FGDH_CAEEL Loading...

Isoform f of FYVE, RhoGEF and PH domain-containing protein tag-77

Canonical isoform description: Activates cdc-42, a member of the Ras-like family of Rho- and Rac proteins, by exchanging bound GDP for free GTP (By similarity). May play a role in regulating the actin cytoskeleton and cell shape (By similarity). Required for normal lifespan¹.

AlphaFold DB (X5LPV6), UniProt , Accession X5LX76-6 (canonical: X5LX76), Species CAEEL (Caenorhabditis elegans), Gene tag-77, Length 846 aa.

						>FGDH_CAEEL|X5LX76-6|tag-77
MGFVPRMQNGGTGTPSERPISQVSTLSQVSDEFDEGDTSASDEESMNSEKHLRRHRHEDDFDELPLPKNERKTTTVAATHSEIMNEMEHLFVRGGKKNNGVHKQQRRQSNIDEIPSDVGKLRDNRKGRHNSLFVSPTSGMSSSSTDDFSRITSMTSDRSSILTSHSGGEDSTDGASPVPDYETGDEKDDQRLKKLHYAAVEFLKVQNNYVQYLKEMAVLYPEYMERFGKRVGRDLLASHNGHENVVLQIKKIMVQILPIHEMLLKEIDKVCSNWDSRYPNMSKTIGTFADFLKCCQPFLDNKADFLNKLLQLRNEDKEFDEATYMFETEVFKRGKKGAVIQQLDQVHQNFMRYKLLMLRYSEYLIDDCDEKEKAQEAIQKLENVTQAVNQKMGLPTTEELTKLYYRFQCQFNVLEPGRVLIRQSEVMKQTRKELQPRYLVLFTDYLWICRVSSSGQFDINRSYRIPLEYMKFERMEEDERIRCLQIRSRVKSALIIFSSEKERNQWTDDLTKAQYDRKSYKRRQSTAVQRHDENKKKMNKLLMLTPEVPDASDLERPQLIDSRSRSMSCESQDELSSVPVTPLDNGEIDETLGFGEVTRNGSGKKPPSEMIKPVWLPDNISNECLMEGCSTEFNIINRRHHCRDCGWLICKFCKGQAPLSKYDFTKQNVCSECFDRHYKAYKDGVLFPSKNMIVQSDETILVKIGKRNDKEIVDPRKLFKAPVNYGFRHRNVEEKRAQSIVFGRVYLRSRKTETVRHALLRRDDLKLVFYKAELDSKSVLELLIYGYFYRETPLDDGWLFELVHRNQIRTDDTKDDVISFRVDNSASAKKWSAAFADKLELDPTRG
					

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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	32.3	Very low	33.6	Very low	248 Å²	248	142.2 Å²	142.2	100%	1.222	80%	0.803	S	S	*	*				0	146.9	0	-72.9	175.8	167.4	0	0	107.9
2	G	30.6	Very low	33.4	Very low	69 Å²	69	142.9 Å²	142.9	71%	0.711	81%	0.813	S	S	*	*			trans	73.8	108.4	-179.1	0	0	0	0	0	112.5
3	F	29.2	Very low	33	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.842	81%	0.81	S	S	*	*				67	115.4	52.5	-77.8	-115.3	0	0	0	113.5
4	V	30.9	Very low	33	Very low	118 Å²	118	137.7 Å²	137.7	72%	0.715	81%	0.813	S	S	*	*				92.3	141.8	55.8	146.8	0	0	0	0	110.9
5	P	59	Low	33.9	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	81%	0.811	S	S	*	*			cis	-151.4	-147.4	-14.9	41.6	-18.9	0	0	0	115.7
6	R	30.5	Very low	33.6	Very low	215 Å²	215	133.8 Å²	133.8	81%	0.811	80%	0.8	S	S	*	*			trans	89.6	119.7	160.5	-84.1	179.5	158.7	157	-4.5	116.8
7	M	33.9	Very low	33.2	Very low	148 Å²	148	136.6 Å²	136.6	73%	0.729	80%	0.803	S	S	*	*				79.2	144.6	68.6	-78.3	-174.1	154.2	0	0	112.5
8	Q	30.8	Very low	33	Very low	165 Å²	165	141.9 Å²	141.9	77%	0.771	81%	0.807	S	S	*	*			cis	-158	-170.7	21.5	-125.3	158	16.3	0	0	109
9	N	33.2	Very low	34	Very low	158 Å²	158	139.6 Å²	139.6	85%	0.845	80%	0.798	S	S	*	*				-165.2	159.7	-70.4	-172.7	29	0	0	0	110.6
10	G	28.6	Very low	33.8	Very low	72 Å²	72	140.5 Å²	140.5	74%	0.742	80%	0.799	S	S	*	*			trans	87.4	151.2	171	0	0	0	0	0	115.2
11	G	30.8	Very low	33.4	Very low	73 Å²	73	139 Å²	139	75%	0.753	80%	0.797	S	S	*	*			cis	170	164	-2.7	0	0	0	0	0	108.8
12	T	31.3	Very low	33.2	Very low	151 Å²	151	135.6 Å²	135.6	93%	0.926	78%	0.778	S	S	*	*			cis	-152.3	162.7	3.1	49	0	0	0	0	110
13	G	27.5	Very low	33	Very low	75 Å²	75	138.6 Å²	138.6	77%	0.773	78%	0.782	S	S	*	*			trans	145	119.7	171.6	0	0	0	0	0	114.1
14	T	33.1	Very low	32.8	Very low	138 Å²	138	134 Å²	134	85%	0.847	77%	0.774	S	S	*	*			trans	-144.3	171.1	-171.9	51	0	0	0	0	110.7
15	P	47.3	Very low	32.6	Very low	122 Å²	122	133.9 Å²	133.9	79%	0.792	77%	0.774	S	S	*	*			cis	-113.7	-151	-1.9	45.6	-33.1	0	0	0	110.9
16	S	28.2	Very low	31.1	Very low	91 Å²	91	136 Å²	136	64%	0.636	78%	0.779	S	S	*	*			cis	-151.4	143.1	1.1	41.1	0	0	0	0	114
17	E	27.7	Very low	30.9	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	77%	0.765	S	S	*	*				23.1	98.4	124	-49.7	-177.4	162.2	0	0	117.3
18	R	28.3	Very low	30.6	Very low	231 Å²	231	130.8 Å²	130.8	87%	0.872	77%	0.77	S	S	*	*			cis	51.6	151.8	30.6	-82.8	-162.2	-175.9	-162.5	4.6	114.9
19	P	52.4	Low	30.5	Very low	98 Å²	98	128.7 Å²	128.7	64%	0.636	77%	0.768	S	S	*	*			cis	-149.7	172.2	-27.2	41.5	-23	0	0	0	117.2
20	I	29.9	Very low	30.2	Very low	158 Å²	158	125.3 Å²	125.3	81%	0.81	76%	0.757	S	S	*	*			trans	38.4	119.1	137.5	-56.5	161.6	0	0	0	121.6
21	S	26.6	Very low	30.2	Very low	108 Å²	108	129 Å²	129	76%	0.755	76%	0.759	S	S	*	*				177.7	128.4	124.9	31	0	0	0	0	109.9
22	Q	27.1	Very low	30.1	Very low	178 Å²	178	133.7 Å²	133.7	83%	0.832	76%	0.762	S	S	*	*				65.7	148.9	89.5	-68	-161.5	-16.4	0	0	117.3
23	V	25.8	Very low	30.1	Very low	131 Å²	131	135 Å²	135	79%	0.794	76%	0.755	S	S	*	*			trans	77.5	141.2	166.7	-173.7	0	0	0	0	116.2
24	S	25.9	Very low	30.2	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	75%	0.751	S	S	*	*			cis	-175.2	174	-28.7	-89	0	0	0	0	110.3
25	T	27	Very low	30.3	Very low	116 Å²	116	139.6 Å²	139.6	71%	0.712	75%	0.751	S	S	*	*			trans	74.9	124	140.7	153.5	0	0	0	0	121.4
26	L	26.2	Very low	29.4	Very low	151 Å²	151	137.4 Å²	137.4	79%	0.791	75%	0.751	S	S	*	*			trans	47.2	154.3	139	-77.9	88.5	0	0	0	121.5
27	S	26.7	Very low	29.8	Very low	75 Å²	75	140.7 Å²	140.7	52%	0.524	76%	0.761	S	S	.	*			cis	-177.9	160.8	-16.1	54.2	0	0	0	0	110.9
28	Q	28.6	Very low	30	Very low	178 Å²	178	138.4 Å²	138.4	83%	0.832	76%	0.76	S	S	*	*			trans	67.8	167.4	166.9	-58.9	163.8	-21	0	0	113.7
29	V	27.6	Very low	30.2	Very low	121 Å²	121	133 Å²	133	73%	0.733	76%	0.757	S	S	*	*			cis	-143.3	163.2	14.1	-152.7	0	0	0	0	110.3
30	S	27.2	Very low	29.4	Very low	87 Å²	87	132.9 Å²	132.9	61%	0.608	76%	0.764	S	S	*	*			trans	63.2	124.6	157	44.8	0	0	0	0	118.9
31	D	28.3	Very low	29.5	Very low	148 Å²	148	130 Å²	130	79%	0.791	76%	0.758	S	S	*	*				75	144.5	77	-47.9	-42.8	0	0	0	111.1
32	E	28.9	Very low	29.7	Very low	173 Å²	173	131.3 Å²	131.3	81%	0.808	76%	0.757	S	S	*	*			cis	-154.8	-169.9	18.4	-148.4	158	-151.1	0	0	111.8
33	F	31	Very low	29.9	Very low	178 Å²	178	130.7 Å²	130.7	78%	0.781	75%	0.754	S	S	*	*			trans	-46.9	170.6	175.4	-75.4	-122.1	0	0	0	116.8
34	D	31.3	Very low	30	Very low	128 Å²	128	131.7 Å²	131.7	68%	0.684	75%	0.75	S	S	*	*			cis	-157.6	-171.9	7.8	-142	-13.9	0	0	0	115.3
35	E	34.5	Very low	30.2	Very low	181 Å²	181	131.4 Å²	131.4	85%	0.846	75%	0.748	S	S	*	*			trans	-21.2	159.4	163.8	-72.9	-175.6	175.6	0	0	121.8
36	G	28.8	Very low	30.2	Very low	77 Å²	77	134.7 Å²	134.7	79%	0.794	76%	0.757	S	S	*	*			trans	173.7	75.3	165.3	0	0	0	0	0	115.9
37	D	35.5	Very low	30.4	Very low	160 Å²	160	134.3 Å²	134.3	86%	0.856	76%	0.756	S	S	*	*			trans	-95.1	143	177.5	-165.9	14.2	0	0	0	112.5
38	T	31.5	Very low	30.4	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	77%	0.766	S	S	*	*			trans	-153.8	153.6	175.9	34.4	0	0	0	0	113
39	S	32.8	Very low	30.5	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	76%	0.761	S	S	*	*			trans	-142.9	162.9	-159.5	57.5	0	0	0	0	115.5
40	A	35.5	Very low	30.6	Very low	96 Å²	96	137.1 Å²	137.1	79%	0.793	76%	0.762	S	S	*	*			trans	66.9	157.4	164.6	0	0	0	0	0	117.5
41	S	31.9	Very low	30.5	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	77%	0.772	S	S	*	*			cis	-159.2	-151.7	-15.8	47.1	0	0	0	0	108.5
42	D	32.4	Very low	30.4	Very low	136 Å²	136	142.4 Å²	142.4	73%	0.727	78%	0.776	S	S	*	*			cis	-166.2	-171.9	4.9	-137	-49.8	0	0	0	112.8
43	E	30.9	Very low	30.3	Very low	164 Å²	164	144.8 Å²	144.8	77%	0.766	78%	0.778	S	S	*	*			trans	88.2	138.1	143.6	-89.3	-178.2	-172.3	0	0	125.9
44	E	28.2	Very low	30	Very low	152 Å²	152	147 Å²	147	71%	0.71	78%	0.781	S	S	*	*			trans	72.4	114.5	141.2	-73.4	-91.8	125.2	0	0	125
45	S	28.8	Very low	29.8	Very low	90 Å²	90	149.8 Å²	149.8	63%	0.629	79%	0.79	S	S	*	*				47.1	156.2	114.5	103.6	0	0	0	0	122.5
46	M	28.4	Very low	29.3	Very low	185 Å²	185	149.8 Å²	149.8	91%	0.911	78%	0.782	S	S	*	*			cis	-149.8	-144.8	-9.9	-138.3	175.4	83.2	0	0	112.9
47	N	29.1	Very low	29.2	Very low	144 Å²	144	154.2 Å²	154.2	77%	0.77	78%	0.782	S	S	*	*			trans	-126.3	179.7	-152.6	-168	14.4	0	0	0	115.8
48	S	27.9	Very low	28.8	Very low	105 Å²	105	152 Å²	152	73%	0.734	77%	0.766	S	S	*	*			trans	99.3	152.6	165.3	79.2	0	0	0	0	118.8
49	E	30.5	Very low	28.6	Very low	154 Å²	154	152.9 Å²	152.9	72%	0.72	77%	0.766	S	S	*	*			cis	-169	171.2	-38.3	-151	-157.3	156.5	0	0	111.7
50	K	28.5	Very low	28.2	Very low	173 Å²	173	154.4 Å²	154.4	75%	0.752	77%	0.765	S	S	*	*			trans	91.4	150.7	154.7	-69.7	-172.8	174.3	72.9	0	122.7
51	H	26.7	Very low	27.8	Very low	179 Å²	179	158.6 Å²	158.6	83%	0.829	77%	0.766	S	S	*	*			trans	-87.8	162.8	-173.2	-75.9	-76.4	0	0	0	115
52	L	25.3	Very low	27.5	Very low	167 Å²	167	160.1 Å²	160.1	87%	0.874	77%	0.766	S	S	*	*				-155.7	-164.8	108.9	-130.1	78.5	0	0	0	114.2
53	R	26	Very low	27.2	Very low	224 Å²	224	161.8 Å²	161.8	85%	0.845	77%	0.77	S	S	*	*			trans	-114.3	155.9	-154.8	-70.1	173.9	166.8	173.9	-3.7	115.1
54	R	26.1	Very low	27.1	Very low	223 Å²	223	161.4 Å²	161.4	84%	0.842	77%	0.772	S	S	*	*			trans	18.6	136.3	141.5	-62	178.1	174.9	173.6	-2.7	118.6
55	H	25.8	Very low	27.2	Very low	188 Å²	188	160 Å²	160	87%	0.87	78%	0.776	S	S	*	*				-154.7	179.9	102.2	-122.3	-99.9	0	0	0	113.6
56	R	24.8	Very low	27.1	Very low	180 Å²	180	163.2 Å²	163.2	68%	0.679	79%	0.785	S	S	*	*			trans	-115.2	149.9	-171.6	-179.7	-151.5	-61.1	-173.6	0.2	109.6	E58	R56-E58 WeakPolarHBondContact CD-OE2 3.41Å; R56-E58 IonicContact NH1-OE1 3.77Å
57	H	26.6	Very low	27.2	Very low	170 Å²	170	159.6 Å²	159.6	79%	0.787	78%	0.776	S	S	*	*			trans	-150.7	150.5	140.7	-121.1	-79.9	0	0	0	112.2
58	E	26.3	Very low	27	Very low	113 Å²	113	162 Å²	162	53%	0.528	78%	0.78	S	S	.	*			trans	-86	162.8	170.5	-66.8	96	159.5	0	0	112.3	R56	R56-E58 WeakPolarHBondContact CD-OE2 3.41Å; R56-E58 IonicContact NH1-OE1 3.77Å
59	D	27.2	Very low	27	Very low	153 Å²	153	165.1 Å²	165.1	82%	0.818	79%	0.788	S	S	*	*				169.2	156.4	120.1	-79.7	-21.5	0	0	0	113.3
60	D	26	Very low	26.7	Very low	149 Å²	149	165.1 Å²	165.1	80%	0.797	79%	0.788	S	S	*	*			trans	-89.1	160.1	-175.8	-66.7	-62.3	0	0	0	114.1
61	F	25.9	Very low	26.7	Very low	184 Å²	184	168.5 Å²	168.5	81%	0.807	80%	0.796	S	S	*	*				172.9	132.2	117.9	-110	-103.7	0	0	0	115.3
62	D	25.9	Very low	26.8	Very low	129 Å²	129	168.3 Å²	168.3	69%	0.69	79%	0.793	S	S	*	*			trans	46	142.9	142.9	-69.8	-7.1	0	0	0	128.6
63	E	25.9	Very low	26.8	Very low	172 Å²	172	166.7 Å²	166.7	80%	0.804	79%	0.79	S	S	*	*			trans	53.7	106.2	148.4	-61.5	-158.8	122	0	0	124.8
64	L	29.6	Very low	26.9	Very low	155 Å²	155	162.2 Å²	162.2	81%	0.812	79%	0.787	S	S	*	*				17.9	142.1	125.4	-66.4	174.4	0	0	0	120.3
65	P	29.7	Very low	27	Very low	124 Å²	124	158.2 Å²	158.2	81%	0.805	79%	0.788	S	S	*	*			cis	-146.4	-177.4	49	39.7	-18.8	0	0	0	118.9
66	L	27.4	Very low	27.2	Very low	156 Å²	156	155.9 Å²	155.9	82%	0.817	79%	0.787	S	S	*	*			trans	-50.5	159.1	175.8	-68.7	169.6	0	0	0	115.1
67	P	29.2	Very low	27.6	Very low	110 Å²	110	152 Å²	152	71%	0.714	79%	0.793	S	S	*	*			cis	-151.3	169	39.7	42.8	-22.2	0	0	0	120.8
68	K	26.6	Very low	28	Very low	195 Å²	195	146.4 Å²	146.4	85%	0.848	78%	0.776	S	S	*	*			trans	40.6	113.3	148	-66.3	174.7	-178.9	177.4	0	119.9
69	N	25.9	Very low	29.1	Very low	170 Å²	170	143.5 Å²	143.5	91%	0.909	77%	0.767	S	S	*	*				-156.9	145.6	112.3	-127.4	-24.8	0	0	0	112.9
70	E	25.8	Very low	30	Very low	154 Å²	154	138.2 Å²	138.2	72%	0.72	74%	0.737	S	S	*	*			trans	-85	135.4	175.6	-67	-171.1	172	0	0	111.4
71	R	27.8	Very low	30.9	Very low	243 Å²	243	132.9 Å²	132.9	92%	0.917	71%	0.711	S	S	*	*			trans	-130.5	111.3	154.1	-85.9	-171.6	169.3	179.9	-2.9	109.7
72	K	29.1	Very low	31.9	Very low	175 Å²	175	129 Å²	129	76%	0.761	70%	0.696	S	S	*	*			trans	-73.9	126.4	175	-65.6	172	-177.6	170.4	0	109.5
73	T	25.4	Very low	33.2	Very low	133 Å²	133	124.4 Å²	124.4	82%	0.816	67%	0.671	S	S	*	*			trans	-117.6	109.6	165.2	39.8	0	0	0	0	108.8
74	T	27.7	Very low	34.8	Very low	130 Å²	130	117.5 Å²	117.5	80%	0.798	64%	0.639	S	S	*	*			trans	-100.8	102	-172.7	46.3	0	0	0	0	112.1
75	T	28.8	Very low	36.3	Very low	139 Å²	139	114 Å²	114	85%	0.853	62%	0.621	S	S	*	*			trans	-149.9	107.2	160.4	30.7	0	0	0	0	110.3
76	V	29.6	Very low	37.6	Very low	139 Å²	139	113 Å²	113	84%	0.842	61%	0.606	S	S	*	*			trans	-133.3	125.5	170.5	-178.6	0	0	0	0	108.5	A78	V76-A78 PolarHBondContact O-N 3.49Å
77	A	32.6	Very low	39.1	Very low	99 Å²	99	105.6 Å²	105.6	82%	0.818	57%	0.567	S	S	*	*			trans	-88.5	102.2	172.2	0	0	0	0	0	109.1
78	A	35.9	Very low	40.7	Very low	52 Å²	52	104.6 Å²	104.6	43%	0.43	55%	0.552	S	S	.	*			trans	-66.4	138.9	179.4	0	0	0	0	0	111.9	V76 E82 I83	V76-A78 PolarHBondContact O-N 3.49Å; A78-E82 HydrophobicContact CB-CB 4.42Å; A78-I83 HydrophobicContact CB-CG1 4.25Å
79	T	49.7	Very low	42.3	Very low	53 Å²	53	101.6 Å²	101.6	33%	0.325	54%	0.541	S	S	.	.			trans	-80.6	160.6	172.2	65.7	0	0	0	0	111.5	S81 E82 I83	T79-S81 PolarHBondContact O-N 3.34Å; T79-S81 VanDerWaalsContact O-N 3.17Å; T79-E82 VanDerWaalsContact CB-OE2 3.25Å; T79-E82 WeakPolarHBondContact CB-OE2 3.38Å; T79-E82 WeakPolarHBondContact CG2-OE2 3.46Å; T79-E82 PolarHBondContact N-OE2 3.24Å; T79-E82 PolarHBondContact O-N 3.07Å; T79-E82 VanDerWaalsContact OG1-CD 3.26Å; T79-E82 PolarHBondContact OG1-N 3.25Å; T79-E82 PolarHBondContact OG1-OE2 3.19Å; T79-I83 PolarHBondContact O-N 3.09Å
80	H	45.2	Very low	43.7	Very low	41 Å²	41	97.6 Å²	97.6	19%	0.19	52%	0.519	C	S	.	.	H	α-helix	trans	-53.8	-35.3	176.3	-176.4	-84.9	0	0	0	113	I83 M84 Q255	H80-I83 WeakPolarHBondContact O-CB 3.33Å; H80-I83 PolarHBondContact O-N 3.13Å; H80-M84 VanDerWaalsContact O-CG 3.28Å; H80-M84 WeakPolarHBondContact O-CG 3.3Å; H80-M84 PolarHBondContact O-N 3.02Å; H80-Q255 PolarHBondContact NE2-O 2.66Å
81	S	44.5	Very low	44.9	Very low	37 Å²	37	93.1 Å²	93.1	26%	0.259	50%	0.497	S	S	.	.	H	α-helix	trans	-72.3	-32.1	176	-170.4	0	0	0	0	113.5	T79 N85	T79-S81 PolarHBondContact O-N 3.34Å; T79-S81 VanDerWaalsContact O-N 3.17Å; S81-N85 WeakPolarHBondContact O-CB 3.29Å; S81-N85 PolarHBondContact O-N 2.9Å; S81-N85 PolarHBondContact O-ND2 2.88Å; S81-N85 PolarHBondContact O-OD1 2.89Å
82	E	48.3	Very low	45.7	Very low	104 Å²	104	87.3 Å²	87.3	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-72.2	-40.6	174.3	-72.9	151	154.7	0	0	110.1	A78 T79 N85 E86	A78-E82 HydrophobicContact CB-CB 4.42Å; T79-E82 VanDerWaalsContact CB-OE2 3.25Å; T79-E82 WeakPolarHBondContact CB-OE2 3.38Å; T79-E82 WeakPolarHBondContact CG2-OE2 3.46Å; T79-E82 PolarHBondContact N-OE2 3.24Å; T79-E82 PolarHBondContact O-N 3.07Å; T79-E82 VanDerWaalsContact OG1-CD 3.26Å; T79-E82 PolarHBondContact OG1-N 3.25Å; T79-E82 PolarHBondContact OG1-OE2 3.19Å; E82-N85 PolarHBondContact O-N 2.86Å; E82-E86 VanDerWaalsContact O-CB 3.25Å; E82-E86 WeakPolarHBondContact O-CB 3.22Å; E82-E86 PolarHBondContact O-N 3Å
83	I	51.5	Low	46	Very low	32 Å²	32	89.7 Å²	89.7	16%	0.164	49%	0.493	C	S	.	.	H	α-helix	trans	-54	-53.8	170.6	-79.8	167	0	0	0	111.6	A78 T79 H80 N85 E86 M87 I259 F291	A78-I83 HydrophobicContact CB-CG1 4.25Å; T79-I83 PolarHBondContact O-N 3.09Å; H80-I83 WeakPolarHBondContact O-CB 3.33Å; H80-I83 PolarHBondContact O-N 3.13Å; I83-N85 VanDerWaalsContact C-N 3.35Å; I83-N85 PolarHBondContact O-N 3.09Å; I83-E86 PolarHBondContact O-N 3.22Å; I83-M87 HydrophobicContact CG2-SD 3.91Å; I83-M87 WeakPolarHBondContact O-CB 3.29Å; I83-M87 WeakPolarHBondContact O-CG 3.43Å; I83-M87 PolarHBondContact O-N 2.86Å; I83-I259 HydrophobicContact CG2-CD1 4.41Å; I83-F291 HydrophobicContact CB-CD1 4.14Å; I83-F291 HydrophobicContact CB-CE1 4.34Å; I83-F291 HydrophobicContact CG1-CD1 3.99Å; I83-F291 HydrophobicContact CG1-CE1 4.16Å; I83-F291 HydrophobicContact CG2-CB 4.42Å; I83-F291 HydrophobicContact CG2-CD1 3.47Å; I83-F291 VanDerWaalsContact CG2-CD1 3.47Å; I83-F291 HydrophobicContact CG2-CE1 4.06Å; I83-F291 HydrophobicContact CG2-CG 4.22Å
84	M	59.4	Low	46.2	Very low	26 Å²	26	86.5 Å²	86.5	13%	0.128	49%	0.486	C	S	.	.	H	α-helix	trans	-62.3	-41.2	-179.2	-68.1	-66.9	-65.1	0	0	112	H80 M87 E88 P258 I259 M262	H80-M84 VanDerWaalsContact O-CG 3.28Å; H80-M84 WeakPolarHBondContact O-CG 3.3Å; H80-M84 PolarHBondContact O-N 3.02Å; M84-M87 PolarHBondContact O-N 2.93Å; M84-M87 HydrophobicContact SD-SD 4.5Å; M84-E88 PolarHBondContact O-N 3.17Å; M84-P258 HydrophobicContact CE-CB 4.11Å; M84-I259 HydrophobicContact SD-CD1 4.2Å; M84-I259 HydrophobicContact SD-CG1 3.47Å; M84-I259 WeakPolarHBondContact SD-CG1 3.43Å; M84-M262 HydrophobicContact CE-SD 3.43Å; M84-M262 WeakPolarHBondContact CE-SD 3.23Å; M84-M262 HydrophobicContact SD-SD 4.26Å
85	N	62.6	Low	46.3	Very low	82 Å²	82	83.5 Å²	83.5	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-68	-38.6	177.6	-68.2	-13	0	0	0	112.3	S81 E82 I83 E88 H89	S81-N85 WeakPolarHBondContact O-CB 3.29Å; S81-N85 PolarHBondContact O-N 2.9Å; S81-N85 PolarHBondContact O-ND2 2.88Å; S81-N85 PolarHBondContact O-OD1 2.89Å; E82-N85 PolarHBondContact O-N 2.86Å; I83-N85 VanDerWaalsContact C-N 3.35Å; I83-N85 PolarHBondContact O-N 3.09Å; N85-E88 PolarHBondContact O-N 3.28Å; N85-H89 WeakPolarHBondContact O-CB 3.39Å; N85-H89 PolarHBondContact O-CD2 2.84Å; N85-H89 PolarHBondContact O-N 2.84Å
86	E	57.3	Low	46.3	Very low	104 Å²	104	86.3 Å²	86.3	49%	0.486	48%	0.482	S	S	.	.	H	α-helix	trans	-64.4	-44	175.6	-177.5	169.5	-150.9	0	0	110.9	E82 I83 H89 L90 F291	E82-E86 VanDerWaalsContact O-CB 3.25Å; E82-E86 WeakPolarHBondContact O-CB 3.22Å; E82-E86 PolarHBondContact O-N 3Å; I83-E86 PolarHBondContact O-N 3.22Å; E86-H89 PolarHBondContact O-N 3.46Å; E86-L90 HydrophobicContact CG-CD1 4.08Å; E86-L90 HydrophobicContact CG-CG 4.44Å; E86-L90 WeakPolarHBondContact O-CB 3.42Å; E86-L90 VanDerWaalsContact O-CG 3.27Å; E86-L90 WeakPolarHBondContact O-CG 3.19Å; E86-L90 PolarHBondContact O-N 3.06Å; E86-F291 HydrophobicContact CG-CZ 4.31Å
87	M	58.9	Low	46.3	Very low	0 Å²	0	89.1 Å²	89.1	0%	0	48%	0.483	C	S	.	.	H	α-helix	trans	-57	-50.8	173.1	-69.8	171.7	73.9	0	0	111.9	I83 M84 H89 L90 F91 I259 M262 F288 F291	I83-M87 HydrophobicContact CG2-SD 3.91Å; I83-M87 WeakPolarHBondContact O-CB 3.29Å; I83-M87 WeakPolarHBondContact O-CG 3.43Å; I83-M87 PolarHBondContact O-N 2.86Å; M84-M87 PolarHBondContact O-N 2.93Å; M84-M87 HydrophobicContact SD-SD 4.5Å; M87-H89 VanDerWaalsContact C-N 3.32Å; M87-H89 PolarHBondContact O-N 2.78Å; M87-L90 PolarHBondContact O-N 2.83Å; M87-F91 VanDerWaalsContact O-CD2 3.26Å; M87-F91 WeakPolarHBondContact O-CD2 3.47Å; M87-F91 PolarHBondContact O-N 3.1Å; M87-I259 HydrophobicContact CE-CG2 4.21Å; M87-I259 HydrophobicContact SD-CG1 4.47Å; M87-M262 HydrophobicContact CB-CE 4.07Å; M87-M262 HydrophobicContact CE-CE 4.49Å; M87-M262 HydrophobicContact CE-SD 4.47Å; M87-F288 HydrophobicContact CE-CD1 3.42Å; M87-F288 VanDerWaalsContact CE-CD1 3.42Å; M87-F288 HydrophobicContact CE-CE1 3.11Å; M87-F288 HydrophobicContact CE-CG 4.43Å; M87-F288 HydrophobicContact CE-CZ 3.92Å; M87-F291 HydrophobicContact CE-CB 4.4Å; M87-F291 HydrophobicContact CE-CD2 4.14Å; M87-F291 HydrophobicContact CE-CG 4.38Å; M87-F291 HydrophobicContact CG-CD1 4.04Å; M87-F291 HydrophobicContact CG-CD2 3.46Å; M87-F291 VanDerWaalsContact CG-CD2 3.46Å; M87-F291 HydrophobicContact CG-CE1 3.93Å; M87-F291 HydrophobicContact CG-CE2 3.37Å; M87-F291 HydrophobicContact CG-CG 3.8Å; M87-F291 HydrophobicContact CG-CZ 3.6Å; M87-F291 HydrophobicContact SD-CB 3.89Å; M87-F291 HydrophobicContact SD-CD1 4.02Å; M87-F291 HydrophobicContact SD-CD2 3.75Å; M87-F291 HydrophobicContact SD-CE1 4.49Å; M87-F291 HydrophobicContact SD-CE2 4.28Å; M87-F291 HydrophobicContact SD-CG 3.6Å; M87-F291 VanDerWaalsContact SD-CG 3.6Å
