-CB 4.44Å; W215-R269 HydrophobicContact CH2-CG 3.97Å; W215-R269 HydrophobicContact CZ3-CB 4.24Å; W215-R269 HydrophobicContact CZ3-CG 3.55Å; W215-M288 HydrophobicContact CB-SD 3.92Å; W215-M288 HydrophobicContact CG-SD 4.29Å; W215-W302 PolarHBondContact N-O 3.49Å; W215-D304 PolarHBondContact NE1-OD1 2.91Å; W215-D304 PolarHBondContact NE1-OD2 3.44Å
216	F	93.4	Very high	88.4	Confident	19 Å²	19	38.7 Å²	38.7	8%	0.083	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.1	-178.1	-69.8	-88.3	0	0	0	112.3	D206 A207 D209 M212 A214 A218 Y252 Y255 F301	D206-F216 WeakPolarHBondContact CA-O 3.32Å; A207-F216 PolarHBondContact N-O 3.5Å; A207-F216 PolarHBondContact O-N 2.88Å; D209-F216 HydrophobicContact CB-CD2 4.14Å; D209-F216 HydrophobicContact CB-CE2 3.84Å; M212-F216 HydrophobicContact CE-CE2 4.11Å; M212-F216 HydrophobicContact CE-CZ 3.68Å; M212-F216 HydrophobicContact CG-CE2 4.3Å; M212-F216 HydrophobicContact SD-CE2 3.5Å; M212-F216 VanDerWaalsContact SD-CE2 3.5Å; M212-F216 HydrophobicContact SD-CZ 3.46Å; M212-F216 WeakPolarHBondContact SD-CZ 3.46Å; A214-F216 HydrophobicContact CB-CE2 3.85Å; A214-F216 HydrophobicContact CB-CZ 4.28Å; F216-A218 PolarHBondContact O-N 2.75Å; F216-Y252 HydrophobicContact CB-CD1 3.68Å; F216-Y252 HydrophobicContact CB-CE1 3.65Å; F216-Y252 HydrophobicContact CG-CE1 4.37Å; F216-Y255 AromaticContact CD1-CE2 3.89Å; F216-Y255 HydrophobicContact CD1-CE2 3.89Å; F216-Y255 HydrophobicContact CE1-CE2 4.09Å; F216-F301 AromaticContact CE1-CD1 3.85Å; F216-F301 HydrophobicContact CE1-CD1 3.85Å; F216-F301 HydrophobicContact CE1-CE1 4.1Å; F216-F301 AromaticContact CZ-CD1 3.94Å; F216-F301 HydrophobicContact CZ-CD1 3.94Å; F216-F301 HydrophobicContact CZ-CE1 4.25Å
217	E	93.1	Very high	86.6	Confident	7 Å²	7	40.7 Å²	40.7	3%	0.033	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	116.4	173.7	-70.5	93.4	143.2	0	0	112.5	Y252 D253 R271 R360	E217-Y252 WeakPolarHBondContact O-CA 3.33Å; E217-D253 HydrophobicContact CB-CB 4.06Å; E217-D253 PolarHBondContact O-N 2.94Å; E217-R271 VanDerWaalsContact CA-CZ 3.42Å; E217-R271 VanDerWaalsContact CA-NH1 3.27Å; E217-R360 VanDerWaalsContact CD-CZ 3.48Å; E217-R360 WeakPolarHBondContact OE1-CB 3.24Å; E217-R360 IonicContact OE1-CZ 3.62Å; E217-R360 PolarHBondContact OE1-N 2.92Å; E217-R360 IonicContact OE1-NE 3.15Å; E217-R360 PolarHBondContact OE1-NE 2.85Å; E217-R360 IonicContact OE1-NH2 2.82Å; E217-R360 IonicContact OE2-CZ 3.57Å; E217-R360 IonicContact OE2-NE 3.78Å; E217-R360 IonicContact OE2-NH2 2.71Å; E217-R360 PolarHBondContact OE2-NH2 3.44Å
218	A	92.8	Very high	84.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	170	175.1	0	0	0	0	0	113.6	V205 A207 F216 V250 K251 Y252 R271	V205-A218 HydrophobicContact CG2-CB 4.37Å; V205-A218 PolarHBondContact N-O 2.93Å; V205-A218 CarbonylContact O-C 3.49Å; V205-A218 WeakPolarHBondContact O-CA 3.45Å; V205-A218 PolarHBondContact O-N 2.83Å; A207-A218 HydrophobicContact CB-CB 3.94Å; F216-A218 PolarHBondContact O-N 2.75Å; A218-V250 HydrophobicContact CB-CB 4.11Å; A218-V250 HydrophobicContact CB-CG2 4.17Å; A218-K251 CarbonylContact C-O 3.48Å; A218-K251 WeakPolarHBondContact CA-O 3.15Å; A218-K251 VanDerWaalsContact CB-O 3.3Å; A218-K251 WeakPolarHBondContact CB-O 3.44Å; A218-Y252 HydrophobicContact CB-CD1 4.01Å; A218-Y252 HydrophobicContact CB-CE1 4.4Å; A218-R271 PolarHBondContact O-NH2 2.82Å
219	Q	92.7	Very high	82.1	Confident	23 Å²	23	48 Å²	48	11%	0.107	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137	172.7	-175	177.4	43.1	0	0	110.2	N202 E203 Y204 V221 V250 K251	N202-Q219 PolarHBondContact O-NE2 3.45Å; E203-Q219 WeakPolarHBondContact O-CA 3.36Å; Y204-Q219 HydrophobicContact CD1-CB 4.43Å; Q219-V221 PolarHBondContact O-N 2.98Å; Q219-V250 VanDerWaalsContact O-CA 3.29Å; Q219-V250 WeakPolarHBondContact O-CA 3.34Å; Q219-K251 HydrophobicContact CB-CG 4.24Å; Q219-K251 PolarHBondContact N-O 3.41Å; Q219-K251 PolarHBondContact O-N 2.85Å
220	V	91.6	Very high	79.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124	175.9	-176.6	0	0	0	0	109.9	K200 N202 E203 V205 V223 Y248 V250	K200-V220 WeakPolarHBondContact O-CB 3.45Å; N202-V220 WeakPolarHBondContact CA-O 3.31Å; N202-V220 PolarHBondContact N-O 2.75Å; E203-V220 PolarHBondContact O-N 2.98Å; V205-V220 HydrophobicContact CB-CG2 4.32Å; V205-V220 HydrophobicContact CG1-CG2 3.69Å; V205-V220 HydrophobicContact CG2-CG2 3.64Å; V220-V223 HydrophobicContact CG1-CG2 3.78Å; V220-Y248 HydrophobicContact CG1-CD1 4.19Å; V220-V250 HydrophobicContact CG2-CG1 4.43Å
221	V	90.6	Very high	78	Confident	55 Å²	55	60.2 Å²	60.2	33%	0.333	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-43.1	178.1	-179.2	0	0	0	0	111	V201 Q219 H249 K251 V260	V201-V221 VanDerWaalsContact CG1-O 3.28Å; V201-V221 WeakPolarHBondContact CG1-O 3.39Å; Q219-V221 PolarHBondContact O-N 2.98Å; V221-H249 WeakPolarHBondContact CA-O 3.38Å; V221-H249 WeakPolarHBondContact CB-O 3.46Å; V221-H249 PolarHBondContact N-O 3.16Å; V221-K251 HydrophobicContact CG2-CB 3.89Å; V221-K251 HydrophobicContact CG2-CD 3.75Å; V221-K251 HydrophobicContact CG2-CG 3.64Å; V221-V260 HydrophobicContact CB-CG1 4.38Å; V221-V260 HydrophobicContact CG1-CG2 4.43Å; V221-V260 HydrophobicContact CG2-CG2 4.39Å
222	R	87.7	Confident	75.6	Confident	78 Å²	78	62 Å²	62	29%	0.294	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	151.1	-178	-174	176.7	64.9	147.4	-7.5	110.8	E193 T224 H249	E193-R222 WeakPolarHBondContact OE1-CD 3.47Å; R222-T224 HydrophobicContact CG-CG2 4.12Å; R222-H249 HydrophobicContact CB-CB 3.9Å; R222-H249 PolarHBondContact N-O 2.79Å; R222-H249 PolarHBondContact NH2-CE1 2.74Å; R222-H249 PolarHBondContact NH2-ND1 2.84Å; R222-H249 WeakPolarHBondContact O-CB 3.42Å; R222-H249 PolarHBondContact O-N 3.21Å
223	V	87.9	Confident	73.5	Confident	10 Å²	10	64.5 Å²	64.5	6%	0.061	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.9	175.7	-172.3	0	0	0	0	108.7	T194 V201 V220 V246 Y248	T194-V223 PolarHBondContact N-O 2.74Å; V201-V223 HydrophobicContact CG2-CG2 4.22Å; V220-V223 HydrophobicContact CG1-CG2 3.78Å; V223-V246 HydrophobicContact CG1-CG1 3.43Å; V223-V246 VanDerWaalsContact CG1-CG1 3.43Å; V223-Y248 HydrophobicContact CG1-CD1 4.19Å; V223-Y248 HydrophobicContact CG1-CE1 3.97Å; V223-Y248 HydrophobicContact CG2-CD1 3.81Å; V223-Y248 HydrophobicContact CG2-CE1 3.92Å
224	T	85.1	Confident	71	Confident	2 Å²	2	71 Å²	71	1%	0.012	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	150.4	-177.9	53.6	0	0	0	0	110.3	W191 R222 I247 H249	W191-T224 HydrophobicContact CB-CG2 4.47Å; R222-T224 HydrophobicContact CG-CG2 4.12Å; T224-I247 PolarHBondContact N-O 2.92Å; T224-I247 PolarHBondContact O-N 2.88Å; T224-I247 PolarHBondContact OG1-O 2.87Å; T224-H249 PolarHBondContact OG1-CD2 2.86Å; T224-H249 PolarHBondContact OG1-NE2 2.92Å
225	R	80.7	Confident	68	Low	80 Å²	80	76.7 Å²	76.7	30%	0.302	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.6	175.2	-172.1	-179	177.5	-171.9	-0.4	111.3	D192 T194 D245	D192-R225 PolarHBondContact O-N 3.13Å; T194-R225 HydrophobicContact CG2-CB 4.4Å; T194-R225 WeakPolarHBondContact OG1-CB 3.41Å; R225-D245 WeakPolarHBondContact CA-O 3.35Å; R225-D245 HydrophobicContact CG-CB 4.19Å
226	K	67.9	Low	65.5	Low	116 Å²	116	81.1 Å²	81.1	50%	0.504	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	123.7	172.3	-152.7	154.8	-174	-178.6	0	110.4	W191 D245	W191-K226 HydrophobicContact CE3-CB 4.34Å; W191-K226 HydrophobicContact CE3-CG 4.45Å; W191-K226 HydrophobicContact CH2-CB 4.23Å; W191-K226 HydrophobicContact CH2-CD 3.8Å; W191-K226 HydrophobicContact CH2-CG 3.58Å; W191-K226 HydrophobicContact CZ3-CB 3.53Å; W191-K226 HydrophobicContact CZ3-CD 3.93Å; W191-K226 HydrophobicContact CZ3-CG 3.4Å; W191-K226 VanDerWaalsContact CZ3-CG 3.4Å; K226-D245 HydrophobicContact CB-CB 4.49Å; K226-D245 PolarHBondContact N-O 2.82Å
227	A	57.1	Low	62.7	Low	42 Å²	42	86.7 Å²	86.7	35%	0.347	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-68.4	140.6	175.2	0	0	0	0	0	110.4	S229	A227-S229 PolarHBondContact O-N 2.83Å
228	P	51.2	Low	59.8	Low	119 Å²	119	92 Å²	92	77%	0.773	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-66.1	123.3	176.9	25.1	-30.8	0	0	0	110	R230	P228-R230 PolarHBondContact O-N 3.4Å
229	S	40.5	Very low	57.1	Low	105 Å²	105	102.7 Å²	102.7	73%	0.734	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-63.9	124.2	174.5	52.1	0	0	0	0	110.1	A227 D231	A227-S229 PolarHBondContact O-N 2.83Å; S229-D231 VanDerWaalsContact C-N 3.3Å; S229-D231 PolarHBondContact O-N 2.81Å
230	R	42.9	Very low	54.7	Low	244 Å²	244	107.4 Å²	107.4	92%	0.921	59%	0.593	S	S	*	*	S	Bend	trans	-70.4	89.9	165.6	-76.2	176.8	138.6	-174.2	-4.3	108.2	P228	P228-R230 PolarHBondContact O-N 3.4Å
231	D	43.3	Very low	52.2	Low	150 Å²	150	110.7 Å²	110.7	80%	0.802	62%	0.62	S	S	*	*			trans	166.8	90.9	151.4	-83.5	-25	0	0	0	108.1	S229	S229-D231 VanDerWaalsContact C-N 3.3Å; S229-D231 PolarHBondContact O-N 2.81Å
232	E	32.9	Very low	50.1	Low	183 Å²	183	113.1 Å²	113.1	86%	0.855	63%	0.631	S	S	*	*			trans	-170.3	137.7	151.9	-103.2	-66.6	104.2	0	0	109.1
233	P	38.5	Very low	48.4	Very low	106 Å²	106	115.6 Å²	115.6	69%	0.688	65%	0.645	S	S	*	*			trans	-78.5	140.8	-171.4	-6.2	23.6	0	0	0	113.1	S235	P233-S235 PolarHBondContact O-N 3.24Å
234	C	33.7	Very low	46.8	Very low	142 Å²	142	120.9 Å²	120.9	96%	0.959	67%	0.67	S	S	*	*			trans	-47.6	119.9	173.5	-88	0	0	0	0	113.8
235	S	30.6	Very low	46	Very low	119 Å²	119	123.6 Å²	123.6	83%	0.832	68%	0.684	S	S	*	*			trans	-125.4	116.1	151.7	-168.4	0	0	0	0	109.6	P233 T237	P233-S235 PolarHBondContact O-N 3.24Å; S235-T237 PolarHBondContact O-N 2.88Å
236	S	41.2	Very low	46.1	Very low	104 Å²	104	120.1 Å²	120.1	73%	0.727	67%	0.672	S	S	*	*			trans	-75.4	115.1	-178.8	49.9	0	0	0	0	111.3
237	T	35.2	Very low	47	Very low	136 Å²	136	116.1 Å²	116.1	83%	0.834	66%	0.655	S	S	*	*			trans	173.3	139.3	131	25	0	0	0	0	111.1	S235	S235-T237 PolarHBondContact O-N 2.88Å
238	S	31.1	Very low	48.6	Very low	119 Å²	119	114.3 Å²	114.3	83%	0.832	64%	0.639	S	S	*	*			trans	89.9	112.8	175.9	76.5	0	0	0	0	117.9
239	R	36.5	Very low	50.5	Low	223 Å²	223	109 Å²	109	84%	0.842	61%	0.605	S	S	*	*			trans	-76.1	135.4	147.3	-86.2	173.9	147.3	-178.6	-7.7	105.9
240	P	42	Very low	52.9	Low	123 Å²	123	104 Å²	104	80%	0.799	57%	0.57	S	S	*	*				-141.8	120.3	56	34.9	-15	0	0	0	114
241	A	40.2	Very low	55.3	Low	68 Å²	68	96.6 Å²	96.6	56%	0.562	54%	0.544	S	S	*	.			trans	-144.6	53.9	169.4	0	0	0	0	0	110.7
242	L	46.4	Very low	57.6	Low	107 Å²	107	90.5 Å²	90.5	56%	0.56	51%	0.51	S	S	*	.	S	Bend	trans	-97	-14.7	168.2	-78.1	165.4	0	0	0	112.1
243	E	50.9	Low	60.1	Low	130 Å²	130	83.2 Å²	83.2	61%	0.607	48%	0.477	S	S	*	.	S	Bend	trans	-100.1	-20.2	-172.8	-67.8	179.2	177	0	0	114.5	S265	E243-S265 WeakPolarHBondContact O-CB 3.37Å; E243-S265 PolarHBondContact O-OG 2.69Å
244	E	54.3	Low	62.1	Low	121 Å²	121	81.6 Å²	81.6	57%	0.565	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.8	179.1	-77.1	-151	134.2	0	0	114.3	R266	E244-R266 IonicContact OE1-CZ 3.77Å; E244-R266 IonicContact OE1-NH2 2.72Å; E244-R266 PolarHBondContact OE1-NH2 2.98Å
245	D	68.2	Low	64.5	Low	59 Å²	59	78.8 Å²	78.8	32%	0.316	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.3	-177.9	-69.6	-22.4	0	0	0	113.6	R225 K226	R225-D245 WeakPolarHBondContact CA-O 3.35Å; R225-D245 HydrophobicContact CG-CB 4.19Å; K226-D245 HydrophobicContact CB-CB 4.49Å; K226-D245 PolarHBondContact N-O 2.82Å
246	V	83.1	Confident	66.8	Low	7 Å²	7	78 Å²	78	4%	0.042	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.7	-177.8	-176.1	0	0	0	0	110	V223 Y248	V223-V246 HydrophobicContact CG1-CG1 3.43Å; V223-V246 VanDerWaalsContact CG1-CG1 3.43Å; V246-Y248 HydrophobicContact CG1-CE1 4.33Å; V246-Y248 HydrophobicContact CG1-CE2 4.17Å
247	I	88.1	Confident	68.4	Low	32 Å²	32	79.3 Å²	79.3	16%	0.164	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.9	175.2	-61.9	177.9	0	0	0	108.5	W191 T224 Q262	W191-I247 HydrophobicContact CH2-CD1 4Å; W191-I247 HydrophobicContact CZ3-CD1 3.72Å; T224-I247 PolarHBondContact N-O 2.92Å; T224-I247 PolarHBondContact O-N 2.88Å; T224-I247 PolarHBondContact OG1-O 2.87Å; I247-Q262 HydrophobicContact CG2-CB 4.05Å
248	Y	90.3	Very high	70.6	Confident	3 Å²	3	77.2 Å²	77.2	1%	0.012	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.1	175.7	-67.3	-77.1	0	0	0	110	L198 Y199 V220 V223 V246 M263 V268	L198-Y248 PolarHBondContact N-OH 3.24Å; Y199-Y248 HydrophobicContact CD2-CE1 4.24Å; Y199-Y248 HydrophobicContact CD2-CE2 4.16Å; Y199-Y248 AromaticContact CD2-CZ 3.83Å; Y199-Y248 PolarHBondContact N-OH 2.9Å; Y199-Y248 WeakPolarHBondContact O-CE1 3.35Å; V220-Y248 HydrophobicContact CG1-CD1 4.19Å; V223-Y248 HydrophobicContact CG1-CD1 4.19Å; V223-Y248 HydrophobicContact CG1-CE1 3.97Å; V223-Y248 HydrophobicContact CG2-CD1 3.81Å; V223-Y248 HydrophobicContact CG2-CE1 3.92Å; V246-Y248 HydrophobicContact CG1-CE1 4.33Å; V246-Y248 HydrophobicContact CG1-CE2 4.17Å; Y248-M263 PolarHBondContact N-O 2.86Å; Y248-M263 PolarHBondContact O-N 2.88Å; Y248-V268 HydrophobicContact CD2-CB 4.1Å; Y248-V268 HydrophobicContact CD2-CG1 4.43Å; Y248-V268 HydrophobicContact CD2-CG2 4.04Å; Y248-V268 HydrophobicContact CG-CG1 4.48Å; Y248-V268 HydrophobicContact CG-CG2 4.27Å
249	H	90.7	Very high	73.3	Confident	9 Å²	9	73.2 Å²	73.2	4%	0.042	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.1	171.4	-63	-110.4	0	0	0	106.9	V221 R222 T224 V260 V261 Q262	V221-H249 WeakPolarHBondContact CA-O 3.38Å; V221-H249 WeakPolarHBondContact CB-O 3.46Å; V221-H249 PolarHBondContact N-O 3.16Å; R222-H249 HydrophobicContact CB-CB 3.9Å; R222-H249 PolarHBondContact N-O 2.79Å; R222-H249 PolarHBondContact NH2-CE1 2.74Å; R222-H249 PolarHBondContact NH2-ND1 2.84Å; R222-H249 WeakPolarHBondContact O-CB 3.42Å; R222-H249 PolarHBondContact O-N 3.21Å; T224-H249 PolarHBondContact OG1-CD2 2.86Å; T224-H249 PolarHBondContact OG1-NE2 2.92Å; H249-V260 HydrophobicContact CB-CG1 3.67Å; H249-V261 CarbonylContact C-O 3.6Å; H249-V261 WeakPolarHBondContact CA-O 3.39Å; H249-Q262 PolarHBondContact CE1-NE2 2.81Å
250	V	91.9	Very high	75.9	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	150.7	-175.1	-53.5	0	0	0	0	110.8	V205 A207 A218 Q219 V220 V260 V261 M263 V268	V205-V250 HydrophobicContact CG2-CG1 4.19Å; A207-V250 HydrophobicContact CB-CG2 4.16Å; A218-V250 HydrophobicContact CB-CB 4.11Å; A218-V250 HydrophobicContact CB-CG2 4.17Å; Q219-V250 VanDerWaalsContact O-CA 3.29Å; Q219-V250 WeakPolarHBondContact O-CA 3.34Å; V220-V250 HydrophobicContact CG2-CG1 4.43Å; V250-V260 WeakPolarHBondContact O-CA 3.21Å; V250-V261 PolarHBondContact N-O 2.68Å; V250-V261 PolarHBondContact O-N 3.37Å; V250-M263 HydrophobicContact CG1-CG 4.35Å; V250-M263 HydrophobicContact CG2-CG 3.5Å; V250-M263 VanDerWaalsContact CG2-CG 3.5Å; V250-V268 HydrophobicContact CG1-CG2 4.49Å
251	K	91.8	Very high	78.2	Confident	88 Å²	88	62.8 Å²	62.8	38%	0.383	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.9	166.9	64.6	-176.7	178.8	-178.7	0	108.6	A218 Q219 V221	A218-K251 CarbonylContact C-O 3.48Å; A218-K251 WeakPolarHBondContact CA-O 3.15Å; A218-K251 VanDerWaalsContact CB-O 3.3Å; A218-K251 WeakPolarHBondContact CB-O 3.44Å; Q219-K251 HydrophobicContact CB-CG 4.24Å; Q219-K251 PolarHBondContact N-O 3.41Å; Q219-K251 PolarHBondContact O-N 2.85Å; V221-K251 HydrophobicContact CG2-CB 3.89Å; V221-K251 HydrophobicContact CG2-CD 3.75Å; V221-K251 HydrophobicContact CG2-CG 3.64Å
252	Y	91.3	Very high	80.6	Confident	21 Å²	21	65.6 Å²	65.6	8%	0.082	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	136.9	177.2	-67.8	-77.9	0	0	0	110.8	A207 F216 E217 A218 D254 V261	A207-Y252 HydrophobicContact CB-CE1 3.9Å; F216-Y252 HydrophobicContact CB-CD1 3.68Å; F216-Y252 HydrophobicContact CB-CE1 3.65Å; F216-Y252 HydrophobicContact CG-CE1 4.37Å; E217-Y252 WeakPolarHBondContact O-CA 3.33Å; A218-Y252 HydrophobicContact CB-CD1 4.01Å; A218-Y252 HydrophobicContact CB-CE1 4.4Å; Y252-D254 VanDerWaalsContact C-N 3.28Å; Y252-D254 PolarHBondContact O-N 2.84Å; Y252-V261 HydrophobicContact CD2-CG2 4.38Å; Y252-V261 HydrophobicContact CE2-CB 4.25Å; Y252-V261 HydrophobicContact CE2-CG2 3.94Å
253	D	86.4	Confident	82.6	Confident	31 Å²	31	61.2 Å²	61.2	17%	0.166	32%	0.317	C	S	.	.	S	Bend	trans	-66.7	-30	-173.2	-69.1	-4	0	0	0	112.6	E217 R271 R359	E217-D253 HydrophobicContact CB-CB 4.06Å; E217-D253 PolarHBondContact O-N 2.94Å; D253-R271 IonicContact OD1-NH2 3.98Å; D253-R271 IonicContact OD2-CZ 3.94Å; D253-R271 IonicContact OD2-NH2 2.88Å; D253-R271 PolarHBondContact OD2-NH2 2.67Å; D253-R359 PolarHBondContact O-NH2 2.85Å
254	D	80.6	Confident	84.4	Confident	71 Å²	71	57.8 Å²	57.8	38%	0.38	30%	0.303	S	S	.	.	S	Bend	trans	-113.7	0.4	-175.7	-73.7	-36.7	0	0	0	114.2	Y252 P256 R359	Y252-D254 VanDerWaalsContact C-N 3.28Å; Y252-D254 PolarHBondContact O-N 2.84Å; D254-P256 VanDerWaalsContact C-CD 3.46Å; D254-R359 IonicContact OD1-CZ 3.06Å; D254-R359 IonicContact OD1-NE 3.8Å; D254-R359 IonicContact OD1-NH1 2.58Å; D254-R359 PolarHBondContact OD1-NH1 3.35Å; D254-R359 IonicContact OD1-NH2 3.45Å; D254-R359 PolarHBondContact OD1-NH2 3.02Å
255	Y	83.3	Confident	86	Confident	84 Å²	84	53.3 Å²	53.3	33%	0.329	29%	0.285	S	S	.	.			trans	-131.7	61	-178.3	-55.5	-90.6	0	0	0	111.2	F216 E257 N258	F216-Y255 AromaticContact CD1-CE2 3.89Å; F216-Y255 HydrophobicContact CD1-CE2 3.89Å; F216-Y255 HydrophobicContact CE1-CE2 4.09Å; Y255-E257 VanDerWaalsContact C-OE2 3.23Å; Y255-E257 WeakPolarHBondContact CA-OE2 3.42Å; Y255-E257 WeakPolarHBondContact CD1-OE1 3.36Å; Y255-E257 PolarHBondContact O-N 2.77Å; Y255-N258 PolarHBondContact O-N 2.79Å
256	P	79.3	Confident	86.9	Confident	101 Å²	101	57.4 Å²	57.4	66%	0.656	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61.1	-24.4	-178.8	27.4	-36.4	0	0	0	113.4	D254 N258 G259	D254-P256 VanDerWaalsContact C-CD 3.46Å; P256-N258 PolarHBondContact O-N 3.32Å; P256-G259 PolarHBondContact O-N 2.78Å
257	E	75.4	Confident	87.2	Confident	132 Å²	132	57.6 Å²	57.6	62%	0.617	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-62	-25.3	177.3	65.6	-82.6	-168.9	0	0	113.6	Y255 G259	Y255-E257 VanDerWaalsContact C-OE2 3.23Å; Y255-E257 WeakPolarHBondContact CA-OE2 3.42Å; Y255-E257 WeakPolarHBondContact CD1-OE1 3.36Å; Y255-E257 PolarHBondContact O-N 2.77Å; E257-G259 PolarHBondContact O-N 2.87Å
258	N	81.4	Confident	87.4	Confident	92 Å²	92	56.4 Å²	56.4	49%	0.492	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-77.1	-8	176.3	-68.5	-27.8	0	0	0	112.7	Y255 P256 V261	Y255-N258 PolarHBondContact O-N 2.79Å; P256-N258 PolarHBondContact O-N 3.32Å; N258-V261 HydrophobicContact CB-CG2 4.41Å
259	G	87.6	Confident	87.5	Confident	35 Å²	35	57 Å²	57	36%	0.361	29%	0.293	S	S	.	.			trans	62.4	-137.1	-178.9	0	0	0	0	0	112.8	P256 E257	P256-G259 PolarHBondContact O-N 2.78Å; E257-G259 PolarHBondContact O-N 2.87Å
260	V	89.9	Confident	87.5	Confident	83 Å²	83	57.1 Å²	57.1	50%	0.503	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.3	179.9	-178.5	0	0	0	0	109.3	V221 H249 V250	V221-V260 HydrophobicContact CB-CG1 4.38Å; V221-V260 HydrophobicContact CG1-CG2 4.43Å; V221-V260 HydrophobicContact CG2-CG2 4.39Å; H249-V260 HydrophobicContact CB-CG1 3.67Å; V250-V260 WeakPolarHBondContact O-CA 3.21Å
261	V	90.8	Very high	87.4	Confident	44 Å²	44	57.3 Å²	57.3	27%	0.267	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140	-176.1	-176.6	0	0	0	0	110.5	H249 V250 Y252 N258 M263	H249-V261 CarbonylContact C-O 3.6Å; H249-V261 WeakPolarHBondContact CA-O 3.39Å; V250-V261 PolarHBondContact N-O 2.68Å; V250-V261 PolarHBondContact O-N 3.37Å; Y252-V261 HydrophobicContact CD2-CG2 4.38Å; Y252-V261 HydrophobicContact CE2-CB 4.25Å; Y252-V261 HydrophobicContact CE2-CG2 3.94Å; N258-V261 HydrophobicContact CB-CG2 4.41Å; V261-M263 HydrophobicContact CG1-SD 3.81Å
262	Q	90.8	Very high	87.4	Confident	127 Å²	127	53.5 Å²	53.5	59%	0.593	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.4	176.6	-60.2	-172.7	7.1	0	0	110.7	I247 H249	I247-Q262 HydrophobicContact CG2-CB 4.05Å; H249-Q262 PolarHBondContact CE1-NE2 2.81Å
263	M	88.6	Confident	87.3	Confident	15 Å²	15	56.8 Å²	56.8	7%	0.074	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.8	-176.9	-56.9	-57.1	-66.7	0	0	110.8	A207 R208 Y248 V250 V261 D267 V268	A207-M263 HydrophobicContact CB-CE 4.37Å; R208-M263 WeakPolarHBondContact O-CE 3.43Å; Y248-M263 PolarHBondContact N-O 2.86Å; Y248-M263 PolarHBondContact O-N 2.88Å; V250-M263 HydrophobicContact CG1-CG 4.35Å; V250-M263 HydrophobicContact CG2-CG 3.5Å; V250-M263 VanDerWaalsContact CG2-CG 3.5Å; V261-M263 HydrophobicContact CG1-SD 3.81Å; M263-D267 HydrophobicContact CE-CB 3.89Å; M263-V268 HydrophobicContact CB-CG2 3.55Å; M263-V268 HydrophobicContact CG-CG2 4.28Å
264	N	89.4	Confident	87.5	Confident	58 Å²	58	58.2 Å²	58.2	31%	0.31	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	150.4	169.7	-167.6	-58.6	0	0	0	109.8	R266 D267	N264-R266 HydrophobicContact CB-CG 4.1Å; N264-R266 PolarHBondContact O-N 2.99Å; N264-R266 VanDerWaalsContact O-N 3.16Å; N264-R266 WeakPolarHBondContact OD1-CG 3.48Å; N264-R266 PolarHBondContact OD1-N 3.18Å; N264-D267 PolarHBondContact O-N 3.34Å
265	S	86.4	Confident	88.1	Confident	27 Å²	27	59.1 Å²	59.1	19%	0.189	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-55.8	-30.1	177.4	61.1	0	0	0	0	114	E243 D267	E243-S265 WeakPolarHBondContact O-CB 3.37Å; E243-S265 PolarHBondContact O-OG 2.69Å; S265-D267 VanDerWaalsContact C-N 3.27Å; S265-D267 PolarHBondContact O-N 2.79Å
266	R	87.3	Confident	88.6	Confident	145 Å²	145	55.9 Å²	55.9	55%	0.547	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-69.4	-21	175.9	71.1	-177.2	62.6	174.3	-3.6	114.6	E244 N264	E244-R266 IonicContact OE1-CZ 3.77Å; E244-R266 IonicContact OE1-NH2 2.72Å; E244-R266 PolarHBondContact OE1-NH2 2.98Å; N264-R266 HydrophobicContact CB-CG 4.1Å; N264-R266 PolarHBondContact O-N 2.99Å; N264-R266 VanDerWaalsContact O-N 3.16Å; N264-R266 WeakPolarHBondContact OD1-CG 3.48Å; N264-R266 PolarHBondContact OD1-N 3.18Å
267	D	90.9	Very high	89.4	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.064	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-103.1	9.8	-175.7	-62.7	-53.6	0	0	0	112.1	A207 R208 W215 M263 N264 S265	A207-D267 CarbonylContact C-O 3.56Å; A207-D267 WeakPolarHBondContact CA-O 3.37Å; R208-D267 HydrophobicContact CB-CB 4.15Å; R208-D267 IonicContact CZ-OD1 3.91Å; R208-D267 PolarHBondContact N-O 2.86Å; R208-D267 IonicContact NE-OD1 3.56Å; R208-D267 PolarHBondContact NE-OD1 3Å; R208-D267 IonicContact NH2-OD1 3.89Å; R208-D267 PolarHBondContact NH2-OD1 3.28Å; W215-D267 WeakPolarHBondContact CZ3-O 3.39Å; M263-D267 HydrophobicContact CE-CB 3.89Å; N264-D267 PolarHBondContact O-N 3.34Å; S265-D267 VanDerWaalsContact C-N 3.27Å; S265-D267 PolarHBondContact O-N 2.79Å
268	V	91.1	Very high	90.2	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.2	177.5	-177.7	0	0	0	0	109	Y199 V205 Y248 V250 M263	Y199-V268 HydrophobicContact CD2-CB 4.41Å; Y199-V268 HydrophobicContact CD2-CG1 3.75Å; Y199-V268 HydrophobicContact CE2-CB 4.5Å; Y199-V268 HydrophobicContact CE2-CG1 4.14Å; Y199-V268 VanDerWaalsContact CE2-O 3.3Å; Y199-V268 WeakPolarHBondContact CE2-O 3.31Å; Y199-V268 HydrophobicContact CG-CG1 4.43Å; V205-V268 HydrophobicContact CB-CG1 3.75Å; V205-V268 HydrophobicContact CG1-CG1 3.99Å; V205-V268 HydrophobicContact CG2-CG1 3.84Å; Y248-V268 HydrophobicContact CD2-CB 4.1Å; Y248-V268 HydrophobicContact CD2-CG1 4.43Å; Y248-V268 HydrophobicContact CD2-CG2 4.04Å; Y248-V268 HydrophobicContact CG-CG1 4.48Å; Y248-V268 HydrophobicContact CG-CG2 4.27Å; V250-V268 HydrophobicContact CG1-CG2 4.49Å; M263-V268 HydrophobicContact CB-CG2 3.55Å; M263-V268 HydrophobicContact CG-CG2 4.28Å
269	R	91.8	Very high	90.7	Very high	16 Å²	16	54 Å²	54	6%	0.06	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	163.2	172.8	68.6	-173.4	-179.2	-174.7	-3.6	111.8	Y199 V205 D206 W215 R271 M288 D304	Y199-R269 WeakPolarHBondContact OH-CA 3.37Å; V205-R269 CarbonylContact C-O 3.42Å; V205-R269 WeakPolarHBondContact CA-O 3.37Å; V205-R269 VanDerWaalsContact CB-O 3.23Å; V205-R269 WeakPolarHBondContact CB-O 3.45Å; D206-R269 HydrophobicContact CB-CG 3.98Å; D206-R269 PolarHBondContact N-O 2.79Å; D206-R269 PolarHBondContact O-N 3.02Å; W215-R269 VanDerWaalsContact CD1-NH2 3.33Å; W215-R269 VanDerWaalsContact CE2-CZ 3.46Å; W215-R269 HydrophobicContact CE3-CG 3.98Å; W215-R269 HydrophobicContact CH2-CB 4.44Å; W215-R269 HydrophobicContact CH2-CG 3.97Å; W215-R269 HydrophobicContact CZ3-CB 4.24Å; W215-R269 HydrophobicContact CZ3-CG 3.55Å; R269-R271 PolarHBondContact O-N 3.03Å; R269-M288 PolarHBondContact NH2-SD 3.13Å; R269-D304 IonicContact CZ-OD1 3.84Å; R269-D304 VanDerWaalsContact CZ-OD1 3.31Å; R269-D304 IonicContact NH1-OD1 2.77Å; R269-D304 PolarHBondContact NH1-OD1 3.28Å; R269-D304 IonicContact NH1-OD2 3.44Å; R269-D304 PolarHBondContact NH1-OD2 3.49Å; R269-D304 IonicContact NH2-OD1 3.08Å; R269-D304 PolarHBondContact NH2-OD1 2.81Å
270	A	90.9	Very high	91	Very high	11 Å²	11	57 Å²	57	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	140.1	175.1	0	0	0	0	0	110.7	Y199 A272 E345	Y199-A270 HydrophobicContact CE1-CB 3.99Å; A270-A272 PolarHBondContact O-N 3.11Å; A270-E345 HydrophobicContact CB-CB 4.12Å
271	R	91.3	Very high	91.2	Very high	5 Å²	5	53.2 Å²	53.2	2%	0.019	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-56.4	128.4	-179.9	167.3	83	77	-96.2	-11.7	110.7	Y204 V205 D206 E217 A218 D253 R269 R273 M353 P357	Y204-R271 VanDerWaalsContact O-CB 3.23Å; Y204-R271 WeakPolarHBondContact O-CB 3.36Å; Y204-R271 PolarHBondContact O-N 2.78Å; Y204-R271 VanDerWaalsContact O-N 3.14Å; V205-R271 PolarHBondContact O-NH1 3.08Å; D206-R271 IonicContact OD1-CZ 3.71Å; D206-R271 IonicContact OD1-NE 3.95Å; D206-R271 IonicContact OD1-NH1 3.65Å; D206-R271 PolarHBondContact OD1-NH1 2.92Å; E217-R271 VanDerWaalsContact CA-CZ 3.42Å; E217-R271 VanDerWaalsContact CA-NH1 3.27Å; A218-R271 PolarHBondContact O-NH2 2.82Å; D253-R271 IonicContact OD1-NH2 3.98Å; D253-R271 IonicContact OD2-CZ 3.94Å; D253-R271 IonicContact OD2-NH2 2.88Å; D253-R271 PolarHBondContact OD2-NH2 2.67Å; R269-R271 PolarHBondContact O-N 3.03Å; R271-R273 PolarHBondContact O-N 3.43Å; R271-M353 HydrophobicContact CB-CE 3.36Å; R271-M353 HydrophobicContact CG-CE 3.08Å; R271-P357 HydrophobicContact CG-CB 4.36Å; R271-P357 HydrophobicContact CG-CG 3.98Å
272	A	91.5	Very high	91.4	Very high	8 Å²	8	57.8 Å²	57.8	7%	0.066	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-61.1	128.4	175.8	0	0	0	0	0	111	D206 A270 M288 F342	D206-A272 WeakPolarHBondContact OD2-CB 3.22Å; D206-A272 PolarHBondContact OD2-N 2.63Å; A270-A272 PolarHBondContact O-N 3.11Å; A272-M288 HydrophobicContact CB-CE 3.33Å; A272-F342 HydrophobicContact CB-CB 4.11Å; A272-F342 HydrophobicContact CB-CD1 3.83Å; A272-F342 HydrophobicContact CB-CG 4.14Å
273	R	88.2	Confident	91.6	Very high	89 Å²	89	56.2 Å²	56.2	34%	0.336	27%	0.274	S	S	.	.			trans	-130.8	-21.1	-176	67.9	-172.5	78.2	172.1	10.5	113.8	R271 S351 M353	R271-R273 PolarHBondContact O-N 3.43Å; R273-S351 VanDerWaalsContact CZ-O 3.25Å; R273-S351 PolarHBondContact NH1-O 3.37Å; R273-S351 PolarHBondContact NH1-OG 2.96Å; R273-S351 PolarHBondContact NH2-O 2.77Å; R273-M353 HydrophobicContact CB-CE 4.25Å; R273-M353 HydrophobicContact CB-SD 4.45Å
274	T	90.7	Very high	91.7	Very high	62 Å²	62	57.4 Å²	57.4	38%	0.38	29%	0.29	S	S	.	.			trans	-103	115	-172.7	-45.9	0	0	0	0	110.5	F342 K343 E345	T274-F342 WeakPolarHBondContact O-CA 3.35Å; T274-K343 HydrophobicContact CG2-CB 4.49Å; T274-K343 PolarHBondContact O-N 2.82Å; T274-E345 PolarHBondContact OG1-OE1 3.32Å
275	I	93.9	Very high	92	Very high	89 Å²	89	57.5 Å²	57.5	46%	0.456	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-83.5	126.8	171.2	-63.9	174.8	0	0	0	109	D339 V341 F342	I275-D339 WeakPolarHBondContact CG2-O 3.4Å; I275-V341 CarbonylContact C-O 3.41Å; I275-V341 WeakPolarHBondContact CA-O 3.49Å; I275-F342 HydrophobicContact CD1-CE1 4.45Å; I275-F342 HydrophobicContact CD1-CZ 4.15Å; I275-F342 HydrophobicContact CG1-CD1 4.13Å; I275-F342 HydrophobicContact CG1-CE1 3.71Å; I275-F342 HydrophobicContact CG1-CE2 4.29Å; I275-F342 HydrophobicContact CG1-CZ 3.8Å
276	I	94.3	Very high	92.4	Very high	17 Å²	17	60.4 Å²	60.4	9%	0.087	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-84.8	121.3	174.1	-56.1	168.7	0	0	0	107.9	D280 L281 V287 V341 K343	I276-D280 HydrophobicContact CG2-CB 3.84Å; I276-L281 HydrophobicContact CB-CD2 3.88Å; I276-L281 HydrophobicContact CG2-CD2 3.5Å; I276-L281 HydrophobicContact CG2-CG 3.98Å; I276-V287 HydrophobicContact CD1-CG1 3.69Å; I276-V341 PolarHBondContact N-O 2.76Å; I276-K343 HydrophobicContact CD1-CB 3.94Å; I276-K343 HydrophobicContact CG1-CB 3.96Å
277	K	94.8	Very high	92.9	Very high	142 Å²	142	53.5 Å²	53.5	62%	0.617	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-71	155.4	179.2	-66.2	-179.3	-179.5	174.5	0	110.4	Q279 D280 L281	K277-Q279 PolarHBondContact O-N 2.92Å; K277-D280 PolarHBondContact O-N 3.02Å; K277-L281 PolarHBondContact O-N 3.46Å
278	W	91.8	Very high	93.1	Very high	7 Å²	7	52.9 Å²	52.9	3%	0.027	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-47.9	-40.9	178.5	173.8	-102.3	0	0	0	113.5	D280 L281 K310 E312 R317 L319 V338	W278-D280 VanDerWaalsContact C-N 3.27Å; W278-D280 PolarHBondContact O-N 2.83Å; W278-L281 HydrophobicContact CE3-CD1 4.25Å; W278-L281 PolarHBondContact O-N 2.9Å; W278-K310 HydrophobicContact CH2-CD 4.42Å; W278-K310 HydrophobicContact CH2-CG 3.56Å; W278-K310 HydrophobicContact CZ2-CD 4.26Å; W278-K310 HydrophobicContact CZ2-CG 3.66Å; W278-K310 HydrophobicContact CZ3-CG 4.23Å; W278-K310 WeakPolarHBondContact O-CE 3.3Å; W278-K310 PolarHBondContact O-NZ 2.81Å; W278-E312 HydrophobicContact CZ2-CB 4.13Å; W278-E312 PolarHBondContact NE1-OE2 3.32Å; W278-R317 HydrophobicContact CD2-CB 4.28Å; W278-R317 HydrophobicContact CD2-CG 4.13Å; W278-R317 HydrophobicContact CE3-CB 4.17Å; W278-R317 HydrophobicContact CH2-CB 3.75Å; W278-R317 HydrophobicContact CH2-CG 4.34Å; W278-R317 HydrophobicContact CZ2-CB 3.87Å; W278-R317 HydrophobicContact CZ2-CG 3.95Å; W278-R317 HydrophobicContact CZ3-CB 3.9Å; W278-L319 HydrophobicContact CZ3-CB 4.11Å; W278-L319 HydrophobicContact CZ3-CD1 4.4Å; W278-V338 HydrophobicContact CE3-CB 4.16Å; W278-V338 HydrophobicContact CZ3-CB 4.23Å; W278-V338 HydrophobicContact CZ3-CG1 4.2Å
279	Q	92.8	Very high	93.4	Very high	135 Å²	135	52.6 Å²	52.6	63%	0.631	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.5	-33.9	-178	-64.3	76.7	18.7	0	0	112.2	K277	K277-Q279 PolarHBondContact O-N 2.92Å
280	D	94.1	Very high	93.5	Very high	99 Å²	99	51.9 Å²	51.9	53%	0.529	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-92	0.8	-172.3	-51.6	-34.8	0	0	0	112.7	I276 K277 W278	I276-D280 HydrophobicContact CG2-CB 3.84Å; K277-D280 PolarHBondContact O-N 3.02Å; W278-D280 VanDerWaalsContact C-N 3.27Å; W278-D280 PolarHBondContact O-N 2.83Å
281	L	94.7	Very high	93.6	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	27%	0.272	C	S	.	.			trans	-80.8	123.9	175.2	-67.2	174	0	0	0	111.4	I276 K277 W278 V287 I307 K310 L319 V341	I276-L281 HydrophobicContact CB-CD2 3.88Å; I276-L281 HydrophobicContact CG2-CD2 3.5Å; I276-L281 HydrophobicContact CG2-CG 3.98Å; K277-L281 PolarHBondContact O-N 3.46Å; W278-L281 HydrophobicContact CE3-CD1 4.25Å; W278-L281 PolarHBondContact O-N 2.9Å; L281-V287 HydrophobicContact CD2-CG1 4.45Å; L281-I307 HydrophobicContact CB-CD1 4.07Å; L281-I307 HydrophobicContact CD2-CD1 3.74Å; L281-I307 HydrophobicContact CG-CD1 4.37Å; L281-K310 WeakPolarHBondContact O-CD 3.41Å; L281-K310 PolarHBondContact O-NZ 3.08Å; L281-L319 HydrophobicContact CD1-CD1 4.48Å; L281-L319 HydrophobicContact CD1-CD2 4.11Å; L281-V341 HydrophobicContact CD1-CG2 4.24Å; L281-V341 HydrophobicContact CD2-CB 4.19Å; L281-V341 HydrophobicContact CD2-CG1 3.69Å
282	E	94.1	Very high	93.7	Very high	139 Å²	139	52.7 Å²	52.7	65%	0.65	27%	0.274	S	S	*	.			trans	-114.2	150.2	179.9	-64	-176.2	174.6	0	0	112.3	Q285 I307	E282-Q285 HydrophobicContact CB-CB 4.48Å; E282-Q285 VanDerWaalsContact N-OE1 3.13Å; E282-Q285 WeakPolarHBondContact O-CB 3.17Å; E282-Q285 PolarHBondContact O-N 3.44Å; E282-I307 WeakPolarHBondContact O-CB 3.41Å
283	V	94.4	Very high	93.5	Very high	94 Å²	94	54.3 Å²	54.3	57%	0.57	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	134.3	174.9	177	0	0	0	0	109.2	Q285 I307 S308 K310	V283-Q285 VanDerWaalsContact C-N 3.34Å; V283-I307 HydrophobicContact CG2-CG2 4.44Å; V283-S308 WeakPolarHBondContact CG1-O 3.32Å; V283-K310 HydrophobicContact CG2-CB 4.34Å
284	G	92.3	Very high	93.4	Very high	40 Å²	40	56.8 Å²	56.8	41%	0.412	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-3.8	-171.9	0	0	0	0	0	113.9	I307	G284-I307 PolarHBondContact N-O 2.9Å
285	Q	94.8	Very high	93.2	Very high	60 Å²	60	58.5 Å²	58.5	28%	0.28	31%	0.31	S	S	.	.			trans	-77.1	133.1	177	-167.3	-179.4	11.4	0	0	110.8	E282 V283 V287 I307	E282-Q285 HydrophobicContact CB-CB 4.48Å; E282-Q285 VanDerWaalsContact N-OE1 3.13Å; E282-Q285 WeakPolarHBondContact O-CB 3.17Å; E282-Q285 PolarHBondContact O-N 3.44Å; V283-Q285 VanDerWaalsContact C-N 3.34Å; Q285-V287 HydrophobicContact CB-CG1 4.5Å; Q285-V287 HydrophobicContact CG-CG1 3.87Å; Q285-I307 HydrophobicContact CB-CD1 4.33Å; Q285-I307 PolarHBondContact O-N 3.33Å
286	V	95.8	Very high	93	Very high	88 Å²	88	57 Å²	57	53%	0.533	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.4	173.4	-170.7	0	0	0	0	109.3	A305 E306 I344	V286-A305 WeakPolarHBondContact CA-O 3.37Å; V286-E306 HydrophobicContact CG2-CB 4.48Å; V286-E306 HydrophobicContact CG2-CG 4.45Å; V286-I344 HydrophobicContact CG1-CD1 3.87Å
287	V	96.1	Very high	92.6	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.9	-174	-62.7	0	0	0	0	110.3	I276 L281 Q285 L289 D304 A305 I307 V341	I276-V287 HydrophobicContact CD1-CG1 3.69Å; L281-V287 HydrophobicContact CD2-CG1 4.45Å; Q285-V287 HydrophobicContact CB-CG1 4.5Å; Q285-V287 HydrophobicContact CG-CG1 3.87Å; V287-L289 HydrophobicContact CG2-CD2 4.03Å; V287-D304 WeakPolarHBondContact O-CA 3.12Å; V287-A305 PolarHBondContact N-O 3.24Å; V287-A305 PolarHBondContact O-N 3.43Å; V287-I307 HydrophobicContact CG1-CD1 4.22Å; V287-I307 HydrophobicContact CG2-CD1 4.06Å; V287-I307 HydrophobicContact CG2-CG1 3.99Å; V287-V341 HydrophobicContact CB-CG1 3.65Å; V287-V341 HydrophobicContact CG1-CG1 4.08Å; V287-V341 HydrophobicContact CG2-CG1 3.56Å
288	M	96.6	Very high	92.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.9	169.1	-175	-179.1	67.5	0	0	109.4	W215 R269 A272 W302 Y303 F342 I344	W215-M288 HydrophobicContact CB-SD 3.92Å; W215-M288 HydrophobicContact CG-SD 4.29Å; R269-M288 PolarHBondContact NH2-SD 3.13Å; A272-M288 HydrophobicContact CB-CE 3.33Å; M288-W302 HydrophobicContact CE-CE3 4.31Å; M288-W302 HydrophobicContact CG-CB 4.17Å; M288-W302 HydrophobicContact CG-CE3 4.44Å; M288-W302 HydrophobicContact SD-CB 3.98Å; M288-Y303 CarbonylContact C-O 3.5Å; M288-Y303 WeakPolarHBondContact CA-O 3.41Å; M288-F342 HydrophobicContact CB-CB 4.19Å; M288-F342 HydrophobicContact CE-CB 3.78Å; M288-F342 HydrophobicContact CE-CD2 4.22Å; M288-F342 HydrophobicContact CE-CG 4.01Å; M288-F342 PolarHBondContact N-O 3.48Å; M288-F342 PolarHBondContact O-N 2.78Å; M288-I344 HydrophobicContact CB-CG1 4.18Å
289	L	95.6	Very high	92	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	161.2	-176.8	57.3	74.3	0	0	0	112.5	V287 W302 Y303 A305 A321 V323 I335 V341	V287-L289 HydrophobicContact CG2-CD2 4.03Å; L289-W302 WeakPolarHBondContact O-CA 3.15Å; L289-Y303 PolarHBondContact N-O 3.19Å; L289-Y303 PolarHBondContact O-N 3.13Å; L289-A305 HydrophobicContact CD1-CB 4.03Å; L289-A305 HydrophobicContact CD2-CB 3.68Å; L289-A305 HydrophobicContact CG-CB 3.76Å; L289-A321 HydrophobicContact CD2-CB 3.95Å; L289-V323 HydrophobicContact CD1-CG2 4.32Å; L289-I335 HydrophobicContact CD1-CD1 3.62Å; L289-I335 HydrophobicContact CD1-CG1 4.26Å; L289-I335 HydrophobicContact CD1-CG2 4.37Å; L289-I335 HydrophobicContact CD2-CD1 4.05Å; L289-I335 HydrophobicContact CD2-CG1 3.83Å; L289-I335 HydrophobicContact CD2-CG2 4.26Å; L289-V341 HydrophobicContact CB-CG2 4.45Å
290	N	95.4	Very high	92	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.6	178	-168.7	-79.6	0	0	0	111.3	R299 G300 F301 W302 F337	N290-R299 WeakPolarHBondContact OD1-CG 3.3Å; N290-G300 PolarHBondContact ND2-O 3.38Å; N290-G300 PolarHBondContact OD1-N 2.86Å; N290-F301 CarbonylContact C-O 3.26Å; N290-F301 VanDerWaalsContact CA-O 3.31Å; N290-F301 WeakPolarHBondContact CA-O 3.32Å; N290-W302 HydrophobicContact CB-CD2 4.47Å; N290-W302 HydrophobicContact CB-CE3 4.2Å; N290-W302 HydrophobicContact CB-CH2 4.05Å; N290-W302 HydrophobicContact CB-CZ2 4.31Å; N290-W302 HydrophobicContact CB-CZ3 4Å; N290-F337 HydrophobicContact CB-CD2 4.2Å
291	Y	93.6	Very high	91.9	Very high	21 Å²	21	53.9 Å²	53.9	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.9	176	-170.3	-113.4	0	0	0	111.7	P293 P296 G300 F301 Y303 V323 L330 C333 I335	Y291-P293 HydrophobicContact CD1-CG 4.25Å; Y291-P293 HydrophobicContact CE1-CG 4.46Å; Y291-P296 HydrophobicContact CE2-CB 4.03Å; Y291-G300 CarbonylContact O-C 3.35Å; Y291-G300 WeakPolarHBondContact O-CA 3.23Å; Y291-F301 PolarHBondContact N-O 2.85Å; Y291-F301 PolarHBondContact O-N 3.14Å; Y291-Y303 VanDerWaalsContact O-CE2 3.29Å; Y291-Y303 WeakPolarHBondContact O-CE2 3.27Å; Y291-V323 HydrophobicContact CD1-CB 4.42Å; Y291-V323 HydrophobicContact CD1-CG1 4.21Å; Y291-V323 HydrophobicContact CD1-CG2 4.04Å; Y291-V323 HydrophobicContact CG-CG2 4.13Å; Y291-L330 HydrophobicContact CE1-CD1 4.27Å; Y291-C333 HydrophobicContact CD2-CB 4.4Å; Y291-C333 HydrophobicContact CE1-CB 4.15Å; Y291-C333 HydrophobicContact CE2-CB 3.83Å; Y291-I335 HydrophobicContact CD2-CD1 3.92Å; Y291-I335 HydrophobicContact CG-CD1 4.48Å
292	N	91.9	Very high	91.9	Very high	12 Å²	12	53.8 Å²	53.8	6%	0.064	29%	0.285	C	S	.	.			trans	-124.5	105.2	175.3	-171.9	-36.4	0	0	0	108.8	D294 N295 P296 R299	N292-D294 VanDerWaalsContact C-N 3.3Å; N292-D294 PolarHBondContact O-N 2.97Å; N292-D294 PolarHBondContact OD1-N 3.49Å; N292-D294 VanDerWaalsContact OD1-N 3.13Å; N292-N295 WeakPolarHBondContact CB-O 3.36Å; N292-N295 CarbonylContact O-C 3.55Å; N292-N295 VanDerWaalsContact O-C 3.31Å; N292-N295 PolarHBondContact O-N 2.99Å; N292-N295 PolarHBondContact OD1-N 3.35Å; N292-P296 VanDerWaalsContact O-CA 3.3Å; N292-P296 WeakPolarHBondContact O-CA 3.29Å; N292-R299 PolarHBondContact ND2-O 3.17Å
293	P	87.8	Confident	92	Very high	42 Å²	42	47.6 Å²	47.6	27%	0.273	26%	0.256	S	S	.	.	S	Bend	trans	-60.2	-36.2	-178.9	-26	35.8	0	0	0	113.8	Y291 Y303 L325 L330	Y291-P293 HydrophobicContact CD1-CG 4.25Å; Y291-P293 HydrophobicContact CE1-CG 4.46Å; P293-Y303 HydrophobicContact CG-CE2 4.44Å; P293-L325 HydrophobicContact CB-CD1 4.27Å; P293-L325 HydrophobicContact CG-CD1 4.02Å; P293-L325 HydrophobicContact CG-CD2 3.99Å; P293-L330 HydrophobicContact CB-CD1 4.19Å
294	D	86.5	Confident	92	Very high	141 Å²	141	44.3 Å²	44.3	75%	0.754	24%	0.235	S	C	*	.	S	Bend	trans	-79.1	-37.2	-178.1	-59.9	-45.8	0	0	0	112.2	N292	N292-D294 VanDerWaalsContact C-N 3.3Å; N292-D294 PolarHBondContact O-N 2.97Å; N292-D294 PolarHBondContact OD1-N 3.49Å; N292-D294 VanDerWaalsContact OD1-N 3.13Å
295	N	85.9	Confident	92.2	Very high	97 Å²	97	42.4 Å²	42.4	52%	0.519	22%	0.215	S	C	.	.			trans	-133	78.8	-178.2	-69	-80.3	0	0	0	111.7	N292 K297 E298	N292-N295 WeakPolarHBondContact CB-O 3.36Å; N292-N295 CarbonylContact O-C 3.55Å; N292-N295 VanDerWaalsContact O-C 3.31Å; N292-N295 PolarHBondContact O-N 2.99Å; N292-N295 PolarHBondContact OD1-N 3.35Å; N295-K297 PolarHBondContact O-N 2.89Å; N295-E298 HydrophobicContact CB-CB 4.25Å; N295-E298 HydrophobicContact CB-CG 4.25Å; N295-E298 PolarHBondContact O-N 2.77Å
296	P	89	Confident	92.2	Very high	59 Å²	59	43.8 Å²	43.8	38%	0.383	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.8	-171	-28.9	36.4	0	0	0	117.3	Y291 N292 I336	Y291-P296 HydrophobicContact CE2-CB 4.03Å; N292-P296 VanDerWaalsContact O-CA 3.3Å; N292-P296 WeakPolarHBondContact O-CA 3.29Å; P296-I336 WeakPolarHBondContact O-CG1 3.25Å
297	K	86.1	Confident	92.3	Very high	172 Å²	172	39.6 Å²	39.6	75%	0.748	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-15.2	177.7	-66.7	-176.7	-179.3	177.7	0	113.4	N295	N295-K297 PolarHBondContact O-N 2.89Å
298	E	86.9	Confident	92.2	Very high	66 Å²	66	41.5 Å²	41.5	31%	0.308	21%	0.21	S	C	.	.	S	Bend	trans	-102.4	164.5	-177.9	-60.7	-67.3	163.4	0	0	110	N295 K367	N295-E298 HydrophobicContact CB-CB 4.25Å; N295-E298 HydrophobicContact CB-CG 4.25Å; N295-E298 PolarHBondContact O-N 2.77Å; E298-K367 WeakPolarHBondContact OE1-CE 3.48Å; E298-K367 IonicContact OE1-NZ 3.8Å; E298-K367 PolarHBondContact OE1-NZ 2.88Å; E298-K367 IonicContact OE2-NZ 3.57Å
299	R	88.6	Confident	92.1	Very high	37 Å²	37	46.5 Å²	46.5	14%	0.14	23%	0.228	C	C	.	.			trans	-67.1	140.1	172.1	-167.6	177.3	-90.3	120.9	-0.7	109.9	N290 N292 F337 E340 K361 S365	N290-R299 WeakPolarHBondContact OD1-CG 3.3Å; N292-R299 PolarHBondContact ND2-O 3.17Å; R299-F337 VanDerWaalsContact CA-CE2 3.48Å; R299-F337 HydrophobicContact CB-CE1 4.45Å; R299-F337 HydrophobicContact CB-CE2 3.82Å; R299-F337 HydrophobicContact CB-CZ 3.58Å; R299-F337 HydrophobicContact CG-CE2 4.12Å; R299-F337 HydrophobicContact CG-CZ 4.07Å; R299-E340 IonicContact NH2-OE1 3.14Å; R299-E340 PolarHBondContact NH2-OE1 3.31Å; R299-E340 VanDerWaalsContact NH2-OE1 3.08Å; R299-E340 IonicContact NH2-OE2 2.63Å; R299-K361 WeakPolarHBondContact CD-O 3.07Å; R299-S365 PolarHBondContact NH1-OG 2.89Å
300	G	91.1	Very high	92.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.			trans	-131.6	-132.7	175.4	0	0	0	0	0	111	N290 Y291 G363	N290-G300 PolarHBondContact ND2-O 3.38Å; N290-G300 PolarHBondContact OD1-N 2.86Å; Y291-G300 CarbonylContact O-C 3.35Å; Y291-G300 WeakPolarHBondContact O-CA 3.23Å; G300-G363 PolarHBondContact O-N 2.9Å
301	F	92.9	Very high	91.9	Very high	58 Å²	58	55.8 Å²	55.8	25%	0.254	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	174.8	-176.1	-56.4	-78.3	0	0	0	111.8	M212 A214 F216 N290 Y291 Y303	M212-F301 HydrophobicContact CE-CB 3.98Å; M212-F301 HydrophobicContact CE-CD1 3.91Å; M212-F301 HydrophobicContact CE-CD2 3.32Å; M212-F301 HydrophobicContact CE-CE1 4.22Å; M212-F301 HydrophobicContact CE-CE2 3.67Å; M212-F301 HydrophobicContact CE-CG 3.46Å; M212-F301 VanDerWaalsContact CE-CG 3.46Å; M212-F301 HydrophobicContact CE-CZ 4.1Å; A214-F301 HydrophobicContact CB-CB 3.84Å; F216-F301 AromaticContact CE1-CD1 3.85Å; F216-F301 HydrophobicContact CE1-CD1 3.85Å; F216-F301 HydrophobicContact CE1-CE1 4.1Å; F216-F301 AromaticContact CZ-CD1 3.94Å; F216-F301 HydrophobicContact CZ-CD1 3.94Å; F216-F301 HydrophobicContact CZ-CE1 4.25Å; N290-F301 CarbonylContact C-O 3.26Å; N290-F301 VanDerWaalsContact CA-O 3.31Å; N290-F301 WeakPolarHBondContact CA-O 3.32Å; Y291-F301 PolarHBondContact N-O 2.85Å; Y291-F301 PolarHBondContact O-N 3.14Å; F301-Y303 HydrophobicContact CB-CE2 3.76Å; F301-Y303 WeakPolarHBondContact O-CD2 3.34Å