88	E	61	Low	46.1	Very low	88 Å²	88	91.7 Å²	91.7	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-60.3	-39.9	177.1	-72.4	-169.7	178.6	0	0	112.3	M84 N85 V92 M262	M84-E88 PolarHBondContact O-N 3.17Å; N85-E88 PolarHBondContact O-N 3.28Å; E88-V92 VanDerWaalsContact O-CG2 3.26Å; E88-V92 WeakPolarHBondContact O-CG2 3.4Å; E88-V92 PolarHBondContact O-N 3.39Å; E88-M262 HydrophobicContact CG-CE 3.9Å
89	H	61.6	Low	45.6	Very low	132 Å²	132	97.2 Å²	97.2	61%	0.611	51%	0.505	S	S	*	.	H	α-helix	trans	-70.6	-32.1	178.3	-78.9	-46.8	0	0	0	114.5	N85 E86 M87	N85-H89 WeakPolarHBondContact O-CB 3.39Å; N85-H89 PolarHBondContact O-CD2 2.84Å; N85-H89 PolarHBondContact O-N 2.84Å; E86-H89 PolarHBondContact O-N 3.46Å; M87-H89 VanDerWaalsContact C-N 3.32Å; M87-H89 PolarHBondContact O-N 2.78Å
90	L	54.2	Low	44.5	Very low	86 Å²	86	98.4 Å²	98.4	45%	0.45	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-46.8	178.6	-77.7	166.7	0	0	0	111.7	E86 M87 T287 F291	E86-L90 HydrophobicContact CG-CD1 4.08Å; E86-L90 HydrophobicContact CG-CG 4.44Å; E86-L90 WeakPolarHBondContact O-CB 3.42Å; E86-L90 VanDerWaalsContact O-CG 3.27Å; E86-L90 WeakPolarHBondContact O-CG 3.19Å; E86-L90 PolarHBondContact O-N 3.06Å; M87-L90 PolarHBondContact O-N 2.83Å; L90-T287 HydrophobicContact CD1-CG2 4.21Å; L90-F291 HydrophobicContact CD1-CE2 4.25Å; L90-F291 HydrophobicContact CD1-CZ 4.2Å
91	F	50.9	Low	43.5	Very low	60 Å²	60	102.5 Å²	102.5	26%	0.263	56%	0.555	S	S	.	*	H	α-helix	trans	-74.7	-26.6	-177.8	-68.4	-73	0	0	0	113.6	M87 R93 E266 T287 F288	M87-F91 VanDerWaalsContact O-CD2 3.26Å; M87-F91 WeakPolarHBondContact O-CD2 3.47Å; M87-F91 PolarHBondContact O-N 3.1Å; F91-R93 VanDerWaalsContact C-N 3.3Å; F91-R93 PolarHBondContact O-N 2.97Å; F91-E266 HydrophobicContact CD1-CG 4.49Å; F91-E266 HydrophobicContact CE1-CG 4.43Å; F91-T287 HydrophobicContact CE1-CG2 4.35Å; F91-T287 HydrophobicContact CE2-CG2 3.92Å; F91-T287 HydrophobicContact CZ-CG2 3.54Å; F91-F288 HydrophobicContact CE1-CE2 4.43Å; F91-F288 HydrophobicContact CE2-CD2 4.24Å; F91-F288 AromaticContact CE2-CE2 3.51Å; F91-F288 HydrophobicContact CE2-CE2 3.51Å; F91-F288 AromaticContact CE2-CZ 3.98Å; F91-F288 HydrophobicContact CE2-CZ 3.98Å; F91-F288 AromaticContact CZ-CD2 3.89Å; F91-F288 HydrophobicContact CZ-CD2 3.89Å; F91-F288 AromaticContact CZ-CE2 3.38Å; F91-F288 HydrophobicContact CZ-CE2 3.38Å; F91-F288 HydrophobicContact CZ-CZ 4.28Å
92	V	45.3	Very low	42.6	Very low	122 Å²	122	109.9 Å²	109.9	74%	0.739	59%	0.585	S	S	*	*	H	α-helix	trans	-69	-23.2	177.7	167.6	0	0	0	0	113.4	E88 G94	E88-V92 VanDerWaalsContact O-CG2 3.26Å; E88-V92 WeakPolarHBondContact O-CG2 3.4Å; E88-V92 PolarHBondContact O-N 3.39Å; V92-G94 PolarHBondContact O-N 3.03Å
93	R	34.7	Very low	41.5	Very low	225 Å²	225	114 Å²	114	85%	0.849	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-5.4	-177.6	-79.3	-178.2	168.2	170.9	-1.7	115.3	F91 G95	F91-R93 VanDerWaalsContact C-N 3.3Å; F91-R93 PolarHBondContact O-N 2.97Å; R93-G95 PolarHBondContact O-N 3.45Å
94	G	31.1	Very low	40.3	Very low	65 Å²	65	120.9 Å²	120.9	67%	0.67	63%	0.633	S	S	*	*			trans	-77.3	-7.2	-164.7	0	0	0	0	0	118.8	V92	V92-G94 PolarHBondContact O-N 3.03Å
95	G	29.3	Very low	38.7	Very low	67 Å²	67	127.7 Å²	127.7	69%	0.691	66%	0.664	S	S	*	*			trans	-129.2	83	-163.6	0	0	0	0	0	117.1	R93	R93-G95 PolarHBondContact O-N 3.45Å
96	K	29.1	Very low	36.8	Very low	199 Å²	199	133.7 Å²	133.7	87%	0.865	68%	0.681	S	S	*	*			trans	-151.2	130.7	160.5	-76.1	-161.3	175.7	179.7	0	113.6
97	K	30.4	Very low	35.2	Very low	198 Å²	198	140.7 Å²	140.7	86%	0.861	70%	0.703	S	S	*	*			trans	70.2	144.1	172.7	-55.3	-175.7	177.5	-175.6	0	114.2
98	N	26.6	Very low	33.6	Very low	152 Å²	152	147 Å²	147	81%	0.813	73%	0.732	S	S	*	*			cis	-119.3	152.8	24.7	-76.7	-35.2	0	0	0	115.3
99	N	27.3	Very low	31.9	Very low	169 Å²	169	147.7 Å²	147.7	90%	0.904	75%	0.747	S	S	*	*			trans	-93.6	127	158.8	-79.7	3.2	0	0	0	109
100	G	24.5	Very low	30	Very low	77 Å²	77	147.6 Å²	147.6	79%	0.794	75%	0.751	S	S	*	*			trans	-128.7	118	167.5	0	0	0	0	0	109.4
101	V	25.6	Very low	28.6	Very low	128 Å²	128	149.9 Å²	149.9	78%	0.776	76%	0.762	S	S	*	*			trans	-95	121.9	-177.1	176.6	0	0	0	0	109.8
102	H	25.5	Very low	27.4	Very low	192 Å²	192	153.4 Å²	153.4	89%	0.889	78%	0.784	S	S	*	*			trans	-130.7	125	160.4	-97.6	-89.3	0	0	0	111
103	K	25.8	Very low	26.4	Very low	189 Å²	189	156.5 Å²	156.5	82%	0.822	79%	0.79	S	S	*	*			trans	-93	128.1	166.5	-74.8	178.7	174.1	177.7	0	108.6
104	Q	25.6	Very low	26	Very low	177 Å²	177	153.6 Å²	153.6	83%	0.827	79%	0.79	S	S	*	*			trans	166.4	149.5	148.6	-97.4	167.1	-4.7	0	0	108.6
105	Q	25.1	Very low	26	Very low	170 Å²	170	155.6 Å²	155.6	79%	0.794	79%	0.791	S	S	*	*			cis	-152.3	148.5	-23.4	-150.3	167.7	-2.2	0	0	109.1	R107	Q105-R107 PolarHBondContact O-N 2.98Å
106	R	23.2	Very low	25.8	Very low	207 Å²	207	157.1 Å²	157.1	78%	0.781	79%	0.791	S	S	*	*			trans	-69.5	117.3	178.7	179.4	-180	176.8	-175.4	-1.2	110.8	Q108	R106-Q108 VanDerWaalsContact CZ-OE1 3.29Å
107	R	24.8	Very low	25.7	Very low	251 Å²	251	155.3 Å²	155.3	95%	0.947	79%	0.791	S	S	*	*			trans	-120.5	149.3	152.6	-96.9	-172.7	168.5	-172.1	-4.1	109.4	Q105	Q105-R107 PolarHBondContact O-N 2.98Å
108	Q	23.7	Very low	25.5	Very low	133 Å²	133	153.2 Å²	153.2	62%	0.621	79%	0.794	S	S	*	*			trans	-157.2	163.7	-164.4	-169.2	164.9	9.3	0	0	107.5	R106	R106-Q108 VanDerWaalsContact CZ-OE1 3.29Å
109	S	25.3	Very low	25.6	Very low	102 Å²	102	149 Å²	149	71%	0.713	79%	0.787	S	S	*	*			trans	77.5	144.5	-177.5	84.3	0	0	0	0	115.3
110	N	23	Very low	25.5	Very low	130 Å²	130	150.2 Å²	150.2	70%	0.695	78%	0.784	S	S	*	*			cis	-173.7	154.5	-12.8	-110.6	6.1	0	0	0	109.4
111	I	24	Very low	25.5	Very low	135 Å²	135	154 Å²	154	69%	0.692	79%	0.785	S	S	*	*			trans	64.9	142	139.9	-74.3	171.2	0	0	0	117.9
112	D	25.4	Very low	25.5	Very low	134 Å²	134	158.3 Å²	158.3	72%	0.717	79%	0.788	S	S	*	*			cis	-160.7	-169.6	-6.6	-114.3	-17.7	0	0	0	110.6
113	E	24.3	Very low	25.6	Very low	186 Å²	186	154.7 Å²	154.7	87%	0.869	78%	0.775	S	S	*	*			trans	84.2	119.1	155.4	-79.8	173.8	-161.4	0	0	121.2
114	I	26.2	Very low	25.6	Very low	165 Å²	165	153.7 Å²	153.7	85%	0.846	78%	0.779	S	S	*	*			trans	-135.4	128.7	164.9	-72.6	172.1	0	0	0	103.4
115	P	30.7	Very low	25.6	Very low	106 Å²	106	154.3 Å²	154.3	69%	0.688	77%	0.774	S	S	*	*				-160.1	160.6	96.5	42	-21.7	0	0	0	120.2
116	S	25.6	Very low	25.9	Very low	99 Å²	99	156.3 Å²	156.3	69%	0.692	78%	0.78	S	S	*	*			trans	58.9	123.3	139.1	64.9	0	0	0	0	123.3
117	D	28.1	Very low	26	Very low	161 Å²	161	149.7 Å²	149.7	86%	0.861	78%	0.776	S	S	*	*			trans	42.6	101.3	140.9	-76.9	-3.5	0	0	0	121.1
118	V	26.2	Very low	26	Very low	154 Å²	154	148.7 Å²	148.7	93%	0.933	77%	0.772	S	S	*	*			trans	-133.5	86.1	148.8	-172.2	0	0	0	0	110.9
119	G	27.3	Very low	26.1	Very low	65 Å²	65	150.5 Å²	150.5	67%	0.67	78%	0.78	S	S	*	*			trans	-98.6	111.5	170.3	0	0	0	0	0	112.7
120	K	25.7	Very low	26.1	Very low	193 Å²	193	153.6 Å²	153.6	84%	0.839	79%	0.789	S	S	*	*			trans	178.6	138.2	152.8	-99.8	144.3	-163	168.1	0	113.6
121	L	23.8	Very low	26.3	Very low	156 Å²	156	152 Å²	152	82%	0.817	79%	0.788	S	S	*	*			trans	68.2	138.9	152.8	-64.3	169.9	0	0	0	117.2
122	R	26	Very low	26.4	Very low	219 Å²	219	152 Å²	152	83%	0.826	79%	0.788	S	S	*	*			cis	-157.4	164.9	-3.1	-164.7	171.8	-178.2	170.4	-0.3	110.7
123	D	27	Very low	26.3	Very low	116 Å²	116	154.1 Å²	154.1	62%	0.62	79%	0.792	S	S	*	*			trans	-48.2	155.2	175.8	-47.3	-92.6	0	0	0	115.3	R125	D123-R125 HydrophobicContact CB-CG 4.34Å
124	N	25.7	Very low	26.3	Very low	169 Å²	169	151.2 Å²	151.2	90%	0.904	79%	0.786	S	S	*	*				-132.2	143.9	125.5	-148.3	-13.9	0	0	0	111.5
125	R	27.6	Very low	26.2	Very low	190 Å²	190	148.9 Å²	148.9	72%	0.717	78%	0.784	S	S	*	*			trans	-109.3	141.6	-163.6	-58.4	166.5	172.5	173.3	-6.7	111.9	D123	D123-R125 HydrophobicContact CB-CG 4.34Å
126	K	29.9	Very low	26.1	Very low	212 Å²	212	149 Å²	149	92%	0.922	79%	0.785	S	S	*	*				167.6	140.3	113.6	-86.9	150.1	-170.4	171.2	0	111.7
127	G	24.8	Very low	26	Very low	68 Å²	68	150.1 Å²	150.1	70%	0.701	79%	0.788	S	S	*	*			cis	169.2	174.2	-10.7	0	0	0	0	0	115.9
128	R	25.5	Very low	25.9	Very low	229 Å²	229	148.2 Å²	148.2	86%	0.864	79%	0.787	S	S	*	*			trans	53.6	99.7	165.4	-68.1	-179.6	172.8	168.8	-4.1	115.5
129	H	26.8	Very low	25.7	Very low	172 Å²	172	144.7 Å²	144.7	80%	0.796	78%	0.782	S	S	*	*				47.3	132.4	61.9	-58	-96	0	0	0	115.1
130	N	25.1	Very low	25.6	Very low	166 Å²	166	150.3 Å²	150.3	89%	0.888	79%	0.793	S	S	*	*				-149.1	144.8	110.8	-103	0	0	0	0	111.3
131	S	27.1	Very low	25.5	Very low	98 Å²	98	146.3 Å²	146.3	69%	0.685	79%	0.79	S	S	*	*			trans	-157.1	-177.6	172.8	-174.7	0	0	0	0	106.5
132	L	25.1	Very low	25.5	Very low	134 Å²	134	144.7 Å²	144.7	70%	0.702	79%	0.792	S	S	*	*			trans	71.4	147.7	-178.5	-42.6	-174	0	0	0	113.5
133	F	23.3	Very low	25.7	Very low	179 Å²	179	139.7 Å²	139.7	79%	0.785	79%	0.79	S	S	*	*			cis	-141.5	-169.9	-23.2	-98.9	-53.5	0	0	0	104.5
134	V	24.3	Very low	25.9	Very low	124 Å²	124	139.8 Å²	139.8	75%	0.752	80%	0.8	S	S	*	*			cis	-166.9	162.9	40	172.9	0	0	0	0	107.1
135	S	24.4	Very low	26	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	80%	0.798	S	S	*	*			trans	-127	148.8	163	-52.6	0	0	0	0	111.1
136	P	28.8	Very low	26.1	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	80%	0.797	S	S	*	*			trans	-141.9	161.5	146.2	36.8	-21.7	0	0	0	116.1
137	T	23.2	Very low	26	Very low	123 Å²	123	131 Å²	131	76%	0.755	78%	0.783	S	S	*	*			trans	64.5	99.3	151.7	46.4	0	0	0	0	121.7
138	S	25.6	Very low	26.2	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	78%	0.783	S	S	*	*				48.3	112.1	125.9	60.5	0	0	0	0	121.4
139	G	23.1	Very low	26.4	Very low	80 Å²	80	128.2 Å²	128.2	83%	0.825	77%	0.767	S	S	*	*			trans	-164.8	132.7	161.3	0	0	0	0	0	110.6
140	M	24.2	Very low	26.5	Very low	183 Å²	183	128.1 Å²	128.1	90%	0.901	76%	0.76	S	S	*	*			trans	-74.2	149	-162	-64.5	168.9	65.6	0	0	116.4
141	S	23.8	Very low	26.8	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	74%	0.736	S	S	*	*			trans	95.2	154.2	139	81.6	0	0	0	0	122.2
142	S	25.1	Very low	26.9	Very low	123 Å²	123	124.1 Å²	124.1	86%	0.86	73%	0.734	S	S	*	*			trans	72.9	136.4	176.5	76.7	0	0	0	0	117.7
143	S	30.1	Very low	27.1	Very low	113 Å²	113	121.8 Å²	121.8	79%	0.79	73%	0.729	S	S	*	*			trans	-119.8	125.4	-168.6	54.3	0	0	0	0	112.5
144	S	30.3	Very low	27.3	Very low	119 Å²	119	120.1 Å²	120.1	83%	0.832	73%	0.725	S	S	*	*			trans	-174	58.3	163.4	46.3	0	0	0	0	114.5
145	T	27.8	Very low	27.6	Very low	140 Å²	140	117.8 Å²	117.8	86%	0.859	71%	0.711	S	S	*	*			trans	-130.5	47.3	-177	56.3	0	0	0	0	115.5
146	D	29.5	Very low	27.7	Very low	131 Å²	131	116.6 Å²	116.6	70%	0.701	70%	0.703	S	S	*	*	S	Bend	trans	-114.2	-8.2	172.3	-107.2	-37.9	0	0	0	114.7	S149	D146-S149 PolarHBondContact O-OG 3.09Å
147	D	29.1	Very low	27.7	Very low	116 Å²	116	115 Å²	115	62%	0.62	69%	0.688	S	S	*	*	S	Bend	trans	-79	-24.9	-177.2	-106.5	-19	0	0	0	113.8	S149 R150 I151	D147-S149 VanDerWaalsContact C-N 3.34Å; D147-S149 PolarHBondContact O-N 2.85Å; D147-R150 PolarHBondContact O-N 2.84Å; D147-I151 PolarHBondContact O-N 2.72Å
148	F	28.5	Very low	28.2	Very low	162 Å²	162	117 Å²	117	71%	0.711	68%	0.682	S	S	*	*	H	α-helix	trans	-74.1	-21.8	-167.9	-120.9	-84.6	0	0	0	114.3
149	S	28.6	Very low	28.5	Very low	75 Å²	75	114.3 Å²	114.3	52%	0.524	66%	0.663	S	S	.	*	H	α-helix	trans	-78.8	-29.3	174.5	56.7	0	0	0	0	112.7	D146 D147 T152 S153	D146-S149 PolarHBondContact O-OG 3.09Å; D147-S149 VanDerWaalsContact C-N 3.34Å; D147-S149 PolarHBondContact O-N 2.85Å; S149-T152 PolarHBondContact O-OG1 3.45Å; S149-S153 PolarHBondContact O-N 3.4Å
150	R	30	Very low	28.9	Very low	171 Å²	171	113.5 Å²	113.5	65%	0.645	65%	0.645	S	S	*	*	H	α-helix	trans	-75	-38	-179.9	-63.7	-177.4	179.4	-172	0.1	112.2	D147 T152 S153 M154	D147-R150 PolarHBondContact O-N 2.84Å; R150-T152 VanDerWaalsContact C-N 3.31Å; R150-T152 PolarHBondContact O-N 3.14Å; R150-S153 PolarHBondContact O-N 3.11Å; R150-M154 WeakPolarHBondContact O-CG 3.32Å; R150-M154 PolarHBondContact O-N 3.09Å; R150-M154 VanDerWaalsContact O-N 3.11Å
151	I	31.5	Very low	29.2	Very low	77 Å²	77	109.7 Å²	109.7	40%	0.395	63%	0.627	S	S	.	*	H	α-helix	trans	-63.1	-35.3	-176.9	-64.9	171.6	0	0	0	112.2	D147	D147-I151 PolarHBondContact O-N 2.72Å
152	T	29.3	Very low	29.6	Very low	103 Å²	103	108.8 Å²	108.8	63%	0.632	61%	0.613	S	S	*	*	H	α-helix	trans	-82	-29.8	174.9	44.7	0	0	0	0	113.2	S149 R150 M154 T155	S149-T152 PolarHBondContact O-OG1 3.45Å; R150-T152 VanDerWaalsContact C-N 3.31Å; R150-T152 PolarHBondContact O-N 3.14Å; T152-M154 VanDerWaalsContact C-N 3.31Å; T152-M154 PolarHBondContact O-N 3.45Å; T152-T155 PolarHBondContact O-OG1 2.97Å
153	S	28.6	Very low	30.2	Very low	85 Å²	85	105.7 Å²	105.7	59%	0.594	59%	0.589	S	S	*	*	H	α-helix	trans	-65.6	-32	174.7	-174.3	0	0	0	0	112.9	S149 R150 T155 S156	S149-S153 PolarHBondContact O-N 3.4Å; R150-S153 PolarHBondContact O-N 3.11Å; S153-T155 PolarHBondContact O-N 3.08Å; S153-S156 PolarHBondContact O-OG 2.96Å
154	M	28	Very low	30.2	Very low	143 Å²	143	104.2 Å²	104.2	70%	0.704	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	7.9	-175.5	-69.8	-130.5	68	0	0	116.3	R150 T152	R150-M154 WeakPolarHBondContact O-CG 3.32Å; R150-M154 PolarHBondContact O-N 3.09Å; R150-M154 VanDerWaalsContact O-N 3.11Å; T152-M154 VanDerWaalsContact C-N 3.31Å; T152-M154 PolarHBondContact O-N 3.45Å
155	T	29.9	Very low	29.9	Very low	76 Å²	76	107.6 Å²	107.6	47%	0.466	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.2	19.2	-176.1	58.3	0	0	0	0	114.8	T152 S153 D157	T152-T155 PolarHBondContact O-OG1 2.97Å; S153-T155 PolarHBondContact O-N 3.08Å; T155-D157 VanDerWaalsContact C-N 3.29Å; T155-D157 PolarHBondContact O-N 2.78Å; T155-D157 VanDerWaalsContact O-N 3.1Å
156	S	27	Very low	30.3	Very low	91 Å²	91	106.6 Å²	106.6	64%	0.636	58%	0.58	S	S	*	*			trans	-84.4	56.2	-179.9	49.5	0	0	0	0	113.5	S153 R158	S153-S156 PolarHBondContact O-OG 2.96Å; S156-R158 VanDerWaalsContact C-N 3.3Å; S156-R158 PolarHBondContact O-N 2.82Å
157	D	28.9	Very low	30.5	Very low	75 Å²	75	104.5 Å²	104.5	40%	0.401	59%	0.589	S	S	.	*			trans	-69.1	78.2	177.3	-59.1	-54	0	0	0	111.9	T155 S159	T155-D157 VanDerWaalsContact C-N 3.29Å; T155-D157 PolarHBondContact O-N 2.78Å; T155-D157 VanDerWaalsContact O-N 3.1Å; D157-S159 PolarHBondContact O-N 3.06Å
158	R	32.9	Very low	30.4	Very low	165 Å²	165	102.7 Å²	102.7	62%	0.623	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	44.1	177.1	-68	-179.7	93.4	168.4	2.4	113.4	S156 D170	S156-R158 VanDerWaalsContact C-N 3.3Å; S156-R158 PolarHBondContact O-N 2.82Å; R158-D170 IonicContact NH1-OD2 2.82Å; R158-D170 IonicContact NH2-OD2 3.82Å
159	S	32.7	Very low	30.7	Very low	64 Å²	64	104.9 Å²	104.9	45%	0.448	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.4	-33	157.4	62.3	0	0	0	0	111	D157 I161	D157-S159 PolarHBondContact O-N 3.06Å; S159-I161 PolarHBondContact O-N 3.17Å
160	S	32.3	Very low	30.7	Very low	63 Å²	63	106.5 Å²	106.5	44%	0.441	61%	0.613	S	S	.	*			trans	-84.1	92.5	168.3	57.5	0	0	0	0	111.1	Q410	S160-Q410 WeakPolarHBondContact CB-O 3.3Å
161	I	30.4	Very low	30.9	Very low	102 Å²	102	103.9 Å²	103.9	52%	0.523	62%	0.621	S	S	.	*			trans	-90	108.2	166.8	-63.3	-178.3	0	0	0	108.1	S159	S159-I161 PolarHBondContact O-N 3.17Å
162	L	31.1	Very low	31	Very low	90 Å²	90	104.7 Å²	104.7	47%	0.471	63%	0.629	S	S	.	*			trans	-93.9	126.6	176.2	-120.4	175.1	0	0	0	110	S164 Q410	L162-S164 PolarHBondContact O-N 3.1Å; L162-Q410 HydrophobicContact CD1-CB 4.33Å; L162-Q410 HydrophobicContact CD1-CG 4.03Å; L162-Q410 HydrophobicContact CD2-CG 3.93Å; L162-Q410 HydrophobicContact CG-CB 4.42Å; L162-Q410 HydrophobicContact CG-CG 3.9Å
163	T	37.8	Very low	31.2	Very low	58 Å²	58	108.1 Å²	108.1	36%	0.356	64%	0.644	S	S	.	*			trans	-85.7	82.5	177.2	52	0	0	0	0	111.2	Y197	T163-Y197 HydrophobicContact CG2-CD2 3.54Å; T163-Y197 HydrophobicContact CG2-CE2 3.7Å; T163-Y197 HydrophobicContact CG2-CG 4.04Å
164	S	29.2	Very low	31.7	Very low	82 Å²	82	108 Å²	108	57%	0.573	66%	0.657	S	S	*	*			trans	-167	98.5	158.9	58.2	0	0	0	0	112.4	L162	L162-S164 PolarHBondContact O-N 3.1Å
165	H	25.5	Very low	32.3	Very low	191 Å²	191	104.7 Å²	104.7	88%	0.884	65%	0.651	S	S	*	*				-172.1	149.5	117.4	-93.2	-62.1	0	0	0	109.3
166	S	36.4	Very low	33.2	Very low	119 Å²	119	105.2 Å²	105.2	83%	0.832	66%	0.658	S	S	*	*			trans	-88.3	146.4	-178.4	35.9	0	0	0	0	111.9
167	G	33.2	Very low	34.8	Very low	86 Å²	86	106.6 Å²	106.6	89%	0.887	67%	0.665	S	S	*	*			trans	85.4	95.8	175	0	0	0	0	0	114.1
168	G	26.2	Very low	36.7	Very low	78 Å²	78	105 Å²	105	80%	0.804	66%	0.658	S	S	*	*			trans	159.8	110.2	173.3	0	0	0	0	0	112.3	D170	G168-D170 PolarHBondContact O-N 3.17Å
169	E	36.1	Very low	38.6	Very low	209 Å²	209	99.7 Å²	99.7	98%	0.977	65%	0.645	S	S	*	*			trans	-76.6	110.9	170.1	-62.1	176	137.7	0	0	109
170	D	27.7	Very low	40.6	Very low	108 Å²	108	101.1 Å²	101.1	58%	0.578	65%	0.648	S	S	*	*			trans	-131.9	104.9	170.5	-176.8	33.8	0	0	0	108.4	R158 G168 T172	R158-D170 IonicContact NH1-OD2 2.82Å; R158-D170 IonicContact NH2-OD2 3.82Å; G168-D170 PolarHBondContact O-N 3.17Å; D170-T172 PolarHBondContact O-N 3.45Å
171	S	35.3	Very low	42.7	Very low	117 Å²	117	98.6 Å²	98.6	82%	0.818	63%	0.629	S	S	*	*			trans	-70.1	119.3	-172.2	49.2	0	0	0	0	111.5
172	T	33.4	Very low	44.9	Very low	93 Å²	93	101.6 Å²	101.6	57%	0.571	64%	0.64	S	S	*	*			trans	-119.7	124	174	44.4	0	0	0	0	110.9	D170 G174	D170-T172 PolarHBondContact O-N 3.45Å; T172-G174 PolarHBondContact O-N 3.19Å
173	D	33.7	Very low	47.1	Very low	176 Å²	176	100.3 Å²	100.3	94%	0.941	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	127.5	-168.7	-68.2	-57.2	0	0	0	114.1
174	G	37.1	Very low	48.8	Very low	83 Å²	83	101.3 Å²	101.3	86%	0.856	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.7	-4.8	157.6	0	0	0	0	0	117.4	T172	T172-G174 PolarHBondContact O-N 3.19Å
175	A	41.3	Very low	51.4	Low	72 Å²	72	101.2 Å²	101.2	60%	0.595	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-80.4	135.4	167.9	0	0	0	0	0	110.6
176	S	48.4	Very low	54	Low	87 Å²	87	99.7 Å²	99.7	61%	0.608	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-62	144.1	163	-62.5	0	0	0	0	109.2	V178	S176-V178 PolarHBondContact O-N 3.39Å
177	P	61.3	Low	56.1	Low	121 Å²	121	101.8 Å²	101.8	79%	0.786	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-54.3	127.1	170.2	-23.6	33.8	0	0	0	109.5	P179	P177-P179 WeakPolarHBondContact O-CD 3.17Å
178	V	69.4	Low	58.5	Low	41 Å²	41	100.1 Å²	100.1	25%	0.248	61%	0.609	C	S	.	*	P	Polyproline II helix	trans	-64.7	122	174.9	-179.3	0	0	0	0	106.9	S176 Y181 K193 H196 Y197	S176-V178 PolarHBondContact O-N 3.39Å; V178-Y181 HydrophobicContact CG1-CE2 4.35Å; V178-K193 HydrophobicContact CG1-CB 4.46Å; V178-K193 HydrophobicContact CG1-CG 4.02Å; V178-H196 HydrophobicContact CG1-CB 4.11Å; V178-Y197 HydrophobicContact CG2-CE1 3.8Å; V178-Y197 HydrophobicContact CG2-CE2 4.49Å
179	P	72.6	Confident	61	Low	53 Å²	53	97.4 Å²	97.4	34%	0.344	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-55.6	145.8	179.6	-25.6	34.4	0	0	0	111.1	P177 Y181	P177-P179 WeakPolarHBondContact O-CD 3.17Å; P179-Y181 HydrophobicContact CB-CE1 4.26Å; P179-Y181 HydrophobicContact CB-CE2 4.36Å; P179-Y181 WeakPolarHBondContact O-CD2 3.3Å; P179-Y181 VanDerWaalsContact O-CE2 3.31Å; P179-Y181 WeakPolarHBondContact O-CE2 3.32Å
180	D	73.4	Confident	63.1	Low	95 Å²	95	92.1 Å²	92.1	51%	0.508	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-75.2	138.5	152.9	-137.1	-44.3	0	0	0	108.8	E182 K193	D180-E182 HydrophobicContact CB-CG 4.33Å; D180-K193 WeakPolarHBondContact OD1-CE 2.88Å; D180-K193 IonicContact OD1-NZ 2.87Å; D180-K193 PolarHBondContact OD1-NZ 3.43Å; D180-K193 IonicContact OD2-NZ 3.72Å; D180-K193 PolarHBondContact OD2-NZ 3.18Å
181	Y	76.5	Confident	65.9	Low	10 Å²	10	89.2 Å²	89.2	4%	0.039	53%	0.533	C	S	.	.			trans	-100.5	-16.7	-171.2	-71.9	-78.1	0	0	0	112.3	V178 P179 T183 D189 L192 K193 H196 S276 R277	V178-Y181 HydrophobicContact CG1-CE2 4.35Å; P179-Y181 HydrophobicContact CB-CE1 4.26Å; P179-Y181 HydrophobicContact CB-CE2 4.36Å; P179-Y181 WeakPolarHBondContact O-CD2 3.3Å; P179-Y181 VanDerWaalsContact O-CE2 3.31Å; P179-Y181 WeakPolarHBondContact O-CE2 3.32Å; Y181-T183 PolarHBondContact O-N 2.72Å; Y181-T183 VanDerWaalsContact O-N 3.08Å; Y181-D189 WeakPolarHBondContact CB-OD1 3.22Å; Y181-L192 HydrophobicContact CD1-CB 4.28Å; Y181-L192 HydrophobicContact CD1-CD1 4.09Å; Y181-L192 HydrophobicContact CD2-CB 3.61Å; Y181-L192 HydrophobicContact CD2-CD1 4.47Å; Y181-L192 HydrophobicContact CE2-CB 3.97Å; Y181-L192 HydrophobicContact CG-CB 3.8Å; Y181-L192 HydrophobicContact CG-CD1 3.82Å; Y181-L192 HydrophobicContact CG-CG 4.45Å; Y181-K193 HydrophobicContact CD2-CG 3.99Å; Y181-K193 HydrophobicContact CE2-CG 4.08Å; Y181-H196 PolarHBondContact OH-ND1 3.05Å; Y181-H196 VanDerWaalsContact OH-ND1 3.1Å; Y181-S276 PolarHBondContact OH-OG 3.46Å; Y181-R277 HydrophobicContact CD1-CG 4.18Å
182	E	76.7	Confident	68.3	Low	165 Å²	165	83.8 Å²	83.8	77%	0.771	49%	0.494	S	S	*	.			trans	45.8	38.7	172.4	-59.9	-172.8	171.2	0	0	113.6	D180 G184 D189	D180-E182 HydrophobicContact CB-CG 4.33Å; E182-G184 PolarHBondContact O-N 3.15Å; E182-D189 PolarHBondContact N-OD1 3.26Å
183	T	77.8	Confident	70.6	Confident	62 Å²	62	82 Å²	82	38%	0.38	48%	0.479	S	S	.	.			trans	-70.4	-18.1	-175.5	56.2	0	0	0	0	113.9	Y181 D185 D189 L192	Y181-T183 PolarHBondContact O-N 2.72Å; Y181-T183 VanDerWaalsContact O-N 3.08Å; T183-D185 PolarHBondContact OG1-N 2.81Å; T183-D185 PolarHBondContact OG1-O 3.16Å; T183-D189 WeakPolarHBondContact CB-OD1 3.14Å; T183-D189 VanDerWaalsContact CG2-OD1 3.32Å; T183-D189 WeakPolarHBondContact CG2-OD1 3.22Å; T183-D189 PolarHBondContact N-OD1 3.15Å; T183-D189 VanDerWaalsContact OG1-CG 3.25Å; T183-D189 PolarHBondContact OG1-OD1 3.04Å; T183-L192 HydrophobicContact CG2-CD1 3.53Å
184	G	73.8	Confident	72.9	Confident	80 Å²	80	76.8 Å²	76.8	83%	0.825	45%	0.448	S	S	*	.	S	Bend	trans	88.7	-4.2	-174.3	0	0	0	0	0	114.6	E182	E182-G184 PolarHBondContact O-N 3.15Å
185	D	82.8	Confident	75.2	Confident	79 Å²	79	72.9 Å²	72.9	42%	0.422	41%	0.407	S	S	.	.			trans	-120	116.2	166.5	-174.7	-5.9	0	0	0	110	T183 K187 D188 D189	T183-D185 PolarHBondContact OG1-N 2.81Å; T183-D185 PolarHBondContact OG1-O 3.16Å; D185-K187 PolarHBondContact O-N 2.88Å; D185-K187 WeakPolarHBondContact OD1-CB 3.26Å; D185-K187 PolarHBondContact OD1-N 3.42Å; D185-D188 HydrophobicContact CB-CB 4.31Å; D185-D188 PolarHBondContact O-N 3.29Å; D185-D189 PolarHBondContact O-N 3.42Å
186	E	80.6	Confident	77.2	Confident	160 Å²	160	70.1 Å²	70.1	75%	0.748	38%	0.382	S	S	*	.	H	α-helix	trans	-51.7	-31.7	175.5	-171.3	-172	176.3	0	0	112.3	Q190	E186-Q190 VanDerWaalsContact O-CB 3.22Å; E186-Q190 WeakPolarHBondContact O-CB 3.47Å; E186-Q190 PolarHBondContact O-N 3.34Å
187	K	81.4	Confident	78.8	Confident	163 Å²	163	71 Å²	71	71%	0.709	37%	0.373	S	S	*	.	H	α-helix	trans	-71.8	-39.9	177.9	-62.3	171.4	-174.2	164.4	0	112.3	D185 Q190 R191	D185-K187 PolarHBondContact O-N 2.88Å; D185-K187 WeakPolarHBondContact OD1-CB 3.26Å; D185-K187 PolarHBondContact OD1-N 3.42Å; K187-Q190 PolarHBondContact O-N 3.37Å; K187-R191 PolarHBondContact O-N 2.93Å
188	D	83	Confident	79.7	Confident	50 Å²	50	65.3 Å²	65.3	27%	0.267	34%	0.336	S	S	.	.	H	α-helix	trans	-77	-40.4	-179	-152.3	64.1	0	0	0	110.8	D185 Q190 R191 L192	D185-D188 HydrophobicContact CB-CB 4.31Å; D185-D188 PolarHBondContact O-N 3.29Å; D188-Q190 VanDerWaalsContact C-N 3.25Å; D188-Q190 PolarHBondContact O-N 2.83Å; D188-R191 CarbonylContact O-C 3.56Å; D188-R191 WeakPolarHBondContact O-CA 3.35Å; D188-R191 WeakPolarHBondContact O-CB 3.39Å; D188-R191 PolarHBondContact O-N 2.97Å; D188-R191 IonicContact OD1-CZ 3.01Å; D188-R191 IonicContact OD1-NE 3.74Å; D188-R191 PolarHBondContact OD1-NE 3.11Å; D188-R191 IonicContact OD1-NH2 3.66Å; D188-R191 PolarHBondContact OD1-NH2 3.01Å; D188-R191 IonicContact OD2-CZ 2.68Å; D188-R191 IonicContact OD2-NH2 2.82Å; D188-R191 PolarHBondContact OD2-NH2 3.28Å; D188-L192 WeakPolarHBondContact O-CB 3.46Å; D188-L192 VanDerWaalsContact O-CG 3.32Å; D188-L192 WeakPolarHBondContact O-CG 3.48Å; D188-L192 PolarHBondContact O-N 3.31Å
189	D	79.1	Confident	80.5	Confident	21 Å²	21	63.4 Å²	63.4	11%	0.112	32%	0.324	C	S	.	.	H	α-helix	trans	-56.2	-41.7	169.1	-73.1	-18.9	0	0	0	111.1	Y181 E182 T183 D185 L192 K193	Y181-D189 WeakPolarHBondContact CB-OD1 3.22Å; E182-D189 PolarHBondContact N-OD1 3.26Å; T183-D189 WeakPolarHBondContact CB-OD1 3.14Å; T183-D189 VanDerWaalsContact CG2-OD1 3.32Å; T183-D189 WeakPolarHBondContact CG2-OD1 3.22Å; T183-D189 PolarHBondContact N-OD1 3.15Å; T183-D189 VanDerWaalsContact OG1-CG 3.25Å; T183-D189 PolarHBondContact OG1-OD1 3.04Å; D185-D189 PolarHBondContact O-N 3.42Å; D189-L192 PolarHBondContact O-N 2.95Å; D189-K193 VanDerWaalsContact O-CB 3.31Å; D189-K193 WeakPolarHBondContact O-CB 3.33Å; D189-K193 WeakPolarHBondContact O-CD 3.47Å; D189-K193 WeakPolarHBondContact O-CG 3.4Å; D189-K193 PolarHBondContact O-N 3.29Å
190	Q	79.6	Confident	81	Confident	99 Å²	99	63 Å²	63	46%	0.463	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-33	175.1	-162.9	-173.7	107.8	0	0	112.8	E186 K187 D188 K194	E186-Q190 VanDerWaalsContact O-CB 3.22Å; E186-Q190 WeakPolarHBondContact O-CB 3.47Å; E186-Q190 PolarHBondContact O-N 3.34Å; K187-Q190 PolarHBondContact O-N 3.37Å; D188-Q190 VanDerWaalsContact C-N 3.25Å; D188-Q190 PolarHBondContact O-N 2.83Å; Q190-K194 WeakPolarHBondContact O-CB 3.18Å; Q190-K194 WeakPolarHBondContact O-CD 3.29Å; Q190-K194 VanDerWaalsContact O-CG 3.24Å; Q190-K194 WeakPolarHBondContact O-CG 3.38Å; Q190-K194 PolarHBondContact O-N 2.94Å
191	R	87.6	Confident	81.4	Confident	46 Å²	46	60.6 Å²	60.6	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-67.9	-47.3	173.1	-175.4	-171.6	61.6	73.1	6.2	111.2	K187 D188 K193 K194 L195 Y363	K187-R191 PolarHBondContact O-N 2.93Å; D188-R191 CarbonylContact O-C 3.56Å; D188-R191 WeakPolarHBondContact O-CA 3.35Å; D188-R191 WeakPolarHBondContact O-CB 3.39Å; D188-R191 PolarHBondContact O-N 2.97Å; D188-R191 IonicContact OD1-CZ 3.01Å; D188-R191 IonicContact OD1-NE 3.74Å; D188-R191 PolarHBondContact OD1-NE 3.11Å; D188-R191 IonicContact OD1-NH2 3.66Å; D188-R191 PolarHBondContact OD1-NH2 3.01Å; D188-R191 IonicContact OD2-CZ 2.68Å; D188-R191 IonicContact OD2-NH2 2.82Å; D188-R191 PolarHBondContact OD2-NH2 3.28Å; R191-K193 VanDerWaalsContact C-N 3.34Å; R191-K193 PolarHBondContact O-N 3.48Å; R191-K194 WeakPolarHBondContact O-CB 3.48Å; R191-K194 PolarHBondContact O-N 3.19Å; R191-L195 WeakPolarHBondContact O-CB 3.37Å; R191-L195 PolarHBondContact O-N 2.89Å; R191-Y363 WeakPolarHBondContact CD-O 3.39Å; R191-Y363 WeakPolarHBondContact CG-O 3.35Å; R191-Y363 PolarHBondContact NH1-O 3.39Å
192	L	85.4	Confident	81.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-38.6	178.5	-68	172.2	0	0	0	112	Y181 T183 D188 D189 L195 H196 S276 R277	Y181-L192 HydrophobicContact CD1-CB 4.28Å; Y181-L192 HydrophobicContact CD1-CD1 4.09Å; Y181-L192 HydrophobicContact CD2-CB 3.61Å; Y181-L192 HydrophobicContact CD2-CD1 4.47Å; Y181-L192 HydrophobicContact CE2-CB 3.97Å; Y181-L192 HydrophobicContact CG-CB 3.8Å; Y181-L192 HydrophobicContact CG-CD1 3.82Å; Y181-L192 HydrophobicContact CG-CG 4.45Å; T183-L192 HydrophobicContact CG2-CD1 3.53Å; D188-L192 WeakPolarHBondContact O-CB 3.46Å; D188-L192 VanDerWaalsContact O-CG 3.32Å; D188-L192 WeakPolarHBondContact O-CG 3.48Å; D188-L192 PolarHBondContact O-N 3.31Å; D189-L192 PolarHBondContact O-N 2.95Å; L192-L195 PolarHBondContact O-N 2.87Å; L192-H196 PolarHBondContact O-N 3Å; L192-S276 WeakPolarHBondContact CD2-O 3.35Å; L192-S276 WeakPolarHBondContact O-CB 3.11Å; L192-S276 PolarHBondContact O-OG 3.46Å; L192-R277 HydrophobicContact CD1-CG 4.23Å; L192-R277 HydrophobicContact CD2-CG 4.39Å
193	K	80.4	Confident	82.4	Confident	55 Å²	55	54 Å²	54	24%	0.239	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-44.6	171.6	-72.1	163.8	-178.5	167.1	0	111.4	V178 D180 Y181 D189 R191 L195 H196 Y197	V178-K193 HydrophobicContact CG1-CB 4.46Å; V178-K193 HydrophobicContact CG1-CG 4.02Å; D180-K193 WeakPolarHBondContact OD1-CE 2.88Å; D180-K193 IonicContact OD1-NZ 2.87Å; D180-K193 PolarHBondContact OD1-NZ 3.43Å; D180-K193 IonicContact OD2-NZ 3.72Å; D180-K193 PolarHBondContact OD2-NZ 3.18Å; Y181-K193 HydrophobicContact CD2-CG 3.99Å; Y181-K193 HydrophobicContact CE2-CG 4.08Å; D189-K193 VanDerWaalsContact O-CB 3.31Å; D189-K193 WeakPolarHBondContact O-CB 3.33Å; D189-K193 WeakPolarHBondContact O-CD 3.47Å; D189-K193 WeakPolarHBondContact O-CG 3.4Å; D189-K193 PolarHBondContact O-N 3.29Å; R191-K193 VanDerWaalsContact C-N 3.34Å; R191-K193 PolarHBondContact O-N 3.48Å; K193-L195 PolarHBondContact O-N 3.19Å; K193-H196 WeakPolarHBondContact O-CB 2.97Å; K193-H196 PolarHBondContact O-N 2.96Å; K193-Y197 WeakPolarHBondContact O-CD2 3.44Å; K193-Y197 PolarHBondContact O-N 3.09Å; K193-Y197 VanDerWaalsContact O-N 3.09Å
194	K	82	Confident	82.6	Confident	68 Å²	68	55.4 Å²	55.4	30%	0.296	28%	0.278	S	S	.	.	H	α-helix	trans	-60.9	-41.4	173.4	-74.7	165.9	-173.1	162	0	112.8	Q190 R191 Y197 A198 Y363	Q190-K194 WeakPolarHBondContact O-CB 3.18Å; Q190-K194 WeakPolarHBondContact O-CD 3.29Å; Q190-K194 VanDerWaalsContact O-CG 3.24Å; Q190-K194 WeakPolarHBondContact O-CG 3.38Å; Q190-K194 PolarHBondContact O-N 2.94Å; R191-K194 WeakPolarHBondContact O-CB 3.48Å; R191-K194 PolarHBondContact O-N 3.19Å; K194-Y197 PolarHBondContact O-N 2.81Å; K194-A198 PolarHBondContact O-N 2.76Å; K194-Y363 HydrophobicContact CB-CD1 4.28Å; K194-Y363 HydrophobicContact CB-CD2 3.76Å; K194-Y363 HydrophobicContact CB-CE1 4.41Å; K194-Y363 HydrophobicContact CB-CE2 3.85Å; K194-Y363 HydrophobicContact CB-CG 4Å; K194-Y363 HydrophobicContact CD-CE1 4.34Å
195	L	85.9	Confident	83.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-40.6	176.7	-177.4	58.1	0	0	0	111.8	R191 L192 K193 A198 A199 W274 P279 Y360 L364	R191-L195 WeakPolarHBondContact O-CB 3.37Å; R191-L195 PolarHBondContact O-N 2.89Å; L192-L195 PolarHBondContact O-N 2.87Å; K193-L195 PolarHBondContact O-N 3.19Å; L195-A198 PolarHBondContact O-N 3.16Å; L195-A199 PolarHBondContact O-N 3.04Å; L195-W274 HydrophobicContact CG-CZ2 4.33Å; L195-P279 HydrophobicContact CD2-CB 4.13Å; L195-P279 HydrophobicContact CD2-CG 4.27Å; L195-Y360 HydrophobicContact CD1-CD2 3.61Å; L195-Y360 HydrophobicContact CD1-CE2 3.57Å; L195-Y360 HydrophobicContact CD1-CG 4.31Å; L195-L364 HydrophobicContact CD1-CD2 3.87Å; L195-L364 HydrophobicContact CD1-CG 4.47Å; L195-L364 HydrophobicContact CD2-CD2 3.95Å
196	H	84.1	Confident	83.5	Confident	14 Å²	14	48.7 Å²	48.7	7%	0.065	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-49.3	172.2	-167.9	120.5	0	0	0	111.2	V178 Y181 L192 K193 A198 A199 V200 W274 S276	V178-H196 HydrophobicContact CG1-CB 4.11Å; Y181-H196 PolarHBondContact OH-ND1 3.05Å; Y181-H196 VanDerWaalsContact OH-ND1 3.1Å; L192-H196 PolarHBondContact O-N 3Å; K193-H196 WeakPolarHBondContact O-CB 2.97Å; K193-H196 PolarHBondContact O-N 2.96Å; H196-A198 VanDerWaalsContact C-N 3.31Å; H196-A198 PolarHBondContact O-N 2.82Å; H196-A199 PolarHBondContact O-N 2.8Å; H196-V200 WeakPolarHBondContact O-CG2 3.47Å; H196-V200 PolarHBondContact O-N 3.01Å; H196-W274 AromaticContact CE1-CD1 3.91Å; H196-W274 AromaticContact CG-CD1 3.92Å; H196-W274 AromaticContact ND1-CD1 3.47Å; H196-S276 PolarHBondContact N-OG 3.33Å
197	Y	81.6	Confident	83.8	Confident	106 Å²	106	45.2 Å²	45.2	42%	0.416	21%	0.21	S	C	.	.	H	α-helix	trans	-61.7	-37.1	177.9	-70.8	-61.7	0	0	0	112.7	T163 V178 K193 K194 V200 E201	T163-Y197 HydrophobicContact CG2-CD2 3.54Å; T163-Y197 HydrophobicContact CG2-CE2 3.7Å; T163-Y197 HydrophobicContact CG2-CG 4.04Å; V178-Y197 HydrophobicContact CG2-CE1 3.8Å; V178-Y197 HydrophobicContact CG2-CE2 4.49Å; K193-Y197 WeakPolarHBondContact O-CD2 3.44Å; K193-Y197 PolarHBondContact O-N 3.09Å; K193-Y197 VanDerWaalsContact O-N 3.09Å; K194-Y197 PolarHBondContact O-N 2.81Å; Y197-V200 PolarHBondContact O-N 3.48Å; Y197-E201 WeakPolarHBondContact O-CB 3.4Å; Y197-E201 PolarHBondContact O-N 2.85Å
198	A	80.8	Confident	84	Confident	2 Å²	2	42 Å²	42	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-40.3	174.8	0	0	0	0	0	112.3	K194 L195 H196 E201 F202 Y360 Y363	K194-A198 PolarHBondContact O-N 2.76Å; L195-A198 PolarHBondContact O-N 3.16Å; H196-A198 VanDerWaalsContact C-N 3.31Å; H196-A198 PolarHBondContact O-N 2.82Å; A198-E201 WeakPolarHBondContact O-CB 3.13Å; A198-E201 PolarHBondContact O-N 2.93Å; A198-F202 WeakPolarHBondContact O-CD2 3.43Å; A198-Y360 HydrophobicContact CB-CD2 4.38Å; A198-Y363 HydrophobicContact CB-CD2 4.11Å; A198-Y363 HydrophobicContact CB-CE2 4.18Å
199	A	85.6	Confident	84.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-45.9	174.3	0	0	0	0	0	112	L195 H196 E201 F202 W274 M281	L195-A199 PolarHBondContact O-N 3.04Å; H196-A199 PolarHBondContact O-N 2.8Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 2.99Å; A199-F202 WeakPolarHBondContact O-CB 3.47Å; A199-F202 PolarHBondContact O-N 3.26Å; A199-W274 HydrophobicContact CB-CD2 3.86Å; A199-W274 HydrophobicContact CB-CE3 3.97Å; A199-W274 HydrophobicContact CB-CH2 3.81Å; A199-W274 HydrophobicContact CB-CZ2 3.67Å; A199-W274 HydrophobicContact CB-CZ3 3.95Å; A199-M281 HydrophobicContact CB-CE 4.16Å
200	V	83.4	Confident	84.8	Confident	46 Å²	46	38.9 Å²	38.9	28%	0.279	18%	0.184	S	C	.	.	H	α-helix	trans	-67	-26.6	177.4	174.3	0	0	0	0	112.4	H196 Y197 F202 L203 K204	H196-V200 WeakPolarHBondContact O-CG2 3.47Å; H196-V200 PolarHBondContact O-N 3.01Å; Y197-V200 PolarHBondContact O-N 3.48Å; V200-F202 VanDerWaalsContact C-N 3.33Å; V200-F202 PolarHBondContact O-N 3.15Å; V200-L203 PolarHBondContact O-N 2.88Å; V200-K204 PolarHBondContact O-N 3.29Å
201	E	81.9	Confident	85.3	Confident	44 Å²	44	37.8 Å²	37.8	21%	0.206	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-39.1	174.2	-165.2	175.6	-170.6	0	0	111.8	Y197 A198 A199 L203 K204 V205 L356 R359	Y197-E201 WeakPolarHBondContact O-CB 3.4Å; Y197-E201 PolarHBondContact O-N 2.85Å; A198-E201 WeakPolarHBondContact O-CB 3.13Å; A198-E201 PolarHBondContact O-N 2.93Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 2.99Å; E201-L203 PolarHBondContact O-N 3.4Å; E201-K204 PolarHBondContact O-N 2.99Å; E201-V205 HydrophobicContact CG-CG2 4.26Å; E201-V205 WeakPolarHBondContact O-CB 3.44Å; E201-V205 VanDerWaalsContact O-CG2 3.23Å; E201-V205 WeakPolarHBondContact O-CG2 3.46Å; E201-V205 PolarHBondContact O-N 3.28Å; E201-L356 HydrophobicContact CB-CD2 4.14Å; E201-L356 HydrophobicContact CG-CD2 3.56Å; E201-R359 IonicContact OE1-NH1 3.96Å; E201-R359 IonicContact OE2-CZ 2.66Å; E201-R359 IonicContact OE2-NH1 2.83Å; E201-R359 PolarHBondContact OE2-NH1 3.21Å
202	F	86.8	Confident	85.4	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-46.9	172.4	-75.1	-84.5	0	0	0	112	A198 A199 V200 V205 Q206 I267 M281 I285 L356 M357 Y360	A198-F202 WeakPolarHBondContact O-CD2 3.43Å; A199-F202 WeakPolarHBondContact O-CB 3.47Å; A199-F202 PolarHBondContact O-N 3.26Å; V200-F202 VanDerWaalsContact C-N 3.33Å; V200-F202 PolarHBondContact O-N 3.15Å; F202-V205 PolarHBondContact O-N 3.22Å; F202-Q206 WeakPolarHBondContact O-CB 3.33Å; F202-Q206 PolarHBondContact O-N 2.88Å; F202-I267 HydrophobicContact CB-CD1 4.35Å; F202-I267 HydrophobicContact CB-CG2 4.13Å; F202-M281 HydrophobicContact CB-CE 4.41Å; F202-M281 HydrophobicContact CD2-CE 4.49Å; F202-M281 HydrophobicContact CD2-CG 3.88Å; F202-M281 HydrophobicContact CD2-SD 4.44Å; F202-M281 HydrophobicContact CE2-CG 3.92Å; F202-M281 HydrophobicContact CG-CG 4.4Å; F202-M281 HydrophobicContact CG-SD 4.48Å; F202-M281 HydrophobicContact CZ-CG 4.47Å; F202-I285 HydrophobicContact CD1-CD1 3.66Å; F202-I285 HydrophobicContact CD1-CG1 4.03Å; F202-I285 HydrophobicContact CE1-CD1 3.82Å; F202-I285 HydrophobicContact CE1-CG1 3.7Å; F202-I285 HydrophobicContact CE1-CG2 4.39Å; F202-I285 HydrophobicContact CG-CD1 4.43Å; F202-I285 HydrophobicContact CZ-CG1 4.15Å; F202-L356 HydrophobicContact CD1-CB 3.94Å; F202-L356 HydrophobicContact CD1-CD1 3.72Å; F202-L356 HydrophobicContact CD1-CG 4.49Å; F202-L356 HydrophobicContact CD2-CB 4.41Å; F202-L356 HydrophobicContact CE1-CB 3.41Å; F202-L356 VanDerWaalsContact CE1-CB 3.41Å; F202-L356 HydrophobicContact CE1-CD1 4.01Å; F202-L356 HydrophobicContact CE1-CG 4.38Å; F202-L356 HydrophobicContact CE2-CB 3.95Å; F202-L356 HydrophobicContact CG-CB 4.41Å; F202-L356 HydrophobicContact CG-CD1 4.19Å; F202-L356 HydrophobicContact CZ-CB 3.43Å; F202-L356 VanDerWaalsContact CZ-CB 3.43Å; F202-M357 HydrophobicContact CE1-CE 4.36Å; F202-M357 HydrophobicContact CE2-CE 4.5Å; F202-M357 HydrophobicContact CZ-CB 4.26Å; F202-M357 HydrophobicContact CZ-CE 3.75Å; F202-M357 HydrophobicContact CZ-SD 4.5Å; F202-Y360 HydrophobicContact CE2-CG 4.47Å
203	L	87.1	Confident	85.6	Confident	34 Å²	34	35.7 Å²	35.7	18%	0.178	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-47.2	179.4	-179.5	57	0	0	0	111.3	V200 E201 V205 Q206 N207 L264 I267 D268 C271	V200-L203 PolarHBondContact O-N 2.88Å; E201-L203 PolarHBondContact O-N 3.4Å; L203-V205 PolarHBondContact O-N 3.19Å; L203-Q206 PolarHBondContact O-N 3Å; L203-N207 WeakPolarHBondContact O-CB 3.41Å; L203-N207 PolarHBondContact O-N 2.99Å; L203-L264 HydrophobicContact CD1-CD1 3.73Å; L203-I267 HydrophobicContact CB-CG2 3.81Å; L203-I267 HydrophobicContact CD1-CG2 4.16Å; L203-D268 HydrophobicContact CD1-CB 4Å; L203-C271 HydrophobicContact CD2-CB 3.86Å
204	K	81.8	Confident	86.1	Confident	91 Å²	91	36.3 Å²	36.3	40%	0.396	17%	0.174	S	C	.	.	H	α-helix	trans	-62.4	-43.5	178.4	-176	176.1	177.2	-176.4	0	111.9	V200 E201 N208	V200-K204 PolarHBondContact O-N 3.29Å; E201-K204 PolarHBondContact O-N 2.99Å; K204-N208 WeakPolarHBondContact O-CB 3.34Å; K204-N208 PolarHBondContact O-N 2.79Å; K204-N208 PolarHBondContact O-ND2 3.26Å