302	W	94.7	Very high	91.8	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.008	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120	-176.3	-61	93.9	0	0	0	110.6	A214 W215 M288 L289 N290 E340 F342 R360 K361 S362	A214-W302 CarbonylContact C-O 3.56Å; A214-W302 VanDerWaalsContact CA-O 3.24Å; A214-W302 WeakPolarHBondContact CA-O 3.15Å; W215-W302 PolarHBondContact N-O 3.49Å; M288-W302 HydrophobicContact CE-CE3 4.31Å; M288-W302 HydrophobicContact CG-CB 4.17Å; M288-W302 HydrophobicContact CG-CE3 4.44Å; M288-W302 HydrophobicContact SD-CB 3.98Å; L289-W302 WeakPolarHBondContact O-CA 3.15Å; N290-W302 HydrophobicContact CB-CD2 4.47Å; N290-W302 HydrophobicContact CB-CE3 4.2Å; N290-W302 HydrophobicContact CB-CH2 4.05Å; N290-W302 HydrophobicContact CB-CZ2 4.31Å; N290-W302 HydrophobicContact CB-CZ3 4Å; W302-E340 HydrophobicContact CH2-CB 4.11Å; W302-E340 WeakPolarHBondContact CZ3-O 3.34Å; W302-F342 HydrophobicContact CE3-CD2 4.15Å; W302-F342 HydrophobicContact CE3-CE2 4.48Å; W302-F342 HydrophobicContact CH2-CD2 4.08Å; W302-F342 AromaticContact CH2-CE2 3.7Å; W302-F342 HydrophobicContact CH2-CE2 3.7Å; W302-F342 AromaticContact CZ3-CD2 3.53Å; W302-F342 HydrophobicContact CZ3-CD2 3.53Å; W302-F342 AromaticContact CZ3-CE2 3.66Å; W302-F342 HydrophobicContact CZ3-CE2 3.66Å; W302-R360 HydrophobicContact CH2-CB 4.38Å; W302-R360 HydrophobicContact CZ2-CB 3.52Å; W302-R360 HydrophobicContact CZ2-CG 4.19Å; W302-K361 WeakPolarHBondContact CZ2-O 3.47Å; W302-S362 PolarHBondContact NE1-OG 3.31Å; W302-S362 VanDerWaalsContact NE1-OG 3.13Å
303	Y	95.4	Very high	91.8	Very high	9 Å²	9	62.4 Å²	62.4	4%	0.035	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.9	-177.7	-62.9	-81.6	0	0	0	110.7	M212 A214 M288 L289 Y291 P293 F301 V323 L325	M212-Y303 WeakPolarHBondContact O-CE1 3Å; A214-Y303 HydrophobicContact CB-CD1 4.05Å; A214-Y303 HydrophobicContact CB-CE1 3.57Å; M288-Y303 CarbonylContact C-O 3.5Å; M288-Y303 WeakPolarHBondContact CA-O 3.41Å; L289-Y303 PolarHBondContact N-O 3.19Å; L289-Y303 PolarHBondContact O-N 3.13Å; Y291-Y303 VanDerWaalsContact O-CE2 3.29Å; Y291-Y303 WeakPolarHBondContact O-CE2 3.27Å; P293-Y303 HydrophobicContact CG-CE2 4.44Å; F301-Y303 HydrophobicContact CB-CE2 3.76Å; F301-Y303 WeakPolarHBondContact O-CD2 3.34Å; Y303-V323 VanDerWaalsContact CB-CG1 3.49Å; Y303-V323 HydrophobicContact CD1-CG1 4.37Å; Y303-V323 HydrophobicContact CD2-CG1 4.19Å; Y303-V323 HydrophobicContact CG-CG1 3.77Å; Y303-L325 HydrophobicContact CD1-CD2 3.51Å; Y303-L325 HydrophobicContact CE1-CD2 3.25Å; Y303-L325 HydrophobicContact CE2-CD2 4.43Å; Y303-L325 HydrophobicContact CG-CD2 4.21Å
304	D	95.5	Very high	91.7	Very high	25 Å²	25	71.8 Å²	71.8	13%	0.134	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.7	164.8	-68.5	-19.7	0	0	0	109.1	W215 R269 V287 V324 I344	W215-D304 PolarHBondContact NE1-OD1 2.91Å; W215-D304 PolarHBondContact NE1-OD2 3.44Å; R269-D304 IonicContact CZ-OD1 3.84Å; R269-D304 VanDerWaalsContact CZ-OD1 3.31Å; R269-D304 IonicContact NH1-OD1 2.77Å; R269-D304 PolarHBondContact NH1-OD1 3.28Å; R269-D304 IonicContact NH1-OD2 3.44Å; R269-D304 PolarHBondContact NH1-OD2 3.49Å; R269-D304 IonicContact NH2-OD1 3.08Å; R269-D304 PolarHBondContact NH2-OD1 2.81Å; V287-D304 WeakPolarHBondContact O-CA 3.12Å; D304-V324 PolarHBondContact O-N 2.98Å; D304-I344 HydrophobicContact CB-CD1 4.37Å; D304-I344 WeakPolarHBondContact OD1-CD1 3.44Å
305	A	95.8	Very high	91.7	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	143.6	-179	0	0	0	0	0	111.7	V286 V287 L289 A321 N322 V323	V286-A305 WeakPolarHBondContact CA-O 3.37Å; V287-A305 PolarHBondContact N-O 3.24Å; V287-A305 PolarHBondContact O-N 3.43Å; L289-A305 HydrophobicContact CD1-CB 4.03Å; L289-A305 HydrophobicContact CD2-CB 3.68Å; L289-A305 HydrophobicContact CG-CB 3.76Å; A305-A321 HydrophobicContact CB-CB 3.82Å; A305-N322 CarbonylContact C-O 3.52Å; A305-N322 WeakPolarHBondContact CA-O 3.06Å; A305-N322 WeakPolarHBondContact CB-O 2.92Å; A305-V323 HydrophobicContact CB-CB 4.49Å; A305-V323 HydrophobicContact CB-CG2 4.06Å
306	E	96.1	Very high	91.8	Very high	90 Å²	90	67.5 Å²	67.5	42%	0.421	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.2	172.5	-173.1	-171.1	176.6	0	0	109.8	V286 S308 A321 N322	V286-E306 HydrophobicContact CG2-CB 4.48Å; V286-E306 HydrophobicContact CG2-CG 4.45Å; E306-S308 PolarHBondContact O-N 3.32Å; E306-A321 CarbonylContact O-C 3.57Å; E306-A321 WeakPolarHBondContact O-CA 3.19Å; E306-A321 WeakPolarHBondContact O-CB 3.04Å; E306-N322 PolarHBondContact N-O 2.78Å; E306-N322 PolarHBondContact O-N 3.24Å
307	I	96.3	Very high	91.9	Very high	0 Å²	0	69 Å²	69	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	116.3	-179.8	-61.8	175.7	0	0	0	109.5	L281 E282 V283 G284 Q285 V287 L319	L281-I307 HydrophobicContact CB-CD1 4.07Å; L281-I307 HydrophobicContact CD2-CD1 3.74Å; L281-I307 HydrophobicContact CG-CD1 4.37Å; E282-I307 WeakPolarHBondContact O-CB 3.41Å; V283-I307 HydrophobicContact CG2-CG2 4.44Å; G284-I307 PolarHBondContact N-O 2.9Å; Q285-I307 HydrophobicContact CB-CD1 4.33Å; Q285-I307 PolarHBondContact O-N 3.33Å; V287-I307 HydrophobicContact CG1-CD1 4.22Å; V287-I307 HydrophobicContact CG2-CD1 4.06Å; V287-I307 HydrophobicContact CG2-CG1 3.99Å; I307-L319 HydrophobicContact CD1-CD1 4.41Å; I307-L319 HydrophobicContact CG1-CD1 4.46Å; I307-L319 HydrophobicContact CG2-CD1 3.73Å
308	S	94.9	Very high	92.3	Very high	39 Å²	39	62.4 Å²	62.4	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-35.1	-176.7	63.4	0	0	0	0	112.7	V283 E306 Y320	V283-S308 WeakPolarHBondContact CG1-O 3.32Å; E306-S308 PolarHBondContact O-N 3.32Å; S308-Y320 PolarHBondContact N-O 3.09Å; S308-Y320 PolarHBondContact OG-O 3.36Å
309	R	94.4	Very high	92.7	Very high	105 Å²	105	59.3 Å²	59.3	40%	0.396	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	133.3	-179.3	177.4	176.9	65.7	-138.7	-6.9	111.6	Y320 D332	R309-Y320 HydrophobicContact CB-CD2 4.25Å; R309-Y320 HydrophobicContact CB-CG 4.47Å; R309-Y320 HydrophobicContact CG-CD2 4.25Å; R309-Y320 PolarHBondContact N-O 3.49Å; R309-Y320 VanDerWaalsContact N-O 3.13Å; R309-Y320 PolarHBondContact O-N 3.35Å; R309-D332 IonicContact CZ-OD1 3.41Å; R309-D332 IonicContact CZ-OD2 2.92Å; R309-D332 IonicContact NH1-OD1 3.02Å; R309-D332 IonicContact NH1-OD2 2.63Å; R309-D332 IonicContact NH2-OD1 3.94Å; R309-D332 PolarHBondContact NH2-OD1 2.82Å; R309-D332 IonicContact NH2-OD2 2.81Å; R309-D332 PolarHBondContact NH2-OD2 2.99Å; R309-D332 VanDerWaalsContact NH2-OD2 3.14Å
310	K	94.4	Very high	93	Very high	66 Å²	66	59.3 Å²	59.3	29%	0.287	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.2	174.2	-174.2	-176.2	179	-176.5	0	109	W278 L281 V283 L319	W278-K310 HydrophobicContact CH2-CD 4.42Å; W278-K310 HydrophobicContact CH2-CG 3.56Å; W278-K310 HydrophobicContact CZ2-CD 4.26Å; W278-K310 HydrophobicContact CZ2-CG 3.66Å; W278-K310 HydrophobicContact CZ3-CG 4.23Å; W278-K310 WeakPolarHBondContact O-CE 3.3Å; W278-K310 PolarHBondContact O-NZ 2.81Å; L281-K310 WeakPolarHBondContact O-CD 3.41Å; L281-K310 PolarHBondContact O-NZ 3.08Å; V283-K310 HydrophobicContact CG2-CB 4.34Å; K310-L319 HydrophobicContact CB-CD1 4.45Å
311	R	91.8	Very high	93.3	Very high	130 Å²	130	59.3 Å²	59.3	49%	0.491	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.9	178.9	178.9	171.2	178.1	-101.2	0.5	110.5	E318	R311-E318 HydrophobicContact CB-CB 4.23Å; R311-E318 WeakPolarHBondContact CD-OE2 3.31Å; R311-E318 IonicContact CZ-OE2 3.67Å; R311-E318 PolarHBondContact N-O 3.05Å; R311-E318 IonicContact NH1-OE1 3.6Å; R311-E318 PolarHBondContact NH1-OE1 2.81Å; R311-E318 IonicContact NH1-OE2 3.86Å; R311-E318 PolarHBondContact NH1-OE2 2.96Å; R311-E318 PolarHBondContact O-N 2.55Å
312	E	92.8	Very high	93.4	Very high	126 Å²	126	58.3 Å²	58.3	59%	0.589	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	133	178.4	-167.7	162.8	-174.1	0	0	110.2	W278 R317	W278-E312 HydrophobicContact CZ2-CB 4.13Å; W278-E312 PolarHBondContact NE1-OE2 3.32Å; E312-R317 HydrophobicContact CG-CG 4.29Å
313	T	90.1	Very high	93.4	Very high	47 Å²	47	58.2 Å²	58.2	29%	0.288	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	167.3	174.3	66.9	0	0	0	0	108.9	T315 A316	T313-T315 PolarHBondContact O-N 3.09Å; T313-A316 PolarHBondContact N-O 2.92Å; T313-A316 PolarHBondContact O-N 3.08Å; T313-A316 PolarHBondContact OG1-N 3.39Å; T313-A316 PolarHBondContact OG1-O 3.22Å
314	R	86.9	Confident	93.1	Very high	239 Å²	239	60.3 Å²	60.3	90%	0.902	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-25.7	177.8	-165	-173.1	70.6	87.1	0.2	113.8
315	T	85.3	Confident	92.7	Very high	116 Å²	116	61.1 Å²	61.1	71%	0.712	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-11.3	-172.9	50.9	0	0	0	0	114.4	T313	T313-T315 PolarHBondContact O-N 3.09Å
316	A	88.1	Confident	91.8	Very high	32 Å²	32	62.3 Å²	62.3	26%	0.264	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	140	-173.4	0	0	0	0	0	112.8	T313 E318	T313-A316 PolarHBondContact N-O 2.92Å; T313-A316 PolarHBondContact O-N 3.08Å; T313-A316 PolarHBondContact OG1-N 3.39Å; T313-A316 PolarHBondContact OG1-O 3.22Å; A316-E318 HydrophobicContact CB-CG 4.5Å
317	R	93	Very high	90.7	Very high	90 Å²	90	66.2 Å²	66.2	34%	0.34	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.9	165	-69.4	177.5	-67.5	159.2	5.2	107.7	W278 E312 V338 D339	W278-R317 HydrophobicContact CD2-CB 4.28Å; W278-R317 HydrophobicContact CD2-CG 4.13Å; W278-R317 HydrophobicContact CE3-CB 4.17Å; W278-R317 HydrophobicContact CH2-CB 3.75Å; W278-R317 HydrophobicContact CH2-CG 4.34Å; W278-R317 HydrophobicContact CZ2-CB 3.87Å; W278-R317 HydrophobicContact CZ2-CG 3.95Å; W278-R317 HydrophobicContact CZ3-CB 3.9Å; E312-R317 HydrophobicContact CG-CG 4.29Å; R317-V338 HydrophobicContact CB-CG2 4.33Å; R317-D339 IonicContact CZ-OD1 3.68Å; R317-D339 VanDerWaalsContact CZ-OD1 3.29Å; R317-D339 IonicContact CZ-OD2 2.85Å; R317-D339 IonicContact NH1-OD1 3.54Å; R317-D339 PolarHBondContact NH1-OD1 3.42Å; R317-D339 IonicContact NH1-OD2 3.94Å; R317-D339 VanDerWaalsContact NH2-CG 3.33Å; R317-D339 IonicContact NH2-OD1 3.41Å; R317-D339 PolarHBondContact NH2-OD1 3.29Å; R317-D339 IonicContact NH2-OD2 3.85Å; R317-D339 PolarHBondContact NH2-OD2 3Å
318	E	93.5	Very high	89.8	Confident	34 Å²	34	72.4 Å²	72.4	16%	0.159	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.5	-177.6	-65.1	173.2	173.4	0	0	109	R311 A316 Y320	R311-E318 HydrophobicContact CB-CB 4.23Å; R311-E318 WeakPolarHBondContact CD-OE2 3.31Å; R311-E318 IonicContact CZ-OE2 3.67Å; R311-E318 PolarHBondContact N-O 3.05Å; R311-E318 IonicContact NH1-OE1 3.6Å; R311-E318 PolarHBondContact NH1-OE1 2.81Å; R311-E318 IonicContact NH1-OE2 3.86Å; R311-E318 PolarHBondContact NH1-OE2 2.96Å; R311-E318 PolarHBondContact O-N 2.55Å; A316-E318 HydrophobicContact CB-CG 4.5Å; E318-Y320 HydrophobicContact CB-CE2 3.92Å
319	L	95.1	Very high	89.3	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.1	173.9	-169.8	64.9	0	0	0	109.1	W278 L281 I307 K310 I335 V338 V341	W278-L319 HydrophobicContact CZ3-CB 4.11Å; W278-L319 HydrophobicContact CZ3-CD1 4.4Å; L281-L319 HydrophobicContact CD1-CD1 4.48Å; L281-L319 HydrophobicContact CD1-CD2 4.11Å; I307-L319 HydrophobicContact CD1-CD1 4.41Å; I307-L319 HydrophobicContact CG1-CD1 4.46Å; I307-L319 HydrophobicContact CG2-CD1 3.73Å; K310-L319 HydrophobicContact CB-CD1 4.45Å; L319-I335 HydrophobicContact CB-CB 4.16Å; L319-I335 HydrophobicContact CD2-CB 4.2Å; L319-I335 HydrophobicContact CD2-CG1 4.42Å; L319-I335 HydrophobicContact CD2-CG2 4.36Å; L319-I335 HydrophobicContact CG-CB 4.35Å; L319-I335 HydrophobicContact CG-CG1 4.4Å; L319-I335 PolarHBondContact O-N 3.28Å; L319-V338 HydrophobicContact CB-CG1 3.8Å; L319-V341 HydrophobicContact CD2-CG2 4.12Å
320	Y	95.9	Very high	89.1	Confident	38 Å²	38	72 Å²	72	15%	0.149	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.3	172.3	-61.8	-97.5	0	0	0	108.8	S308 R309 E318 D332 C333 R334	S308-Y320 PolarHBondContact N-O 3.09Å; S308-Y320 PolarHBondContact OG-O 3.36Å; R309-Y320 HydrophobicContact CB-CD2 4.25Å; R309-Y320 HydrophobicContact CB-CG 4.47Å; R309-Y320 HydrophobicContact CG-CD2 4.25Å; R309-Y320 PolarHBondContact N-O 3.49Å; R309-Y320 VanDerWaalsContact N-O 3.13Å; R309-Y320 PolarHBondContact O-N 3.35Å; E318-Y320 HydrophobicContact CB-CE2 3.92Å; Y320-D332 WeakPolarHBondContact CD1-OD1 3.38Å; Y320-C333 VanDerWaalsContact CA-O 3.23Å; Y320-C333 WeakPolarHBondContact CA-O 3.12Å; Y320-R334 HydrophobicContact CD1-CB 4.11Å; Y320-R334 HydrophobicContact CE1-CB 3.83Å; Y320-R334 HydrophobicContact CE1-CG 4.14Å
321	A	95.8	Very high	89	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156	179.9	0	0	0	0	0	111.1	L289 A305 E306 C333 I335	L289-A321 HydrophobicContact CD2-CB 3.95Å; A305-A321 HydrophobicContact CB-CB 3.82Å; E306-A321 CarbonylContact O-C 3.57Å; E306-A321 WeakPolarHBondContact O-CA 3.19Å; E306-A321 WeakPolarHBondContact O-CB 3.04Å; A321-C333 PolarHBondContact N-O 2.98Å; A321-C333 VanDerWaalsContact O-CB 3.32Å; A321-C333 WeakPolarHBondContact O-CB 3.48Å; A321-C333 PolarHBondContact O-N 3.06Å; A321-I335 HydrophobicContact CB-CD1 4.3Å; A321-I335 HydrophobicContact CB-CG1 4.07Å
322	N	95.1	Very high	88.9	Confident	37 Å²	37	71.9 Å²	71.9	20%	0.198	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.3	171.4	-56.1	-29.7	0	0	0	107.4	A305 E306 L330 N331 D332	A305-N322 CarbonylContact C-O 3.52Å; A305-N322 WeakPolarHBondContact CA-O 3.06Å; A305-N322 WeakPolarHBondContact CB-O 2.92Å; E306-N322 PolarHBondContact N-O 2.78Å; E306-N322 PolarHBondContact O-N 3.24Å; N322-L330 CarbonylContact C-O 3.48Å; N322-L330 VanDerWaalsContact CA-O 3.32Å; N322-L330 WeakPolarHBondContact CA-O 3.1Å; N322-N331 WeakPolarHBondContact OD1-CA 3.43Å; N322-D332 PolarHBondContact OD1-N 3.11Å; N322-D332 VanDerWaalsContact OD1-N 3.11Å
323	V	94.4	Very high	88.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	128.4	-173.7	179.7	0	0	0	0	109.6	L289 Y291 Y303 A305 L325 S329 L330 C333 I335	L289-V323 HydrophobicContact CD1-CG2 4.32Å; Y291-V323 HydrophobicContact CD1-CB 4.42Å; Y291-V323 HydrophobicContact CD1-CG1 4.21Å; Y291-V323 HydrophobicContact CD1-CG2 4.04Å; Y291-V323 HydrophobicContact CG-CG2 4.13Å; Y303-V323 VanDerWaalsContact CB-CG1 3.49Å; Y303-V323 HydrophobicContact CD1-CG1 4.37Å; Y303-V323 HydrophobicContact CD2-CG1 4.19Å; Y303-V323 HydrophobicContact CG-CG1 3.77Å; A305-V323 HydrophobicContact CB-CB 4.49Å; A305-V323 HydrophobicContact CB-CG2 4.06Å; V323-L325 HydrophobicContact CG1-CD2 4.13Å; V323-S329 CarbonylContact O-C 3.39Å; V323-S329 WeakPolarHBondContact O-CA 3.45Å; V323-L330 HydrophobicContact CB-CB 4.49Å; V323-L330 PolarHBondContact N-O 3.11Å; V323-L330 PolarHBondContact O-N 2.65Å; V323-C333 HydrophobicContact CG2-CB 3.77Å; V323-I335 HydrophobicContact CG2-CD1 4.26Å
324	V	90.6	Very high	89.1	Confident	52 Å²	52	69.3 Å²	69.3	32%	0.315	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	121.7	179.6	-174.6	0	0	0	0	109.6	D304	D304-V324 PolarHBondContact O-N 2.98Å
325	L	85.9	Confident	89.5	Confident	42 Å²	42	58 Å²	58	22%	0.22	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	90.1	178.1	-62.7	-173.6	0	0	0	109.2	P293 Y303 V323 D327 D328 L330	P293-L325 HydrophobicContact CB-CD1 4.27Å; P293-L325 HydrophobicContact CG-CD1 4.02Å; P293-L325 HydrophobicContact CG-CD2 3.99Å; Y303-L325 HydrophobicContact CD1-CD2 3.51Å; Y303-L325 HydrophobicContact CE1-CD2 3.25Å; Y303-L325 HydrophobicContact CE2-CD2 4.43Å; Y303-L325 HydrophobicContact CG-CD2 4.21Å; V323-L325 HydrophobicContact CG1-CD2 4.13Å; L325-D327 PolarHBondContact O-N 3.1Å; L325-D327 VanDerWaalsContact O-N 3.08Å; L325-D328 CarbonylContact C-O 3.57Å; L325-D328 PolarHBondContact N-O 3.26Å; L325-D328 PolarHBondContact O-N 2.93Å; L325-D328 VanDerWaalsContact O-O 3.13Å; L325-L330 HydrophobicContact CD1-CD1 3.35Å; L325-L330 HydrophobicContact CD1-CG 3.79Å; L325-L330 HydrophobicContact CG-CD1 4.2Å; L325-L330 HydrophobicContact CG-CG 4.43Å
326	G	78.3	Confident	89.8	Confident	25 Å²	25	55.4 Å²	55.4	26%	0.258	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-114.1	-177.9	0	0	0	0	0	110.9
327	D	72.7	Confident	90	Very high	173 Å²	173	55.7 Å²	55.7	93%	0.925	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-15.4	-179.9	-62	-24.6	0	0	0	113.9	L325	L325-D327 PolarHBondContact O-N 3.1Å; L325-D327 VanDerWaalsContact O-N 3.08Å
328	D	76.2	Confident	90	Very high	129 Å²	129	51.9 Å²	51.9	69%	0.69	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	158.9	-177.4	-80.8	-32.7	0	0	0	111.7	L325	L325-D328 CarbonylContact C-O 3.57Å; L325-D328 PolarHBondContact N-O 3.26Å; L325-D328 PolarHBondContact O-N 2.93Å; L325-D328 VanDerWaalsContact O-O 3.13Å
329	S	85.3	Confident	89.9	Confident	67 Å²	67	54.6 Å²	54.6	47%	0.469	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.1	176.2	-64	0	0	0	0	111.8	V323	V323-S329 CarbonylContact O-C 3.39Å; V323-S329 WeakPolarHBondContact O-CA 3.45Å
330	L	89.6	Confident	89.8	Confident	69 Å²	69	56.9 Å²	56.9	36%	0.361	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	107	172.8	-76.4	176.8	0	0	0	110.7	Y291 P293 N322 V323 L325 C333	Y291-L330 HydrophobicContact CE1-CD1 4.27Å; P293-L330 HydrophobicContact CB-CD1 4.19Å; N322-L330 CarbonylContact C-O 3.48Å; N322-L330 VanDerWaalsContact CA-O 3.32Å; N322-L330 WeakPolarHBondContact CA-O 3.1Å; V323-L330 HydrophobicContact CB-CB 4.49Å; V323-L330 PolarHBondContact N-O 3.11Å; V323-L330 PolarHBondContact O-N 2.65Å; L325-L330 HydrophobicContact CD1-CD1 3.35Å; L325-L330 HydrophobicContact CD1-CG 3.79Å; L325-L330 HydrophobicContact CG-CD1 4.2Å; L325-L330 HydrophobicContact CG-CG 4.43Å; L330-C333 VanDerWaalsContact CB-SG 3.51Å; L330-C333 PolarHBondContact O-SG 3.03Å
331	N	91.7	Very high	89.7	Confident	115 Å²	115	55.1 Å²	55.1	62%	0.615	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	151.1	-177.1	-58.6	-42.6	0	0	0	113	N322 C333	N322-N331 WeakPolarHBondContact OD1-CA 3.43Å; N331-C333 VanDerWaalsContact C-N 3.32Å; N331-C333 PolarHBondContact O-N 3.01Å
332	D	90.4	Very high	89.7	Confident	79 Å²	79	56.1 Å²	56.1	42%	0.422	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.2	36.4	176.3	-154.2	36.3	0	0	0	114.8	R309 Y320 N322 R334	R309-D332 IonicContact CZ-OD1 3.41Å; R309-D332 IonicContact CZ-OD2 2.92Å; R309-D332 IonicContact NH1-OD1 3.02Å; R309-D332 IonicContact NH1-OD2 2.63Å; R309-D332 IonicContact NH2-OD1 3.94Å; R309-D332 PolarHBondContact NH2-OD1 2.82Å; R309-D332 IonicContact NH2-OD2 2.81Å; R309-D332 PolarHBondContact NH2-OD2 2.99Å; R309-D332 VanDerWaalsContact NH2-OD2 3.14Å; Y320-D332 WeakPolarHBondContact CD1-OD1 3.38Å; N322-D332 PolarHBondContact OD1-N 3.11Å; N322-D332 VanDerWaalsContact OD1-N 3.11Å; D332-R334 PolarHBondContact O-N 3.15Å
333	C	92.5	Very high	89.7	Confident	9 Å²	9	57.9 Å²	57.9	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.7	176.8	-67.7	0	0	0	0	111.2	Y291 Y320 A321 V323 L330 N331 I335	Y291-C333 HydrophobicContact CD2-CB 4.4Å; Y291-C333 HydrophobicContact CE1-CB 4.15Å; Y291-C333 HydrophobicContact CE2-CB 3.83Å; Y320-C333 VanDerWaalsContact CA-O 3.23Å; Y320-C333 WeakPolarHBondContact CA-O 3.12Å; A321-C333 PolarHBondContact N-O 2.98Å; A321-C333 VanDerWaalsContact O-CB 3.32Å; A321-C333 WeakPolarHBondContact O-CB 3.48Å; A321-C333 PolarHBondContact O-N 3.06Å; V323-C333 HydrophobicContact CG2-CB 3.77Å; L330-C333 VanDerWaalsContact CB-SG 3.51Å; L330-C333 PolarHBondContact O-SG 3.03Å; N331-C333 VanDerWaalsContact C-N 3.32Å; N331-C333 PolarHBondContact O-N 3.01Å; C333-I335 HydrophobicContact CB-CD1 4.24Å; C333-I335 PolarHBondContact O-N 2.76Å
334	R	94.7	Very high	89.6	Confident	109 Å²	109	59.9 Å²	59.9	41%	0.411	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	114.3	176.1	-175.8	175.8	-177.7	-88	-2.6	110.7	Y320 D332	Y320-R334 HydrophobicContact CD1-CB 4.11Å; Y320-R334 HydrophobicContact CE1-CB 3.83Å; Y320-R334 HydrophobicContact CE1-CG 4.14Å; D332-R334 PolarHBondContact O-N 3.15Å
335	I	94.8	Very high	89.6	Confident	3 Å²	3	58 Å²	58	2%	0.015	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.3	-177.6	-48.3	-52.9	0	0	0	110.1	L289 Y291 L319 A321 V323 C333	L289-I335 HydrophobicContact CD1-CD1 3.62Å; L289-I335 HydrophobicContact CD1-CG1 4.26Å; L289-I335 HydrophobicContact CD1-CG2 4.37Å; L289-I335 HydrophobicContact CD2-CD1 4.05Å; L289-I335 HydrophobicContact CD2-CG1 3.83Å; L289-I335 HydrophobicContact CD2-CG2 4.26Å; Y291-I335 HydrophobicContact CD2-CD1 3.92Å; Y291-I335 HydrophobicContact CG-CD1 4.48Å; L319-I335 HydrophobicContact CB-CB 4.16Å; L319-I335 HydrophobicContact CD2-CB 4.2Å; L319-I335 HydrophobicContact CD2-CG1 4.42Å; L319-I335 HydrophobicContact CD2-CG2 4.36Å; L319-I335 HydrophobicContact CG-CB 4.35Å; L319-I335 HydrophobicContact CG-CG1 4.4Å; L319-I335 PolarHBondContact O-N 3.28Å; A321-I335 HydrophobicContact CB-CD1 4.3Å; A321-I335 HydrophobicContact CB-CG1 4.07Å; V323-I335 HydrophobicContact CG2-CD1 4.26Å; C333-I335 HydrophobicContact CB-CD1 4.24Å; C333-I335 PolarHBondContact O-N 2.76Å
336	I	93	Very high	89.4	Confident	61 Å²	61	63.7 Å²	63.7	31%	0.313	32%	0.323	S	S	.	.	S	Bend	trans	-85.3	-42.8	-178.1	-55.9	-59.2	0	0	0	111.4	P296 V338	P296-I336 WeakPolarHBondContact O-CG1 3.25Å; I336-V338 VanDerWaalsContact C-N 3.31Å; I336-V338 PolarHBondContact O-N 2.96Å; I336-V338 VanDerWaalsContact O-N 3.08Å
337	F	92.3	Very high	89.5	Confident	38 Å²	38	66.6 Å²	66.6	17%	0.167	34%	0.337	C	S	.	.			trans	-89.2	64.5	-173.6	-56.4	-81.2	0	0	0	111.4	N290 R299 D339 E340	N290-F337 HydrophobicContact CB-CD2 4.2Å; R299-F337 VanDerWaalsContact CA-CE2 3.48Å; R299-F337 HydrophobicContact CB-CE1 4.45Å; R299-F337 HydrophobicContact CB-CE2 3.82Å; R299-F337 HydrophobicContact CB-CZ 3.58Å; R299-F337 HydrophobicContact CG-CE2 4.12Å; R299-F337 HydrophobicContact CG-CZ 4.07Å; F337-D339 PolarHBondContact O-N 3.16Å; F337-E340 HydrophobicContact CB-CB 4.17Å; F337-E340 HydrophobicContact CB-CG 4.47Å; F337-E340 PolarHBondContact O-N 3.45Å; F337-E340 VanDerWaalsContact O-N 3.12Å
338	V	92.3	Very high	89.3	Confident	10 Å²	10	62 Å²	62	6%	0.061	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.3	-176.1	-59.4	0	0	0	0	114.5	W278 R317 L319 I336	W278-V338 HydrophobicContact CE3-CB 4.16Å; W278-V338 HydrophobicContact CZ3-CB 4.23Å; W278-V338 HydrophobicContact CZ3-CG1 4.2Å; R317-V338 HydrophobicContact CB-CG2 4.33Å; L319-V338 HydrophobicContact CB-CG1 3.8Å; I336-V338 VanDerWaalsContact C-N 3.31Å; I336-V338 PolarHBondContact O-N 2.96Å; I336-V338 VanDerWaalsContact O-N 3.08Å
339	D	91.2	Very high	88.9	Confident	91 Å²	91	60.9 Å²	60.9	49%	0.487	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-3.7	177.8	-62.2	-47.1	0	0	0	112.6	I275 R317 F337	I275-D339 WeakPolarHBondContact CG2-O 3.4Å; R317-D339 IonicContact CZ-OD1 3.68Å; R317-D339 VanDerWaalsContact CZ-OD1 3.29Å; R317-D339 IonicContact CZ-OD2 2.85Å; R317-D339 IonicContact NH1-OD1 3.54Å; R317-D339 PolarHBondContact NH1-OD1 3.42Å; R317-D339 IonicContact NH1-OD2 3.94Å; R317-D339 VanDerWaalsContact NH2-CG 3.33Å; R317-D339 IonicContact NH2-OD1 3.41Å; R317-D339 PolarHBondContact NH2-OD1 3.29Å; R317-D339 IonicContact NH2-OD2 3.85Å; R317-D339 PolarHBondContact NH2-OD2 3Å; F337-D339 PolarHBondContact O-N 3.16Å
340	E	92.7	Very high	88	Confident	48 Å²	48	61.1 Å²	61.1	22%	0.224	33%	0.334	C	S	.	.			trans	-118.2	45.8	-178.5	-58	179	-154.6	0	0	110.2	R299 W302 F337	R299-E340 IonicContact NH2-OE1 3.14Å; R299-E340 PolarHBondContact NH2-OE1 3.31Å; R299-E340 VanDerWaalsContact NH2-OE1 3.08Å; R299-E340 IonicContact NH2-OE2 2.63Å; W302-E340 HydrophobicContact CH2-CB 4.11Å; W302-E340 WeakPolarHBondContact CZ3-O 3.34Å; F337-E340 HydrophobicContact CB-CB 4.17Å; F337-E340 HydrophobicContact CB-CG 4.47Å; F337-E340 PolarHBondContact O-N 3.45Å; F337-E340 VanDerWaalsContact O-N 3.12Å
341	V	95.2	Very high	87.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-98.7	121.6	176.6	-177.8	0	0	0	0	109.3	I275 I276 L281 V287 L289 L319	I275-V341 CarbonylContact C-O 3.41Å; I275-V341 WeakPolarHBondContact CA-O 3.49Å; I276-V341 PolarHBondContact N-O 2.76Å; L281-V341 HydrophobicContact CD1-CG2 4.24Å; L281-V341 HydrophobicContact CD2-CB 4.19Å; L281-V341 HydrophobicContact CD2-CG1 3.69Å; V287-V341 HydrophobicContact CB-CG1 3.65Å; V287-V341 HydrophobicContact CG1-CG1 4.08Å; V287-V341 HydrophobicContact CG2-CG1 3.56Å; L289-V341 HydrophobicContact CB-CG2 4.45Å; L319-V341 HydrophobicContact CD2-CG2 4.12Å
342	F	95.2	Very high	86.4	Confident	21 Å²	21	59.7 Å²	59.7	9%	0.092	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-98.9	142.6	-177.3	-78.3	-91	0	0	0	112.3	A272 T274 I275 M288 W302 R360	A272-F342 HydrophobicContact CB-CB 4.11Å; A272-F342 HydrophobicContact CB-CD1 3.83Å; A272-F342 HydrophobicContact CB-CG 4.14Å; T274-F342 WeakPolarHBondContact O-CA 3.35Å; I275-F342 HydrophobicContact CD1-CE1 4.45Å; I275-F342 HydrophobicContact CD1-CZ 4.15Å; I275-F342 HydrophobicContact CG1-CD1 4.13Å; I275-F342 HydrophobicContact CG1-CE1 3.71Å; I275-F342 HydrophobicContact CG1-CE2 4.29Å; I275-F342 HydrophobicContact CG1-CZ 3.8Å; M288-F342 HydrophobicContact CB-CB 4.19Å; M288-F342 HydrophobicContact CE-CB 3.78Å; M288-F342 HydrophobicContact CE-CD2 4.22Å; M288-F342 HydrophobicContact CE-CG 4.01Å; M288-F342 PolarHBondContact N-O 3.48Å; M288-F342 PolarHBondContact O-N 2.78Å; W302-F342 HydrophobicContact CE3-CD2 4.15Å; W302-F342 HydrophobicContact CE3-CE2 4.48Å; W302-F342 HydrophobicContact CH2-CD2 4.08Å; W302-F342 AromaticContact CH2-CE2 3.7Å; W302-F342 HydrophobicContact CH2-CE2 3.7Å; W302-F342 AromaticContact CZ3-CD2 3.53Å; W302-F342 HydrophobicContact CZ3-CD2 3.53Å; W302-F342 AromaticContact CZ3-CE2 3.66Å; W302-F342 HydrophobicContact CZ3-CE2 3.66Å; F342-R360 HydrophobicContact CE2-CG 4.08Å; F342-R360 HydrophobicContact CZ-CG 3.95Å
343	K	94.3	Very high	85.7	Confident	74 Å²	74	57 Å²	57	32%	0.322	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-68.4	134.7	164.1	-174.7	-165	167	-143.8	0	109.1	T274 I276 E345	T274-K343 HydrophobicContact CG2-CB 4.49Å; T274-K343 PolarHBondContact O-N 2.82Å; I276-K343 HydrophobicContact CD1-CB 3.94Å; I276-K343 HydrophobicContact CG1-CB 3.96Å; K343-E345 IonicContact NZ-OE2 2.67Å; K343-E345 PolarHBondContact NZ-OE2 2.84Å; K343-E345 PolarHBondContact O-N 3.43Å
344	I	93.6	Very high	84.8	Confident	42 Å²	42	61.2 Å²	61.2	22%	0.215	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-76.5	118.8	168.6	-62.2	175.6	0	0	0	108	V286 M288 D304	V286-I344 HydrophobicContact CG1-CD1 3.87Å; M288-I344 HydrophobicContact CB-CG1 4.18Å; D304-I344 HydrophobicContact CB-CD1 4.37Å; D304-I344 WeakPolarHBondContact OD1-CD1 3.44Å
345	E	90.1	Very high	83.8	Confident	14 Å²	14	62.2 Å²	62.2	7%	0.065	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-75.8	130.4	177.9	-58.5	-57.5	167	0	0	110.1	A270 T274 K343	A270-E345 HydrophobicContact CB-CB 4.12Å; T274-E345 PolarHBondContact OG1-OE1 3.32Å; K343-E345 IonicContact NZ-OE2 2.67Å; K343-E345 PolarHBondContact NZ-OE2 2.84Å; K343-E345 PolarHBondContact O-N 3.43Å
346	R	82.2	Confident	82.8	Confident	161 Å²	161	67.5 Å²	67.5	61%	0.608	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-84.3	143.1	-178	-68.5	-178.4	174	-164.3	-1.7	110.2	G348 E349	R346-G348 PolarHBondContact O-N 2.91Å; R346-E349 HydrophobicContact CB-CB 4.21Å; R346-E349 HydrophobicContact CB-CG 4.24Å; R346-E349 WeakPolarHBondContact CD-OE2 3.46Å; R346-E349 PolarHBondContact O-N 2.93Å; R346-E349 VanDerWaalsContact O-N 3.16Å
347	P	80.1	Confident	82.1	Confident	85 Å²	85	65.7 Å²	65.7	55%	0.552	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	127.3	174.7	-24.7	33.9	0	0	0	111.7	L198 E349	L198-P347 HydrophobicContact CD1-CB 4.27Å; P347-E349 VanDerWaalsContact C-N 3.3Å; P347-E349 PolarHBondContact O-N 2.84Å
348	G	68.8	Low	81.2	Confident	76 Å²	76	72.7 Å²	72.7	78%	0.784	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-8.1	178.8	0	0	0	0	0	116.3	R346	R346-G348 PolarHBondContact O-N 2.91Å
349	E	67.1	Low	80.7	Confident	107 Å²	107	78.9 Å²	78.9	50%	0.5	44%	0.439	S	S	.	.	S	Bend	trans	-99.5	118.3	175.7	-68	179.4	-165.5	0	0	110.7	R346 P347	R346-E349 HydrophobicContact CB-CB 4.21Å; R346-E349 HydrophobicContact CB-CG 4.24Å; R346-E349 WeakPolarHBondContact CD-OE2 3.46Å; R346-E349 PolarHBondContact O-N 2.93Å; R346-E349 VanDerWaalsContact O-N 3.16Å; P347-E349 VanDerWaalsContact C-N 3.3Å; P347-E349 PolarHBondContact O-N 2.84Å
350	G	65.7	Low	80.6	Confident	71 Å²	71	75.5 Å²	75.5	73%	0.732	42%	0.419	S	S	*	.	S	Bend	trans	101.8	169.4	-180	0	0	0	0	0	113.8
351	S	73.6	Confident	80.2	Confident	78 Å²	78	79.9 Å²	79.9	55%	0.545	44%	0.438	S	S	.	.			trans	-79.6	141.1	179.1	54.6	0	0	0	0	111.5	R273 M353	R273-S351 VanDerWaalsContact CZ-O 3.25Å; R273-S351 PolarHBondContact NH1-O 3.37Å; R273-S351 PolarHBondContact NH1-OG 2.96Å; R273-S351 PolarHBondContact NH2-O 2.77Å; S351-M353 PolarHBondContact O-N 3.36Å
352	P	75	Confident	79.4	Confident	76 Å²	76	82 Å²	82	49%	0.494	45%	0.452	S	S	.	.			trans	-59.3	137.1	173.2	24.2	-32.1	0	0	0	109.9	E203 V354	E203-P352 HydrophobicContact CG-CB 4.32Å; E203-P352 WeakPolarHBondContact OE1-CA 3.28Å; E203-P352 WeakPolarHBondContact OE1-CB 3.4Å; P352-V354 PolarHBondContact O-N 3.23Å
353	M	76.1	Confident	78.4	Confident	24 Å²	24	81.5 Å²	81.5	12%	0.118	45%	0.453	C	S	.	.			trans	-90.1	100.6	-178	-163.5	134.8	70	0	0	109.9	Y204 R271 R273 S351 P357	Y204-M353 WeakPolarHBondContact CD2-O 3.27Å; Y204-M353 PolarHBondContact N-O 3.12Å; R271-M353 HydrophobicContact CB-CE 3.36Å; R271-M353 HydrophobicContact CG-CE 3.08Å; R273-M353 HydrophobicContact CB-CE 4.25Å; R273-M353 HydrophobicContact CB-SD 4.45Å; S351-M353 PolarHBondContact O-N 3.36Å; M353-P357 HydrophobicContact CE-CB 3.58Å; M353-P357 HydrophobicContact CE-CG 3.91Å; M353-P357 HydrophobicContact SD-CB 4Å
354	V	73.3	Confident	77.2	Confident	96 Å²	96	82.7 Å²	82.7	58%	0.582	47%	0.469	S	S	*	.			trans	-101.5	-20.2	176.8	-77.9	0	0	0	0	112.7	P352	P352-V354 PolarHBondContact O-N 3.23Å
355	D	73.7	Confident	76.2	Confident	130 Å²	130	82.3 Å²	82.3	70%	0.695	47%	0.47	S	S	*	.	S	Bend	trans	-84.5	139.6	175.5	-62.4	-48.2	0	0	0	110.8	P357	D355-P357 WeakPolarHBondContact O-CD 3.2Å
356	N	73.5	Confident	75.7	Confident	115 Å²	115	82.5 Å²	82.5	62%	0.615	47%	0.472	S	S	*	.			trans	-60	109	-178	-173.8	20.5	0	0	0	110.9	Y204	Y204-N356 HydrophobicContact CE2-CB 4.44Å
357	P	77.7	Confident	75.7	Confident	23 Å²	23	81.8 Å²	81.8	15%	0.149	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-77.5	158.6	-173.4	30.8	-32.1	0	0	0	111.7	Y204 R271 M353 D355 R359	Y204-P357 HydrophobicContact CD1-CG 4.19Å; Y204-P357 HydrophobicContact CG-CG 4.08Å; R271-P357 HydrophobicContact CG-CB 4.36Å; R271-P357 HydrophobicContact CG-CG 3.98Å; M353-P357 HydrophobicContact CE-CB 3.58Å; M353-P357 HydrophobicContact CE-CG 3.91Å; M353-P357 HydrophobicContact SD-CB 4Å; D355-P357 WeakPolarHBondContact O-CD 3.2Å; P357-R359 PolarHBondContact O-N 3.45Å
358	M	74.2	Confident	75.8	Confident	185 Å²	185	84 Å²	84	91%	0.911	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-62.9	129.2	169.6	-68	-171.5	71.6	0	0	109.8
359	R	82.7	Confident	76.6	Confident	140 Å²	140	80.6 Å²	80.6	53%	0.528	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-68.7	143.1	180	-66.4	-173.2	175	-172.8	-17.5	111.8	D253 D254 P357	D253-R359 PolarHBondContact O-NH2 2.85Å; D254-R359 IonicContact OD1-CZ 3.06Å; D254-R359 IonicContact OD1-NE 3.8Å; D254-R359 IonicContact OD1-NH1 2.58Å; D254-R359 PolarHBondContact OD1-NH1 3.35Å; D254-R359 IonicContact OD1-NH2 3.45Å; D254-R359 PolarHBondContact OD1-NH2 3.02Å; P357-R359 PolarHBondContact O-N 3.45Å
360	R	88.6	Confident	77.3	Confident	20 Å²	20	83.8 Å²	83.8	8%	0.075	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-76.7	156.6	172.8	-58.5	-179.6	-69	-102.6	-1.3	109.4	D206 E217 W302 F342 S362	D206-R360 VanDerWaalsContact CG-NH1 3.29Å; D206-R360 IonicContact OD1-CZ 3.21Å; D206-R360 IonicContact OD1-NH1 2.8Å; D206-R360 PolarHBondContact OD1-NH1 3.04Å; D206-R360 IonicContact OD1-NH2 2.89Å; D206-R360 PolarHBondContact OD1-NH2 3.4Å; D206-R360 IonicContact OD2-CZ 3.95Å; D206-R360 IonicContact OD2-NH1 3.03Å; D206-R360 PolarHBondContact OD2-NH1 3.31Å; E217-R360 VanDerWaalsContact CD-CZ 3.48Å; E217-R360 WeakPolarHBondContact OE1-CB 3.24Å; E217-R360 IonicContact OE1-CZ 3.62Å; E217-R360 PolarHBondContact OE1-N 2.92Å; E217-R360 IonicContact OE1-NE 3.15Å; E217-R360 PolarHBondContact OE1-NE 2.85Å; E217-R360 IonicContact OE1-NH2 2.82Å; E217-R360 IonicContact OE2-CZ 3.57Å; E217-R360 IonicContact OE2-NE 3.78Å; E217-R360 IonicContact OE2-NH2 2.71Å; E217-R360 PolarHBondContact OE2-NH2 3.44Å; W302-R360 HydrophobicContact CH2-CB 4.38Å; W302-R360 HydrophobicContact CZ2-CB 3.52Å; W302-R360 HydrophobicContact CZ2-CG 4.19Å; F342-R360 HydrophobicContact CE2-CG 4.08Å; F342-R360 HydrophobicContact CZ-CG 3.95Å; R360-S362 PolarHBondContact O-N 3.2Å
361	K	82.9	Confident	77.8	Confident	140 Å²	140	83.4 Å²	83.4	61%	0.609	43%	0.434	S	S	*	.			trans	-85.8	108.3	173.1	-70.7	-179.2	-178.3	174.7	0	108.5	R299 W302	R299-K361 WeakPolarHBondContact CD-O 3.07Å; W302-K361 WeakPolarHBondContact CZ2-O 3.47Å
362	S	79.8	Confident	78.1	Confident	44 Å²	44	83.2 Å²	83.2	31%	0.308	43%	0.427	S	S	.	.			trans	-96.8	146.4	171.5	-59.4	0	0	0	0	109.8	W302 R360	W302-S362 PolarHBondContact NE1-OG 3.31Å; W302-S362 VanDerWaalsContact NE1-OG 3.13Å; R360-S362 PolarHBondContact O-N 3.2Å
363	G	73.7	Confident	78.2	Confident	11 Å²	11	84.8 Å²	84.8	11%	0.113	43%	0.434	C	S	.	.	S	Bend	trans	-104.1	176.9	-177.6	0	0	0	0	0	113.3	G300	G300-G363 PolarHBondContact O-N 2.9Å
364	P	68.4	Low	78.4	Confident	99 Å²	99	91 Å²	91	64%	0.643	47%	0.468	S	S	*	.			cis	-82.2	142.2	6.3	-10.8	27.7	0	0	0	114.1
365	S	72.8	Confident	79.1	Confident	34 Å²	34	93.2 Å²	93.2	24%	0.238	47%	0.466	C	S	.	.			trans	-82.3	128.7	176.3	-74.9	0	0	0	0	112.5	R299 K367 D371	R299-S365 PolarHBondContact NH1-OG 2.89Å; S365-K367 PolarHBondContact O-N 3.25Å; S365-D371 WeakPolarHBondContact CA-OD2 3.22Å; S365-D371 WeakPolarHBondContact CB-OD2 3.48Å; S365-D371 PolarHBondContact OG-OD2 3.32Å
366	C	80.1	Confident	79.8	Confident	17 Å²	17	93 Å²	93	12%	0.115	46%	0.464	C	S	.	.			trans	-72.1	114.2	176.1	-179.2	0	0	0	0	111.2	H368 C369 K370 D371 C380	C366-H368 PolarHBondContact O-N 3.02Å; C366-C369 VanDerWaalsContact CB-SG 3.56Å; C366-C369 VanDerWaalsContact SG-SG 3.63Å; C366-K370 WeakPolarHBondContact O-CA 3.4Å; C366-K370 PolarHBondContact O-N 2.74Å; C366-D371 WeakPolarHBondContact CB-OD1 3.35Å; C366-D371 PolarHBondContact N-OD1 3.25Å; C366-C380 HydrophobicContact CB-CB 3.68Å; C366-C380 VanDerWaalsContact SG-SG 3.66Å
367	K	81.8	Confident	80.5	Confident	147 Å²	147	88 Å²	88	64%	0.639	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.8	178.3	-66.7	176.5	-177.5	168.3	0	114.2	E298 S365	E298-K367 WeakPolarHBondContact OE1-CE 3.48Å; E298-K367 IonicContact OE1-NZ 3.8Å; E298-K367 PolarHBondContact OE1-NZ 2.88Å; E298-K367 IonicContact OE2-NZ 3.57Å; S365-K367 PolarHBondContact O-N 3.25Å
368	H	82.7	Confident	81	Confident	132 Å²	132	94.3 Å²	94.3	61%	0.611	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-49.1	-175.6	-68.8	-90.4	0	0	0	113	C366 V379	C366-H368 PolarHBondContact O-N 3.02Å; H368-V379 HydrophobicContact CB-CB 4.49Å; H368-V379 HydrophobicContact CB-CG2 4.3Å
369	C	85.3	Confident	81.4	Confident	3 Å²	3	88.4 Å²	88.4	2%	0.02	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-9.4	178.2	70.5	0	0	0	0	113.5	C366 D371 D372 C377 C380 R388	C366-C369 VanDerWaalsContact CB-SG 3.56Å; C366-C369 VanDerWaalsContact SG-SG 3.63Å; C369-D371 PolarHBondContact O-N 2.87Å; C369-D371 PolarHBondContact SG-N 3.27Å; C369-D371 VanDerWaalsContact SG-N 3.41Å; C369-D372 WeakPolarHBondContact O-CB 3.37Å; C369-D372 PolarHBondContact O-N 3.04Å; C369-C377 HydrophobicContact CB-CB 3.81Å; C369-C380 PolarHBondContact SG-SG 3.17Å; C369-R388 PolarHBondContact SG-NH2 2.87Å
370	K	80.8	Confident	81.5	Confident	175 Å²	175	84.6 Å²	84.6	76%	0.761	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	36.5	-174	-55.1	-179.3	-179.7	179.5	0	112.5	C366 D372	C366-K370 WeakPolarHBondContact O-CA 3.4Å; C366-K370 PolarHBondContact O-N 2.74Å; K370-D372 PolarHBondContact O-N 2.83Å
371	D	76.6	Confident	81.5	Confident	63 Å²	63	83.7 Å²	83.7	34%	0.337	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	22.3	-177.6	-50.2	-40.2	0	0	0	114.9	S365 C366 C369 V373	S365-D371 WeakPolarHBondContact CA-OD2 3.22Å; S365-D371 WeakPolarHBondContact CB-OD2 3.48Å; S365-D371 PolarHBondContact OG-OD2 3.32Å; C366-D371 WeakPolarHBondContact CB-OD1 3.35Å; C366-D371 PolarHBondContact N-OD1 3.25Å; C369-D371 PolarHBondContact O-N 2.87Å; C369-D371 PolarHBondContact SG-N 3.27Å; C369-D371 VanDerWaalsContact SG-N 3.41Å; D371-V373 PolarHBondContact O-N 2.96Å
372	D	80.3	Confident	81.9	Confident	74 Å²	74	77 Å²	77	40%	0.396	40%	0.395	S	S	.	.			trans	-66.7	105.5	174.4	-175.1	-9.4	0	0	0	110.4	C369 K370 N374 R375 R388	C369-D372 WeakPolarHBondContact O-CB 3.37Å; C369-D372 PolarHBondContact O-N 3.04Å; K370-D372 PolarHBondContact O-N 2.83Å; D372-N374 PolarHBondContact O-N 2.87Å; D372-N374 PolarHBondContact OD1-N 2.92Å; D372-N374 VanDerWaalsContact OD1-N 3.14Å; D372-R375 HydrophobicContact CB-CB 3.83Å; D372-R375 PolarHBondContact O-N 3.09Å; D372-R375 VanDerWaalsContact O-N 3.1Å; D372-R388 PolarHBondContact O-NH2 3.19Å
373	V	77.6	Confident	82.4	Confident	108 Å²	108	77.4 Å²	77.4	66%	0.655	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-30.1	-174.8	-177.8	0	0	0	0	111.9	D371 R375	D371-V373 PolarHBondContact O-N 2.96Å; V373-R375 VanDerWaalsContact C-N 3.33Å
374	N	81.1	Confident	83.1	Confident	156 Å²	156	80.4 Å²	80.4	83%	0.834	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.3	-178.2	-64.7	-36.7	0	0	0	112.8	D372	D372-N374 PolarHBondContact O-N 2.87Å; D372-N374 PolarHBondContact OD1-N 2.92Å; D372-N374 VanDerWaalsContact OD1-N 3.14Å
375	R	86.4	Confident	84.2	Confident	142 Å²	142	78 Å²	78	54%	0.536	39%	0.39	S	S	.	.	S	Bend	trans	-99	125.3	-177.4	-170.3	176	178.8	-175.6	0.2	111.2	D372 V373 C377	D372-R375 HydrophobicContact CB-CB 3.83Å; D372-R375 PolarHBondContact O-N 3.09Å; D372-R375 VanDerWaalsContact O-N 3.1Å; V373-R375 VanDerWaalsContact C-N 3.33Å; R375-C377 PolarHBondContact O-N 3.49Å
376	L	88.6	Confident	84.9	Confident	125 Å²	125	76.3 Å²	76.3	65%	0.654	38%	0.378	S	S	*	.			trans	-59.3	133.5	170.2	-62.6	177	0	0	0	110.5	G386	L376-G386 CarbonylContact C-O 3.41Å; L376-G386 WeakPolarHBondContact CA-O 3.31Å
377	C	87.6	Confident	85.3	Confident	9 Å²	9	75.6 Å²	75.6	6%	0.061	37%	0.373	C	S	.	.			trans	-142.3	111.8	-176.3	-171.3	0	0	0	0	111.5	C369 R375 V379 C380 A381 G386	C369-C377 HydrophobicContact CB-CB 3.81Å; R375-C377 PolarHBondContact O-N 3.49Å; C377-V379 PolarHBondContact O-N 3.24Å; C377-V379 VanDerWaalsContact O-N 3.13Å; C377-C380 PolarHBondContact SG-SG 3.4Å; C377-A381 WeakPolarHBondContact O-CA 3.47Å; C377-A381 WeakPolarHBondContact O-CB 3.46Å; C377-A381 PolarHBondContact O-N 2.83Å; C377-G386 PolarHBondContact N-O 3.06Å
378	R	88.2	Confident	85.4	Confident	157 Å²	157	72.5 Å²	72.5	59%	0.592	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	13.3	176.7	-64.1	-177.5	-179.7	-173.1	-0.4	114.3	H383 L384 M402	R378-H383 WeakPolarHBondContact CD-O 3.47Å; R378-H383 WeakPolarHBondContact CG-O 3.32Å; R378-H383 PolarHBondContact O-ND1 3.29Å; R378-L384 PolarHBondContact NE-O 2.67Å; R378-L384 PolarHBondContact NH2-O 3.29Å; R378-M402 VanDerWaalsContact O-CE 3.26Å; R378-M402 WeakPolarHBondContact O-CE 3.17Å
379	V	84.6	Confident	85.4	Confident	60 Å²	60	70.9 Å²	70.9	36%	0.364	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-54.9	-178.4	-176.9	0	0	0	0	111.2	H368 C377	H368-V379 HydrophobicContact CB-CB 4.49Å; H368-V379 HydrophobicContact CB-CG2 4.3Å; C377-V379 PolarHBondContact O-N 3.24Å; C377-V379 VanDerWaalsContact O-N 3.13Å
380	C	84.6	Confident	85.2	Confident	60 Å²	60	74 Å²	74	41%	0.405	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	4.8	177.5	68.7	0	0	0	0	113.7	C366 C369 C377	C366-C380 HydrophobicContact CB-CB 3.68Å; C366-C380 VanDerWaalsContact SG-SG 3.66Å; C369-C380 PolarHBondContact SG-SG 3.17Å; C377-C380 PolarHBondContact SG-SG 3.4Å
381	A	88.5	Confident	85.1	Confident	2 Å²	2	70.1 Å²	70.1	2%	0.017	36%	0.359	C	S	.	.	S	Bend	trans	-134.9	-164.2	175.8	0	0	0	0	0	108.7	C377 H383 G387 R388	C377-A381 WeakPolarHBondContact O-CA 3.47Å; C377-A381 WeakPolarHBondContact O-CB 3.46Å; C377-A381 PolarHBondContact O-N 2.83Å; A381-H383 PolarHBondContact O-N 3.28Å; A381-G387 VanDerWaalsContact CB-O 3.27Å; A381-G387 WeakPolarHBondContact CB-O 3.41Å; A381-R388 HydrophobicContact CB-CG 3.66Å
382	C	90.7	Very high	85.3	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-55	126.2	-177.7	176.7	0	0	0	0	111.6	L384 C385 G386 G387 A403 H405	C382-L384 PolarHBondContact O-N 2.95Å; C382-C385 WeakPolarHBondContact CB-SG 3.41Å; C382-C385 VanDerWaalsContact SG-SG 3.62Å; C382-G386 WeakPolarHBondContact O-CA 3.34Å; C382-G386 PolarHBondContact O-N 2.79Å; C382-G387 PolarHBondContact N-O 2.8Å; C382-A403 CarbonylContact C-O 3.53Å; C382-A403 VanDerWaalsContact CA-O 3.29Å; C382-A403 WeakPolarHBondContact CA-O 3.36Å; C382-H405 VanDerWaalsContact CB-ND1 3.31Å; C382-H405 WeakPolarHBondContact CB-ND1 3.35Å
383	H	90.9	Very high	85.6	Confident	51 Å²	51	72.8 Å²	72.8	24%	0.236	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.2	-175.7	-166.9	50.8	0	0	0	112.8	R378 A381 M402 A403 F404	R378-H383 WeakPolarHBondContact CD-O 3.47Å; R378-H383 WeakPolarHBondContact CG-O 3.32Å; R378-H383 PolarHBondContact O-ND1 3.29Å; A381-H383 PolarHBondContact O-N 3.28Å; H383-M402 HydrophobicContact CB-CB 4.2Å; H383-M402 VanDerWaalsContact CE1-CE 3.45Å; H383-M402 WeakPolarHBondContact CE1-CE 3.32Å; H383-M402 WeakPolarHBondContact ND1-CE 3.49Å; H383-A403 PolarHBondContact N-O 3.31Å; H383-F404 HydrophobicContact CB-CD1 4.2Å; H383-F404 HydrophobicContact CB-CE1 3.7Å; H383-F404 HydrophobicContact CB-CE2 4.22Å; H383-F404 HydrophobicContact CB-CZ 3.7Å; H383-F404 AromaticContact CD2-CZ 3.87Å
384	L	88.4	Confident	86.1	Confident	75 Å²	75	69.8 Å²	69.8	39%	0.393	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-59.2	-179.3	-59.4	176.1	0	0	0	111.4	R378 C382 F404 C408	R378-L384 PolarHBondContact NE-O 2.67Å; R378-L384 PolarHBondContact NH2-O 3.29Å; C382-L384 PolarHBondContact O-N 2.95Å; L384-F404 HydrophobicContact CD1-CD1 3.93Å; L384-F404 HydrophobicContact CD1-CE1 4.38Å; L384-F404 HydrophobicContact CD2-CE1 4.26Å; L384-F404 HydrophobicContact CG-CD1 3.86Å; L384-F404 HydrophobicContact CG-CE1 4.01Å; L384-C408 HydrophobicContact CB-CB 4.32Å; L384-C408 HydrophobicContact CD1-CB 4Å; L384-C408 WeakPolarHBondContact CD1-O 3.4Å
385	C	90.3	Very high	86.5	Confident	47 Å²	47	63.1 Å²	63.1	32%	0.318	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-23.1	-174.9	72.6	0	0	0	0	113.9	C382 G387 H405	C382-C385 WeakPolarHBondContact CB-SG 3.41Å; C382-C385 VanDerWaalsContact SG-SG 3.62Å; C385-G387 PolarHBondContact O-N 3.23Å; C385-G387 PolarHBondContact SG-N 2.89Å; C385-H405 PolarHBondContact SG-ND1 3.02Å
386	G	87.9	Confident	86.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.			trans	74.8	5.2	-173.8	0	0	0	0	0	114.5	L376 C377 C382	L376-G386 CarbonylContact C-O 3.41Å; L376-G386 WeakPolarHBondContact CA-O 3.31Å; C377-G386 PolarHBondContact N-O 3.06Å; C382-G386 WeakPolarHBondContact O-CA 3.34Å; C382-G386 PolarHBondContact O-N 2.79Å
387	G	87.9	Confident	86.3	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.01	29%	0.286	C	S	.	.			trans	-78.4	151.2	179.7	0	0	0	0	0	112.9	A381 C382 C385	A381-G387 VanDerWaalsContact CB-O 3.27Å; A381-G387 WeakPolarHBondContact CB-O 3.41Å; C382-G387 PolarHBondContact N-O 2.8Å; C385-G387 PolarHBondContact O-N 3.23Å; C385-G387 PolarHBondContact SG-N 2.89Å
388	R	84	Confident	85.9	Confident	82 Å²	82	59 Å²	59	31%	0.309	30%	0.299	S	S	.	.			trans	-109.5	1.6	179.2	-60.8	176.7	-171.7	-145.6	5.7	113	C369 D372 A381	C369-R388 PolarHBondContact SG-NH2 2.87Å; D372-R388 PolarHBondContact O-NH2 3.19Å; A381-R388 HydrophobicContact CB-CG 3.66Å
389	Q	82.6	Confident	85.2	Confident	98 Å²	98	53 Å²	53	46%	0.458	28%	0.278	S	S	.	.			trans	-63.6	156.8	175.2	59.5	-89.4	23	0	0	111.3	H405	Q389-H405 PolarHBondContact O-NE2 3.22Å
390	D	81.4	Confident	84.9	Confident	68 Å²	68	51.2 Å²	51.2	36%	0.364	27%	0.267	S	S	.	.			trans	47.4	61.9	174.2	-46.1	-45.1	0	0	0	114.8	D392 K393 Y407	D390-D392 VanDerWaalsContact C-OD1 3.31Å; D390-D392 WeakPolarHBondContact CA-OD1 3.47Å; D390-D392 PolarHBondContact O-N 3.44Å; D390-K393 HydrophobicContact CB-CB 4.12Å; D390-K393 HydrophobicContact CB-CD 4.33Å; D390-K393 PolarHBondContact O-N 3.39Å; D390-Y407 PolarHBondContact OD2-OH 2.81Å