205	V	83.9	Confident	86.4	Confident	19 Å²	19	33.5 Å²	33.5	12%	0.115	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-46.4	178	166.6	0	0	0	0	111	E201 F202 L203 N208 Y209 R352 L356	E201-V205 HydrophobicContact CG-CG2 4.26Å; E201-V205 WeakPolarHBondContact O-CB 3.44Å; E201-V205 VanDerWaalsContact O-CG2 3.23Å; E201-V205 WeakPolarHBondContact O-CG2 3.46Å; E201-V205 PolarHBondContact O-N 3.28Å; F202-V205 PolarHBondContact O-N 3.22Å; L203-V205 PolarHBondContact O-N 3.19Å; V205-N208 PolarHBondContact O-N 2.94Å; V205-Y209 PolarHBondContact O-N 3.39Å; V205-R352 VanDerWaalsContact CG1-CD 3.45Å; V205-R352 HydrophobicContact CG1-CG 4.23Å; V205-L356 HydrophobicContact CB-CD1 4.17Å; V205-L356 HydrophobicContact CG1-CD1 4.14Å; V205-L356 HydrophobicContact CG2-CD1 4.14Å
206	Q	91	Very high	86.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.4	-40.6	-177.6	-173.4	66.1	7.8	0	0	112.4	F202 L203 Y209 V210 H260 L263 L264 I267 Y353	F202-Q206 WeakPolarHBondContact O-CB 3.33Å; F202-Q206 PolarHBondContact O-N 2.88Å; L203-Q206 PolarHBondContact O-N 3Å; Q206-Y209 PolarHBondContact O-N 2.91Å; Q206-V210 WeakPolarHBondContact O-CG2 3.49Å; Q206-V210 PolarHBondContact O-N 3.16Å; Q206-H260 PolarHBondContact NE2-ND1 3.05Å; Q206-H260 PolarHBondContact NE2-O 3.28Å; Q206-L263 HydrophobicContact CG-CG 4.37Å; Q206-L264 HydrophobicContact CB-CD1 4.11Å; Q206-L264 HydrophobicContact CG-CB 3.78Å; Q206-L264 HydrophobicContact CG-CD1 3.88Å; Q206-L264 HydrophobicContact CG-CG 4.4Å; Q206-I267 HydrophobicContact CB-CD1 4.08Å; Q206-I267 HydrophobicContact CG-CD1 4.08Å; Q206-Y353 PolarHBondContact OE1-OH 2.79Å
207	N	88.2	Confident	86.9	Confident	87 Å²	87	32.9 Å²	32.9	47%	0.465	16%	0.159	S	C	.	.	H	α-helix	trans	-62.1	-49.8	177	-171.6	-29	0	0	0	110.7	L203 Y209 V210 Q211 L264	L203-N207 WeakPolarHBondContact O-CB 3.41Å; L203-N207 PolarHBondContact O-N 2.99Å; N207-Y209 PolarHBondContact O-N 3.36Å; N207-V210 PolarHBondContact O-N 3.39Å; N207-Q211 WeakPolarHBondContact O-CB 3.41Å; N207-Q211 PolarHBondContact O-N 3.24Å; N207-L264 HydrophobicContact CB-CD1 4.01Å
208	N	83.9	Confident	87.2	Confident	95 Å²	95	30.5 Å²	30.5	51%	0.508	16%	0.155	S	C	.	.	H	α-helix	trans	-56.8	-37.3	173.5	-76.6	-49.6	0	0	0	112.6	K204 V205 Y212	K204-N208 WeakPolarHBondContact O-CB 3.34Å; K204-N208 PolarHBondContact O-N 2.79Å; K204-N208 PolarHBondContact O-ND2 3.26Å; V205-N208 PolarHBondContact O-N 2.94Å; N208-Y212 PolarHBondContact O-N 2.76Å
209	Y	89.8	Confident	87.6	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-70.8	-45.7	179	-170.2	-139.2	0	0	0	113.2	V205 Q206 N207 Q211 Y212 L213 H260 Q345 V346 N349	V205-Y209 PolarHBondContact O-N 3.39Å; Q206-Y209 PolarHBondContact O-N 2.91Å; N207-Y209 PolarHBondContact O-N 3.36Å; Y209-Q211 PolarHBondContact O-N 3.08Å; Y209-Y212 AromaticContact CD2-CD1 3.62Å; Y209-Y212 HydrophobicContact CD2-CD1 3.62Å; Y209-Y212 HydrophobicContact CD2-CE1 4.26Å; Y209-Y212 AromaticContact CE2-CD1 3.59Å; Y209-Y212 HydrophobicContact CE2-CD1 3.59Å; Y209-Y212 AromaticContact CE2-CE1 3.75Å; Y209-Y212 HydrophobicContact CE2-CE1 3.75Å; Y209-Y212 WeakPolarHBondContact O-CB 3.05Å; Y209-Y212 PolarHBondContact O-N 3.43Å; Y209-L213 HydrophobicContact CD1-CD1 4.06Å; Y209-L213 HydrophobicContact CD2-CD1 4.47Å; Y209-L213 HydrophobicContact CD2-CG 4.26Å; Y209-L213 HydrophobicContact CE1-CD1 3.74Å; Y209-L213 HydrophobicContact CE1-CG 4.4Å; Y209-L213 HydrophobicContact CE2-CD1 4.19Å; Y209-L213 HydrophobicContact CE2-CD2 4.11Å; Y209-L213 HydrophobicContact CE2-CG 3.96Å; Y209-L213 HydrophobicContact CG-CD1 4.4Å; Y209-L213 WeakPolarHBondContact O-CG 3.42Å; Y209-L213 PolarHBondContact O-N 2.82Å; Y209-H260 HydrophobicContact CD1-CB 4.39Å; Y209-H260 AromaticContact CD1-CG 3.92Å; Y209-H260 AromaticContact CD1-ND1 3.5Å; Y209-H260 WeakPolarHBondContact CD1-ND1 3.4Å; Y209-H260 HydrophobicContact CE1-CB 4.47Å; Y209-H260 AromaticContact CE1-CD2 3.96Å; Y209-H260 AromaticContact CE1-CE1 3.54Å; Y209-H260 AromaticContact CE1-CG 3.67Å; Y209-H260 AromaticContact CE1-ND1 3.39Å; Y209-H260 WeakPolarHBondContact CE1-ND1 3.36Å; Y209-H260 AromaticContact CE1-NE2 3.86Å; Y209-Q345 HydrophobicContact CD2-CG 4.15Å; Y209-Q345 HydrophobicContact CE2-CG 4.41Å; Y209-V346 HydrophobicContact CE2-CG2 4.41Å; Y209-V346 WeakPolarHBondContact OH-CA 3.17Å; Y209-V346 WeakPolarHBondContact OH-CG1 3.48Å; Y209-N349 WeakPolarHBondContact CB-ND2 3.46Å; Y209-N349 HydrophobicContact CD1-CB 4.2Å; Y209-N349 HydrophobicContact CD2-CB 4.04Å; Y209-N349 WeakPolarHBondContact CD2-ND2 3.25Å; Y209-N349 HydrophobicContact CE1-CB 4.36Å; Y209-N349 HydrophobicContact CE2-CB 4.2Å; Y209-N349 HydrophobicContact CG-CB 4.05Å
210	V	91.1	Very high	87.9	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-37.6	174.8	165.7	0	0	0	0	110.8	Q206 N207 L213 K214 L257 H260 E261 L264	Q206-V210 WeakPolarHBondContact O-CG2 3.49Å; Q206-V210 PolarHBondContact O-N 3.16Å; N207-V210 PolarHBondContact O-N 3.39Å; V210-L213 PolarHBondContact O-N 3.26Å; V210-K214 HydrophobicContact CG1-CD 4.31Å; V210-K214 WeakPolarHBondContact O-CG 3.3Å; V210-K214 PolarHBondContact O-N 2.71Å; V210-L257 HydrophobicContact CG1-CD1 4.08Å; V210-H260 HydrophobicContact CG2-CB 3.99Å; V210-H260 WeakPolarHBondContact CG2-O 3.15Å; V210-E261 HydrophobicContact CG1-CG 3.79Å; V210-E261 HydrophobicContact CG2-CG 4.4Å; V210-L264 HydrophobicContact CB-CD2 4.01Å; V210-L264 HydrophobicContact CG1-CD2 4.06Å; V210-L264 HydrophobicContact CG2-CB 4.16Å; V210-L264 HydrophobicContact CG2-CD2 3.98Å
211	Q	88.6	Confident	88.3	Confident	77 Å²	77	31.7 Å²	31.7	36%	0.36	16%	0.159	S	C	.	.	H	α-helix	trans	-66.3	-44.5	174.4	-179.4	55.5	28.8	0	0	112.4	N207 Y209 L213 K214 E215	N207-Q211 WeakPolarHBondContact O-CB 3.41Å; N207-Q211 PolarHBondContact O-N 3.24Å; Y209-Q211 PolarHBondContact O-N 3.08Å; Q211-L213 VanDerWaalsContact C-N 3.35Å; Q211-L213 PolarHBondContact O-N 2.88Å; Q211-K214 PolarHBondContact O-N 3.32Å; Q211-E215 WeakPolarHBondContact CG-OE1 3.32Å; Q211-E215 PolarHBondContact NE2-OE1 3.14Å; Q211-E215 WeakPolarHBondContact O-CG 3.47Å; Q211-E215 PolarHBondContact O-N 2.98Å
212	Y	89.6	Confident	88.7	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-57.9	-44.6	171.3	153.4	-93.2	0	0	0	112	N208 Y209 K214 E215 M216 M253 Q342 Q345 V346	N208-Y212 PolarHBondContact O-N 2.76Å; Y209-Y212 AromaticContact CD2-CD1 3.62Å; Y209-Y212 HydrophobicContact CD2-CD1 3.62Å; Y209-Y212 HydrophobicContact CD2-CE1 4.26Å; Y209-Y212 AromaticContact CE2-CD1 3.59Å; Y209-Y212 HydrophobicContact CE2-CD1 3.59Å; Y209-Y212 AromaticContact CE2-CE1 3.75Å; Y209-Y212 HydrophobicContact CE2-CE1 3.75Å; Y209-Y212 WeakPolarHBondContact O-CB 3.05Å; Y209-Y212 PolarHBondContact O-N 3.43Å; Y212-K214 VanDerWaalsContact C-N 3.28Å; Y212-K214 PolarHBondContact O-N 3.02Å; Y212-E215 PolarHBondContact O-N 3.12Å; Y212-M216 HydrophobicContact CD2-CG 3.89Å; Y212-M216 HydrophobicContact CE2-CB 4.39Å; Y212-M216 HydrophobicContact CE2-CG 3.29Å; Y212-M216 HydrophobicContact CE2-SD 4.39Å; Y212-M216 PolarHBondContact O-N 2.91Å; Y212-M253 VanDerWaalsContact OH-CE 3.24Å; Y212-M253 WeakPolarHBondContact OH-CE 3.28Å; Y212-Q342 HydrophobicContact CD2-CB 4.34Å; Y212-Q342 HydrophobicContact CE2-CB 3.93Å; Y212-Q342 WeakPolarHBondContact CE2-O 3.49Å; Y212-Q342 PolarHBondContact OH-O 2.92Å; Y212-Q345 HydrophobicContact CD1-CB 4.11Å; Y212-Q345 HydrophobicContact CD1-CG 3.78Å; Y212-Q345 HydrophobicContact CD2-CB 4.05Å; Y212-Q345 HydrophobicContact CD2-CG 4.06Å; Y212-Q345 HydrophobicContact CE1-CB 3.97Å; Y212-Q345 HydrophobicContact CE1-CG 4.14Å; Y212-Q345 HydrophobicContact CE2-CB 3.9Å; Y212-Q345 HydrophobicContact CE2-CG 4.4Å; Y212-Q345 HydrophobicContact CG-CB 4.16Å; Y212-Q345 HydrophobicContact CG-CG 3.75Å; Y212-V346 HydrophobicContact CE1-CG2 3.9Å
213	L	90.3	Very high	88.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-35.7	179.5	-73.5	172.4	0	0	0	111.5	Y209 V210 Q211 A217 M253 I256 L257 H260	Y209-L213 HydrophobicContact CD1-CD1 4.06Å; Y209-L213 HydrophobicContact CD2-CD1 4.47Å; Y209-L213 HydrophobicContact CD2-CG 4.26Å; Y209-L213 HydrophobicContact CE1-CD1 3.74Å; Y209-L213 HydrophobicContact CE1-CG 4.4Å; Y209-L213 HydrophobicContact CE2-CD1 4.19Å; Y209-L213 HydrophobicContact CE2-CD2 4.11Å; Y209-L213 HydrophobicContact CE2-CG 3.96Å; Y209-L213 HydrophobicContact CG-CD1 4.4Å; Y209-L213 WeakPolarHBondContact O-CG 3.42Å; Y209-L213 PolarHBondContact O-N 2.82Å; V210-L213 PolarHBondContact O-N 3.26Å; Q211-L213 VanDerWaalsContact C-N 3.35Å; Q211-L213 PolarHBondContact O-N 2.88Å; L213-A217 WeakPolarHBondContact O-CB 3.16Å; L213-A217 PolarHBondContact O-N 3.4Å; L213-M253 HydrophobicContact CD2-SD 3.64Å; L213-I256 HydrophobicContact CD1-CG2 3.92Å; L213-I256 HydrophobicContact CD2-CG2 4.08Å; L213-L257 HydrophobicContact CB-CB 4.33Å; L213-L257 HydrophobicContact CB-CD1 3.81Å; L213-L257 HydrophobicContact CD1-CD1 4.49Å; L213-H260 HydrophobicContact CD1-CB 3.97Å
214	K	90.4	Very high	89	Confident	69 Å²	69	31.8 Å²	31.8	30%	0.3	16%	0.158	S	C	.	.	H	α-helix	trans	-69.2	-42.9	172.6	-72.3	170.2	-177	-179.6	0	112.5	V210 Q211 Y212 M216 V218 L219 L257 E261	V210-K214 HydrophobicContact CG1-CD 4.31Å; V210-K214 WeakPolarHBondContact O-CG 3.3Å; V210-K214 PolarHBondContact O-N 2.71Å; Q211-K214 PolarHBondContact O-N 3.32Å; Y212-K214 VanDerWaalsContact C-N 3.28Å; Y212-K214 PolarHBondContact O-N 3.02Å; K214-M216 VanDerWaalsContact C-N 3.28Å; K214-M216 PolarHBondContact O-N 2.66Å; K214-V218 WeakPolarHBondContact O-CB 3.32Å; K214-V218 PolarHBondContact O-N 3.25Å; K214-L219 PolarHBondContact O-N 2.95Å; K214-L257 HydrophobicContact CG-CD1 3.92Å; K214-L257 HydrophobicContact CG-CD2 3.86Å; K214-E261 WeakPolarHBondContact CE-OE1 3.45Å; K214-E261 IonicContact NZ-OE1 2.66Å; K214-E261 PolarHBondContact NZ-OE1 3.16Å
215	E	89.1	Confident	89.4	Confident	9 Å²	9	31.6 Å²	31.6	4%	0.042	16%	0.158	C	C	.	.	I	π-helix	trans	-58.3	-40.3	175.4	-73.8	163.7	-172.3	0	0	111.5	Q211 Y212 L219 Y220 V330 F331 K336	Q211-E215 WeakPolarHBondContact CG-OE1 3.32Å; Q211-E215 PolarHBondContact NE2-OE1 3.14Å; Q211-E215 WeakPolarHBondContact O-CG 3.47Å; Q211-E215 PolarHBondContact O-N 2.98Å; Y212-E215 PolarHBondContact O-N 3.12Å; E215-L219 HydrophobicContact CG-CD1 4.08Å; E215-L219 PolarHBondContact O-N 3.02Å; E215-Y220 WeakPolarHBondContact O-CB 3.37Å; E215-Y220 PolarHBondContact O-N 3.36Å; E215-V330 HydrophobicContact CG-CG1 4.09Å; E215-F331 HydrophobicContact CB-CE1 4.19Å; E215-K336 IonicContact OE1-NZ 3.7Å; E215-K336 PolarHBondContact OE1-NZ 3.1Å; E215-K336 IonicContact OE2-NZ 3.46Å; E215-K336 PolarHBondContact OE2-NZ 3.25Å
216	M	89.8	Confident	89.6	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	18%	0.181	C	C	.	.	I	π-helix	trans	-84.8	-34.6	179.4	-69.7	-51.7	-54.9	0	0	115.3	Y212 K214 Y220 P221 I249 M253 F331 V339 L343	Y212-M216 HydrophobicContact CD2-CG 3.89Å; Y212-M216 HydrophobicContact CE2-CB 4.39Å; Y212-M216 HydrophobicContact CE2-CG 3.29Å; Y212-M216 HydrophobicContact CE2-SD 4.39Å; Y212-M216 PolarHBondContact O-N 2.91Å; K214-M216 VanDerWaalsContact C-N 3.28Å; K214-M216 PolarHBondContact O-N 2.66Å; M216-Y220 HydrophobicContact CE-CD1 3.74Å; M216-Y220 HydrophobicContact CE-CE1 4.35Å; M216-Y220 HydrophobicContact CE-CG 4.41Å; M216-P221 WeakPolarHBondContact O-CD 3.45Å; M216-I249 HydrophobicContact CE-CG2 4.42Å; M216-M253 HydrophobicContact CB-CG 4.35Å; M216-F331 HydrophobicContact SD-CZ 4.09Å; M216-V339 HydrophobicContact CE-CG1 3.71Å; M216-V339 HydrophobicContact SD-CG1 4.22Å; M216-L343 HydrophobicContact CE-CD2 3.98Å
217	A	89.6	Confident	89.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-79.9	-32.3	-178.9	0	0	0	0	0	113.4	L213 K250 M253 V254	L213-A217 WeakPolarHBondContact O-CB 3.16Å; L213-A217 PolarHBondContact O-N 3.4Å; A217-K250 VanDerWaalsContact O-CE 3.3Å; A217-K250 WeakPolarHBondContact O-CE 3.4Å; A217-K250 WeakPolarHBondContact O-CG 3.06Å; A217-M253 HydrophobicContact CB-CB 3.74Å; A217-V254 HydrophobicContact CB-CG2 3.94Å
218	V	88.8	Confident	89.3	Confident	55 Å²	55	34.7 Å²	34.7	33%	0.333	16%	0.163	S	C	.	.	I	π-helix	trans	-118	-63.7	-168.9	-176.3	0	0	0	0	110.1	K214 P221 E222	K214-V218 WeakPolarHBondContact O-CB 3.32Å; K214-V218 PolarHBondContact O-N 3.25Å; V218-P221 WeakPolarHBondContact O-CD 3.33Å; V218-E222 WeakPolarHBondContact CG1-OE1 3.39Å; V218-E222 WeakPolarHBondContact O-CG 3.38Å; V218-E222 PolarHBondContact O-N 2.68Å; V218-E222 VanDerWaalsContact O-N 3.14Å
219	L	89.1	Confident	89.4	Confident	71 Å²	71	37.2 Å²	37.2	37%	0.372	17%	0.169	S	C	.	.	I	π-helix	trans	-69.1	-43.1	-167.7	-56.7	-178.5	0	0	0	113.4	K214 E215 E222 Y223 F326 V330	K214-L219 PolarHBondContact O-N 2.95Å; E215-L219 HydrophobicContact CG-CD1 4.08Å; E215-L219 PolarHBondContact O-N 3.02Å; L219-E222 PolarHBondContact O-N 2.99Å; L219-Y223 VanDerWaalsContact O-CB 3.3Å; L219-Y223 WeakPolarHBondContact O-CB 3.2Å; L219-Y223 PolarHBondContact O-N 3.27Å; L219-F326 HydrophobicContact CB-CE2 4.08Å; L219-V330 HydrophobicContact CD1-CG1 4.26Å
220	Y	91.3	Very high	89.1	Confident	1 Å²	1	45 Å²	45	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-50.9	-179.7	177.3	-126.4	0	0	0	112.7	E215 M216 E222 Y223 M224 V246 F319 T323 F326 V339	E215-Y220 WeakPolarHBondContact O-CB 3.37Å; E215-Y220 PolarHBondContact O-N 3.36Å; M216-Y220 HydrophobicContact CE-CD1 3.74Å; M216-Y220 HydrophobicContact CE-CE1 4.35Å; M216-Y220 HydrophobicContact CE-CG 4.41Å; Y220-E222 PolarHBondContact O-N 2.64Å; Y220-Y223 PolarHBondContact O-N 3.32Å; Y220-M224 HydrophobicContact CD2-CE 3.89Å; Y220-M224 HydrophobicContact CD2-CG 4.39Å; Y220-M224 HydrophobicContact CD2-SD 4.38Å; Y220-M224 HydrophobicContact CE2-CE 3.49Å; Y220-M224 VanDerWaalsContact CE2-CE 3.49Å; Y220-M224 HydrophobicContact CE2-CG 4.04Å; Y220-M224 HydrophobicContact CE2-SD 3.6Å; Y220-M224 VanDerWaalsContact CE2-SD 3.6Å; Y220-M224 WeakPolarHBondContact O-CG 3.36Å; Y220-M224 PolarHBondContact O-N 2.77Å; Y220-M224 VanDerWaalsContact O-N 3.08Å; Y220-V246 HydrophobicContact CD1-CG1 3.84Å; Y220-V246 HydrophobicContact CE1-CB 4.35Å; Y220-V246 HydrophobicContact CE1-CG1 3.77Å; Y220-V246 HydrophobicContact CE1-CG2 3.72Å; Y220-F319 WeakPolarHBondContact OH-CZ 3.37Å; Y220-T323 HydrophobicContact CE2-CG2 3.98Å; Y220-T323 WeakPolarHBondContact OH-CG2 3.3Å; Y220-T323 PolarHBondContact OH-OG1 3.48Å; Y220-F326 VanDerWaalsContact CA-CE2 3.47Å; Y220-F326 HydrophobicContact CD2-CB 4.3Å; Y220-F326 AromaticContact CD2-CD1 3.59Å; Y220-F326 HydrophobicContact CD2-CD1 3.59Å; Y220-F326 HydrophobicContact CD2-CD2 4.14Å; Y220-F326 AromaticContact CD2-CE1 3.88Å; Y220-F326 HydrophobicContact CD2-CE1 3.88Å; Y220-F326 HydrophobicContact CD2-CE2 4.38Å; Y220-F326 AromaticContact CD2-CG 3.74Å; Y220-F326 HydrophobicContact CD2-CG 3.74Å; Y220-F326 HydrophobicContact CD2-CZ 4.28Å; Y220-F326 HydrophobicContact CE2-CD1 4.29Å; Y220-F326 HydrophobicContact CE2-CG 4.47Å; Y220-F326 HydrophobicContact CG-CD1 4.31Å; Y220-F326 HydrophobicContact CG-CE1 4.14Å; Y220-F326 HydrophobicContact CG-CZ 4.31Å; Y220-V339 HydrophobicContact CD1-CG1 4.29Å; Y220-V339 HydrophobicContact CD2-CG2 4.29Å; Y220-V339 HydrophobicContact CE1-CG1 3.86Å; Y220-V339 HydrophobicContact CE2-CG2 4.13Å
221	P	92.1	Very high	88.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.013	22%	0.219	C	C	.	.	H	α-helix	trans	-56.4	-47	172.3	-25.4	33	0	0	0	113.7	M216 V218 Y223 M224 E225 V246 K250	M216-P221 WeakPolarHBondContact O-CD 3.45Å; V218-P221 WeakPolarHBondContact O-CD 3.33Å; P221-Y223 VanDerWaalsContact C-N 3.26Å; P221-Y223 PolarHBondContact O-N 3.24Å; P221-M224 PolarHBondContact O-N 2.91Å; P221-E225 PolarHBondContact O-N 2.59Å; P221-E225 VanDerWaalsContact O-N 3.12Å; P221-V246 HydrophobicContact CB-CG1 4.19Å; P221-V246 HydrophobicContact CG-CG1 3.94Å; P221-K250 HydrophobicContact CB-CD 3.85Å; P221-K250 HydrophobicContact CG-CB 3.99Å; P221-K250 HydrophobicContact CG-CD 3.78Å; P221-K250 HydrophobicContact CG-CG 4.18Å
222	E	91.1	Very high	88.3	Confident	54 Å²	54	48.2 Å²	48.2	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-35.5	177.2	-78.7	-175.8	-129.3	0	0	112.7	V218 L219 Y220 E225 R226	V218-E222 WeakPolarHBondContact CG1-OE1 3.39Å; V218-E222 WeakPolarHBondContact O-CG 3.38Å; V218-E222 PolarHBondContact O-N 2.68Å; V218-E222 VanDerWaalsContact O-N 3.14Å; L219-E222 PolarHBondContact O-N 2.99Å; Y220-E222 PolarHBondContact O-N 2.64Å; E222-E225 PolarHBondContact O-N 2.83Å; E222-R226 WeakPolarHBondContact O-CB 3.48Å; E222-R226 WeakPolarHBondContact O-CG 3.44Å; E222-R226 PolarHBondContact O-N 2.86Å; E222-R226 IonicContact OE2-CZ 3.2Å; E222-R226 IonicContact OE2-NE 3.07Å; E222-R226 IonicContact OE2-NH2 3.77Å; E222-R226 PolarHBondContact OE2-NH2 3.2Å
223	Y	90.2	Very high	88.1	Confident	27 Å²	27	53 Å²	53	11%	0.106	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-43.3	177.5	-162.6	-80.8	0	0	0	111.6	L219 Y220 P221 E225 R226 F227 M325 F326 E329	L219-Y223 VanDerWaalsContact O-CB 3.3Å; L219-Y223 WeakPolarHBondContact O-CB 3.2Å; L219-Y223 PolarHBondContact O-N 3.27Å; Y220-Y223 PolarHBondContact O-N 3.32Å; P221-Y223 VanDerWaalsContact C-N 3.26Å; P221-Y223 PolarHBondContact O-N 3.24Å; Y223-E225 VanDerWaalsContact C-N 3.31Å; Y223-E225 PolarHBondContact O-N 3.49Å; Y223-R226 PolarHBondContact O-N 3.41Å; Y223-F227 HydrophobicContact CD1-CB 4.47Å; Y223-F227 HydrophobicContact CE1-CB 4.39Å; Y223-F227 AromaticContact CE1-CD2 3.96Å; Y223-F227 HydrophobicContact CE1-CD2 3.96Å; Y223-F227 VanDerWaalsContact O-CB 3.28Å; Y223-F227 WeakPolarHBondContact O-CB 3.46Å; Y223-F227 PolarHBondContact O-N 2.74Å; Y223-M325 HydrophobicContact CE1-CB 4.09Å; Y223-F326 HydrophobicContact CD1-CB 3.84Å; Y223-F326 HydrophobicContact CD1-CD2 4.43Å; Y223-F326 HydrophobicContact CD2-CD2 4.1Å; Y223-F326 HydrophobicContact CE1-CB 4.18Å; Y223-F326 HydrophobicContact CG-CB 4.08Å; Y223-F326 AromaticContact CG-CD2 3.82Å; Y223-F326 HydrophobicContact CG-CD2 3.82Å; Y223-F326 HydrophobicContact CG-CG 4.43Å; Y223-E329 WeakPolarHBondContact CE2-OE2 3.29Å; Y223-E329 VanDerWaalsContact CZ-OE2 3.26Å; Y223-E329 PolarHBondContact OH-OE1 3.02Å; Y223-E329 PolarHBondContact OH-OE2 3.1Å
224	M	90.4	Very high	88	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.6	-44.1	174.4	-60.5	-58.2	85.8	0	0	111.2	Y220 P221 F227 G228 L236 V246 F319 A322 F326	Y220-M224 HydrophobicContact CD2-CE 3.89Å; Y220-M224 HydrophobicContact CD2-CG 4.39Å; Y220-M224 HydrophobicContact CD2-SD 4.38Å; Y220-M224 HydrophobicContact CE2-CE 3.49Å; Y220-M224 VanDerWaalsContact CE2-CE 3.49Å; Y220-M224 HydrophobicContact CE2-CG 4.04Å; Y220-M224 HydrophobicContact CE2-SD 3.6Å; Y220-M224 VanDerWaalsContact CE2-SD 3.6Å; Y220-M224 WeakPolarHBondContact O-CG 3.36Å; Y220-M224 PolarHBondContact O-N 2.77Å; Y220-M224 VanDerWaalsContact O-N 3.08Å; P221-M224 PolarHBondContact O-N 2.91Å; M224-F227 PolarHBondContact O-N 2.64Å; M224-G228 PolarHBondContact O-N 3.15Å; M224-L236 HydrophobicContact CB-CD1 4.18Å; M224-L236 HydrophobicContact CB-CD2 3.67Å; M224-L236 HydrophobicContact CB-CG 3.84Å; M224-L236 HydrophobicContact CG-CD2 4.05Å; M224-V246 HydrophobicContact CG-CG1 4.42Å; M224-F319 HydrophobicContact CG-CE2 4.43Å; M224-F319 HydrophobicContact SD-CD2 4.34Å; M224-F319 HydrophobicContact SD-CE2 3.96Å; M224-F319 HydrophobicContact SD-CZ 4.33Å; M224-A322 HydrophobicContact CE-CB 3.82Å; M224-A322 WeakPolarHBondContact CE-O 3.41Å; M224-A322 HydrophobicContact SD-CB 4.07Å; M224-F326 HydrophobicContact CE-CB 4.42Å
225	E	89.6	Confident	87.8	Confident	87 Å²	87	54.7 Å²	54.7	41%	0.407	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-45.9	178.7	-164.5	-170.2	148.1	0	0	112.2	P221 E222 Y223 G228 K229 L236	P221-E225 PolarHBondContact O-N 2.59Å; P221-E225 VanDerWaalsContact O-N 3.12Å; E222-E225 PolarHBondContact O-N 2.83Å; Y223-E225 VanDerWaalsContact C-N 3.31Å; Y223-E225 PolarHBondContact O-N 3.49Å; E225-G228 PolarHBondContact O-N 2.69Å; E225-K229 HydrophobicContact CG-CD 4.48Å; E225-K229 WeakPolarHBondContact O-CB 3.49Å; E225-K229 WeakPolarHBondContact O-CG 3.18Å; E225-K229 PolarHBondContact O-N 2.95Å; E225-K229 WeakPolarHBondContact OE1-CE 3.46Å; E225-K229 IonicContact OE1-NZ 3.4Å; E225-K229 PolarHBondContact OE1-NZ 2.59Å; E225-L236 HydrophobicContact CB-CD1 4.09Å
226	R	87.8	Confident	87.7	Confident	156 Å²	156	55.1 Å²	55.1	59%	0.589	27%	0.271	S	S	*	.	H	α-helix	trans	-67.7	-32.1	177.5	-67.8	169.7	-167.2	-143.3	10.3	112.6	E222 Y223 R230	E222-R226 WeakPolarHBondContact O-CB 3.48Å; E222-R226 WeakPolarHBondContact O-CG 3.44Å; E222-R226 PolarHBondContact O-N 2.86Å; E222-R226 IonicContact OE2-CZ 3.2Å; E222-R226 IonicContact OE2-NE 3.07Å; E222-R226 IonicContact OE2-NH2 3.77Å; E222-R226 PolarHBondContact OE2-NH2 3.2Å; Y223-R226 PolarHBondContact O-N 3.41Å; R226-R230 WeakPolarHBondContact O-CG 3.49Å; R226-R230 PolarHBondContact O-NE 3.01Å
227	F	87.6	Confident	87.4	Confident	14 Å²	14	57.2 Å²	57.2	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-72.7	-48.8	174	-165	-74.7	0	0	0	110.5	Y223 M224 K229 R230 V231 L235 E321 A322 M325	Y223-F227 HydrophobicContact CD1-CB 4.47Å; Y223-F227 HydrophobicContact CE1-CB 4.39Å; Y223-F227 AromaticContact CE1-CD2 3.96Å; Y223-F227 HydrophobicContact CE1-CD2 3.96Å; Y223-F227 VanDerWaalsContact O-CB 3.28Å; Y223-F227 WeakPolarHBondContact O-CB 3.46Å; Y223-F227 PolarHBondContact O-N 2.74Å; M224-F227 PolarHBondContact O-N 2.64Å; F227-K229 VanDerWaalsContact C-N 3.32Å; F227-K229 PolarHBondContact O-N 3.12Å; F227-R230 WeakPolarHBondContact O-CB 3.35Å; F227-R230 PolarHBondContact O-N 3.18Å; F227-V231 HydrophobicContact CD1-CG2 3.9Å; F227-V231 HydrophobicContact CE1-CG2 3.65Å; F227-V231 PolarHBondContact O-N 3Å; F227-L235 HydrophobicContact CB-CD1 4.49Å; F227-L235 HydrophobicContact CD1-CD1 3.83Å; F227-E321 HydrophobicContact CZ-CB 4.44Å; F227-E321 HydrophobicContact CZ-CG 4.09Å; F227-A322 HydrophobicContact CB-CB 3.92Å; F227-A322 HydrophobicContact CD1-CB 3.52Å; F227-A322 HydrophobicContact CD2-CB 3.96Å; F227-A322 HydrophobicContact CE1-CB 3.94Å; F227-A322 HydrophobicContact CE2-CB 4.36Å; F227-A322 HydrophobicContact CG-CB 3.53Å; F227-A322 HydrophobicContact CZ-CB 4.35Å; F227-M325 HydrophobicContact CE2-CB 4.36Å; F227-M325 HydrophobicContact CE2-CG 4.14Å
228	G	86.4	Confident	87	Confident	2 Å²	2	61.4 Å²	61.4	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-55.5	-44.5	177.3	0	0	0	0	0	113.1	M224 E225 R230 V231 G232 R233	M224-G228 PolarHBondContact O-N 3.15Å; E225-G228 PolarHBondContact O-N 2.69Å; G228-R230 VanDerWaalsContact C-N 3.28Å; G228-R230 PolarHBondContact O-N 3.33Å; G228-V231 CarbonylContact O-C 3.53Å; G228-V231 PolarHBondContact O-N 2.91Å; G228-G232 PolarHBondContact O-N 3.31Å; G228-R233 CarbonylContact C-O 3.56Å; G228-R233 WeakPolarHBondContact CA-O 3.35Å; G228-R233 PolarHBondContact O-N 3.1Å; G228-R233 VanDerWaalsContact O-O 3.08Å
229	K	86	Confident	86.3	Confident	147 Å²	147	61.7 Å²	61.7	64%	0.639	32%	0.315	S	S	*	.	H	α-helix	trans	-59.5	-31.5	174.1	-74.8	173.9	-177.3	173.9	0	114	E225 F227	E225-K229 HydrophobicContact CG-CD 4.48Å; E225-K229 WeakPolarHBondContact O-CB 3.49Å; E225-K229 WeakPolarHBondContact O-CG 3.18Å; E225-K229 PolarHBondContact O-N 2.95Å; E225-K229 WeakPolarHBondContact OE1-CE 3.46Å; E225-K229 IonicContact OE1-NZ 3.4Å; E225-K229 PolarHBondContact OE1-NZ 2.59Å; F227-K229 VanDerWaalsContact C-N 3.32Å; F227-K229 PolarHBondContact O-N 3.12Å
230	R	82.5	Confident	85.3	Confident	165 Å²	165	64 Å²	64	62%	0.623	33%	0.328	S	S	*	.	H	α-helix	trans	-74.3	-27.9	174.6	-73.7	-178	-71.7	168.1	-2	113.2	R226 F227 G228	R226-R230 WeakPolarHBondContact O-CG 3.49Å; R226-R230 PolarHBondContact O-NE 3.01Å; F227-R230 WeakPolarHBondContact O-CB 3.35Å; F227-R230 PolarHBondContact O-N 3.18Å; G228-R230 VanDerWaalsContact C-N 3.28Å; G228-R230 PolarHBondContact O-N 3.33Å
231	V	81.5	Confident	84.1	Confident	75 Å²	75	67.3 Å²	67.3	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-96.4	-3.5	179.9	-174.4	0	0	0	0	111.9	F227 G228 R233 E318	F227-V231 HydrophobicContact CD1-CG2 3.9Å; F227-V231 HydrophobicContact CE1-CG2 3.65Å; F227-V231 PolarHBondContact O-N 3Å; G228-V231 CarbonylContact O-C 3.53Å; G228-V231 PolarHBondContact O-N 2.91Å; V231-R233 VanDerWaalsContact C-N 3.34Å; V231-E318 HydrophobicContact CG1-CG 4.24Å
232	G	81.9	Confident	83.1	Confident	74 Å²	74	73.1 Å²	73.1	76%	0.763	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	18.6	-179.2	0	0	0	0	0	114.5	G228	G228-G232 PolarHBondContact O-N 3.31Å
233	R	85.6	Confident	82.8	Confident	103 Å²	103	74.1 Å²	74.1	39%	0.389	39%	0.394	S	S	.	.	S	Bend	trans	-135	132.8	-171.8	-173.8	171.9	178.2	-112.5	-25.2	111.3	G228 V231 L235 D316 E318	G228-R233 CarbonylContact C-O 3.56Å; G228-R233 WeakPolarHBondContact CA-O 3.35Å; G228-R233 PolarHBondContact O-N 3.1Å; G228-R233 VanDerWaalsContact O-O 3.08Å; V231-R233 VanDerWaalsContact C-N 3.34Å; R233-L235 HydrophobicContact CG-CD2 4.48Å; R233-L235 PolarHBondContact O-N 2.81Å; R233-D316 IonicContact CZ-OD1 3.95Å; R233-D316 IonicContact CZ-OD2 2.71Å; R233-D316 IonicContact NH1-OD1 2.69Å; R233-D316 PolarHBondContact NH1-OD1 2.85Å; R233-D316 IonicContact NH1-OD2 2.86Å; R233-D316 PolarHBondContact NH1-OD2 3.09Å; R233-D316 IonicContact NH2-OD2 2.69Å; R233-D316 PolarHBondContact NH2-OD2 3.4Å; R233-E318 IonicContact CZ-OE2 2.68Å; R233-E318 IonicContact NH1-OE2 2.59Å; R233-E318 PolarHBondContact NH1-OE2 2.75Å
234	D	86.6	Confident	82.8	Confident	101 Å²	101	73 Å²	73	54%	0.54	39%	0.39	S	S	.	.			trans	-77.8	102.2	175.4	-177.2	10	0	0	0	111.1	L236 A237	D234-L236 PolarHBondContact O-N 2.87Å; D234-L236 WeakPolarHBondContact OD1-CA 3.32Å; D234-L236 PolarHBondContact OD1-N 3.26Å; D234-A237 HydrophobicContact CB-CB 4.17Å; D234-A237 WeakPolarHBondContact O-CB 3.37Å; D234-A237 PolarHBondContact OD1-N 3.46Å; D234-A237 PolarHBondContact OD2-N 3.07Å
235	L	86.9	Confident	82.7	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.026	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-7.1	176.9	-60	-179.4	0	0	0	113.4	F227 R233 N244 E318 F319 A322	F227-L235 HydrophobicContact CB-CD1 4.49Å; F227-L235 HydrophobicContact CD1-CD1 3.83Å; R233-L235 HydrophobicContact CG-CD2 4.48Å; R233-L235 PolarHBondContact O-N 2.81Å; L235-N244 PolarHBondContact O-ND2 2.8Å; L235-N244 VanDerWaalsContact O-ND2 3.13Å; L235-E318 HydrophobicContact CD2-CB 3.91Å; L235-F319 HydrophobicContact CB-CD2 4.36Å; L235-A322 HydrophobicContact CD1-CB 3.71Å
236	L	87.2	Confident	82.8	Confident	18 Å²	18	69.3 Å²	69.3	9%	0.094	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	6.4	175.8	-65.5	-178.6	0	0	0	113	M224 E225 D234 N244 V246 L247	M224-L236 HydrophobicContact CB-CD1 4.18Å; M224-L236 HydrophobicContact CB-CD2 3.67Å; M224-L236 HydrophobicContact CB-CG 3.84Å; M224-L236 HydrophobicContact CG-CD2 4.05Å; E225-L236 HydrophobicContact CB-CD1 4.09Å; D234-L236 PolarHBondContact O-N 2.87Å; D234-L236 WeakPolarHBondContact OD1-CA 3.32Å; D234-L236 PolarHBondContact OD1-N 3.26Å; L236-N244 VanDerWaalsContact O-CB 3.29Å; L236-N244 WeakPolarHBondContact O-CB 3.5Å; L236-V246 HydrophobicContact CD2-CB 3.81Å; L236-V246 HydrophobicContact CD2-CG1 3.95Å; L236-V246 HydrophobicContact CD2-CG2 4.31Å; L236-L247 HydrophobicContact CB-CD1 4.47Å; L236-L247 HydrophobicContact CD1-CD2 4.28Å
237	A	83.4	Confident	83	Confident	45 Å²	45	64 Å²	64	37%	0.372	36%	0.356	S	S	.	.	S	Bend	trans	-56.4	156.6	172.6	0	0	0	0	0	112.3	D234 H239 N244	D234-A237 HydrophobicContact CB-CB 4.17Å; D234-A237 WeakPolarHBondContact O-CB 3.37Å; D234-A237 PolarHBondContact OD1-N 3.46Å; D234-A237 PolarHBondContact OD2-N 3.07Å; A237-H239 PolarHBondContact O-N 2.93Å; A237-N244 PolarHBondContact O-ND2 3.38Å
238	S	81.6	Confident	83.1	Confident	88 Å²	88	65.6 Å²	65.6	62%	0.615	36%	0.364	S	S	*	.			trans	-62.8	113.3	178.3	-63.5	0	0	0	0	111.8	H242	S238-H242 CarbonylContact C-O 3.54Å; S238-H242 VanDerWaalsContact C-O 3.28Å; S238-H242 WeakPolarHBondContact CA-O 3.32Å; S238-H242 VanDerWaalsContact CB-O 3.26Å; S238-H242 WeakPolarHBondContact CB-O 3.48Å
239	H	73.3	Confident	83.3	Confident	60 Å²	60	65.6 Å²	65.6	28%	0.278	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-83.4	130.7	177.8	-163.7	46.7	0	0	0	110.8	A237 G241 H242 E315	A237-H239 PolarHBondContact O-N 2.93Å; H239-G241 PolarHBondContact O-N 3.38Å; H239-G241 VanDerWaalsContact O-N 3.12Å; H239-H242 PolarHBondContact N-O 2.83Å; H239-H242 PolarHBondContact O-N 3.42Å; H239-E315 IonicContact CD2-OE2 2.71Å; H239-E315 IonicContact CE1-OE2 2.74Å; H239-E315 PolarHBondContact CE1-OE2 3.31Å; H239-E315 IonicContact NE2-OE2 2.71Å; H239-E315 PolarHBondContact NE2-OE2 3.47Å
240	N	68.5	Low	83.5	Confident	119 Å²	119	62 Å²	62	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	38.9	178.3	-63	-27.6	0	0	0	114.5	H242	N240-H242 VanDerWaalsContact C-N 3.28Å; N240-H242 PolarHBondContact O-N 3.05Å
241	G	66.4	Low	83.9	Confident	71 Å²	71	59.3 Å²	59.3	73%	0.732	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	11.9	-179.6	0	0	0	0	0	115	H239	H239-G241 PolarHBondContact O-N 3.38Å; H239-G241 VanDerWaalsContact O-N 3.12Å
242	H	71.1	Confident	84.2	Confident	124 Å²	124	56.5 Å²	56.5	57%	0.574	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-122.4	154.3	177.8	-66.7	-24	0	0	0	111.1	S238 H239 N240 N244	S238-H242 CarbonylContact C-O 3.54Å; S238-H242 VanDerWaalsContact C-O 3.28Å; S238-H242 WeakPolarHBondContact CA-O 3.32Å; S238-H242 VanDerWaalsContact CB-O 3.26Å; S238-H242 WeakPolarHBondContact CB-O 3.48Å; H239-H242 PolarHBondContact N-O 2.83Å; H239-H242 PolarHBondContact O-N 3.42Å; N240-H242 VanDerWaalsContact C-N 3.28Å; N240-H242 PolarHBondContact O-N 3.05Å; H242-N244 PolarHBondContact O-N 3.22Å
243	E	83.3	Confident	84.6	Confident	75 Å²	75	53 Å²	53	35%	0.35	29%	0.286	S	S	.	.			trans	-58.4	139.2	176.4	176.2	169.7	-113.2	0	0	111	V245 L247 Q248 K251	E243-V245 PolarHBondContact O-N 2.97Å; E243-L247 HydrophobicContact CG-CB 3.86Å; E243-L247 HydrophobicContact CG-CD1 4.33Å; E243-Q248 HydrophobicContact CB-CG 4.44Å; E243-Q248 HydrophobicContact CG-CG 4.26Å; E243-Q248 PolarHBondContact O-NE2 3.18Å; E243-K251 VanDerWaalsContact OE1-CE 3.28Å; E243-K251 WeakPolarHBondContact OE1-CE 3.42Å; E243-K251 IonicContact OE1-NZ 3.79Å; E243-K251 PolarHBondContact OE1-NZ 2.67Å; E243-K251 WeakPolarHBondContact OE2-CE 3.46Å; E243-K251 IonicContact OE2-NZ 3.93Å; E243-K251 PolarHBondContact OE2-NZ 3.42Å
244	N	90.5	Very high	84.7	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	29%	0.289	C	S	.	.			trans	-55.5	137.6	-178.5	-168	-67.3	0	0	0	112.2	L235 L236 A237 H242 V246 L247 Q248	L235-N244 PolarHBondContact O-ND2 2.8Å; L235-N244 VanDerWaalsContact O-ND2 3.13Å; L236-N244 VanDerWaalsContact O-CB 3.29Å; L236-N244 WeakPolarHBondContact O-CB 3.5Å; A237-N244 PolarHBondContact O-ND2 3.38Å; H242-N244 PolarHBondContact O-N 3.22Å; N244-V246 PolarHBondContact O-N 3.49Å; N244-V246 VanDerWaalsContact O-N 3.17Å; N244-V246 WeakPolarHBondContact OD1-CB 3.43Å; N244-V246 WeakPolarHBondContact OD1-CG2 3.3Å; N244-V246 PolarHBondContact OD1-N 2.61Å; N244-L247 HydrophobicContact CB-CD1 4.19Å; N244-L247 HydrophobicContact CB-CG 4.24Å; N244-L247 WeakPolarHBondContact O-CB 3.28Å; N244-L247 PolarHBondContact O-N 2.92Å; N244-Q248 PolarHBondContact O-N 3.39Å; N244-Q248 VanDerWaalsContact O-N 3.08Å
245	V	90	Very high	84.7	Confident	8 Å²	8	48.6 Å²	48.6	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-56.8	-33.9	-177.1	65.6	0	0	0	0	112.8	E243 L247 Q248 I249 F305 K308 L309 L312	E243-V245 PolarHBondContact O-N 2.97Å; V245-L247 VanDerWaalsContact C-N 3.32Å; V245-L247 PolarHBondContact O-N 3.12Å; V245-Q248 PolarHBondContact O-N 3.35Å; V245-I249 HydrophobicContact CG2-CD1 4.06Å; V245-I249 WeakPolarHBondContact O-CD1 3.29Å; V245-I249 VanDerWaalsContact O-CG1 3.3Å; V245-I249 WeakPolarHBondContact O-CG1 3.5Å; V245-I249 PolarHBondContact O-N 2.89Å; V245-F305 HydrophobicContact CG2-CB 4.37Å; V245-F305 HydrophobicContact CG2-CD1 4.12Å; V245-K308 HydrophobicContact CB-CB 4.07Å; V245-K308 HydrophobicContact CG2-CB 3.75Å; V245-L309 HydrophobicContact CG1-CB 4.25Å; V245-L309 HydrophobicContact CG1-CD1 3.89Å; V245-L312 HydrophobicContact CG1-CD2 4.14Å
246	V	91.3	Very high	84.8	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-37.3	176.8	-178.3	0	0	0	0	111.3	Y220 P221 M224 L236 N244 K250 L309 F319	Y220-V246 HydrophobicContact CD1-CG1 3.84Å; Y220-V246 HydrophobicContact CE1-CB 4.35Å; Y220-V246 HydrophobicContact CE1-CG1 3.77Å; Y220-V246 HydrophobicContact CE1-CG2 3.72Å; P221-V246 HydrophobicContact CB-CG1 4.19Å; P221-V246 HydrophobicContact CG-CG1 3.94Å; M224-V246 HydrophobicContact CG-CG1 4.42Å; L236-V246 HydrophobicContact CD2-CB 3.81Å; L236-V246 HydrophobicContact CD2-CG1 3.95Å; L236-V246 HydrophobicContact CD2-CG2 4.31Å; N244-V246 PolarHBondContact O-N 3.49Å; N244-V246 VanDerWaalsContact O-N 3.17Å; N244-V246 WeakPolarHBondContact OD1-CB 3.43Å; N244-V246 WeakPolarHBondContact OD1-CG2 3.3Å; N244-V246 PolarHBondContact OD1-N 2.61Å; V246-K250 WeakPolarHBondContact O-CB 3.47Å; V246-K250 PolarHBondContact O-N 3.16Å; V246-L309 HydrophobicContact CG2-CD1 4.44Å; V246-F319 HydrophobicContact CG2-CE2 3.81Å; V246-F319 HydrophobicContact CG2-CZ 3.6Å
247	L	90.9	Very high	84.9	Confident	46 Å²	46	48.5 Å²	48.5	24%	0.241	27%	0.272	C	S	.	.	H	α-helix	trans	-73.7	-35.8	176.8	-62.2	178	0	0	0	112	L236 E243 N244 V245 K250 K251	L236-L247 HydrophobicContact CB-CD1 4.47Å; L236-L247 HydrophobicContact CD1-CD2 4.28Å; E243-L247 HydrophobicContact CG-CB 3.86Å; E243-L247 HydrophobicContact CG-CD1 4.33Å; N244-L247 HydrophobicContact CB-CD1 4.19Å; N244-L247 HydrophobicContact CB-CG 4.24Å; N244-L247 WeakPolarHBondContact O-CB 3.28Å; N244-L247 PolarHBondContact O-N 2.92Å; V245-L247 VanDerWaalsContact C-N 3.32Å; V245-L247 PolarHBondContact O-N 3.12Å; L247-K250 PolarHBondContact O-N 3.03Å; L247-K251 WeakPolarHBondContact O-CG 3.19Å; L247-K251 PolarHBondContact O-N 3.18Å
248	Q	90.6	Very high	85.1	Confident	47 Å²	47	48.4 Å²	48.4	22%	0.22	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-46.9	171.9	-61.6	-178.8	37.5	0	0	111	E243 N244 V245 K251 F305	E243-Q248 HydrophobicContact CB-CG 4.44Å; E243-Q248 HydrophobicContact CG-CG 4.26Å; E243-Q248 PolarHBondContact O-NE2 3.18Å; N244-Q248 PolarHBondContact O-N 3.39Å; N244-Q248 VanDerWaalsContact O-N 3.08Å; V245-Q248 PolarHBondContact O-N 3.35Å; Q248-K251 PolarHBondContact O-N 3.14Å; Q248-F305 HydrophobicContact CB-CE1 3.82Å
249	I	90	Very high	85.5	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-49	175.4	-66.6	161.9	0	0	0	110.5	M216 V245 K251 I252 M253 F305 L343	M216-I249 HydrophobicContact CE-CG2 4.42Å; V245-I249 HydrophobicContact CG2-CD1 4.06Å; V245-I249 WeakPolarHBondContact O-CD1 3.29Å; V245-I249 VanDerWaalsContact O-CG1 3.3Å; V245-I249 WeakPolarHBondContact O-CG1 3.5Å; V245-I249 PolarHBondContact O-N 2.89Å; I249-K251 VanDerWaalsContact C-N 3.31Å; I249-K251 PolarHBondContact O-N 3.09Å; I249-I252 PolarHBondContact O-N 3Å; I249-I252 VanDerWaalsContact O-N 3.11Å; I249-M253 HydrophobicContact CG2-CE 3.95Å; I249-M253 HydrophobicContact CG2-CG 3.91Å; I249-M253 WeakPolarHBondContact O-CG 3.07Å; I249-M253 PolarHBondContact O-N 2.78Å; I249-F305 HydrophobicContact CD1-CB 4.22Å; I249-F305 HydrophobicContact CG1-CB 4.18Å; I249-F305 HydrophobicContact CG1-CD1 4.2Å; I249-F305 HydrophobicContact CG1-CD2 4.26Å; I249-F305 HydrophobicContact CG1-CG 3.97Å; I249-L343 HydrophobicContact CD1-CD1 4.06Å; I249-L343 HydrophobicContact CD1-CD2 4.17Å; I249-L343 HydrophobicContact CG2-CD2 4.09Å
250	K	91.1	Very high	86.4	Confident	70 Å²	70	41.5 Å²	41.5	30%	0.304	23%	0.225	S	C	.	.	H	α-helix	trans	-49.7	-50.2	177	175.8	169.6	-162.9	165.4	0	111.7	A217 P221 V246 L247 I252 M253 V254	A217-K250 VanDerWaalsContact O-CE 3.3Å; A217-K250 WeakPolarHBondContact O-CE 3.4Å; A217-K250 WeakPolarHBondContact O-CG 3.06Å; P221-K250 HydrophobicContact CB-CD 3.85Å; P221-K250 HydrophobicContact CG-CB 3.99Å; P221-K250 HydrophobicContact CG-CD 3.78Å; P221-K250 HydrophobicContact CG-CG 4.18Å; V246-K250 WeakPolarHBondContact O-CB 3.47Å; V246-K250 PolarHBondContact O-N 3.16Å; L247-K250 PolarHBondContact O-N 3.03Å; K250-I252 VanDerWaalsContact C-N 3.26Å; K250-I252 PolarHBondContact O-N 3.37Å; K250-M253 PolarHBondContact O-N 2.89Å; K250-V254 HydrophobicContact CG-CG2 4.33Å; K250-V254 VanDerWaalsContact O-CG2 3.28Å; K250-V254 WeakPolarHBondContact O-CG2 3.34Å; K250-V254 PolarHBondContact O-N 2.75Å
251	K	89.8	Confident	87.5	Confident	109 Å²	109	38.6 Å²	38.6	47%	0.474	21%	0.208	S	C	.	.	H	α-helix	trans	-57.3	-35.2	-178.1	-77.4	175.2	-178	177.2	0	113.5	E243 L247 Q248 I249 Q255	E243-K251 VanDerWaalsContact OE1-CE 3.28Å; E243-K251 WeakPolarHBondContact OE1-CE 3.42Å; E243-K251 IonicContact OE1-NZ 3.79Å; E243-K251 PolarHBondContact OE1-NZ 2.67Å; E243-K251 WeakPolarHBondContact OE2-CE 3.46Å; E243-K251 IonicContact OE2-NZ 3.93Å; E243-K251 PolarHBondContact OE2-NZ 3.42Å; L247-K251 WeakPolarHBondContact O-CG 3.19Å; L247-K251 PolarHBondContact O-N 3.18Å; Q248-K251 PolarHBondContact O-N 3.14Å; I249-K251 VanDerWaalsContact C-N 3.31Å; I249-K251 PolarHBondContact O-N 3.09Å; K251-Q255 PolarHBondContact O-NE2 3.08Å
252	I	88.8	Confident	88.6	Confident	16 Å²	16	36.8 Å²	36.8	8%	0.082	18%	0.181	C	C	.	.	H	α-helix	trans	-86.6	-40.5	-179.2	-49.3	174.4	0	0	0	111	I249 K250 V254 Q255 I256 P297 F298 F305	I249-I252 PolarHBondContact O-N 3Å; I249-I252 VanDerWaalsContact O-N 3.11Å; K250-I252 VanDerWaalsContact C-N 3.26Å; K250-I252 PolarHBondContact O-N 3.37Å; I252-V254 VanDerWaalsContact C-N 3.26Å; I252-V254 PolarHBondContact O-N 2.77Å; I252-Q255 WeakPolarHBondContact O-CB 3.33Å; I252-Q255 PolarHBondContact O-N 3.01Å; I252-I256 HydrophobicContact CG2-CD1 4.1Å; I252-I256 PolarHBondContact O-N 3.22Å; I252-P297 HydrophobicContact CG2-CB 4.4Å; I252-F298 HydrophobicContact CB-CB 4.5Å; I252-F298 HydrophobicContact CG2-CB 3.73Å; I252-F305 HydrophobicContact CD1-CE2 3.83Å; I252-F305 HydrophobicContact CD1-CZ 3.64Å