391	P	79.6	Confident	84.8	Confident	94 Å²	94	54.3 Å²	54.3	61%	0.61	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-61.5	-28.6	179.5	26.1	-34	0	0	0	112.8	K393 Q394	P391-K393 PolarHBondContact O-N 2.86Å; P391-Q394 WeakPolarHBondContact O-CB 3.47Å; P391-Q394 PolarHBondContact O-N 3.4Å
392	D	80.7	Confident	84.7	Confident	106 Å²	106	56 Å²	56	57%	0.567	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.8	174.2	65	-46.2	0	0	0	113.2	D390	D390-D392 VanDerWaalsContact C-OD1 3.31Å; D390-D392 WeakPolarHBondContact CA-OD1 3.47Å; D390-D392 PolarHBondContact O-N 3.44Å
393	K	86.6	Confident	84.6	Confident	87 Å²	87	56.5 Å²	56.5	38%	0.378	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-108.6	23.3	-179.4	-66.8	175.1	-169.2	168.1	0	112.2	D390 P391 H405 I406 Y407	D390-K393 HydrophobicContact CB-CB 4.12Å; D390-K393 HydrophobicContact CB-CD 4.33Å; D390-K393 PolarHBondContact O-N 3.39Å; P391-K393 PolarHBondContact O-N 2.86Å; K393-H405 WeakPolarHBondContact O-CA 3.43Å; K393-I406 HydrophobicContact CB-CD1 3.94Å; K393-I406 HydrophobicContact CB-CG1 4.05Å; K393-I406 HydrophobicContact CD-CD1 4.28Å; K393-I406 HydrophobicContact CG-CD1 3.96Å; K393-I406 PolarHBondContact O-N 3.19Å; K393-Y407 HydrophobicContact CB-CE1 4.5Å
394	Q	87.9	Confident	84.7	Confident	46 Å²	46	54.3 Å²	54.3	22%	0.215	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128	-180	-159.9	173.7	4.8	0	0	111	P391 A403 F404	P391-Q394 WeakPolarHBondContact O-CB 3.47Å; P391-Q394 PolarHBondContact O-N 3.4Å; Q394-A403 HydrophobicContact CG-CB 3.92Å; Q394-F404 CarbonylContact C-O 3.46Å; Q394-F404 WeakPolarHBondContact CA-O 3.43Å
395	L	88.5	Confident	84.8	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.079	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.7	176.8	-61	173.4	0	0	0	110.1	A403 F404 I406 L409 L413 V416 P417 W422	L395-A403 CarbonylContact O-C 3.49Å; L395-A403 WeakPolarHBondContact O-CA 3.36Å; L395-F404 PolarHBondContact N-O 3.28Å; L395-F404 PolarHBondContact O-N 2.92Å; L395-I406 HydrophobicContact CD1-CG2 3.81Å; L395-I406 HydrophobicContact CD2-CG2 4.38Å; L395-I406 HydrophobicContact CG-CG2 3.84Å; L395-L409 HydrophobicContact CD1-CD1 4.09Å; L395-L413 HydrophobicContact CD1-CD1 3.62Å; L395-V416 HydrophobicContact CD2-CB 4.24Å; L395-V416 HydrophobicContact CD2-CG1 3.72Å; L395-V416 HydrophobicContact CD2-CG2 4.12Å; L395-P417 HydrophobicContact CD1-CG 4.46Å; L395-W422 HydrophobicContact CB-CD2 4.1Å; L395-W422 HydrophobicContact CB-CE3 3.78Å; L395-W422 HydrophobicContact CB-CH2 4.19Å; L395-W422 HydrophobicContact CB-CZ2 4.5Å; L395-W422 HydrophobicContact CB-CZ3 3.82Å; L395-W422 HydrophobicContact CD1-CD2 4.04Å; L395-W422 HydrophobicContact CD1-CG 4.43Å; L395-W422 HydrophobicContact CD1-CH2 4.49Å; L395-W422 HydrophobicContact CD1-CZ2 4.02Å
396	M	86.3	Confident	84.9	Confident	129 Å²	129	49 Å²	49	64%	0.635	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	136	171.9	-59.5	-147.2	-58.5	0	0	110.3	A403	M396-A403 HydrophobicContact CG-CB 4.19Å
397	C	84.6	Confident	85.1	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.			trans	-85.4	124.6	179.6	173.6	0	0	0	0	112	E399 C400 D401 M402 F404 W422 C424	C397-E399 PolarHBondContact O-N 2.89Å; C397-C400 PolarHBondContact O-N 3.23Å; C397-C400 VanDerWaalsContact SG-SG 3.64Å; C397-D401 VanDerWaalsContact O-CA 3.3Å; C397-D401 WeakPolarHBondContact O-CA 3.48Å; C397-D401 PolarHBondContact O-N 2.97Å; C397-M402 PolarHBondContact N-O 2.87Å; C397-F404 HydrophobicContact CB-CE2 4.33Å; C397-W422 WeakPolarHBondContact CA-O 3.34Å; C397-W422 HydrophobicContact CB-CE3 4.16Å; C397-W422 HydrophobicContact CB-CZ3 3.86Å; C397-C424 HydrophobicContact CB-CB 3.87Å; C397-C424 PolarHBondContact SG-N 2.8Å; C397-C424 VanDerWaalsContact SG-SG 3.69Å
398	D	80.1	Confident	85.2	Confident	62 Å²	62	55.2 Å²	55.2	33%	0.332	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-6.9	-177.7	-64.7	-59.6	0	0	0	115.7	E421 W422 Y423 K446	D398-E421 VanDerWaalsContact OD2-CA 3.27Å; D398-E421 WeakPolarHBondContact OD2-CA 3.37Å; D398-W422 PolarHBondContact N-O 3.33Å; D398-W422 VanDerWaalsContact N-O 3.09Å; D398-W422 PolarHBondContact OD2-N 2.75Å; D398-Y423 HydrophobicContact CB-CE1 4.17Å; D398-K446 PolarHBondContact O-NZ 3.18Å
399	E	73.4	Confident	85.4	Confident	30 Å²	30	51.9 Å²	51.9	14%	0.14	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-37.1	179.5	-179.6	69.1	-173.9	0	0	112.9	C397 Y423 C427 S444 K446	C397-E399 PolarHBondContact O-N 2.89Å; E399-Y423 HydrophobicContact CB-CD1 3.79Å; E399-Y423 HydrophobicContact CB-CE1 4.02Å; E399-C427 HydrophobicContact CB-CB 3.69Å; E399-C427 HydrophobicContact CG-CB 3.76Å; E399-C427 VanDerWaalsContact CG-SG 3.58Å; E399-S444 WeakPolarHBondContact OE1-CB 3.31Å; E399-S444 PolarHBondContact OE1-OG 3.19Å; E399-K446 VanDerWaalsContact CD-CB 3.46Å; E399-K446 WeakPolarHBondContact OE1-CB 3.42Å; E399-K446 PolarHBondContact OE1-N 2.8Å; E399-K446 VanDerWaalsContact OE1-N 3.08Å; E399-K446 WeakPolarHBondContact OE2-CD 3.49Å
400	C	78.4	Confident	85.2	Confident	22 Å²	22	54.2 Å²	54.2	15%	0.149	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-5.7	-175.5	68	0	0	0	0	114.8	C397 M402	C397-C400 PolarHBondContact O-N 3.23Å; C397-C400 VanDerWaalsContact SG-SG 3.64Å; C400-M402 HydrophobicContact CB-CG 4.15Å; C400-M402 PolarHBondContact O-N 3.36Å; C400-M402 VanDerWaalsContact O-N 3.11Å
401	D	81.5	Confident	85.3	Confident	125 Å²	125	55.8 Å²	55.8	67%	0.668	30%	0.298	S	S	*	.			trans	55.4	19.3	-175.9	-55.2	-33.9	0	0	0	113.8	C397	C397-D401 VanDerWaalsContact O-CA 3.3Å; C397-D401 WeakPolarHBondContact O-CA 3.48Å; C397-D401 PolarHBondContact O-N 2.97Å
402	M	86.9	Confident	85.7	Confident	39 Å²	39	55.5 Å²	55.5	19%	0.192	30%	0.296	C	S	.	.			trans	-89.6	143.6	176.1	-54	-60.8	-88.8	0	0	109.7	R378 H383 C397 C400 F404	R378-M402 VanDerWaalsContact O-CE 3.26Å; R378-M402 WeakPolarHBondContact O-CE 3.17Å; H383-M402 HydrophobicContact CB-CB 4.2Å; H383-M402 VanDerWaalsContact CE1-CE 3.45Å; H383-M402 WeakPolarHBondContact CE1-CE 3.32Å; H383-M402 WeakPolarHBondContact ND1-CE 3.49Å; C397-M402 PolarHBondContact N-O 2.87Å; C400-M402 HydrophobicContact CB-CG 4.15Å; C400-M402 PolarHBondContact O-N 3.36Å; C400-M402 VanDerWaalsContact O-N 3.11Å; M402-F404 HydrophobicContact CB-CE2 3.83Å; M402-F404 HydrophobicContact CB-CZ 4.3Å; M402-F404 VanDerWaalsContact O-CD2 3.3Å; M402-F404 WeakPolarHBondContact O-CD2 3.45Å; M402-F404 VanDerWaalsContact O-CE2 3.32Å; M402-F404 WeakPolarHBondContact O-CE2 3.48Å
403	A	88.8	Confident	86	Confident	10 Å²	10	53.4 Å²	53.4	8%	0.083	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	148.4	-175.5	0	0	0	0	0	112	C382 H383 Q394 L395 M396	C382-A403 CarbonylContact C-O 3.53Å; C382-A403 VanDerWaalsContact CA-O 3.29Å; C382-A403 WeakPolarHBondContact CA-O 3.36Å; H383-A403 PolarHBondContact N-O 3.31Å; Q394-A403 HydrophobicContact CG-CB 3.92Å; L395-A403 CarbonylContact O-C 3.49Å; L395-A403 WeakPolarHBondContact O-CA 3.36Å; M396-A403 HydrophobicContact CG-CB 4.19Å
404	F	92.1	Very high	85.9	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.6	-173.8	-65.3	-98.4	0	0	0	110.5	H383 L384 Q394 L395 C397 M402 L409 W422 C424	H383-F404 HydrophobicContact CB-CD1 4.2Å; H383-F404 HydrophobicContact CB-CE1 3.7Å; H383-F404 HydrophobicContact CB-CE2 4.22Å; H383-F404 HydrophobicContact CB-CZ 3.7Å; H383-F404 AromaticContact CD2-CZ 3.87Å; L384-F404 HydrophobicContact CD1-CD1 3.93Å; L384-F404 HydrophobicContact CD1-CE1 4.38Å; L384-F404 HydrophobicContact CD2-CE1 4.26Å; L384-F404 HydrophobicContact CG-CD1 3.86Å; L384-F404 HydrophobicContact CG-CE1 4.01Å; Q394-F404 CarbonylContact C-O 3.46Å; Q394-F404 WeakPolarHBondContact CA-O 3.43Å; L395-F404 PolarHBondContact N-O 3.28Å; L395-F404 PolarHBondContact O-N 2.92Å; C397-F404 HydrophobicContact CB-CE2 4.33Å; M402-F404 HydrophobicContact CB-CE2 3.83Å; M402-F404 HydrophobicContact CB-CZ 4.3Å; M402-F404 VanDerWaalsContact O-CD2 3.3Å; M402-F404 WeakPolarHBondContact O-CD2 3.45Å; M402-F404 VanDerWaalsContact O-CE2 3.32Å; M402-F404 WeakPolarHBondContact O-CE2 3.48Å; F404-L409 HydrophobicContact CB-CD2 4.01Å; F404-L409 HydrophobicContact CD1-CD2 4Å; F404-L409 HydrophobicContact CG-CD2 4.22Å; F404-W422 HydrophobicContact CB-CH2 3.85Å; F404-W422 HydrophobicContact CB-CZ3 4.38Å; F404-W422 AromaticContact CD2-CH2 3.69Å; F404-W422 HydrophobicContact CD2-CH2 3.69Å; F404-W422 AromaticContact CD2-CZ3 3.75Å; F404-W422 HydrophobicContact CD2-CZ3 3.75Å; F404-W422 HydrophobicContact CE2-CH2 4.44Å; F404-W422 HydrophobicContact CE2-CZ3 4.45Å; F404-W422 AromaticContact CG-CH2 3.84Å; F404-W422 HydrophobicContact CG-CH2 3.84Å; F404-W422 HydrophobicContact CG-CZ3 4.32Å; F404-C424 HydrophobicContact CD2-CB 3.88Å; F404-C424 HydrophobicContact CE1-CB 4.1Å; F404-C424 HydrophobicContact CE2-CB 3.31Å; F404-C424 HydrophobicContact CG-CB 4.5Å; F404-C424 HydrophobicContact CZ-CB 3.44Å; F404-C424 VanDerWaalsContact CZ-CB 3.44Å
405	H	92.4	Very high	85.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	141.5	169.4	-68.1	115.4	0	0	0	110.8	C382 C385 Q389 K393 Y407 C408 L409	C382-H405 VanDerWaalsContact CB-ND1 3.31Å; C382-H405 WeakPolarHBondContact CB-ND1 3.35Å; C385-H405 PolarHBondContact SG-ND1 3.02Å; Q389-H405 PolarHBondContact O-NE2 3.22Å; K393-H405 WeakPolarHBondContact O-CA 3.43Å; H405-Y407 HydrophobicContact CB-CD1 4.2Å; H405-Y407 HydrophobicContact CB-CD2 3.94Å; H405-Y407 HydrophobicContact CB-CE1 3.99Å; H405-Y407 HydrophobicContact CB-CE2 3.68Å; H405-Y407 HydrophobicContact CB-CG 4.2Å; H405-Y407 AromaticContact CD2-CZ 3.78Å; H405-Y407 AromaticContact CG-CE2 3.82Å; H405-Y407 AromaticContact CG-CZ 3.61Å; H405-Y407 PolarHBondContact O-N 2.64Å; H405-Y407 VanDerWaalsContact O-N 3.14Å; H405-C408 HydrophobicContact CB-CB 3.93Å; H405-C408 PolarHBondContact O-N 3.34Å; H405-L409 PolarHBondContact O-N 3.31Å
406	I	90.8	Very high	85.6	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.062	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-35.5	175.8	62.6	-179.6	0	0	0	112.4	K393 L395 L413 V416	K393-I406 HydrophobicContact CB-CD1 3.94Å; K393-I406 HydrophobicContact CB-CG1 4.05Å; K393-I406 HydrophobicContact CD-CD1 4.28Å; K393-I406 HydrophobicContact CG-CD1 3.96Å; K393-I406 PolarHBondContact O-N 3.19Å; L395-I406 HydrophobicContact CD1-CG2 3.81Å; L395-I406 HydrophobicContact CD2-CG2 4.38Å; L395-I406 HydrophobicContact CG-CG2 3.84Å; I406-L413 HydrophobicContact CB-CB 4.03Å; I406-L413 PolarHBondContact O-N 3.31Å; I406-V416 HydrophobicContact CG2-CG2 4.08Å
407	Y	91.7	Very high	85.5	Confident	92 Å²	92	55.3 Å²	55.3	36%	0.361	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-12.4	-178.7	54.3	-105.4	0	0	0	114.5	D390 K393 H405 L409	D390-Y407 PolarHBondContact OD2-OH 2.81Å; K393-Y407 HydrophobicContact CB-CE1 4.5Å; H405-Y407 HydrophobicContact CB-CD1 4.2Å; H405-Y407 HydrophobicContact CB-CD2 3.94Å; H405-Y407 HydrophobicContact CB-CE1 3.99Å; H405-Y407 HydrophobicContact CB-CE2 3.68Å; H405-Y407 HydrophobicContact CB-CG 4.2Å; H405-Y407 AromaticContact CD2-CZ 3.78Å; H405-Y407 AromaticContact CG-CE2 3.82Å; H405-Y407 AromaticContact CG-CZ 3.61Å; H405-Y407 PolarHBondContact O-N 2.64Å; H405-Y407 VanDerWaalsContact O-N 3.14Å; Y407-L409 VanDerWaalsContact C-N 3.34Å
408	C	90	Very high	85.1	Confident	39 Å²	39	61 Å²	61	26%	0.264	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.9	173.9	-73.2	0	0	0	0	112.1	L384 H405	L384-C408 HydrophobicContact CB-CB 4.32Å; L384-C408 HydrophobicContact CD1-CB 4Å; L384-C408 WeakPolarHBondContact CD1-O 3.4Å; H405-C408 HydrophobicContact CB-CB 3.93Å; H405-C408 PolarHBondContact O-N 3.34Å
409	L	88.3	Confident	84.9	Confident	12 Å²	12	65.5 Å²	65.5	6%	0.063	38%	0.382	C	S	.	.	S	Bend	trans	-71.5	156.9	176.6	-64	169.1	0	0	0	111	L395 F404 H405 Y407 P411 P412 L413 W422 P425	L395-L409 HydrophobicContact CD1-CD1 4.09Å; F404-L409 HydrophobicContact CB-CD2 4.01Å; F404-L409 HydrophobicContact CD1-CD2 4Å; F404-L409 HydrophobicContact CG-CD2 4.22Å; H405-L409 PolarHBondContact O-N 3.31Å; Y407-L409 VanDerWaalsContact C-N 3.34Å; L409-P411 CarbonylContact C-O 3.57Å; L409-P411 CarbonylContact O-C 3.52Å; L409-P411 VanDerWaalsContact O-C 3.26Å; L409-P412 WeakPolarHBondContact O-CA 3.34Å; L409-L413 HydrophobicContact CD1-CD1 3.56Å; L409-L413 HydrophobicContact CD1-CG 3.98Å; L409-W422 HydrophobicContact CD1-CH2 4.26Å; L409-W422 HydrophobicContact CD1-CZ2 3.57Å; L409-W422 HydrophobicContact CD2-CH2 4.03Å; L409-W422 HydrophobicContact CD2-CZ2 3.88Å; L409-W422 HydrophobicContact CG-CZ2 4.39Å; L409-P425 HydrophobicContact CD2-CG 4.15Å
410	D	79.8	Confident	84.9	Confident	147 Å²	147	72 Å²	72	79%	0.786	42%	0.418	S	S	*	.	S	Bend	trans	-125.6	112.4	174.8	-173	15.4	0	0	0	109.7
411	P	83.9	Confident	84.9	Confident	101 Å²	101	76.6 Å²	76.6	66%	0.656	44%	0.437	S	S	*	.	S	Bend	cis	-68	152.9	-5.6	29.6	-34.9	0	0	0	112.3	L409	L409-P411 CarbonylContact C-O 3.57Å; L409-P411 CarbonylContact O-C 3.52Å; L409-P411 VanDerWaalsContact O-C 3.26Å
412	P	87.9	Confident	85.1	Confident	88 Å²	88	72.5 Å²	72.5	57%	0.571	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-68.2	140.5	178.4	27.3	-33.9	0	0	0	110.8	L409	L409-P412 WeakPolarHBondContact O-CA 3.34Å
413	L	86.8	Confident	84.9	Confident	61 Å²	61	74.6 Å²	74.6	32%	0.319	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-85.4	139.2	177.4	-65.6	174.9	0	0	0	110.5	L395 I406 L409 P417	L395-L413 HydrophobicContact CD1-CD1 3.62Å; I406-L413 HydrophobicContact CB-CB 4.03Å; I406-L413 PolarHBondContact O-N 3.31Å; L409-L413 HydrophobicContact CD1-CD1 3.56Å; L409-L413 HydrophobicContact CD1-CG 3.98Å; L413-P417 HydrophobicContact CD1-CG 4.01Å
414	S	84.8	Confident	84.7	Confident	123 Å²	123	74.1 Å²	74.1	86%	0.86	42%	0.415	S	S	*	.	S	Bend	trans	-74	-29.7	177.9	53.2	0	0	0	0	113.3
415	S	86.2	Confident	84.1	Confident	71 Å²	71	77.8 Å²	77.8	50%	0.497	44%	0.439	S	S	.	.	S	Bend	trans	-154	162.5	-179.1	58	0	0	0	0	110.1
416	V	83.8	Confident	83.4	Confident	74 Å²	74	82.3 Å²	82.3	45%	0.448	46%	0.46	S	S	.	.			trans	-58.6	125.8	169.9	171.6	0	0	0	0	108.6	L395 I406	L395-V416 HydrophobicContact CD2-CB 4.24Å; L395-V416 HydrophobicContact CD2-CG1 3.72Å; L395-V416 HydrophobicContact CD2-CG2 4.12Å; I406-V416 HydrophobicContact CG2-CG2 4.08Å
417	P	84	Confident	82.6	Confident	49 Å²	49	82.5 Å²	82.5	32%	0.318	46%	0.462	S	S	.	.			trans	-59.2	149.6	178.4	-25	35.5	0	0	0	112.4	L395 L413	L395-P417 HydrophobicContact CD1-CG 4.46Å; L413-P417 HydrophobicContact CD1-CG 4.01Å
418	S	76.1	Confident	81.6	Confident	121 Å²	121	85.7 Å²	85.7	85%	0.846	47%	0.474	S	S	*	.	S	Bend	trans	-86.7	-2.3	179.6	60.1	0	0	0	0	114.4
419	E	76	Confident	80	Confident	155 Å²	155	89 Å²	89	72%	0.724	49%	0.489	S	S	*	.	S	Bend	trans	-83.8	144.1	178.7	-59.3	-154.6	179.3	0	0	110.8	E421	E419-E421 PolarHBondContact O-N 2.98Å
420	D	72.2	Confident	78.1	Confident	166 Å²	166	91.8 Å²	91.8	89%	0.888	50%	0.504	S	S	*	.	S	Bend	trans	-67	-19.1	-177.2	-62.4	-22.5	0	0	0	113.2
421	E	79.3	Confident	76.5	Confident	119 Å²	119	90.2 Å²	90.2	56%	0.556	51%	0.511	S	S	*	.			trans	-120.5	133.2	179	-63.7	-175.7	-167.7	0	0	111.3	D398 E419 Y423	D398-E421 VanDerWaalsContact OD2-CA 3.27Å; D398-E421 WeakPolarHBondContact OD2-CA 3.37Å; E419-E421 PolarHBondContact O-N 2.98Å; E421-Y423 HydrophobicContact CB-CE2 4.06Å; E421-Y423 PolarHBondContact OE2-OH 2.89Å
422	W	85.6	Confident	74.5	Confident	39 Å²	39	89.6 Å²	89.6	15%	0.148	51%	0.509	C	S	.	.			trans	-135.4	136.7	173.3	-179.7	85	0	0	0	112.2	L395 C397 D398 F404 L409 C424	L395-W422 HydrophobicContact CB-CD2 4.1Å; L395-W422 HydrophobicContact CB-CE3 3.78Å; L395-W422 HydrophobicContact CB-CH2 4.19Å; L395-W422 HydrophobicContact CB-CZ2 4.5Å; L395-W422 HydrophobicContact CB-CZ3 3.82Å; L395-W422 HydrophobicContact CD1-CD2 4.04Å; L395-W422 HydrophobicContact CD1-CG 4.43Å; L395-W422 HydrophobicContact CD1-CH2 4.49Å; L395-W422 HydrophobicContact CD1-CZ2 4.02Å; C397-W422 WeakPolarHBondContact CA-O 3.34Å; C397-W422 HydrophobicContact CB-CE3 4.16Å; C397-W422 HydrophobicContact CB-CZ3 3.86Å; D398-W422 PolarHBondContact N-O 3.33Å; D398-W422 VanDerWaalsContact N-O 3.09Å; D398-W422 PolarHBondContact OD2-N 2.75Å; F404-W422 HydrophobicContact CB-CH2 3.85Å; F404-W422 HydrophobicContact CB-CZ3 4.38Å; F404-W422 AromaticContact CD2-CH2 3.69Å; F404-W422 HydrophobicContact CD2-CH2 3.69Å; F404-W422 AromaticContact CD2-CZ3 3.75Å; F404-W422 HydrophobicContact CD2-CZ3 3.75Å; F404-W422 HydrophobicContact CE2-CH2 4.44Å; F404-W422 HydrophobicContact CE2-CZ3 4.45Å; F404-W422 AromaticContact CG-CH2 3.84Å; F404-W422 HydrophobicContact CG-CH2 3.84Å; F404-W422 HydrophobicContact CG-CZ3 4.32Å; L409-W422 HydrophobicContact CD1-CH2 4.26Å; L409-W422 HydrophobicContact CD1-CZ2 3.57Å; L409-W422 HydrophobicContact CD2-CH2 4.03Å; L409-W422 HydrophobicContact CD2-CZ2 3.88Å; L409-W422 HydrophobicContact CG-CZ2 4.39Å; W422-C424 HydrophobicContact CH2-CB 3.68Å; W422-C424 HydrophobicContact CZ2-CB 4.44Å; W422-C424 HydrophobicContact CZ3-CB 3.95Å
423	Y	83.1	Confident	72.3	Confident	84 Å²	84	92.2 Å²	92.2	33%	0.329	51%	0.514	S	S	.	.			trans	-119.2	128.2	-179.5	-59.9	-87.7	0	0	0	110.3	D398 E399 E421	D398-Y423 HydrophobicContact CB-CE1 4.17Å; E399-Y423 HydrophobicContact CB-CD1 3.79Å; E399-Y423 HydrophobicContact CB-CE1 4.02Å; E421-Y423 HydrophobicContact CB-CE2 4.06Å; E421-Y423 PolarHBondContact OE2-OH 2.89Å
424	C	84.8	Confident	70	Confident	0 Å²	0	95.3 Å²	95.3	0%	0	54%	0.535	C	S	.	.			trans	-63.7	159.3	175.2	72.7	0	0	0	0	111.5	C397 F404 W422 E426 C427 R428	C397-C424 HydrophobicContact CB-CB 3.87Å; C397-C424 PolarHBondContact SG-N 2.8Å; C397-C424 VanDerWaalsContact SG-SG 3.69Å; F404-C424 HydrophobicContact CD2-CB 3.88Å; F404-C424 HydrophobicContact CE1-CB 4.1Å; F404-C424 HydrophobicContact CE2-CB 3.31Å; F404-C424 HydrophobicContact CG-CB 4.5Å; F404-C424 HydrophobicContact CZ-CB 3.44Å; F404-C424 VanDerWaalsContact CZ-CB 3.44Å; W422-C424 HydrophobicContact CH2-CB 3.68Å; W422-C424 HydrophobicContact CZ2-CB 4.44Å; W422-C424 HydrophobicContact CZ3-CB 3.95Å; C424-E426 PolarHBondContact O-N 2.98Å; C424-C427 CarbonylContact O-C 3.53Å; C424-C427 PolarHBondContact O-N 2.96Å; C424-C427 VanDerWaalsContact SG-SG 3.69Å; C424-R428 WeakPolarHBondContact O-CB 3.28Å; C424-R428 PolarHBondContact O-N 3.22Å
425	P	79.4	Confident	67.7	Low	80 Å²	80	92.7 Å²	92.7	52%	0.519	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-26	-179.5	-28.2	35.7	0	0	0	114.8	L409	L409-P425 HydrophobicContact CD2-CG 4.15Å
426	E	77.2	Confident	65.3	Low	96 Å²	96	95.5 Å²	95.5	45%	0.449	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-23.5	175.8	-64.4	-165	173.2	0	0	114.3	C424 K445	C424-E426 PolarHBondContact O-N 2.98Å; E426-K445 IonicContact OE2-NZ 3.62Å; E426-K445 PolarHBondContact OE2-NZ 3.3Å
427	C	73.6	Confident	62.6	Low	16 Å²	16	94.7 Å²	94.7	11%	0.108	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-21.7	-175.6	-75.7	0	0	0	0	113	E399 C424 N429	E399-C427 HydrophobicContact CB-CB 3.69Å; E399-C427 HydrophobicContact CG-CB 3.76Å; E399-C427 VanDerWaalsContact CG-SG 3.58Å; C424-C427 CarbonylContact O-C 3.53Å; C424-C427 PolarHBondContact O-N 2.96Å; C424-C427 VanDerWaalsContact SG-SG 3.69Å; C427-N429 PolarHBondContact O-N 3.49Å
428	R	70.3	Confident	60.6	Low	159 Å²	159	95 Å²	95	60%	0.6	54%	0.536	S	S	*	.			trans	-68.2	118.7	176.2	-172.5	179.3	-177.8	-161.7	0.2	108.6	C424 D430	C424-R428 WeakPolarHBondContact O-CB 3.28Å; C424-R428 PolarHBondContact O-N 3.22Å; R428-D430 PolarHBondContact O-N 3.07Å
429	N	57.2	Low	58.6	Low	109 Å²	109	95.8 Å²	95.8	58%	0.583	53%	0.526	S	S	*	.			trans	-78.3	107.4	163.8	-70	-30.5	0	0	0	106.8	C427 A431	C427-N429 PolarHBondContact O-N 3.49Å; N429-A431 PolarHBondContact O-N 2.98Å
430	D	49.2	Very low	56.8	Low	70 Å²	70	98.6 Å²	98.6	37%	0.374	53%	0.53	S	S	.	.			trans	-70	120.1	179.1	-159.8	-28.3	0	0	0	109.3	R428 S432 E433	R428-D430 PolarHBondContact O-N 3.07Å; D430-S432 PolarHBondContact O-N 3.24Å; D430-S432 VanDerWaalsContact O-N 3.11Å; D430-S432 PolarHBondContact OD1-N 2.99Å; D430-S432 PolarHBondContact OD1-OG 3.19Å; D430-S432 PolarHBondContact OD2-OG 2.91Å; D430-E433 HydrophobicContact CB-CB 4.19Å; D430-E433 PolarHBondContact O-N 3.12Å; D430-E433 VanDerWaalsContact O-N 3.15Å
431	A	44.3	Very low	55.2	Low	113 Å²	113	96.8 Å²	96.8	93%	0.934	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.5	178.2	0	0	0	0	0	112.6	N429	N429-A431 PolarHBondContact O-N 2.98Å
432	S	42.5	Very low	53.3	Low	89 Å²	89	100.1 Å²	100.1	62%	0.622	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-6.3	176.8	65.4	0	0	0	0	114.4	D430 V434	D430-S432 PolarHBondContact O-N 3.24Å; D430-S432 VanDerWaalsContact O-N 3.11Å; D430-S432 PolarHBondContact OD1-N 2.99Å; D430-S432 PolarHBondContact OD1-OG 3.19Å; D430-S432 PolarHBondContact OD2-OG 2.91Å; S432-V434 PolarHBondContact O-N 3.37Å
433	E	41.3	Very low	51.3	Low	142 Å²	142	105.5 Å²	105.5	66%	0.664	55%	0.554	S	S	*	*			trans	-78.4	93.7	176.5	-155.3	175.4	-144.5	0	0	109.7	D430 V435	D430-E433 HydrophobicContact CB-CB 4.19Å; D430-E433 PolarHBondContact O-N 3.12Å; D430-E433 VanDerWaalsContact O-N 3.15Å; E433-V435 PolarHBondContact O-N 3.42Å
434	V	38.6	Very low	49.4	Very low	126 Å²	126	103.3 Å²	103.3	76%	0.764	55%	0.551	S	S	*	*			trans	-67.1	100.4	169.5	-179.7	0	0	0	0	107.5	S432 L436	S432-V434 PolarHBondContact O-N 3.37Å; V434-L436 PolarHBondContact O-N 2.93Å
435	V	38	Very low	47.8	Very low	68 Å²	68	107.6 Å²	107.6	41%	0.412	57%	0.569	S	S	.	*			trans	-53.3	111.1	172.8	-175.1	0	0	0	0	108.6	E433 E439 L441	E433-V435 PolarHBondContact O-N 3.42Å; V435-E439 HydrophobicContact CG1-CB 3.99Å; V435-E439 WeakPolarHBondContact CG1-O 3.41Å; V435-L441 HydrophobicContact CG2-CG 4.46Å
436	L	34.9	Very low	46.1	Very low	130 Å²	130	109.4 Å²	109.4	68%	0.681	57%	0.569	S	S	*	*			trans	-61.1	149.9	176.1	-73	164.9	0	0	0	109.7	V434 G438 E439	V434-L436 PolarHBondContact O-N 2.93Å; L436-G438 PolarHBondContact O-N 3.17Å; L436-E439 PolarHBondContact O-N 3.38Å; L436-E439 VanDerWaalsContact O-N 3.16Å
437	A	28.1	Very low	44.8	Very low	57 Å²	57	111.4 Å²	111.4	47%	0.471	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	110.4	-176.8	0	0	0	0	0	110.9
438	G	40.3	Very low	43.6	Very low	56 Å²	56	113 Å²	113	58%	0.577	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.7	-13.3	177.4	0	0	0	0	0	115.2	L436	L436-G438 PolarHBondContact O-N 3.17Å
439	E	35.1	Very low	42.5	Very low	138 Å²	138	113 Å²	113	65%	0.645	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-83.8	139.2	173	-95.7	-173.8	143.8	0	0	112.3	V435 L436	V435-E439 HydrophobicContact CG1-CB 3.99Å; V435-E439 WeakPolarHBondContact CG1-O 3.41Å; L436-E439 PolarHBondContact O-N 3.38Å; L436-E439 VanDerWaalsContact O-N 3.16Å
440	R	37.4	Very low	41.8	Very low	213 Å²	213	112.6 Å²	112.6	80%	0.804	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-77.1	138.5	170.7	-74.2	-176.4	174.2	179.3	-0.8	108.9	R442	R440-R442 PolarHBondContact O-N 3.25Å
441	L	38.2	Very low	41.4	Very low	128 Å²	128	113.5 Å²	113.5	67%	0.67	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-49	129.4	164.4	-109.2	129.1	0	0	0	109	V435 E443	V435-L441 HydrophobicContact CG2-CG 4.46Å; L441-E443 PolarHBondContact O-N 3.41Å
442	R	39.9	Very low	41.3	Very low	189 Å²	189	112.4 Å²	112.4	71%	0.713	59%	0.594	S	S	*	*			trans	-57.3	113.4	170	-86.2	-176.2	166.5	-170	0.1	108	R440 S444	R440-R442 PolarHBondContact O-N 3.25Å; R442-S444 PolarHBondContact O-N 3.5Å
443	E	44.8	Very low	41.3	Very low	152 Å²	152	110.9 Å²	110.9	71%	0.71	59%	0.586	S	S	*	*			trans	-66.3	132.7	173.5	-67.3	-175.5	156.9	0	0	108.5	L441 K445	L441-E443 PolarHBondContact O-N 3.41Å; E443-K445 PolarHBondContact O-N 3.41Å
444	S	43.2	Very low	41.3	Very low	38 Å²	38	109.2 Å²	109.2	27%	0.266	59%	0.586	S	S	.	*			trans	-53.9	133.3	176.2	115.1	0	0	0	0	109.6	E399 R442 K446 K447 A448	E399-S444 WeakPolarHBondContact OE1-CB 3.31Å; E399-S444 PolarHBondContact OE1-OG 3.19Å; R442-S444 PolarHBondContact O-N 3.5Å; S444-K446 PolarHBondContact O-N 3.2Å; S444-K446 VanDerWaalsContact O-N 3.09Å; S444-K446 PolarHBondContact OG-N 3.08Å; S444-K447 WeakPolarHBondContact O-CB 3.21Å; S444-K447 PolarHBondContact O-N 2.66Å; S444-K447 PolarHBondContact OG-N 2.82Å; S444-A448 PolarHBondContact O-N 2.91Å
445	K	49.6	Very low	41.3	Very low	90 Å²	90	106.8 Å²	106.8	39%	0.391	58%	0.575	S	S	.	*	H	α-helix	trans	-59.6	-23.8	-179.7	-71.5	-179.8	-177.8	175.4	0	111.2	E426 E443 A448 K449	E426-K445 IonicContact OE2-NZ 3.62Å; E426-K445 PolarHBondContact OE2-NZ 3.3Å; E443-K445 PolarHBondContact O-N 3.41Å; K445-A448 PolarHBondContact O-N 2.74Å; K445-K449 WeakPolarHBondContact O-CB 3.2Å; K445-K449 WeakPolarHBondContact O-CG 3.39Å; K445-K449 PolarHBondContact O-N 3.31Å
446	K	44.7	Very low	41.4	Very low	118 Å²	118	109 Å²	109	51%	0.513	59%	0.593	S	S	.	*	H	α-helix	trans	-67.4	-36.1	173	-158.4	165.3	-171.2	167.3	0	112.1	D398 E399 S444 M450	D398-K446 PolarHBondContact O-NZ 3.18Å; E399-K446 VanDerWaalsContact CD-CB 3.46Å; E399-K446 WeakPolarHBondContact OE1-CB 3.42Å; E399-K446 PolarHBondContact OE1-N 2.8Å; E399-K446 VanDerWaalsContact OE1-N 3.08Å; E399-K446 WeakPolarHBondContact OE2-CD 3.49Å; S444-K446 PolarHBondContact O-N 3.2Å; S444-K446 VanDerWaalsContact O-N 3.09Å; S444-K446 PolarHBondContact OG-N 3.08Å; K446-M450 WeakPolarHBondContact O-CG 3.32Å; K446-M450 PolarHBondContact O-N 3.23Å
447	K	49.9	Very low	41.6	Very low	138 Å²	138	105.4 Å²	105.4	60%	0.6	58%	0.579	S	S	*	*	H	α-helix	trans	-68.2	-39.4	169.3	-89.7	-177.7	178.1	174.5	0	113.1	S444 M450 A453	S444-K447 WeakPolarHBondContact O-CB 3.21Å; S444-K447 PolarHBondContact O-N 2.66Å; S444-K447 PolarHBondContact OG-N 2.82Å; K447-M450 PolarHBondContact O-N 2.9Å; K447-A453 WeakPolarHBondContact O-CB 3.44Å
448	A	48	Very low	42	Very low	50 Å²	50	112.1 Å²	112.1	41%	0.413	60%	0.601	S	S	.	*	H	α-helix	trans	-72.3	-27.7	-179.6	0	0	0	0	0	113.6	S444 K445 A453	S444-A448 PolarHBondContact O-N 2.91Å; K445-A448 PolarHBondContact O-N 2.74Å; A448-A453 VanDerWaalsContact O-CB 3.31Å; A448-A453 WeakPolarHBondContact O-CB 3.29Å
449	K	47.4	Very low	41.6	Very low	160 Å²	160	118.2 Å²	118.2	70%	0.696	61%	0.606	S	S	*	*	H	α-helix	trans	-88.8	-8	176.7	-71.9	179.9	179.7	179	0	114.2	K445	K445-K449 WeakPolarHBondContact O-CB 3.2Å; K445-K449 WeakPolarHBondContact O-CG 3.39Å; K445-K449 PolarHBondContact O-N 3.31Å
450	M	42.3	Very low	41.9	Very low	100 Å²	100	118.8 Å²	118.8	49%	0.493	61%	0.613	S	S	.	*	S	Bend	trans	-62.7	145.4	174.3	-67.4	-144.8	-66.9	0	0	110.9	K446 K447 S452 A453	K446-M450 WeakPolarHBondContact O-CG 3.32Å; K446-M450 PolarHBondContact O-N 3.23Å; K447-M450 PolarHBondContact O-N 2.9Å; M450-S452 WeakPolarHBondContact CB-OG 3.29Å; M450-S452 PolarHBondContact O-N 2.77Å; M450-A453 PolarHBondContact O-N 2.77Å
451	A	40.2	Very low	41.9	Very low	89 Å²	89	118 Å²	118	74%	0.736	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-15.4	176.3	0	0	0	0	0	113.9
452	S	43.8	Very low	41.9	Very low	90 Å²	90	114.2 Å²	114.2	63%	0.629	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-21.3	171.8	53.2	0	0	0	0	114.3	M450	M450-S452 WeakPolarHBondContact CB-OG 3.29Å; M450-S452 PolarHBondContact O-N 2.77Å
453	A	42.4	Very low	42.1	Very low	56 Å²	56	113.2 Å²	113.2	46%	0.463	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.3	-28.3	-176.4	0	0	0	0	0	113.2	K447 A448 M450 S455	K447-A453 WeakPolarHBondContact O-CB 3.44Å; A448-A453 VanDerWaalsContact O-CB 3.31Å; A448-A453 WeakPolarHBondContact O-CB 3.29Å; M450-A453 PolarHBondContact O-N 2.77Å; A453-S455 VanDerWaalsContact C-N 3.26Å; A453-S455 PolarHBondContact O-N 2.72Å
454	T	40.7	Very low	42.6	Very low	108 Å²	108	108.5 Å²	108.5	66%	0.663	60%	0.595	S	S	*	*	S	Bend	trans	-83	2.8	173.5	25.9	0	0	0	0	114	S456	T454-S456 PolarHBondContact O-N 3.5Å
455	S	39	Very low	43.9	Very low	75 Å²	75	109.5 Å²	109.5	52%	0.524	60%	0.596	S	S	.	*			trans	-77.3	67.2	166.4	170.9	0	0	0	0	110.4	A453 S457	A453-S455 VanDerWaalsContact C-N 3.26Å; A453-S455 PolarHBondContact O-N 2.72Å; S455-S457 PolarHBondContact O-N 3.19Å
456	S	39.8	Very low	44.3	Very low	113 Å²	113	109.9 Å²	109.9	79%	0.79	62%	0.616	S	S	*	*			trans	-73.4	50.5	151.1	67.1	0	0	0	0	109.1	T454 Q458	T454-S456 PolarHBondContact O-N 3.5Å; S456-Q458 PolarHBondContact O-N 3.47Å; S456-Q458 VanDerWaalsContact O-N 3.1Å
457	S	37.7	Very low	45.3	Very low	55 Å²	55	110.4 Å²	110.4	39%	0.385	63%	0.633	S	S	.	*			trans	-74.2	103.2	164.8	102.7	0	0	0	0	105.1	S455 R459	S455-S457 PolarHBondContact O-N 3.19Å; S457-R459 PolarHBondContact O-N 2.97Å
458	Q	37.2	Very low	46.4	Very low	199 Å²	199	106.9 Å²	106.9	93%	0.93	62%	0.623	S	S	*	*			trans	-62.9	35.7	153.9	-78.8	-112.3	-21.2	0	0	110.9	S456	S456-Q458 PolarHBondContact O-N 3.47Å; S456-Q458 VanDerWaalsContact O-N 3.1Å
459	R	33.2	Very low	47.6	Very low	183 Å²	183	106.6 Å²	106.6	69%	0.691	63%	0.625	S	S	*	*			trans	-98.8	97.4	168.2	-76.8	-179.3	174.9	173.5	-1	105.9	S457 W461	S457-R459 PolarHBondContact O-N 2.97Å; R459-W461 VanDerWaalsContact C-N 3.27Å; R459-W461 PolarHBondContact O-N 3.22Å
460	D	40.8	Very low	49.1	Very low	150 Å²	150	104 Å²	104	80%	0.802	61%	0.611	S	S	*	*			trans	-59.5	96.1	159.6	-179.9	7	0	0	0	107.9	G462	D460-G462 PolarHBondContact O-N 2.97Å; D460-G462 VanDerWaalsContact O-N 3.09Å; D460-G462 PolarHBondContact OD1-N 2.91Å
461	W	37.4	Very low	50.6	Low	198 Å²	198	104.2 Å²	104.2	75%	0.75	62%	0.618	S	S	*	*			trans	-77	28	175.9	-75.4	97.4	0	0	0	112.6	R459 K463	R459-W461 VanDerWaalsContact C-N 3.27Å; R459-W461 PolarHBondContact O-N 3.22Å; W461-K463 PolarHBondContact O-N 3.42Å
462	G	37.6	Very low	52.4	Low	47 Å²	47	105.9 Å²	105.9	49%	0.485	61%	0.609	S	S	.	*			trans	46.4	66.8	164.7	0	0	0	0	0	114	D460	D460-G462 PolarHBondContact O-N 2.97Å; D460-G462 VanDerWaalsContact O-N 3.09Å; D460-G462 PolarHBondContact OD1-N 2.91Å
463	K	43.6	Very low	53.9	Low	169 Å²	169	106.7 Å²	106.7	74%	0.735	60%	0.602	S	S	*	*	S	Bend	trans	48.5	77.5	157.7	-60.5	177.8	-179.9	174	0	116.1	W461	W461-K463 PolarHBondContact O-N 3.42Å
464	G	56.6	Low	55.7	Low	53 Å²	53	104.6 Å²	104.6	55%	0.546	59%	0.585	S	S	.	*			trans	-139.2	151.8	170.3	0	0	0	0	0	114.3	A466	G464-A466 VanDerWaalsContact C-N 3.25Å; G464-A466 PolarHBondContact O-N 3.48Å
465	M	69.3	Low	57.4	Low	58 Å²	58	103.7 Å²	103.7	29%	0.286	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	14.7	-174.9	-64.4	-59.3	-64.6	0	0	115.2	V468 F496 V498 P672	M465-V468 HydrophobicContact CE-CB 3.99Å; M465-V468 HydrophobicContact CE-CG1 3.89Å; M465-V468 HydrophobicContact CE-CG2 4.29Å; M465-V468 HydrophobicContact SD-CB 4.42Å; M465-V468 HydrophobicContact SD-CG2 4.06Å; M465-F496 HydrophobicContact CB-CD1 3.88Å; M465-F496 HydrophobicContact CB-CE1 3.9Å; M465-F496 HydrophobicContact CB-CG 4.33Å; M465-F496 HydrophobicContact CB-CZ 4.36Å; M465-F496 HydrophobicContact CE-CD2 4.29Å; M465-F496 HydrophobicContact CE-CG 4.4Å; M465-F496 HydrophobicContact CG-CD1 3.84Å; M465-F496 HydrophobicContact CG-CD2 3.96Å; M465-F496 HydrophobicContact CG-CE1 3.62Å; M465-F496 HydrophobicContact CG-CE2 3.73Å; M465-F496 HydrophobicContact CG-CG 4Å; M465-F496 HydrophobicContact CG-CZ 3.56Å; M465-V498 HydrophobicContact CE-CG1 3.66Å; M465-P672 HydrophobicContact CE-CG 3.92Å; M465-P672 HydrophobicContact SD-CG 4.28Å
466	A	58.4	Low	59.2	Low	98 Å²	98	101.9 Å²	101.9	81%	0.81	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-34	-170.2	0	0	0	0	0	114	G464	G464-A466 VanDerWaalsContact C-N 3.25Å; G464-A466 PolarHBondContact O-N 3.48Å
467	C	65.4	Low	61	Low	130 Å²	130	96.7 Å²	96.7	88%	0.878	53%	0.527	S	S	*	.	S	Bend	trans	-118.1	12.6	-177.3	-56.7	0	0	0	0	112.8
468	V	73.4	Confident	62.8	Low	63 Å²	63	96.8 Å²	96.8	38%	0.382	53%	0.526	S	S	.	.			trans	-78.2	128	-174.2	179.8	0	0	0	0	110	M465	M465-V468 HydrophobicContact CE-CB 3.99Å; M465-V468 HydrophobicContact CE-CG1 3.89Å; M465-V468 HydrophobicContact CE-CG2 4.29Å; M465-V468 HydrophobicContact SD-CB 4.42Å; M465-V468 HydrophobicContact SD-CG2 4.06Å
469	G	73.5	Confident	64.8	Low	44 Å²	44	89.6 Å²	89.6	45%	0.454	50%	0.497	S	S	.	.			trans	-78.5	176.9	173	0	0	0	0	0	112.9
470	R	77.8	Confident	67.2	Low	106 Å²	106	83.8 Å²	83.8	40%	0.4	48%	0.48	S	S	.	.			trans	-69	138.5	173.7	-64.1	174.8	-70.5	168.9	6.8	109.7	E473 V498 S501 E502 H509	R470-E473 IonicContact CZ-OE1 3.59Å; R470-E473 IonicContact CZ-OE2 2.66Å; R470-E473 IonicContact NH1-OE1 2.64Å; R470-E473 PolarHBondContact NH1-OE1 2.79Å; R470-E473 IonicContact NH1-OE2 2.89Å; R470-E473 IonicContact NH2-OE1 3.59Å; R470-E473 IonicContact NH2-OE2 3.14Å; R470-V498 HydrophobicContact CG-CG2 4.12Å; R470-S501 WeakPolarHBondContact CD-OG 3.46Å; R470-E502 HydrophobicContact CB-CG 4.06Å; R470-E502 HydrophobicContact CG-CG 4.15Å; R470-H509 WeakPolarHBondContact CG-NE2 3.47Å
471	T	74.4	Confident	69.6	Low	105 Å²	105	77.2 Å²	77.2	64%	0.644	44%	0.444	S	S	*	.	S	Bend	trans	-90.2	-25.5	169.4	62.4	0	0	0	0	112	E502	T471-E502 WeakPolarHBondContact CB-OE1 3.37Å; T471-E502 PolarHBondContact N-OE1 2.9Å; T471-E502 PolarHBondContact OG1-OE1 3.46Å
472	K	77.3	Confident	72.2	Confident	124 Å²	124	70.1 Å²	70.1	54%	0.539	42%	0.418	S	S	.	.			trans	-140.2	154.2	-179.4	-61	175.7	-169.9	166.3	0	109.8	E502 E673	K472-E502 VanDerWaalsContact O-CG 3.31Å; K472-E502 WeakPolarHBondContact O-CG 3.31Å; K472-E673 IonicContact NZ-OE1 3.03Å; K472-E673 PolarHBondContact NZ-OE1 3.42Å
473	E	77.1	Confident	74.8	Confident	106 Å²	106	68.1 Å²	68.1	50%	0.495	40%	0.398	S	S	.	.			trans	-123.8	136.6	174.8	179.8	152.7	-147.3	0	0	110.4	R470 T475 R507	R470-E473 IonicContact CZ-OE1 3.59Å; R470-E473 IonicContact CZ-OE2 2.66Å; R470-E473 IonicContact NH1-OE1 2.64Å; R470-E473 PolarHBondContact NH1-OE1 2.79Å; R470-E473 IonicContact NH1-OE2 2.89Å; R470-E473 IonicContact NH2-OE1 3.59Å; R470-E473 IonicContact NH2-OE2 3.14Å; E473-T475 PolarHBondContact O-N 3.48Å; E473-T475 VanDerWaalsContact O-N 3.15Å; E473-R507 IonicContact OE1-NH1 3.93Å
474	C	78.5	Confident	77.1	Confident	13 Å²	13	63.2 Å²	63.2	9%	0.088	38%	0.383	C	S	.	.			trans	-70.6	108.6	176.1	179.1	0	0	0	0	110.2	E502 R507	C474-E502 WeakPolarHBondContact CB-O 3.26Å; C474-E502 PolarHBondContact N-O 3.25Å; C474-R507 PolarHBondContact O-NH1 2.63Å; C474-R507 PolarHBondContact O-NH2 2.52Å; C474-R507 VanDerWaalsContact O-NH2 3.1Å
475	T	77.3	Confident	78.7	Confident	89 Å²	89	60.9 Å²	60.9	55%	0.546	36%	0.358	S	S	.	.			trans	-100.6	-8.6	175.4	53.7	0	0	0	0	113	E473 V477 R857	E473-T475 PolarHBondContact O-N 3.48Å; E473-T475 VanDerWaalsContact O-N 3.15Å; T475-V477 PolarHBondContact O-N 2.59Å; T475-R857 PolarHBondContact O-NH2 2.89Å
476	I	75.9	Confident	79.3	Confident	37 Å²	37	58.2 Å²	58.2	19%	0.19	35%	0.345	C	S	.	.	S	Bend	trans	-61.6	-35.9	-178.5	-57.3	175.9	0	0	0	111.4	P486	I476-P486 HydrophobicContact CG2-CB 3.89Å; I476-P486 HydrophobicContact CG2-CG 3.8Å
477	V	77.9	Confident	80.4	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.024	31%	0.312	C	S	.	.	S	Bend	trans	-136.4	152	175.1	-64.9	0	0	0	0	109.7	T475 H481 I485 P486 R507	T475-V477 PolarHBondContact O-N 2.59Å; V477-H481 HydrophobicContact CB-CB 3.81Å; V477-H481 HydrophobicContact CG2-CB 3.84Å; V477-I485 HydrophobicContact CG2-CD1 3.63Å; V477-I485 HydrophobicContact CG2-CG2 4.45Å; V477-P486 HydrophobicContact CG1-CG 3.71Å; V477-R507 PolarHBondContact O-NH2 3.44Å
478	P	75.4	Confident	81.5	Confident	57 Å²	57	48.9 Å²	48.9	37%	0.37	28%	0.275	S	S	.	.			trans	-66.4	168.4	-179.8	29.2	-37	0	0	0	112.3	N480 H481 R507	P478-N480 VanDerWaalsContact C-N 3.26Å; P478-N480 WeakPolarHBondContact CB-OD1 3.17Å; P478-N480 PolarHBondContact O-N 2.83Å; P478-H481 HydrophobicContact CG-CB 4.33Å; P478-H481 VanDerWaalsContact O-CB 3.31Å; P478-H481 WeakPolarHBondContact O-CB 3.03Å; P478-H481 PolarHBondContact O-N 2.83Å; P478-R507 PolarHBondContact O-NH2 2.74Å
479	S	80.2	Confident	82.3	Confident	47 Å²	47	46.3 Å²	46.3	33%	0.329	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.9	-176.9	60.7	0	0	0	0	114	H481 H514	S479-H481 VanDerWaalsContact C-N 3.33Å; S479-H514 PolarHBondContact O-CE1 2.99Å
480	N	84.3	Confident	83.4	Confident	61 Å²	61	44.4 Å²	44.4	33%	0.326	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	16.5	179	62.4	-26.4	0	0	0	113.7	P478 Y482 Y522	P478-N480 VanDerWaalsContact C-N 3.26Å; P478-N480 WeakPolarHBondContact CB-OD1 3.17Å; P478-N480 PolarHBondContact O-N 2.83Å; N480-Y482 PolarHBondContact O-N 3.42Å; N480-Y522 VanDerWaalsContact CA-CZ 3.49Å; N480-Y522 HydrophobicContact CB-CE1 3.76Å; N480-Y522 HydrophobicContact CB-CE2 4.27Å; N480-Y522 WeakPolarHBondContact CB-OH 3.24Å; N480-Y522 WeakPolarHBondContact O-CD1 3.24Å; N480-Y522 WeakPolarHBondContact O-CE1 3.37Å
481	H	89.3	Confident	84.1	Confident	12 Å²	12	39.3 Å²	39.3	6%	0.056	22%	0.22	C	C	.	.			trans	-65.2	131.7	-179.8	178.3	72.5	0	0	0	112.9	V477 P478 S479 P484 R598	V477-H481 HydrophobicContact CB-CB 3.81Å; V477-H481 HydrophobicContact CG2-CB 3.84Å; P478-H481 HydrophobicContact CG-CB 4.33Å; P478-H481 VanDerWaalsContact O-CB 3.31Å; P478-H481 WeakPolarHBondContact O-CB 3.03Å; P478-H481 PolarHBondContact O-N 2.83Å; S479-H481 VanDerWaalsContact C-N 3.33Å; H481-P484 PolarHBondContact NE2-O 3.14Å; H481-R598 PolarHBondContact O-NH1 2.95Å; H481-R598 PolarHBondContact O-NH2 2.9Å
482	Y	92.3	Very high	85.1	Confident	49 Å²	49	34.7 Å²	34.7	19%	0.192	19%	0.191	C	C	.	.			trans	-95.9	143.3	171.4	-74.9	-79.3	0	0	0	111.7	N480 D519 G520 A521 Y522 K595	N480-Y482 PolarHBondContact O-N 3.42Å; Y482-D519 VanDerWaalsContact OH-CG 3.3Å; Y482-D519 PolarHBondContact OH-O 3.07Å; Y482-D519 PolarHBondContact OH-OD1 3.21Å; Y482-D519 VanDerWaalsContact OH-OD1 3.07Å; Y482-G520 WeakPolarHBondContact OH-CA 3.2Å; Y482-G520 PolarHBondContact OH-N 3.37Å; Y482-G520 VanDerWaalsContact OH-N 3.09Å; Y482-A521 WeakPolarHBondContact CE1-O 3.42Å; Y482-Y522 HydrophobicContact CD1-CD1 4.09Å; Y482-Y522 HydrophobicContact CD2-CD1 4.22Å; Y482-Y522 HydrophobicContact CD2-CE1 4.26Å; Y482-Y522 AromaticContact CE1-CD1 3.8Å; Y482-Y522 HydrophobicContact CE1-CD1 3.8Å; Y482-Y522 HydrophobicContact CE1-CE1 4.14Å; Y482-Y522 AromaticContact CE2-CD1 3.94Å; Y482-Y522 HydrophobicContact CE2-CD1 3.94Å; Y482-Y522 AromaticContact CE2-CE1 3.64Å; Y482-Y522 HydrophobicContact CE2-CE1 3.64Å; Y482-Y522 HydrophobicContact CG-CD1 4.29Å; Y482-Y522 AromaticContact CZ-CD1 3.72Å; Y482-Y522 AromaticContact CZ-CE1 3.57Å; Y482-K595 HydrophobicContact CD1-CB 4.18Å; Y482-K595 HydrophobicContact CE1-CB 3.96Å; Y482-K595 HydrophobicContact CE1-CD 3.9Å; Y482-K595 HydrophobicContact CE2-CD 4.36Å
483	G	92.3	Very high	86	Confident	6 Å²	6	30.3 Å²	30.3	6%	0.062	17%	0.173	C	C	.	.	S	Bend	trans	92.4	-170.1	178.5	0	0	0	0	0	113.9	R598	G483-R598 WeakPolarHBondContact O-CD 3.29Å; G483-R598 WeakPolarHBondContact O-CG 3.34Å; G483-R598 PolarHBondContact O-NH1 2.84Å
484	P	92.3	Very high	86.9	Confident	65 Å²	65	26.1 Å²	26.1	42%	0.422	15%	0.153	S	C	.	.	P	Polyproline II helix	trans	-62.4	153.1	-176.7	-21.8	33.2	0	0	0	112.6	H481 I622	H481-P484 PolarHBondContact NE2-O 3.14Å; P484-I622 HydrophobicContact CG-CD1 4Å; P484-I622 HydrophobicContact CG-CG1 3.77Å
485	I	89.7	Confident	87.5	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-86	126.6	170.2	-54.5	-59.8	0	0	0	108.3	V477 G487 I488 G504 V505	V477-I485 HydrophobicContact CG2-CD1 3.63Å; V477-I485 HydrophobicContact CG2-CG2 4.45Å; I485-G487 PolarHBondContact O-N 3.43Å; I485-I488 HydrophobicContact CB-CB 4.26Å; I485-I488 HydrophobicContact CB-CD1 3.95Å; I485-I488 HydrophobicContact CB-CG1 4.26Å; I485-I488 HydrophobicContact CG2-CD1 3.67Å; I485-I488 HydrophobicContact CG2-CG1 4.1Å; I485-I488 PolarHBondContact O-N 3.34Å; I485-I488 VanDerWaalsContact O-N 3.14Å; I485-G504 WeakPolarHBondContact CD1-O 3.09Å; I485-V505 HydrophobicContact CB-CG2 4.34Å; I485-V505 HydrophobicContact CG1-CB 4.39Å; I485-V505 HydrophobicContact CG1-CG2 3.83Å
486	P	83.5	Confident	88.2	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.019	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	135.3	176.9	-19.9	25.6	0	0	0	112	I476 V477 I488 F850 P851	I476-P486 HydrophobicContact CG2-CB 3.89Å; I476-P486 HydrophobicContact CG2-CG 3.8Å; V477-P486 HydrophobicContact CG1-CG 3.71Å; P486-I488 VanDerWaalsContact C-N 3.28Å; P486-I488 PolarHBondContact O-N 3.47Å; P486-F850 HydrophobicContact CB-CB 3.78Å; P486-F850 HydrophobicContact CB-CD1 4.25Å; P486-P851 WeakPolarHBondContact CG-O 3.31Å
487	G	80	Confident	89	Confident	11 Å²	11	26.7 Å²	26.7	11%	0.113	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	8.6	180	0	0	0	0	0	116.1	I485 Q776 L779	I485-G487 PolarHBondContact O-N 3.43Å; G487-Q776 PolarHBondContact O-NE2 2.74Å; G487-Q776 VanDerWaalsContact O-NE2 3.11Å; G487-Q776 PolarHBondContact O-OE1 3.36Å; G487-L779 VanDerWaalsContact CA-CD1 3.45Å
488	I	89.9	Confident	89.6	Confident	21 Å²	21	27.1 Å²	27.1	11%	0.108	15%	0.145	C	C	.	.			trans	-121.7	91.7	176.6	-54.7	-175.5	0	0	0	110.2	I485 P486 T492 W494 S503 V505 Y619	I485-I488 HydrophobicContact CB-CB 4.26Å; I485-I488 HydrophobicContact CB-CD1 3.95Å; I485-I488 HydrophobicContact CB-CG1 4.26Å; I485-I488 HydrophobicContact CG2-CD1 3.67Å; I485-I488 HydrophobicContact CG2-CG1 4.1Å; I485-I488 PolarHBondContact O-N 3.34Å; I485-I488 VanDerWaalsContact O-N 3.14Å; P486-I488 VanDerWaalsContact C-N 3.28Å; P486-I488 PolarHBondContact O-N 3.47Å; I488-T492 HydrophobicContact CG2-CG2 4.15Å; I488-W494 HydrophobicContact CD1-CZ2 4.4Å; I488-W494 HydrophobicContact CG2-CH2 3.61Å; I488-W494 HydrophobicContact CG2-CZ2 3.78Å; I488-S503 WeakPolarHBondContact CD1-O 3.14Å; I488-V505 HydrophobicContact CB-CG2 4.4Å; I488-V505 HydrophobicContact CD1-CG2 3.74Å; I488-V505 HydrophobicContact CG2-CG2 3.81Å; I488-Y619 HydrophobicContact CG2-CD1 4.29Å
489	P	90.2	Very high	90.3	Very high	9 Å²	9	25.1 Å²	25.1	6%	0.058	13%	0.13	C	C	.	.			trans	-72.9	158.3	-179.4	29.9	-35.2	0	0	0	112.5	G491 T492 L665 L667	P489-G491 PolarHBondContact O-N 3.1Å; P489-T492 WeakPolarHBondContact CD-OG1 3.27Å; P489-T492 WeakPolarHBondContact O-CB 3.45Å; P489-T492 PolarHBondContact O-N 3.29Å; P489-T492 VanDerWaalsContact O-N 3.15Å; P489-T492 PolarHBondContact O-OG1 2.85Å; P489-L665 HydrophobicContact CB-CD1 4.1Å; P489-L665 HydrophobicContact CG-CD1 4.15Å; P489-L667 HydrophobicContact CG-CD1 3.99Å; P489-L667 HydrophobicContact CG-CD2 4.05Å
490	V	95.9	Very high	91.1	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.018	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	131.7	169.9	173.7	0	0	0	0	110	Y619 G621 E650 P653	V490-Y619 HydrophobicContact CG2-CD1 4.34Å; V490-Y619 HydrophobicContact CG2-CE1 4.01Å; V490-G621 VanDerWaalsContact CG2-CA 3.44Å; V490-E650 WeakPolarHBondContact CA-OE2 3.23Å; V490-E650 HydrophobicContact CB-CB 3.96Å; V490-E650 WeakPolarHBondContact CB-OE2 3.4Å; V490-E650 HydrophobicContact CG2-CB 3.84Å; V490-E650 HydrophobicContact CG2-CG 4.32Å; V490-E650 WeakPolarHBondContact CG2-OE2 3.37Å; V490-E650 PolarHBondContact N-OE2 3.06Å; V490-P653 HydrophobicContact CG1-CG 3.53Å
491	G	93.4	Very high	91.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	-2.8	-173.9	0	0	0	0	0	114.7	P489 M493 Y619	P489-G491 PolarHBondContact O-N 3.1Å; G491-M493 WeakPolarHBondContact O-CG 3.42Å; G491-Y619 PolarHBondContact N-O 3.07Å
492	T	94.1	Very high	91.5	Very high	7 Å²	7	21.1 Å²	21.1	4%	0.043	11%	0.105	C	C	.	.			trans	-62.2	137	171.5	-55.8	0	0	0	0	110.5	I488 P489 W494 R618 Y619	I488-T492 HydrophobicContact CG2-CG2 4.15Å; P489-T492 WeakPolarHBondContact CD-OG1 3.27Å; P489-T492 WeakPolarHBondContact O-CB 3.45Å; P489-T492 PolarHBondContact O-N 3.29Å; P489-T492 VanDerWaalsContact O-N 3.15Å; P489-T492 PolarHBondContact O-OG1 2.85Å; T492-W494 HydrophobicContact CG2-CD2 4.43Å; T492-W494 HydrophobicContact CG2-CH2 3.57Å; T492-W494 HydrophobicContact CG2-CZ2 3.33Å; T492-W494 HydrophobicContact CG2-CZ3 4.23Å; T492-W494 WeakPolarHBondContact O-CZ3 3.49Å; T492-R618 WeakPolarHBondContact O-CA 3.45Å; T492-Y619 PolarHBondContact O-N 3.44Å
493	M	95.5	Very high	91.4	Very high	33 Å²	33	19.7 Å²	19.7	16%	0.163	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.6	-170.5	-69.6	166.4	-72.8	0	0	112.3	G491 N617 R618 I662 L667 M669 Q670	G491-M493 WeakPolarHBondContact O-CG 3.42Å; M493-N617 CarbonylContact C-O 3.49Å; M493-N617 VanDerWaalsContact CA-O 3.22Å; M493-N617 WeakPolarHBondContact CA-O 3.42Å; M493-R618 HydrophobicContact CG-CB 4.1Å; M493-R618 HydrophobicContact CG-CG 3.78Å; M493-I662 HydrophobicContact CE-CG2 4.32Å; M493-L667 HydrophobicContact CE-CB 4.39Å; M493-L667 WeakPolarHBondContact CE-O 3.23Å; M493-M669 HydrophobicContact CB-CE 3.92Å; M493-M669 HydrophobicContact CB-SD 3.92Å; M493-M669 HydrophobicContact CG-CE 4.44Å; M493-M669 HydrophobicContact SD-CE 4.48Å; M493-Q670 WeakPolarHBondContact O-CB 3.28Å; M493-Q670 VanDerWaalsContact O-CG 3.28Å; M493-Q670 WeakPolarHBondContact O-CG 3.49Å; M493-Q670 PolarHBondContact O-N 3.34Å
494	W	96.2	Very high	91.3	Very high	17 Å²	17	19.4 Å²	19.4	6%	0.064	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.8	176.4	-55.4	-91.4	0	0	0	111.8	I488 T492 F496 Q499 V500 S503 V505 G616 N617	I488-W494 HydrophobicContact CD1-CZ2 4.4Å; I488-W494 HydrophobicContact CG2-CH2 3.61Å; I488-W494 HydrophobicContact CG2-CZ2 3.78Å; T492-W494 HydrophobicContact CG2-CD2 4.43Å; T492-W494 HydrophobicContact CG2-CH2 3.57Å; T492-W494 HydrophobicContact CG2-CZ2 3.33Å; T492-W494 HydrophobicContact CG2-CZ3 4.23Å; T492-W494 WeakPolarHBondContact O-CZ3 3.49Å; W494-F496 PolarHBondContact O-N 3.38Å; W494-Q499 HydrophobicContact CB-CB 3.9Å; W494-Q499 HydrophobicContact CG-CB 4.04Å; W494-V500 HydrophobicContact CB-CG2 3.95Å; W494-V500 HydrophobicContact CD2-CG2 4.11Å; W494-V500 HydrophobicContact CE3-CG1 4.42Å; W494-V500 HydrophobicContact CE3-CG2 3.85Å; W494-V500 HydrophobicContact CG-CG2 4.2Å; W494-S503 WeakPolarHBondContact CZ2-OG 3.4Å; W494-V505 HydrophobicContact CH2-CB 4.47Å; W494-V505 HydrophobicContact CH2-CG2 3.83Å; W494-V505 HydrophobicContact CZ2-CG2 4.31Å; W494-G616 CarbonylContact O-C 3.46Å; W494-G616 WeakPolarHBondContact O-CA 3.19Å; W494-N617 PolarHBondContact N-O 2.8Å; W494-N617 PolarHBondContact O-N 3.45Å; W494-N617 PolarHBondContact O-ND2 3.29Å
495	R	92.4	Very high	91.5	Very high	69 Å²	69	16.3 Å²	16.3	26%	0.26	8%	0.079	S	C	.	.	S	Bend	trans	-69.9	-37	-176.6	-174	59.1	-177.4	81.9	-4.8	113	E615 M669 Q670 Y671	R495-E615 VanDerWaalsContact CD-OE1 3.23Å; R495-E615 WeakPolarHBondContact CD-OE1 3.49Å; R495-E615 IonicContact CZ-OE1 3.99Å; R495-E615 IonicContact NE-OE1 2.7Å; R495-E615 PolarHBondContact NE-OE1 3.49Å; R495-E615 IonicContact NH2-OE1 3.92Å; R495-M669 HydrophobicContact CB-CG 4.43Å; R495-M669 HydrophobicContact CB-SD 4.3Å; R495-M669 PolarHBondContact N-SD 3.02Å; R495-Q670 WeakPolarHBondContact CB-O 3.41Å; R495-Q670 PolarHBondContact N-O 3.44Å; R495-Y671 HydrophobicContact CB-CD1 3.71Å; R495-Y671 HydrophobicContact CB-CE1 3.95Å; R495-Y671 HydrophobicContact CB-CG 4.47Å; R495-Y671 HydrophobicContact CG-CD1 3.77Å; R495-Y671 HydrophobicContact CG-CE1 3.75Å
496	F	92.5	Very high	91.9	Very high	37 Å²	37	16.1 Å²	16.1	16%	0.162	8%	0.078	C	C	.	.	S	Bend	trans	-125.1	153.4	-174.6	-60.6	-75.1	0	0	0	113.1	M465 W494 V498 Q499 V500 P672 Y675	M465-F496 HydrophobicContact CB-CD1 3.88Å; M465-F496 HydrophobicContact CB-CE1 3.9Å; M465-F496 HydrophobicContact CB-CG 4.33Å; M465-F496 HydrophobicContact CB-CZ 4.36Å; M465-F496 HydrophobicContact CE-CD2 4.29Å; M465-F496 HydrophobicContact CE-CG 4.4Å; M465-F496 HydrophobicContact CG-CD1 3.84Å; M465-F496 HydrophobicContact CG-CD2 3.96Å; M465-F496 HydrophobicContact CG-CE1 3.62Å; M465-F496 HydrophobicContact CG-CE2 3.73Å; M465-F496 HydrophobicContact CG-CG 4Å; M465-F496 HydrophobicContact CG-CZ 3.56Å; W494-F496 PolarHBondContact O-N 3.38Å; F496-V498 VanDerWaalsContact C-N 3.28Å; F496-V498 HydrophobicContact CB-CG1 4.05Å; F496-V498 PolarHBondContact O-N 3.44Å; F496-Q499 VanDerWaalsContact N-OE1 3.09Å; F496-Q499 PolarHBondContact O-N 3.3Å; F496-V500 PolarHBondContact O-N 3.5Å; F496-P672 HydrophobicContact CD2-CG 3.53Å; F496-P672 HydrophobicContact CE2-CG 3.84Å; F496-Y675 HydrophobicContact CE2-CD2 4.07Å; F496-Y675 HydrophobicContact CE2-CE1 4.25Å; F496-Y675 AromaticContact CE2-CE2 3.75Å; F496-Y675 HydrophobicContact CE2-CE2 3.75Å; F496-Y675 HydrophobicContact CE2-CG 4.48Å; F496-Y675 AromaticContact CE2-CZ 3.85Å; F496-Y675 HydrophobicContact CZ-CD2 4.41Å; F496-Y675 HydrophobicContact CZ-CE1 4.41Å; F496-Y675 AromaticContact CZ-CE2 3.65Å; F496-Y675 HydrophobicContact CZ-CE2 3.65Å; F496-Y675 AromaticContact CZ-CZ 3.66Å
497	R	92.4	Very high	92.3	Very high	45 Å²	45	17.1 Å²	17.1	17%	0.17	8%	0.081	C	C	.	.	H	α-helix	trans	-61.6	-33	178.6	-78.2	-72.7	-60.5	-82.5	-1.4	113.2	Q499 V500 S501 H506 P508 H509 V510 A511 N617	R497-Q499 VanDerWaalsContact C-N 3.29Å; R497-Q499 PolarHBondContact O-N 3.45Å; R497-V500 WeakPolarHBondContact O-CB 3.3Å; R497-V500 PolarHBondContact O-N 3.46Å; R497-S501 PolarHBondContact O-N 3.33Å; R497-S501 VanDerWaalsContact O-N 3.07Å; R497-H506 PolarHBondContact NH2-CD2 3.16Å; R497-H506 PolarHBondContact NH2-NE2 3.19Å; R497-P508 PolarHBondContact NH2-O 3.16Å; R497-H509 WeakPolarHBondContact CB-O 3.14Å; R497-V510 PolarHBondContact NH1-O 3.2Å; R497-V510 VanDerWaalsContact NH1-O 3.14Å; R497-V510 PolarHBondContact NH2-O 3.03Å; R497-A511 PolarHBondContact NH2-O 2.99Å; R497-N617 WeakPolarHBondContact CD-OD1 3.49Å
498	V	88.9	Confident	92.8	Very high	14 Å²	14	18 Å²	18	9%	0.085	8%	0.084	C	C	.	.	H	α-helix	trans	-59.4	-40.4	176	65.8	0	0	0	0	111.4	M465 R470 F496 V500 S501 E502	M465-V498 HydrophobicContact CE-CG1 3.66Å; R470-V498 HydrophobicContact CG-CG2 4.12Å; F496-V498 VanDerWaalsContact C-N 3.28Å; F496-V498 HydrophobicContact CB-CG1 4.05Å; F496-V498 PolarHBondContact O-N 3.44Å; V498-V500 VanDerWaalsContact C-N 3.33Å; V498-V500 PolarHBondContact O-N 3.04Å; V498-S501 CarbonylContact O-C 3.37Å; V498-S501 WeakPolarHBondContact O-CA 3.37Å; V498-S501 VanDerWaalsContact O-CB 3.25Å; V498-S501 WeakPolarHBondContact O-CB 3.43Å; V498-S501 PolarHBondContact O-N 3.35Å; V498-E502 HydrophobicContact CG2-CG 4.47Å; V498-E502 VanDerWaalsContact O-CG 3.3Å; V498-E502 WeakPolarHBondContact O-CG 3.2Å; V498-E502 PolarHBondContact O-N 2.95Å
499	Q	91.9	Very high	92.5	Very high	14 Å²	14	20.3 Å²	20.3	7%	0.065	10%	0.095	C	C	.	.	H	α-helix	trans	-69.5	-30.6	178.2	-60.3	173.6	-81	0	0	113	W494 F496 R497 S501 E502 S503 Q670 Y671 P672	W494-Q499 HydrophobicContact CB-CB 3.9Å; W494-Q499 HydrophobicContact CG-CB 4.04Å; F496-Q499 VanDerWaalsContact N-OE1 3.09Å; F496-Q499 PolarHBondContact O-N 3.3Å; R497-Q499 VanDerWaalsContact C-N 3.29Å; R497-Q499 PolarHBondContact O-N 3.45Å; Q499-S501 PolarHBondContact O-N 3.36Å; Q499-E502 WeakPolarHBondContact CA-OE2 3.38Å; Q499-S503 WeakPolarHBondContact O-CB 3.44Å; Q499-S503 PolarHBondContact O-N 2.9Å; Q499-Q670 PolarHBondContact NE2-O 3.41Å; Q499-Q670 PolarHBondContact OE1-O 2.77Å; Q499-Y671 PolarHBondContact NE2-O 2.87Å; Q499-P672 HydrophobicContact CG-CG 4.41Å
500	V	95.2	Very high	92.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.2	-29	171.5	-168.1	0	0	0	0	111.1	W494 F496 R497 V498 S503 V505 H506 V600 N617	W494-V500 HydrophobicContact CB-CG2 3.95Å; W494-V500 HydrophobicContact CD2-CG2 4.11Å; W494-V500 HydrophobicContact CE3-CG1 4.42Å; W494-V500 HydrophobicContact CE3-CG2 3.85Å; W494-V500 HydrophobicContact CG-CG2 4.2Å; F496-V500 PolarHBondContact O-N 3.5Å; R497-V500 WeakPolarHBondContact O-CB 3.3Å; R497-V500 PolarHBondContact O-N 3.46Å; V498-V500 VanDerWaalsContact C-N 3.33Å; V498-V500 PolarHBondContact O-N 3.04Å; V500-S503 PolarHBondContact O-OG 3.29Å; V500-V505 HydrophobicContact CG1-CB 4.14Å; V500-V505 HydrophobicContact CG1-CG1 4.34Å; V500-V505 PolarHBondContact O-N 3.06Å; V500-H506 CarbonylContact C-O 3.31Å; V500-H506 HydrophobicContact CG1-CB 3.85Å; V500-H506 PolarHBondContact O-N 2.77Å; V500-V600 HydrophobicContact CG1-CG1 4.35Å; V500-V600 HydrophobicContact CG1-CG2 4.03Å; V500-N617 HydrophobicContact CG2-CB 3.62Å
501	S	92.9	Very high	92	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-76	-46.2	174	176.7	0	0	0	0	112.1	R470 R497 V498 Q499 S503 G504 H506 R507 H509	R470-S501 WeakPolarHBondContact CD-OG 3.46Å; R497-S501 PolarHBondContact O-N 3.33Å; R497-S501 VanDerWaalsContact O-N 3.07Å; V498-S501 CarbonylContact O-C 3.37Å; V498-S501 WeakPolarHBondContact O-CA 3.37Å; V498-S501 VanDerWaalsContact O-CB 3.25Å; V498-S501 WeakPolarHBondContact O-CB 3.43Å; V498-S501 PolarHBondContact O-N 3.35Å; Q499-S501 PolarHBondContact O-N 3.36Å; S501-S503 PolarHBondContact O-N 3.35Å; S501-G504 PolarHBondContact O-N 3.17Å; S501-H506 VanDerWaalsContact CA-O 3.23Å; S501-H506 WeakPolarHBondContact CA-O 3.31Å; S501-H506 PolarHBondContact N-O 3.12Å; S501-R507 WeakPolarHBondContact CB-O 3.34Å; S501-R507 WeakPolarHBondContact OG-CA 3.14Å; S501-R507 PolarHBondContact OG-O 3.35Å; S501-H509 PolarHBondContact OG-NE2 2.79Å
502	E	89.1	Confident	91.9	Very high	36 Å²	36	27.1 Å²	27.1	17%	0.168	15%	0.147	C	C	.	.	H	α-helix	trans	-55.5	-36.6	174.4	-65.9	173.1	154.9	0	0	111.4	R470 T471 K472 C474 V498 Q499 G504	R470-E502 HydrophobicContact CB-CG 4.06Å; R470-E502 HydrophobicContact CG-CG 4.15Å; T471-E502 WeakPolarHBondContact CB-OE1 3.37Å; T471-E502 PolarHBondContact N-OE1 2.9Å; T471-E502 PolarHBondContact OG1-OE1 3.46Å; K472-E502 VanDerWaalsContact O-CG 3.31Å; K472-E502 WeakPolarHBondContact O-CG 3.31Å; C474-E502 WeakPolarHBondContact CB-O 3.26Å; C474-E502 PolarHBondContact N-O 3.25Å; V498-E502 HydrophobicContact CG2-CG 4.47Å; V498-E502 VanDerWaalsContact O-CG 3.3Å; V498-E502 WeakPolarHBondContact O-CG 3.2Å; V498-E502 PolarHBondContact O-N 2.95Å; Q499-E502 WeakPolarHBondContact CA-OE2 3.38Å; E502-G504 VanDerWaalsContact C-N 3.26Å; E502-G504 PolarHBondContact O-N 3.43Å
503	S	91.4	Very high	91.9	Very high	19 Å²	19	27 Å²	27	13%	0.133	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-11	177.6	82.5	0	0	0	0	114.2	I488 W494 Q499 V500 S501 V505	I488-S503 WeakPolarHBondContact CD1-O 3.14Å; W494-S503 WeakPolarHBondContact CZ2-OG 3.4Å; Q499-S503 WeakPolarHBondContact O-CB 3.44Å; Q499-S503 PolarHBondContact O-N 2.9Å; V500-S503 PolarHBondContact O-OG 3.29Å; S501-S503 PolarHBondContact O-N 3.35Å; S503-V505 PolarHBondContact O-N 3Å; S503-V505 WeakPolarHBondContact OG-CG2 3.34Å
504	G	90.2	Very high	91.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-8.5	-178.5	0	0	0	0	0	114.9	I485 S501 E502 H506	I485-G504 WeakPolarHBondContact CD1-O 3.09Å; S501-G504 PolarHBondContact O-N 3.17Å; E502-G504 VanDerWaalsContact C-N 3.26Å; E502-G504 PolarHBondContact O-N 3.43Å; G504-H506 PolarHBondContact O-N 3.5Å
505	V	95.8	Very high	91.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	-61.7	-46.7	-179.4	175.2	0	0	0	0	110.7	I485 I488 W494 V500 S503 S523 R598 V600 Y619	I485-V505 HydrophobicContact CB-CG2 4.34Å; I485-V505 HydrophobicContact CG1-CB 4.39Å; I485-V505 HydrophobicContact CG1-CG2 3.83Å; I488-V505 HydrophobicContact CB-CG2 4.4Å; I488-V505 HydrophobicContact CD1-CG2 3.74Å; I488-V505 HydrophobicContact CG2-CG2 3.81Å; W494-V505 HydrophobicContact CH2-CB 4.47Å; W494-V505 HydrophobicContact CH2-CG2 3.83Å; W494-V505 HydrophobicContact CZ2-CG2 4.31Å; V500-V505 HydrophobicContact CG1-CB 4.14Å; V500-V505 HydrophobicContact CG1-CG1 4.34Å; V500-V505 PolarHBondContact O-N 3.06Å; S503-V505 PolarHBondContact O-N 3Å; S503-V505 WeakPolarHBondContact OG-CG2 3.34Å; V505-S523 WeakPolarHBondContact O-CB 3.33Å; V505-S523 PolarHBondContact O-OG 3.47Å; V505-R598 PolarHBondContact O-NE 2.82Å; V505-V600 HydrophobicContact CG1-CG2 3.58Å; V505-Y619 HydrophobicContact CG1-CD2 3.76Å; V505-Y619 HydrophobicContact CG1-CE2 4.32Å; V505-Y619 HydrophobicContact CG1-CG 4.14Å
506	H	97.4	Very high	91.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-144.3	97.1	175.3	-177.2	83	0	0	0	110.4	R497 V500 S501 G504 P508 A511 G512 S523 V525 V600	R497-H506 PolarHBondContact NH2-CD2 3.16Å; R497-H506 PolarHBondContact NH2-NE2 3.19Å; V500-H506 CarbonylContact C-O 3.31Å; V500-H506 HydrophobicContact CG1-CB 3.85Å; V500-H506 PolarHBondContact O-N 2.77Å; S501-H506 VanDerWaalsContact CA-O 3.23Å; S501-H506 WeakPolarHBondContact CA-O 3.31Å; S501-H506 PolarHBondContact N-O 3.12Å; G504-H506 PolarHBondContact O-N 3.5Å; H506-P508 PolarHBondContact CD2-O 3.46Å; H506-P508 PolarHBondContact NE2-O 3.47Å; H506-A511 PolarHBondContact NE2-O 3.01Å; H506-G512 PolarHBondContact CE1-O 2.82Å; H506-S523 WeakPolarHBondContact CA-OG 3.25Å; H506-S523 PolarHBondContact ND1-OG 3.29Å; H506-V525 HydrophobicContact CB-CG2 4.35Å; H506-V525 VanDerWaalsContact CD2-CG2 3.42Å; H506-V525 WeakPolarHBondContact CD2-CG2 3.36Å; H506-V600 HydrophobicContact CB-CG2 4.29Å
507	R	91.9	Very high	91.2	Very high	25 Å²	25	30.3 Å²	30.3	9%	0.094	17%	0.169	C	C	.	.			trans	-66.9	-33.7	-170.7	-60.4	-169	-176.6	-116.2	4.5	115.3	E473 C474 V477 P478 S501 H509	E473-R507 IonicContact OE1-NH1 3.93Å; C474-R507 PolarHBondContact O-NH1 2.63Å; C474-R507 PolarHBondContact O-NH2 2.52Å; C474-R507 VanDerWaalsContact O-NH2 3.1Å; V477-R507 PolarHBondContact O-NH2 3.44Å; P478-R507 PolarHBondContact O-NH2 2.74Å; S501-R507 WeakPolarHBondContact CB-O 3.34Å; S501-R507 WeakPolarHBondContact OG-CA 3.14Å; S501-R507 PolarHBondContact OG-O 3.35Å; R507-H509 PolarHBondContact O-N 3.06Å
508	P	91	Very high	90.9	Very high	28 Å²	28	34.7 Å²	34.7	18%	0.182	20%	0.195	C	C	.	.			trans	-65.6	133.3	175.7	-23.5	34.1	0	0	0	112.7	R497 H506 A511 H514	R497-P508 PolarHBondContact NH2-O 3.16Å; H506-P508 PolarHBondContact CD2-O 3.46Å; H506-P508 PolarHBondContact NE2-O 3.47Å; P508-A511 HydrophobicContact CB-CB 3.87Å; P508-H514 VanDerWaalsContact CD-CB 3.46Å; P508-H514 VanDerWaalsContact CD-CG 3.46Å; P508-H514 HydrophobicContact CG-CB 3.58Å
509	H	84.8	Confident	91	Very high	70 Å²	70	36.2 Å²	36.2	32%	0.324	20%	0.203	S	C	.	.	S	Bend	trans	-73.6	-31.9	179	-70.4	-168.5	0	0	0	112.9	R470 R497 S501 R507	R470-H509 WeakPolarHBondContact CG-NE2 3.47Å; R497-H509 WeakPolarHBondContact CB-O 3.14Å; S501-H509 PolarHBondContact OG-NE2 2.79Å; R507-H509 PolarHBondContact O-N 3.06Å
510	V	86.5	Confident	91	Very high	80 Å²	80	35.5 Å²	35.5	49%	0.485	20%	0.2	S	C	.	.	S	Bend	trans	-120.5	-52.7	-171.8	-177.4	0	0	0	0	111.4	R497 R555	R497-V510 PolarHBondContact NH1-O 3.2Å; R497-V510 VanDerWaalsContact NH1-O 3.14Å; R497-V510 PolarHBondContact NH2-O 3.03Å; V510-R555 HydrophobicContact CG1-CB 4.11Å; V510-R555 HydrophobicContact CG1-CG 4.49Å
511	A	87.8	Confident	91.1	Very high	50 Å²	50	35.5 Å²	35.5	41%	0.413	20%	0.2	S	C	.	.			trans	-53.5	146.3	-174	0	0	0	0	0	112.5	R497 H506 P508	R497-A511 PolarHBondContact NH2-O 2.99Å; H506-A511 PolarHBondContact NE2-O 3.01Å; P508-A511 HydrophobicContact CB-CB 3.87Å
512	G	91.4	Very high	91.2	Very high	26 Å²	26	35.6 Å²	35.6	27%	0.268	20%	0.2	S	C	.	.	S	Bend	trans	-74.5	-33.6	178.1	0	0	0	0	0	112.9	H506 L524 V525 Y542	H506-G512 PolarHBondContact CE1-O 2.82Å; G512-L524 CarbonylContact O-C 3.5Å; G512-L524 WeakPolarHBondContact O-CA 3.1Å; G512-L524 WeakPolarHBondContact O-CB 3.11Å; G512-V525 PolarHBondContact O-N 3.27Å; G512-Y542 PolarHBondContact O-OH 3.02Å
513	I	94.4	Very high	91.7	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.2	-176.7	-58.5	167.8	0	0	0	109.2	A521 L524 Y542 T568 L572	I513-A521 HydrophobicContact CG2-CB 3.98Å; I513-L524 HydrophobicContact CG1-CB 4.45Å; I513-Y542 HydrophobicContact CD1-CE1 3.92Å; I513-Y542 HydrophobicContact CG1-CE1 3.71Å; I513-T568 HydrophobicContact CB-CG2 4.11Å; I513-T568 HydrophobicContact CG2-CG2 4.13Å; I513-L572 HydrophobicContact CD1-CB 4.42Å; I513-L572 HydrophobicContact CD1-CD2 3.97Å
514	H	96.2	Very high	92	Very high	31 Å²	31	33 Å²	33	14%	0.144	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.3	166.7	-177.8	-148.4	0	0	0	108.5	S479 P508 A521 Y522 S523	S479-H514 PolarHBondContact O-CE1 2.99Å; P508-H514 VanDerWaalsContact CD-CB 3.46Å; P508-H514 VanDerWaalsContact CD-CG 3.46Å; P508-H514 HydrophobicContact CG-CB 3.58Å; H514-A521 CarbonylContact O-C 3.56Å; H514-A521 WeakPolarHBondContact O-CA 3.49Å; H514-Y522 AromaticContact CE1-CD2 3.57Å; H514-Y522 AromaticContact CG-CD2 3.92Å; H514-Y522 AromaticContact ND1-CD2 3.65Å; H514-Y522 AromaticContact NE2-CD2 3.83Å; H514-Y522 PolarHBondContact O-N 3.19Å; H514-S523 VanDerWaalsContact CB-OG 3.24Å; H514-S523 WeakPolarHBondContact CB-OG 3.25Å; H514-S523 PolarHBondContact N-O 3.41Å; H514-S523 PolarHBondContact O-N 2.81Å
515	G	90.6	Very high	92.3	Very high	20 Å²	20	33.2 Å²	33.2	21%	0.206	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	163.7	-179.9	0	0	0	0	0	112.6	G520	G515-G520 CarbonylContact C-O 3.57Å; G515-G520 WeakPolarHBondContact CA-O 3.29Å
516	R	85.5	Confident	92.4	Very high	136 Å²	136	33.6 Å²	33.6	51%	0.513	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.2	171.1	-65.8	-179.7	-178.5	179.7	-1.9	108.7	N518 D519 G520 Y522 A571	R516-N518 PolarHBondContact O-N 2.71Å; R516-N518 VanDerWaalsContact O-N 3.08Å; R516-D519 HydrophobicContact CB-CB 4.23Å; R516-D519 PolarHBondContact O-N 3.14Å; R516-D519 VanDerWaalsContact O-N 3.15Å; R516-G520 PolarHBondContact N-O 3.32Å; R516-G520 PolarHBondContact O-N 2.81Å; R516-Y522 WeakPolarHBondContact CD-OH 3.48Å; R516-Y522 HydrophobicContact CG-CE2 4.24Å; R516-Y522 WeakPolarHBondContact CG-OH 3.35Å; R516-A571 VanDerWaalsContact O-CB 3.25Å; R516-A571 WeakPolarHBondContact O-CB 3.44Å
517	S	90	Very high	92.1	Very high	38 Å²	38	34.9 Å²	34.9	27%	0.266	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.7	-174.8	49.9	0	0	0	0	113.4	N567 R570 L574	S517-N567 WeakPolarHBondContact CA-O 3.13Å; S517-R570 PolarHBondContact O-NH1 3.17Å; S517-L574 WeakPolarHBondContact O-CD1 3.44Å
518	N	86.4	Confident	91.7	Very high	137 Å²	137	35.5 Å²	35.5	73%	0.733	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.4	-175.6	-60.7	-15	0	0	0	114.3	R516	R516-N518 PolarHBondContact O-N 2.71Å; R516-N518 VanDerWaalsContact O-N 3.08Å
519	D	89.9	Confident	91.3	Very high	45 Å²	45	36.1 Å²	36.1	24%	0.241	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-60.5	-176.9	175.9	23.5	0	0	0	110.8	Y482 R516 Y522 K595	Y482-D519 VanDerWaalsContact OH-CG 3.3Å; Y482-D519 PolarHBondContact OH-O 3.07Å; Y482-D519 PolarHBondContact OH-OD1 3.21Å; Y482-D519 VanDerWaalsContact OH-OD1 3.07Å; R516-D519 HydrophobicContact CB-CB 4.23Å; R516-D519 PolarHBondContact O-N 3.14Å; R516-D519 VanDerWaalsContact O-N 3.15Å; D519-Y522 WeakPolarHBondContact OD2-CE1 3.4Å; D519-Y522 PolarHBondContact OD2-OH 2.85Å; D519-K595 PolarHBondContact O-NZ 2.78Å; D519-K595 IonicContact OD1-NZ 3.69Å; D519-K595 PolarHBondContact OD1-NZ 3.15Å; D519-K595 VanDerWaalsContact OD1-NZ 3.14Å
520	G	92.6	Very high	91.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-175.3	174	0	0	0	0	0	112.9	Y482 G515 R516 A571	Y482-G520 WeakPolarHBondContact OH-CA 3.2Å; Y482-G520 PolarHBondContact OH-N 3.37Å; Y482-G520 VanDerWaalsContact OH-N 3.09Å; G515-G520 CarbonylContact C-O 3.57Å; G515-G520 WeakPolarHBondContact CA-O 3.29Å; R516-G520 PolarHBondContact N-O 3.32Å; R516-G520 PolarHBondContact O-N 2.81Å; G520-A571 CarbonylContact C-O 3.56Å; G520-A571 WeakPolarHBondContact CA-O 3.43Å
521	A	96.7	Very high	91.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128.7	177.3	0	0	0	0	0	112.5	Y482 I513 H514 A571 L572 N575	Y482-A521 WeakPolarHBondContact CE1-O 3.42Å; I513-A521 HydrophobicContact CG2-CB 3.98Å; H514-A521 CarbonylContact O-C 3.56Å; H514-A521 WeakPolarHBondContact O-CA 3.49Å; A521-A571 HydrophobicContact CB-CB 4.49Å; A521-A571 PolarHBondContact N-O 2.81Å; A521-L572 HydrophobicContact CB-CB 4.07Å; A521-L572 HydrophobicContact CB-CD1 3.76Å; A521-N575 PolarHBondContact N-OD1 3.24Å; A521-N575 PolarHBondContact O-ND2 3.4Å; A521-N575 PolarHBondContact O-OD1 3.31Å
522	Y	95.9	Very high	91.2	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-34.7	-179.4	-43.8	-63.3	0	0	0	112.1	N480 Y482 H514 R516 D519 R598	N480-Y522 VanDerWaalsContact CA-CZ 3.49Å; N480-Y522 HydrophobicContact CB-CE1 3.76Å; N480-Y522 HydrophobicContact CB-CE2 4.27Å; N480-Y522 WeakPolarHBondContact CB-OH 3.24Å; N480-Y522 WeakPolarHBondContact O-CD1 3.24Å; N480-Y522 WeakPolarHBondContact O-CE1 3.37Å; Y482-Y522 HydrophobicContact CD1-CD1 4.09Å; Y482-Y522 HydrophobicContact CD2-CD1 4.22Å; Y482-Y522 HydrophobicContact CD2-CE1 4.26Å; Y482-Y522 AromaticContact CE1-CD1 3.8Å; Y482-Y522 HydrophobicContact CE1-CD1 3.8Å; Y482-Y522 HydrophobicContact CE1-CE1 4.14Å; Y482-Y522 AromaticContact CE2-CD1 3.94Å; Y482-Y522 HydrophobicContact CE2-CD1 3.94Å; Y482-Y522 AromaticContact CE2-CE1 3.64Å; Y482-Y522 HydrophobicContact CE2-CE1 3.64Å; Y482-Y522 HydrophobicContact CG-CD1 4.29Å; Y482-Y522 AromaticContact CZ-CD1 3.72Å; Y482-Y522 AromaticContact CZ-CE1 3.57Å; H514-Y522 AromaticContact CE1-CD2 3.57Å; H514-Y522 AromaticContact CG-CD2 3.92Å; H514-Y522 AromaticContact ND1-CD2 3.65Å; H514-Y522 AromaticContact NE2-CD2 3.83Å; H514-Y522 PolarHBondContact O-N 3.19Å; R516-Y522 WeakPolarHBondContact CD-OH 3.48Å; R516-Y522 HydrophobicContact CG-CE2 4.24Å; R516-Y522 WeakPolarHBondContact CG-OH 3.35Å; D519-Y522 WeakPolarHBondContact OD2-CE1 3.4Å; D519-Y522 PolarHBondContact OD2-OH 2.85Å; Y522-R598 PolarHBondContact O-N 3.19Å
523	S	98.4	Very high	91.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	157.5	-176.5	62.9	0	0	0	0	112.5	V505 H506 H514 R598	V505-S523 WeakPolarHBondContact O-CB 3.33Å; V505-S523 PolarHBondContact O-OG 3.47Å; H506-S523 WeakPolarHBondContact CA-OG 3.25Å; H506-S523 PolarHBondContact ND1-OG 3.29Å; H514-S523 VanDerWaalsContact CB-OG 3.24Å; H514-S523 WeakPolarHBondContact CB-OG 3.25Å; H514-S523 PolarHBondContact N-O 3.41Å; H514-S523 PolarHBondContact O-N 2.81Å; S523-R598 CarbonylContact C-O 3.54Å; S523-R598 WeakPolarHBondContact CA-O 3.28Å; S523-R598 WeakPolarHBondContact CB-O 3.44Å
524	L	98.3	Very high	91.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	165.6	172.9	66.5	75.1	0	0	0	113.5	G512 I513 L526 F540 Y542 L572 V597 R598 V599 V600 L644	G512-L524 CarbonylContact O-C 3.5Å; G512-L524 WeakPolarHBondContact O-CA 3.1Å; G512-L524 WeakPolarHBondContact O-CB 3.11Å; I513-L524 HydrophobicContact CG1-CB 4.45Å; L524-L526 HydrophobicContact CD1-CG 4.49Å; L524-F540 HydrophobicContact CD1-CE2 4.05Å; L524-F540 HydrophobicContact CD1-CZ 3.93Å; L524-F540 HydrophobicContact CD2-CE2 4.41Å; L524-F540 HydrophobicContact CD2-CZ 4.5Å; L524-Y542 HydrophobicContact CD1-CD2 4.11Å; L524-Y542 HydrophobicContact CD1-CE2 3.88Å; L524-Y542 HydrophobicContact CD2-CD1 4.19Å; L524-Y542 HydrophobicContact CD2-CD2 4.35Å; L524-Y542 HydrophobicContact CD2-CE1 4.34Å; L524-Y542 HydrophobicContact CD2-CE2 4.49Å; L524-Y542 HydrophobicContact CD2-CG 4.2Å; L524-L572 HydrophobicContact CD2-CD1 4.23Å; L524-L572 HydrophobicContact CD2-CD2 4.22Å; L524-V597 HydrophobicContact CB-CG1 4.42Å; L524-V597 HydrophobicContact CD2-CG1 3.95Å; L524-V597 HydrophobicContact CG-CG1 3.84Å; L524-R598 PolarHBondContact N-O 3.47Å; L524-V599 HydrophobicContact CD1-CB 4.48Å; L524-V599 HydrophobicContact CD1-CG1 4.12Å; L524-V599 HydrophobicContact CD1-CG2 4.04Å; L524-V599 HydrophobicContact CG-CG2 4.29Å; L524-V600 PolarHBondContact O-N 2.73Å; L524-L644 HydrophobicContact CD2-CD1 4.29Å; L524-L644 HydrophobicContact CD2-CD2 3.75Å
525	V	97.9	Very high	91.4	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.024	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.7	179.3	-170.6	0	0	0	0	111.5	H506 G512 A527 Y542 V600 N602	H506-V525 HydrophobicContact CB-CG2 4.35Å; H506-V525 VanDerWaalsContact CD2-CG2 3.42Å; H506-V525 WeakPolarHBondContact CD2-CG2 3.36Å; G512-V525 PolarHBondContact O-N 3.27Å; V525-A527 HydrophobicContact CG1-CB 4.13Å; V525-Y542 WeakPolarHBondContact O-CE2 3.28Å; V525-Y542 PolarHBondContact O-OH 3.1Å; V525-V600 CarbonylContact C-O 3.54Å; V525-V600 VanDerWaalsContact CA-O 3.29Å; V525-V600 WeakPolarHBondContact CA-O 3.39Å; V525-V600 HydrophobicContact CG1-CB 4.49Å; V525-V600 HydrophobicContact CG1-CG1 4.42Å; V525-V600 HydrophobicContact CG2-CB 4.23Å; V525-N602 HydrophobicContact CG1-CB 4.22Å
526	L	96.5	Very high	91.7	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.047	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	100.8	167.2	-78.3	166.4	0	0	0	109.5	L524 F540 Y542 V599 V600 R601 N602	L524-L526 HydrophobicContact CD1-CG 4.49Å; L526-F540 HydrophobicContact CD1-CD1 4.01Å; L526-F540 HydrophobicContact CD1-CD2 3.97Å; L526-F540 HydrophobicContact CD1-CE1 4.06Å; L526-F540 HydrophobicContact CD1-CE2 4Å; L526-F540 HydrophobicContact CD1-CG 3.97Å; L526-F540 HydrophobicContact CD1-CZ 4.06Å; L526-F540 HydrophobicContact CD2-CD2 3.99Å; L526-F540 HydrophobicContact CD2-CE2 4.2Å; L526-F540 HydrophobicContact CG-CD2 4.34Å; L526-F540 HydrophobicContact CG-CE2 4.21Å; L526-Y542 HydrophobicContact CD2-CD2 3.65Å; L526-Y542 HydrophobicContact CD2-CE2 3.9Å; L526-Y542 HydrophobicContact CG-CD2 4.3Å; L526-Y542 HydrophobicContact CG-CE2 4.31Å; L526-V599 HydrophobicContact CD1-CG1 4.2Å; L526-V600 PolarHBondContact N-O 3.01Å; L526-R601 HydrophobicContact CB-CG 4.17Å; L526-R601 HydrophobicContact CD1-CG 4.03Å; L526-N602 PolarHBondContact O-N 3Å
527	A	91.6	Very high	92.1	Very high	26 Å²	26	29.2 Å²	29.2	22%	0.215	18%	0.177	C	C	.	.			trans	-124.7	9.2	-175.4	0	0	0	0	0	114.5	V525 G529 N602 K604 G605	V525-A527 HydrophobicContact CG1-CB 4.13Å; A527-G529 VanDerWaalsContact C-N 3.25Å; A527-G529 PolarHBondContact O-N 3.01Å; A527-N602 HydrophobicContact CB-CB 3.97Å; A527-K604 CarbonylContact O-C 3.55Å; A527-K604 WeakPolarHBondContact O-CB 3.34Å; A527-G605 PolarHBondContact O-N 3.04Å
528	G	84.3	Confident	92.4	Very high	38 Å²	38	31.5 Å²	31.5	39%	0.392	19%	0.186	S	C	.	.	S	Bend	trans	64.6	29.8	179.1	0	0	0	0	0	113.5
529	G	81	Confident	93	Very high	42 Å²	42	29.2 Å²	29.2	43%	0.433	17%	0.17	S	C	.	.			trans	-88.2	-7.4	177.2	0	0	0	0	0	113.7	A527 R548	A527-G529 VanDerWaalsContact C-N 3.25Å; A527-G529 PolarHBondContact O-N 3.01Å; G529-R548 PolarHBondContact O-NH1 3.03Å; G529-R548 PolarHBondContact O-NH2 3.48Å
530	Y	83.6	Confident	93.4	Very high	32 Å²	32	27.1 Å²	27.1	13%	0.125	16%	0.158	C	C	.	.	S	Bend	trans	-128.4	129.7	176	-73.4	-93.2	0	0	0	108.5	D532 D533 T543 G544 S545 G546 R548 Q559	Y530-D532 PolarHBondContact O-N 3.09Å; Y530-D533 PolarHBondContact O-N 2.97Å; Y530-T543 HydrophobicContact CD1-CG2 3.74Å; Y530-T543 HydrophobicContact CE1-CG2 4.41Å; Y530-T543 HydrophobicContact CG-CG2 4.21Å; Y530-G544 VanDerWaalsContact CE1-O 3.28Å; Y530-G544 WeakPolarHBondContact CE1-O 3.44Å; Y530-S545 WeakPolarHBondContact OH-CA 3.41Å; Y530-G546 PolarHBondContact OH-N 2.84Å; Y530-R548 PolarHBondContact OH-NE 3.45Å; Y530-Q559 VanDerWaalsContact CE1-OE1 3.31Å
531	E	85.6	Confident	93.6	Very high	55 Å²	55	28 Å²	28	26%	0.257	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.5	-178.1	58.3	-84.3	-165.8	0	0	113.1	K634 S635	E531-K634 HydrophobicContact CB-CD 4.25Å; E531-K634 HydrophobicContact CG-CB 4.05Å; E531-K634 HydrophobicContact CG-CD 4.16Å; E531-K634 PolarHBondContact O-NZ 3.49Å; E531-S635 PolarHBondContact OE1-OG 2.96Å
532	D	89.3	Confident	93.7	Very high	8 Å²	8	28.3 Å²	28.3	4%	0.043	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.7	-179.2	-59.4	-53.9	0	0	0	113.6	Y530 T543 K634 R641	Y530-D532 PolarHBondContact O-N 3.09Å; D532-T543 HydrophobicContact CB-CG2 4.3Å; D532-T543 VanDerWaalsContact CB-OG1 3.27Å; D532-T543 WeakPolarHBondContact CB-OG1 3.12Å; D532-K634 WeakPolarHBondContact OD1-CB 3.43Å; D532-K634 VanDerWaalsContact OD1-CG 3.27Å; D532-K634 WeakPolarHBondContact OD1-CG 3.41Å; D532-K634 PolarHBondContact OD1-N 3.32Å; D532-R641 PolarHBondContact O-NH2 3.01Å
533	D	92.8	Very high	93.6	Very high	19 Å²	19	28.2 Å²	28.2	10%	0.102	17%	0.165	C	C	.	.			trans	-66.3	131.4	173.7	-75.7	-19.7	0	0	0	110.4	Y530 T541 T543	Y530-D533 PolarHBondContact O-N 2.97Å; D533-T541 WeakPolarHBondContact CA-O 3.27Å; D533-T543 PolarHBondContact OD1-N 3.16Å; D533-T543 PolarHBondContact OD1-OG1 3.37Å
534	V	95.1	Very high	93.2	Very high	52 Å²	52	28.2 Å²	28.2	32%	0.315	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	113.9	176.9	-174.8	0	0	0	0	109.9	H536 F540 T541	V534-H536 VanDerWaalsContact CG1-NE2 3.34Å; V534-H536 WeakPolarHBondContact CG1-NE2 3.46Å; V534-F540 CarbonylContact O-C 3.55Å; V534-F540 WeakPolarHBondContact O-CA 3.42Å; V534-F540 VanDerWaalsContact O-CB 3.23Å; V534-F540 WeakPolarHBondContact O-CB 3.48Å; V534-T541 PolarHBondContact N-O 3Å; V534-T541 PolarHBondContact O-N 3.15Å
535	D	97.3	Very high	92.7	Very high	22 Å²	22	29.7 Å²	29.7	12%	0.118	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	116.2	-172.3	-174.3	12.8	0	0	0	113.1	G537 F540 R601 S609 Y611	D535-G537 PolarHBondContact OD1-N 3.08Å; D535-F540 HydrophobicContact CB-CB 4.32Å; D535-R601 IonicContact OD1-CZ 3.87Å; D535-R601 IonicContact OD1-NE 3.37Å; D535-R601 PolarHBondContact OD1-NE 2.86Å; D535-R601 IonicContact OD1-NH2 3.79Å; D535-R601 PolarHBondContact OD1-NH2 2.99Å; D535-R601 IonicContact OD2-CZ 3.24Å; D535-R601 IonicContact OD2-NE 2.78Å; D535-R601 PolarHBondContact OD2-NE 3.45Å; D535-R601 IonicContact OD2-NH2 2.68Å; D535-S609 VanDerWaalsContact CG-OG 3.29Å; D535-S609 WeakPolarHBondContact OD2-CB 3.31Å; D535-S609 PolarHBondContact OD2-OG 2.94Å; D535-Y611 WeakPolarHBondContact O-CE2 3.24Å
536	H	96.3	Very high	92.1	Very high	85 Å²	85	31.2 Å²	31.2	39%	0.394	19%	0.192	S	C	.	.			trans	-108.5	14.9	175.7	-59	-77	0	0	0	113	V534 N538 F539 Y611	V534-H536 VanDerWaalsContact CG1-NE2 3.34Å; V534-H536 WeakPolarHBondContact CG1-NE2 3.46Å; H536-N538 PolarHBondContact O-N 2.97Å; H536-F539 CarbonylContact C-O 3.54Å; H536-F539 VanDerWaalsContact C-O 3.32Å; H536-F539 VanDerWaalsContact CA-O 3.24Å; H536-F539 WeakPolarHBondContact CA-O 3.25Å; H536-F539 HydrophobicContact CB-CD1 4.12Å; H536-F539 HydrophobicContact CB-CD2 4.01Å; H536-F539 HydrophobicContact CB-CE1 3.79Å; H536-F539 HydrophobicContact CB-CE2 3.69Å; H536-F539 HydrophobicContact CB-CG 4.22Å; H536-F539 HydrophobicContact CB-CZ 3.57Å; H536-F539 VanDerWaalsContact CB-O 3.26Å; H536-F539 WeakPolarHBondContact CB-O 3.4Å; H536-F539 AromaticContact CD2-CD2 3.86Å; H536-F539 AromaticContact CD2-CE2 3.25Å; H536-F539 WeakPolarHBondContact CD2-CE2 3.3Å; H536-F539 AromaticContact CD2-CZ 3.82Å; H536-F539 AromaticContact CG-CE2 3.6Å; H536-F539 AromaticContact CG-CZ 3.69Å; H536-F539 PolarHBondContact N-O 2.89Å; H536-Y611 VanDerWaalsContact C-CZ 3.43Å; H536-Y611 VanDerWaalsContact CA-CE2 3.47Å; H536-Y611 PolarHBondContact O-OH 2.88Å
537	G	94.8	Very high	91.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	79.2	-80.6	178.1	0	0	0	0	0	111.4	D535 F539 R601 Y611 Y623 W654	D535-G537 PolarHBondContact OD1-N 3.08Å; G537-F539 PolarHBondContact N-O 2.82Å; G537-F539 PolarHBondContact O-N 2.74Å; G537-R601 PolarHBondContact O-NH2 3.31Å; G537-Y611 VanDerWaalsContact N-CD2 3.32Å; G537-Y611 VanDerWaalsContact N-CE2 3.28Å; G537-Y623 WeakPolarHBondContact O-CE1 3.17Å; G537-Y623 PolarHBondContact O-OH 3.3Å; G537-W654 VanDerWaalsContact C-CZ2 3.44Å
538	N	96.9	Very high	90.8	Very high	86 Å²	86	31.7 Å²	31.7	46%	0.46	19%	0.19	S	C	.	.	S	Bend	trans	-71.3	-18.8	-179.7	-73.2	-14.1	0	0	0	113.3	H536 R646 W654	H536-N538 PolarHBondContact O-N 2.97Å; N538-R646 VanDerWaalsContact O-CB 3.25Å; N538-R646 WeakPolarHBondContact O-CB 3.02Å; N538-R646 PolarHBondContact O-N 3.43Å; N538-W654 WeakPolarHBondContact OD1-CZ2 3.23Å
539	F	97.7	Very high	90.4	Very high	89 Å²	89	33.8 Å²	33.8	39%	0.39	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	157.9	170	63.5	-83.9	0	0	0	108.8	H536 G537 L643 L644 R645	H536-F539 CarbonylContact C-O 3.54Å; H536-F539 VanDerWaalsContact C-O 3.32Å; H536-F539 VanDerWaalsContact CA-O 3.24Å; H536-F539 WeakPolarHBondContact CA-O 3.25Å; H536-F539 HydrophobicContact CB-CD1 4.12Å; H536-F539 HydrophobicContact CB-CD2 4.01Å; H536-F539 HydrophobicContact CB-CE1 3.79Å; H536-F539 HydrophobicContact CB-CE2 3.69Å; H536-F539 HydrophobicContact CB-CG 4.22Å; H536-F539 HydrophobicContact CB-CZ 3.57Å; H536-F539 VanDerWaalsContact CB-O 3.26Å; H536-F539 WeakPolarHBondContact CB-O 3.4Å; H536-F539 AromaticContact CD2-CD2 3.86Å; H536-F539 AromaticContact CD2-CE2 3.25Å; H536-F539 WeakPolarHBondContact CD2-CE2 3.3Å; H536-F539 AromaticContact CD2-CZ 3.82Å; H536-F539 AromaticContact CG-CE2 3.6Å; H536-F539 AromaticContact CG-CZ 3.69Å; H536-F539 PolarHBondContact N-O 2.89Å; G537-F539 PolarHBondContact N-O 2.82Å; G537-F539 PolarHBondContact O-N 2.74Å; F539-L643 HydrophobicContact CD2-CD1 4.26Å; F539-L644 CarbonylContact C-O 3.37Å; F539-L644 WeakPolarHBondContact CA-O 3.28Å; F539-L644 VanDerWaalsContact CB-O 3.29Å; F539-L644 WeakPolarHBondContact CB-O 3.4Å; F539-R645 HydrophobicContact CB-CB 4.42Å; F539-R645 HydrophobicContact CB-CG 4.41Å
540	F	98.2	Very high	90	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.8	176.4	58	-89.6	0	0	0	110.6	L524 L526 V534 D535 Y542 V599 Y623 L644	L524-F540 HydrophobicContact CD1-CE2 4.05Å; L524-F540 HydrophobicContact CD1-CZ 3.93Å; L524-F540 HydrophobicContact CD2-CE2 4.41Å; L524-F540 HydrophobicContact CD2-CZ 4.5Å; L526-F540 HydrophobicContact CD1-CD1 4.01Å; L526-F540 HydrophobicContact CD1-CD2 3.97Å; L526-F540 HydrophobicContact CD1-CE1 4.06Å; L526-F540 HydrophobicContact CD1-CE2 4Å; L526-F540 HydrophobicContact CD1-CG 3.97Å; L526-F540 HydrophobicContact CD1-CZ 4.06Å; L526-F540 HydrophobicContact CD2-CD2 3.99Å; L526-F540 HydrophobicContact CD2-CE2 4.2Å; L526-F540 HydrophobicContact CG-CD2 4.34Å; L526-F540 HydrophobicContact CG-CE2 4.21Å; V534-F540 CarbonylContact O-C 3.55Å; V534-F540 WeakPolarHBondContact O-CA 3.42Å; V534-F540 VanDerWaalsContact O-CB 3.23Å; V534-F540 WeakPolarHBondContact O-CB 3.48Å; D535-F540 HydrophobicContact CB-CB 4.32Å; F540-Y542 HydrophobicContact CD2-CD2 4.29Å; F540-Y542 AromaticContact CE2-CD2 3.89Å; F540-Y542 HydrophobicContact CE2-CD2 3.89Å; F540-Y542 HydrophobicContact CE2-CG 4.22Å; F540-V599 HydrophobicContact CE1-CG1 3.92Å; F540-V599 HydrophobicContact CE1-CG2 3.98Å; F540-V599 HydrophobicContact CZ-CG1 3.92Å; F540-V599 HydrophobicContact CZ-CG2 3.72Å; F540-Y623 HydrophobicContact CD1-CD1 4.05Å; F540-Y623 AromaticContact CD1-CE1 3.81Å; F540-Y623 HydrophobicContact CD1-CE1 3.81Å; F540-Y623 AromaticContact CE1-CD1 3.46Å; F540-Y623 HydrophobicContact CE1-CD1 3.46Å; F540-Y623 VanDerWaalsContact CE1-CD1 3.46Å; F540-Y623 HydrophobicContact CE1-CD2 4.47Å; F540-Y623 AromaticContact CE1-CE1 3.51Å; F540-Y623 HydrophobicContact CE1-CE1 3.51Å; F540-Y623 AromaticContact CE1-CG 3.98Å; F540-Y623 HydrophobicContact CE1-CG 3.98Å; F540-Y623 HydrophobicContact CZ-CD1 4.39Å; F540-L644 HydrophobicContact CD1-CB 4.35Å; F540-L644 HydrophobicContact CD2-CB 4.31Å; F540-L644 HydrophobicContact CD2-CD1 4.35Å; F540-L644 HydrophobicContact CE1-CB 3.92Å; F540-L644 HydrophobicContact CE2-CB 3.9Å; F540-L644 HydrophobicContact CE2-CD1 3.76Å; F540-L644 HydrophobicContact CE2-CD2 4.25Å; F540-L644 HydrophobicContact CE2-CG 4.17Å; F540-L644 HydrophobicContact CZ-CB 3.67Å; F540-L644 HydrophobicContact CZ-CD1 4.21Å; F540-L644 HydrophobicContact CZ-CD2 3.87Å; F540-L644 HydrophobicContact CZ-CG 4.12Å; F540-L644 PolarHBondContact N-O 2.86Å; F540-L644 PolarHBondContact O-N 2.98Å
541	T	97.8	Very high	88.9	Confident	19 Å²	19	37.4 Å²	37.4	12%	0.117	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120	168	-49.6	0	0	0	0	108	D533 V534 W629 R641 Y642	D533-T541 WeakPolarHBondContact CA-O 3.27Å; V534-T541 PolarHBondContact N-O 3Å; V534-T541 PolarHBondContact O-N 3.15Å; T541-W629 HydrophobicContact CG2-CH2 3.85Å; T541-W629 HydrophobicContact CG2-CZ2 4.16Å; T541-R641 HydrophobicContact CG2-CB 4.01Å; T541-Y642 CarbonylContact C-O 3.53Å; T541-Y642 VanDerWaalsContact CA-O 3.31Å; T541-Y642 WeakPolarHBondContact CA-O 3.42Å
542	Y	97.8	Very high	87.6	Confident	7 Å²	7	38.4 Å²	38.4	3%	0.027	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	143.7	-179.2	-163.7	-102.8	0	0	0	110.2	G512 I513 L524 V525 L526 F540 L572 R641 Y642	G512-Y542 PolarHBondContact O-OH 3.02Å; I513-Y542 HydrophobicContact CD1-CE1 3.92Å; I513-Y542 HydrophobicContact CG1-CE1 3.71Å; L524-Y542 HydrophobicContact CD1-CD2 4.11Å; L524-Y542 HydrophobicContact CD1-CE2 3.88Å; L524-Y542 HydrophobicContact CD2-CD1 4.19Å; L524-Y542 HydrophobicContact CD2-CD2 4.35Å; L524-Y542 HydrophobicContact CD2-CE1 4.34Å; L524-Y542 HydrophobicContact CD2-CE2 4.49Å; L524-Y542 HydrophobicContact CD2-CG 4.2Å; V525-Y542 WeakPolarHBondContact O-CE2 3.28Å; V525-Y542 PolarHBondContact O-OH 3.1Å; L526-Y542 HydrophobicContact CD2-CD2 3.65Å; L526-Y542 HydrophobicContact CD2-CE2 3.9Å; L526-Y542 HydrophobicContact CG-CD2 4.3Å; L526-Y542 HydrophobicContact CG-CE2 4.31Å; F540-Y542 HydrophobicContact CD2-CD2 4.29Å; F540-Y542 AromaticContact CE2-CD2 3.89Å; F540-Y542 HydrophobicContact CE2-CD2 3.89Å; F540-Y542 HydrophobicContact CE2-CG 4.22Å; Y542-L572 HydrophobicContact CD1-CD2 4Å; Y542-R641 CarbonylContact O-C 3.49Å; Y542-R641 WeakPolarHBondContact O-CA 3.27Å; Y542-Y642 PolarHBondContact N-O 2.95Å; Y542-Y642 PolarHBondContact O-N 3.46Å
543	T	95.5	Very high	86.6	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.1	175.8	-54.3	0	0	0	0	111.3	Y530 D532 D533 V639 W640	Y530-T543 HydrophobicContact CD1-CG2 3.74Å; Y530-T543 HydrophobicContact CE1-CG2 4.41Å; Y530-T543 HydrophobicContact CG-CG2 4.21Å; D532-T543 HydrophobicContact CB-CG2 4.3Å; D532-T543 VanDerWaalsContact CB-OG1 3.27Å; D532-T543 WeakPolarHBondContact CB-OG1 3.12Å; D533-T543 PolarHBondContact OD1-N 3.16Å; D533-T543 PolarHBondContact OD1-OG1 3.37Å; T543-V639 HydrophobicContact CG2-CB 3.89Å; T543-V639 HydrophobicContact CG2-CG1 4.3Å; T543-V639 HydrophobicContact CG2-CG2 4.25Å; T543-W640 CarbonylContact C-O 3.43Å
544	G	89.1	Confident	85.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-58.1	162.3	174.5	0	0	0	0	0	112.5	Y530 Q563 N569 W640	Y530-G544 VanDerWaalsContact CE1-O 3.28Å; Y530-G544 WeakPolarHBondContact CE1-O 3.44Å; G544-Q563 PolarHBondContact O-NE2 3.04Å; G544-Q563 PolarHBondContact O-OE1 3.34Å; G544-N569 WeakPolarHBondContact CA-OD1 3.38Å; G544-W640 PolarHBondContact N-O 3.27Å
545	S	87.1	Confident	83.9	Confident	31 Å²	31	52.8 Å²	52.8	22%	0.217	29%	0.293	C	S	.	.	S	Bend	trans	-85.1	162.8	173.6	58.3	0	0	0	0	112.3	Y530 T568 N569	Y530-S545 WeakPolarHBondContact OH-CA 3.41Å; S545-T568 PolarHBondContact OG-OG1 2.85Å; S545-N569 PolarHBondContact N-OD1 3.2Å; S545-N569 PolarHBondContact O-ND2 2.67Å; S545-N569 PolarHBondContact O-OD1 2.78Å; S545-N569 PolarHBondContact OG-OD1 3.41Å
546	G	85.6	Confident	82.9	Confident	36 Å²	36	56.5 Å²	56.5	37%	0.371	32%	0.316	S	S	.	.			trans	88.6	-162.2	179.1	0	0	0	0	0	113.6	Y530 R548 Q559 Q563	Y530-G546 PolarHBondContact OH-N 2.84Å; G546-R548 VanDerWaalsContact C-N 3.29Å; G546-Q559 PolarHBondContact O-NE2 3.07Å; G546-Q559 VanDerWaalsContact O-NE2 3.1Å; G546-Q559 PolarHBondContact O-OE1 3.01Å; G546-Q563 PolarHBondContact O-NE2 3Å
547	G	80.4	Confident	82.1	Confident	9 Å²	9	53.8 Å²	53.8	9%	0.093	31%	0.308	C	S	.	.			trans	68.2	28.8	-171.7	0	0	0	0	0	113	Q559 S560 C561	G547-Q559 CarbonylContact O-C 3.51Å; G547-Q559 VanDerWaalsContact O-CA 3.26Å; G547-Q559 WeakPolarHBondContact O-CA 2.98Å; G547-Q559 PolarHBondContact O-NE2 3.49Å; G547-S560 PolarHBondContact O-N 3.33Å; G547-C561 CarbonylContact C-O 3.59Å; G547-C561 VanDerWaalsContact C-SG 3.6Å; G547-C561 WeakPolarHBondContact CA-O 3.45Å; G547-C561 VanDerWaalsContact CA-SG 3.57Å; G547-C561 PolarHBondContact O-N 3.22Å
548	R	80.3	Confident	81.3	Confident	35 Å²	35	61.7 Å²	61.7	13%	0.132	35%	0.345	C	S	.	.	S	Bend	trans	-139	135	-169.2	-70	175.9	178.7	-162.8	-14.8	110.2	G529 Y530 G546 L550 A557 Q559	G529-R548 PolarHBondContact O-NH1 3.03Å; G529-R548 PolarHBondContact O-NH2 3.48Å; Y530-R548 PolarHBondContact OH-NE 3.45Å; G546-R548 VanDerWaalsContact C-N 3.29Å; R548-L550 HydrophobicContact CB-CD2 4.24Å; R548-L550 HydrophobicContact CB-CG 4.35Å; R548-L550 PolarHBondContact O-N 2.79Å; R548-A557 HydrophobicContact CB-CB 4.27Å; R548-A557 WeakPolarHBondContact CD-O 3.46Å; R548-A557 PolarHBondContact NE-O 3.24Å; R548-Q559 VanDerWaalsContact CG-OE1 3.26Å
549	D	76	Confident	80.4	Confident	83 Å²	83	58.2 Å²	58.2	44%	0.444	33%	0.326	S	S	.	.			trans	-78.1	107.7	166.6	-179.2	18.7	0	0	0	110.7	S551 A557 S560	D549-S551 VanDerWaalsContact CG-OG 3.25Å; D549-S551 WeakPolarHBondContact OD1-CB 2.9Å; D549-S551 PolarHBondContact OD1-N 3.42Å; D549-S551 PolarHBondContact OD1-OG 3.27Å; D549-S551 PolarHBondContact OD2-OG 2.83Å; D549-A557 WeakPolarHBondContact O-CB 3.44Å; D549-S560 PolarHBondContact N-OG 3.47Å
550	L	73.2	Confident	79.8	Confident	82 Å²	82	56.6 Å²	56.6	43%	0.429	33%	0.326	S	S	.	.			trans	-100.3	15	177	-59.3	-179.7	0	0	0	112.9	R548 K554 A557	R548-L550 HydrophobicContact CB-CD2 4.24Å; R548-L550 HydrophobicContact CB-CG 4.35Å; R548-L550 PolarHBondContact O-N 2.79Å; L550-K554 HydrophobicContact CD2-CB 4.29Å; L550-K554 PolarHBondContact O-N 2.89Å; L550-A557 HydrophobicContact CD2-CB 4.06Å
551	S	60.2	Low	79.1	Confident	67 Å²	67	59.5 Å²	59.5	47%	0.469	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	149.2	172	69.7	0	0	0	0	111.7	D549	D549-S551 VanDerWaalsContact CG-OG 3.25Å; D549-S551 WeakPolarHBondContact OD1-CB 2.9Å; D549-S551 PolarHBondContact OD1-N 3.42Å; D549-S551 PolarHBondContact OD1-OG 3.27Å; D549-S551 PolarHBondContact OD2-OG 2.83Å
552	G	58.7	Low	78.7	Confident	76 Å²	76	63 Å²	63	78%	0.784	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	32.4	-176.6	0	0	0	0	0	114.2	K554	G552-K554 PolarHBondContact O-N 2.89Å
553	N	67.7	Low	78.2	Confident	125 Å²	125	62.9 Å²	62.9	67%	0.668	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	29.9	174.7	-166.4	28.8	0	0	0	113.6	R555	N553-R555 PolarHBondContact O-NH1 2.9Å; N553-R555 VanDerWaalsContact OD1-CZ 3.26Å; N553-R555 PolarHBondContact OD1-NH1 2.78Å; N553-R555 PolarHBondContact OD1-NH2 2.85Å
554	K	63.2	Low	77.8	Confident	111 Å²	111	70.3 Å²	70.3	48%	0.483	40%	0.396	S	S	.	.			trans	-71.3	156.6	173.9	-67.2	173.9	-173.5	166.2	0	110.2	L550 G552	L550-K554 HydrophobicContact CD2-CB 4.29Å; L550-K554 PolarHBondContact O-N 2.89Å; G552-K554 PolarHBondContact O-N 2.89Å
555	R	68.7	Low	78	Confident	146 Å²	146	71.2 Å²	71.2	55%	0.551	40%	0.4	S	S	*	.	S	Bend	trans	-111.7	-20.1	174.3	-66	-65.8	176.1	-83.9	-3.2	112.8	V510 N553	V510-R555 HydrophobicContact CG1-CB 4.11Å; V510-R555 HydrophobicContact CG1-CG 4.49Å; N553-R555 PolarHBondContact O-NH1 2.9Å; N553-R555 VanDerWaalsContact OD1-CZ 3.26Å; N553-R555 PolarHBondContact OD1-NH1 2.78Å; N553-R555 PolarHBondContact OD1-NH2 2.85Å
556	T	76.1	Confident	78	Confident	99 Å²	99	73.1 Å²	73.1	61%	0.607	41%	0.411	S	S	*	.			trans	-146.5	144.2	177.5	55.1	0	0	0	0	107.9
557	A	78.6	Confident	78.2	Confident	28 Å²	28	76.8 Å²	76.8	23%	0.231	42%	0.422	C	S	.	.			trans	-147.4	171.4	171	0	0	0	0	0	108.2	R548 D549 L550	R548-A557 HydrophobicContact CB-CB 4.27Å; R548-A557 WeakPolarHBondContact CD-O 3.46Å; R548-A557 PolarHBondContact NE-O 3.24Å; D549-A557 WeakPolarHBondContact O-CB 3.44Å; L550-A557 HydrophobicContact CD2-CB 4.06Å
558	E	78.6	Confident	78.7	Confident	167 Å²	167	78 Å²	78	78%	0.78	43%	0.427	S	S	*	.			trans	-72.8	161.9	169.4	-65.8	179.7	168.2	0	0	110.3	S560	E558-S560 PolarHBondContact O-N 3.41Å