253	M	89.8	Confident	89.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-36.2	177	-63.6	-63.8	-178.1	0	0	112.3	Y212 L213 M216 A217 I249 K250 Q255 I256 L257 F298 L343 V346	Y212-M253 VanDerWaalsContact OH-CE 3.24Å; Y212-M253 WeakPolarHBondContact OH-CE 3.28Å; L213-M253 HydrophobicContact CD2-SD 3.64Å; M216-M253 HydrophobicContact CB-CG 4.35Å; A217-M253 HydrophobicContact CB-CB 3.74Å; I249-M253 HydrophobicContact CG2-CE 3.95Å; I249-M253 HydrophobicContact CG2-CG 3.91Å; I249-M253 WeakPolarHBondContact O-CG 3.07Å; I249-M253 PolarHBondContact O-N 2.78Å; K250-M253 PolarHBondContact O-N 2.89Å; M253-Q255 VanDerWaalsContact C-N 3.25Å; M253-Q255 PolarHBondContact O-N 2.85Å; M253-I256 PolarHBondContact O-N 3.23Å; M253-L257 WeakPolarHBondContact O-CB 2.94Å; M253-L257 PolarHBondContact O-N 2.84Å; M253-F298 HydrophobicContact CE-CD2 3.71Å; M253-F298 HydrophobicContact CE-CE1 4.19Å; M253-F298 HydrophobicContact CE-CE2 3.34Å; M253-F298 HydrophobicContact CE-CG 4.28Å; M253-F298 HydrophobicContact CE-CZ 3.6Å; M253-L343 HydrophobicContact CE-CD2 4.11Å; M253-V346 HydrophobicContact CE-CG2 3.84Å; M253-V346 HydrophobicContact SD-CG2 4.03Å
254	V	88	Confident	90.1	Very high	74 Å²	74	28.9 Å²	28.9	45%	0.448	15%	0.145	S	C	.	.	H	α-helix	trans	-64.5	-24.1	174	171.4	0	0	0	0	113.1	A217 K250 I252 P258	A217-V254 HydrophobicContact CB-CG2 3.94Å; K250-V254 HydrophobicContact CG-CG2 4.33Å; K250-V254 VanDerWaalsContact O-CG2 3.28Å; K250-V254 WeakPolarHBondContact O-CG2 3.34Å; K250-V254 PolarHBondContact O-N 2.75Å; I252-V254 VanDerWaalsContact C-N 3.26Å; I252-V254 PolarHBondContact O-N 2.77Å; V254-P258 WeakPolarHBondContact O-CD 3.29Å
255	Q	85.1	Confident	90.1	Very high	39 Å²	39	34.9 Å²	34.9	18%	0.182	17%	0.171	C	C	.	.	H	α-helix	trans	-83.7	-30.8	175.3	-67.1	168.4	66	0	0	112.7	H80 K251 I252 M253	H80-Q255 PolarHBondContact NE2-O 2.66Å; K251-Q255 PolarHBondContact O-NE2 3.08Å; I252-Q255 WeakPolarHBondContact O-CB 3.33Å; I252-Q255 PolarHBondContact O-N 3.01Å; M253-Q255 VanDerWaalsContact C-N 3.25Å; M253-Q255 PolarHBondContact O-N 2.85Å
256	I	89.2	Confident	90.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-78.7	-41.3	178.7	-63.5	168.9	0	0	0	110.8	L213 I252 M253 I259 H260 F298 V346	L213-I256 HydrophobicContact CD1-CG2 3.92Å; L213-I256 HydrophobicContact CD2-CG2 4.08Å; I252-I256 HydrophobicContact CG2-CD1 4.1Å; I252-I256 PolarHBondContact O-N 3.22Å; M253-I256 PolarHBondContact O-N 3.23Å; I256-I259 PolarHBondContact O-N 3.37Å; I256-H260 PolarHBondContact O-CD2 2.87Å; I256-H260 PolarHBondContact O-N 3.49Å; I256-F298 HydrophobicContact CD1-CB 3.93Å; I256-V346 HydrophobicContact CD1-CG1 4.47Å
257	L	89.8	Confident	90.2	Very high	21 Å²	21	36.3 Å²	36.3	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-52.2	-49.4	-173.4	173.9	62.8	0	0	0	114.5	V210 L213 K214 M253 I259 H260 E261	V210-L257 HydrophobicContact CG1-CD1 4.08Å; L213-L257 HydrophobicContact CB-CB 4.33Å; L213-L257 HydrophobicContact CB-CD1 3.81Å; L213-L257 HydrophobicContact CD1-CD1 4.49Å; K214-L257 HydrophobicContact CG-CD1 3.92Å; K214-L257 HydrophobicContact CG-CD2 3.86Å; M253-L257 WeakPolarHBondContact O-CB 2.94Å; M253-L257 PolarHBondContact O-N 2.84Å; L257-I259 VanDerWaalsContact C-N 3.34Å; L257-I259 PolarHBondContact O-N 2.97Å; L257-H260 CarbonylContact O-C 3.58Å; L257-H260 PolarHBondContact O-N 3.44Å; L257-H260 VanDerWaalsContact O-N 3.17Å; L257-E261 HydrophobicContact CD1-CG 3.85Å; L257-E261 HydrophobicContact CG-CG 4.32Å; L257-E261 PolarHBondContact O-N 2.73Å
258	P	88.9	Confident	90.2	Very high	43 Å²	43	36 Å²	36	28%	0.279	18%	0.176	S	C	.	.	H	α-helix	trans	-61.6	-37.9	-177.2	-25.1	35.6	0	0	0	113.9	M84 V254 H260 E261 M262	M84-P258 HydrophobicContact CE-CB 4.11Å; V254-P258 WeakPolarHBondContact O-CD 3.29Å; P258-H260 VanDerWaalsContact C-N 3.34Å; P258-H260 PolarHBondContact O-N 2.85Å; P258-E261 PolarHBondContact O-N 3.03Å; P258-M262 WeakPolarHBondContact O-CG 3.47Å; P258-M262 PolarHBondContact O-N 3.35Å
259	I	88.4	Confident	90.2	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-63.8	-42.6	177.9	-70.2	168.9	0	0	0	109.9	I83 M84 M87 I256 L257 M262 L263 C294	I83-I259 HydrophobicContact CG2-CD1 4.41Å; M84-I259 HydrophobicContact SD-CD1 4.2Å; M84-I259 HydrophobicContact SD-CG1 3.47Å; M84-I259 WeakPolarHBondContact SD-CG1 3.43Å; M87-I259 HydrophobicContact CE-CG2 4.21Å; M87-I259 HydrophobicContact SD-CG1 4.47Å; I256-I259 PolarHBondContact O-N 3.37Å; L257-I259 VanDerWaalsContact C-N 3.34Å; L257-I259 PolarHBondContact O-N 2.97Å; I259-M262 PolarHBondContact O-N 2.9Å; I259-L263 PolarHBondContact O-N 3.47Å; I259-C294 HydrophobicContact CD1-CB 3.45Å; I259-C294 VanDerWaalsContact CD1-CB 3.45Å; I259-C294 VanDerWaalsContact CD1-SG 3.6Å
260	H	92	Very high	90.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-75.5	-25.9	176.7	-73.1	-88.7	0	0	0	113	Q206 Y209 V210 L213 I256 L257 P258 L264 L292 Y353	Q206-H260 PolarHBondContact NE2-ND1 3.05Å; Q206-H260 PolarHBondContact NE2-O 3.28Å; Y209-H260 HydrophobicContact CD1-CB 4.39Å; Y209-H260 AromaticContact CD1-CG 3.92Å; Y209-H260 AromaticContact CD1-ND1 3.5Å; Y209-H260 WeakPolarHBondContact CD1-ND1 3.4Å; Y209-H260 HydrophobicContact CE1-CB 4.47Å; Y209-H260 AromaticContact CE1-CD2 3.96Å; Y209-H260 AromaticContact CE1-CE1 3.54Å; Y209-H260 AromaticContact CE1-CG 3.67Å; Y209-H260 AromaticContact CE1-ND1 3.39Å; Y209-H260 WeakPolarHBondContact CE1-ND1 3.36Å; Y209-H260 AromaticContact CE1-NE2 3.86Å; V210-H260 HydrophobicContact CG2-CB 3.99Å; V210-H260 WeakPolarHBondContact CG2-O 3.15Å; L213-H260 HydrophobicContact CD1-CB 3.97Å; I256-H260 PolarHBondContact O-CD2 2.87Å; I256-H260 PolarHBondContact O-N 3.49Å; L257-H260 CarbonylContact O-C 3.58Å; L257-H260 PolarHBondContact O-N 3.44Å; L257-H260 VanDerWaalsContact O-N 3.17Å; P258-H260 VanDerWaalsContact C-N 3.34Å; P258-H260 PolarHBondContact O-N 2.85Å; H260-L264 WeakPolarHBondContact O-CB 3.2Å; H260-L264 PolarHBondContact O-N 3.21Å; H260-L292 VanDerWaalsContact CE1-CD2 3.49Å; H260-L292 WeakPolarHBondContact CE1-CD2 3.3Å; H260-Y353 AromaticContact CE1-CE2 3.99Å; H260-Y353 AromaticContact CE1-CZ 3.94Å; H260-Y353 PolarHBondContact CE1-OH 3.27Å; H260-Y353 PolarHBondContact ND1-OH 2.86Å
261	E	92.1	Very high	90.1	Very high	58 Å²	58	37 Å²	37	27%	0.271	18%	0.183	S	C	.	.	H	α-helix	trans	-69.5	-35.4	167.7	-72.1	-160.6	122.8	0	0	113	V210 K214 L257 P258 L264 K265	V210-E261 HydrophobicContact CG1-CG 3.79Å; V210-E261 HydrophobicContact CG2-CG 4.4Å; K214-E261 WeakPolarHBondContact CE-OE1 3.45Å; K214-E261 IonicContact NZ-OE1 2.66Å; K214-E261 PolarHBondContact NZ-OE1 3.16Å; L257-E261 HydrophobicContact CD1-CG 3.85Å; L257-E261 HydrophobicContact CG-CG 4.32Å; L257-E261 PolarHBondContact O-N 2.73Å; P258-E261 PolarHBondContact O-N 3.03Å; E261-L264 PolarHBondContact O-N 3.39Å; E261-K265 VanDerWaalsContact O-CG 3.29Å; E261-K265 WeakPolarHBondContact O-CG 3.29Å; E261-K265 PolarHBondContact O-N 2.99Å; E261-K265 VanDerWaalsContact O-N 3.09Å
262	M	90	Very high	90	Very high	33 Å²	33	35.1 Å²	35.1	16%	0.163	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-45.1	171.5	-71.9	177.2	73.8	0	0	111.4	M84 M87 E88 P258 I259 L264 K265 E266 F288	M84-M262 HydrophobicContact CE-SD 3.43Å; M84-M262 WeakPolarHBondContact CE-SD 3.23Å; M84-M262 HydrophobicContact SD-SD 4.26Å; M87-M262 HydrophobicContact CB-CE 4.07Å; M87-M262 HydrophobicContact CE-CE 4.49Å; M87-M262 HydrophobicContact CE-SD 4.47Å; E88-M262 HydrophobicContact CG-CE 3.9Å; P258-M262 WeakPolarHBondContact O-CG 3.47Å; P258-M262 PolarHBondContact O-N 3.35Å; I259-M262 PolarHBondContact O-N 2.9Å; M262-L264 VanDerWaalsContact C-N 3.29Å; M262-L264 PolarHBondContact O-N 3.38Å; M262-K265 PolarHBondContact O-N 3.43Å; M262-E266 PolarHBondContact O-N 2.87Å; M262-E266 VanDerWaalsContact O-N 3.09Å; M262-F288 HydrophobicContact CB-CE1 3.88Å; M262-F288 HydrophobicContact CB-CZ 3.99Å
263	L	92.3	Very high	89.9	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-39	175.2	178.1	53.7	0	0	0	111.5	Q206 I259 I267 T284 I285 F288 Y353	Q206-L263 HydrophobicContact CG-CG 4.37Å; I259-L263 PolarHBondContact O-N 3.47Å; L263-I267 HydrophobicContact CD1-CD1 3.56Å; L263-I267 HydrophobicContact CD1-CG1 3.93Å; L263-I267 HydrophobicContact CG-CD1 3.75Å; L263-I267 HydrophobicContact CG-CG1 4.5Å; L263-I267 WeakPolarHBondContact O-CB 3.35Å; L263-I267 VanDerWaalsContact O-CG1 3.27Å; L263-I267 WeakPolarHBondContact O-CG1 3.42Å; L263-I267 PolarHBondContact O-N 3.44Å; L263-T284 HydrophobicContact CD1-CG2 4.42Å; L263-I285 HydrophobicContact CD1-CD1 4.12Å; L263-F288 VanDerWaalsContact CA-CE1 3.48Å; L263-F288 HydrophobicContact CB-CD1 3.6Å; L263-F288 HydrophobicContact CB-CE1 3.59Å; L263-F288 HydrophobicContact CB-CG 4.13Å; L263-F288 HydrophobicContact CB-CZ 4.12Å; L263-F288 HydrophobicContact CD1-CB 3.88Å; L263-F288 HydrophobicContact CD1-CD1 4.05Å; L263-F288 HydrophobicContact CD1-CD2 3.74Å; L263-F288 HydrophobicContact CD1-CE1 4.48Å; L263-F288 HydrophobicContact CD1-CE2 4.21Å; L263-F288 HydrophobicContact CD1-CG 3.64Å; L263-F288 HydrophobicContact CD2-CB 4.32Å; L263-F288 HydrophobicContact CD2-CD1 4.45Å; L263-F288 HydrophobicContact CG-CD1 4.23Å; L263-F288 HydrophobicContact CG-CG 4.3Å; L263-F288 VanDerWaalsContact N-CE1 3.27Å; L263-Y353 HydrophobicContact CD2-CE1 4.08Å
264	L	93.5	Very high	89.8	Confident	30 Å²	30	41.5 Å²	41.5	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-44.8	174.6	-178.1	57.1	0	0	0	111.8	L203 Q206 N207 V210 H260 E261 M262 I267 D268	L203-L264 HydrophobicContact CD1-CD1 3.73Å; Q206-L264 HydrophobicContact CB-CD1 4.11Å; Q206-L264 HydrophobicContact CG-CB 3.78Å; Q206-L264 HydrophobicContact CG-CD1 3.88Å; Q206-L264 HydrophobicContact CG-CG 4.4Å; N207-L264 HydrophobicContact CB-CD1 4.01Å; V210-L264 HydrophobicContact CB-CD2 4.01Å; V210-L264 HydrophobicContact CG1-CD2 4.06Å; V210-L264 HydrophobicContact CG2-CB 4.16Å; V210-L264 HydrophobicContact CG2-CD2 3.98Å; H260-L264 WeakPolarHBondContact O-CB 3.2Å; H260-L264 PolarHBondContact O-N 3.21Å; E261-L264 PolarHBondContact O-N 3.39Å; M262-L264 VanDerWaalsContact C-N 3.29Å; M262-L264 PolarHBondContact O-N 3.38Å; L264-I267 PolarHBondContact O-N 2.84Å; L264-D268 WeakPolarHBondContact O-CB 3.32Å; L264-D268 PolarHBondContact O-N 3.39Å
265	K	91.1	Very high	89.7	Confident	130 Å²	130	39.7 Å²	39.7	57%	0.565	20%	0.203	S	C	*	.	H	α-helix	trans	-63	-42.1	179.3	-71.2	163.1	-174.7	171.8	0	112.7	E261 M262 K269	E261-K265 VanDerWaalsContact O-CG 3.29Å; E261-K265 WeakPolarHBondContact O-CG 3.29Å; E261-K265 PolarHBondContact O-N 2.99Å; E261-K265 VanDerWaalsContact O-N 3.09Å; M262-K265 PolarHBondContact O-N 3.43Å; K265-K269 WeakPolarHBondContact O-CB 3.36Å; K265-K269 PolarHBondContact O-N 3.12Å
266	E	91.1	Very high	89.8	Confident	39 Å²	39	38 Å²	38	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-75	-32.9	179.2	-69.1	-64.2	126.9	0	0	112.5	F91 M262 K269 V270 T284 F288	F91-E266 HydrophobicContact CD1-CG 4.49Å; F91-E266 HydrophobicContact CE1-CG 4.43Å; M262-E266 PolarHBondContact O-N 2.87Å; M262-E266 VanDerWaalsContact O-N 3.09Å; E266-K269 WeakPolarHBondContact OE1-CD 3.38Å; E266-K269 IonicContact OE1-NZ 3.88Å; E266-K269 PolarHBondContact OE1-NZ 2.88Å; E266-K269 IonicContact OE2-NZ 3.54Å; E266-K269 PolarHBondContact OE2-NZ 2.92Å; E266-V270 WeakPolarHBondContact O-CG2 3.29Å; E266-V270 PolarHBondContact O-N 3.2Å; E266-T284 HydrophobicContact CB-CG2 3.89Å; E266-F288 HydrophobicContact CB-CE2 4.24Å; E266-F288 HydrophobicContact CG-CE2 4.28Å; E266-F288 HydrophobicContact CG-CZ 4.46Å
267	I	92	Very high	89.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-45.7	169.8	-67.8	167	0	0	0	111	F202 L203 Q206 L263 L264 K269 V270 C271 M281 T284 I285	F202-I267 HydrophobicContact CB-CD1 4.35Å; F202-I267 HydrophobicContact CB-CG2 4.13Å; L203-I267 HydrophobicContact CB-CG2 3.81Å; L203-I267 HydrophobicContact CD1-CG2 4.16Å; Q206-I267 HydrophobicContact CB-CD1 4.08Å; Q206-I267 HydrophobicContact CG-CD1 4.08Å; L263-I267 HydrophobicContact CD1-CD1 3.56Å; L263-I267 HydrophobicContact CD1-CG1 3.93Å; L263-I267 HydrophobicContact CG-CD1 3.75Å; L263-I267 HydrophobicContact CG-CG1 4.5Å; L263-I267 WeakPolarHBondContact O-CB 3.35Å; L263-I267 VanDerWaalsContact O-CG1 3.27Å; L263-I267 WeakPolarHBondContact O-CG1 3.42Å; L263-I267 PolarHBondContact O-N 3.44Å; L264-I267 PolarHBondContact O-N 2.84Å; I267-K269 VanDerWaalsContact C-N 3.31Å; I267-K269 PolarHBondContact O-N 3.1Å; I267-V270 PolarHBondContact O-N 2.87Å; I267-V270 VanDerWaalsContact O-N 3.14Å; I267-C271 WeakPolarHBondContact O-CB 3.33Å; I267-C271 PolarHBondContact O-N 2.74Å; I267-C271 PolarHBondContact O-SG 3.38Å; I267-M281 HydrophobicContact CG1-SD 4.22Å; I267-M281 HydrophobicContact CG2-CE 4.14Å; I267-M281 HydrophobicContact CG2-SD 4.48Å; I267-T284 HydrophobicContact CG1-CG2 4.24Å; I267-I285 HydrophobicContact CD1-CD1 3.8Å; I267-I285 HydrophobicContact CG1-CD1 4.09Å
268	D	91.3	Very high	89.5	Confident	40 Å²	40	51.9 Å²	51.9	21%	0.214	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-43.8	177.5	-175.7	62.4	0	0	0	111.5	L203 L264 C271 S272 N824	L203-D268 HydrophobicContact CD1-CB 4Å; L264-D268 WeakPolarHBondContact O-CB 3.32Å; L264-D268 PolarHBondContact O-N 3.39Å; D268-C271 PolarHBondContact O-N 2.98Å; D268-S272 VanDerWaalsContact O-CB 3.24Å; D268-S272 WeakPolarHBondContact O-CB 3.26Å; D268-S272 PolarHBondContact O-N 3.45Å; D268-S272 PolarHBondContact O-OG 3.02Å; D268-N824 PolarHBondContact OD2-ND2 2.89Å
269	K	89.4	Confident	89.6	Confident	106 Å²	106	51.2 Å²	51.2	46%	0.461	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-37.8	174.2	172.6	-177.7	164.7	-155.7	0	113.6	K265 E266 I267 N273	K265-K269 WeakPolarHBondContact O-CB 3.36Å; K265-K269 PolarHBondContact O-N 3.12Å; E266-K269 WeakPolarHBondContact OE1-CD 3.38Å; E266-K269 IonicContact OE1-NZ 3.88Å; E266-K269 PolarHBondContact OE1-NZ 2.88Å; E266-K269 IonicContact OE2-NZ 3.54Å; E266-K269 PolarHBondContact OE2-NZ 2.92Å; I267-K269 VanDerWaalsContact C-N 3.31Å; I267-K269 PolarHBondContact O-N 3.1Å; K269-N273 PolarHBondContact O-ND2 3.3Å
270	V	91.1	Very high	89.8	Confident	16 Å²	16	54.5 Å²	54.5	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-51	172.9	161.1	0	0	0	0	110.8	E266 I267 S272 N273 W274 N280 M281	E266-V270 WeakPolarHBondContact O-CG2 3.29Å; E266-V270 PolarHBondContact O-N 3.2Å; I267-V270 PolarHBondContact O-N 2.87Å; I267-V270 VanDerWaalsContact O-N 3.14Å; V270-S272 VanDerWaalsContact C-N 3.3Å; V270-S272 PolarHBondContact O-N 2.95Å; V270-N273 CarbonylContact O-C 3.5Å; V270-N273 PolarHBondContact O-N 3.13Å; V270-N273 VanDerWaalsContact O-N 3.13Å; V270-W274 HydrophobicContact CG1-CE3 3.66Å; V270-W274 HydrophobicContact CG1-CZ3 3.7Å; V270-W274 PolarHBondContact O-N 3.08Å; V270-N280 VanDerWaalsContact CG1-OD1 3.27Å; V270-N280 WeakPolarHBondContact CG1-OD1 3.41Å; V270-M281 HydrophobicContact CB-CE 4.28Å; V270-M281 HydrophobicContact CG1-CE 3.51Å; V270-M281 HydrophobicContact CG1-SD 4.07Å
271	C	87.9	Confident	89.8	Confident	18 Å²	18	54.4 Å²	54.4	12%	0.122	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-32.7	179.6	-70.1	0	0	0	0	113.1	L203 I267 D268 N273 W274	L203-C271 HydrophobicContact CD2-CB 3.86Å; I267-C271 WeakPolarHBondContact O-CB 3.33Å; I267-C271 PolarHBondContact O-N 2.74Å; I267-C271 PolarHBondContact O-SG 3.38Å; D268-C271 PolarHBondContact O-N 2.98Å; C271-N273 PolarHBondContact O-N 2.66Å; C271-W274 WeakPolarHBondContact O-CB 3.28Å
272	S	87.9	Confident	89.9	Confident	69 Å²	69	51.7 Å²	51.7	48%	0.483	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-22.7	175.9	-64.6	0	0	0	0	113.7	D268 V270	D268-S272 VanDerWaalsContact O-CB 3.24Å; D268-S272 WeakPolarHBondContact O-CB 3.26Å; D268-S272 PolarHBondContact O-N 3.45Å; D268-S272 PolarHBondContact O-OG 3.02Å; V270-S272 VanDerWaalsContact C-N 3.3Å; V270-S272 PolarHBondContact O-N 2.95Å
273	N	87.1	Confident	89.9	Confident	125 Å²	125	56.7 Å²	56.7	67%	0.668	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	32.8	-178.3	-61	-79.8	0	0	0	111	K269 V270 C271	K269-N273 PolarHBondContact O-ND2 3.3Å; V270-N273 CarbonylContact O-C 3.5Å; V270-N273 PolarHBondContact O-N 3.13Å; V270-N273 VanDerWaalsContact O-N 3.13Å; C271-N273 PolarHBondContact O-N 2.66Å
274	W	88.1	Confident	89.8	Confident	26 Å²	26	57 Å²	57	10%	0.098	27%	0.271	C	S	.	.			trans	-83.5	125.1	-168.6	-172.8	-92.6	0	0	0	114	L195 H196 A199 V270 C271 S276 P279 N280 M281 Y360	L195-W274 HydrophobicContact CG-CZ2 4.33Å; H196-W274 AromaticContact CE1-CD1 3.91Å; H196-W274 AromaticContact CG-CD1 3.92Å; H196-W274 AromaticContact ND1-CD1 3.47Å; A199-W274 HydrophobicContact CB-CD2 3.86Å; A199-W274 HydrophobicContact CB-CE3 3.97Å; A199-W274 HydrophobicContact CB-CH2 3.81Å; A199-W274 HydrophobicContact CB-CZ2 3.67Å; A199-W274 HydrophobicContact CB-CZ3 3.95Å; V270-W274 HydrophobicContact CG1-CE3 3.66Å; V270-W274 HydrophobicContact CG1-CZ3 3.7Å; V270-W274 PolarHBondContact O-N 3.08Å; C271-W274 WeakPolarHBondContact O-CB 3.28Å; W274-S276 PolarHBondContact NE1-OG 3.28Å; W274-P279 HydrophobicContact CH2-CB 3.82Å; W274-P279 HydrophobicContact CZ2-CB 3.96Å; W274-N280 WeakPolarHBondContact CZ3-OD1 3.49Å; W274-M281 HydrophobicContact CH2-CB 4.24Å; W274-M281 HydrophobicContact CZ3-CB 4.06Å; W274-M281 HydrophobicContact CZ3-CE 4.5Å; W274-Y360 AromaticContact CH2-CE2 3.68Å; W274-Y360 HydrophobicContact CH2-CE2 3.68Å; W274-Y360 WeakPolarHBondContact CH2-OH 3.45Å; W274-Y360 HydrophobicContact CZ2-CE2 4.14Å
275	D	85.3	Confident	89.7	Confident	36 Å²	36	55.8 Å²	55.8	19%	0.193	27%	0.265	C	S	.	.			trans	-126.6	121.4	161.4	-171.2	-16.5	0	0	0	109.3	R277 Y278	D275-R277 PolarHBondContact O-N 3.48Å; D275-R277 VanDerWaalsContact O-N 3.15Å; D275-R277 VanDerWaalsContact OD1-CB 3.31Å; D275-R277 WeakPolarHBondContact OD1-CB 3.35Å; D275-R277 WeakPolarHBondContact OD1-CG 3.47Å; D275-R277 IonicContact OD1-CZ 2.7Å; D275-R277 PolarHBondContact OD1-N 3.1Å; D275-R277 IonicContact OD1-NE 2.69Å; D275-R277 PolarHBondContact OD1-NE 2.88Å; D275-R277 VanDerWaalsContact OD1-NE 3.11Å; D275-R277 IonicContact OD1-NH2 2.86Å; D275-R277 IonicContact OD2-CZ 3.87Å; D275-R277 VanDerWaalsContact OD2-CZ 3.27Å; D275-R277 IonicContact OD2-NE 3.19Å; D275-R277 PolarHBondContact OD2-NE 2.73Å; D275-R277 IonicContact OD2-NH2 3.88Å; D275-R277 PolarHBondContact OD2-NH2 3.49Å; D275-Y278 HydrophobicContact CB-CD2 4.4Å; D275-Y278 CarbonylContact O-C 3.52Å; D275-Y278 PolarHBondContact O-N 2.76Å
276	S	87.4	Confident	89.5	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.021	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.4	177.2	-66	0	0	0	0	113.5	Y181 L192 H196 W274 Y278	Y181-S276 PolarHBondContact OH-OG 3.46Å; L192-S276 WeakPolarHBondContact CD2-O 3.35Å; L192-S276 WeakPolarHBondContact O-CB 3.11Å; L192-S276 PolarHBondContact O-OG 3.46Å; H196-S276 PolarHBondContact N-OG 3.33Å; W274-S276 PolarHBondContact NE1-OG 3.28Å; S276-Y278 VanDerWaalsContact C-N 3.34Å
277	R	84.9	Confident	89.4	Confident	137 Å²	137	49.6 Å²	49.6	52%	0.517	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.6	171.2	-59.8	173.2	-65.7	-159.1	4.7	112.4	Y181 L192 D275 P279	Y181-R277 HydrophobicContact CD1-CG 4.18Å; L192-R277 HydrophobicContact CD1-CG 4.23Å; L192-R277 HydrophobicContact CD2-CG 4.39Å; D275-R277 PolarHBondContact O-N 3.48Å; D275-R277 VanDerWaalsContact O-N 3.15Å; D275-R277 VanDerWaalsContact OD1-CB 3.31Å; D275-R277 WeakPolarHBondContact OD1-CB 3.35Å; D275-R277 WeakPolarHBondContact OD1-CG 3.47Å; D275-R277 IonicContact OD1-CZ 2.7Å; D275-R277 PolarHBondContact OD1-N 3.1Å; D275-R277 IonicContact OD1-NE 2.69Å; D275-R277 PolarHBondContact OD1-NE 2.88Å; D275-R277 VanDerWaalsContact OD1-NE 3.11Å; D275-R277 IonicContact OD1-NH2 2.86Å; D275-R277 IonicContact OD2-CZ 3.87Å; D275-R277 VanDerWaalsContact OD2-CZ 3.27Å; D275-R277 IonicContact OD2-NE 3.19Å; D275-R277 PolarHBondContact OD2-NE 2.73Å; D275-R277 IonicContact OD2-NH2 3.88Å; D275-R277 PolarHBondContact OD2-NH2 3.49Å; R277-P279 VanDerWaalsContact C-CD 3.43Å