559	Q	79	Confident	79.2	Confident	12 Å²	12	76.5 Å²	76.5	6%	0.056	42%	0.422	C	S	.	.			trans	-65.4	129.4	177.2	-61.7	-56.4	108.2	0	0	110	Y530 G546 G547 R548 F637	Y530-Q559 VanDerWaalsContact CE1-OE1 3.31Å; G546-Q559 PolarHBondContact O-NE2 3.07Å; G546-Q559 VanDerWaalsContact O-NE2 3.1Å; G546-Q559 PolarHBondContact O-OE1 3.01Å; G547-Q559 CarbonylContact O-C 3.51Å; G547-Q559 VanDerWaalsContact O-CA 3.26Å; G547-Q559 WeakPolarHBondContact O-CA 2.98Å; G547-Q559 PolarHBondContact O-NE2 3.49Å; R548-Q559 VanDerWaalsContact CG-OE1 3.26Å; Q559-F637 HydrophobicContact CB-CD2 4.01Å; Q559-F637 WeakPolarHBondContact O-CE2 3.41Å
560	S	83.3	Confident	80.1	Confident	55 Å²	55	76.4 Å²	76.4	39%	0.385	42%	0.416	S	S	.	.			trans	-131.2	-9	-178.1	63.8	0	0	0	0	113.6	G547 D549 E558 F637	G547-S560 PolarHBondContact O-N 3.33Å; D549-S560 PolarHBondContact N-OG 3.47Å; E558-S560 PolarHBondContact O-N 3.41Å; S560-F637 WeakPolarHBondContact O-CE1 3.4Å; S560-F637 WeakPolarHBondContact O-CZ 3.28Å
561	C	84.4	Confident	81.2	Confident	62 Å²	62	72.5 Å²	72.5	42%	0.419	40%	0.395	S	S	.	.	S	Bend	trans	-156.6	168.4	175	66	0	0	0	0	110.5	G547	G547-C561 CarbonylContact C-O 3.59Å; G547-C561 VanDerWaalsContact C-SG 3.6Å; G547-C561 WeakPolarHBondContact CA-O 3.45Å; G547-C561 VanDerWaalsContact CA-SG 3.57Å; G547-C561 PolarHBondContact O-N 3.22Å
562	D	88.6	Confident	82.9	Confident	91 Å²	91	69.3 Å²	69.3	49%	0.487	37%	0.373	S	S	.	.			trans	-64	140.6	179	-68.5	-15.3	0	0	0	112	L638	D562-L638 HydrophobicContact CB-CB 3.92Å; D562-L638 PolarHBondContact OD1-N 2.79Å
563	Q	88.8	Confident	84.8	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.028	34%	0.336	C	S	.	.			trans	-75.8	145.5	171.7	-64.2	-169	-8.8	0	0	110.7	G544 G546 L638 V639 W640	G544-Q563 PolarHBondContact O-NE2 3.04Å; G544-Q563 PolarHBondContact O-OE1 3.34Å; G546-Q563 PolarHBondContact O-NE2 3Å; Q563-L638 PolarHBondContact N-O 3Å; Q563-L638 WeakPolarHBondContact O-CD2 3.44Å; Q563-V639 HydrophobicContact CG-CB 4.44Å; Q563-V639 HydrophobicContact CG-CG1 4.26Å; Q563-W640 PolarHBondContact O-NE1 2.78Å
564	K	87.1	Confident	86.2	Confident	155 Å²	155	61.9 Å²	61.9	67%	0.674	32%	0.315	S	S	*	.			trans	-108.2	149.7	175.6	-59.7	-174	178.7	-174.1	0	110.6	T566 N569	K564-T566 HydrophobicContact CB-CG2 4.15Å; K564-T566 PolarHBondContact O-N 2.81Å; K564-N569 PolarHBondContact O-ND2 3.22Å
565	L	92.3	Very high	87.8	Confident	19 Å²	19	56.6 Å²	56.6	10%	0.099	29%	0.292	C	S	.	.	S	Bend	trans	-80.7	60.4	172.2	-165	67.8	0	0	0	111.1	N569 A573 I580 D582 Y628 W640 Y642	L565-N569 HydrophobicContact CD1-CB 4.24Å; L565-A573 HydrophobicContact CD1-CB 3.96Å; L565-A573 HydrophobicContact CD2-CB 4.49Å; L565-I580 HydrophobicContact CD2-CD1 4.3Å; L565-D582 HydrophobicContact CD2-CB 4.01Å; L565-Y628 HydrophobicContact CD1-CE2 4.47Å; L565-Y628 HydrophobicContact CD2-CE2 3.97Å; L565-W640 HydrophobicContact CB-CD2 4.23Å; L565-W640 HydrophobicContact CB-CH2 4.24Å; L565-W640 HydrophobicContact CB-CZ2 3.66Å; L565-W640 HydrophobicContact CD1-CD2 3.75Å; L565-W640 HydrophobicContact CD1-CE3 3.8Å; L565-W640 HydrophobicContact CD1-CG 4.23Å; L565-W640 HydrophobicContact CD1-CH2 4.4Å; L565-W640 HydrophobicContact CD1-CZ2 4.4Å; L565-W640 HydrophobicContact CD1-CZ3 4.12Å; L565-W640 HydrophobicContact CD2-CH2 3.94Å; L565-W640 HydrophobicContact CD2-CZ2 4.23Å; L565-W640 HydrophobicContact CD2-CZ3 4.18Å; L565-W640 HydrophobicContact CG-CD2 4.49Å; L565-W640 HydrophobicContact CG-CH2 4.42Å; L565-W640 HydrophobicContact CG-CZ2 4.3Å; L565-Y642 WeakPolarHBondContact CD1-OH 3.44Å
566	T	87.1	Confident	89.2	Confident	72 Å²	72	50 Å²	50	44%	0.442	27%	0.268	S	S	.	.			trans	-124.4	170.6	-179.9	58.7	0	0	0	0	110.5	K564 T568 N569 R570	K564-T566 HydrophobicContact CB-CG2 4.15Å; K564-T566 PolarHBondContact O-N 2.81Å; T566-T568 PolarHBondContact O-N 2.93Å; T566-N569 WeakPolarHBondContact O-CB 2.85Å; T566-N569 PolarHBondContact O-N 3.47Å; T566-R570 PolarHBondContact O-N 2.77Å
567	N	90.1	Very high	90.2	Very high	113 Å²	113	50.9 Å²	50.9	60%	0.604	26%	0.264	S	S	*	.	H	α-helix	trans	52.3	-120.6	172.7	-58.6	-27.7	0	0	0	113.2	S517 N569 R570 A571	S517-N567 WeakPolarHBondContact CA-O 3.13Å; N567-N569 VanDerWaalsContact C-N 3.34Å; N567-N569 PolarHBondContact O-N 3.36Å; N567-R570 PolarHBondContact O-N 2.77Å; N567-A571 WeakPolarHBondContact O-CB 3.46Å; N567-A571 PolarHBondContact O-N 2.76Å
568	T	90.1	Very high	91	Very high	33 Å²	33	50.9 Å²	50.9	20%	0.202	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-28.7	179.5	36	0	0	0	0	113.6	I513 S545 T566 A571 L572	I513-T568 HydrophobicContact CB-CG2 4.11Å; I513-T568 HydrophobicContact CG2-CG2 4.13Å; S545-T568 PolarHBondContact OG-OG1 2.85Å; T566-T568 PolarHBondContact O-N 2.93Å; T568-A571 PolarHBondContact O-N 3.45Å; T568-L572 PolarHBondContact O-N 3.44Å
569	N	92.3	Very high	91.7	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.027	26%	0.263	C	S	.	.	H	α-helix	trans	-71.1	-45	176.9	-63.4	-5	0	0	0	109.9	G544 S545 K564 L565 T566 N567 A571 L572 A573 Y642	G544-N569 WeakPolarHBondContact CA-OD1 3.38Å; S545-N569 PolarHBondContact N-OD1 3.2Å; S545-N569 PolarHBondContact O-ND2 2.67Å; S545-N569 PolarHBondContact O-OD1 2.78Å; S545-N569 PolarHBondContact OG-OD1 3.41Å; K564-N569 PolarHBondContact O-ND2 3.22Å; L565-N569 HydrophobicContact CD1-CB 4.24Å; T566-N569 WeakPolarHBondContact O-CB 2.85Å; T566-N569 PolarHBondContact O-N 3.47Å; N567-N569 VanDerWaalsContact C-N 3.34Å; N567-N569 PolarHBondContact O-N 3.36Å; N569-A571 VanDerWaalsContact C-N 3.34Å; N569-L572 PolarHBondContact O-N 2.81Å; N569-A573 PolarHBondContact O-N 3.36Å; N569-Y642 VanDerWaalsContact C-OH 3.25Å; N569-Y642 VanDerWaalsContact CA-OH 3.24Å; N569-Y642 WeakPolarHBondContact CA-OH 3.11Å; N569-Y642 VanDerWaalsContact CB-OH 3.28Å; N569-Y642 WeakPolarHBondContact CB-OH 3.44Å; N569-Y642 PolarHBondContact O-OH 3.24Å
570	R	94.7	Very high	92.4	Very high	80 Å²	80	51.1 Å²	51.1	30%	0.302	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-43.8	171.7	-167.6	-178.7	-172	-83.2	3.2	111.4	S517 T566 N567 L572 A573 L574	S517-R570 PolarHBondContact O-NH1 3.17Å; T566-R570 PolarHBondContact O-N 2.77Å; N567-R570 PolarHBondContact O-N 2.77Å; R570-L572 VanDerWaalsContact C-N 3.31Å; R570-L572 PolarHBondContact O-N 3.4Å; R570-A573 PolarHBondContact O-N 3.4Å; R570-A573 VanDerWaalsContact O-N 3.16Å; R570-L574 WeakPolarHBondContact O-CG 3.49Å; R570-L574 PolarHBondContact O-N 3.37Å
571	A	95.1	Very high	92.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.1	-45.5	176.9	0	0	0	0	0	111.6	R516 G520 A521 N567 T568 N569 L574 N575	R516-A571 VanDerWaalsContact O-CB 3.25Å; R516-A571 WeakPolarHBondContact O-CB 3.44Å; G520-A571 CarbonylContact C-O 3.56Å; G520-A571 WeakPolarHBondContact CA-O 3.43Å; A521-A571 HydrophobicContact CB-CB 4.49Å; A521-A571 PolarHBondContact N-O 2.81Å; N567-A571 WeakPolarHBondContact O-CB 3.46Å; N567-A571 PolarHBondContact O-N 2.76Å; T568-A571 PolarHBondContact O-N 3.45Å; N569-A571 VanDerWaalsContact C-N 3.34Å; A571-L574 PolarHBondContact O-N 3.14Å; A571-N575 PolarHBondContact O-OD1 2.79Å
572	L	97.3	Very high	93.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-34.3	178.5	-172.5	59.3	0	0	0	112.6	I513 A521 L524 Y542 T568 N569 R570 N575 V597 V625 Y642	I513-L572 HydrophobicContact CD1-CB 4.42Å; I513-L572 HydrophobicContact CD1-CD2 3.97Å; A521-L572 HydrophobicContact CB-CB 4.07Å; A521-L572 HydrophobicContact CB-CD1 3.76Å; L524-L572 HydrophobicContact CD2-CD1 4.23Å; L524-L572 HydrophobicContact CD2-CD2 4.22Å; Y542-L572 HydrophobicContact CD1-CD2 4Å; T568-L572 PolarHBondContact O-N 3.44Å; N569-L572 PolarHBondContact O-N 2.81Å; R570-L572 VanDerWaalsContact C-N 3.31Å; R570-L572 PolarHBondContact O-N 3.4Å; L572-N575 WeakPolarHBondContact O-CB 3.28Å; L572-N575 PolarHBondContact O-N 2.85Å; L572-V597 HydrophobicContact CD1-CG2 4.08Å; L572-V625 HydrophobicContact CD1-CG2 3.87Å; L572-V625 HydrophobicContact CG-CG2 4.28Å; L572-Y642 HydrophobicContact CB-CD1 4.21Å; L572-Y642 HydrophobicContact CB-CE1 3.94Å; L572-Y642 HydrophobicContact CD2-CD1 3.78Å; L572-Y642 HydrophobicContact CD2-CD2 3.77Å; L572-Y642 HydrophobicContact CD2-CE1 4.15Å; L572-Y642 HydrophobicContact CD2-CE2 4.15Å; L572-Y642 HydrophobicContact CD2-CG 3.59Å; L572-Y642 HydrophobicContact CG-CD1 3.68Å; L572-Y642 HydrophobicContact CG-CE1 3.95Å; L572-Y642 HydrophobicContact CG-CG 4.03Å
573	A	97.3	Very high	93	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-38.1	175.4	0	0	0	0	0	112.6	L565 N569 R570 N575 C576 I580 Y628 Y642	L565-A573 HydrophobicContact CD1-CB 3.96Å; L565-A573 HydrophobicContact CD2-CB 4.49Å; N569-A573 PolarHBondContact O-N 3.36Å; R570-A573 PolarHBondContact O-N 3.4Å; R570-A573 VanDerWaalsContact O-N 3.16Å; A573-N575 PolarHBondContact O-N 3.21Å; A573-N575 VanDerWaalsContact O-N 3.09Å; A573-C576 WeakPolarHBondContact O-CB 3.36Å; A573-C576 PolarHBondContact O-N 3.05Å; A573-I580 HydrophobicContact CB-CD1 3.46Å; A573-I580 VanDerWaalsContact CB-CD1 3.46Å; A573-Y628 HydrophobicContact CB-CD1 4.03Å; A573-Y628 HydrophobicContact CB-CD2 3.86Å; A573-Y628 HydrophobicContact CB-CE1 3.87Å; A573-Y628 HydrophobicContact CB-CE2 3.71Å; A573-Y628 HydrophobicContact CB-CG 4.04Å; A573-Y642 HydrophobicContact CB-CE1 4.04Å
574	L	96.9	Very high	93.2	Very high	44 Å²	44	63.8 Å²	63.8	23%	0.23	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.8	175.5	-73.4	178.9	0	0	0	114.3	S517 R570 A571 C576 I580	S517-L574 WeakPolarHBondContact O-CD1 3.44Å; R570-L574 WeakPolarHBondContact O-CG 3.49Å; R570-L574 PolarHBondContact O-N 3.37Å; A571-L574 PolarHBondContact O-N 3.14Å; L574-C576 VanDerWaalsContact C-N 3.27Å; L574-I580 HydrophobicContact CD2-CB 4.33Å; L574-I580 HydrophobicContact CD2-CD1 4.2Å; L574-I580 HydrophobicContact CG-CD1 4.49Å
575	N	97.9	Very high	93.6	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-20.2	173.2	-71.6	58.8	0	0	0	112.8	A521 A571 L572 A573 G594 K595 V597 V625	A521-N575 PolarHBondContact N-OD1 3.24Å; A521-N575 PolarHBondContact O-ND2 3.4Å; A521-N575 PolarHBondContact O-OD1 3.31Å; A571-N575 PolarHBondContact O-OD1 2.79Å; L572-N575 WeakPolarHBondContact O-CB 3.28Å; L572-N575 PolarHBondContact O-N 2.85Å; A573-N575 PolarHBondContact O-N 3.21Å; A573-N575 VanDerWaalsContact O-N 3.09Å; N575-G594 CarbonylContact O-C 3.55Å; N575-G594 VanDerWaalsContact O-CA 3.23Å; N575-G594 WeakPolarHBondContact O-CA 3.31Å; N575-K595 HydrophobicContact CB-CB 4.13Å; N575-K595 PolarHBondContact ND2-O 3.19Å; N575-K595 PolarHBondContact O-N 2.98Å; N575-V597 HydrophobicContact CB-CG2 4.3Å; N575-V597 WeakPolarHBondContact ND2-CG2 3.44Å; N575-V625 HydrophobicContact CB-CB 4.33Å; N575-V625 HydrophobicContact CB-CG2 3.82Å
576	C	97.9	Very high	93.8	Very high	6 Å²	6	56.8 Å²	56.8	4%	0.041	30%	0.301	C	S	.	.	S	Bend	trans	-66.3	133.4	174.5	-165.4	0	0	0	0	109.1	A573 L574 A578 V625 Y628	A573-C576 WeakPolarHBondContact O-CB 3.36Å; A573-C576 PolarHBondContact O-N 3.05Å; L574-C576 VanDerWaalsContact C-N 3.27Å; C576-A578 PolarHBondContact O-N 2.77Å; C576-V625 HydrophobicContact CB-CB 4.23Å; C576-V625 HydrophobicContact CB-CG1 3.87Å; C576-Y628 HydrophobicContact CB-CD1 3.87Å; C576-Y628 HydrophobicContact CB-CE1 3.93Å
577	F	97.1	Very high	94.3	Very high	118 Å²	118	59.1 Å²	59.1	52%	0.518	31%	0.307	S	S	.	.	S	Bend	trans	-80.1	62.2	174.8	-167.2	-109.6	0	0	0	110.9	A588 D590 S593	F577-A588 HydrophobicContact CB-CB 4.06Å; F577-A588 WeakPolarHBondContact O-CB 3.46Å; F577-D590 HydrophobicContact CD1-CB 4.39Å; F577-S593 WeakPolarHBondContact CD2-O 3.45Å
578	A	95.3	Very high	94.7	Very high	28 Å²	28	54 Å²	54	23%	0.231	28%	0.28	C	S	.	.	S	Bend	trans	-151.9	152	176.3	0	0	0	0	0	108.8	C576 A586	C576-A578 PolarHBondContact O-N 2.77Å; A578-A586 HydrophobicContact CB-CB 3.77Å
579	P	93.7	Very high	94.8	Very high	117 Å²	117	63 Å²	63	76%	0.76	32%	0.316	S	S	*	.			trans	-54.1	141.5	171.5	-24.9	34.9	0	0	0	111.4	N581	P579-N581 PolarHBondContact O-N 2.63Å
580	I	93.9	Very high	95	Very high	67 Å²	67	66.2 Å²	66.2	34%	0.344	33%	0.334	S	S	.	.			trans	-66.4	126	178.8	-165	77	0	0	0	109.6	L565 A573 L574	L565-I580 HydrophobicContact CD2-CD1 4.3Å; A573-I580 HydrophobicContact CB-CD1 3.46Å; A573-I580 VanDerWaalsContact CB-CD1 3.46Å; L574-I580 HydrophobicContact CD2-CB 4.33Å; L574-I580 HydrophobicContact CD2-CD1 4.2Å; L574-I580 HydrophobicContact CG-CD1 4.49Å
581	N	93.7	Very high	95.1	Very high	56 Å²	56	64 Å²	64	30%	0.299	33%	0.326	S	S	.	.			trans	-127.4	125.6	171.5	-179.4	-28.8	0	0	0	108.4	P579 Q583 E584 G585 Y628	P579-N581 PolarHBondContact O-N 2.63Å; N581-Q583 PolarHBondContact OD1-N 2.92Å; N581-E584 PolarHBondContact OD1-N 3.44Å; N581-E584 VanDerWaalsContact OD1-N 3.08Å; N581-G585 WeakPolarHBondContact CB-O 3.4Å; N581-G585 WeakPolarHBondContact O-CA 3.39Å; N581-Y628 PolarHBondContact N-OH 3.15Å; N581-Y628 WeakPolarHBondContact O-CE2 3.34Å; N581-Y628 PolarHBondContact O-OH 3.41Å
582	D	87.6	Confident	95.1	Very high	115 Å²	115	71 Å²	71	62%	0.615	35%	0.352	S	S	*	.	S	Bend	trans	-98.6	-8	-173.5	61.2	-22.3	0	0	0	114.4	L565 W640	L565-D582 HydrophobicContact CD2-CB 4.01Å; D582-W640 WeakPolarHBondContact O-CH2 3.43Å; D582-W640 VanDerWaalsContact O-CZ2 3.25Å; D582-W640 WeakPolarHBondContact O-CZ2 3.29Å
583	Q	87.5	Confident	95.1	Very high	156 Å²	156	74 Å²	74	73%	0.729	37%	0.373	S	S	*	.	S	Bend	trans	-98.6	-52.6	177.9	-61.9	-160.8	-4.3	0	0	112.6	N581 P630	N581-Q583 PolarHBondContact OD1-N 2.92Å; Q583-P630 VanDerWaalsContact O-CG 3.28Å; Q583-P630 WeakPolarHBondContact O-CG 3.35Å
584	E	92.2	Very high	95	Very high	153 Å²	153	74.2 Å²	74.2	72%	0.715	38%	0.375	S	S	*	.	S	Bend	trans	-105.5	-15.6	-174.6	-61.6	-174.7	168.6	0	0	112.6	N581 P630	N581-E584 PolarHBondContact OD1-N 3.44Å; N581-E584 VanDerWaalsContact OD1-N 3.08Å; E584-P630 WeakPolarHBondContact O-CD 3.09Å
585	G	95.9	Very high	95	Very high	9 Å²	9	75.8 Å²	75.8	9%	0.093	38%	0.38	C	S	.	.			trans	79	-167.5	-166.8	0	0	0	0	0	112.6	N581 Y628	N581-G585 WeakPolarHBondContact CB-O 3.4Å; N581-G585 WeakPolarHBondContact O-CA 3.39Å; G585-Y628 CarbonylContact C-O 3.51Å; G585-Y628 VanDerWaalsContact CA-CE2 3.44Å; G585-Y628 VanDerWaalsContact CA-O 3.26Å; G585-Y628 WeakPolarHBondContact CA-O 3.45Å
586	A	97.1	Very high	95	Very high	18 Å²	18	77.3 Å²	77.3	15%	0.149	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	153.4	-176.8	0	0	0	0	0	112.8	A578 K627 Y628	A578-A586 HydrophobicContact CB-CB 3.77Å; A586-K627 CarbonylContact O-C 3.51Å; A586-K627 WeakPolarHBondContact O-CA 3.28Å; A586-K627 WeakPolarHBondContact O-CB 3.44Å; A586-Y628 HydrophobicContact CB-CD1 4.47Å; A586-Y628 HydrophobicContact CB-CE1 3.62Å; A586-Y628 PolarHBondContact N-O 2.97Å; A586-Y628 PolarHBondContact O-N 2.98Å
587	E	97.8	Very high	95.1	Very high	121 Å²	121	77 Å²	77	57%	0.565	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.6	176.5	177.8	157.1	-163.7	0	0	110.5	K627	E587-K627 HydrophobicContact CB-CB 3.71Å; E587-K627 HydrophobicContact CB-CD 4.36Å; E587-K627 HydrophobicContact CG-CB 3.9Å; E587-K627 HydrophobicContact CG-CD 4.18Å; E587-K627 WeakPolarHBondContact OE2-CD 3.5Å; E587-K627 IonicContact OE2-NZ 2.86Å
588	A	96.5	Very high	95.2	Very high	6 Å²	6	71.4 Å²	71.4	5%	0.05	36%	0.363	C	S	.	.			trans	-78.6	122.8	179.9	0	0	0	0	0	110.8	F577 D590 W591 V626	F577-A588 HydrophobicContact CB-CB 4.06Å; F577-A588 WeakPolarHBondContact O-CB 3.46Å; A588-D590 VanDerWaalsContact C-N 3.33Å; A588-W591 HydrophobicContact CB-CB 4.14Å; A588-V626 WeakPolarHBondContact CB-O 3.48Å; A588-V626 PolarHBondContact N-O 3.14Å
589	K	93.7	Very high	95.3	Very high	221 Å²	221	70.1 Å²	70.1	96%	0.961	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-42.7	171.9	-66.2	-177.5	-179.4	178.2	0	111.4
590	D	95.7	Very high	95.5	Very high	73 Å²	73	64.5 Å²	64.5	39%	0.39	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	78.1	172.5	-178.9	22.6	0	0	0	110.7	F577 A588 R592 S593	F577-D590 HydrophobicContact CD1-CB 4.39Å; A588-D590 VanDerWaalsContact C-N 3.33Å; D590-R592 PolarHBondContact O-N 3.42Å; D590-R592 VanDerWaalsContact O-N 3.1Å; D590-R592 PolarHBondContact OD1-N 2.88Å; D590-S593 PolarHBondContact O-N 3.29Å; D590-S593 WeakPolarHBondContact OD2-CB 3.45Å; D590-S593 PolarHBondContact OD2-OG 3.46Å
591	W	96.9	Very high	95.7	Very high	35 Å²	35	61.4 Å²	61.4	13%	0.133	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.1	-22.7	-177.7	70	-86.5	0	0	0	114.1	A588 S593 G594 K624 V626 R645 D647	A588-W591 HydrophobicContact CB-CB 4.14Å; W591-S593 VanDerWaalsContact C-N 3.28Å; W591-S593 PolarHBondContact O-N 3.46Å; W591-G594 PolarHBondContact O-N 3Å; W591-K624 HydrophobicContact CE3-CB 3.96Å; W591-K624 HydrophobicContact CZ3-CB 4.18Å; W591-V626 HydrophobicContact CB-CB 4.2Å; W591-V626 HydrophobicContact CB-CG1 4.15Å; W591-V626 HydrophobicContact CB-CG2 4.01Å; W591-V626 HydrophobicContact CD2-CG2 4.01Å; W591-V626 HydrophobicContact CE3-CG2 4.03Å; W591-V626 HydrophobicContact CG-CG1 4.43Å; W591-V626 HydrophobicContact CG-CG2 4Å; W591-R645 HydrophobicContact CE3-CB 4.17Å; W591-R645 HydrophobicContact CH2-CB 4.11Å; W591-R645 HydrophobicContact CH2-CG 3.74Å; W591-R645 HydrophobicContact CZ2-CG 4.17Å; W591-R645 HydrophobicContact CZ3-CB 3.81Å; W591-R645 HydrophobicContact CZ3-CG 3.99Å; W591-D647 HydrophobicContact CH2-CB 4.08Å; W591-D647 HydrophobicContact CZ3-CB 3.89Å
592	R	96.3	Very high	95.9	Very high	147 Å²	147	59.4 Å²	59.4	56%	0.555	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-73.3	-20.3	177.4	-70.8	-173.6	178	173.8	-1.9	112.5	D590 G594 K624 D647	D590-R592 PolarHBondContact O-N 3.42Å; D590-R592 VanDerWaalsContact O-N 3.1Å; D590-R592 PolarHBondContact OD1-N 2.88Å; R592-G594 PolarHBondContact O-N 3.23Å; R592-K624 WeakPolarHBondContact O-CD 3.48Å; R592-K624 WeakPolarHBondContact O-CE 3.41Å; R592-K624 PolarHBondContact O-NZ 3.41Å; R592-D647 IonicContact NE-OD1 2.81Å
593	S	95.9	Very high	96.3	Very high	62 Å²	62	56.4 Å²	56.4	43%	0.434	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-78.6	-2.3	172	-70.6	0	0	0	0	113.1	F577 D590 W591	F577-S593 WeakPolarHBondContact CD2-O 3.45Å; D590-S593 PolarHBondContact O-N 3.29Å; D590-S593 WeakPolarHBondContact OD2-CB 3.45Å; D590-S593 PolarHBondContact OD2-OG 3.46Å; W591-S593 VanDerWaalsContact C-N 3.28Å; W591-S593 PolarHBondContact O-N 3.46Å
594	G	95.9	Very high	96.5	Very high	5 Å²	5	56.1 Å²	56.1	5%	0.052	27%	0.271	C	S	.	.	S	Bend	trans	-69.6	158.3	176.9	0	0	0	0	0	114.1	N575 W591 R592 K624	N575-G594 CarbonylContact O-C 3.55Å; N575-G594 VanDerWaalsContact O-CA 3.23Å; N575-G594 WeakPolarHBondContact O-CA 3.31Å; W591-G594 PolarHBondContact O-N 3Å; R592-G594 PolarHBondContact O-N 3.23Å; G594-K624 WeakPolarHBondContact O-CD 3.47Å; G594-K624 WeakPolarHBondContact O-CE 3.47Å
595	K	97.4	Very high	96.5	Very high	77 Å²	77	49.2 Å²	49.2	34%	0.335	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-69	133.6	179.9	-59.5	-173.6	175.4	-164.8	0	110.8	Y482 D519 N575	Y482-K595 HydrophobicContact CD1-CB 4.18Å; Y482-K595 HydrophobicContact CE1-CB 3.96Å; Y482-K595 HydrophobicContact CE1-CD 3.9Å; Y482-K595 HydrophobicContact CE2-CD 4.36Å; D519-K595 PolarHBondContact O-NZ 2.78Å; D519-K595 IonicContact OD1-NZ 3.69Å; D519-K595 PolarHBondContact OD1-NZ 3.15Å; D519-K595 VanDerWaalsContact OD1-NZ 3.14Å; N575-K595 HydrophobicContact CB-CB 4.13Å; N575-K595 PolarHBondContact ND2-O 3.19Å; N575-K595 PolarHBondContact O-N 2.98Å
596	P	98	Very high	96.2	Very high	33 Å²	33	50.9 Å²	50.9	21%	0.214	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-72.4	139.8	-175.2	29.7	-35.5	0	0	0	112.7	I622	P596-I622 HydrophobicContact CB-CG2 3.37Å
597	V	98.6	Very high	95.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.3	177	-176.3	0	0	0	0	109.3	L524 L572 N575 V599 Y623 L644	L524-V597 HydrophobicContact CB-CG1 4.42Å; L524-V597 HydrophobicContact CD2-CG1 3.95Å; L524-V597 HydrophobicContact CG-CG1 3.84Å; L572-V597 HydrophobicContact CD1-CG2 4.08Å; N575-V597 HydrophobicContact CB-CG2 4.3Å; N575-V597 WeakPolarHBondContact ND2-CG2 3.44Å; V597-V599 PolarHBondContact O-N 3.18Å; V597-Y623 PolarHBondContact N-O 2.98Å; V597-Y623 PolarHBondContact O-N 2.81Å; V597-L644 HydrophobicContact CB-CD2 4.26Å; V597-L644 HydrophobicContact CG1-CD2 4.34Å; V597-L644 HydrophobicContact CG2-CD2 4.39Å
598	R	98.7	Very high	95.1	Very high	1 Å²	1	58.2 Å²	58.2	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.3	170.1	-65.6	-178.8	-68.2	-78.8	4.3	110.2	H481 G483 V505 Y522 S523 L524 Y619 I622	H481-R598 PolarHBondContact O-NH1 2.95Å; H481-R598 PolarHBondContact O-NH2 2.9Å; G483-R598 WeakPolarHBondContact O-CD 3.29Å; G483-R598 WeakPolarHBondContact O-CG 3.34Å; G483-R598 PolarHBondContact O-NH1 2.84Å; V505-R598 PolarHBondContact O-NE 2.82Å; Y522-R598 PolarHBondContact O-N 3.19Å; S523-R598 CarbonylContact C-O 3.54Å; S523-R598 WeakPolarHBondContact CA-O 3.28Å; S523-R598 WeakPolarHBondContact CB-O 3.44Å; L524-R598 PolarHBondContact N-O 3.47Å; R598-Y619 HydrophobicContact CB-CE2 3.85Å; R598-Y619 HydrophobicContact CG-CE2 4.1Å; R598-I622 HydrophobicContact CB-CD1 4.49Å; R598-I622 HydrophobicContact CG-CD1 3.72Å
599	V	98.6	Very high	95	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.8	-178.9	176.1	0	0	0	0	111.2	L524 L526 F540 V597 Y619 D620 G621 Y623	L524-V599 HydrophobicContact CD1-CB 4.48Å; L524-V599 HydrophobicContact CD1-CG1 4.12Å; L524-V599 HydrophobicContact CD1-CG2 4.04Å; L524-V599 HydrophobicContact CG-CG2 4.29Å; L526-V599 HydrophobicContact CD1-CG1 4.2Å; F540-V599 HydrophobicContact CE1-CG1 3.92Å; F540-V599 HydrophobicContact CE1-CG2 3.98Å; F540-V599 HydrophobicContact CZ-CG1 3.92Å; F540-V599 HydrophobicContact CZ-CG2 3.72Å; V597-V599 PolarHBondContact O-N 3.18Å; V599-Y619 WeakPolarHBondContact O-CD2 3.37Å; V599-D620 PolarHBondContact O-N 3.42Å; V599-G621 PolarHBondContact N-O 3.48Å; V599-Y623 HydrophobicContact CB-CD2 3.56Å; V599-Y623 HydrophobicContact CB-CE2 3.74Å; V599-Y623 HydrophobicContact CB-CG 4.36Å; V599-Y623 HydrophobicContact CG1-CD2 4.35Å; V599-Y623 HydrophobicContact CG1-CE2 4.17Å; V599-Y623 HydrophobicContact CG2-CD1 4.49Å; V599-Y623 HydrophobicContact CG2-CD2 3.24Å; V599-Y623 HydrophobicContact CG2-CE2 3.91Å; V599-Y623 HydrophobicContact CG2-CG 3.6Å
600	V	98.5	Very high	95	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.3	173.5	178.9	0	0	0	0	109.3	V500 V505 H506 L524 V525 L526 N617 R618	V500-V600 HydrophobicContact CG1-CG1 4.35Å; V500-V600 HydrophobicContact CG1-CG2 4.03Å; V505-V600 HydrophobicContact CG1-CG2 3.58Å; H506-V600 HydrophobicContact CB-CG2 4.29Å; L524-V600 PolarHBondContact O-N 2.73Å; V525-V600 CarbonylContact C-O 3.54Å; V525-V600 VanDerWaalsContact CA-O 3.29Å; V525-V600 WeakPolarHBondContact CA-O 3.39Å; V525-V600 HydrophobicContact CG1-CB 4.49Å; V525-V600 HydrophobicContact CG1-CG1 4.42Å; V525-V600 HydrophobicContact CG2-CB 4.23Å; L526-V600 PolarHBondContact N-O 3.01Å; V600-N617 HydrophobicContact CG1-CB 3.87Å; V600-R618 CarbonylContact C-O 3.56Å; V600-R618 VanDerWaalsContact CA-O 3.32Å; V600-R618 WeakPolarHBondContact CA-O 3.42Å
601	R	98.1	Very high	95.1	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.1	170.7	-70.2	-166.9	175.7	73.6	3.5	110.4	L526 D535 G537 P613 N617 R618 D620 Y623 W654	L526-R601 HydrophobicContact CB-CG 4.17Å; L526-R601 HydrophobicContact CD1-CG 4.03Å; D535-R601 IonicContact OD1-CZ 3.87Å; D535-R601 IonicContact OD1-NE 3.37Å; D535-R601 PolarHBondContact OD1-NE 2.86Å; D535-R601 IonicContact OD1-NH2 3.79Å; D535-R601 PolarHBondContact OD1-NH2 2.99Å; D535-R601 IonicContact OD2-CZ 3.24Å; D535-R601 IonicContact OD2-NE 2.78Å; D535-R601 PolarHBondContact OD2-NE 3.45Å; D535-R601 IonicContact OD2-NH2 2.68Å; G537-R601 PolarHBondContact O-NH2 3.31Å; R601-P613 WeakPolarHBondContact O-CD 3.33Å; R601-P613 WeakPolarHBondContact O-CG 3.35Å; R601-N617 CarbonylContact O-C 3.32Å; R601-N617 WeakPolarHBondContact O-CA 3.3Å; R601-R618 PolarHBondContact N-O 2.66Å; R601-R618 PolarHBondContact O-N 3.38Å; R601-D620 WeakPolarHBondContact CD-OD2 3.31Å; R601-D620 WeakPolarHBondContact CG-OD2 3.35Å; R601-D620 IonicContact CZ-OD2 3.71Å; R601-D620 IonicContact NE-OD2 2.8Å; R601-D620 IonicContact NH1-OD2 2.77Å; R601-D620 PolarHBondContact NH1-OD2 3.5Å; R601-Y623 PolarHBondContact NH1-OH 3.32Å; R601-Y623 VanDerWaalsContact NH1-OH 3.15Å; R601-Y623 PolarHBondContact NH2-OH 3.43Å; R601-W654 VanDerWaalsContact NH1-CZ3 3.31Å
602	N	96.9	Very high	95.1	Very high	14 Å²	14	53.9 Å²	53.9	8%	0.075	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	148.6	178.3	179.4	-85.1	0	0	0	111.1	V525 L526 A527 K604 G605 G616 N617	V525-N602 HydrophobicContact CG1-CB 4.22Å; L526-N602 PolarHBondContact O-N 3Å; A527-N602 HydrophobicContact CB-CB 3.97Å; N602-K604 PolarHBondContact O-N 2.85Å; N602-K604 VanDerWaalsContact O-N 3.08Å; N602-K604 VanDerWaalsContact OD1-CB 3.28Å; N602-K604 WeakPolarHBondContact OD1-CB 3.37Å; N602-K604 VanDerWaalsContact OD1-CG 3.3Å; N602-K604 WeakPolarHBondContact OD1-CG 3.34Å; N602-K604 PolarHBondContact OD1-N 3.46Å; N602-G605 PolarHBondContact O-N 3.35Å; N602-G616 WeakPolarHBondContact CA-O 3.24Å; N602-G616 PolarHBondContact ND2-O 2.83Å; N602-N617 PolarHBondContact ND2-OD1 3.27Å
603	V	95.9	Very high	95.1	Very high	53 Å²	53	47.3 Å²	47.3	32%	0.321	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-50.3	-32.6	178.1	62.8	0	0	0	0	114.1	G605 G606 P613 A614 G616	V603-G605 PolarHBondContact O-N 3.12Å; V603-G606 PolarHBondContact O-N 3.31Å; V603-P613 WeakPolarHBondContact CA-O 3.38Å; V603-A614 VanDerWaalsContact CG2-O 3.29Å; V603-A614 WeakPolarHBondContact CG2-O 3.13Å; V603-G616 PolarHBondContact N-O 3.36Å
604	K	92.8	Very high	94.9	Very high	149 Å²	149	49.5 Å²	49.5	65%	0.648	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-62.6	-25.6	178.2	-68.3	179.9	178.7	-174.1	0	113	A527 N602 G606	A527-K604 CarbonylContact O-C 3.55Å; A527-K604 WeakPolarHBondContact O-CB 3.34Å; N602-K604 PolarHBondContact O-N 2.85Å; N602-K604 VanDerWaalsContact O-N 3.08Å; N602-K604 VanDerWaalsContact OD1-CB 3.28Å; N602-K604 WeakPolarHBondContact OD1-CB 3.37Å; N602-K604 VanDerWaalsContact OD1-CG 3.3Å; N602-K604 WeakPolarHBondContact OD1-CG 3.34Å; N602-K604 PolarHBondContact OD1-N 3.46Å; K604-G606 PolarHBondContact O-N 2.86Å
605	G	90.8	Very high	94.7	Very high	8 Å²	8	52.8 Å²	52.8	8%	0.082	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-69.2	-13	171.9	0	0	0	0	0	114	A527 N602 V603 K607 N608 S609	A527-G605 PolarHBondContact O-N 3.04Å; N602-G605 PolarHBondContact O-N 3.35Å; V603-G605 PolarHBondContact O-N 3.12Å; G605-K607 PolarHBondContact O-N 3.03Å; G605-N608 PolarHBondContact O-N 2.88Å; G605-N608 VanDerWaalsContact O-N 3.08Å; G605-S609 WeakPolarHBondContact O-CB 3.32Å; G605-S609 PolarHBondContact O-N 3.37Å
606	G	90.2	Very high	94.6	Very high	45 Å²	45	49.1 Å²	49.1	46%	0.464	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-61.5	-16.7	-177.6	0	0	0	0	0	115.2	V603 K604 N608 S609	V603-G606 PolarHBondContact O-N 3.31Å; K604-G606 PolarHBondContact O-N 2.86Å; G606-N608 VanDerWaalsContact C-N 3.3Å; G606-N608 PolarHBondContact O-N 3.47Å; G606-S609 WeakPolarHBondContact CA-O 3.18Å
607	K	87.1	Confident	94.6	Very high	184 Å²	184	47.6 Å²	47.6	80%	0.8	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-62.5	-38.8	173.3	-62.9	-177.8	-179.4	-178.2	0	112.1	G605	G605-K607 PolarHBondContact O-N 3.03Å
608	N	85.8	Confident	94.5	Very high	108 Å²	108	48.8 Å²	48.8	58%	0.578	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-9.3	-171.3	-58.7	-0.8	0	0	0	112.4	G605 G606	G605-N608 PolarHBondContact O-N 2.88Å; G605-N608 VanDerWaalsContact O-N 3.08Å; G606-N608 VanDerWaalsContact C-N 3.3Å; G606-N608 PolarHBondContact O-N 3.47Å
609	S	92.9	Very high	94.5	Very high	11 Å²	11	48.9 Å²	48.9	8%	0.077	26%	0.263	C	S	.	.			trans	-130.8	123.7	-177.6	177.3	0	0	0	0	112.3	D535 G605 G606 Y611	D535-S609 VanDerWaalsContact CG-OG 3.29Å; D535-S609 WeakPolarHBondContact OD2-CB 3.31Å; D535-S609 PolarHBondContact OD2-OG 2.94Å; G605-S609 WeakPolarHBondContact O-CB 3.32Å; G605-S609 PolarHBondContact O-N 3.37Å; G606-S609 WeakPolarHBondContact CA-O 3.18Å; S609-Y611 PolarHBondContact O-N 2.93Å; S609-Y611 PolarHBondContact OG-N 3.38Å
610	K	95.1	Very high	94.5	Very high	175 Å²	175	48.9 Å²	48.9	76%	0.761	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.2	169.3	67.8	-177.9	179.7	-175.6	0	113.8
611	Y	96.8	Very high	94.4	Very high	40 Å²	40	48.9 Å²	48.9	16%	0.157	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-14.8	-177.5	-53.8	-77.4	0	0	0	112.6	D535 H536 G537 S609 R618 W654	D535-Y611 WeakPolarHBondContact O-CE2 3.24Å; H536-Y611 VanDerWaalsContact C-CZ 3.43Å; H536-Y611 VanDerWaalsContact CA-CE2 3.47Å; H536-Y611 PolarHBondContact O-OH 2.88Å; G537-Y611 VanDerWaalsContact N-CD2 3.32Å; G537-Y611 VanDerWaalsContact N-CE2 3.28Å; S609-Y611 PolarHBondContact O-N 2.93Å; S609-Y611 PolarHBondContact OG-N 3.38Å; Y611-R618 PolarHBondContact O-NH2 3.41Å; Y611-W654 HydrophobicContact CD1-CB 4.38Å; Y611-W654 AromaticContact CD1-CD1 3.78Å; Y611-W654 AromaticContact CD1-CD2 3.82Å; Y611-W654 HydrophobicContact CD1-CD2 3.82Å; Y611-W654 AromaticContact CD1-CE2 3.95Å; Y611-W654 HydrophobicContact CD1-CE3 4.5Å; Y611-W654 AromaticContact CD1-CG 3.73Å; Y611-W654 HydrophobicContact CD1-CG 3.73Å; Y611-W654 AromaticContact CD1-NE1 3.89Å; Y611-W654 AromaticContact CE1-CD1 3.89Å; Y611-W654 HydrophobicContact CE1-CG 4.3Å; Y611-W654 AromaticContact CE1-NE1 3.9Å
612	A	96.2	Very high	94.4	Very high	18 Å²	18	49.3 Å²	49.3	15%	0.149	27%	0.265	C	S	.	.	S	Bend	trans	-58.1	144.4	173.8	0	0	0	0	0	111.1
613	P	96	Very high	94.5	Very high	10 Å²	10	48.6 Å²	48.6	7%	0.065	26%	0.262	C	S	.	.			trans	-68.1	154.6	175.4	31.6	-36.4	0	0	0	110.8	R601 V603 E615 R618	R601-P613 WeakPolarHBondContact O-CD 3.33Å; R601-P613 WeakPolarHBondContact O-CG 3.35Å; V603-P613 WeakPolarHBondContact CA-O 3.38Å; P613-E615 WeakPolarHBondContact CB-O 3.5Å; P613-E615 PolarHBondContact O-N 3.04Å; P613-R618 HydrophobicContact CB-CB 4.18Å; P613-R618 HydrophobicContact CG-CB 4.19Å
614	A	92.6	Very high	94.6	Very high	107 Å²	107	47.7 Å²	47.7	88%	0.884	25%	0.253	S	S	*	.	S	Bend	trans	-66.1	-24.2	176.8	0	0	0	0	0	112.9	V603	V603-A614 VanDerWaalsContact CG2-O 3.29Å; V603-A614 WeakPolarHBondContact CG2-O 3.13Å
615	E	92.2	Very high	94.9	Very high	74 Å²	74	40.6 Å²	40.6	35%	0.346	22%	0.223	S	C	.	.	S	Bend	trans	-148.2	152.1	178.3	-177.7	171.1	-159.8	0	0	110.2	R495 P613 M669	R495-E615 VanDerWaalsContact CD-OE1 3.23Å; R495-E615 WeakPolarHBondContact CD-OE1 3.49Å; R495-E615 IonicContact CZ-OE1 3.99Å; R495-E615 IonicContact NE-OE1 2.7Å; R495-E615 PolarHBondContact NE-OE1 3.49Å; R495-E615 IonicContact NH2-OE1 3.92Å; P613-E615 WeakPolarHBondContact CB-O 3.5Å; P613-E615 PolarHBondContact O-N 3.04Å; E615-M669 HydrophobicContact CB-CE 4.01Å; E615-M669 HydrophobicContact CG-CE 4.15Å; E615-M669 WeakPolarHBondContact O-CE 3.47Å
616	G	94.5	Very high	95.3	Very high	1 Å²	1	41 Å²	41	1%	0.01	22%	0.224	C	C	.	.	S	Bend	trans	63.3	-141.2	168.9	0	0	0	0	0	114.5	W494 N602 V603	W494-G616 CarbonylContact O-C 3.46Å; W494-G616 WeakPolarHBondContact O-CA 3.19Å; N602-G616 WeakPolarHBondContact CA-O 3.24Å; N602-G616 PolarHBondContact ND2-O 2.83Å; V603-G616 PolarHBondContact N-O 3.36Å
617	N	97.6	Very high	95.6	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.3	-177	-51.5	-91.9	0	0	0	108.5	M493 W494 R497 V500 V600 R601 N602	M493-N617 CarbonylContact C-O 3.49Å; M493-N617 VanDerWaalsContact CA-O 3.22Å; M493-N617 WeakPolarHBondContact CA-O 3.42Å; W494-N617 PolarHBondContact N-O 2.8Å; W494-N617 PolarHBondContact O-N 3.45Å; W494-N617 PolarHBondContact O-ND2 3.29Å; R497-N617 WeakPolarHBondContact CD-OD1 3.49Å; V500-N617 HydrophobicContact CG2-CB 3.62Å; V600-N617 HydrophobicContact CG1-CB 3.87Å; R601-N617 CarbonylContact O-C 3.32Å; R601-N617 WeakPolarHBondContact O-CA 3.3Å; N602-N617 PolarHBondContact ND2-OD1 3.27Å
618	R	98.2	Very high	96.2	Very high	25 Å²	25	33.2 Å²	33.2	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.2	176	-169	-178.6	68.6	-146.8	-10.5	110.6	T492 M493 V600 R601 Y611 P613 D620	T492-R618 WeakPolarHBondContact O-CA 3.45Å; M493-R618 HydrophobicContact CG-CB 4.1Å; M493-R618 HydrophobicContact CG-CG 3.78Å; V600-R618 CarbonylContact C-O 3.56Å; V600-R618 VanDerWaalsContact CA-O 3.32Å; V600-R618 WeakPolarHBondContact CA-O 3.42Å; R601-R618 PolarHBondContact N-O 2.66Å; R601-R618 PolarHBondContact O-N 3.38Å; Y611-R618 PolarHBondContact O-NH2 3.41Å; P613-R618 HydrophobicContact CB-CB 4.18Å; P613-R618 HydrophobicContact CG-CB 4.19Å; R618-D620 WeakPolarHBondContact CG-OD1 3.14Å; R618-D620 IonicContact CZ-OD1 3.4Å; R618-D620 IonicContact CZ-OD2 2.71Å; R618-D620 IonicContact NE-OD1 3.03Å; R618-D620 PolarHBondContact NE-OD1 3.28Å; R618-D620 IonicContact NE-OD2 3.52Å; R618-D620 IonicContact NH2-OD1 3.99Å; R618-D620 PolarHBondContact NH2-OD1 3Å; R618-D620 IonicContact NH2-OD2 3.71Å; R618-D620 PolarHBondContact NH2-OD2 2.64Å
619	Y	98.3	Very high	96.8	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.9	172.1	175.1	-131.3	0	0	0	110.1	I488 V490 G491 T492 V505 R598 V599 G621 I622	I488-Y619 HydrophobicContact CG2-CD1 4.29Å; V490-Y619 HydrophobicContact CG2-CD1 4.34Å; V490-Y619 HydrophobicContact CG2-CE1 4.01Å; G491-Y619 PolarHBondContact N-O 3.07Å; T492-Y619 PolarHBondContact O-N 3.44Å; V505-Y619 HydrophobicContact CG1-CD2 3.76Å; V505-Y619 HydrophobicContact CG1-CE2 4.32Å; V505-Y619 HydrophobicContact CG1-CG 4.14Å; R598-Y619 HydrophobicContact CB-CE2 3.85Å; R598-Y619 HydrophobicContact CG-CE2 4.1Å; V599-Y619 WeakPolarHBondContact O-CD2 3.37Å; Y619-G621 WeakPolarHBondContact CE2-O 3.41Å; Y619-I622 WeakPolarHBondContact OH-CD1 3.26Å
620	D	97.9	Very high	97	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	4	-170.4	-75.3	4.2	0	0	0	113.7	V599 R601 R618 R646 W654	V599-D620 PolarHBondContact O-N 3.42Å; R601-D620 WeakPolarHBondContact CD-OD2 3.31Å; R601-D620 WeakPolarHBondContact CG-OD2 3.35Å; R601-D620 IonicContact CZ-OD2 3.71Å; R601-D620 IonicContact NE-OD2 2.8Å; R601-D620 IonicContact NH1-OD2 2.77Å; R601-D620 PolarHBondContact NH1-OD2 3.5Å; R618-D620 WeakPolarHBondContact CG-OD1 3.14Å; R618-D620 IonicContact CZ-OD1 3.4Å; R618-D620 IonicContact CZ-OD2 2.71Å; R618-D620 IonicContact NE-OD1 3.03Å; R618-D620 PolarHBondContact NE-OD1 3.28Å; R618-D620 IonicContact NE-OD2 3.52Å; R618-D620 IonicContact NH2-OD1 3.99Å; R618-D620 PolarHBondContact NH2-OD1 3Å; R618-D620 IonicContact NH2-OD2 3.71Å; R618-D620 PolarHBondContact NH2-OD2 2.64Å; D620-R646 PolarHBondContact O-NE 2.85Å; D620-R646 VanDerWaalsContact O-NE 3.12Å; D620-R646 PolarHBondContact O-NH2 3.02Å; D620-W654 HydrophobicContact CB-CZ3 4.06Å; D620-W654 WeakPolarHBondContact OD2-CZ3 3.49Å
621	G	97.3	Very high	97	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.9	-160.4	173.9	0	0	0	0	0	114.3	V490 V599 Y619 D648	V490-G621 VanDerWaalsContact CG2-CA 3.44Å; V599-G621 PolarHBondContact N-O 3.48Å; Y619-G621 WeakPolarHBondContact CE2-O 3.41Å; G621-D648 WeakPolarHBondContact CA-OD2 3.23Å
622	I	98.2	Very high	96.9	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.051	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.7	-174.7	-58.7	-55.8	0	0	0	111.7	P484 P596 R598 Y619 R646 D647 D648	P484-I622 HydrophobicContact CG-CD1 4Å; P484-I622 HydrophobicContact CG-CG1 3.77Å; P596-I622 HydrophobicContact CB-CG2 3.37Å; R598-I622 HydrophobicContact CB-CD1 4.49Å; R598-I622 HydrophobicContact CG-CD1 3.72Å; Y619-I622 WeakPolarHBondContact OH-CD1 3.26Å; I622-R646 WeakPolarHBondContact O-CG 3.3Å; I622-D647 PolarHBondContact O-N 3.39Å; I622-D648 HydrophobicContact CB-CB 4.05Å; I622-D648 PolarHBondContact N-OD2 2.88Å
623	Y	98.6	Very high	96.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	158.2	175.1	-69.8	-112.4	0	0	0	109.5	G537 F540 V597 V599 R601 L644 R645 R646 W654	G537-Y623 WeakPolarHBondContact O-CE1 3.17Å; G537-Y623 PolarHBondContact O-OH 3.3Å; F540-Y623 HydrophobicContact CD1-CD1 4.05Å; F540-Y623 AromaticContact CD1-CE1 3.81Å; F540-Y623 HydrophobicContact CD1-CE1 3.81Å; F540-Y623 AromaticContact CE1-CD1 3.46Å; F540-Y623 HydrophobicContact CE1-CD1 3.46Å; F540-Y623 VanDerWaalsContact CE1-CD1 3.46Å; F540-Y623 HydrophobicContact CE1-CD2 4.47Å; F540-Y623 AromaticContact CE1-CE1 3.51Å; F540-Y623 HydrophobicContact CE1-CE1 3.51Å; F540-Y623 AromaticContact CE1-CG 3.98Å; F540-Y623 HydrophobicContact CE1-CG 3.98Å; F540-Y623 HydrophobicContact CZ-CD1 4.39Å; V597-Y623 PolarHBondContact N-O 2.98Å; V597-Y623 PolarHBondContact O-N 2.81Å; V599-Y623 HydrophobicContact CB-CD2 3.56Å; V599-Y623 HydrophobicContact CB-CE2 3.74Å; V599-Y623 HydrophobicContact CB-CG 4.36Å; V599-Y623 HydrophobicContact CG1-CD2 4.35Å; V599-Y623 HydrophobicContact CG1-CE2 4.17Å; V599-Y623 HydrophobicContact CG2-CD1 4.49Å; V599-Y623 HydrophobicContact CG2-CD2 3.24Å; V599-Y623 HydrophobicContact CG2-CE2 3.91Å; V599-Y623 HydrophobicContact CG2-CG 3.6Å; R601-Y623 PolarHBondContact NH1-OH 3.32Å; R601-Y623 VanDerWaalsContact NH1-OH 3.15Å; R601-Y623 PolarHBondContact NH2-OH 3.43Å; Y623-L644 HydrophobicContact CD1-CB 4.36Å; Y623-R645 CarbonylContact C-O 3.57Å; Y623-R645 VanDerWaalsContact CA-O 3.25Å; Y623-R645 WeakPolarHBondContact CA-O 3.48Å; Y623-R645 VanDerWaalsContact CD1-C 3.45Å; Y623-R646 VanDerWaalsContact CD1-CA 3.49Å; Y623-R646 HydrophobicContact CD1-CB 3.84Å; Y623-R646 HydrophobicContact CD1-CG 4.4Å; Y623-R646 VanDerWaalsContact CD1-N 3.26Å; Y623-R646 HydrophobicContact CD2-CG 4.23Å; Y623-R646 HydrophobicContact CE1-CB 3.53Å; Y623-R646 HydrophobicContact CE1-CG 4.03Å; Y623-R646 HydrophobicContact CE2-CB 4.27Å; Y623-R646 HydrophobicContact CE2-CG 3.84Å; Y623-R646 HydrophobicContact CG-CB 4.33Å; Y623-R646 HydrophobicContact CG-CG 4.5Å; Y623-W654 WeakPolarHBondContact OH-CH2 3.13Å
624	K	98.4	Very high	96.4	Very high	33 Å²	33	39.1 Å²	39.1	14%	0.143	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149	175.4	-70.2	175.1	178.9	166.8	0	110	W591 R592 G594 V626 L644 R645 D647	W591-K624 HydrophobicContact CE3-CB 3.96Å; W591-K624 HydrophobicContact CZ3-CB 4.18Å; R592-K624 WeakPolarHBondContact O-CD 3.48Å; R592-K624 WeakPolarHBondContact O-CE 3.41Å; R592-K624 PolarHBondContact O-NZ 3.41Å; G594-K624 WeakPolarHBondContact O-CD 3.47Å; G594-K624 WeakPolarHBondContact O-CE 3.47Å; K624-V626 PolarHBondContact O-N 2.79Å; K624-L644 WeakPolarHBondContact O-CA 3.3Å; K624-R645 PolarHBondContact N-O 3.18Å; K624-R645 PolarHBondContact O-N 2.89Å; K624-D647 HydrophobicContact CD-CB 4.16Å; K624-D647 WeakPolarHBondContact CD-OD2 3.27Å; K624-D647 WeakPolarHBondContact CE-OD2 3.48Å; K624-D647 HydrophobicContact CG-CB 4.48Å; K624-D647 IonicContact NZ-OD2 3.23Å; K624-D647 PolarHBondContact NZ-OD2 2.92Å
625	V	98.5	Very high	96.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.9	178.5	-179.5	0	0	0	0	108.1	L572 N575 C576 Y642 L644	L572-V625 HydrophobicContact CD1-CG2 3.87Å; L572-V625 HydrophobicContact CG-CG2 4.28Å; N575-V625 HydrophobicContact CB-CB 4.33Å; N575-V625 HydrophobicContact CB-CG2 3.82Å; C576-V625 HydrophobicContact CB-CB 4.23Å; C576-V625 HydrophobicContact CB-CG1 3.87Å; V625-Y642 HydrophobicContact CG1-CD1 4.49Å; V625-L644 HydrophobicContact CG2-CD2 4.35Å; V625-L644 HydrophobicContact CG2-CG 4.16Å
626	V	98.4	Very high	95.8	Very high	17 Å²	17	34.8 Å²	34.8	10%	0.103	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-46.5	177.5	179.7	0	0	0	0	110.1	A588 W591 K624 L643 R645	A588-V626 WeakPolarHBondContact CB-O 3.48Å; A588-V626 PolarHBondContact N-O 3.14Å; W591-V626 HydrophobicContact CB-CB 4.2Å; W591-V626 HydrophobicContact CB-CG1 4.15Å; W591-V626 HydrophobicContact CB-CG2 4.01Å; W591-V626 HydrophobicContact CD2-CG2 4.01Å; W591-V626 HydrophobicContact CE3-CG2 4.03Å; W591-V626 HydrophobicContact CG-CG1 4.43Å; W591-V626 HydrophobicContact CG-CG2 4Å; K624-V626 PolarHBondContact O-N 2.79Å; V626-L643 HydrophobicContact CB-CB 4.45Å; V626-L643 HydrophobicContact CB-CD2 4.1Å; V626-L643 HydrophobicContact CB-CG 4.15Å; V626-L643 HydrophobicContact CG1-CD2 4.18Å; V626-L643 HydrophobicContact CG2-CG 4.45Å; V626-L643 PolarHBondContact N-O 3.09Å; V626-R645 HydrophobicContact CG2-CB 3.6Å
627	K	98	Very high	95.7	Very high	64 Å²	64	38.1 Å²	38.1	28%	0.278	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	162.4	176.4	66.3	-179.7	-175.3	-180	0	111.1	A586 E587 W629 L643	A586-K627 CarbonylContact O-C 3.51Å; A586-K627 WeakPolarHBondContact O-CA 3.28Å; A586-K627 WeakPolarHBondContact O-CB 3.44Å; E587-K627 HydrophobicContact CB-CB 3.71Å; E587-K627 HydrophobicContact CB-CD 4.36Å; E587-K627 HydrophobicContact CG-CB 3.9Å; E587-K627 HydrophobicContact CG-CD 4.18Å; E587-K627 WeakPolarHBondContact OE2-CD 3.5Å; E587-K627 IonicContact OE2-NZ 2.86Å; K627-W629 HydrophobicContact CD-CE3 4.23Å; K627-W629 HydrophobicContact CD-CZ3 4.2Å; K627-W629 HydrophobicContact CG-CE3 3.84Å; K627-W629 HydrophobicContact CG-CZ3 3.65Å; K627-L643 HydrophobicContact CG-CB 3.95Å; K627-L643 HydrophobicContact CG-CD2 4.26Å; K627-L643 PolarHBondContact O-N 3.27Å
628	Y	98.4	Very high	95.4	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	147.4	172.8	68.9	-84.1	0	0	0	110	L565 A573 C576 N581 G585 A586 W640 R641 Y642	L565-Y628 HydrophobicContact CD1-CE2 4.47Å; L565-Y628 HydrophobicContact CD2-CE2 3.97Å; A573-Y628 HydrophobicContact CB-CD1 4.03Å; A573-Y628 HydrophobicContact CB-CD2 3.86Å; A573-Y628 HydrophobicContact CB-CE1 3.87Å; A573-Y628 HydrophobicContact CB-CE2 3.71Å; A573-Y628 HydrophobicContact CB-CG 4.04Å; C576-Y628 HydrophobicContact CB-CD1 3.87Å; C576-Y628 HydrophobicContact CB-CE1 3.93Å; N581-Y628 PolarHBondContact N-OH 3.15Å; N581-Y628 WeakPolarHBondContact O-CE2 3.34Å; N581-Y628 PolarHBondContact O-OH 3.41Å; G585-Y628 CarbonylContact C-O 3.51Å; G585-Y628 VanDerWaalsContact CA-CE2 3.44Å; G585-Y628 VanDerWaalsContact CA-O 3.26Å; G585-Y628 WeakPolarHBondContact CA-O 3.45Å; A586-Y628 HydrophobicContact CB-CD1 4.47Å; A586-Y628 HydrophobicContact CB-CE1 3.62Å; A586-Y628 PolarHBondContact N-O 2.97Å; A586-Y628 PolarHBondContact O-N 2.98Å; Y628-W640 AromaticContact CD2-CE3 3.88Å; Y628-W640 HydrophobicContact CD2-CE3 3.88Å; Y628-W640 AromaticContact CD2-CZ3 3.62Å; Y628-W640 HydrophobicContact CD2-CZ3 3.62Å; Y628-W640 HydrophobicContact CE2-CE3 4.44Å; Y628-W640 AromaticContact CE2-CZ3 3.81Å; Y628-W640 HydrophobicContact CE2-CZ3 3.81Å; Y628-R641 CarbonylContact C-O 3.53Å; Y628-R641 WeakPolarHBondContact CA-O 3.39Å; Y628-R641 WeakPolarHBondContact CB-O 3.16Å; Y628-Y642 VanDerWaalsContact CB-CD1 3.42Å; Y628-Y642 HydrophobicContact CD2-CE1 4.43Å; Y628-Y642 HydrophobicContact CG-CD1 4.26Å; Y628-Y642 HydrophobicContact CG-CE1 4.18Å
629	W	98.3	Very high	95.3	Very high	57 Å²	57	39.7 Å²	39.7	22%	0.216	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	151.5	-175.6	65.5	100.3	0	0	0	110.7	T541 K627 E631 R641 L643	T541-W629 HydrophobicContact CG2-CH2 3.85Å; T541-W629 HydrophobicContact CG2-CZ2 4.16Å; K627-W629 HydrophobicContact CD-CE3 4.23Å; K627-W629 HydrophobicContact CD-CZ3 4.2Å; K627-W629 HydrophobicContact CG-CE3 3.84Å; K627-W629 HydrophobicContact CG-CZ3 3.65Å; W629-E631 PolarHBondContact NE1-OE2 3.16Å; W629-R641 HydrophobicContact CD2-CB 4.1Å; W629-R641 HydrophobicContact CE3-CB 4.47Å; W629-R641 HydrophobicContact CH2-CB 4.17Å; W629-R641 HydrophobicContact CZ2-CB 3.8Å; W629-R641 HydrophobicContact CZ3-CB 4.47Å; W629-R641 PolarHBondContact N-O 2.96Å; W629-R641 PolarHBondContact O-N 2.83Å; W629-L643 HydrophobicContact CH2-CB 4.23Å; W629-L643 HydrophobicContact CZ3-CB 3.89Å