278	Y	87.9	Confident	89.2	Confident	176 Å²	176	49.8 Å²	49.8	69%	0.69	24%	0.243	S	C	*	.	S	Bend	trans	-130.6	58.4	178.9	-57.3	-69.2	0	0	0	111.5	D275 S276	D275-Y278 HydrophobicContact CB-CD2 4.4Å; D275-Y278 CarbonylContact O-C 3.52Å; D275-Y278 PolarHBondContact O-N 2.76Å; S276-Y278 VanDerWaalsContact C-N 3.34Å
279	P	90.6	Very high	89	Confident	28 Å²	28	47.9 Å²	47.9	18%	0.182	23%	0.233	C	C	.	.			trans	-67	142.3	-172.7	30.4	-36.1	0	0	0	112.1	L195 W274 R277 Y360 L364 E370	L195-P279 HydrophobicContact CD2-CB 4.13Å; L195-P279 HydrophobicContact CD2-CG 4.27Å; W274-P279 HydrophobicContact CH2-CB 3.82Å; W274-P279 HydrophobicContact CZ2-CB 3.96Å; R277-P279 VanDerWaalsContact C-CD 3.43Å; P279-Y360 WeakPolarHBondContact CB-OH 3.26Å; P279-L364 HydrophobicContact CB-CD2 3.98Å; P279-L364 HydrophobicContact CG-CD2 3.69Å; P279-E370 HydrophobicContact CB-CG 4.19Å; P279-E370 HydrophobicContact CG-CB 4.41Å; P279-E370 HydrophobicContact CG-CG 4.14Å; P279-E370 WeakPolarHBondContact O-CG 3.15Å
280	N	92	Very high	88.6	Confident	70 Å²	70	45.6 Å²	45.6	37%	0.374	23%	0.226	S	C	.	.			trans	-149.8	14.1	-170.4	62.3	19.9	0	0	0	115.7	V270 W274 S282 Y360 E370	V270-N280 VanDerWaalsContact CG1-OD1 3.27Å; V270-N280 WeakPolarHBondContact CG1-OD1 3.41Å; W274-N280 WeakPolarHBondContact CZ3-OD1 3.49Å; N280-S282 PolarHBondContact O-N 3.26Å; N280-Y360 PolarHBondContact N-OH 3.37Å; N280-E370 WeakPolarHBondContact CA-OE1 3.45Å; N280-E370 PolarHBondContact N-OE1 3.29Å
281	M	93.5	Very high	88.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.6	-31.5	-178.4	-172.6	61.2	74.6	0	0	113.3	A199 F202 I267 V270 W274 K283 T284 I285 Y360 E370	A199-M281 HydrophobicContact CB-CE 4.16Å; F202-M281 HydrophobicContact CB-CE 4.41Å; F202-M281 HydrophobicContact CD2-CE 4.49Å; F202-M281 HydrophobicContact CD2-CG 3.88Å; F202-M281 HydrophobicContact CD2-SD 4.44Å; F202-M281 HydrophobicContact CE2-CG 3.92Å; F202-M281 HydrophobicContact CG-CG 4.4Å; F202-M281 HydrophobicContact CG-SD 4.48Å; F202-M281 HydrophobicContact CZ-CG 4.47Å; I267-M281 HydrophobicContact CG1-SD 4.22Å; I267-M281 HydrophobicContact CG2-CE 4.14Å; I267-M281 HydrophobicContact CG2-SD 4.48Å; V270-M281 HydrophobicContact CB-CE 4.28Å; V270-M281 HydrophobicContact CG1-CE 3.51Å; V270-M281 HydrophobicContact CG1-SD 4.07Å; W274-M281 HydrophobicContact CH2-CB 4.24Å; W274-M281 HydrophobicContact CZ3-CB 4.06Å; W274-M281 HydrophobicContact CZ3-CE 4.5Å; M281-K283 VanDerWaalsContact C-N 3.34Å; M281-K283 PolarHBondContact O-N 3.19Å; M281-T284 PolarHBondContact O-N 3.41Å; M281-T284 VanDerWaalsContact O-N 3.12Å; M281-I285 HydrophobicContact CG-CG1 4.05Å; M281-I285 PolarHBondContact O-N 2.89Å; M281-I285 VanDerWaalsContact O-N 3.17Å; M281-I285 HydrophobicContact SD-CD1 4.31Å; M281-I285 HydrophobicContact SD-CG1 4.23Å; M281-Y360 HydrophobicContact CB-CE1 4.3Å; M281-Y360 HydrophobicContact CB-CE2 3.75Å; M281-Y360 WeakPolarHBondContact CB-OH 3.43Å; M281-Y360 PolarHBondContact N-OH 3.47Å; M281-Y360 VanDerWaalsContact N-OH 3.07Å; M281-E370 PolarHBondContact N-OE1 3.32Å
282	S	93.4	Very high	88	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-38	-172.5	-65.7	0	0	0	0	112.9	N280 T284 G286 M357 Y360 E370 A374	N280-S282 PolarHBondContact O-N 3.26Å; S282-T284 VanDerWaalsContact C-N 3.34Å; S282-T284 PolarHBondContact O-N 2.82Å; S282-G286 WeakPolarHBondContact O-CA 3.33Å; S282-G286 PolarHBondContact O-N 2.78Å; S282-M357 PolarHBondContact OG-SD 3.37Å; S282-Y360 VanDerWaalsContact OG-CE1 3.23Å; S282-Y360 WeakPolarHBondContact OG-CE1 3.4Å; S282-E370 WeakPolarHBondContact CB-OE1 3.42Å; S282-E370 PolarHBondContact N-OE1 3.33Å; S282-E370 PolarHBondContact OG-OE1 3.19Å; S282-A374 VanDerWaalsContact OG-CA 3.29Å; S282-A374 WeakPolarHBondContact OG-CA 3.41Å; S282-A374 VanDerWaalsContact OG-CB 3.29Å; S282-A374 WeakPolarHBondContact OG-CB 3.42Å
283	K	89.1	Confident	87.6	Confident	138 Å²	138	46.2 Å²	46.2	60%	0.6	22%	0.217	S	C	*	.	H	α-helix	trans	-59.9	-42.2	174.3	-177.3	176.4	178.3	179.6	0	112.3	M281 T287	M281-K283 VanDerWaalsContact C-N 3.34Å; M281-K283 PolarHBondContact O-N 3.19Å; K283-T287 WeakPolarHBondContact O-CB 3.47Å; K283-T287 PolarHBondContact O-N 2.81Å; K283-T287 VanDerWaalsContact O-N 3.07Å; K283-T287 PolarHBondContact O-OG1 2.84Å
284	T	90.3	Very high	87.4	Confident	10 Å²	10	41.2 Å²	41.2	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-55.9	179.8	-63.5	0	0	0	0	110.3	L263 E266 I267 M281 S282 G286 T287 F288	L263-T284 HydrophobicContact CD1-CG2 4.42Å; E266-T284 HydrophobicContact CB-CG2 3.89Å; I267-T284 HydrophobicContact CG1-CG2 4.24Å; M281-T284 PolarHBondContact O-N 3.41Å; M281-T284 VanDerWaalsContact O-N 3.12Å; S282-T284 VanDerWaalsContact C-N 3.34Å; S282-T284 PolarHBondContact O-N 2.82Å; T284-G286 PolarHBondContact O-N 2.92Å; T284-T287 PolarHBondContact O-N 2.95Å; T284-F288 WeakPolarHBondContact O-CD2 3.25Å; T284-F288 PolarHBondContact O-N 3.21Å
285	I	91.9	Very high	87.3	Confident	4 Å²	4	40 Å²	40	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-42	-178.8	-54.4	-58.7	0	0	0	111.6	F202 L263 I267 M281 T287 F288 A289 M357 L381	F202-I285 HydrophobicContact CD1-CD1 3.66Å; F202-I285 HydrophobicContact CD1-CG1 4.03Å; F202-I285 HydrophobicContact CE1-CD1 3.82Å; F202-I285 HydrophobicContact CE1-CG1 3.7Å; F202-I285 HydrophobicContact CE1-CG2 4.39Å; F202-I285 HydrophobicContact CG-CD1 4.43Å; F202-I285 HydrophobicContact CZ-CG1 4.15Å; L263-I285 HydrophobicContact CD1-CD1 4.12Å; I267-I285 HydrophobicContact CD1-CD1 3.8Å; I267-I285 HydrophobicContact CG1-CD1 4.09Å; M281-I285 HydrophobicContact CG-CG1 4.05Å; M281-I285 PolarHBondContact O-N 2.89Å; M281-I285 VanDerWaalsContact O-N 3.17Å; M281-I285 HydrophobicContact SD-CD1 4.31Å; M281-I285 HydrophobicContact SD-CG1 4.23Å; I285-T287 PolarHBondContact O-N 2.83Å; I285-F288 PolarHBondContact O-N 3.43Å; I285-F288 VanDerWaalsContact O-N 3.13Å; I285-A289 PolarHBondContact O-N 2.82Å; I285-M357 HydrophobicContact CB-CE 3.47Å; I285-M357 VanDerWaalsContact CB-CE 3.47Å; I285-M357 HydrophobicContact CG1-CE 3.57Å; I285-M357 HydrophobicContact CG2-CE 3.85Å; I285-L381 HydrophobicContact CG2-CD1 3.93Å
286	G	88.1	Confident	87.3	Confident	10 Å²	10	41 Å²	41	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-67.5	-18.6	178.4	0	0	0	0	0	114.8	S282 T284 K380	S282-G286 WeakPolarHBondContact O-CA 3.33Å; S282-G286 PolarHBondContact O-N 2.78Å; T284-G286 PolarHBondContact O-N 2.92Å; G286-K380 WeakPolarHBondContact O-CD 3.47Å; G286-K380 PolarHBondContact O-NZ 3.27Å
287	T	87.9	Confident	87.2	Confident	29 Å²	29	43.5 Å²	43.5	18%	0.178	21%	0.207	C	C	.	.	H	α-helix	trans	-80.6	-40.4	169.1	-55.4	0	0	0	0	111.1	L90 F91 K283 T284 I285 F291	L90-T287 HydrophobicContact CD1-CG2 4.21Å; F91-T287 HydrophobicContact CE1-CG2 4.35Å; F91-T287 HydrophobicContact CE2-CG2 3.92Å; F91-T287 HydrophobicContact CZ-CG2 3.54Å; K283-T287 WeakPolarHBondContact O-CB 3.47Å; K283-T287 PolarHBondContact O-N 2.81Å; K283-T287 VanDerWaalsContact O-N 3.07Å; K283-T287 PolarHBondContact O-OG1 2.84Å; T284-T287 PolarHBondContact O-N 2.95Å; I285-T287 PolarHBondContact O-N 2.83Å; T287-F291 VanDerWaalsContact O-CD2 3.29Å; T287-F291 WeakPolarHBondContact O-CD2 3.44Å; T287-F291 WeakPolarHBondContact O-CE2 3.48Å
288	F	88.9	Confident	87.4	Confident	3 Å²	3	37 Å²	37	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-78.8	-20.5	179.7	-81.8	-99.1	0	0	0	114.2	M87 F91 M262 L263 E266 T284 I285 D290 F291 L292	M87-F288 HydrophobicContact CE-CD1 3.42Å; M87-F288 VanDerWaalsContact CE-CD1 3.42Å; M87-F288 HydrophobicContact CE-CE1 3.11Å; M87-F288 HydrophobicContact CE-CG 4.43Å; M87-F288 HydrophobicContact CE-CZ 3.92Å; F91-F288 HydrophobicContact CE1-CE2 4.43Å; F91-F288 HydrophobicContact CE2-CD2 4.24Å; F91-F288 AromaticContact CE2-CE2 3.51Å; F91-F288 HydrophobicContact CE2-CE2 3.51Å; F91-F288 AromaticContact CE2-CZ 3.98Å; F91-F288 HydrophobicContact CE2-CZ 3.98Å; F91-F288 AromaticContact CZ-CD2 3.89Å; F91-F288 HydrophobicContact CZ-CD2 3.89Å; F91-F288 AromaticContact CZ-CE2 3.38Å; F91-F288 HydrophobicContact CZ-CE2 3.38Å; F91-F288 HydrophobicContact CZ-CZ 4.28Å; M262-F288 HydrophobicContact CB-CE1 3.88Å; M262-F288 HydrophobicContact CB-CZ 3.99Å; L263-F288 VanDerWaalsContact CA-CE1 3.48Å; L263-F288 HydrophobicContact CB-CD1 3.6Å; L263-F288 HydrophobicContact CB-CE1 3.59Å; L263-F288 HydrophobicContact CB-CG 4.13Å; L263-F288 HydrophobicContact CB-CZ 4.12Å; L263-F288 HydrophobicContact CD1-CB 3.88Å; L263-F288 HydrophobicContact CD1-CD1 4.05Å; L263-F288 HydrophobicContact CD1-CD2 3.74Å; L263-F288 HydrophobicContact CD1-CE1 4.48Å; L263-F288 HydrophobicContact CD1-CE2 4.21Å; L263-F288 HydrophobicContact CD1-CG 3.64Å; L263-F288 HydrophobicContact CD2-CB 4.32Å; L263-F288 HydrophobicContact CD2-CD1 4.45Å; L263-F288 HydrophobicContact CG-CD1 4.23Å; L263-F288 HydrophobicContact CG-CG 4.3Å; L263-F288 VanDerWaalsContact N-CE1 3.27Å; E266-F288 HydrophobicContact CB-CE2 4.24Å; E266-F288 HydrophobicContact CG-CE2 4.28Å; E266-F288 HydrophobicContact CG-CZ 4.46Å; T284-F288 WeakPolarHBondContact O-CD2 3.25Å; T284-F288 PolarHBondContact O-N 3.21Å; I285-F288 PolarHBondContact O-N 3.43Å; I285-F288 VanDerWaalsContact O-N 3.13Å; F288-D290 VanDerWaalsContact C-N 3.31Å; F288-D290 PolarHBondContact O-N 2.93Å; F288-F291 PolarHBondContact O-N 2.84Å; F288-L292 PolarHBondContact O-N 3.32Å
289	A	86.9	Confident	87.3	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-52.8	-42	-177.8	0	0	0	0	0	113.9	I285 F291 L292 K380 L381	I285-A289 PolarHBondContact O-N 2.82Å; A289-F291 VanDerWaalsContact C-N 3.27Å; A289-F291 PolarHBondContact O-N 2.71Å; A289-L292 WeakPolarHBondContact O-CB 3.46Å; A289-L292 PolarHBondContact O-N 2.98Å; A289-K380 HydrophobicContact CB-CB 3.94Å; A289-K380 HydrophobicContact CB-CD 4.32Å; A289-L381 HydrophobicContact CB-CD2 3.69Å; A289-L381 HydrophobicContact CB-CG 3.95Å
290	D	81.1	Confident	86.9	Confident	58 Å²	58	29.9 Å²	29.9	31%	0.31	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-66.7	-29.2	179.3	-71.9	-63.5	0	0	0	113	F288 K293 K380	F288-D290 VanDerWaalsContact C-N 3.31Å; F288-D290 PolarHBondContact O-N 2.93Å; D290-K293 WeakPolarHBondContact O-CD 3.28Å; D290-K293 WeakPolarHBondContact O-CG 3.45Å; D290-K380 WeakPolarHBondContact OD2-CD 3.43Å; D290-K380 WeakPolarHBondContact OD2-CE 3.33Å; D290-K380 IonicContact OD2-NZ 2.67Å; D290-K380 PolarHBondContact OD2-NZ 3.44Å
291	F	82.5	Confident	86.6	Confident	17 Å²	17	29.7 Å²	29.7	8%	0.075	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-87.9	-12.5	-178	-54.7	-63.1	0	0	0	113.4	I83 E86 M87 L90 T287 F288 A289 K293 C294	I83-F291 HydrophobicContact CB-CD1 4.14Å; I83-F291 HydrophobicContact CB-CE1 4.34Å; I83-F291 HydrophobicContact CG1-CD1 3.99Å; I83-F291 HydrophobicContact CG1-CE1 4.16Å; I83-F291 HydrophobicContact CG2-CB 4.42Å; I83-F291 HydrophobicContact CG2-CD1 3.47Å; I83-F291 VanDerWaalsContact CG2-CD1 3.47Å; I83-F291 HydrophobicContact CG2-CE1 4.06Å; I83-F291 HydrophobicContact CG2-CG 4.22Å; E86-F291 HydrophobicContact CG-CZ 4.31Å; M87-F291 HydrophobicContact CE-CB 4.4Å; M87-F291 HydrophobicContact CE-CD2 4.14Å; M87-F291 HydrophobicContact CE-CG 4.38Å; M87-F291 HydrophobicContact CG-CD1 4.04Å; M87-F291 HydrophobicContact CG-CD2 3.46Å; M87-F291 VanDerWaalsContact CG-CD2 3.46Å; M87-F291 HydrophobicContact CG-CE1 3.93Å; M87-F291 HydrophobicContact CG-CE2 3.37Å; M87-F291 HydrophobicContact CG-CG 3.8Å; M87-F291 HydrophobicContact CG-CZ 3.6Å; M87-F291 HydrophobicContact SD-CB 3.89Å; M87-F291 HydrophobicContact SD-CD1 4.02Å; M87-F291 HydrophobicContact SD-CD2 3.75Å; M87-F291 HydrophobicContact SD-CE1 4.49Å; M87-F291 HydrophobicContact SD-CE2 4.28Å; M87-F291 HydrophobicContact SD-CG 3.6Å; M87-F291 VanDerWaalsContact SD-CG 3.6Å; L90-F291 HydrophobicContact CD1-CE2 4.25Å; L90-F291 HydrophobicContact CD1-CZ 4.2Å; T287-F291 VanDerWaalsContact O-CD2 3.29Å; T287-F291 WeakPolarHBondContact O-CD2 3.44Å; T287-F291 WeakPolarHBondContact O-CE2 3.48Å; F288-F291 PolarHBondContact O-N 2.84Å; A289-F291 VanDerWaalsContact C-N 3.27Å; A289-F291 PolarHBondContact O-N 2.71Å; F291-K293 PolarHBondContact O-N 3.36Å; F291-C294 WeakPolarHBondContact O-CB 3.48Å; F291-C294 PolarHBondContact O-N 3.05Å; F291-C294 PolarHBondContact O-SG 3.23Å
292	L	82.4	Confident	86.2	Confident	6 Å²	6	30.6 Å²	30.6	3%	0.031	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-59.2	-15.7	171.7	-65.8	-179.3	0	0	0	113.3	H260 F288 A289 C294 C295 F350 Y353 L381	H260-L292 VanDerWaalsContact CE1-CD2 3.49Å; H260-L292 WeakPolarHBondContact CE1-CD2 3.3Å; F288-L292 PolarHBondContact O-N 3.32Å; A289-L292 WeakPolarHBondContact O-CB 3.46Å; A289-L292 PolarHBondContact O-N 2.98Å; L292-C294 PolarHBondContact O-N 2.84Å; L292-C294 VanDerWaalsContact O-N 3.1Å; L292-C295 WeakPolarHBondContact O-CB 3.23Å; L292-C295 PolarHBondContact O-N 3.03Å; L292-F350 HydrophobicContact CB-CD2 4.05Å; L292-F350 HydrophobicContact CB-CE2 3.98Å; L292-Y353 HydrophobicContact CD1-CD2 3.66Å; L292-Y353 HydrophobicContact CD1-CE2 4.17Å; L292-Y353 HydrophobicContact CD1-CG 4.35Å; L292-Y353 HydrophobicContact CD2-CD2 4.19Å; L292-Y353 HydrophobicContact CD2-CE2 3.83Å; L292-L381 HydrophobicContact CD1-CD2 3.51Å
293	K	81.1	Confident	85.4	Confident	92 Å²	92	33.2 Å²	33.2	40%	0.4	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-55.7	-19.7	169	-64.6	172	-168.3	158.6	0	113	D290 F291 C295 Q296 V384	D290-K293 WeakPolarHBondContact O-CD 3.28Å; D290-K293 WeakPolarHBondContact O-CG 3.45Å; F291-K293 PolarHBondContact O-N 3.36Å; K293-C295 PolarHBondContact O-N 3.26Å; K293-C295 VanDerWaalsContact O-N 3.11Å; K293-Q296 VanDerWaalsContact O-CB 3.26Å; K293-Q296 WeakPolarHBondContact O-CB 3.43Å; K293-Q296 VanDerWaalsContact O-CG 3.29Å; K293-Q296 WeakPolarHBondContact O-CG 3.25Å; K293-Q296 PolarHBondContact O-N 2.9Å; K293-V384 HydrophobicContact CG-CG1 4.08Å
294	C	83.2	Confident	85.2	Confident	20 Å²	20	30.3 Å²	30.3	14%	0.135	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-56.7	-22.8	171.2	66.8	0	0	0	0	114.3	I259 F291 L292 Q296 P297	I259-C294 HydrophobicContact CD1-CB 3.45Å; I259-C294 VanDerWaalsContact CD1-CB 3.45Å; I259-C294 VanDerWaalsContact CD1-SG 3.6Å; F291-C294 WeakPolarHBondContact O-CB 3.48Å; F291-C294 PolarHBondContact O-N 3.05Å; F291-C294 PolarHBondContact O-SG 3.23Å; L292-C294 PolarHBondContact O-N 2.84Å; L292-C294 VanDerWaalsContact O-N 3.1Å; C294-Q296 VanDerWaalsContact C-N 3.33Å; C294-P297 WeakPolarHBondContact O-CD 3.18Å
295	C	85.9	Confident	85.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.007	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-74.6	-18.8	174.4	-67.7	0	0	0	0	113.6	L292 K293 F298 L299 V346 F350	L292-C295 WeakPolarHBondContact O-CB 3.23Å; L292-C295 PolarHBondContact O-N 3.03Å; K293-C295 PolarHBondContact O-N 3.26Å; K293-C295 VanDerWaalsContact O-N 3.11Å; C295-F298 PolarHBondContact O-N 2.86Å; C295-F298 VanDerWaalsContact O-N 3.14Å; C295-L299 HydrophobicContact CB-CD1 3.93Å; C295-L299 HydrophobicContact CB-CG 4.4Å; C295-L299 WeakPolarHBondContact O-CG 3.26Å; C295-L299 PolarHBondContact O-N 3.49Å; C295-V346 HydrophobicContact CB-CG1 3.93Å; C295-F350 HydrophobicContact CB-CD2 4.28Å
296	Q	83.9	Confident	84.6	Confident	56 Å²	56	31.2 Å²	31.2	26%	0.262	17%	0.174	S	C	.	.	H	α-helix	trans	-54.8	-47.5	-172.5	-70.2	-179.7	-29.9	0	0	113.9	K293 C294 F298 L299 D300 V388	K293-Q296 VanDerWaalsContact O-CB 3.26Å; K293-Q296 WeakPolarHBondContact O-CB 3.43Å; K293-Q296 VanDerWaalsContact O-CG 3.29Å; K293-Q296 WeakPolarHBondContact O-CG 3.25Å; K293-Q296 PolarHBondContact O-N 2.9Å; C294-Q296 VanDerWaalsContact C-N 3.33Å; Q296-F298 PolarHBondContact O-N 3.08Å; Q296-L299 PolarHBondContact O-N 2.88Å; Q296-D300 WeakPolarHBondContact O-CB 3.37Å; Q296-D300 PolarHBondContact O-N 3.44Å; Q296-V388 HydrophobicContact CG-CG2 3.72Å
297	P	85.6	Confident	84.3	Confident	56 Å²	56	35.6 Å²	35.6	36%	0.364	20%	0.195	S	C	.	.	H	α-helix	trans	-62.8	-28	-179	-23	35.2	0	0	0	114	I252 C294 N301	I252-P297 HydrophobicContact CG2-CB 4.4Å; C294-P297 WeakPolarHBondContact O-CD 3.18Å; P297-N301 PolarHBondContact O-ND2 3.39Å
298	F	88.6	Confident	84.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-74.2	-47.7	171.8	175.2	-97.3	0	0	0	110.9	I252 M253 I256 C295 Q296 N301 K302 F305 L343 V346	I252-F298 HydrophobicContact CB-CB 4.5Å; I252-F298 HydrophobicContact CG2-CB 3.73Å; M253-F298 HydrophobicContact CE-CD2 3.71Å; M253-F298 HydrophobicContact CE-CE1 4.19Å; M253-F298 HydrophobicContact CE-CE2 3.34Å; M253-F298 HydrophobicContact CE-CG 4.28Å; M253-F298 HydrophobicContact CE-CZ 3.6Å; I256-F298 HydrophobicContact CD1-CB 3.93Å; C295-F298 PolarHBondContact O-N 2.86Å; C295-F298 VanDerWaalsContact O-N 3.14Å; Q296-F298 PolarHBondContact O-N 3.08Å; F298-N301 CarbonylContact O-C 3.28Å; F298-N301 PolarHBondContact O-N 2.67Å; F298-K302 HydrophobicContact CE1-CB 4.35Å; F298-K302 HydrophobicContact CE1-CD 4.25Å; F298-K302 HydrophobicContact CE1-CG 3.99Å; F298-K302 HydrophobicContact CZ-CG 4.13Å; F298-K302 PolarHBondContact O-N 2.79Å; F298-F305 HydrophobicContact CD2-CD2 4.02Å; F298-F305 AromaticContact CD2-CE2 3.95Å; F298-F305 HydrophobicContact CD2-CE2 3.95Å; F298-F305 AromaticContact CE2-CD2 3.84Å; F298-F305 HydrophobicContact CE2-CD2 3.84Å; F298-F305 HydrophobicContact CE2-CE2 4.23Å; F298-L343 WeakPolarHBondContact CE1-O 3.43Å; F298-L343 HydrophobicContact CE2-CD2 4.1Å; F298-L343 HydrophobicContact CZ-CB 4.1Å; F298-L343 HydrophobicContact CZ-CD2 3.89Å; F298-L343 HydrophobicContact CZ-CG 4.49Å; F298-V346 HydrophobicContact CD1-CB 3.67Å; F298-V346 HydrophobicContact CD1-CG1 3.67Å; F298-V346 HydrophobicContact CD1-CG2 3.72Å; F298-V346 HydrophobicContact CE1-CB 3.72Å; F298-V346 HydrophobicContact CE1-CG1 4.26Å; F298-V346 HydrophobicContact CE1-CG2 3.65Å; F298-V346 HydrophobicContact CG-CG2 4.46Å; F298-V346 HydrophobicContact CZ-CG2 4.36Å
299	L	85.6	Confident	84.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-51.7	-176	-66.2	173.6	0	0	0	110.8	C295 Q296 N301 K302 V346 H347 F350 V388 M392	C295-L299 HydrophobicContact CB-CD1 3.93Å; C295-L299 HydrophobicContact CB-CG 4.4Å; C295-L299 WeakPolarHBondContact O-CG 3.26Å; C295-L299 PolarHBondContact O-N 3.49Å; Q296-L299 PolarHBondContact O-N 2.88Å; L299-N301 PolarHBondContact O-N 2.78Å; L299-K302 WeakPolarHBondContact O-CB 3.48Å; L299-K302 PolarHBondContact O-N 3.41Å; L299-V346 HydrophobicContact CD2-CB 4.33Å; L299-V346 HydrophobicContact CD2-CG1 3.96Å; L299-V346 HydrophobicContact CG-CG1 4.22Å; L299-H347 HydrophobicContact CD2-CB 3.58Å; L299-F350 HydrophobicContact CD1-CD1 4.29Å; L299-F350 HydrophobicContact CD1-CG 4.32Å; L299-V388 HydrophobicContact CB-CG1 4.4Å; L299-V388 HydrophobicContact CD1-CG1 3.78Å; L299-M392 HydrophobicContact CB-SD 4.34Å; L299-M392 VanDerWaalsContact O-CE 3.28Å; L299-M392 WeakPolarHBondContact O-CE 3.42Å