630	P	97.3	Very high	95.2	Very high	34 Å²	34	40 Å²	40	22%	0.221	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	140.3	168.4	30.6	-26.9	0	0	0	110.5	Q583 E584 L638 W640	Q583-P630 VanDerWaalsContact O-CG 3.28Å; Q583-P630 WeakPolarHBondContact O-CG 3.35Å; E584-P630 WeakPolarHBondContact O-CD 3.09Å; P630-L638 HydrophobicContact CB-CD1 4.03Å; P630-L638 HydrophobicContact CB-CD2 3.88Å; P630-L638 HydrophobicContact CB-CG 4.04Å; P630-W640 HydrophobicContact CB-CD2 4.27Å; P630-W640 HydrophobicContact CB-CE3 4.35Å; P630-W640 HydrophobicContact CB-CH2 4.17Å; P630-W640 HydrophobicContact CB-CZ2 4.03Å; P630-W640 HydrophobicContact CB-CZ3 4.32Å; P630-W640 HydrophobicContact CG-CH2 3.91Å; P630-W640 HydrophobicContact CG-CZ2 4.16Å; P630-W640 HydrophobicContact CG-CZ3 4.17Å
631	E	95.4	Very high	95.2	Very high	75 Å²	75	41.5 Å²	41.5	35%	0.35	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	151.7	178	-170.1	-179.4	121.2	0	0	109.6	W629 G633 V639 R641	W629-E631 PolarHBondContact NE1-OE2 3.16Å; E631-G633 PolarHBondContact O-N 3.04Å; E631-V639 PolarHBondContact N-O 3.35Å; E631-V639 WeakPolarHBondContact O-CG2 3.4Å; E631-V639 PolarHBondContact O-N 3.25Å; E631-R641 HydrophobicContact CB-CG 4.2Å; E631-R641 IonicContact OE1-CZ 3.72Å; E631-R641 IonicContact OE1-NH1 3.41Å; E631-R641 PolarHBondContact OE1-NH1 3.39Å; E631-R641 WeakPolarHBondContact OE2-CD 3.49Å; E631-R641 IonicContact OE2-NH1 2.82Å; E631-R641 PolarHBondContact OE2-NH1 3.01Å
632	K	94.7	Very high	95.3	Very high	158 Å²	158	41.5 Å²	41.5	69%	0.687	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	110.7	171.5	-162	173.7	-170.6	174.8	0	109	G636	K632-G636 WeakPolarHBondContact CE-O 3.35Å
633	G	92	Very high	95.3	Very high	8 Å²	8	42.9 Å²	42.9	8%	0.082	21%	0.214	C	C	.	.			trans	-69.9	174.1	-179.8	0	0	0	0	0	112.7	E631 S635 G636 F637	E631-G633 PolarHBondContact O-N 3.04Å; G633-S635 PolarHBondContact O-N 3.43Å; G633-S635 VanDerWaalsContact O-N 3.15Å; G633-G636 PolarHBondContact O-N 2.96Å; G633-F637 PolarHBondContact N-O 3.35Å
634	K	90	Very high	95.3	Very high	153 Å²	153	42.9 Å²	42.9	67%	0.665	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-29.5	179.4	-73.8	169.2	-175.1	173.9	0	113.7	E531 D532 G636	E531-K634 HydrophobicContact CB-CD 4.25Å; E531-K634 HydrophobicContact CG-CB 4.05Å; E531-K634 HydrophobicContact CG-CD 4.16Å; E531-K634 PolarHBondContact O-NZ 3.49Å; D532-K634 WeakPolarHBondContact OD1-CB 3.43Å; D532-K634 VanDerWaalsContact OD1-CG 3.27Å; D532-K634 WeakPolarHBondContact OD1-CG 3.41Å; D532-K634 PolarHBondContact OD1-N 3.32Å; K634-G636 PolarHBondContact O-N 2.84Å
635	S	84.9	Confident	95.3	Very high	53 Å²	53	47.3 Å²	47.3	37%	0.371	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-0.9	177.4	-67.3	0	0	0	0	113.7	E531 G633 F637	E531-S635 PolarHBondContact OE1-OG 2.96Å; G633-S635 PolarHBondContact O-N 3.43Å; G633-S635 VanDerWaalsContact O-N 3.15Å; S635-F637 VanDerWaalsContact C-N 3.32Å; S635-F637 PolarHBondContact O-N 3.19Å
636	G	87.7	Confident	95.3	Very high	38 Å²	38	49 Å²	49	39%	0.392	24%	0.236	S	C	.	.	S	Bend	trans	84.6	-2.1	177.1	0	0	0	0	0	115.3	K632 G633 K634	K632-G636 WeakPolarHBondContact CE-O 3.35Å; G633-G636 PolarHBondContact O-N 2.96Å; K634-G636 PolarHBondContact O-N 2.84Å
637	F	91.4	Very high	95.2	Very high	70 Å²	70	50.4 Å²	50.4	31%	0.307	24%	0.243	S	C	.	.	S	Bend	trans	-96.9	156.2	173.6	-62.2	-75.9	0	0	0	111.4	Q559 S560 G633 S635 V639	Q559-F637 HydrophobicContact CB-CD2 4.01Å; Q559-F637 WeakPolarHBondContact O-CE2 3.41Å; S560-F637 WeakPolarHBondContact O-CE1 3.4Å; S560-F637 WeakPolarHBondContact O-CZ 3.28Å; G633-F637 PolarHBondContact N-O 3.35Å; S635-F637 VanDerWaalsContact C-N 3.32Å; S635-F637 PolarHBondContact O-N 3.19Å; F637-V639 PolarHBondContact O-N 3.47Å
638	L	92.1	Very high	95.1	Very high	59 Å²	59	48.9 Å²	48.9	31%	0.309	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.1	173.3	-173.9	151.6	0	0	0	109.9	D562 Q563 P630	D562-L638 HydrophobicContact CB-CB 3.92Å; D562-L638 PolarHBondContact OD1-N 2.79Å; Q563-L638 PolarHBondContact N-O 3Å; Q563-L638 WeakPolarHBondContact O-CD2 3.44Å; P630-L638 HydrophobicContact CB-CD1 4.03Å; P630-L638 HydrophobicContact CB-CD2 3.88Å; P630-L638 HydrophobicContact CB-CG 4.04Å
639	V	95.5	Very high	94.8	Very high	1 Å²	1	57 Å²	57	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.4	174.6	-61.2	0	0	0	0	109.9	T543 Q563 E631 F637 R641	T543-V639 HydrophobicContact CG2-CB 3.89Å; T543-V639 HydrophobicContact CG2-CG1 4.3Å; T543-V639 HydrophobicContact CG2-CG2 4.25Å; Q563-V639 HydrophobicContact CG-CB 4.44Å; Q563-V639 HydrophobicContact CG-CG1 4.26Å; E631-V639 PolarHBondContact N-O 3.35Å; E631-V639 WeakPolarHBondContact O-CG2 3.4Å; E631-V639 PolarHBondContact O-N 3.25Å; F637-V639 PolarHBondContact O-N 3.47Å; V639-R641 HydrophobicContact CG2-CG 4.17Å
640	W	97	Very high	94.6	Very high	9 Å²	9	57 Å²	57	3%	0.034	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.2	173.6	-80.3	89.5	0	0	0	110	T543 G544 Q563 L565 D582 Y628 P630 Y642	T543-W640 CarbonylContact C-O 3.43Å; G544-W640 PolarHBondContact N-O 3.27Å; Q563-W640 PolarHBondContact O-NE1 2.78Å; L565-W640 HydrophobicContact CB-CD2 4.23Å; L565-W640 HydrophobicContact CB-CH2 4.24Å; L565-W640 HydrophobicContact CB-CZ2 3.66Å; L565-W640 HydrophobicContact CD1-CD2 3.75Å; L565-W640 HydrophobicContact CD1-CE3 3.8Å; L565-W640 HydrophobicContact CD1-CG 4.23Å; L565-W640 HydrophobicContact CD1-CH2 4.4Å; L565-W640 HydrophobicContact CD1-CZ2 4.4Å; L565-W640 HydrophobicContact CD1-CZ3 4.12Å; L565-W640 HydrophobicContact CD2-CH2 3.94Å; L565-W640 HydrophobicContact CD2-CZ2 4.23Å; L565-W640 HydrophobicContact CD2-CZ3 4.18Å; L565-W640 HydrophobicContact CG-CD2 4.49Å; L565-W640 HydrophobicContact CG-CH2 4.42Å; L565-W640 HydrophobicContact CG-CZ2 4.3Å; D582-W640 WeakPolarHBondContact O-CH2 3.43Å; D582-W640 VanDerWaalsContact O-CZ2 3.25Å; D582-W640 WeakPolarHBondContact O-CZ2 3.29Å; Y628-W640 AromaticContact CD2-CE3 3.88Å; Y628-W640 HydrophobicContact CD2-CE3 3.88Å; Y628-W640 AromaticContact CD2-CZ3 3.62Å; Y628-W640 HydrophobicContact CD2-CZ3 3.62Å; Y628-W640 HydrophobicContact CE2-CE3 4.44Å; Y628-W640 AromaticContact CE2-CZ3 3.81Å; Y628-W640 HydrophobicContact CE2-CZ3 3.81Å; P630-W640 HydrophobicContact CB-CD2 4.27Å; P630-W640 HydrophobicContact CB-CE3 4.35Å; P630-W640 HydrophobicContact CB-CH2 4.17Å; P630-W640 HydrophobicContact CB-CZ2 4.03Å; P630-W640 HydrophobicContact CB-CZ3 4.32Å; P630-W640 HydrophobicContact CG-CH2 3.91Å; P630-W640 HydrophobicContact CG-CZ2 4.16Å; P630-W640 HydrophobicContact CG-CZ3 4.17Å; W640-Y642 HydrophobicContact CB-CE2 3.84Å
641	R	97.6	Very high	94.4	Very high	31 Å²	31	57 Å²	57	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.9	-179	-55.9	-164.1	77.4	-169	4	110.4	D532 T541 Y542 Y628 W629 E631 V639	D532-R641 PolarHBondContact O-NH2 3.01Å; T541-R641 HydrophobicContact CG2-CB 4.01Å; Y542-R641 CarbonylContact O-C 3.49Å; Y542-R641 WeakPolarHBondContact O-CA 3.27Å; Y628-R641 CarbonylContact C-O 3.53Å; Y628-R641 WeakPolarHBondContact CA-O 3.39Å; Y628-R641 WeakPolarHBondContact CB-O 3.16Å; W629-R641 HydrophobicContact CD2-CB 4.1Å; W629-R641 HydrophobicContact CE3-CB 4.47Å; W629-R641 HydrophobicContact CH2-CB 4.17Å; W629-R641 HydrophobicContact CZ2-CB 3.8Å; W629-R641 HydrophobicContact CZ3-CB 4.47Å; W629-R641 PolarHBondContact N-O 2.96Å; W629-R641 PolarHBondContact O-N 2.83Å; E631-R641 HydrophobicContact CB-CG 4.2Å; E631-R641 IonicContact OE1-CZ 3.72Å; E631-R641 IonicContact OE1-NH1 3.41Å; E631-R641 PolarHBondContact OE1-NH1 3.39Å; E631-R641 WeakPolarHBondContact OE2-CD 3.49Å; E631-R641 IonicContact OE2-NH1 2.82Å; E631-R641 PolarHBondContact OE2-NH1 3.01Å; V639-R641 HydrophobicContact CG2-CG 4.17Å
642	Y	98.4	Very high	94.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	121.5	-178.5	-55.5	-97.1	0	0	0	109.2	T541 Y542 L565 N569 L572 A573 V625 Y628 W640	T541-Y642 CarbonylContact C-O 3.53Å; T541-Y642 VanDerWaalsContact CA-O 3.31Å; T541-Y642 WeakPolarHBondContact CA-O 3.42Å; Y542-Y642 PolarHBondContact N-O 2.95Å; Y542-Y642 PolarHBondContact O-N 3.46Å; L565-Y642 WeakPolarHBondContact CD1-OH 3.44Å; N569-Y642 VanDerWaalsContact C-OH 3.25Å; N569-Y642 VanDerWaalsContact CA-OH 3.24Å; N569-Y642 WeakPolarHBondContact CA-OH 3.11Å; N569-Y642 VanDerWaalsContact CB-OH 3.28Å; N569-Y642 WeakPolarHBondContact CB-OH 3.44Å; N569-Y642 PolarHBondContact O-OH 3.24Å; L572-Y642 HydrophobicContact CB-CD1 4.21Å; L572-Y642 HydrophobicContact CB-CE1 3.94Å; L572-Y642 HydrophobicContact CD2-CD1 3.78Å; L572-Y642 HydrophobicContact CD2-CD2 3.77Å; L572-Y642 HydrophobicContact CD2-CE1 4.15Å; L572-Y642 HydrophobicContact CD2-CE2 4.15Å; L572-Y642 HydrophobicContact CD2-CG 3.59Å; L572-Y642 HydrophobicContact CG-CD1 3.68Å; L572-Y642 HydrophobicContact CG-CE1 3.95Å; L572-Y642 HydrophobicContact CG-CG 4.03Å; A573-Y642 HydrophobicContact CB-CE1 4.04Å; V625-Y642 HydrophobicContact CG1-CD1 4.49Å; Y628-Y642 VanDerWaalsContact CB-CD1 3.42Å; Y628-Y642 HydrophobicContact CD2-CE1 4.43Å; Y628-Y642 HydrophobicContact CG-CD1 4.26Å; Y628-Y642 HydrophobicContact CG-CE1 4.18Å; W640-Y642 HydrophobicContact CB-CE2 3.84Å
643	L	98.5	Very high	94.4	Very high	38 Å²	38	46.2 Å²	46.2	20%	0.199	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.7	170.8	177.8	62.2	0	0	0	108.8	F539 V626 K627 W629	F539-L643 HydrophobicContact CD2-CD1 4.26Å; V626-L643 HydrophobicContact CB-CB 4.45Å; V626-L643 HydrophobicContact CB-CD2 4.1Å; V626-L643 HydrophobicContact CB-CG 4.15Å; V626-L643 HydrophobicContact CG1-CD2 4.18Å; V626-L643 HydrophobicContact CG2-CG 4.45Å; V626-L643 PolarHBondContact N-O 3.09Å; K627-L643 HydrophobicContact CG-CB 3.95Å; K627-L643 HydrophobicContact CG-CD2 4.26Å; K627-L643 PolarHBondContact O-N 3.27Å; W629-L643 HydrophobicContact CH2-CB 4.23Å; W629-L643 HydrophobicContact CZ3-CB 3.89Å
644	L	98.6	Very high	94.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	138	174.4	-74	94.4	0	0	0	110.7	L524 F539 F540 V597 Y623 K624 V625	L524-L644 HydrophobicContact CD2-CD1 4.29Å; L524-L644 HydrophobicContact CD2-CD2 3.75Å; F539-L644 CarbonylContact C-O 3.37Å; F539-L644 WeakPolarHBondContact CA-O 3.28Å; F539-L644 VanDerWaalsContact CB-O 3.29Å; F539-L644 WeakPolarHBondContact CB-O 3.4Å; F540-L644 HydrophobicContact CD1-CB 4.35Å; F540-L644 HydrophobicContact CD2-CB 4.31Å; F540-L644 HydrophobicContact CD2-CD1 4.35Å; F540-L644 HydrophobicContact CE1-CB 3.92Å; F540-L644 HydrophobicContact CE2-CB 3.9Å; F540-L644 HydrophobicContact CE2-CD1 3.76Å; F540-L644 HydrophobicContact CE2-CD2 4.25Å; F540-L644 HydrophobicContact CE2-CG 4.17Å; F540-L644 HydrophobicContact CZ-CB 3.67Å; F540-L644 HydrophobicContact CZ-CD1 4.21Å; F540-L644 HydrophobicContact CZ-CD2 3.87Å; F540-L644 HydrophobicContact CZ-CG 4.12Å; F540-L644 PolarHBondContact N-O 2.86Å; F540-L644 PolarHBondContact O-N 2.98Å; V597-L644 HydrophobicContact CB-CD2 4.26Å; V597-L644 HydrophobicContact CG1-CD2 4.34Å; V597-L644 HydrophobicContact CG2-CD2 4.39Å; Y623-L644 HydrophobicContact CD1-CB 4.36Å; K624-L644 WeakPolarHBondContact O-CA 3.3Å; V625-L644 HydrophobicContact CG2-CD2 4.35Å; V625-L644 HydrophobicContact CG2-CG 4.16Å
645	R	98.4	Very high	94.7	Very high	127 Å²	127	42.9 Å²	42.9	48%	0.479	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.4	176.7	-172.2	172.3	-178.7	176.7	2.8	110.6	F539 W591 Y623 K624 V626	F539-R645 HydrophobicContact CB-CB 4.42Å; F539-R645 HydrophobicContact CB-CG 4.41Å; W591-R645 HydrophobicContact CE3-CB 4.17Å; W591-R645 HydrophobicContact CH2-CB 4.11Å; W591-R645 HydrophobicContact CH2-CG 3.74Å; W591-R645 HydrophobicContact CZ2-CG 4.17Å; W591-R645 HydrophobicContact CZ3-CB 3.81Å; W591-R645 HydrophobicContact CZ3-CG 3.99Å; Y623-R645 CarbonylContact C-O 3.57Å; Y623-R645 VanDerWaalsContact CA-O 3.25Å; Y623-R645 WeakPolarHBondContact CA-O 3.48Å; Y623-R645 VanDerWaalsContact CD1-C 3.45Å; K624-R645 PolarHBondContact N-O 3.18Å; K624-R645 PolarHBondContact O-N 2.89Å; V626-R645 HydrophobicContact CG2-CB 3.6Å
646	R	98.1	Very high	95.2	Very high	34 Å²	34	48.3 Å²	48.3	13%	0.128	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	133.3	-177.4	-161	172.1	-173.3	-82.2	-3.8	110.6	N538 D620 I622 Y623 D648 E650	N538-R646 VanDerWaalsContact O-CB 3.25Å; N538-R646 WeakPolarHBondContact O-CB 3.02Å; N538-R646 PolarHBondContact O-N 3.43Å; D620-R646 PolarHBondContact O-NE 2.85Å; D620-R646 VanDerWaalsContact O-NE 3.12Å; D620-R646 PolarHBondContact O-NH2 3.02Å; I622-R646 WeakPolarHBondContact O-CG 3.3Å; Y623-R646 VanDerWaalsContact CD1-CA 3.49Å; Y623-R646 HydrophobicContact CD1-CB 3.84Å; Y623-R646 HydrophobicContact CD1-CG 4.4Å; Y623-R646 VanDerWaalsContact CD1-N 3.26Å; Y623-R646 HydrophobicContact CD2-CG 4.23Å; Y623-R646 HydrophobicContact CE1-CB 3.53Å; Y623-R646 HydrophobicContact CE1-CG 4.03Å; Y623-R646 HydrophobicContact CE2-CB 4.27Å; Y623-R646 HydrophobicContact CE2-CG 3.84Å; Y623-R646 HydrophobicContact CG-CB 4.33Å; Y623-R646 HydrophobicContact CG-CG 4.5Å; R646-D648 HydrophobicContact CG-CB 4.32Å; R646-D648 PolarHBondContact NH1-O 3.3Å; R646-D648 IonicContact NH2-OD1 3.77Å; R646-E650 PolarHBondContact NH1-O 3.47Å; R646-E650 PolarHBondContact NH2-O 2.91Å
647	D	97.6	Very high	95.5	Very high	48 Å²	48	53.3 Å²	53.3	26%	0.257	25%	0.253	S	S	.	.			trans	-142.2	75.1	177	-167.8	39.3	0	0	0	108.1	W591 R592 I622 K624	W591-D647 HydrophobicContact CH2-CB 4.08Å; W591-D647 HydrophobicContact CZ3-CB 3.89Å; R592-D647 IonicContact NE-OD1 2.81Å; I622-D647 PolarHBondContact O-N 3.39Å; K624-D647 HydrophobicContact CD-CB 4.16Å; K624-D647 WeakPolarHBondContact CD-OD2 3.27Å; K624-D647 WeakPolarHBondContact CE-OD2 3.48Å; K624-D647 HydrophobicContact CG-CB 4.48Å; K624-D647 IonicContact NZ-OD2 3.23Å; K624-D647 PolarHBondContact NZ-OD2 2.92Å
648	D	95.8	Very high	95.6	Very high	32 Å²	32	50 Å²	50	17%	0.171	24%	0.239	C	C	.	.			trans	-151.5	128.9	-171.7	-170.4	-47.5	0	0	0	108.9	G621 I622 R646 E650	G621-D648 WeakPolarHBondContact CA-OD2 3.23Å; I622-D648 HydrophobicContact CB-CB 4.05Å; I622-D648 PolarHBondContact N-OD2 2.88Å; R646-D648 HydrophobicContact CG-CB 4.32Å; R646-D648 PolarHBondContact NH1-O 3.3Å; R646-D648 IonicContact NH2-OD1 3.77Å; D648-E650 VanDerWaalsContact C-N 3.29Å; D648-E650 PolarHBondContact O-N 3.27Å; D648-E650 VanDerWaalsContact OD1-CB 3.26Å; D648-E650 WeakPolarHBondContact OD1-CB 3.41Å; D648-E650 PolarHBondContact OD1-N 3.41Å
649	D	92.6	Very high	95.6	Very high	171 Å²	171	53.2 Å²	53.2	91%	0.914	25%	0.251	S	S	*	.	S	Bend	trans	-70.9	-24.1	-177.3	-62.2	-36.5	0	0	0	112.7
650	E	92.3	Very high	95.3	Very high	57 Å²	57	57.5 Å²	57.5	27%	0.266	27%	0.273	S	S	.	.	S	Bend	trans	-72.5	136.6	177.7	-58.6	-164	164.5	0	0	110	V490 R646 D648 R661	V490-E650 WeakPolarHBondContact CA-OE2 3.23Å; V490-E650 HydrophobicContact CB-CB 3.96Å; V490-E650 WeakPolarHBondContact CB-OE2 3.4Å; V490-E650 HydrophobicContact CG2-CB 3.84Å; V490-E650 HydrophobicContact CG2-CG 4.32Å; V490-E650 WeakPolarHBondContact CG2-OE2 3.37Å; V490-E650 PolarHBondContact N-OE2 3.06Å; R646-E650 PolarHBondContact NH1-O 3.47Å; R646-E650 PolarHBondContact NH2-O 2.91Å; D648-E650 VanDerWaalsContact C-N 3.29Å; D648-E650 PolarHBondContact O-N 3.27Å; D648-E650 VanDerWaalsContact OD1-CB 3.26Å; D648-E650 WeakPolarHBondContact OD1-CB 3.41Å; D648-E650 PolarHBondContact OD1-N 3.41Å; E650-R661 VanDerWaalsContact CD-NH1 3.28Å; E650-R661 IonicContact OE1-CZ 3.75Å; E650-R661 IonicContact OE1-NH1 3.87Å; E650-R661 IonicContact OE1-NH2 3.84Å; E650-R661 PolarHBondContact OE1-NH2 3.32Å; E650-R661 IonicContact OE2-CZ 3.26Å; E650-R661 VanDerWaalsContact OE2-CZ 3.26Å; E650-R661 IonicContact OE2-NH1 2.65Å; E650-R661 PolarHBondContact OE2-NH1 2.97Å; E650-R661 IonicContact OE2-NH2 2.69Å; E650-R661 PolarHBondContact OE2-NH2 3.29Å
651	P	93.7	Very high	94.9	Very high	34 Å²	34	60.3 Å²	60.3	22%	0.221	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-66.9	141	-177.5	25.9	-34.3	0	0	0	111.9	E657	P651-E657 HydrophobicContact CB-CB 3.94Å; P651-E657 HydrophobicContact CG-CB 4.28Å
652	G	94.4	Very high	94.5	Very high	4 Å²	4	60.2 Å²	60.2	4%	0.041	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-57.2	132.1	177.6	0	0	0	0	0	112.4	W654 T655	G652-W654 PolarHBondContact O-N 3.22Å; G652-T655 PolarHBondContact O-N 3Å; G652-T655 PolarHBondContact O-OG1 3.06Å
653	P	95.6	Very high	93.9	Very high	4 Å²	4	67.7 Å²	67.7	3%	0.026	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-21	-173.6	-35.6	41.4	0	0	0	117.2	V490 K659 I662	V490-P653 HydrophobicContact CG1-CG 3.53Å; P653-K659 WeakPolarHBondContact O-CG 3.21Å; P653-I662 HydrophobicContact CB-CD1 3.83Å
654	W	93.8	Very high	93.1	Very high	46 Å²	46	73.9 Å²	73.9	17%	0.174	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-16	179.1	53.9	87.8	0	0	0	113.6	G537 N538 R601 Y611 D620 Y623 G652 K659	G537-W654 VanDerWaalsContact C-CZ2 3.44Å; N538-W654 WeakPolarHBondContact OD1-CZ2 3.23Å; R601-W654 VanDerWaalsContact NH1-CZ3 3.31Å; Y611-W654 HydrophobicContact CD1-CB 4.38Å; Y611-W654 AromaticContact CD1-CD1 3.78Å; Y611-W654 AromaticContact CD1-CD2 3.82Å; Y611-W654 HydrophobicContact CD1-CD2 3.82Å; Y611-W654 AromaticContact CD1-CE2 3.95Å; Y611-W654 HydrophobicContact CD1-CE3 4.5Å; Y611-W654 AromaticContact CD1-CG 3.73Å; Y611-W654 HydrophobicContact CD1-CG 3.73Å; Y611-W654 AromaticContact CD1-NE1 3.89Å; Y611-W654 AromaticContact CE1-CD1 3.89Å; Y611-W654 HydrophobicContact CE1-CG 4.3Å; Y611-W654 AromaticContact CE1-NE1 3.9Å; D620-W654 HydrophobicContact CB-CZ3 4.06Å; D620-W654 WeakPolarHBondContact OD2-CZ3 3.49Å; Y623-W654 WeakPolarHBondContact OH-CH2 3.13Å; G652-W654 PolarHBondContact O-N 3.22Å; W654-K659 WeakPolarHBondContact O-CE 3.48Å; W654-K659 PolarHBondContact O-NZ 2.86Å
655	T	95.6	Very high	92.2	Very high	44 Å²	44	75.1 Å²	75.1	27%	0.27	35%	0.35	S	S	.	.	S	Bend	trans	-74.2	164.9	177.7	74.5	0	0	0	0	110.9	G652 G658 K659	G652-T655 PolarHBondContact O-N 3Å; G652-T655 PolarHBondContact O-OG1 3.06Å; T655-G658 PolarHBondContact O-N 2.98Å; T655-G658 PolarHBondContact OG1-N 2.89Å; T655-K659 VanDerWaalsContact O-CG 3.29Å; T655-K659 WeakPolarHBondContact O-CG 3.45Å; T655-K659 PolarHBondContact O-N 3.49Å
656	K	94.9	Very high	91.4	Very high	168 Å²	168	69.8 Å²	69.8	73%	0.73	33%	0.334	S	S	*	.	H	α-helix	trans	-60.2	-47.8	175.9	-174	-179.4	176	-172.8	0	110.9	G658 K659 D660	K656-G658 PolarHBondContact O-N 2.86Å; K656-K659 PolarHBondContact O-N 2.94Å; K656-D660 VanDerWaalsContact O-CG 3.3Å; K656-D660 PolarHBondContact O-N 3.44Å
657	E	94	Very high	90.9	Very high	142 Å²	142	68.9 Å²	68.9	66%	0.664	33%	0.332	S	S	*	.	H	α-helix	trans	-60.4	-42.7	177.4	-65.9	166.7	-168.5	0	0	112.5	P651 D660 R661	P651-E657 HydrophobicContact CB-CB 3.94Å; P651-E657 HydrophobicContact CG-CB 4.28Å; E657-D660 PolarHBondContact O-N 2.93Å; E657-R661 VanDerWaalsContact O-CB 3.31Å; E657-R661 WeakPolarHBondContact O-CB 3.47Å; E657-R661 PolarHBondContact O-N 2.95Å
658	G	92.6	Very high	90.5	Very high	2 Å²	2	70.1 Å²	70.1	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-43.2	176.6	0	0	0	0	0	112.5	T655 K656 R661 I662	T655-G658 PolarHBondContact O-N 2.98Å; T655-G658 PolarHBondContact OG1-N 2.89Å; K656-G658 PolarHBondContact O-N 2.86Å; G658-R661 PolarHBondContact O-N 2.84Å; G658-I662 WeakPolarHBondContact O-CB 3.41Å; G658-I662 VanDerWaalsContact O-CG1 3.3Å; G658-I662 WeakPolarHBondContact O-CG1 3.41Å; G658-I662 PolarHBondContact O-N 3.23Å
659	K	91.8	Very high	90.2	Very high	126 Å²	126	70.1 Å²	70.1	55%	0.548	34%	0.341	S	S	.	.	H	α-helix	trans	-63.4	-43.3	175.5	-72	170.5	-178.1	169.2	0	112.1	P653 W654 T655 K656 R661 I662 K663	P653-K659 WeakPolarHBondContact O-CG 3.21Å; W654-K659 WeakPolarHBondContact O-CE 3.48Å; W654-K659 PolarHBondContact O-NZ 2.86Å; T655-K659 VanDerWaalsContact O-CG 3.29Å; T655-K659 WeakPolarHBondContact O-CG 3.45Å; T655-K659 PolarHBondContact O-N 3.49Å; K656-K659 PolarHBondContact O-N 2.94Å; K659-R661 VanDerWaalsContact C-N 3.32Å; K659-I662 PolarHBondContact O-N 2.88Å; K659-K663 WeakPolarHBondContact O-CB 3.49Å; K659-K663 PolarHBondContact O-N 3.48Å
660	D	90.6	Very high	90	Very high	90 Å²	90	64.7 Å²	64.7	48%	0.481	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-39	177.3	-69.9	-23.4	0	0	0	110.9	K656 E657 K663 K664	K656-D660 VanDerWaalsContact O-CG 3.3Å; K656-D660 PolarHBondContact O-N 3.44Å; E657-D660 PolarHBondContact O-N 2.93Å; D660-K663 PolarHBondContact O-N 3.46Å; D660-K664 WeakPolarHBondContact O-CB 3.33Å; D660-K664 PolarHBondContact O-N 2.76Å
661	R	88.3	Confident	89.5	Confident	68 Å²	68	65.2 Å²	65.2	26%	0.257	31%	0.31	S	S	.	.	H	α-helix	trans	-66.3	-44.8	174.9	-174.7	169.1	177.3	-105.7	4.6	112.8	E650 E657 G658 K659 K663 K664 L665	E650-R661 VanDerWaalsContact CD-NH1 3.28Å; E650-R661 IonicContact OE1-CZ 3.75Å; E650-R661 IonicContact OE1-NH1 3.87Å; E650-R661 IonicContact OE1-NH2 3.84Å; E650-R661 PolarHBondContact OE1-NH2 3.32Å; E650-R661 IonicContact OE2-CZ 3.26Å; E650-R661 VanDerWaalsContact OE2-CZ 3.26Å; E650-R661 IonicContact OE2-NH1 2.65Å; E650-R661 PolarHBondContact OE2-NH1 2.97Å; E650-R661 IonicContact OE2-NH2 2.69Å; E650-R661 PolarHBondContact OE2-NH2 3.29Å; E657-R661 VanDerWaalsContact O-CB 3.31Å; E657-R661 WeakPolarHBondContact O-CB 3.47Å; E657-R661 PolarHBondContact O-N 2.95Å; G658-R661 PolarHBondContact O-N 2.84Å; K659-R661 VanDerWaalsContact C-N 3.32Å; R661-K663 VanDerWaalsContact C-N 3.26Å; R661-K663 PolarHBondContact O-N 3.03Å; R661-K664 PolarHBondContact O-N 3Å; R661-L665 HydrophobicContact CG-CD1 3.9Å; R661-L665 HydrophobicContact CG-CG 4.3Å; R661-L665 WeakPolarHBondContact O-CB 3.15Å; R661-L665 WeakPolarHBondContact O-CG 3.18Å; R661-L665 PolarHBondContact O-N 2.76Å
662	I	88.1	Confident	88.8	Confident	30 Å²	30	65.1 Å²	65.1	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-56.1	-44	174.1	-75.6	166.8	0	0	0	110.5	M493 P653 G658 K659 G666 L667	M493-I662 HydrophobicContact CE-CG2 4.32Å; P653-I662 HydrophobicContact CB-CD1 3.83Å; G658-I662 WeakPolarHBondContact O-CB 3.41Å; G658-I662 VanDerWaalsContact O-CG1 3.3Å; G658-I662 WeakPolarHBondContact O-CG1 3.41Å; G658-I662 PolarHBondContact O-N 3.23Å; K659-I662 PolarHBondContact O-N 2.88Å; I662-G666 PolarHBondContact O-N 2.87Å; I662-L667 HydrophobicContact CG1-CD1 4.33Å; I662-L667 HydrophobicContact CG2-CB 4.25Å; I662-L667 PolarHBondContact O-N 2.94Å; I662-L667 VanDerWaalsContact O-N 3.08Å
663	K	87.1	Confident	87.7	Confident	156 Å²	156	72 Å²	72	68%	0.678	34%	0.341	S	S	*	.	H	α-helix	trans	-66.6	-43.7	177.4	-172.4	-178	177.8	-172	0	112	K659 D660 R661 L665 G666	K659-K663 WeakPolarHBondContact O-CB 3.49Å; K659-K663 PolarHBondContact O-N 3.48Å; D660-K663 PolarHBondContact O-N 3.46Å; R661-K663 VanDerWaalsContact C-N 3.26Å; R661-K663 PolarHBondContact O-N 3.03Å; K663-L665 VanDerWaalsContact C-N 3.35Å; K663-G666 PolarHBondContact O-N 3.19Å; K663-G666 VanDerWaalsContact O-N 3.15Å
664	K	81.5	Confident	86.2	Confident	168 Å²	168	73.7 Å²	73.7	73%	0.73	36%	0.359	S	S	*	.	H	α-helix	trans	-62.6	-41.4	177.4	-175.7	179	179.8	-179.5	0	111.9	D660 R661 G666	D660-K664 WeakPolarHBondContact O-CB 3.33Å; D660-K664 PolarHBondContact O-N 2.76Å; R661-K664 PolarHBondContact O-N 3Å; K664-G666 VanDerWaalsContact C-N 3.25Å; K664-G666 PolarHBondContact O-N 3.49Å
665	L	78.9	Confident	85.1	Confident	26 Å²	26	74.2 Å²	74.2	14%	0.136	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.5	176.8	-68	177.2	0	0	0	112.8	P489 R661 K663 L667 S773	P489-L665 HydrophobicContact CB-CD1 4.1Å; P489-L665 HydrophobicContact CG-CD1 4.15Å; R661-L665 HydrophobicContact CG-CD1 3.9Å; R661-L665 HydrophobicContact CG-CG 4.3Å; R661-L665 WeakPolarHBondContact O-CB 3.15Å; R661-L665 WeakPolarHBondContact O-CG 3.18Å; R661-L665 PolarHBondContact O-N 2.76Å; K663-L665 VanDerWaalsContact C-N 3.35Å; L665-L667 VanDerWaalsContact C-N 3.25Å; L665-L667 HydrophobicContact CB-CD1 4.28Å; L665-L667 HydrophobicContact CB-CD2 4.04Å; L665-L667 HydrophobicContact CB-CG 3.77Å; L665-L667 HydrophobicContact CD1-CD1 4.24Å; L665-L667 PolarHBondContact O-N 3.22Å; L665-S773 WeakPolarHBondContact O-CB 3.34Å
666	G	82.9	Confident	84	Confident	15 Å²	15	76.8 Å²	76.8	16%	0.155	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	30	-179.4	0	0	0	0	0	113.8	I662 K663 K664 T668	I662-G666 PolarHBondContact O-N 2.87Å; K663-G666 PolarHBondContact O-N 3.19Å; K663-G666 VanDerWaalsContact O-N 3.15Å; K664-G666 VanDerWaalsContact C-N 3.25Å; K664-G666 PolarHBondContact O-N 3.49Å; G666-T668 PolarHBondContact O-N 3.35Å
667	L	87.6	Confident	82.9	Confident	16 Å²	16	75.5 Å²	75.5	8%	0.084	37%	0.369	C	S	.	.			trans	-71.6	124.5	-179	-52.6	178.4	0	0	0	109.5	P489 M493 I662 L665	P489-L667 HydrophobicContact CG-CD1 3.99Å; P489-L667 HydrophobicContact CG-CD2 4.05Å; M493-L667 HydrophobicContact CE-CB 4.39Å; M493-L667 WeakPolarHBondContact CE-O 3.23Å; I662-L667 HydrophobicContact CG1-CD1 4.33Å; I662-L667 HydrophobicContact CG2-CB 4.25Å; I662-L667 PolarHBondContact O-N 2.94Å; I662-L667 VanDerWaalsContact O-N 3.08Å; L665-L667 VanDerWaalsContact C-N 3.25Å; L665-L667 HydrophobicContact CB-CD1 4.28Å; L665-L667 HydrophobicContact CB-CD2 4.04Å; L665-L667 HydrophobicContact CB-CG 3.77Å; L665-L667 HydrophobicContact CD1-CD1 4.24Å; L665-L667 PolarHBondContact O-N 3.22Å
668	T	88.9	Confident	81.6	Confident	73 Å²	73	70.4 Å²	70.4	45%	0.448	35%	0.351	S	S	.	.			trans	-123.9	161.7	-179.3	50.8	0	0	0	0	110.2	G666 Q670	G666-T668 PolarHBondContact O-N 3.35Å; T668-Q670 PolarHBondContact O-N 2.88Å
669	M	89.9	Confident	80.5	Confident	32 Å²	32	73.2 Å²	73.2	16%	0.158	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	120.4	176.3	-176.5	62	66.8	0	0	109.6	M493 R495 E615 Y671	M493-M669 HydrophobicContact CB-CE 3.92Å; M493-M669 HydrophobicContact CB-SD 3.92Å; M493-M669 HydrophobicContact CG-CE 4.44Å; M493-M669 HydrophobicContact SD-CE 4.48Å; R495-M669 HydrophobicContact CB-CG 4.43Å; R495-M669 HydrophobicContact CB-SD 4.3Å; R495-M669 PolarHBondContact N-SD 3.02Å; E615-M669 HydrophobicContact CB-CE 4.01Å; E615-M669 HydrophobicContact CG-CE 4.15Å; E615-M669 WeakPolarHBondContact O-CE 3.47Å; M669-Y671 HydrophobicContact CB-CE2 3.87Å; M669-Y671 HydrophobicContact CG-CD2 4.41Å; M669-Y671 HydrophobicContact CG-CE1 4.15Å; M669-Y671 HydrophobicContact CG-CE2 3.73Å; M669-Y671 VanDerWaalsContact O-CD2 3.27Å; M669-Y671 WeakPolarHBondContact O-CD2 3.47Å; M669-Y671 WeakPolarHBondContact O-CE2 3.44Å
670	Q	86.8	Confident	79.5	Confident	58 Å²	58	68.9 Å²	68.9	27%	0.271	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.2	177.3	-57.4	-65.8	4.8	0	0	110.5	M493 R495 Q499 T668	M493-Q670 WeakPolarHBondContact O-CB 3.28Å; M493-Q670 VanDerWaalsContact O-CG 3.28Å; M493-Q670 WeakPolarHBondContact O-CG 3.49Å; M493-Q670 PolarHBondContact O-N 3.34Å; R495-Q670 WeakPolarHBondContact CB-O 3.41Å; R495-Q670 PolarHBondContact N-O 3.44Å; Q499-Q670 PolarHBondContact NE2-O 3.41Å; Q499-Q670 PolarHBondContact OE1-O 2.77Å; T668-Q670 PolarHBondContact O-N 2.88Å
671	Y	83.3	Confident	78.5	Confident	68 Å²	68	68.3 Å²	68.3	27%	0.267	35%	0.35	S	S	.	.			trans	-114.9	153.2	177.5	-63.5	-86.7	0	0	0	110.4	R495 Q499 M669 Y675 L676	R495-Y671 HydrophobicContact CB-CD1 3.71Å; R495-Y671 HydrophobicContact CB-CE1 3.95Å; R495-Y671 HydrophobicContact CB-CG 4.47Å; R495-Y671 HydrophobicContact CG-CD1 3.77Å; R495-Y671 HydrophobicContact CG-CE1 3.75Å; Q499-Y671 PolarHBondContact NE2-O 2.87Å; M669-Y671 HydrophobicContact CB-CE2 3.87Å; M669-Y671 HydrophobicContact CG-CD2 4.41Å; M669-Y671 HydrophobicContact CG-CE1 4.15Å; M669-Y671 HydrophobicContact CG-CE2 3.73Å; M669-Y671 VanDerWaalsContact O-CD2 3.27Å; M669-Y671 WeakPolarHBondContact O-CD2 3.47Å; M669-Y671 WeakPolarHBondContact O-CE2 3.44Å; Y671-Y675 AromaticContact CD1-CD1 3.44Å; Y671-Y675 HydrophobicContact CD1-CD1 3.44Å; Y671-Y675 VanDerWaalsContact CD1-CD1 3.44Å; Y671-Y675 AromaticContact CD1-CE1 3.62Å; Y671-Y675 HydrophobicContact CD1-CE1 3.62Å; Y671-Y675 HydrophobicContact CE1-CD1 4.27Å; Y671-Y675 HydrophobicContact CE1-CE1 4.06Å; Y671-Y675 HydrophobicContact CG-CD1 4.07Å; Y671-L676 HydrophobicContact CD1-CD2 4.15Å; Y671-L676 HydrophobicContact CD2-CD1 4.02Å; Y671-L676 HydrophobicContact CD2-CD2 3.97Å; Y671-L676 HydrophobicContact CD2-CG 4.15Å; Y671-L676 HydrophobicContact CE1-CD2 4.26Å; Y671-L676 HydrophobicContact CE2-CD2 4.09Å; Y671-L676 HydrophobicContact CG-CD1 4.49Å; Y671-L676 HydrophobicContact CG-CD2 3.99Å; Y671-L676 HydrophobicContact CG-CG 4.16Å
672	P	79.1	Confident	77.6	Confident	31 Å²	31	71.3 Å²	71.3	20%	0.201	36%	0.361	C	S	.	.			trans	-57.7	148.9	171.3	-22.3	33.4	0	0	0	111	M465 F496 Q499 G674 Y675	M465-P672 HydrophobicContact CE-CG 3.92Å; M465-P672 HydrophobicContact SD-CG 4.28Å; F496-P672 HydrophobicContact CD2-CG 3.53Å; F496-P672 HydrophobicContact CE2-CG 3.84Å; Q499-P672 HydrophobicContact CG-CG 4.41Å; P672-G674 PolarHBondContact O-N 2.95Å; P672-Y675 WeakPolarHBondContact O-CB 3.34Å; P672-Y675 PolarHBondContact O-N 2.7Å
673	E	70.3	Confident	77	Confident	150 Å²	150	76.3 Å²	76.3	70%	0.701	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	133.7	177.4	-68.4	173.7	-163.7	0	0	110.2	K472 Y675	K472-E673 IonicContact NZ-OE1 3.03Å; K472-E673 PolarHBondContact NZ-OE1 3.42Å; E673-Y675 PolarHBondContact O-N 3.32Å
674	G	64.9	Low	76.3	Confident	39 Å²	39	76.6 Å²	76.6	40%	0.402	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	-3.8	-177.1	0	0	0	0	0	116.4	P672 E677 A678	P672-G674 PolarHBondContact O-N 2.95Å; G674-E677 PolarHBondContact O-N 2.73Å; G674-A678 WeakPolarHBondContact O-CB 3.13Å; G674-A678 PolarHBondContact O-N 3.4Å
675	Y	70.9	Confident	75.7	Confident	56 Å²	56	74 Å²	74	22%	0.22	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-43.6	-176.3	-179	-101.2	0	0	0	113.5	F496 Y671 P672 E673 E677 A678 L679	F496-Y675 HydrophobicContact CE2-CD2 4.07Å; F496-Y675 HydrophobicContact CE2-CE1 4.25Å; F496-Y675 AromaticContact CE2-CE2 3.75Å; F496-Y675 HydrophobicContact CE2-CE2 3.75Å; F496-Y675 HydrophobicContact CE2-CG 4.48Å; F496-Y675 AromaticContact CE2-CZ 3.85Å; F496-Y675 HydrophobicContact CZ-CD2 4.41Å; F496-Y675 HydrophobicContact CZ-CE1 4.41Å; F496-Y675 AromaticContact CZ-CE2 3.65Å; F496-Y675 HydrophobicContact CZ-CE2 3.65Å; F496-Y675 AromaticContact CZ-CZ 3.66Å; Y671-Y675 AromaticContact CD1-CD1 3.44Å; Y671-Y675 HydrophobicContact CD1-CD1 3.44Å; Y671-Y675 VanDerWaalsContact CD1-CD1 3.44Å; Y671-Y675 AromaticContact CD1-CE1 3.62Å; Y671-Y675 HydrophobicContact CD1-CE1 3.62Å; Y671-Y675 HydrophobicContact CE1-CD1 4.27Å; Y671-Y675 HydrophobicContact CE1-CE1 4.06Å; Y671-Y675 HydrophobicContact CG-CD1 4.07Å; P672-Y675 WeakPolarHBondContact O-CB 3.34Å; P672-Y675 PolarHBondContact O-N 2.7Å; E673-Y675 PolarHBondContact O-N 3.32Å; Y675-E677 VanDerWaalsContact C-N 3.35Å; Y675-A678 PolarHBondContact O-N 2.95Å; Y675-L679 HydrophobicContact CD1-CD1 3.9Å; Y675-L679 HydrophobicContact CD1-CG 4.46Å; Y675-L679 HydrophobicContact CE1-CD1 3.3Å; Y675-L679 HydrophobicContact CE1-CG 4.07Å; Y675-L679 PolarHBondContact O-N 3.19Å
676	L	72.5	Confident	75.3	Confident	99 Å²	99	78.3 Å²	78.3	52%	0.518	39%	0.389	S	S	.	.	H	α-helix	trans	-68.6	-35.7	-179.7	-65.9	176.9	0	0	0	112	Y671 L679 A680	Y671-L676 HydrophobicContact CD1-CD2 4.15Å; Y671-L676 HydrophobicContact CD2-CD1 4.02Å; Y671-L676 HydrophobicContact CD2-CD2 3.97Å; Y671-L676 HydrophobicContact CD2-CG 4.15Å; Y671-L676 HydrophobicContact CE1-CD2 4.26Å; Y671-L676 HydrophobicContact CE2-CD2 4.09Å; Y671-L676 HydrophobicContact CG-CD1 4.49Å; Y671-L676 HydrophobicContact CG-CD2 3.99Å; Y671-L676 HydrophobicContact CG-CG 4.16Å; L676-L679 PolarHBondContact O-N 3.49Å; L676-A680 WeakPolarHBondContact O-CB 3.33Å; L676-A680 PolarHBondContact O-N 3.5Å
677	E	70.1	Confident	74.8	Confident	141 Å²	141	82.4 Å²	82.4	66%	0.659	40%	0.404	S	S	*	.	H	α-helix	trans	-68.2	-42.8	175.6	-65.5	170	-178.2	0	0	110.9	G674 Y675 L679 A680 N681	G674-E677 PolarHBondContact O-N 2.73Å; Y675-E677 VanDerWaalsContact C-N 3.35Å; E677-L679 VanDerWaalsContact C-N 3.34Å; E677-L679 PolarHBondContact O-N 3.33Å; E677-A680 PolarHBondContact O-N 2.8Å; E677-N681 WeakPolarHBondContact O-CB 3.48Å; E677-N681 PolarHBondContact O-N 3.05Å
678	A	67.3	Low	73.9	Confident	34 Å²	34	85.9 Å²	85.9	28%	0.281	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-38.7	175	0	0	0	0	0	112.4	G674 Y675 R682	G674-A678 WeakPolarHBondContact O-CB 3.13Å; G674-A678 PolarHBondContact O-N 3.4Å; Y675-A678 PolarHBondContact O-N 2.95Å; A678-R682 WeakPolarHBondContact O-CB 3.22Å; A678-R682 PolarHBondContact O-N 2.88Å
679	L	69.5	Low	73	Confident	61 Å²	61	85.3 Å²	85.3	32%	0.319	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-46.7	173	-79.5	179	0	0	0	111.8	Y675 L676 E677 N681 R682 E683	Y675-L679 HydrophobicContact CD1-CD1 3.9Å; Y675-L679 HydrophobicContact CD1-CG 4.46Å; Y675-L679 HydrophobicContact CE1-CD1 3.3Å; Y675-L679 HydrophobicContact CE1-CG 4.07Å; Y675-L679 PolarHBondContact O-N 3.19Å; L676-L679 PolarHBondContact O-N 3.49Å; E677-L679 VanDerWaalsContact C-N 3.34Å; E677-L679 PolarHBondContact O-N 3.33Å; L679-N681 VanDerWaalsContact C-N 3.31Å; L679-N681 PolarHBondContact O-N 3.41Å; L679-R682 PolarHBondContact O-N 3.24Å; L679-E683 WeakPolarHBondContact O-CG 3.19Å; L679-E683 PolarHBondContact O-N 3.22Å
680	A	71.9	Confident	72.1	Confident	35 Å²	35	90.3 Å²	90.3	29%	0.289	44%	0.442	S	S	.	.	H	α-helix	trans	-61.4	-40	178.5	0	0	0	0	0	111.9	L676 E677 E683 R684	L676-A680 WeakPolarHBondContact O-CB 3.33Å; L676-A680 PolarHBondContact O-N 3.5Å; E677-A680 PolarHBondContact O-N 2.8Å; A680-E683 PolarHBondContact O-N 3.41Å; A680-R684 WeakPolarHBondContact O-CB 3.46Å; A680-R684 VanDerWaalsContact O-CG 3.23Å; A680-R684 WeakPolarHBondContact O-CG 3.34Å; A680-R684 PolarHBondContact O-N 2.83Å
681	N	69.8	Low	71.1	Confident	79 Å²	79	93.8 Å²	93.8	42%	0.422	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-42.9	174.6	-72.8	-7.9	0	0	0	111.4	E677 L679 E683 R684 E685	E677-N681 WeakPolarHBondContact O-CB 3.48Å; E677-N681 PolarHBondContact O-N 3.05Å; L679-N681 VanDerWaalsContact C-N 3.31Å; L679-N681 PolarHBondContact O-N 3.41Å; N681-E683 VanDerWaalsContact C-N 3.33Å; N681-E683 PolarHBondContact O-N 2.8Å; N681-R684 PolarHBondContact O-N 2.87Å; N681-E685 WeakPolarHBondContact O-CB 3.33Å; N681-E685 VanDerWaalsContact O-CG 3.29Å; N681-E685 WeakPolarHBondContact O-CG 3.46Å; N681-E685 PolarHBondContact O-N 2.79Å
682	R	69.4	Low	69.9	Low	131 Å²	131	95.8 Å²	95.8	49%	0.494	47%	0.465	S	S	.	.	H	α-helix	trans	-65.5	-34.7	177.3	-168.1	178.7	-176.1	-179.2	3.3	112.8	A678 L679 K686	A678-R682 WeakPolarHBondContact O-CB 3.22Å; A678-R682 PolarHBondContact O-N 2.88Å; L679-R682 PolarHBondContact O-N 3.24Å; R682-K686 WeakPolarHBondContact O-CB 3.17Å; R682-K686 VanDerWaalsContact O-CG 3.28Å; R682-K686 WeakPolarHBondContact O-CG 3.43Å; R682-K686 PolarHBondContact O-N 2.67Å
683	E	73.8	Confident	68.8	Low	135 Å²	135	100.4 Å²	100.4	63%	0.631	48%	0.484	S	S	*	.	H	α-helix	trans	-69	-41.3	173.9	-75.6	-178.7	171.3	0	0	111.4	L679 A680 N681 K686 E687	L679-E683 WeakPolarHBondContact O-CG 3.19Å; L679-E683 PolarHBondContact O-N 3.22Å; A680-E683 PolarHBondContact O-N 3.41Å; N681-E683 VanDerWaalsContact C-N 3.33Å; N681-E683 PolarHBondContact O-N 2.8Å; E683-K686 PolarHBondContact O-N 3.24Å; E683-E687 WeakPolarHBondContact O-CB 3.41Å; E683-E687 PolarHBondContact O-N 3.08Å
684	R	73.2	Confident	68.1	Low	162 Å²	162	99.7 Å²	99.7	61%	0.611	48%	0.48	S	S	*	.	H	α-helix	trans	-63.4	-42.1	173.1	-71.5	170.9	-173.9	-168.9	3.1	112.3	A680 N681 E687 N688	A680-R684 WeakPolarHBondContact O-CB 3.46Å; A680-R684 VanDerWaalsContact O-CG 3.23Å; A680-R684 WeakPolarHBondContact O-CG 3.34Å; A680-R684 PolarHBondContact O-N 2.83Å; N681-R684 PolarHBondContact O-N 2.87Å; R684-E687 PolarHBondContact O-N 3.39Å; R684-N688 WeakPolarHBondContact O-CB 3.28Å; R684-N688 PolarHBondContact O-N 2.95Å
685	E	68.8	Low	67.7	Low	112 Å²	112	104.7 Å²	104.7	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-45.9	174.5	-75.6	165.5	-171.3	0	0	110.8	N681 E687 N688 S689	N681-E685 WeakPolarHBondContact O-CB 3.33Å; N681-E685 VanDerWaalsContact O-CG 3.29Å; N681-E685 WeakPolarHBondContact O-CG 3.46Å; N681-E685 PolarHBondContact O-N 2.79Å; E685-E687 VanDerWaalsContact C-N 3.35Å; E685-E687 PolarHBondContact O-N 3Å; E685-N688 PolarHBondContact O-N 2.65Å; E685-S689 PolarHBondContact O-N 3.12Å; E685-S689 PolarHBondContact O-OG 3.21Å
686	K	71.1	Confident	66.8	Low	118 Å²	118	109.4 Å²	109.4	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-36.7	175.5	-76.3	175.8	180	-177.7	0	113.2	R682 E683 K690	R682-K686 WeakPolarHBondContact O-CB 3.17Å; R682-K686 VanDerWaalsContact O-CG 3.28Å; R682-K686 WeakPolarHBondContact O-CG 3.43Å; R682-K686 PolarHBondContact O-N 2.67Å; E683-K686 PolarHBondContact O-N 3.24Å; K686-K690 WeakPolarHBondContact O-CB 3.43Å; K686-K690 WeakPolarHBondContact O-CG 3.46Å; K686-K690 PolarHBondContact O-N 3.13Å
687	E	71.7	Confident	65.7	Low	101 Å²	101	112.9 Å²	112.9	47%	0.472	53%	0.531	S	S	.	.	H	α-helix	trans	-69.5	-39	176.4	-164.2	178.4	175.5	0	0	110.9	E683 R684 E685 K690 R691	E683-E687 WeakPolarHBondContact O-CB 3.41Å; E683-E687 PolarHBondContact O-N 3.08Å; R684-E687 PolarHBondContact O-N 3.39Å; E685-E687 VanDerWaalsContact C-N 3.35Å; E685-E687 PolarHBondContact O-N 3Å; E687-K690 PolarHBondContact O-N 2.88Å; E687-R691 VanDerWaalsContact O-CG 3.28Å; E687-R691 WeakPolarHBondContact O-CG 3.31Å; E687-R691 PolarHBondContact O-N 3.39Å; E687-R691 IonicContact OE1-CZ 2.84Å; E687-R691 IonicContact OE1-NE 3.7Å; E687-R691 IonicContact OE1-NH2 2.72Å; E687-R691 PolarHBondContact OE1-NH2 2.76Å
688	N	69.3	Low	64.8	Low	88 Å²	88	114.6 Å²	114.6	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-45.8	173.3	-77.1	-1.5	0	0	0	111.8	R684 E685 K690 R691 E692	R684-N688 WeakPolarHBondContact O-CB 3.28Å; R684-N688 PolarHBondContact O-N 2.95Å; E685-N688 PolarHBondContact O-N 2.65Å; N688-K690 VanDerWaalsContact C-N 3.3Å; N688-K690 PolarHBondContact O-N 3.26Å; N688-R691 PolarHBondContact O-N 2.86Å; N688-R691 VanDerWaalsContact O-N 3.12Å; N688-E692 WeakPolarHBondContact O-CG 3.37Å; N688-E692 PolarHBondContact O-N 3Å
689	S	69	Low	63.6	Low	61 Å²	61	116.3 Å²	116.3	43%	0.427	56%	0.56	S	S	.	*	H	α-helix	trans	-62.1	-36.7	176.6	-58.6	0	0	0	0	112.4	E685 E692 E693	E685-S689 PolarHBondContact O-N 3.12Å; E685-S689 PolarHBondContact O-OG 3.21Å; S689-E692 PolarHBondContact O-N 2.94Å; S689-E693 WeakPolarHBondContact O-CG 3.37Å; S689-E693 PolarHBondContact O-N 2.94Å
690	K	71.1	Confident	62.1	Low	137 Å²	137	116.2 Å²	116.2	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-66.6	-38.5	173.4	-79.5	-178.3	176.8	-171.1	0	112.8	K686 E687 N688 E693 E694	K686-K690 WeakPolarHBondContact O-CB 3.43Å; K686-K690 WeakPolarHBondContact O-CG 3.46Å; K686-K690 PolarHBondContact O-N 3.13Å; E687-K690 PolarHBondContact O-N 2.88Å; N688-K690 VanDerWaalsContact C-N 3.3Å; N688-K690 PolarHBondContact O-N 3.26Å; K690-E693 PolarHBondContact O-N 2.88Å; K690-E694 WeakPolarHBondContact O-CG 3.41Å; K690-E694 PolarHBondContact O-N 3.25Å
691	R	66.1	Low	60.3	Low	132 Å²	132	124.4 Å²	124.4	50%	0.498	60%	0.603	S	S	.	*	H	α-helix	trans	-67.4	-37.8	175.4	-72.2	172.5	-173.7	-168.9	5.7	111.6	E687 N688 E694 E695	E687-R691 VanDerWaalsContact O-CG 3.28Å; E687-R691 WeakPolarHBondContact O-CG 3.31Å; E687-R691 PolarHBondContact O-N 3.39Å; E687-R691 IonicContact OE1-CZ 2.84Å; E687-R691 IonicContact OE1-NE 3.7Å; E687-R691 IonicContact OE1-NH2 2.72Å; E687-R691 PolarHBondContact OE1-NH2 2.76Å; N688-R691 PolarHBondContact O-N 2.86Å; N688-R691 VanDerWaalsContact O-N 3.12Å; R691-E694 PolarHBondContact O-N 2.93Å; R691-E695 WeakPolarHBondContact O-CB 3.32Å; R691-E695 WeakPolarHBondContact O-CG 3.49Å; R691-E695 PolarHBondContact O-N 2.78Å
692	E	58.5	Low	58.6	Low	110 Å²	110	125.2 Å²	125.2	51%	0.514	62%	0.621	S	S	.	*	H	α-helix	trans	-67.4	-36.7	174.9	-73.4	172.7	179.1	0	0	112.4	N688 S689 Q696	N688-E692 WeakPolarHBondContact O-CG 3.37Å; N688-E692 PolarHBondContact O-N 3Å; S689-E692 PolarHBondContact O-N 2.94Å; E692-Q696 WeakPolarHBondContact O-CB 3.22Å; E692-Q696 VanDerWaalsContact O-CG 3.27Å; E692-Q696 WeakPolarHBondContact O-CG 3.42Å; E692-Q696 PolarHBondContact O-N 2.97Å
693	E	55.2	Low	56.8	Low	127 Å²	127	123.6 Å²	123.6	59%	0.593	63%	0.63	S	S	*	*	H	α-helix	trans	-68.2	-36.5	172.9	-78	177.9	173.2	0	0	112.6	S689 K690 Q697	S689-E693 WeakPolarHBondContact O-CG 3.37Å; S689-E693 PolarHBondContact O-N 2.94Å; K690-E693 PolarHBondContact O-N 2.88Å; E693-Q697 PolarHBondContact O-N 2.95Å
694	E	57.1	Low	55.9	Low	135 Å²	135	121.9 Å²	121.9	63%	0.631	63%	0.63	S	S	*	*	H	α-helix	trans	-69.9	-39.7	174.6	-75.3	175.8	177.9	0	0	111.9	K690 R691 Q697 E698	K690-E694 WeakPolarHBondContact O-CG 3.41Å; K690-E694 PolarHBondContact O-N 3.25Å; R691-E694 PolarHBondContact O-N 2.93Å; E694-Q697 PolarHBondContact O-N 3.37Å; E694-E698 PolarHBondContact O-N 3.44Å
695	E	55.1	Low	53.8	Low	144 Å²	144	125 Å²	125	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-69.6	-31.5	175.9	-76.9	-179.5	173.5	0	0	113	R691 E698 G699	R691-E695 WeakPolarHBondContact O-CB 3.32Å; R691-E695 WeakPolarHBondContact O-CG 3.49Å; R691-E695 PolarHBondContact O-N 2.78Å; E695-E698 PolarHBondContact O-N 3.14Å; E695-G699 PolarHBondContact O-N 2.95Å
696	Q	52.2	Low	51.8	Low	155 Å²	155	126.2 Å²	126.2	72%	0.724	66%	0.657	S	S	*	*	H	α-helix	trans	-74.3	-23.4	174.9	-75.4	175.1	35.3	0	0	113.3	E692	E692-Q696 WeakPolarHBondContact O-CB 3.22Å; E692-Q696 VanDerWaalsContact O-CG 3.27Å; E692-Q696 WeakPolarHBondContact O-CG 3.42Å; E692-Q696 PolarHBondContact O-N 2.97Å
697	Q	50.6	Low	49.7	Very low	172 Å²	172	124 Å²	124	80%	0.804	67%	0.668	S	S	*	*	H	α-helix	trans	-80.9	-23.6	173.2	-79.1	-178.5	16.7	0	0	113.5	E693 E694	E693-Q697 PolarHBondContact O-N 2.95Å; E694-Q697 PolarHBondContact O-N 3.37Å
698	E	49.7	Very low	47.6	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	69%	0.691	S	S	*	*	H	α-helix	trans	-88.2	-15.8	175.4	-71.9	-163.2	156.1	0	0	114	E694 E695	E694-E698 PolarHBondContact O-N 3.44Å; E695-E698 PolarHBondContact O-N 3.14Å
699	G	42.9	Very low	45.5	Very low	70 Å²	70	129.1 Å²	129.1	72%	0.722	71%	0.706	S	S	*	*	S	Bend	trans	-86.1	0.9	-172.6	0	0	0	0	0	117.5	E695	E695-G699 PolarHBondContact O-N 2.95Å
700	G	38.3	Very low	43.5	Very low	59 Å²	59	135.7 Å²	135.7	61%	0.608	73%	0.727	S	S	*	*			trans	-121.5	70.8	-168	0	0	0	0	0	116.1
701	F	34.5	Very low	41.2	Very low	206 Å²	206	139 Å²	139	90%	0.904	74%	0.736	S	S	*	*			trans	-177.2	121.9	138.7	-127.8	-101.3	0	0	0	114.2
702	A	32.3	Very low	39.2	Very low	96 Å²	96	140.3 Å²	140.3	79%	0.793	75%	0.745	S	S	*	*			trans	-152.9	131.1	145	0	0	0	0	0	106.1
703	S	31.9	Very low	38.1	Very low	98 Å²	98	146.5 Å²	146.5	69%	0.685	76%	0.764	S	S	*	*			cis	179.5	-163.6	43.3	-152.9	0	0	0	0	107.4
704	P	55.7	Low	36.6	Very low	99 Å²	99	150.5 Å²	150.5	64%	0.643	78%	0.78	S	S	*	*				-122.3	163.7	-58.7	25.5	-6.5	0	0	0	112.3
705	R	28.1	Very low	35.3	Very low	228 Å²	228	149.7 Å²	149.7	86%	0.86	79%	0.789	S	S	*	*				167.3	135.9	124.7	-91.5	170.7	-178.6	-150.3	0.6	115
706	T	26.9	Very low	33.9	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	80%	0.798	S	S	*	*			trans	64.5	101.1	146.6	58.8	0	0	0	0	121
707	G	28.1	Very low	32.5	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	80%	0.802	S	S	*	*				86.8	110	102.2	0	0	0	0	0	120.3
708	K	27.3	Very low	31.2	Very low	220 Å²	220	139.9 Å²	139.9	96%	0.957	80%	0.804	S	S	*	*			trans	94.2	114.6	142.6	-65.5	-174.8	176	176.8	0	120.8
709	G	25.9	Very low	30.1	Very low	76 Å²	76	135 Å²	135	78%	0.784	80%	0.801	S	S	*	*			trans	89.1	142.4	145.1	0	0	0	0	0	115
710	K	25.3	Very low	29.8	Very low	198 Å²	198	137.4 Å²	137.4	86%	0.861	80%	0.804	S	S	*	*			cis	-169.6	137.9	6.5	-144.7	175.4	-174.1	177.5	0	107.3
711	W	24.1	Very low	29.1	Very low	207 Å²	207	139.5 Å²	139.5	78%	0.784	81%	0.81	S	S	*	*			trans	78.4	116.4	145.1	-112.4	12.3	0	0	0	125.2
712	K	24.2	Very low	29.1	Very low	160 Å²	160	141.7 Å²	141.7	70%	0.696	81%	0.812	S	S	*	*				81.3	112.6	121.3	-101.5	180	-173.5	169.5	0	121.4
713	R	35	Very low	28.7	Very low	240 Å²	240	142.2 Å²	142.2	91%	0.906	82%	0.816	S	S	*	*			trans	-57.9	153.9	154.9	-70.2	176.9	175.9	172.5	-1.8	112.8
714	K	23.6	Very low	28.6	Very low	211 Å²	211	141.1 Å²	141.1	92%	0.917	82%	0.82	S	S	*	*				-158.2	131.6	128.1	-108.5	179.8	-178.7	-173.9	0	111.9
715	S	29.1	Very low	27.1	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	83%	0.83	S	S	*	*			trans	-55	167.2	157.2	-50.2	0	0	0	0	110.3
716	A	26.8	Very low	27.2	Very low	104 Å²	104	136.7 Å²	136.7	86%	0.86	82%	0.824	S	S	*	*			cis	-168.9	165.8	29.7	0	0	0	0	0	108.6
717	G	22.3	Very low	27.4	Very low	79 Å²	79	142.1 Å²	142.1	81%	0.814	83%	0.829	S	S	*	*			trans	157.5	101.5	154.2	0	0	0	0	0	116.4
718	G	23.4	Very low	27.3	Very low	82 Å²	82	150.2 Å²	150.2	85%	0.845	84%	0.837	S	S	*	*			trans	91.4	106.7	143.6	0	0	0	0	0	119.2
719	G	25.6	Very low	27.4	Very low	75 Å²	75	145.8 Å²	145.8	77%	0.773	83%	0.829	S	S	*	*			trans	-77.8	-170.7	151.5	0	0	0	0	0	111.7
720	P	37.8	Very low	27.6	Very low	120 Å²	120	147.4 Å²	147.4	78%	0.779	83%	0.828	S	S	*	*			cis	-145.8	178.1	24.3	37.3	-14.3	0	0	0	118.3
721	S	23.2	Very low	27.8	Very low	104 Å²	104	147.4 Å²	147.4	73%	0.727	83%	0.828	S	S	*	*			trans	73.3	100.5	142	51.3	0	0	0	0	123.1
722	R	33.6	Very low	28.2	Very low	252 Å²	252	147.3 Å²	147.3	95%	0.951	83%	0.833	S	S	*	*				31.8	121.7	118	-73.5	-178.2	161.5	-166.5	-4.5	120.1
723	A	24.5	Very low	28.7	Very low	106 Å²	106	144.8 Å²	144.8	88%	0.876	83%	0.831	S	S	*	*				-147.6	121.9	129.6	0	0	0	0	0	109.5
724	G	30.1	Very low	28.7	Very low	76 Å²	76	142 Å²	142	78%	0.784	83%	0.826	S	S	*	*			trans	-79.5	161.6	176.9	0	0	0	0	0	112.6
725	S	24.6	Very low	29.7	Very low	122 Å²	122	135.5 Å²	135.5	85%	0.853	80%	0.804	S	S	*	*			trans	-140.8	146.8	161	-92	0	0	0	0	110.8
726	P	30	Very low	30.5	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	80%	0.798	S	S	*	*			trans	-95.9	138.8	-144.1	4	15.9	0	0	0	111.9	R728	P726-R728 VanDerWaalsContact C-N 3.3Å; P726-R728 PolarHBondContact O-N 3.38Å
727	R	30.7	Very low	31.9	Very low	249 Å²	249	137.1 Å²	137.1	94%	0.94	79%	0.789	S	S	*	*			trans	-60.7	95.5	155.5	-99.8	-178.2	170	-164.9	-2.3	108.1	T729	R727-T729 PolarHBondContact O-N 2.92Å; R727-T729 VanDerWaalsContact O-N 3.15Å
728	R	25.6	Very low	33.8	Very low	243 Å²	243	135.1 Å²	135.1	92%	0.917	76%	0.758	S	S	*	*			trans	-74.6	95.4	167.8	-121.4	177.4	153.4	-158.7	-4.8	107.4	P726 S730	P726-R728 VanDerWaalsContact C-N 3.3Å; P726-R728 PolarHBondContact O-N 3.38Å; R728-S730 PolarHBondContact O-N 3.49Å
729	T	30.1	Very low	35.7	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	75%	0.747	S	S	*	*			trans	-63	115.6	155.8	46.2	0	0	0	0	106.4	R727 K731	R727-T729 PolarHBondContact O-N 2.92Å; R727-T729 VanDerWaalsContact O-N 3.15Å; T729-K731 PolarHBondContact O-N 3.37Å
730	S	29.6	Very low	38	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	72%	0.717	S	S	*	*			trans	-59.8	108	174.2	48.9	0	0	0	0	108.1	R728 K732	R728-S730 PolarHBondContact O-N 3.49Å; S730-K732 PolarHBondContact O-N 3.11Å; S730-K732 VanDerWaalsContact O-N 3.15Å
731	K	29.8	Very low	39.9	Very low	198 Å²	198	130.9 Å²	130.9	86%	0.861	70%	0.701	S	S	*	*			trans	-48.2	121.7	162.9	-96.3	178.9	173.6	176.3	0	107.2	T729 T733	T729-K731 PolarHBondContact O-N 3.37Å; K731-T733 PolarHBondContact O-N 3.14Å
732	K	33.5	Very low	42.4	Very low	205 Å²	205	130.1 Å²	130.1	89%	0.891	70%	0.701	S	S	*	*			trans	-51.3	113.9	169.7	-74.1	-177.7	177.7	-179.7	0	107.4	S730 K734	S730-K732 PolarHBondContact O-N 3.11Å; S730-K732 VanDerWaalsContact O-N 3.15Å; K732-K734 PolarHBondContact O-N 3.4Å
733	T	34.4	Very low	44.6	Very low	106 Å²	106	124.1 Å²	124.1	65%	0.65	68%	0.683	S	S	*	*			trans	-62.6	125.2	178.1	-61.7	0	0	0	0	107.3	K731 V735	K731-T733 PolarHBondContact O-N 3.14Å; T733-V735 VanDerWaalsContact C-N 3.3Å; T733-V735 PolarHBondContact O-N 2.97Å
734	K	35.3	Very low	47.3	Very low	182 Å²	182	120 Å²	120	79%	0.791	65%	0.646	S	S	*	*			trans	-65.8	91.8	175.6	-162.8	-178.4	-176.2	-170.9	0	107	K732 E736	K732-K734 PolarHBondContact O-N 3.4Å; K734-E736 PolarHBondContact O-N 2.76Å
735	V	43	Very low	49.9	Very low	75 Å²	75	117.9 Å²	117.9	46%	0.455	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-65.8	117.2	168.5	-179.1	0	0	0	0	105.5	T733 P774	T733-V735 VanDerWaalsContact C-N 3.3Å; T733-V735 PolarHBondContact O-N 2.97Å; V735-P774 HydrophobicContact CG1-CG 4.03Å
736	E	46.8	Very low	52.8	Low	151 Å²	151	114.2 Å²	114.2	71%	0.706	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-65.8	143.9	174.5	-69	-152.7	145.3	0	0	109.5	K734 Y738	K734-E736 PolarHBondContact O-N 2.76Å; E736-Y738 PolarHBondContact O-N 2.95Å
737	P	54.9	Low	55.5	Low	105 Å²	105	110 Å²	110	68%	0.682	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-53.5	135.1	170	-17.3	28.7	0	0	0	109	S739	P737-S739 PolarHBondContact O-N 3.49Å; P737-S739 VanDerWaalsContact O-N 3.15Å
738	Y	62.5	Low	58.3	Low	37 Å²	37	98.5 Å²	98.5	15%	0.145	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-61.3	121.5	172.6	168.3	-103.8	0	0	0	108.7	E736 L740 Q744 L765 F775 F778	E736-Y738 PolarHBondContact O-N 2.95Å; Y738-L740 HydrophobicContact CE1-CD2 3.71Å; Y738-L740 HydrophobicContact CE1-CG 4.16Å; Y738-Q744 PolarHBondContact OH-OE1 2.88Å; Y738-L765 HydrophobicContact CD1-CD2 3.9Å; Y738-F775 HydrophobicContact CD1-CD2 4.27Å; Y738-F775 HydrophobicContact CD2-CB 3.85Å; Y738-F775 AromaticContact CD2-CD2 3.89Å; Y738-F775 HydrophobicContact CD2-CD2 3.89Å; Y738-F775 HydrophobicContact CD2-CG 4.22Å; Y738-F775 AromaticContact CE1-CD2 3.71Å; Y738-F775 HydrophobicContact CE1-CD2 3.71Å; Y738-F775 HydrophobicContact CE1-CE2 4.3Å; Y738-F775 HydrophobicContact CE2-CB 4.11Å; Y738-F775 AromaticContact CE2-CD2 3.29Å; Y738-F775 HydrophobicContact CE2-CD2 3.29Å; Y738-F775 AromaticContact CE2-CE2 3.93Å; Y738-F775 HydrophobicContact CE2-CE2 3.93Å; Y738-F775 AromaticContact CE2-CG 3.96Å; Y738-F775 HydrophobicContact CE2-CG 3.96Å; Y738-F775 HydrophobicContact CG-CB 4.18Å; Y738-F775 HydrophobicContact CG-CD2 4.35Å; Y738-F775 AromaticContact CZ-CD2 3.19Å; Y738-F775 AromaticContact CZ-CE2 3.59Å; Y738-F775 WeakPolarHBondContact OH-CD2 3.32Å; Y738-F775 VanDerWaalsContact OH-CE2 3.23Å; Y738-F775 WeakPolarHBondContact OH-CE2 3.32Å; Y738-F778 HydrophobicContact CD1-CB 4.38Å; Y738-F778 HydrophobicContact CD1-CG 4.44Å; Y738-F778 HydrophobicContact CE1-CB 4.47Å; Y738-F778 AromaticContact CE1-CD1 3.84Å; Y738-F778 HydrophobicContact CE1-CD1 3.84Å; Y738-F778 HydrophobicContact CE1-CE1 4.33Å; Y738-F778 HydrophobicContact CE1-CG 4.15Å
739	S	63.9	Low	61.3	Low	90 Å²	90	95.2 Å²	95.2	63%	0.629	51%	0.509	S	S	*	.			trans	-104.8	128	173.8	58.3	0	0	0	0	109.6	P737	P737-S739 PolarHBondContact O-N 3.49Å; P737-S739 VanDerWaalsContact O-N 3.15Å
740	L	73.2	Confident	64.2	Low	26 Å²	26	93.7 Å²	93.7	14%	0.136	49%	0.494	C	S	.	.			trans	-59.8	146.9	172	-69.7	165.9	0	0	0	109.8	Y738 Q744 S745 I748 L762 L765 F778	Y738-L740 HydrophobicContact CE1-CD2 3.71Å; Y738-L740 HydrophobicContact CE1-CG 4.16Å; L740-Q744 HydrophobicContact CB-CB 4.21Å; L740-Q744 HydrophobicContact CD2-CB 4.11Å; L740-S745 WeakPolarHBondContact CB-OG 3.34Å; L740-I748 HydrophobicContact CD1-CD1 3.74Å; L740-I748 HydrophobicContact CD2-CD1 4.36Å; L740-L762 HydrophobicContact CD1-CD2 3.36Å; L740-L765 HydrophobicContact CD1-CD1 4.37Å; L740-F778 HydrophobicContact CD2-CD1 4.46Å; L740-F778 HydrophobicContact CD2-CE1 3.72Å; L740-F778 HydrophobicContact CD2-CE2 4.31Å; L740-F778 HydrophobicContact CD2-CZ 3.63Å
741	T	78.1	Confident	67.2	Low	71 Å²	71	88.6 Å²	88.6	44%	0.436	46%	0.457	S	S	.	.			trans	-63.3	157.4	170.6	68.5	0	0	0	0	110.1	Q743 Q744 S745	T741-Q743 PolarHBondContact O-N 2.82Å; T741-Q744 PolarHBondContact O-N 2.85Å; T741-Q744 WeakPolarHBondContact OG1-CB 3.38Å; T741-Q744 VanDerWaalsContact OG1-CG 3.25Å; T741-Q744 WeakPolarHBondContact OG1-CG 3.21Å; T741-Q744 PolarHBondContact OG1-N 2.9Å; T741-Q744 VanDerWaalsContact OG1-N 3.08Å; T741-Q744 PolarHBondContact OG1-OE1 2.81Å; T741-S745 WeakPolarHBondContact O-CB 3.23Å; T741-S745 PolarHBondContact O-N 2.8Å; T741-S745 PolarHBondContact O-OG 2.94Å
742	A	76.1	Confident	70.1	Confident	88 Å²	88	87.7 Å²	87.7	73%	0.727	45%	0.454	S	S	*	.	H	α-helix	trans	-56.9	-35.6	175.7	0	0	0	0	0	111.5	S746	A742-S746 PolarHBondContact O-N 3Å
743	Q	78.8	Confident	72.7	Confident	126 Å²	126	81.3 Å²	81.3	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-66.9	-50	175.9	-169	-177.7	11.5	0	0	112.1	T741 S745 S746 L747 Q848	T741-Q743 PolarHBondContact O-N 2.82Å; Q743-S745 VanDerWaalsContact C-N 3.29Å; Q743-S745 PolarHBondContact O-N 3.45Å; Q743-S746 WeakPolarHBondContact O-CB 3.27Å; Q743-S746 PolarHBondContact O-N 2.86Å; Q743-S746 VanDerWaalsContact O-N 3.12Å; Q743-L747 HydrophobicContact CG-CD1 4.18Å; Q743-L747 WeakPolarHBondContact O-CG 3.21Å; Q743-L747 PolarHBondContact O-N 2.97Å; Q743-Q848 VanDerWaalsContact CD-NE2 3.29Å
744	Q	81.8	Confident	75.5	Confident	20 Å²	20	76.4 Å²	76.4	9%	0.093	41%	0.405	C	S	.	.	H	α-helix	trans	-59.2	-42.6	177	-75.8	167.6	-26.1	0	0	111.5	Y738 L740 T741 S746 L747 I748 L849	Y738-Q744 PolarHBondContact OH-OE1 2.88Å; L740-Q744 HydrophobicContact CB-CB 4.21Å; L740-Q744 HydrophobicContact CD2-CB 4.11Å; T741-Q744 PolarHBondContact O-N 2.85Å; T741-Q744 WeakPolarHBondContact OG1-CB 3.38Å; T741-Q744 VanDerWaalsContact OG1-CG 3.25Å; T741-Q744 WeakPolarHBondContact OG1-CG 3.21Å; T741-Q744 PolarHBondContact OG1-N 2.9Å; T741-Q744 VanDerWaalsContact OG1-N 3.08Å; T741-Q744 PolarHBondContact OG1-OE1 2.81Å; Q744-S746 VanDerWaalsContact C-N 3.29Å; Q744-S746 PolarHBondContact O-N 2.91Å; Q744-L747 PolarHBondContact O-N 2.83Å; Q744-I748 WeakPolarHBondContact O-CB 3.49Å; Q744-I748 VanDerWaalsContact O-CG1 3.3Å; Q744-I748 WeakPolarHBondContact O-CG1 3.46Å; Q744-I748 PolarHBondContact O-N 3.24Å; Q744-L849 HydrophobicContact CG-CD2 4.34Å
745	S	84.4	Confident	78.2	Confident	31 Å²	31	69.9 Å²	69.9	22%	0.217	39%	0.385	C	S	.	.	H	α-helix	trans	-65.7	-32.1	177.7	-55.7	0	0	0	0	112.5	L740 T741 Q743 R749	L740-S745 WeakPolarHBondContact CB-OG 3.34Å; T741-S745 WeakPolarHBondContact O-CB 3.23Å; T741-S745 PolarHBondContact O-N 2.8Å; T741-S745 PolarHBondContact O-OG 2.94Å; Q743-S745 VanDerWaalsContact C-N 3.29Å; Q743-S745 PolarHBondContact O-N 3.45Å; S745-R749 WeakPolarHBondContact O-CG 3.45Å; S745-R749 PolarHBondContact O-N 3.08Å; S745-R749 PolarHBondContact O-NE 2.88Å
746	S	86.3	Confident	80.4	Confident	46 Å²	46	73 Å²	73	32%	0.322	39%	0.392	S	S	.	.	H	α-helix	trans	-68.2	-52.2	173.6	-165.7	0	0	0	0	111	A742 Q743 Q744 I748 R749 E750	A742-S746 PolarHBondContact O-N 3Å; Q743-S746 WeakPolarHBondContact O-CB 3.27Å; Q743-S746 PolarHBondContact O-N 2.86Å; Q743-S746 VanDerWaalsContact O-N 3.12Å; Q744-S746 VanDerWaalsContact C-N 3.29Å; Q744-S746 PolarHBondContact O-N 2.91Å; S746-I748 VanDerWaalsContact C-N 3.3Å; S746-I748 PolarHBondContact O-N 2.93Å; S746-R749 WeakPolarHBondContact O-CA 3.29Å; S746-R749 WeakPolarHBondContact O-CB 3.42Å; S746-R749 PolarHBondContact O-N 3.07Å; S746-E750 PolarHBondContact O-N 2.92Å; S746-E750 VanDerWaalsContact O-N 3.1Å; S746-E750 PolarHBondContact OG-OE1 2.91Å
747	L	86.8	Confident	82.5	Confident	22 Å²	22	67.8 Å²	67.8	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-61.6	-38.3	-177.1	-68.8	167.3	0	0	0	112	Q743 Q744 R749 E750 T844 V845	Q743-L747 HydrophobicContact CG-CD1 4.18Å; Q743-L747 WeakPolarHBondContact O-CG 3.21Å; Q743-L747 PolarHBondContact O-N 2.97Å; Q744-L747 PolarHBondContact O-N 2.83Å; L747-R749 VanDerWaalsContact C-N 3.31Å; L747-R749 PolarHBondContact O-N 3.23Å; L747-E750 WeakPolarHBondContact O-CB 3.31Å; L747-E750 PolarHBondContact O-N 3.08Å; L747-T844 HydrophobicContact CD1-CG2 4.32Å; L747-T844 HydrophobicContact CD2-CG2 3.81Å; L747-V845 HydrophobicContact CB-CG2 3.55Å; L747-V845 VanDerWaalsContact O-CG2 3.31Å; L747-V845 WeakPolarHBondContact O-CG2 3.42Å
748	I	89.4	Confident	84.3	Confident	8 Å²	8	63 Å²	63	4%	0.041	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-38.2	174.1	-73	166.3	0	0	0	111.6	L740 Q744 S746 E750 D751 W758 L762 F778 V845	L740-I748 HydrophobicContact CD1-CD1 3.74Å; L740-I748 HydrophobicContact CD2-CD1 4.36Å; Q744-I748 WeakPolarHBondContact O-CB 3.49Å; Q744-I748 VanDerWaalsContact O-CG1 3.3Å; Q744-I748 WeakPolarHBondContact O-CG1 3.46Å; Q744-I748 PolarHBondContact O-N 3.24Å; S746-I748 VanDerWaalsContact C-N 3.3Å; S746-I748 PolarHBondContact O-N 2.93Å; I748-E750 VanDerWaalsContact C-N 3.31Å; I748-E750 PolarHBondContact O-N 3.32Å; I748-D751 PolarHBondContact O-N 3.49Å; I748-W758 HydrophobicContact CB-CD2 4.46Å; I748-W758 HydrophobicContact CD1-CE3 4.15Å; I748-W758 HydrophobicContact CD1-CZ3 4Å; I748-W758 HydrophobicContact CG1-CD2 4.24Å; I748-W758 HydrophobicContact CG1-CE3 4.01Å; I748-W758 HydrophobicContact CG1-CH2 4.18Å; I748-W758 HydrophobicContact CG1-CZ2 4.37Å; I748-W758 HydrophobicContact CG1-CZ3 3.98Å; I748-W758 HydrophobicContact CG2-CB 3.84Å; I748-W758 HydrophobicContact CG2-CD2 3.66Å; I748-W758 HydrophobicContact CG2-CE3 3.85Å; I748-W758 HydrophobicContact CG2-CG 3.66Å; I748-L762 HydrophobicContact CG2-CD1 4.31Å; I748-F778 HydrophobicContact CD1-CZ 4.44Å; I748-V845 HydrophobicContact CG1-CG1 3.75Å; I748-V845 HydrophobicContact CG1-CG2 4.21Å
749	R	88.4	Confident	85.6	Confident	174 Å²	174	66.3 Å²	66.3	66%	0.657	36%	0.358	S	S	*	.	H	α-helix	trans	-73.2	-22.7	177.9	-73.5	-175.4	-63	-117.3	0.5	113.3	S745 S746 L747 D751	S745-R749 WeakPolarHBondContact O-CG 3.45Å; S745-R749 PolarHBondContact O-N 3.08Å; S745-R749 PolarHBondContact O-NE 2.88Å; S746-R749 WeakPolarHBondContact O-CA 3.29Å; S746-R749 WeakPolarHBondContact O-CB 3.42Å; S746-R749 PolarHBondContact O-N 3.07Å; L747-R749 VanDerWaalsContact C-N 3.31Å; L747-R749 PolarHBondContact O-N 3.23Å; R749-D751 VanDerWaalsContact C-N 3.31Å
750	E	91.3	Very high	86.7	Confident	97 Å²	97	66.9 Å²	66.9	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-71.5	-26.6	176.8	-71.9	163.2	-148.5	0	0	112	S746 L747 I748 K752 P841	S746-E750 PolarHBondContact O-N 2.92Å; S746-E750 VanDerWaalsContact O-N 3.1Å; S746-E750 PolarHBondContact OG-OE1 2.91Å; L747-E750 WeakPolarHBondContact O-CB 3.31Å; L747-E750 PolarHBondContact O-N 3.08Å; I748-E750 VanDerWaalsContact C-N 3.31Å; I748-E750 PolarHBondContact O-N 3.32Å; E750-K752 VanDerWaalsContact C-N 3.29Å; E750-K752 PolarHBondContact O-N 3.36Å; E750-P841 HydrophobicContact CB-CB 4.32Å
751	D	91.9	Very high	87.3	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.011	34%	0.344	C	S	.	.			trans	-79.5	72.5	174.2	-174.2	13.3	0	0	0	112.5	I748 R749 S753 N754 A755 W758 N839 P841 L842	I748-D751 PolarHBondContact O-N 3.49Å; R749-D751 VanDerWaalsContact C-N 3.31Å; D751-S753 PolarHBondContact O-N 2.89Å; D751-N754 PolarHBondContact O-N 3.13Å; D751-N754 PolarHBondContact OD1-N 2.86Å; D751-N754 PolarHBondContact OD1-ND2 3.12Å; D751-N754 VanDerWaalsContact OD1-ND2 3.12Å; D751-N754 VanDerWaalsContact OD2-CB 3.31Å; D751-N754 WeakPolarHBondContact OD2-CB 3.43Å; D751-N754 PolarHBondContact OD2-ND2 2.93Å; D751-A755 PolarHBondContact O-N 2.93Å; D751-W758 PolarHBondContact OD2-NE1 3.42Å; D751-N839 PolarHBondContact OD1-ND2 3.1Å; D751-P841 HydrophobicContact CB-CB 3.87Å; D751-L842 WeakPolarHBondContact OD2-CB 3.32Å
752	K	91.2	Very high	87.7	Confident	179 Å²	179	64.8 Å²	64.8	78%	0.778	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-61.5	-32	-179	-63.7	-179.6	-177.1	176.4	0	113	E750 N754 A755	E750-K752 VanDerWaalsContact C-N 3.29Å; E750-K752 PolarHBondContact O-N 3.36Å; K752-N754 VanDerWaalsContact C-N 3.3Å; K752-N754 PolarHBondContact O-N 3.31Å; K752-A755 WeakPolarHBondContact O-CB 3.5Å; K752-A755 PolarHBondContact O-N 3.46Å
753	S	88.7	Confident	88.1	Confident	71 Å²	71	63 Å²	63	50%	0.497	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-67.4	-30.5	-176.8	-56.5	0	0	0	0	112.7	D751	D751-S753 PolarHBondContact O-N 2.89Å
754	N	92.9	Very high	87.7	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-108	21.2	178.2	-59	-64.2	0	0	0	113.3	D751 K752 K756 L757 W758 F786 T800 N806 N839	D751-N754 PolarHBondContact O-N 3.13Å; D751-N754 PolarHBondContact OD1-N 2.86Å; D751-N754 PolarHBondContact OD1-ND2 3.12Å; D751-N754 VanDerWaalsContact OD1-ND2 3.12Å; D751-N754 VanDerWaalsContact OD2-CB 3.31Å; D751-N754 WeakPolarHBondContact OD2-CB 3.43Å; D751-N754 PolarHBondContact OD2-ND2 2.93Å; K752-N754 VanDerWaalsContact C-N 3.3Å; K752-N754 PolarHBondContact O-N 3.31Å; N754-K756 PolarHBondContact O-N 2.86Å; N754-K756 VanDerWaalsContact O-N 3.1Å; N754-L757 HydrophobicContact CB-CB 4.37Å; N754-L757 HydrophobicContact CB-CD1 4.29Å; N754-L757 PolarHBondContact O-N 3.45Å; N754-W758 PolarHBondContact O-N 2.92Å; N754-F786 HydrophobicContact CB-CE1 3.96Å; N754-F786 HydrophobicContact CB-CZ 4.16Å; N754-T800 PolarHBondContact ND2-OG1 3.35Å; N754-N806 PolarHBondContact ND2-OD1 2.93Å; N754-N806 PolarHBondContact OD1-ND2 2.92Å; N754-N806 PolarHBondContact OD1-OD1 3.07Å; N754-N839 PolarHBondContact ND2-ND2 3.23Å; N754-N839 VanDerWaalsContact ND2-ND2 3.13Å
755	A	90.9	Very high	87.1	Confident	45 Å²	45	58.5 Å²	58.5	37%	0.372	30%	0.304	S	S	.	.	H	α-helix	trans	-53.3	-37.2	-175.9	0	0	0	0	0	113.2	D751 K752 N759	D751-A755 PolarHBondContact O-N 2.93Å; K752-A755 WeakPolarHBondContact O-CB 3.5Å; K752-A755 PolarHBondContact O-N 3.46Å; A755-N759 WeakPolarHBondContact O-CB 3.43Å; A755-N759 PolarHBondContact O-N 3.4Å; A755-N759 PolarHBondContact O-ND2 2.96Å; A755-N759 VanDerWaalsContact O-ND2 3.12Å
756	K	90.3	Very high	86.2	Confident	140 Å²	140	65.8 Å²	65.8	61%	0.609	33%	0.331	S	S	*	.	H	α-helix	trans	-64.9	-48.3	176.5	-171.6	-177.4	174.5	-170.7	0	112.1	N754 W758 N759 E760	N754-K756 PolarHBondContact O-N 2.86Å; N754-K756 VanDerWaalsContact O-N 3.1Å; K756-W758 VanDerWaalsContact C-N 3.34Å; K756-W758 PolarHBondContact O-N 3.3Å; K756-N759 PolarHBondContact O-N 2.99Å; K756-E760 WeakPolarHBondContact CE-OE1 3.34Å; K756-E760 WeakPolarHBondContact O-CG 3.26Å; K756-E760 PolarHBondContact O-N 3.18Å; K756-E760 VanDerWaalsContact O-N 3.08Å
757	L	90.8	Very high	85	Confident	42 Å²	42	68.9 Å²	68.9	22%	0.22	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-43.3	177.8	-63.6	176.1	0	0	0	110.9	N754 N759 E760 V761 T785 F786 N806	N754-L757 HydrophobicContact CB-CB 4.37Å; N754-L757 HydrophobicContact CB-CD1 4.29Å; N754-L757 PolarHBondContact O-N 3.45Å; L757-N759 PolarHBondContact O-N 3.29Å; L757-E760 PolarHBondContact O-N 2.9Å; L757-V761 WeakPolarHBondContact O-CG2 3.43Å; L757-V761 PolarHBondContact O-N 3.02Å; L757-T785 HydrophobicContact CB-CG2 3.87Å; L757-T785 HydrophobicContact CD1-CG2 4.43Å; L757-T785 HydrophobicContact CD2-CG2 3.96Å; L757-T785 HydrophobicContact CG-CG2 4.3Å; L757-F786 HydrophobicContact CB-CE1 4.4Å; L757-F786 HydrophobicContact CB-CZ 4.11Å; L757-F786 HydrophobicContact CD1-CE1 3.98Å; L757-N806 WeakPolarHBondContact CD1-ND2 3.24Å
758	W	92.7	Very high	83.5	Confident	4 Å²	4	77.6 Å²	77.6	2%	0.015	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-39.9	175.5	-77.1	121	0	0	0	112.7	I748 D751 N754 K756 E760 V761 L762 V782 F786 L842 V845 L849	I748-W758 HydrophobicContact CB-CD2 4.46Å; I748-W758 HydrophobicContact CD1-CE3 4.15Å; I748-W758 HydrophobicContact CD1-CZ3 4Å; I748-W758 HydrophobicContact CG1-CD2 4.24Å; I748-W758 HydrophobicContact CG1-CE3 4.01Å; I748-W758 HydrophobicContact CG1-CH2 4.18Å; I748-W758 HydrophobicContact CG1-CZ2 4.37Å; I748-W758 HydrophobicContact CG1-CZ3 3.98Å; I748-W758 HydrophobicContact CG2-CB 3.84Å; I748-W758 HydrophobicContact CG2-CD2 3.66Å; I748-W758 HydrophobicContact CG2-CE3 3.85Å; I748-W758 HydrophobicContact CG2-CG 3.66Å; D751-W758 PolarHBondContact OD2-NE1 3.42Å; N754-W758 PolarHBondContact O-N 2.92Å; K756-W758 VanDerWaalsContact C-N 3.34Å; K756-W758 PolarHBondContact O-N 3.3Å; W758-E760 VanDerWaalsContact C-N 3.32Å; W758-E760 PolarHBondContact O-N 3.49Å; W758-V761 HydrophobicContact CE3-CB 4.41Å; W758-V761 HydrophobicContact CE3-CG1 4.42Å; W758-V761 HydrophobicContact CZ3-CG1 4.42Å; W758-V761 PolarHBondContact O-N 3.1Å; W758-L762 WeakPolarHBondContact O-CB 3.43Å; W758-L762 WeakPolarHBondContact O-CG 3.4Å; W758-L762 PolarHBondContact O-N 3.03Å; W758-V782 HydrophobicContact CH2-CG1 4.02Å; W758-V782 HydrophobicContact CH2-CG2 4.43Å; W758-V782 HydrophobicContact CZ3-CG1 4.33Å; W758-V782 HydrophobicContact CZ3-CG2 3.96Å; W758-F786 HydrophobicContact CD2-CE2 4.01Å; W758-F786 AromaticContact CD2-CZ 3.99Å; W758-F786 HydrophobicContact CD2-CZ 3.99Å; W758-F786 AromaticContact CE2-CE2 3.68Å; W758-F786 AromaticContact CE2-CZ 3.54Å; W758-F786 HydrophobicContact CE3-CE2 4.16Å; W758-F786 HydrophobicContact CG-CZ 4.39Å; W758-F786 HydrophobicContact CH2-CD2 4.36Å; W758-F786 AromaticContact CH2-CE2 3.67Å; W758-F786 HydrophobicContact CH2-CE2 3.67Å; W758-F786 HydrophobicContact CH2-CZ 4.36Å; W758-F786 HydrophobicContact CZ2-CD2 4.36Å; W758-F786 AromaticContact CZ2-CE2 3.51Å; W758-F786 HydrophobicContact CZ2-CE2 3.51Å; W758-F786 AromaticContact CZ2-CZ 3.75Å; W758-F786 HydrophobicContact CZ2-CZ 3.75Å; W758-F786 HydrophobicContact CZ3-CE2 4.01Å; W758-F786 AromaticContact NE1-CZ 3.69Å; W758-L842 HydrophobicContact CZ2-CD1 3.75Å; W758-V845 HydrophobicContact CH2-CB 4.49Å; W758-V845 HydrophobicContact CH2-CG1 3.45Å; W758-V845 VanDerWaalsContact CH2-CG1 3.45Å; W758-V845 HydrophobicContact CZ2-CB 4.17Å; W758-V845 HydrophobicContact CZ2-CG1 3.58Å; W758-V845 HydrophobicContact CZ3-CG1 4.4Å; W758-L849 HydrophobicContact CH2-CD1 4.11Å; W758-L849 HydrophobicContact CZ3-CD1 4.45Å
759	N	89.1	Confident	81.9	Confident	108 Å²	108	78.9 Å²	78.9	58%	0.578	39%	0.385	S	S	*	.	H	α-helix	trans	-62.6	-38.9	175.1	-73.7	-29.2	0	0	0	112.3	A755 K756 L757 L762 A763	A755-N759 WeakPolarHBondContact O-CB 3.43Å; A755-N759 PolarHBondContact O-N 3.4Å; A755-N759 PolarHBondContact O-ND2 2.96Å; A755-N759 VanDerWaalsContact O-ND2 3.12Å; K756-N759 PolarHBondContact O-N 2.99Å; L757-N759 PolarHBondContact O-N 3.29Å; N759-L762 PolarHBondContact O-N 3.32Å; N759-A763 VanDerWaalsContact O-CB 3.32Å; N759-A763 WeakPolarHBondContact O-CB 3.35Å; N759-A763 PolarHBondContact O-N 2.75Å
760	E	87.1	Confident	80.2	Confident	101 Å²	101	76 Å²	76	47%	0.472	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.4	-70	172.5	-163.8	0	0	111.4	K756 L757 W758 L762 A763 S764	K756-E760 WeakPolarHBondContact CE-OE1 3.34Å; K756-E760 WeakPolarHBondContact O-CG 3.26Å; K756-E760 PolarHBondContact O-N 3.18Å; K756-E760 VanDerWaalsContact O-N 3.08Å; L757-E760 PolarHBondContact O-N 2.9Å; W758-E760 VanDerWaalsContact C-N 3.32Å; W758-E760 PolarHBondContact O-N 3.49Å; E760-L762 PolarHBondContact O-N 3.36Å; E760-A763 PolarHBondContact O-N 2.92Å; E760-S764 PolarHBondContact O-N 3.48Å
761	V	87.4	Confident	78	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-60.4	-46.5	174.2	173.4	0	0	0	0	110.9	L757 W758 A763 S764 F778 K781 V782 T785	L757-V761 WeakPolarHBondContact O-CG2 3.43Å; L757-V761 PolarHBondContact O-N 3.02Å; W758-V761 HydrophobicContact CE3-CB 4.41Å; W758-V761 HydrophobicContact CE3-CG1 4.42Å; W758-V761 HydrophobicContact CZ3-CG1 4.42Å; W758-V761 PolarHBondContact O-N 3.1Å; V761-A763 VanDerWaalsContact C-N 3.32Å; V761-A763 PolarHBondContact O-N 3.39Å; V761-S764 PolarHBondContact O-N 3.1Å; V761-S764 PolarHBondContact O-OG 3.36Å; V761-F778 HydrophobicContact CG1-CD2 3.93Å; V761-F778 HydrophobicContact CG1-CE2 3.58Å; V761-K781 HydrophobicContact CG1-CG 4.49Å; V761-K781 HydrophobicContact CG2-CG 4.28Å; V761-V782 HydrophobicContact CG1-CG2 3.63Å; V761-T785 HydrophobicContact CG2-CG2 4Å; V761-T785 WeakPolarHBondContact CG2-OG1 3.4Å
762	L	86.2	Confident	76.2	Confident	53 Å²	53	77.6 Å²	77.6	28%	0.277	42%	0.424	S	S	.	.	H	α-helix	trans	-68.5	-29.2	179.8	-69.1	173.8	0	0	0	112.8	L740 I748 W758 N759 E760 S764 L765	L740-L762 HydrophobicContact CD1-CD2 3.36Å; I748-L762 HydrophobicContact CG2-CD1 4.31Å; W758-L762 WeakPolarHBondContact O-CB 3.43Å; W758-L762 WeakPolarHBondContact O-CG 3.4Å; W758-L762 PolarHBondContact O-N 3.03Å; N759-L762 PolarHBondContact O-N 3.32Å; E760-L762 PolarHBondContact O-N 3.36Å; L762-S764 VanDerWaalsContact C-N 3.33Å; L762-L765 HydrophobicContact CD2-CD1 3.74Å; L762-L765 WeakPolarHBondContact O-CB 3.4Å; L762-L765 PolarHBondContact O-N 3.08Å
763	A	82.8	Confident	74.8	Confident	51 Å²	51	69.2 Å²	69.2	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-38.4	173.8	0	0	0	0	0	111.3	N759 E760 V761 L765 K766	N759-A763 VanDerWaalsContact O-CB 3.32Å; N759-A763 WeakPolarHBondContact O-CB 3.35Å; N759-A763 PolarHBondContact O-N 2.75Å; E760-A763 PolarHBondContact O-N 2.92Å; V761-A763 VanDerWaalsContact C-N 3.32Å; V761-A763 PolarHBondContact O-N 3.39Å; A763-L765 PolarHBondContact O-N 3.42Å; A763-K766 WeakPolarHBondContact O-CB 3.37Å; A763-K766 PolarHBondContact O-N 2.88Å; A763-K766 VanDerWaalsContact O-N 3.09Å
764	S	71.8	Confident	73.9	Confident	19 Å²	19	66.8 Å²	66.8	13%	0.133	37%	0.37	C	S	.	.	H	α-helix	trans	-65.1	-19.1	177.9	78	0	0	0	0	114	E760 V761 L762 K766 D767	E760-S764 PolarHBondContact O-N 3.48Å; V761-S764 PolarHBondContact O-N 3.1Å; V761-S764 PolarHBondContact O-OG 3.36Å; L762-S764 VanDerWaalsContact C-N 3.33Å; S764-K766 PolarHBondContact O-N 3.42Å; S764-D767 WeakPolarHBondContact O-CB 3.33Å; S764-D767 PolarHBondContact O-N 2.77Å
765	L	68.4	Low	72.9	Confident	33 Å²	33	68 Å²	68	17%	0.173	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.9	173.1	-72.6	173.6	0	0	0	113.6	Y738 L740 L762 A763 D767 F778	Y738-L765 HydrophobicContact CD1-CD2 3.9Å; L740-L765 HydrophobicContact CD1-CD1 4.37Å; L762-L765 HydrophobicContact CD2-CD1 3.74Å; L762-L765 WeakPolarHBondContact O-CB 3.4Å; L762-L765 PolarHBondContact O-N 3.08Å; A763-L765 PolarHBondContact O-N 3.42Å; L765-D767 VanDerWaalsContact C-N 3.28Å; L765-F778 HydrophobicContact CD1-CD2 3.91Å; L765-F778 HydrophobicContact CD1-CE2 4.14Å; L765-F778 HydrophobicContact CD2-CB 3.55Å; L765-F778 HydrophobicContact CD2-CD2 3.53Å; L765-F778 HydrophobicContact CD2-CG 3.77Å; L765-F778 HydrophobicContact CG-CD2 3.82Å; L765-F778 HydrophobicContact CG-CE2 4.49Å
766	K	65.1	Low	71.9	Confident	184 Å²	184	69 Å²	69	80%	0.8	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-17	177.7	-62	178.7	-177.8	174.7	0	111.9	A763 S764	A763-K766 WeakPolarHBondContact O-CB 3.37Å; A763-K766 PolarHBondContact O-N 2.88Å; A763-K766 VanDerWaalsContact O-N 3.09Å; S764-K766 PolarHBondContact O-N 3.42Å
767	D	61.2	Low	71.2	Confident	111 Å²	111	65.7 Å²	65.7	59%	0.594	36%	0.361	S	S	*	.	S	Bend	trans	-78.9	130.5	178.7	-63.6	-29.7	0	0	0	110.3	S764 L765 P769	S764-D767 WeakPolarHBondContact O-CB 3.33Å; S764-D767 PolarHBondContact O-N 2.77Å; L765-D767 VanDerWaalsContact C-N 3.28Å; D767-P769 WeakPolarHBondContact O-CD 3.47Å
768	R	56.5	Low	70.8	Confident	205 Å²	205	63.8 Å²	63.8	77%	0.774	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-81.4	119.3	177.1	179.5	179.5	-84.5	171.8	-4.1	108.9
769	P	55.9	Low	70.4	Confident	35 Å²	35	63.7 Å²	63.7	23%	0.227	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-64.5	141	177.5	21	-28.6	0	0	0	111.8	D767 S771 P774 L777	D767-P769 WeakPolarHBondContact O-CD 3.47Å; P769-S771 VanDerWaalsContact C-N 3.32Å; P769-P774 HydrophobicContact CG-CG 4.1Å; P769-L777 HydrophobicContact CB-CD2 4.2Å
770	A	51.3	Low	69.9	Low	114 Å²	114	61 Å²	61	94%	0.942	34%	0.341	S	S	*	.	S	Bend	trans	-70.8	-28.8	171.9	0	0	0	0	0	112.2
771	S	45.5	Very low	69.9	Low	106 Å²	106	59.6 Å²	59.6	74%	0.741	33%	0.333	S	S	*	.	S	Bend	trans	-155.5	144.4	176.2	55.2	0	0	0	0	110.4	P769	P769-S771 VanDerWaalsContact C-N 3.32Å
772	G	54.1	Low	69.9	Low	26 Å²	26	59.6 Å²	59.6	27%	0.268	33%	0.333	S	S	.	.	S	Bend	trans	98.8	169.1	-179.6	0	0	0	0	0	114.4
773	S	63.2	Low	69.9	Low	3 Å²	3	59.8 Å²	59.8	2%	0.021	33%	0.332	C	S	.	.			trans	-78.8	143.2	176.9	63.2	0	0	0	0	111.1	L665 F775 Q776 L777	L665-S773 WeakPolarHBondContact O-CB 3.34Å; S773-F775 PolarHBondContact O-N 3.38Å; S773-F775 VanDerWaalsContact O-N 3.14Å; S773-Q776 PolarHBondContact O-N 3.21Å; S773-Q776 VanDerWaalsContact OG-CB 3.32Å; S773-Q776 WeakPolarHBondContact OG-CB 3.48Å; S773-Q776 PolarHBondContact OG-N 2.6Å; S773-L777 PolarHBondContact O-N 3.03Å; S773-L777 VanDerWaalsContact O-N 3.13Å
774	P	68.8	Low	70	Confident	19 Å²	19	62.5 Å²	62.5	12%	0.123	34%	0.336	C	S	.	.	H	α-helix	trans	-56.8	-27.4	172.6	-24.1	33.4	0	0	0	113	V735 P769 F778	V735-P774 HydrophobicContact CG1-CG 4.03Å; P769-P774 HydrophobicContact CG-CG 4.1Å; P774-F778 WeakPolarHBondContact O-CB 3.4Å; P774-F778 PolarHBondContact O-N 2.66Å; P774-F778 VanDerWaalsContact O-N 3.11Å
775	F	72.1	Confident	70.9	Confident	28 Å²	28	63.3 Å²	63.3	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-68.7	-42.3	172.5	-178.3	-121.9	0	0	0	113.2	Y738 S773 L777 F778 L779	Y738-F775 HydrophobicContact CD1-CD2 4.27Å; Y738-F775 HydrophobicContact CD2-CB 3.85Å; Y738-F775 AromaticContact CD2-CD2 3.89Å; Y738-F775 HydrophobicContact CD2-CD2 3.89Å; Y738-F775 HydrophobicContact CD2-CG 4.22Å; Y738-F775 AromaticContact CE1-CD2 3.71Å; Y738-F775 HydrophobicContact CE1-CD2 3.71Å; Y738-F775 HydrophobicContact CE1-CE2 4.3Å; Y738-F775 HydrophobicContact CE2-CB 4.11Å; Y738-F775 AromaticContact CE2-CD2 3.29Å; Y738-F775 HydrophobicContact CE2-CD2 3.29Å; Y738-F775 AromaticContact CE2-CE2 3.93Å; Y738-F775 HydrophobicContact CE2-CE2 3.93Å; Y738-F775 AromaticContact CE2-CG 3.96Å; Y738-F775 HydrophobicContact CE2-CG 3.96Å; Y738-F775 HydrophobicContact CG-CB 4.18Å; Y738-F775 HydrophobicContact CG-CD2 4.35Å; Y738-F775 AromaticContact CZ-CD2 3.19Å; Y738-F775 AromaticContact CZ-CE2 3.59Å; Y738-F775 WeakPolarHBondContact OH-CD2 3.32Å; Y738-F775 VanDerWaalsContact OH-CE2 3.23Å; Y738-F775 WeakPolarHBondContact OH-CE2 3.32Å; S773-F775 PolarHBondContact O-N 3.38Å; S773-F775 VanDerWaalsContact O-N 3.14Å; F775-L777 VanDerWaalsContact C-N 3.33Å; F775-L777 PolarHBondContact O-N 3.48Å; F775-F778 HydrophobicContact CD2-CD1 4.46Å; F775-F778 WeakPolarHBondContact O-CB 3.49Å; F775-F778 PolarHBondContact O-N 3.1Å; F775-L779 HydrophobicContact CD1-CD1 4.25Å; F775-L779 HydrophobicContact CD2-CG 4.41Å; F775-L779 HydrophobicContact CE1-CD1 3.67Å; F775-L779 HydrophobicContact CE1-CG 4.4Å; F775-L779 HydrophobicContact CE2-CD1 4.13Å; F775-L779 HydrophobicContact CE2-CD2 4.13Å; F775-L779 HydrophobicContact CE2-CG 4.04Å; F775-L779 HydrophobicContact CZ-CD1 3.62Å; F775-L779 HydrophobicContact CZ-CD2 4.24Å; F775-L779 HydrophobicContact CZ-CG 4.05Å; F775-L779 WeakPolarHBondContact O-CG 3.47Å; F775-L779 PolarHBondContact O-N 2.96Å
776	Q	69.7	Low	72.1	Confident	66 Å²	66	61.7 Å²	61.7	31%	0.308	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-39.5	177.5	-154.6	80.3	31.7	0	0	111.2	G487 S773 F778 L779 S780	G487-Q776 PolarHBondContact O-NE2 2.74Å; G487-Q776 VanDerWaalsContact O-NE2 3.11Å; G487-Q776 PolarHBondContact O-OE1 3.36Å; S773-Q776 PolarHBondContact O-N 3.21Å; S773-Q776 VanDerWaalsContact OG-CB 3.32Å; S773-Q776 WeakPolarHBondContact OG-CB 3.48Å; S773-Q776 PolarHBondContact OG-N 2.6Å; Q776-F778 VanDerWaalsContact C-N 3.33Å; Q776-L779 PolarHBondContact O-N 3.34Å; Q776-S780 WeakPolarHBondContact O-CB 3.08Å; Q776-S780 PolarHBondContact O-N 3.24Å
777	L	76.1	Confident	73.3	Confident	72 Å²	72	57.8 Å²	57.8	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-44.2	175.8	-178	66.7	0	0	0	111	P769 S773 F775 S780 K781	P769-L777 HydrophobicContact CB-CD2 4.2Å; S773-L777 PolarHBondContact O-N 3.03Å; S773-L777 VanDerWaalsContact O-N 3.13Å; F775-L777 VanDerWaalsContact C-N 3.33Å; F775-L777 PolarHBondContact O-N 3.48Å; L777-S780 PolarHBondContact O-N 3.08Å; L777-K781 PolarHBondContact O-N 3.46Å
778	F	83.1	Confident	74.7	Confident	1 Å²	1	52.5 Å²	52.5	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-57	-52	174.6	173.6	-110.5	0	0	0	112.1	Y738 L740 I748 V761 L765 P774 F775 Q776 S780 K781 V782 L849	Y738-F778 HydrophobicContact CD1-CB 4.38Å; Y738-F778 HydrophobicContact CD1-CG 4.44Å; Y738-F778 HydrophobicContact CE1-CB 4.47Å; Y738-F778 AromaticContact CE1-CD1 3.84Å; Y738-F778 HydrophobicContact CE1-CD1 3.84Å; Y738-F778 HydrophobicContact CE1-CE1 4.33Å; Y738-F778 HydrophobicContact CE1-CG 4.15Å; L740-F778 HydrophobicContact CD2-CD1 4.46Å; L740-F778 HydrophobicContact CD2-CE1 3.72Å; L740-F778 HydrophobicContact CD2-CE2 4.31Å; L740-F778 HydrophobicContact CD2-CZ 3.63Å; I748-F778 HydrophobicContact CD1-CZ 4.44Å; V761-F778 HydrophobicContact CG1-CD2 3.93Å; V761-F778 HydrophobicContact CG1-CE2 3.58Å; L765-F778 HydrophobicContact CD1-CD2 3.91Å; L765-F778 HydrophobicContact CD1-CE2 4.14Å; L765-F778 HydrophobicContact CD2-CB 3.55Å; L765-F778 HydrophobicContact CD2-CD2 3.53Å; L765-F778 HydrophobicContact CD2-CG 3.77Å; L765-F778 HydrophobicContact CG-CD2 3.82Å; L765-F778 HydrophobicContact CG-CE2 4.49Å; P774-F778 WeakPolarHBondContact O-CB 3.4Å; P774-F778 PolarHBondContact O-N 2.66Å; P774-F778 VanDerWaalsContact O-N 3.11Å; F775-F778 HydrophobicContact CD2-CD1 4.46Å; F775-F778 WeakPolarHBondContact O-CB 3.49Å; F775-F778 PolarHBondContact O-N 3.1Å; Q776-F778 VanDerWaalsContact C-N 3.33Å; F778-S780 VanDerWaalsContact C-N 3.34Å; F778-S780 PolarHBondContact O-N 3.45Å; F778-K781 PolarHBondContact O-N 3.23Å; F778-K781 VanDerWaalsContact O-N 3.14Å; F778-V782 HydrophobicContact CD1-CG2 4.45Å; F778-V782 HydrophobicContact CD2-CG2 4.21Å; F778-V782 HydrophobicContact CE1-CG2 4.03Å; F778-V782 HydrophobicContact CE2-CG2 3.79Å; F778-V782 HydrophobicContact CZ-CG2 3.67Å; F778-V782 WeakPolarHBondContact O-CG2 3.25Å; F778-V782 PolarHBondContact O-N 3.31Å; F778-L849 HydrophobicContact CE1-CD1 3.88Å; F778-L849 HydrophobicContact CE1-CD2 3.78Å; F778-L849 HydrophobicContact CE1-CG 4.47Å; F778-L849 HydrophobicContact CZ-CD1 4.02Å; F778-L849 HydrophobicContact CZ-CD2 4.48Å
779	L	82.8	Confident	76.2	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-42.3	179.7	-67.6	-177.4	0	0	0	111.9	G487 F775 Q776 K781 V782 E783 L849 F850	G487-L779 VanDerWaalsContact CA-CD1 3.45Å; F775-L779 HydrophobicContact CD1-CD1 4.25Å; F775-L779 HydrophobicContact CD2-CG 4.41Å; F775-L779 HydrophobicContact CE1-CD1 3.67Å; F775-L779 HydrophobicContact CE1-CG 4.4Å; F775-L779 HydrophobicContact CE2-CD1 4.13Å; F775-L779 HydrophobicContact CE2-CD2 4.13Å; F775-L779 HydrophobicContact CE2-CG 4.04Å; F775-L779 HydrophobicContact CZ-CD1 3.62Å; F775-L779 HydrophobicContact CZ-CD2 4.24Å; F775-L779 HydrophobicContact CZ-CG 4.05Å; F775-L779 WeakPolarHBondContact O-CG 3.47Å; F775-L779 PolarHBondContact O-N 2.96Å; Q776-L779 PolarHBondContact O-N 3.34Å; L779-K781 VanDerWaalsContact C-N 3.29Å; L779-K781 PolarHBondContact O-N 2.69Å; L779-V782 PolarHBondContact O-N 3.5Å; L779-E783 WeakPolarHBondContact O-CB 3.46Å; L779-E783 PolarHBondContact O-N 2.63Å; L779-L849 HydrophobicContact CD2-CB 4Å; L779-L849 HydrophobicContact CD2-CD2 4.36Å; L779-F850 HydrophobicContact CB-CE1 4.11Å; L779-F850 HydrophobicContact CB-CZ 4.09Å; L779-F850 HydrophobicContact CD2-CE1 4.26Å; L779-F850 HydrophobicContact CD2-CE2 4.35Å; L779-F850 HydrophobicContact CD2-CZ 3.99Å; L779-F850 WeakPolarHBondContact O-CZ 3.43Å
780	S	79.8	Confident	77.5	Confident	51 Å²	51	48.6 Å²	48.6	36%	0.357	28%	0.284	S	S	.	.	H	α-helix	trans	-58.1	-42.3	174.6	-167.9	0	0	0	0	111.5	Q776 L777 F778 E783 E784	Q776-S780 WeakPolarHBondContact O-CB 3.08Å; Q776-S780 PolarHBondContact O-N 3.24Å; L777-S780 PolarHBondContact O-N 3.08Å; F778-S780 VanDerWaalsContact C-N 3.34Å; F778-S780 PolarHBondContact O-N 3.45Å; S780-E783 PolarHBondContact O-N 3.24Å; S780-E784 WeakPolarHBondContact O-CB 3.49Å; S780-E784 VanDerWaalsContact O-CG 3.3Å; S780-E784 WeakPolarHBondContact O-CG 3.32Å; S780-E784 PolarHBondContact O-N 3.02Å
781	K	85.8	Confident	79	Confident	72 Å²	72	45 Å²	45	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-67.4	-39.8	178.2	-164.3	72.9	-143.5	153.5	0	112.3	V761 L777 F778 L779 E784 T785	V761-K781 HydrophobicContact CG1-CG 4.49Å; V761-K781 HydrophobicContact CG2-CG 4.28Å; L777-K781 PolarHBondContact O-N 3.46Å; F778-K781 PolarHBondContact O-N 3.23Å; F778-K781 VanDerWaalsContact O-N 3.14Å; L779-K781 VanDerWaalsContact C-N 3.29Å; L779-K781 PolarHBondContact O-N 2.69Å; K781-E784 IonicContact NZ-OE2 3.31Å; K781-E784 PolarHBondContact NZ-OE2 3.23Å; K781-T785 VanDerWaalsContact O-CB 3.28Å; K781-T785 WeakPolarHBondContact O-CB 3.43Å; K781-T785 PolarHBondContact O-N 3.36Å; K781-T785 PolarHBondContact O-OG1 2.95Å
782	V	88.9	Confident	80.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-47	174.4	177.1	0	0	0	0	110.1	W758 V761 F778 L779 T785 F786 L846 L849 F850	W758-V782 HydrophobicContact CH2-CG1 4.02Å; W758-V782 HydrophobicContact CH2-CG2 4.43Å; W758-V782 HydrophobicContact CZ3-CG1 4.33Å; W758-V782 HydrophobicContact CZ3-CG2 3.96Å; V761-V782 HydrophobicContact CG1-CG2 3.63Å; F778-V782 HydrophobicContact CD1-CG2 4.45Å; F778-V782 HydrophobicContact CD2-CG2 4.21Å; F778-V782 HydrophobicContact CE1-CG2 4.03Å; F778-V782 HydrophobicContact CE2-CG2 3.79Å; F778-V782 HydrophobicContact CZ-CG2 3.67Å; F778-V782 WeakPolarHBondContact O-CG2 3.25Å; F778-V782 PolarHBondContact O-N 3.31Å; L779-V782 PolarHBondContact O-N 3.5Å; V782-T785 PolarHBondContact O-N 2.75Å; V782-F786 HydrophobicContact CG1-CD2 3.9Å; V782-F786 HydrophobicContact CG1-CE2 4.44Å; V782-F786 WeakPolarHBondContact O-CD2 3.29Å; V782-F786 PolarHBondContact O-N 2.87Å; V782-L846 HydrophobicContact CG1-CD2 3.8Å; V782-L849 HydrophobicContact CG1-CD1 4.09Å; V782-L849 HydrophobicContact CG2-CD1 4.18Å; V782-F850 HydrophobicContact CB-CE2 4.24Å; V782-F850 HydrophobicContact CB-CZ 4.32Å; V782-F850 HydrophobicContact CG1-CE2 3.74Å; V782-F850 HydrophobicContact CG1-CZ 4.29Å
783	E	84.5	Confident	82.2	Confident	56 Å²	56	48.6 Å²	48.6	26%	0.262	25%	0.25	S	C	.	.	H	α-helix	trans	-59.5	-47.7	179	-175.4	175.3	-168.3	0	0	111.9	L779 S780 T785 F786 Q787 F850	L779-E783 WeakPolarHBondContact O-CB 3.46Å; L779-E783 PolarHBondContact O-N 2.63Å; S780-E783 PolarHBondContact O-N 3.24Å; E783-T785 PolarHBondContact O-N 3.43Å; E783-F786 CarbonylContact O-C 3.53Å; E783-Q787 WeakPolarHBondContact O-CB 3.1Å; E783-Q787 PolarHBondContact O-N 2.83Å; E783-Q787 VanDerWaalsContact O-N 3.14Å; E783-F850 HydrophobicContact CB-CZ 4.22Å
784	E	85.6	Confident	83.3	Confident	108 Å²	108	48.9 Å²	48.9	51%	0.505	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-43.5	175.1	-75.2	170.3	-164.3	0	0	112.6	S780 K781	S780-E784 WeakPolarHBondContact O-CB 3.49Å; S780-E784 VanDerWaalsContact O-CG 3.3Å; S780-E784 WeakPolarHBondContact O-CG 3.32Å; S780-E784 PolarHBondContact O-N 3.02Å; K781-E784 IonicContact NZ-OE2 3.31Å; K781-E784 PolarHBondContact NZ-OE2 3.23Å
785	T	90.8	Very high	84.3	Confident	36 Å²	36	48 Å²	48	22%	0.221	25%	0.245	C	C	.	.	H	α-helix	trans	-72.4	-35.3	-174	-55.7	0	0	0	0	111.7	L757 V761 K781 V782 E783	L757-T785 HydrophobicContact CB-CG2 3.87Å; L757-T785 HydrophobicContact CD1-CG2 4.43Å; L757-T785 HydrophobicContact CD2-CG2 3.96Å; L757-T785 HydrophobicContact CG-CG2 4.3Å; V761-T785 HydrophobicContact CG2-CG2 4Å; V761-T785 WeakPolarHBondContact CG2-OG1 3.4Å; K781-T785 VanDerWaalsContact O-CB 3.28Å; K781-T785 WeakPolarHBondContact O-CB 3.43Å; K781-T785 PolarHBondContact O-N 3.36Å; K781-T785 PolarHBondContact O-OG1 2.95Å; V782-T785 PolarHBondContact O-N 2.75Å; E783-T785 PolarHBondContact O-N 3.43Å
786	F	93.5	Very high	85.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	32.2	-178.7	-63.3	-73.1	0	0	0	112.2	N754 L757 W758 V782 E783 L794 V795 N806 L842	N754-F786 HydrophobicContact CB-CE1 3.96Å; N754-F786 HydrophobicContact CB-CZ 4.16Å; L757-F786 HydrophobicContact CB-CE1 4.4Å; L757-F786 HydrophobicContact CB-CZ 4.11Å; L757-F786 HydrophobicContact CD1-CE1 3.98Å; W758-F786 HydrophobicContact CD2-CE2 4.01Å; W758-F786 AromaticContact CD2-CZ 3.99Å; W758-F786 HydrophobicContact CD2-CZ 3.99Å; W758-F786 AromaticContact CE2-CE2 3.68Å; W758-F786 AromaticContact CE2-CZ 3.54Å; W758-F786 HydrophobicContact CE3-CE2 4.16Å; W758-F786 HydrophobicContact CG-CZ 4.39Å; W758-F786 HydrophobicContact CH2-CD2 4.36Å; W758-F786 AromaticContact CH2-CE2 3.67Å; W758-F786 HydrophobicContact CH2-CE2 3.67Å; W758-F786 HydrophobicContact CH2-CZ 4.36Å; W758-F786 HydrophobicContact CZ2-CD2 4.36Å; W758-F786 AromaticContact CZ2-CE2 3.51Å; W758-F786 HydrophobicContact CZ2-CE2 3.51Å; W758-F786 AromaticContact CZ2-CZ 3.75Å; W758-F786 HydrophobicContact CZ2-CZ 3.75Å; W758-F786 HydrophobicContact CZ3-CE2 4.01Å; W758-F786 AromaticContact NE1-CZ 3.69Å; V782-F786 HydrophobicContact CG1-CD2 3.9Å; V782-F786 HydrophobicContact CG1-CE2 4.44Å; V782-F786 WeakPolarHBondContact O-CD2 3.29Å; V782-F786 PolarHBondContact O-N 2.87Å; E783-F786 CarbonylContact O-C 3.53Å; F786-L794 HydrophobicContact CB-CD1 3.94Å; F786-V795 HydrophobicContact CB-CG2 4.02Å; F786-V795 WeakPolarHBondContact O-CG1 3.5Å; F786-V795 WeakPolarHBondContact O-CG2 3.43Å; F786-V795 PolarHBondContact O-N 3.41Å; F786-N806 HydrophobicContact CD1-CB 4.5Å; F786-L842 HydrophobicContact CD1-CD1 3.85Å; F786-L842 HydrophobicContact CD1-CD2 3.85Å; F786-L842 HydrophobicContact CD2-CD1 4.43Å; F786-L842 HydrophobicContact CE1-CD1 3.7Å; F786-L842 HydrophobicContact CE1-CD2 3.98Å; F786-L842 HydrophobicContact CE2-CD1 4.3Å; F786-L842 HydrophobicContact CG-CD1 4.22Å; F786-L842 HydrophobicContact CZ-CD1 3.93Å
787	Q	91.4	Very high	86.2	Confident	102 Å²	102	49.2 Å²	49.2	48%	0.477	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-78.1	130.3	171.6	-169.8	176.7	50.7	0	0	110.5	E783 I789 Q792	E783-Q787 WeakPolarHBondContact O-CB 3.1Å; E783-Q787 PolarHBondContact O-N 2.83Å; E783-Q787 VanDerWaalsContact O-N 3.14Å; Q787-I789 PolarHBondContact O-N 3.32Å; Q787-Q792 PolarHBondContact NE2-O 3.49Å
788	C	88.6	Confident	87.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.			trans	-73	124.7	175.6	-178.3	0	0	0	0	110.2	C790 C791 Q792 E793 V795 C808	C788-C790 PolarHBondContact O-N 3.11Å; C788-C790 VanDerWaalsContact O-N 3.16Å; C788-C791 VanDerWaalsContact CB-SG 3.53Å; C788-Q792 WeakPolarHBondContact O-CA 3.19Å; C788-Q792 PolarHBondContact O-N 3.19Å; C788-E793 WeakPolarHBondContact CB-O 3.37Å; C788-E793 PolarHBondContact N-O 2.94Å; C788-V795 HydrophobicContact CB-CG1 3.7Å; C788-C808 VanDerWaalsContact CB-SG 3.55Å; C788-C808 PolarHBondContact SG-N 3.26Å
789	I	89.3	Confident	87.7	Confident	99 Å²	99	45.8 Å²	45.8	51%	0.508	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.9	179.8	-165.9	59.6	0	0	0	113.8	Q787 P824 A825	Q787-I789 PolarHBondContact O-N 3.32Å; I789-P824 HydrophobicContact CG2-CB 3.78Å; I789-A825 HydrophobicContact CG2-CB 4.11Å
790	C	83.8	Confident	88.3	Confident	59 Å²	59	46.7 Å²	46.7	40%	0.399	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-48.6	-175.8	-59.9	0	0	0	0	112.6	C788 C811 P824	C788-C790 PolarHBondContact O-N 3.11Å; C788-C790 VanDerWaalsContact O-N 3.16Å; C790-C811 HydrophobicContact CB-CB 3.56Å; C790-P824 WeakPolarHBondContact SG-CB 3.25Å
791	C	82.6	Confident	88.9	Confident	39 Å²	39	44.5 Å²	44.5	26%	0.264	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-8.9	-179.2	63.7	0	0	0	0	113.5	C788 E793	C788-C791 VanDerWaalsContact CB-SG 3.53Å; C791-E793 PolarHBondContact O-N 3.13Å
792	Q	82.4	Confident	89.2	Confident	143 Å²	143	45.5 Å²	45.5	67%	0.668	23%	0.231	S	C	*	.	S	Bend	trans	60.3	23.7	-176.8	-54.5	-177.4	7.2	0	0	114.3	Q787 C788	Q787-Q792 PolarHBondContact NE2-O 3.49Å; C788-Q792 WeakPolarHBondContact O-CA 3.19Å; C788-Q792 PolarHBondContact O-N 3.19Å
793	E	82.8	Confident	89.3	Confident	64 Å²	64	46.9 Å²	46.9	30%	0.299	24%	0.241	S	C	.	.	S	Bend	trans	-116.6	164.2	177.6	-58.8	175.2	132.7	0	0	110.5	C788 C791 V795 R857	C788-E793 WeakPolarHBondContact CB-O 3.37Å; C788-E793 PolarHBondContact N-O 2.94Å; C791-E793 PolarHBondContact O-N 3.13Å; E793-V795 PolarHBondContact O-N 3.15Å; E793-R857 IonicContact OE1-CZ 2.78Å; E793-R857 IonicContact OE1-NE 2.69Å; E793-R857 IonicContact OE1-NH2 3.23Å; E793-R857 PolarHBondContact OE1-NH2 3Å; E793-R857 IonicContact OE2-CZ 3.74Å; E793-R857 IonicContact OE2-NE 3.8Å; E793-R857 PolarHBondContact OE2-NE 3.04Å; E793-R857 IonicContact OE2-NH1 2.73Å; E793-R857 PolarHBondContact OE2-NH1 3.14Å; E793-R857 IonicContact OE2-NH2 3.61Å; E793-R857 PolarHBondContact OE2-NH2 2.71Å
794	L	87.6	Confident	89.7	Confident	9 Å²	9	50.2 Å²	50.2	5%	0.047	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-52.5	129.1	170.7	-174.7	65.9	0	0	0	110.2	F786 F796 L846 F850 Y853 R857	F786-L794 HydrophobicContact CB-CD1 3.94Å; L794-F796 PolarHBondContact O-N 3.12Å; L794-L846 HydrophobicContact CD1-CD1 4.31Å; L794-L846 HydrophobicContact CD1-CD2 3.92Å; L794-L846 HydrophobicContact CD2-CD2 4.34Å; L794-L846 HydrophobicContact CG-CD1 4.43Å; L794-L846 HydrophobicContact CG-CD2 4.48Å; L794-F850 HydrophobicContact CD2-CB 4.2Å; L794-F850 HydrophobicContact CD2-CD1 4.32Å; L794-F850 HydrophobicContact CD2-CD2 3.5Å; L794-F850 VanDerWaalsContact CD2-CD2 3.5Å; L794-F850 HydrophobicContact CD2-CE2 3.85Å; L794-F850 HydrophobicContact CD2-CG 3.76Å; L794-F850 HydrophobicContact CD2-CZ 4.38Å; L794-Y853 HydrophobicContact CB-CD2 4.44Å; L794-Y853 HydrophobicContact CD2-CD2 3.79Å; L794-Y853 HydrophobicContact CD2-CE2 3.89Å; L794-Y853 HydrophobicContact CD2-CG 4.11Å; L794-Y853 HydrophobicContact CG-CD2 4.27Å; L794-Y853 HydrophobicContact CG-CE2 4.09Å; L794-R857 PolarHBondContact O-NH1 2.82Å; L794-R857 VanDerWaalsContact O-NH1 3.16Å
795	V	90.1	Very high	90	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.247	C	C	.	.			trans	-56.4	126.9	-173.2	-72.6	0	0	0	0	112	F786 C788 E793 P798 N806 L842 L846 Y853	F786-V795 HydrophobicContact CB-CG2 4.02Å; F786-V795 WeakPolarHBondContact O-CG1 3.5Å; F786-V795 WeakPolarHBondContact O-CG2 3.43Å; F786-V795 PolarHBondContact O-N 3.41Å; C788-V795 HydrophobicContact CB-CG1 3.7Å; E793-V795 PolarHBondContact O-N 3.15Å; V795-P798 HydrophobicContact CB-CB 4.01Å; V795-P798 HydrophobicContact CG2-CB 3.75Å; V795-P798 HydrophobicContact CG2-CG 4.44Å; V795-N806 HydrophobicContact CG1-CB 4.16Å; V795-L842 HydrophobicContact CG2-CD2 4.34Å; V795-L846 HydrophobicContact CG2-CD1 3.63Å; V795-Y853 WeakPolarHBondContact O-CE2 2.99Å; V795-Y853 PolarHBondContact O-OH 3.2Å; V795-Y853 VanDerWaalsContact O-OH 3.12Å
796	F	90.7	Very high	90.3	Very high	32 Å²	32	47.3 Å²	47.3	14%	0.14	24%	0.24	C	C	.	.	S	Bend	trans	-111.9	133.1	175.3	179	-114.5	0	0	0	110.2	L794 C808 Y853 R857	L794-F796 PolarHBondContact O-N 3.12Å; F796-C808 PolarHBondContact N-SG 3.31Å; F796-C808 VanDerWaalsContact O-CA 3.3Å; F796-C808 WeakPolarHBondContact O-CA 3.34Å; F796-C808 WeakPolarHBondContact O-CB 3.25Å; F796-Y853 HydrophobicContact CB-CE2 4.47Å; F796-Y853 HydrophobicContact CD2-CE2 4.4Å; F796-R857 HydrophobicContact CD1-CB 3.83Å; F796-R857 HydrophobicContact CE1-CB 3.99Å; F796-R857 VanDerWaalsContact CE1-O 3.24Å; F796-R857 WeakPolarHBondContact CE1-O 3.45Å; F796-R857 HydrophobicContact CG-CB 4.19Å; F796-R857 HydrophobicContact CZ-CB 4.49Å
797	R	91.3	Very high	90.3	Very high	87 Å²	87	47.3 Å²	47.3	33%	0.328	24%	0.24	S	C	.	.	S	Bend	trans	45.6	62.3	-166.7	-64.1	-171.8	-67.3	147.2	-5.1	110.4	I799 K809 D810 V838	R797-I799 PolarHBondContact O-N 3.15Å; R797-K809 HydrophobicContact CB-CB 4.06Å; R797-K809 VanDerWaalsContact O-CB 3.31Å; R797-K809 WeakPolarHBondContact O-CB 3.33Å; R797-K809 PolarHBondContact O-N 3.36Å; R797-D810 IonicContact CZ-OD1 2.7Å; R797-D810 IonicContact CZ-OD2 2.93Å; R797-D810 IonicContact NE-OD2 3.61Å; R797-D810 IonicContact NH2-OD1 3.56Å; R797-D810 PolarHBondContact NH2-OD1 3.46Å; R797-D810 IonicContact NH2-OD2 3.87Å; R797-D810 PolarHBondContact NH2-OD2 3.03Å; R797-V838 HydrophobicContact CB-CG1 4.34Å; R797-V838 HydrophobicContact CB-CG2 4.21Å
798	P	94.5	Very high	90.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.5	-168.3	26.1	-33.7	0	0	0	111.4	V795 V838 N839 L842 Q843	V795-P798 HydrophobicContact CB-CB 4.01Å; V795-P798 HydrophobicContact CG2-CB 3.75Å; V795-P798 HydrophobicContact CG2-CG 4.44Å; P798-V838 WeakPolarHBondContact O-CA 3.45Å; P798-N839 HydrophobicContact CG-CB 4.44Å; P798-N839 PolarHBondContact O-N 3.42Å; P798-L842 HydrophobicContact CB-CD2 3.72Å; P798-L842 HydrophobicContact CB-CG 4.35Å; P798-L842 HydrophobicContact CG-CB 4.08Å; P798-L842 HydrophobicContact CG-CD2 3.82Å; P798-L842 HydrophobicContact CG-CG 3.89Å; P798-Q843 HydrophobicContact CG-CB 4.3Å
799	I	95.4	Very high	90.7	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	116.1	163.9	-52.5	-59.5	0	0	0	106.9	R797 T801 N806 V807 K809 L812 Y834 M836 Q837 V838	R797-I799 PolarHBondContact O-N 3.15Å; I799-T801 PolarHBondContact O-N 3.38Å; I799-N806 WeakPolarHBondContact O-CA 3.36Å; I799-V807 PolarHBondContact N-O 2.61Å; I799-V807 PolarHBondContact O-N 2.95Å; I799-K809 HydrophobicContact CD1-CB 3.98Å; I799-K809 HydrophobicContact CD1-CD 4.48Å; I799-K809 HydrophobicContact CD1-CG 4.08Å; I799-K809 HydrophobicContact CG1-CB 3.92Å; I799-K809 HydrophobicContact CG1-CG 4.29Å; I799-L812 HydrophobicContact CB-CD2 4.2Å; I799-L812 HydrophobicContact CG1-CD2 4.35Å; I799-L812 HydrophobicContact CG2-CD2 3.92Å; I799-Y834 HydrophobicContact CG2-CE1 4.23Å; I799-M836 HydrophobicContact CD1-CB 4.03Å; I799-M836 HydrophobicContact CG1-CB 4.39Å; I799-Q837 VanDerWaalsContact CD1-C 3.43Å; I799-Q837 WeakPolarHBondContact CD1-O 3.25Å; I799-V838 HydrophobicContact CD1-CG2 4.09Å
800	T	95.3	Very high	90.7	Very high	23 Å²	23	42.9 Å²	42.9	14%	0.141	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	108.8	167.3	-52.1	0	0	0	0	107.7	N754 N806 N839	N754-T800 PolarHBondContact ND2-OG1 3.35Å; T800-N806 WeakPolarHBondContact CB-OD1 3.1Å; T800-N806 PolarHBondContact OG1-OD1 3.32Å; T800-N839 PolarHBondContact OG1-ND2 3.14Å
801	T	92.9	Very high	91.1	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.031	20%	0.203	C	C	.	.			trans	-68.9	161.1	-178.6	54.3	0	0	0	0	112	I799 C803 Q804 H805 L830 Y834	I799-T801 PolarHBondContact O-N 3.38Å; T801-C803 PolarHBondContact O-N 2.82Å; T801-C803 PolarHBondContact OG1-SG 2.8Å; T801-Q804 WeakPolarHBondContact O-CA 3.42Å; T801-Q804 PolarHBondContact O-N 2.74Å; T801-H805 PolarHBondContact N-O 2.93Å; T801-H805 PolarHBondContact OG1-N 3.23Å; T801-H805 PolarHBondContact OG1-O 2.71Å; T801-L830 HydrophobicContact CG2-CD1 4.17Å; T801-L830 HydrophobicContact CG2-CD2 4.3Å; T801-Y834 WeakPolarHBondContact CA-OH 3.36Å
802	V	90.6	Very high	91.6	Very high	93 Å²	93	38.6 Å²	38.6	56%	0.564	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-28.2	173.8	-68.6	0	0	0	0	113.2	Q804 Y828 L830 Y834	V802-Q804 PolarHBondContact O-N 2.86Å; V802-Y828 HydrophobicContact CG2-CD1 4.03Å; V802-Y828 HydrophobicContact CG2-CE1 3.56Å; V802-L830 HydrophobicContact CG2-CD2 3.85Å; V802-Y834 HydrophobicContact CG1-CE2 3.96Å; V802-Y834 HydrophobicContact CG2-CE2 4.3Å; V802-Y834 PolarHBondContact N-OH 3.23Å
803	C	92.2	Very high	92	Very high	29 Å²	29	33.6 Å²	33.6	20%	0.196	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	16.8	171	59.4	0	0	0	0	113.8	T801 H805 C823 C826 Y828	T801-C803 PolarHBondContact O-N 2.82Å; T801-C803 PolarHBondContact OG1-SG 2.8Å; C803-H805 VanDerWaalsContact C-N 3.29Å; C803-H805 PolarHBondContact O-N 2.77Å; C803-H805 PolarHBondContact O-ND1 3.39Å; C803-C823 VanDerWaalsContact SG-CB 3.58Å; C803-C823 PolarHBondContact SG-SG 3.4Å; C803-C826 PolarHBondContact SG-SG 2.59Å; C803-Y828 HydrophobicContact CB-CD1 4.15Å; C803-Y828 HydrophobicContact CB-CG 4.01Å
804	Q	91.9	Very high	92.4	Very high	126 Å²	126	38.1 Å²	38.1	59%	0.589	18%	0.182	S	C	*	.	S	Bend	trans	60.4	25.3	175.3	-57.9	-176.3	-8.8	0	0	116.1	T801 V802	T801-Q804 WeakPolarHBondContact O-CA 3.42Å; T801-Q804 PolarHBondContact O-N 2.74Å; V802-Q804 PolarHBondContact O-N 2.86Å
805	H	93.1	Very high	92.5	Very high	68 Å²	68	38.8 Å²	38.8	32%	0.315	19%	0.188	S	C	.	.			trans	-99.5	142.2	172	-67.2	90.5	0	0	0	111.1	T801 C803 A825 C826	T801-H805 PolarHBondContact N-O 2.93Å; T801-H805 PolarHBondContact OG1-N 3.23Å; T801-H805 PolarHBondContact OG1-O 2.71Å; C803-H805 VanDerWaalsContact C-N 3.29Å; C803-H805 PolarHBondContact O-N 2.77Å; C803-H805 PolarHBondContact O-ND1 3.39Å; H805-A825 HydrophobicContact CB-CB 3.86Å; H805-A825 WeakPolarHBondContact CD2-CB 3.23Å; H805-C826 VanDerWaalsContact CE1-CB 3.47Å; H805-C826 WeakPolarHBondContact CE1-CB 3.4Å; H805-C826 VanDerWaalsContact CE1-SG 3.55Å; H805-C826 PolarHBondContact ND1-SG 3.43Å
806	N	95.4	Very high	92.5	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.08	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.4	178.9	-63.9	-70.7	0	0	0	110.4	N754 L757 F786 V795 I799 T800 L842	N754-N806 PolarHBondContact ND2-OD1 2.93Å; N754-N806 PolarHBondContact OD1-ND2 2.92Å; N754-N806 PolarHBondContact OD1-OD1 3.07Å; L757-N806 WeakPolarHBondContact CD1-ND2 3.24Å; F786-N806 HydrophobicContact CD1-CB 4.5Å; V795-N806 HydrophobicContact CG1-CB 4.16Å; I799-N806 WeakPolarHBondContact O-CA 3.36Å; T800-N806 WeakPolarHBondContact CB-OD1 3.1Å; T800-N806 PolarHBondContact OG1-OD1 3.32Å; N806-L842 WeakPolarHBondContact OD1-CD2 3.26Å
807	V	94.3	Very high	92.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.1	-179.4	-173.6	0	0	0	0	108.7	I799 K809 C811 L812 P824	I799-V807 PolarHBondContact N-O 2.61Å; I799-V807 PolarHBondContact O-N 2.95Å; V807-K809 PolarHBondContact O-N 2.96Å; V807-C811 HydrophobicContact CG1-CB 3.99Å; V807-L812 HydrophobicContact CG1-CB 4.24Å; V807-P824 HydrophobicContact CG1-CG 4.46Å
808	C	94.2	Very high	92.4	Very high	7 Å²	7	47.3 Å²	47.3	5%	0.047	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	139.4	172.8	-54.5	0	0	0	0	110.2	C788 F796 D810 C811 L812	C788-C808 VanDerWaalsContact CB-SG 3.55Å; C788-C808 PolarHBondContact SG-N 3.26Å; F796-C808 PolarHBondContact N-SG 3.31Å; F796-C808 VanDerWaalsContact O-CA 3.3Å; F796-C808 WeakPolarHBondContact O-CA 3.34Å; F796-C808 WeakPolarHBondContact O-CB 3.25Å; C808-D810 VanDerWaalsContact C-N 3.29Å; C808-D810 PolarHBondContact O-N 3.45Å; C808-C811 HydrophobicContact CB-CB 4Å; C808-C811 WeakPolarHBondContact O-CB 3.46Å; C808-C811 PolarHBondContact O-N 3.12Å; C808-L812 PolarHBondContact O-N 3.33Å
809	K	93.8	Very high	92.2	Very high	49 Å²	49	53.3 Å²	53.3	21%	0.213	26%	0.262	C	S	.	.	H	α-helix	trans	-52.2	-47.3	176.4	-176.2	179.4	-178.9	-59.8	0	112.2	R797 I799 V807 C811 L812 D813 V838	R797-K809 HydrophobicContact CB-CB 4.06Å; R797-K809 VanDerWaalsContact O-CB 3.31Å; R797-K809 WeakPolarHBondContact O-CB 3.33Å; R797-K809 PolarHBondContact O-N 3.36Å; I799-K809 HydrophobicContact CD1-CB 3.98Å; I799-K809 HydrophobicContact CD1-CD 4.48Å; I799-K809 HydrophobicContact CD1-CG 4.08Å; I799-K809 HydrophobicContact CG1-CB 3.92Å; I799-K809 HydrophobicContact CG1-CG 4.29Å; V807-K809 PolarHBondContact O-N 2.96Å; K809-C811 VanDerWaalsContact C-N 3.29Å; K809-C811 PolarHBondContact O-N 2.95Å; K809-L812 PolarHBondContact O-N 2.99Å; K809-D813 IonicContact NZ-OD1 3Å; K809-D813 IonicContact NZ-OD2 3.85Å; K809-D813 PolarHBondContact NZ-OD2 2.82Å; K809-D813 WeakPolarHBondContact O-CB 3.43Å; K809-D813 PolarHBondContact O-N 2.87Å; K809-V838 HydrophobicContact CD-CG2 4.01Å
810	D	90.8	Very high	91.9	Very high	51 Å²	51	56 Å²	56	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-67.8	-29.2	-178.9	-57.5	-46.4	0	0	0	113.4	R797 C808 R814	R797-D810 IonicContact CZ-OD1 2.7Å; R797-D810 IonicContact CZ-OD2 2.93Å; R797-D810 IonicContact NE-OD2 3.61Å; R797-D810 IonicContact NH2-OD1 3.56Å; R797-D810 PolarHBondContact NH2-OD1 3.46Å; R797-D810 IonicContact NH2-OD2 3.87Å; R797-D810 PolarHBondContact NH2-OD2 3.03Å; C808-D810 VanDerWaalsContact C-N 3.29Å; C808-D810 PolarHBondContact O-N 3.45Å; D810-R814 WeakPolarHBondContact O-CB 3.43Å; D810-R814 VanDerWaalsContact O-CG 3.31Å; D810-R814 WeakPolarHBondContact O-CG 3.43Å; D810-R814 PolarHBondContact O-N 3.38Å; D810-R814 PolarHBondContact O-NE 2.81Å
811	C	91.5	Very high	91.8	Very high	8 Å²	8	56.7 Å²	56.7	5%	0.054	28%	0.28	C	S	.	.	H	α-helix	trans	-70.8	-41.3	174.5	-69.6	0	0	0	0	111	C790 V807 C808 K809 R814 S815	C790-C811 HydrophobicContact CB-CB 3.56Å; V807-C811 HydrophobicContact CG1-CB 3.99Å; C808-C811 HydrophobicContact CB-CB 4Å; C808-C811 WeakPolarHBondContact O-CB 3.46Å; C808-C811 PolarHBondContact O-N 3.12Å; K809-C811 VanDerWaalsContact C-N 3.29Å; K809-C811 PolarHBondContact O-N 2.95Å; C811-R814 PolarHBondContact O-N 3.03Å; C811-R814 PolarHBondContact SG-NH2 2.65Å; C811-R814 VanDerWaalsContact SG-NH2 3.41Å; C811-S815 PolarHBondContact O-N 2.78Å
812	L	92.5	Very high	91.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.5	-40.7	177	-168.2	62	0	0	0	111.7	I799 V807 C808 K809 R814 S815 F816 P824 L830 M836	I799-L812 HydrophobicContact CB-CD2 4.2Å; I799-L812 HydrophobicContact CG1-CD2 4.35Å; I799-L812 HydrophobicContact CG2-CD2 3.92Å; V807-L812 HydrophobicContact CG1-CB 4.24Å; C808-L812 PolarHBondContact O-N 3.33Å; K809-L812 PolarHBondContact O-N 2.99Å; L812-R814 VanDerWaalsContact C-N 3.33Å; L812-R814 PolarHBondContact O-N 3.43Å; L812-S815 WeakPolarHBondContact O-CB 3.25Å; L812-S815 PolarHBondContact O-N 3.47Å; L812-S815 VanDerWaalsContact O-N 3.17Å; L812-F816 HydrophobicContact CD1-CD1 4.31Å; L812-F816 HydrophobicContact CD1-CE1 4Å; L812-F816 HydrophobicContact CG-CD1 4.44Å; L812-F816 HydrophobicContact CG-CE1 4.3Å; L812-F816 PolarHBondContact O-N 2.83Å; L812-P824 HydrophobicContact CD1-CG 4.19Å; L812-L830 HydrophobicContact CD1-CD1 4.06Å; L812-M836 HydrophobicContact CB-SD 4.04Å; L812-M836 HydrophobicContact CD2-CE 4.33Å; L812-M836 HydrophobicContact CD2-CG 4.02Å; L812-M836 HydrophobicContact CD2-SD 3.84Å; L812-M836 HydrophobicContact CG-CE 3.94Å; L812-M836 HydrophobicContact CG-SD 3.81Å
813	D	91.4	Very high	91.8	Very high	39 Å²	39	53.1 Å²	53.1	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-44.2	173.4	-83.8	-34.1	0	0	0	111.3	K809 S815 F816 R817	K809-D813 IonicContact NZ-OD1 3Å; K809-D813 IonicContact NZ-OD2 3.85Å; K809-D813 PolarHBondContact NZ-OD2 2.82Å; K809-D813 WeakPolarHBondContact O-CB 3.43Å; K809-D813 PolarHBondContact O-N 2.87Å; D813-S815 VanDerWaalsContact C-N 3.35Å; D813-S815 PolarHBondContact O-N 3.47Å; D813-F816 PolarHBondContact O-N 3.46Å; D813-R817 WeakPolarHBondContact O-CG 3.47Å; D813-R817 PolarHBondContact O-N 2.95Å
814	R	90.6	Very high	91.7	Very high	158 Å²	158	52.7 Å²	52.7	60%	0.596	26%	0.256	S	S	*	.	H	α-helix	trans	-61.1	-41.4	175.3	-80.2	-174.3	-71	-178.7	-0.8	112.5	D810 C811 L812 R817 A818	D810-R814 WeakPolarHBondContact O-CB 3.43Å; D810-R814 VanDerWaalsContact O-CG 3.31Å; D810-R814 WeakPolarHBondContact O-CG 3.43Å; D810-R814 PolarHBondContact O-N 3.38Å; D810-R814 PolarHBondContact O-NE 2.81Å; C811-R814 PolarHBondContact O-N 3.03Å; C811-R814 PolarHBondContact SG-NH2 2.65Å; C811-R814 VanDerWaalsContact SG-NH2 3.41Å; L812-R814 VanDerWaalsContact C-N 3.33Å; L812-R814 PolarHBondContact O-N 3.43Å; R814-R817 PolarHBondContact O-N 3.09Å; R814-A818 PolarHBondContact O-N 3.21Å; R814-A818 VanDerWaalsContact O-N 3.12Å
815	S	90.1	Very high	91.5	Very high	23 Å²	23	48.7 Å²	48.7	16%	0.161	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-45.6	175	-174	0	0	0	0	111.7	C811 L812 D813 A818 V820	C811-S815 PolarHBondContact O-N 2.78Å; L812-S815 WeakPolarHBondContact O-CB 3.25Å; L812-S815 PolarHBondContact O-N 3.47Å; L812-S815 VanDerWaalsContact O-N 3.17Å; D813-S815 VanDerWaalsContact C-N 3.35Å; D813-S815 PolarHBondContact O-N 3.47Å; S815-A818 CarbonylContact O-C 3.5Å; S815-A818 PolarHBondContact O-N 2.7Å; S815-V820 CarbonylContact C-O 3.38Å; S815-V820 PolarHBondContact O-N 3.15Å; S815-V820 PolarHBondContact OG-O 3.04Å
816	F	90.9	Very high	91.3	Very high	22 Å²	22	48.2 Å²	48.2	10%	0.096	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-37.7	-179.6	-86.2	41.7	0	0	0	112.2	L812 D813 A818 Q819 V820 F821 L830 G831 Y834 M836	L812-F816 HydrophobicContact CD1-CD1 4.31Å; L812-F816 HydrophobicContact CD1-CE1 4Å; L812-F816 HydrophobicContact CG-CD1 4.44Å; L812-F816 HydrophobicContact CG-CE1 4.3Å; L812-F816 PolarHBondContact O-N 2.83Å; D813-F816 PolarHBondContact O-N 3.46Å; F816-A818 PolarHBondContact O-N 2.72Å; F816-Q819 PolarHBondContact O-N 3.08Å; F816-V820 WeakPolarHBondContact CD1-O 3.31Å; F816-F821 HydrophobicContact CB-CD1 4.42Å; F816-F821 HydrophobicContact CB-CE1 4.38Å; F816-F821 HydrophobicContact CD1-CD1 4.27Å; F816-F821 AromaticContact CD2-CD1 3.7Å; F816-F821 HydrophobicContact CD2-CD1 3.7Å; F816-F821 HydrophobicContact CD2-CE1 4.12Å; F816-F821 HydrophobicContact CE1-CB 4.5Å; F816-F821 HydrophobicContact CE1-CD1 4.46Å; F816-F821 AromaticContact CE2-CD1 3.92Å; F816-F821 HydrophobicContact CE2-CD1 3.92Å; F816-F821 AromaticContact CG-CD1 3.88Å; F816-F821 HydrophobicContact CG-CD1 3.88Å; F816-F821 HydrophobicContact CG-CE1 4.29Å; F816-F821 HydrophobicContact CZ-CB 4.44Å; F816-F821 HydrophobicContact CZ-CD1 4.3Å; F816-L830 HydrophobicContact CE1-CD1 4.16Å; F816-L830 HydrophobicContact CZ-CB 4.03Å; F816-L830 HydrophobicContact CZ-CD1 4.26Å; F816-G831 WeakPolarHBondContact CE2-O 3.48Å; F816-Y834 HydrophobicContact CZ-CG 4.46Å; F816-M836 HydrophobicContact CB-CE 3.87Å; F816-M836 HydrophobicContact CD1-CE 3.77Å; F816-M836 HydrophobicContact CD2-CE 3.24Å; F816-M836 HydrophobicContact CE1-CE 4.1Å; F816-M836 HydrophobicContact CE2-CE 3.62Å; F816-M836 HydrophobicContact CG-CE 3.33Å; F816-M836 HydrophobicContact CZ-CE 4.04Å
817	R	89.8	Confident	91	Very high	209 Å²	209	55.8 Å²	55.8	79%	0.789	28%	0.276	S	S	*	.	H	α-helix	trans	-60.8	-34.4	172.6	-73.2	179.1	-170.6	-151.6	3.1	112.2	D813 R814 Q819	D813-R817 WeakPolarHBondContact O-CG 3.47Å; D813-R817 PolarHBondContact O-N 2.95Å; R814-R817 PolarHBondContact O-N 3.09Å; R817-Q819 PolarHBondContact O-N 3.46Å
818	A	89.1	Confident	90.9	Very high	68 Å²	68	62 Å²	62	56%	0.562	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	14.6	173.5	0	0	0	0	0	113.8	R814 S815 F816 V820	R814-A818 PolarHBondContact O-N 3.21Å; R814-A818 VanDerWaalsContact O-N 3.12Å; S815-A818 CarbonylContact O-C 3.5Å; S815-A818 PolarHBondContact O-N 2.7Å; F816-A818 PolarHBondContact O-N 2.72Å; A818-V820 PolarHBondContact O-N 3.31Å
819	Q	89.9	Confident	90.8	Very high	125 Å²	125	67 Å²	67	58%	0.584	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	20.4	-178.1	-55.8	-66.5	-46.3	0	0	114.4	F816 R817 F821	F816-Q819 PolarHBondContact O-N 3.08Å; R817-Q819 PolarHBondContact O-N 3.46Å; Q819-F821 HydrophobicContact CB-CE2 4.34Å; Q819-F821 WeakPolarHBondContact O-CE2 3.32Å
820	V	90.3	Very high	90.7	Very high	57 Å²	57	65.5 Å²	65.5	35%	0.345	32%	0.32	S	S	.	.			trans	-102.9	98.5	175.5	-178.7	0	0	0	0	109.4	S815 F816 A818 S822	S815-V820 CarbonylContact C-O 3.38Å; S815-V820 PolarHBondContact O-N 3.15Å; S815-V820 PolarHBondContact OG-O 3.04Å; F816-V820 WeakPolarHBondContact CD1-O 3.31Å; A818-V820 PolarHBondContact O-N 3.31Å; V820-S822 VanDerWaalsContact C-N 3.33Å; V820-S822 WeakPolarHBondContact CG1-OG 3.3Å; V820-S822 PolarHBondContact O-N 2.83Å
821	F	92.4	Very high	90.6	Very high	38 Å²	38	64.1 Å²	64.1	17%	0.167	32%	0.318	C	S	.	.			trans	-92.2	16.5	-176.3	-52.7	-71.5	0	0	0	114.2	F816 Q819 L830 R832	F816-F821 HydrophobicContact CB-CD1 4.42Å; F816-F821 HydrophobicContact CB-CE1 4.38Å; F816-F821 HydrophobicContact CD1-CD1 4.27Å; F816-F821 AromaticContact CD2-CD1 3.7Å; F816-F821 HydrophobicContact CD2-CD1 3.7Å; F816-F821 HydrophobicContact CD2-CE1 4.12Å; F816-F821 HydrophobicContact CE1-CB 4.5Å; F816-F821 HydrophobicContact CE1-CD1 4.46Å; F816-F821 AromaticContact CE2-CD1 3.92Å; F816-F821 HydrophobicContact CE2-CD1 3.92Å; F816-F821 AromaticContact CG-CD1 3.88Å; F816-F821 HydrophobicContact CG-CD1 3.88Å; F816-F821 HydrophobicContact CG-CE1 4.29Å; F816-F821 HydrophobicContact CZ-CB 4.44Å; F816-F821 HydrophobicContact CZ-CD1 4.3Å; Q819-F821 HydrophobicContact CB-CE2 4.34Å; Q819-F821 WeakPolarHBondContact O-CE2 3.32Å; F821-L830 WeakPolarHBondContact O-CA 3.32Å; F821-L830 VanDerWaalsContact O-CB 3.3Å; F821-L830 WeakPolarHBondContact O-CB 3.16Å; F821-L830 PolarHBondContact O-N 3.36Å; F821-R832 HydrophobicContact CD1-CB 4.33Å; F821-R832 HydrophobicContact CD1-CG 4.08Å; F821-R832 HydrophobicContact CD2-CG 3.74Å; F821-R832 HydrophobicContact CE1-CB 4.28Å; F821-R832 HydrophobicContact CE1-CG 4.04Å; F821-R832 HydrophobicContact CE2-CG 3.7Å; F821-R832 HydrophobicContact CG-CG 3.93Å; F821-R832 HydrophobicContact CZ-CB 4.48Å; F821-R832 HydrophobicContact CZ-CG 3.85Å
822	S	92.4	Very high	90.3	Very high	24 Å²	24	72.8 Å²	72.8	17%	0.168	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-99.8	151.8	178.2	66.2	0	0	0	0	111.8	V820 P824 Y828	V820-S822 VanDerWaalsContact C-N 3.33Å; V820-S822 WeakPolarHBondContact CG1-OG 3.3Å; V820-S822 PolarHBondContact O-N 2.83Å; S822-P824 WeakPolarHBondContact O-CD 3.38Å; S822-Y828 CarbonylContact C-O 3.56Å; S822-Y828 VanDerWaalsContact CA-O 3.31Å; S822-Y828 WeakPolarHBondContact CA-O 3.09Å
823	C	90.8	Very high	89.9	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	39%	0.389	C	S	.	.			trans	-56.8	124.2	170	177.5	0	0	0	0	111	C803 A825 R827 Y828 L830	C803-C823 VanDerWaalsContact SG-CB 3.58Å; C803-C823 PolarHBondContact SG-SG 3.4Å; C823-A825 PolarHBondContact O-N 3.38Å; C823-A825 VanDerWaalsContact O-N 3.16Å; C823-R827 WeakPolarHBondContact O-CA 3.22Å; C823-R827 PolarHBondContact O-N 3.04Å; C823-Y828 PolarHBondContact N-O 3.19Å; C823-L830 HydrophobicContact CB-CD1 4.21Å; C823-L830 HydrophobicContact CB-CD2 4.42Å; C823-L830 HydrophobicContact CB-CG 4.32Å
824	P	90.1	Very high	89.9	Confident	20 Å²	20	78.8 Å²	78.8	13%	0.13	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.2	-179.6	-27.8	36.5	0	0	0	114.9	I789 C790 V807 L812 S822	I789-P824 HydrophobicContact CG2-CB 3.78Å; C790-P824 WeakPolarHBondContact SG-CB 3.25Å; V807-P824 HydrophobicContact CG1-CG 4.46Å; L812-P824 HydrophobicContact CD1-CG 4.19Å; S822-P824 WeakPolarHBondContact O-CD 3.38Å
825	A	87.4	Confident	89.7	Confident	42 Å²	42	74.5 Å²	74.5	35%	0.347	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-44.5	-176.6	0	0	0	0	0	113.3	I789 H805 C823	I789-A825 HydrophobicContact CG2-CB 4.11Å; H805-A825 HydrophobicContact CB-CB 3.86Å; H805-A825 WeakPolarHBondContact CD2-CB 3.23Å; C823-A825 PolarHBondContact O-N 3.38Å; C823-A825 VanDerWaalsContact O-N 3.16Å
826	C	89.8	Confident	89.7	Confident	57 Å²	57	75 Å²	75	39%	0.385	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	1.9	-173.7	66.1	0	0	0	0	114.8	C803 H805 Y828	C803-C826 PolarHBondContact SG-SG 2.59Å; H805-C826 VanDerWaalsContact CE1-CB 3.47Å; H805-C826 WeakPolarHBondContact CE1-CB 3.4Å; H805-C826 VanDerWaalsContact CE1-SG 3.55Å; H805-C826 PolarHBondContact ND1-SG 3.43Å; C826-Y828 PolarHBondContact O-N 2.88Å; C826-Y828 VanDerWaalsContact O-N 3.12Å
827	R	90.1	Very high	89.7	Confident	175 Å²	175	81.3 Å²	81.3	66%	0.66	42%	0.416	S	S	*	.			trans	62.2	11.7	-179.6	-50.2	-60.3	-177.8	168	-0.7	115.5	C823 D829	C823-R827 WeakPolarHBondContact O-CA 3.22Å; C823-R827 PolarHBondContact O-N 3.04Å; R827-D829 PolarHBondContact O-N 3.33Å
828	Y	90.8	Very high	89.9	Confident	130 Å²	130	73.5 Å²	73.5	51%	0.51	39%	0.392	S	S	.	.			trans	-57.2	133.6	170	-177	-93.7	0	0	0	110.7	V802 C803 S822 C823 C826 L830	V802-Y828 HydrophobicContact CG2-CD1 4.03Å; V802-Y828 HydrophobicContact CG2-CE1 3.56Å; C803-Y828 HydrophobicContact CB-CD1 4.15Å; C803-Y828 HydrophobicContact CB-CG 4.01Å; S822-Y828 CarbonylContact C-O 3.56Å; S822-Y828 VanDerWaalsContact CA-O 3.31Å; S822-Y828 WeakPolarHBondContact CA-O 3.09Å; C823-Y828 PolarHBondContact N-O 3.19Å; C826-Y828 PolarHBondContact O-N 2.88Å; C826-Y828 VanDerWaalsContact O-N 3.12Å; Y828-L830 HydrophobicContact CD1-CD2 4.12Å; Y828-L830 PolarHBondContact O-N 2.96Å
829	D	92.3	Very high	90.2	Very high	112 Å²	112	71 Å²	71	60%	0.599	37%	0.369	S	S	*	.	B	Isolated β-bridge	trans	-71.9	120.2	179.9	-173.4	8.8	0	0	0	110.9	R827 G831	R827-D829 PolarHBondContact O-N 3.33Å; D829-G831 PolarHBondContact OD1-N 2.95Å
830	L	91.1	Very high	90.4	Very high	17 Å²	17	70.6 Å²	70.6	9%	0.089	37%	0.367	C	S	.	.			trans	-92.9	-17.1	179.1	-59.7	172.2	0	0	0	111.8	T801 V802 L812 F816 F821 C823 Y828 Y834	T801-L830 HydrophobicContact CG2-CD1 4.17Å; T801-L830 HydrophobicContact CG2-CD2 4.3Å; V802-L830 HydrophobicContact CG2-CD2 3.85Å; L812-L830 HydrophobicContact CD1-CD1 4.06Å; F816-L830 HydrophobicContact CE1-CD1 4.16Å; F816-L830 HydrophobicContact CZ-CB 4.03Å; F816-L830 HydrophobicContact CZ-CD1 4.26Å; F821-L830 WeakPolarHBondContact O-CA 3.32Å; F821-L830 VanDerWaalsContact O-CB 3.3Å; F821-L830 WeakPolarHBondContact O-CB 3.16Å; F821-L830 PolarHBondContact O-N 3.36Å; C823-L830 HydrophobicContact CB-CD1 4.21Å; C823-L830 HydrophobicContact CB-CD2 4.42Å; C823-L830 HydrophobicContact CB-CG 4.32Å; Y828-L830 HydrophobicContact CD1-CD2 4.12Å; Y828-L830 PolarHBondContact O-N 2.96Å; L830-Y834 HydrophobicContact CB-CD2 3.87Å; L830-Y834 HydrophobicContact CB-CE2 4.47Å; L830-Y834 HydrophobicContact CB-CG 3.92Å; L830-Y834 HydrophobicContact CD2-CD2 4.28Å; L830-Y834 HydrophobicContact CD2-CE2 4.03Å; L830-Y834 WeakPolarHBondContact O-CB 3.39Å; L830-Y834 WeakPolarHBondContact O-CD2 3.36Å
831	G	88.9	Confident	90.5	Very high	23 Å²	23	70 Å²	70	24%	0.237	36%	0.364	C	S	.	.			trans	77.7	157.5	-175	0	0	0	0	0	114.3	F816 D829 S833 Y834	F816-G831 WeakPolarHBondContact CE2-O 3.48Å; D829-G831 PolarHBondContact OD1-N 2.95Å; G831-S833 VanDerWaalsContact C-N 3.3Å; G831-S833 PolarHBondContact O-N 2.96Å; G831-Y834 WeakPolarHBondContact O-CB 3.26Å; G831-Y834 PolarHBondContact O-N 2.99Å
832	R	86.1	Confident	90.5	Very high	190 Å²	190	68.1 Å²	68.1	72%	0.717	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-29	-175.8	-62.5	-172.4	178.5	-151.4	-1.6	114	F821	F821-R832 HydrophobicContact CD1-CB 4.33Å; F821-R832 HydrophobicContact CD1-CG 4.08Å; F821-R832 HydrophobicContact CD2-CG 3.74Å; F821-R832 HydrophobicContact CE1-CB 4.28Å; F821-R832 HydrophobicContact CE1-CG 4.04Å; F821-R832 HydrophobicContact CE2-CG 3.7Å; F821-R832 HydrophobicContact CG-CG 3.93Å; F821-R832 HydrophobicContact CZ-CB 4.48Å; F821-R832 HydrophobicContact CZ-CG 3.85Å
833	S	84.2	Confident	90.5	Very high	118 Å²	118	67.6 Å²	67.6	83%	0.825	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	20.4	-177.6	59.4	0	0	0	0	113.1	G831 A835	G831-S833 VanDerWaalsContact C-N 3.3Å; G831-S833 PolarHBondContact O-N 2.96Å; S833-A835 PolarHBondContact O-N 3.22Å
834	Y	90.4	Very high	90.4	Very high	47 Å²	47	70.1 Å²	70.1	18%	0.184	37%	0.367	C	S	.	.			trans	-60.7	125.1	-179.2	-171.5	-100.3	0	0	0	111.8	I799 T801 V802 F816 L830 G831 M836	I799-Y834 HydrophobicContact CG2-CE1 4.23Å; T801-Y834 WeakPolarHBondContact CA-OH 3.36Å; V802-Y834 HydrophobicContact CG1-CE2 3.96Å; V802-Y834 HydrophobicContact CG2-CE2 4.3Å; V802-Y834 PolarHBondContact N-OH 3.23Å; F816-Y834 HydrophobicContact CZ-CG 4.46Å; L830-Y834 HydrophobicContact CB-CD2 3.87Å; L830-Y834 HydrophobicContact CB-CE2 4.47Å; L830-Y834 HydrophobicContact CB-CG 3.92Å; L830-Y834 HydrophobicContact CD2-CD2 4.28Å; L830-Y834 HydrophobicContact CD2-CE2 4.03Å; L830-Y834 WeakPolarHBondContact O-CB 3.39Å; L830-Y834 WeakPolarHBondContact O-CD2 3.36Å; G831-Y834 WeakPolarHBondContact O-CB 3.26Å; G831-Y834 PolarHBondContact O-N 2.99Å; Y834-M836 HydrophobicContact CD1-CG 4.06Å; Y834-M836 PolarHBondContact O-N 3.15Å
835	A	87.4	Confident	90.4	Very high	67 Å²	67	69.2 Å²	69.2	55%	0.554	36%	0.361	S	S	*	.			trans	-80	105.3	178.1	0	0	0	0	0	111	S833 Q837	S833-A835 PolarHBondContact O-N 3.22Å; A835-Q837 VanDerWaalsContact C-N 3.32Å; A835-Q837 PolarHBondContact O-N 3.15Å
836	M	90.2	Very high	90.4	Very high	33 Å²	33	67.2 Å²	67.2	16%	0.163	34%	0.344	C	S	.	.			trans	-78.1	76.5	178.4	-59.6	-169.2	-157.7	0	0	112	I799 L812 F816 Y834	I799-M836 HydrophobicContact CD1-CB 4.03Å; I799-M836 HydrophobicContact CG1-CB 4.39Å; L812-M836 HydrophobicContact CB-SD 4.04Å; L812-M836 HydrophobicContact CD2-CE 4.33Å; L812-M836 HydrophobicContact CD2-CG 4.02Å; L812-M836 HydrophobicContact CD2-SD 3.84Å; L812-M836 HydrophobicContact CG-CE 3.94Å; L812-M836 HydrophobicContact CG-SD 3.81Å; F816-M836 HydrophobicContact CB-CE 3.87Å; F816-M836 HydrophobicContact CD1-CE 3.77Å; F816-M836 HydrophobicContact CD2-CE 3.24Å; F816-M836 HydrophobicContact CE1-CE 4.1Å; F816-M836 HydrophobicContact CE2-CE 3.62Å; F816-M836 HydrophobicContact CG-CE 3.33Å; F816-M836 HydrophobicContact CZ-CE 4.04Å; Y834-M836 HydrophobicContact CD1-CG 4.06Å; Y834-M836 PolarHBondContact O-N 3.15Å
837	Q	91.2	Very high	90.2	Very high	155 Å²	155	67.9 Å²	67.9	72%	0.724	34%	0.344	S	S	*	.			trans	-84	129.6	175	-64.7	-174.4	-4.7	0	0	111.6	I799 A835 N839	I799-Q837 VanDerWaalsContact CD1-C 3.43Å; I799-Q837 WeakPolarHBondContact CD1-O 3.25Å; A835-Q837 VanDerWaalsContact C-N 3.32Å; A835-Q837 PolarHBondContact O-N 3.15Å; Q837-N839 PolarHBondContact O-N 3.49Å
838	V	94.1	Very high	89.8	Confident	45 Å²	45	62 Å²	62	27%	0.273	32%	0.324	S	S	.	.			trans	-70.8	128.8	177	179.1	0	0	0	0	109.9	R797 P798 I799 K809 Q840	R797-V838 HydrophobicContact CB-CG1 4.34Å; R797-V838 HydrophobicContact CB-CG2 4.21Å; P798-V838 WeakPolarHBondContact O-CA 3.45Å; I799-V838 HydrophobicContact CD1-CG2 4.09Å; K809-V838 HydrophobicContact CD-CG2 4.01Å; V838-Q840 VanDerWaalsContact C-N 3.3Å; V838-Q840 PolarHBondContact O-N 2.98Å
839	N	94.4	Very high	89.4	Confident	17 Å²	17	56.1 Å²	56.1	9%	0.091	30%	0.301	C	S	.	.			trans	-72.3	87.7	171.1	-174.8	-19.7	0	0	0	109.3	D751 N754 P798 T800 Q837 P841 L842 Q843	D751-N839 PolarHBondContact OD1-ND2 3.1Å; N754-N839 PolarHBondContact ND2-ND2 3.23Å; N754-N839 VanDerWaalsContact ND2-ND2 3.13Å; P798-N839 HydrophobicContact CG-CB 4.44Å; P798-N839 PolarHBondContact O-N 3.42Å; T800-N839 PolarHBondContact OG1-ND2 3.14Å; Q837-N839 PolarHBondContact O-N 3.49Å; N839-P841 VanDerWaalsContact OD1-CD 3.25Å; N839-P841 WeakPolarHBondContact OD1-CD 3.47Å; N839-L842 HydrophobicContact CB-CB 4.09Å; N839-L842 VanDerWaalsContact CG-CB 3.5Å; N839-L842 PolarHBondContact O-N 3.42Å; N839-L842 PolarHBondContact OD1-N 3.03Å; N839-Q843 PolarHBondContact O-N 2.95Å
840	Q	93.1	Very high	88.9	Confident	115 Å²	115	50.9 Å²	50.9	54%	0.537	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-40.4	-177.6	-161.3	64.6	24.7	0	0	113.4	V838 Q843 T844	V838-Q840 VanDerWaalsContact C-N 3.3Å; V838-Q840 PolarHBondContact O-N 2.98Å; Q840-Q843 PolarHBondContact O-N 2.92Å; Q840-T844 WeakPolarHBondContact O-CB 3.5Å; Q840-T844 PolarHBondContact O-N 3.43Å; Q840-T844 PolarHBondContact O-OG1 3.39Å
841	P	92.9	Very high	87.9	Confident	44 Å²	44	53.7 Å²	53.7	29%	0.286	29%	0.292	S	S	.	.	H	α-helix	trans	-55.2	-50.8	171.2	-28.7	35.7	0	0	0	113.2	E750 D751 N839 Q843 T844 V845	E750-P841 HydrophobicContact CB-CB 4.32Å; D751-P841 HydrophobicContact CB-CB 3.87Å; N839-P841 VanDerWaalsContact OD1-CD 3.25Å; N839-P841 WeakPolarHBondContact OD1-CD 3.47Å; P841-Q843 PolarHBondContact O-N 3.23Å; P841-T844 PolarHBondContact O-N 3.31Å; P841-V845 WeakPolarHBondContact O-CG2 3.3Å; P841-V845 PolarHBondContact O-N 3Å
842	L	93.3	Very high	86.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-46.1	178.4	179.8	56.8	0	0	0	111.5	D751 W758 F786 V795 P798 N806 N839 T844 V845 L846	D751-L842 WeakPolarHBondContact OD2-CB 3.32Å; W758-L842 HydrophobicContact CZ2-CD1 3.75Å; F786-L842 HydrophobicContact CD1-CD1 3.85Å; F786-L842 HydrophobicContact CD1-CD2 3.85Å; F786-L842 HydrophobicContact CD2-CD1 4.43Å; F786-L842 HydrophobicContact CE1-CD1 3.7Å; F786-L842 HydrophobicContact CE1-CD2 3.98Å; F786-L842 HydrophobicContact CE2-CD1 4.3Å; F786-L842 HydrophobicContact CG-CD1 4.22Å; F786-L842 HydrophobicContact CZ-CD1 3.93Å; V795-L842 HydrophobicContact CG2-CD2 4.34Å; P798-L842 HydrophobicContact CB-CD2 3.72Å; P798-L842 HydrophobicContact CB-CG 4.35Å; P798-L842 HydrophobicContact CG-CB 4.08Å; P798-L842 HydrophobicContact CG-CD2 3.82Å; P798-L842 HydrophobicContact CG-CG 3.89Å; N806-L842 WeakPolarHBondContact OD1-CD2 3.26Å; N839-L842 HydrophobicContact CB-CB 4.09Å; N839-L842 VanDerWaalsContact CG-CB 3.5Å; N839-L842 PolarHBondContact O-N 3.42Å; N839-L842 PolarHBondContact OD1-N 3.03Å; L842-T844 VanDerWaalsContact C-N 3.25Å; L842-T844 PolarHBondContact O-N 3.12Å; L842-V845 PolarHBondContact O-N 3.31Å; L842-L846 HydrophobicContact CD1-CD1 3.98Å; L842-L846 HydrophobicContact CD1-CD2 4.41Å; L842-L846 HydrophobicContact CD1-CG 3.93Å; L842-L846 HydrophobicContact CG-CD1 3.96Å; L842-L846 HydrophobicContact CG-CG 4.32Å; L842-L846 WeakPolarHBondContact O-CB 3.49Å; L842-L846 VanDerWaalsContact O-CG 3.32Å; L842-L846 WeakPolarHBondContact O-CG 3.37Å; L842-L846 PolarHBondContact O-N 3.38Å
843	Q	91.6	Very high	86.2	Confident	12 Å²	12	44.7 Å²	44.7	6%	0.056	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-41	177	-177.6	64	63.4	0	0	111.9	P798 N839 Q840 P841 L846 N847 Y853	P798-Q843 HydrophobicContact CG-CB 4.3Å; N839-Q843 PolarHBondContact O-N 2.95Å; Q840-Q843 PolarHBondContact O-N 2.92Å; P841-Q843 PolarHBondContact O-N 3.23Å; Q843-L846 PolarHBondContact O-N 3.21Å; Q843-N847 PolarHBondContact NE2-ND2 3.08Å; Q843-N847 PolarHBondContact NE2-OD1 3.15Å; Q843-N847 WeakPolarHBondContact O-CB 3.46Å; Q843-N847 PolarHBondContact O-N 3.34Å; Q843-N847 PolarHBondContact O-ND2 3.25Å; Q843-Y853 PolarHBondContact NE2-OH 3.38Å
844	T	88.5	Confident	85.2	Confident	54 Å²	54	39.8 Å²	39.8	33%	0.331	23%	0.226	S	C	.	.	H	α-helix	trans	-68.4	-43.7	-178.8	-55.1	0	0	0	0	111.3	L747 Q840 P841 L842 N847 Q848	L747-T844 HydrophobicContact CD1-CG2 4.32Å; L747-T844 HydrophobicContact CD2-CG2 3.81Å; Q840-T844 WeakPolarHBondContact O-CB 3.5Å; Q840-T844 PolarHBondContact O-N 3.43Å; Q840-T844 PolarHBondContact O-OG1 3.39Å; P841-T844 PolarHBondContact O-N 3.31Å; L842-T844 VanDerWaalsContact C-N 3.25Å; L842-T844 PolarHBondContact O-N 3.12Å; T844-N847 PolarHBondContact O-N 2.94Å; T844-Q848 PolarHBondContact O-N 3.02Å; T844-Q848 VanDerWaalsContact O-N 3.08Å
845	V	90.1	Very high	83.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-49.2	174.2	177.2	0	0	0	0	110.6	L747 I748 W758 P841 L842 N847 Q848 L849	L747-V845 HydrophobicContact CB-CG2 3.55Å; L747-V845 VanDerWaalsContact O-CG2 3.31Å; L747-V845 WeakPolarHBondContact O-CG2 3.42Å; I748-V845 HydrophobicContact CG1-CG1 3.75Å; I748-V845 HydrophobicContact CG1-CG2 4.21Å; W758-V845 HydrophobicContact CH2-CB 4.49Å; W758-V845 HydrophobicContact CH2-CG1 3.45Å; W758-V845 VanDerWaalsContact CH2-CG1 3.45Å; W758-V845 HydrophobicContact CZ2-CB 4.17Å; W758-V845 HydrophobicContact CZ2-CG1 3.58Å; W758-V845 HydrophobicContact CZ3-CG1 4.4Å; P841-V845 WeakPolarHBondContact O-CG2 3.3Å; P841-V845 PolarHBondContact O-N 3Å; L842-V845 PolarHBondContact O-N 3.31Å; V845-N847 VanDerWaalsContact C-N 3.33Å; V845-N847 PolarHBondContact O-N 3.28Å; V845-Q848 PolarHBondContact O-N 3.45Å; V845-Q848 VanDerWaalsContact O-N 3.1Å; V845-L849 HydrophobicContact CG1-CD1 3.71Å; V845-L849 HydrophobicContact CG1-CG 4.11Å; V845-L849 WeakPolarHBondContact O-CG 3.5Å; V845-L849 PolarHBondContact O-N 2.85Å
846	L	88.9	Confident	82	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-38.8	-179.3	-67.1	178.4	0	0	0	111.8	V782 L794 V795 L842 Q843 Q848 L849 F850 Y853	V782-L846 HydrophobicContact CG1-CD2 3.8Å; L794-L846 HydrophobicContact CD1-CD1 4.31Å; L794-L846 HydrophobicContact CD1-CD2 3.92Å; L794-L846 HydrophobicContact CD2-CD2 4.34Å; L794-L846 HydrophobicContact CG-CD1 4.43Å; L794-L846 HydrophobicContact CG-CD2 4.48Å; V795-L846 HydrophobicContact CG2-CD1 3.63Å; L842-L846 HydrophobicContact CD1-CD1 3.98Å; L842-L846 HydrophobicContact CD1-CD2 4.41Å; L842-L846 HydrophobicContact CD1-CG 3.93Å; L842-L846 HydrophobicContact CG-CD1 3.96Å; L842-L846 HydrophobicContact CG-CG 4.32Å; L842-L846 WeakPolarHBondContact O-CB 3.49Å; L842-L846 VanDerWaalsContact O-CG 3.32Å; L842-L846 WeakPolarHBondContact O-CG 3.37Å; L842-L846 PolarHBondContact O-N 3.38Å; Q843-L846 PolarHBondContact O-N 3.21Å; L846-Q848 VanDerWaalsContact C-N 3.27Å; L846-Q848 PolarHBondContact O-N 3.03Å; L846-L849 PolarHBondContact O-N 2.88Å; L846-F850 HydrophobicContact CD2-CD2 4.33Å; L846-F850 HydrophobicContact CD2-CE2 4.26Å; L846-F850 WeakPolarHBondContact O-CA 3.45Å; L846-F850 WeakPolarHBondContact O-CB 3.34Å; L846-F850 PolarHBondContact O-N 3.39Å; L846-Y853 HydrophobicContact CB-CE1 3.76Å; L846-Y853 WeakPolarHBondContact CB-OH 3.29Å
847	N	84.1	Confident	80.4	Confident	71 Å²	71	46 Å²	46	38%	0.38	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-34.5	174.5	-78.5	-18.3	0	0	0	112.3	Q843 T844 V845 F850 P851 Y853	Q843-N847 PolarHBondContact NE2-ND2 3.08Å; Q843-N847 PolarHBondContact NE2-OD1 3.15Å; Q843-N847 WeakPolarHBondContact O-CB 3.46Å; Q843-N847 PolarHBondContact O-N 3.34Å; Q843-N847 PolarHBondContact O-ND2 3.25Å; T844-N847 PolarHBondContact O-N 2.94Å; V845-N847 VanDerWaalsContact C-N 3.33Å; V845-N847 PolarHBondContact O-N 3.28Å; N847-F850 CarbonylContact O-C 3.52Å; N847-P851 VanDerWaalsContact O-CA 3.26Å; N847-P851 WeakPolarHBondContact O-CA 3.46Å; N847-Y853 WeakPolarHBondContact OD1-CE1 3.47Å
848	Q	82.4	Confident	79.8	Confident	51 Å²	51	40.6 Å²	40.6	24%	0.238	24%	0.242	C	C	.	.	H	α-helix	trans	-76.2	-38.6	177.6	-163.9	-172.2	30.2	0	0	112.2	Q743 T844 V845 L846	Q743-Q848 VanDerWaalsContact CD-NE2 3.29Å; T844-Q848 PolarHBondContact O-N 3.02Å; T844-Q848 VanDerWaalsContact O-N 3.08Å; V845-Q848 PolarHBondContact O-N 3.45Å; V845-Q848 VanDerWaalsContact O-N 3.1Å; L846-Q848 VanDerWaalsContact C-N 3.27Å; L846-Q848 PolarHBondContact O-N 3.03Å
849	L	83.3	Confident	79.1	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-76.1	-32.7	179.2	-67.2	-176.9	0	0	0	112.4	Q744 W758 F778 L779 V782 V845 L846	Q744-L849 HydrophobicContact CG-CD2 4.34Å; W758-L849 HydrophobicContact CH2-CD1 4.11Å; W758-L849 HydrophobicContact CZ3-CD1 4.45Å; F778-L849 HydrophobicContact CE1-CD1 3.88Å; F778-L849 HydrophobicContact CE1-CD2 3.78Å; F778-L849 HydrophobicContact CE1-CG 4.47Å; F778-L849 HydrophobicContact CZ-CD1 4.02Å; F778-L849 HydrophobicContact CZ-CD2 4.48Å; L779-L849 HydrophobicContact CD2-CB 4Å; L779-L849 HydrophobicContact CD2-CD2 4.36Å; V782-L849 HydrophobicContact CG1-CD1 4.09Å; V782-L849 HydrophobicContact CG2-CD1 4.18Å; V845-L849 HydrophobicContact CG1-CD1 3.71Å; V845-L849 HydrophobicContact CG1-CG 4.11Å; V845-L849 WeakPolarHBondContact O-CG 3.5Å; V845-L849 PolarHBondContact O-N 2.85Å; L846-L849 PolarHBondContact O-N 2.88Å
850	F	80.3	Confident	78.2	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.013	25%	0.249	C	C	.	.	S	Bend	trans	-126.8	67.6	-179.3	-56.7	-87.8	0	0	0	111.7	P486 L779 V782 E783 L794 L846 N847 G852 Y853	P486-F850 HydrophobicContact CB-CB 3.78Å; P486-F850 HydrophobicContact CB-CD1 4.25Å; L779-F850 HydrophobicContact CB-CE1 4.11Å; L779-F850 HydrophobicContact CB-CZ 4.09Å; L779-F850 HydrophobicContact CD2-CE1 4.26Å; L779-F850 HydrophobicContact CD2-CE2 4.35Å; L779-F850 HydrophobicContact CD2-CZ 3.99Å; L779-F850 WeakPolarHBondContact O-CZ 3.43Å; V782-F850 HydrophobicContact CB-CE2 4.24Å; V782-F850 HydrophobicContact CB-CZ 4.32Å; V782-F850 HydrophobicContact CG1-CE2 3.74Å; V782-F850 HydrophobicContact CG1-CZ 4.29Å; E783-F850 HydrophobicContact CB-CZ 4.22Å; L794-F850 HydrophobicContact CD2-CB 4.2Å; L794-F850 HydrophobicContact CD2-CD1 4.32Å; L794-F850 HydrophobicContact CD2-CD2 3.5Å; L794-F850 VanDerWaalsContact CD2-CD2 3.5Å; L794-F850 HydrophobicContact CD2-CE2 3.85Å; L794-F850 HydrophobicContact CD2-CG 3.76Å; L794-F850 HydrophobicContact CD2-CZ 4.38Å; L846-F850 HydrophobicContact CD2-CD2 4.33Å; L846-F850 HydrophobicContact CD2-CE2 4.26Å; L846-F850 WeakPolarHBondContact O-CA 3.45Å; L846-F850 WeakPolarHBondContact O-CB 3.34Å; L846-F850 PolarHBondContact O-N 3.39Å; N847-F850 CarbonylContact O-C 3.52Å; F850-G852 PolarHBondContact O-N 3.43Å; F850-G852 VanDerWaalsContact O-N 3.08Å; F850-Y853 HydrophobicContact CB-CD1 3.86Å; F850-Y853 HydrophobicContact CB-CG 4.11Å; F850-Y853 WeakPolarHBondContact O-CD1 3.34Å; F850-Y853 PolarHBondContact O-N 2.88Å; F850-Y853 VanDerWaalsContact O-N 3.13Å
851	P	71.6	Confident	77.4	Confident	76 Å²	76	37.3 Å²	37.3	49%	0.494	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	118.7	-175.4	-25.2	34.9	0	0	0	113.3	P486 N847	P486-P851 WeakPolarHBondContact CG-O 3.31Å; N847-P851 VanDerWaalsContact O-CA 3.26Å; N847-P851 WeakPolarHBondContact O-CA 3.46Å
852	G	61	Low	76.4	Confident	20 Å²	20	36.9 Å²	36.9	21%	0.206	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	6.9	177.1	0	0	0	0	0	116	F850 G854 N855	F850-G852 PolarHBondContact O-N 3.43Å; F850-G852 VanDerWaalsContact O-N 3.08Å; G852-G854 PolarHBondContact O-N 3.29Å; G852-N855 WeakPolarHBondContact O-CB 3.33Å; G852-N855 PolarHBondContact O-N 2.99Å
853	Y	76.8	Confident	75.3	Confident	3 Å²	3	39.3 Å²	39.3	1%	0.012	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.1	176.3	86.5	-80.1	0	0	0	113.9	L794 V795 F796 Q843 L846 N847 F850 N855	L794-Y853 HydrophobicContact CB-CD2 4.44Å; L794-Y853 HydrophobicContact CD2-CD2 3.79Å; L794-Y853 HydrophobicContact CD2-CE2 3.89Å; L794-Y853 HydrophobicContact CD2-CG 4.11Å; L794-Y853 HydrophobicContact CG-CD2 4.27Å; L794-Y853 HydrophobicContact CG-CE2 4.09Å; V795-Y853 WeakPolarHBondContact O-CE2 2.99Å; V795-Y853 PolarHBondContact O-OH 3.2Å; V795-Y853 VanDerWaalsContact O-OH 3.12Å; F796-Y853 HydrophobicContact CB-CE2 4.47Å; F796-Y853 HydrophobicContact CD2-CE2 4.4Å; Q843-Y853 PolarHBondContact NE2-OH 3.38Å; L846-Y853 HydrophobicContact CB-CE1 3.76Å; L846-Y853 WeakPolarHBondContact CB-OH 3.29Å; N847-Y853 WeakPolarHBondContact OD1-CE1 3.47Å; F850-Y853 HydrophobicContact CB-CD1 3.86Å; F850-Y853 HydrophobicContact CB-CG 4.11Å; F850-Y853 WeakPolarHBondContact O-CD1 3.34Å; F850-Y853 PolarHBondContact O-N 2.88Å; F850-Y853 VanDerWaalsContact O-N 3.13Å; Y853-N855 VanDerWaalsContact C-N 3.35Å
854	G	63.7	Low	74.1	Confident	16 Å²	16	41.3 Å²	41.3	17%	0.165	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.3	173.1	0	0	0	0	0	114.5	G852 G856 R857	G852-G854 PolarHBondContact O-N 3.29Å; G854-G856 PolarHBondContact O-N 3.4Å; G854-R857 PolarHBondContact O-N 2.96Å
855	N	59.2	Low	73	Confident	97 Å²	97	40.3 Å²	40.3	52%	0.519	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	110.5	-177.5	-69.7	-5.5	0	0	0	110	G852 Y853	G852-N855 WeakPolarHBondContact O-CB 3.33Å; G852-N855 PolarHBondContact O-N 2.99Å; Y853-N855 VanDerWaalsContact C-N 3.35Å
856	G	51.1	Low	71.6	Confident	80 Å²	80	43.6 Å²	43.6	83%	0.825	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	17.1	-179.9	0	0	0	0	0	114.9	G854	G854-G856 PolarHBondContact O-N 3.4Å
857	R	56.4	Low	70	Confident	100 Å²	100	47.5 Å²	47.5	38%	0.377	30%	0.296	S	S	.	.			trans	-117.2	0	173.2	-73.1	-168.8	175.1	167.4	9.2	113	T475 E793 L794 F796 G854	T475-R857 PolarHBondContact O-NH2 2.89Å; E793-R857 IonicContact OE1-CZ 2.78Å; E793-R857 IonicContact OE1-NE 2.69Å; E793-R857 IonicContact OE1-NH2 3.23Å; E793-R857 PolarHBondContact OE1-NH2 3Å; E793-R857 IonicContact OE2-CZ 3.74Å; E793-R857 IonicContact OE2-NE 3.8Å; E793-R857 PolarHBondContact OE2-NE 3.04Å; E793-R857 IonicContact OE2-NH1 2.73Å; E793-R857 PolarHBondContact OE2-NH1 3.14Å; E793-R857 IonicContact OE2-NH2 3.61Å; E793-R857 PolarHBondContact OE2-NH2 2.71Å; L794-R857 PolarHBondContact O-NH1 2.82Å; L794-R857 VanDerWaalsContact O-NH1 3.16Å; F796-R857 HydrophobicContact CD1-CB 3.83Å; F796-R857 HydrophobicContact CE1-CB 3.99Å; F796-R857 VanDerWaalsContact CE1-O 3.24Å; F796-R857 WeakPolarHBondContact CE1-O 3.45Å; F796-R857 HydrophobicContact CG-CB 4.19Å; F796-R857 HydrophobicContact CZ-CB 4.49Å; G854-R857 PolarHBondContact O-N 2.96Å

Retrieved 857 of 857 residues in 537.2 ms (Link to these results)

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