300	D	83.4	Confident	83.9	Confident	55 Å²	55	39.6 Å²	39.6	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-47.7	-36	176.5	-67.2	-31	0	0	0	113.2	Q296 K391	Q296-D300 WeakPolarHBondContact O-CB 3.37Å; Q296-D300 PolarHBondContact O-N 3.44Å; D300-K391 VanDerWaalsContact OD1-CD 3.23Å; D300-K391 WeakPolarHBondContact OD1-CD 3.49Å; D300-K391 WeakPolarHBondContact OD1-CE 3.24Å; D300-K391 IonicContact OD1-NZ 2.67Å; D300-K391 PolarHBondContact OD1-NZ 3.25Å; D300-K391 IonicContact OD2-NZ 2.71Å; D300-K391 PolarHBondContact OD2-NZ 3.28Å
301	N	84.6	Confident	84.1	Confident	67 Å²	67	41.1 Å²	41.1	36%	0.358	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	3.6	-176.6	-66	-84.3	0	0	0	113.1	P297 F298 L299 A303 D304 F305	P297-N301 PolarHBondContact O-ND2 3.39Å; F298-N301 CarbonylContact O-C 3.28Å; F298-N301 PolarHBondContact O-N 2.67Å; L299-N301 PolarHBondContact O-N 2.78Å; N301-A303 PolarHBondContact O-N 3.47Å; N301-D304 WeakPolarHBondContact O-CA 3.44Å; N301-D304 VanDerWaalsContact O-CB 3.3Å; N301-D304 WeakPolarHBondContact O-CB 3.22Å; N301-D304 PolarHBondContact O-N 3.27Å; N301-D304 VanDerWaalsContact O-N 3.09Å; N301-F305 HydrophobicContact CB-CD2 4.01Å; N301-F305 HydrophobicContact CB-CE1 4.26Å; N301-F305 HydrophobicContact CB-CE2 3.42Å; N301-F305 VanDerWaalsContact CB-CE2 3.42Å; N301-F305 HydrophobicContact CB-CZ 3.56Å; N301-F305 VanDerWaalsContact O-CD2 3.26Å; N301-F305 WeakPolarHBondContact O-CD2 3.47Å; N301-F305 WeakPolarHBondContact O-CG 3.44Å; N301-F305 PolarHBondContact O-N 3.19Å
302	K	84.8	Confident	84.3	Confident	19 Å²	19	40.6 Å²	40.6	8%	0.083	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-45.9	-172.2	-171.4	-171.8	67.2	163	0	112.1	F298 L299 D304 F305 L306 D344 M392	F298-K302 HydrophobicContact CE1-CB 4.35Å; F298-K302 HydrophobicContact CE1-CD 4.25Å; F298-K302 HydrophobicContact CE1-CG 3.99Å; F298-K302 HydrophobicContact CZ-CG 4.13Å; F298-K302 PolarHBondContact O-N 2.79Å; L299-K302 WeakPolarHBondContact O-CB 3.48Å; L299-K302 PolarHBondContact O-N 3.41Å; K302-D304 VanDerWaalsContact C-N 3.3Å; K302-D304 PolarHBondContact O-N 2.86Å; K302-F305 PolarHBondContact O-N 3.34Å; K302-L306 HydrophobicContact CD-CD1 4.49Å; K302-L306 HydrophobicContact CG-CD1 4.03Å; K302-L306 HydrophobicContact CG-CG 4.46Å; K302-L306 WeakPolarHBondContact O-CB 3.4Å; K302-L306 WeakPolarHBondContact O-CD1 3.3Å; K302-L306 WeakPolarHBondContact O-CG 3.42Å; K302-L306 PolarHBondContact O-N 2.67Å; K302-D344 IonicContact NZ-OD1 3.83Å; K302-D344 PolarHBondContact NZ-OD1 3.34Å; K302-M392 HydrophobicContact CB-CE 4.45Å
303	A	78.2	Confident	84.4	Confident	56 Å²	56	41.8 Å²	41.8	46%	0.463	22%	0.22	S	C	.	.	H	α-helix	trans	-60.5	-41.5	177.3	0	0	0	0	0	111.7	N301 L306 N307	N301-A303 PolarHBondContact O-N 3.47Å; A303-L306 PolarHBondContact O-N 3.44Å; A303-N307 WeakPolarHBondContact O-CB 3.35Å; A303-N307 PolarHBondContact O-N 2.84Å; A303-N307 PolarHBondContact O-ND2 3.08Å
304	D	84.8	Confident	84.4	Confident	77 Å²	77	42.7 Å²	42.7	41%	0.412	23%	0.229	S	C	.	.	H	α-helix	trans	-64.2	-42.5	177.2	-119	46.8	0	0	0	112.1	N301 K302 K308	N301-D304 WeakPolarHBondContact O-CA 3.44Å; N301-D304 VanDerWaalsContact O-CB 3.3Å; N301-D304 WeakPolarHBondContact O-CB 3.22Å; N301-D304 PolarHBondContact O-N 3.27Å; N301-D304 VanDerWaalsContact O-N 3.09Å; K302-D304 VanDerWaalsContact C-N 3.3Å; K302-D304 PolarHBondContact O-N 2.86Å; D304-K308 WeakPolarHBondContact O-CB 3.21Å; D304-K308 VanDerWaalsContact O-CD 3.27Å; D304-K308 WeakPolarHBondContact O-CD 3.25Å; D304-K308 WeakPolarHBondContact O-CG 3.4Å; D304-K308 PolarHBondContact O-N 3.14Å; D304-K308 VanDerWaalsContact OD2-CE 3.28Å; D304-K308 WeakPolarHBondContact OD2-CE 3.18Å; D304-K308 IonicContact OD2-NZ 3.38Å; D304-K308 PolarHBondContact OD2-NZ 3Å
305	F	88.5	Confident	84.5	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.022	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-42.2	174.7	-62.5	-40.9	0	0	0	112.4	V245 Q248 I249 I252 F298 N301 K302 L309	V245-F305 HydrophobicContact CG2-CB 4.37Å; V245-F305 HydrophobicContact CG2-CD1 4.12Å; Q248-F305 HydrophobicContact CB-CE1 3.82Å; I249-F305 HydrophobicContact CD1-CB 4.22Å; I249-F305 HydrophobicContact CG1-CB 4.18Å; I249-F305 HydrophobicContact CG1-CD1 4.2Å; I249-F305 HydrophobicContact CG1-CD2 4.26Å; I249-F305 HydrophobicContact CG1-CG 3.97Å; I252-F305 HydrophobicContact CD1-CE2 3.83Å; I252-F305 HydrophobicContact CD1-CZ 3.64Å; F298-F305 HydrophobicContact CD2-CD2 4.02Å; F298-F305 AromaticContact CD2-CE2 3.95Å; F298-F305 HydrophobicContact CD2-CE2 3.95Å; F298-F305 AromaticContact CE2-CD2 3.84Å; F298-F305 HydrophobicContact CE2-CD2 3.84Å; F298-F305 HydrophobicContact CE2-CE2 4.23Å; N301-F305 HydrophobicContact CB-CD2 4.01Å; N301-F305 HydrophobicContact CB-CE1 4.26Å; N301-F305 HydrophobicContact CB-CE2 3.42Å; N301-F305 VanDerWaalsContact CB-CE2 3.42Å; N301-F305 HydrophobicContact CB-CZ 3.56Å; N301-F305 VanDerWaalsContact O-CD2 3.26Å; N301-F305 WeakPolarHBondContact O-CD2 3.47Å; N301-F305 WeakPolarHBondContact O-CG 3.44Å; N301-F305 PolarHBondContact O-N 3.19Å; K302-F305 PolarHBondContact O-N 3.34Å; F305-L309 WeakPolarHBondContact O-CB 3.48Å; F305-L309 PolarHBondContact O-N 3.01Å
306	L	81.2	Confident	84.5	Confident	28 Å²	28	47.2 Å²	47.2	15%	0.147	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-48.5	175.2	-72.4	165	0	0	0	110.9	K302 A303 L309 L310 I340 L343	K302-L306 HydrophobicContact CD-CD1 4.49Å; K302-L306 HydrophobicContact CG-CD1 4.03Å; K302-L306 HydrophobicContact CG-CG 4.46Å; K302-L306 WeakPolarHBondContact O-CB 3.4Å; K302-L306 WeakPolarHBondContact O-CD1 3.3Å; K302-L306 WeakPolarHBondContact O-CG 3.42Å; K302-L306 PolarHBondContact O-N 2.67Å; A303-L306 PolarHBondContact O-N 3.44Å; L306-L309 PolarHBondContact O-N 3.08Å; L306-L310 VanDerWaalsContact O-CB 3.3Å; L306-L310 WeakPolarHBondContact O-CB 3.45Å; L306-L310 WeakPolarHBondContact O-CD1 3.38Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 2.9Å; L306-I340 HydrophobicContact CD2-CB 4.49Å; L306-I340 HydrophobicContact CD2-CG2 3.68Å; L306-I340 WeakPolarHBondContact CD2-O 3.36Å; L306-L343 HydrophobicContact CD2-CB 4.15Å; L306-L343 HydrophobicContact CD2-CD1 4.02Å; L306-L343 HydrophobicContact CG-CD1 4.45Å
307	N	80.4	Confident	84.5	Confident	101 Å²	101	50.3 Å²	50.3	54%	0.54	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-47.9	179.4	-71.1	-21.3	0	0	0	112	A303 L309 L310 Q311	A303-N307 WeakPolarHBondContact O-CB 3.35Å; A303-N307 PolarHBondContact O-N 2.84Å; A303-N307 PolarHBondContact O-ND2 3.08Å; N307-L309 VanDerWaalsContact C-N 3.35Å; N307-L309 PolarHBondContact O-N 3.49Å; N307-L310 PolarHBondContact O-N 2.88Å; N307-Q311 WeakPolarHBondContact O-CB 3.09Å; N307-Q311 PolarHBondContact O-N 3.04Å
308	K	86.8	Confident	84.5	Confident	70 Å²	70	51 Å²	51	30%	0.304	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-38.5	178.1	-70.5	161.2	-170.5	163.8	0	112.4	V245 D304 L312	V245-K308 HydrophobicContact CB-CB 4.07Å; V245-K308 HydrophobicContact CG2-CB 3.75Å; D304-K308 WeakPolarHBondContact O-CB 3.21Å; D304-K308 VanDerWaalsContact O-CD 3.27Å; D304-K308 WeakPolarHBondContact O-CD 3.25Å; D304-K308 WeakPolarHBondContact O-CG 3.4Å; D304-K308 PolarHBondContact O-N 3.14Å; D304-K308 VanDerWaalsContact OD2-CE 3.28Å; D304-K308 WeakPolarHBondContact OD2-CE 3.18Å; D304-K308 IonicContact OD2-NZ 3.38Å; D304-K308 PolarHBondContact OD2-NZ 3Å; K308-L312 WeakPolarHBondContact O-CB 3.43Å; K308-L312 PolarHBondContact O-N 3.46Å
309	L	87.4	Confident	84.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-73	-37.1	178	-172.4	65.4	0	0	0	112.3	V245 V246 F305 L306 N307 R313 F319 V339 I340 L343	V245-L309 HydrophobicContact CG1-CB 4.25Å; V245-L309 HydrophobicContact CG1-CD1 3.89Å; V246-L309 HydrophobicContact CG2-CD1 4.44Å; F305-L309 WeakPolarHBondContact O-CB 3.48Å; F305-L309 PolarHBondContact O-N 3.01Å; L306-L309 PolarHBondContact O-N 3.08Å; N307-L309 VanDerWaalsContact C-N 3.35Å; N307-L309 PolarHBondContact O-N 3.49Å; L309-R313 WeakPolarHBondContact O-CG 3.34Å; L309-R313 PolarHBondContact O-N 3.41Å; L309-R313 VanDerWaalsContact O-N 3.11Å; L309-F319 HydrophobicContact CD1-CE1 3.69Å; L309-F319 HydrophobicContact CD1-CZ 3.72Å; L309-V339 HydrophobicContact CD2-CG1 3.88Å; L309-I340 HydrophobicContact CD2-CG1 3.82Å; L309-I340 HydrophobicContact CG-CG1 4.22Å; L309-L343 HydrophobicContact CD2-CD1 4.18Å
310	L	82.6	Confident	84.5	Confident	48 Å²	48	51.7 Å²	51.7	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-63.4	-44.5	171.2	-83.7	162.9	0	0	0	111.8	L306 N307 R313 N314 I340 R523	L306-L310 VanDerWaalsContact O-CB 3.3Å; L306-L310 WeakPolarHBondContact O-CB 3.45Å; L306-L310 WeakPolarHBondContact O-CD1 3.38Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 2.9Å; N307-L310 PolarHBondContact O-N 2.88Å; L310-R313 PolarHBondContact O-N 3.05Å; L310-N314 PolarHBondContact O-N 3.17Å; L310-N314 VanDerWaalsContact O-N 3.16Å; L310-N314 PolarHBondContact O-ND2 2.9Å; L310-I340 HydrophobicContact CD2-CD1 3.72Å; L310-I340 HydrophobicContact CG-CD1 3.98Å; L310-R523 VanDerWaalsContact CD2-NH1 3.33Å
311	Q	84.1	Confident	84.5	Confident	90 Å²	90	49.9 Å²	49.9	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-51.8	176.5	179.1	173.6	6.6	0	0	110.9	N307 R313 N314 E315	N307-Q311 WeakPolarHBondContact O-CB 3.09Å; N307-Q311 PolarHBondContact O-N 3.04Å; Q311-R313 VanDerWaalsContact C-N 3.32Å; Q311-R313 PolarHBondContact O-N 2.91Å; Q311-N314 WeakPolarHBondContact O-CB 3.45Å; Q311-N314 PolarHBondContact O-N 3.49Å; Q311-E315 VanDerWaalsContact CG-CD 3.44Å; Q311-E315 HydrophobicContact CG-CG 4.28Å; Q311-E315 WeakPolarHBondContact CG-OE1 3.42Å; Q311-E315 PolarHBondContact NE2-OE1 3.11Å; Q311-E315 WeakPolarHBondContact O-CG 3.34Å; Q311-E315 PolarHBondContact O-N 3.28Å
312	L	86.3	Confident	84.7	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-38	-179.4	-174.6	59.4	0	0	0	112.4	V245 K308 N314 E315 D316 F319	V245-L312 HydrophobicContact CG1-CD2 4.14Å; K308-L312 WeakPolarHBondContact O-CB 3.43Å; K308-L312 PolarHBondContact O-N 3.46Å; L312-N314 VanDerWaalsContact C-N 3.3Å; L312-N314 PolarHBondContact O-N 3.35Å; L312-E315 PolarHBondContact O-N 3.23Å; L312-D316 HydrophobicContact CD1-CB 3.96Å; L312-D316 WeakPolarHBondContact O-CA 3.49Å; L312-D316 VanDerWaalsContact O-CB 3.3Å; L312-D316 WeakPolarHBondContact O-CB 3.27Å; L312-D316 PolarHBondContact O-N 3.29Å; L312-F319 HydrophobicContact CB-CD1 4.44Å; L312-F319 HydrophobicContact CB-CE1 4.43Å; L312-F319 HydrophobicContact CD2-CD1 3.99Å; L312-F319 HydrophobicContact CD2-CD2 3.84Å; L312-F319 HydrophobicContact CD2-CE1 3.82Å; L312-F319 HydrophobicContact CD2-CE2 3.65Å; L312-F319 HydrophobicContact CD2-CG 4.03Å; L312-F319 HydrophobicContact CD2-CZ 3.65Å; L312-F319 HydrophobicContact CG-CD1 3.75Å; L312-F319 HydrophobicContact CG-CD2 4.24Å; L312-F319 HydrophobicContact CG-CE1 3.97Å; L312-F319 HydrophobicContact CG-CE2 4.43Å; L312-F319 HydrophobicContact CG-CG 3.92Å; L312-F319 HydrophobicContact CG-CZ 4.31Å
313	R	85.3	Confident	84.8	Confident	31 Å²	31	45.8 Å²	45.8	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-71.4	-18.5	173.7	-70.4	-179.7	72.3	158.4	10.3	114.7	L309 L310 Q311 F319 D320 T323 E327	L309-R313 WeakPolarHBondContact O-CG 3.34Å; L309-R313 PolarHBondContact O-N 3.41Å; L309-R313 VanDerWaalsContact O-N 3.11Å; L310-R313 PolarHBondContact O-N 3.05Å; Q311-R313 VanDerWaalsContact C-N 3.32Å; Q311-R313 PolarHBondContact O-N 2.91Å; R313-F319 HydrophobicContact CG-CD1 3.8Å; R313-F319 HydrophobicContact CG-CE1 3.79Å; R313-D320 HydrophobicContact CB-CB 4.16Å; R313-D320 HydrophobicContact CG-CB 4.39Å; R313-D320 IonicContact CZ-OD1 3.24Å; R313-D320 IonicContact NE-OD1 3.48Å; R313-D320 PolarHBondContact NE-OD1 2.95Å; R313-D320 IonicContact NH2-OD1 3.4Å; R313-D320 PolarHBondContact NH2-OD1 2.81Å; R313-D320 WeakPolarHBondContact O-CB 3.29Å; R313-T323 VanDerWaalsContact NH1-CG2 3.34Å; R313-E327 IonicContact CZ-OE1 2.94Å; R313-E327 IonicContact CZ-OE2 2.69Å; R313-E327 VanDerWaalsContact NH1-CD 3.35Å; R313-E327 IonicContact NH1-OE1 3.69Å; R313-E327 PolarHBondContact NH1-OE1 3.06Å; R313-E327 IonicContact NH1-OE2 2.62Å; R313-E327 PolarHBondContact NH1-OE2 3.05Å; R313-E327 IonicContact NH2-OE1 2.78Å; R313-E327 IonicContact NH2-OE2 3.86Å; R313-E327 PolarHBondContact NH2-OE2 3.43Å; R313-E327 VanDerWaalsContact NH2-OE2 3.09Å
314	N	81.4	Confident	85	Confident	111 Å²	111	43.8 Å²	43.8	59%	0.594	21%	0.212	S	C	*	.	H	α-helix	trans	-87	-35.6	173.9	-67.5	-21.5	0	0	0	111.5	L310 Q311 L312	L310-N314 PolarHBondContact O-N 3.17Å; L310-N314 VanDerWaalsContact O-N 3.16Å; L310-N314 PolarHBondContact O-ND2 2.9Å; Q311-N314 WeakPolarHBondContact O-CB 3.45Å; Q311-N314 PolarHBondContact O-N 3.49Å; L312-N314 VanDerWaalsContact C-N 3.3Å; L312-N314 PolarHBondContact O-N 3.35Å
315	E	85.8	Confident	84.9	Confident	97 Å²	97	41 Å²	41	45%	0.453	20%	0.197	S	C	.	.	H	α-helix	trans	-81.5	-41.8	-178.7	-68.9	171.8	171.9	0	0	112.5	H239 Q311 L312	H239-E315 IonicContact CD2-OE2 2.71Å; H239-E315 IonicContact CE1-OE2 2.74Å; H239-E315 PolarHBondContact CE1-OE2 3.31Å; H239-E315 IonicContact NE2-OE2 2.71Å; H239-E315 PolarHBondContact NE2-OE2 3.47Å; Q311-E315 VanDerWaalsContact CG-CD 3.44Å; Q311-E315 HydrophobicContact CG-CG 4.28Å; Q311-E315 WeakPolarHBondContact CG-OE1 3.42Å; Q311-E315 PolarHBondContact NE2-OE1 3.11Å; Q311-E315 WeakPolarHBondContact O-CG 3.34Å; Q311-E315 PolarHBondContact O-N 3.28Å; L312-E315 PolarHBondContact O-N 3.23Å
316	D	86.3	Confident	84.8	Confident	18 Å²	18	40.8 Å²	40.8	10%	0.096	20%	0.196	C	C	.	.			trans	-111.3	110.4	-171.6	-168	-41.5	0	0	0	111.7	R233 L312 E318 F319 D320	R233-D316 IonicContact CZ-OD1 3.95Å; R233-D316 IonicContact CZ-OD2 2.71Å; R233-D316 IonicContact NH1-OD1 2.69Å; R233-D316 PolarHBondContact NH1-OD1 2.85Å; R233-D316 IonicContact NH1-OD2 2.86Å; R233-D316 PolarHBondContact NH1-OD2 3.09Å; R233-D316 IonicContact NH2-OD2 2.69Å; R233-D316 PolarHBondContact NH2-OD2 3.4Å; L312-D316 HydrophobicContact CD1-CB 3.96Å; L312-D316 WeakPolarHBondContact O-CA 3.49Å; L312-D316 VanDerWaalsContact O-CB 3.3Å; L312-D316 WeakPolarHBondContact O-CB 3.27Å; L312-D316 PolarHBondContact O-N 3.29Å; D316-E318 PolarHBondContact OD1-N 3.43Å; D316-F319 HydrophobicContact CB-CB 3.77Å; D316-F319 WeakPolarHBondContact OD1-CB 3.21Å; D316-F319 PolarHBondContact OD1-N 3.16Å; D316-D320 PolarHBondContact O-N 3.21Å; D316-D320 VanDerWaalsContact O-N 3.08Å
317	K	83.1	Confident	84.8	Confident	122 Å²	122	39.9 Å²	39.9	53%	0.53	19%	0.191	S	C	.	.	H	α-helix	trans	-74.7	-36.5	-173.8	-64.9	171.9	-171.8	164.4	0	112.4	D320 E321	K317-D320 PolarHBondContact O-N 3.17Å; K317-E321 WeakPolarHBondContact O-CB 3.46Å; K317-E321 PolarHBondContact O-N 3.11Å
318	E	84.8	Confident	84.6	Confident	71 Å²	71	36.3 Å²	36.3	33%	0.332	17%	0.173	S	C	.	.	H	α-helix	trans	-72.5	-33.8	178	-64.1	76.7	-124.4	0	0	110.7	V231 R233 L235 D316 A322	V231-E318 HydrophobicContact CG1-CG 4.24Å; R233-E318 IonicContact CZ-OE2 2.68Å; R233-E318 IonicContact NH1-OE2 2.59Å; R233-E318 PolarHBondContact NH1-OE2 2.75Å; L235-E318 HydrophobicContact CD2-CB 3.91Å; D316-E318 PolarHBondContact OD1-N 3.43Å; E318-A322 VanDerWaalsContact O-CB 3.26Å; E318-A322 WeakPolarHBondContact O-CB 3.39Å; E318-A322 PolarHBondContact O-N 2.98Å
319	F	89.6	Confident	84.1	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	18%	0.181	C	C	.	.	H	α-helix	trans	-67.4	-40.6	172.2	-175.7	-85.7	0	0	0	112.9	Y220 M224 L235 V246 L309 L312 R313 D316 T323	Y220-F319 WeakPolarHBondContact OH-CZ 3.37Å; M224-F319 HydrophobicContact CG-CE2 4.43Å; M224-F319 HydrophobicContact SD-CD2 4.34Å; M224-F319 HydrophobicContact SD-CE2 3.96Å; M224-F319 HydrophobicContact SD-CZ 4.33Å; L235-F319 HydrophobicContact CB-CD2 4.36Å; V246-F319 HydrophobicContact CG2-CE2 3.81Å; V246-F319 HydrophobicContact CG2-CZ 3.6Å; L309-F319 HydrophobicContact CD1-CE1 3.69Å; L309-F319 HydrophobicContact CD1-CZ 3.72Å; L312-F319 HydrophobicContact CB-CD1 4.44Å; L312-F319 HydrophobicContact CB-CE1 4.43Å; L312-F319 HydrophobicContact CD2-CD1 3.99Å; L312-F319 HydrophobicContact CD2-CD2 3.84Å; L312-F319 HydrophobicContact CD2-CE1 3.82Å; L312-F319 HydrophobicContact CD2-CE2 3.65Å; L312-F319 HydrophobicContact CD2-CG 4.03Å; L312-F319 HydrophobicContact CD2-CZ 3.65Å; L312-F319 HydrophobicContact CG-CD1 3.75Å; L312-F319 HydrophobicContact CG-CD2 4.24Å; L312-F319 HydrophobicContact CG-CE1 3.97Å; L312-F319 HydrophobicContact CG-CE2 4.43Å; L312-F319 HydrophobicContact CG-CG 3.92Å; L312-F319 HydrophobicContact CG-CZ 4.31Å; R313-F319 HydrophobicContact CG-CD1 3.8Å; R313-F319 HydrophobicContact CG-CE1 3.79Å; D316-F319 HydrophobicContact CB-CB 3.77Å; D316-F319 WeakPolarHBondContact OD1-CB 3.21Å; D316-F319 PolarHBondContact OD1-N 3.16Å; F319-T323 WeakPolarHBondContact CE1-OG1 3.1Å; F319-T323 VanDerWaalsContact O-CB 3.3Å; F319-T323 WeakPolarHBondContact O-CB 3.26Å; F319-T323 PolarHBondContact O-N 2.96Å; F319-T323 PolarHBondContact O-OG1 3.47Å
320	D	85.1	Confident	83.5	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.064	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-42.6	173.8	-176.4	46.3	0	0	0	111.9	R313 D316 K317 T323 Y324	R313-D320 HydrophobicContact CB-CB 4.16Å; R313-D320 HydrophobicContact CG-CB 4.39Å; R313-D320 IonicContact CZ-OD1 3.24Å; R313-D320 IonicContact NE-OD1 3.48Å; R313-D320 PolarHBondContact NE-OD1 2.95Å; R313-D320 IonicContact NH2-OD1 3.4Å; R313-D320 PolarHBondContact NH2-OD1 2.81Å; R313-D320 WeakPolarHBondContact O-CB 3.29Å; D316-D320 PolarHBondContact O-N 3.21Å; D316-D320 VanDerWaalsContact O-N 3.08Å; K317-D320 PolarHBondContact O-N 3.17Å; D320-T323 PolarHBondContact O-N 2.76Å; D320-Y324 VanDerWaalsContact O-CB 3.32Å; D320-Y324 WeakPolarHBondContact O-CB 3.48Å; D320-Y324 PolarHBondContact O-N 2.98Å
321	E	84.1	Confident	82.9	Confident	17 Å²	17	37.4 Å²	37.4	8%	0.079	18%	0.18	C	C	.	.	H	α-helix	trans	-62.3	-47.5	174.7	-168.4	177.1	144.3	0	0	111.2	F227 K317 T323 Y324 M325 H531 N534	F227-E321 HydrophobicContact CZ-CB 4.44Å; F227-E321 HydrophobicContact CZ-CG 4.09Å; K317-E321 WeakPolarHBondContact O-CB 3.46Å; K317-E321 PolarHBondContact O-N 3.11Å; E321-T323 PolarHBondContact O-N 2.98Å; E321-Y324 PolarHBondContact O-N 2.97Å; E321-M325 WeakPolarHBondContact O-CG 3.26Å; E321-M325 PolarHBondContact O-N 2.61Å; E321-H531 HydrophobicContact CG-CB 4.15Å; E321-H531 WeakPolarHBondContact OE1-CA 3.38Å; E321-H531 IonicContact OE1-CD2 2.67Å; E321-N534 PolarHBondContact OE2-ND2 3.43Å
322	A	87.9	Confident	81.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-44.7	176.1	0	0	0	0	0	112.3	M224 F227 L235 E318 M325 F326	M224-A322 HydrophobicContact CE-CB 3.82Å; M224-A322 WeakPolarHBondContact CE-O 3.41Å; M224-A322 HydrophobicContact SD-CB 4.07Å; F227-A322 HydrophobicContact CB-CB 3.92Å; F227-A322 HydrophobicContact CD1-CB 3.52Å; F227-A322 HydrophobicContact CD2-CB 3.96Å; F227-A322 HydrophobicContact CE1-CB 3.94Å; F227-A322 HydrophobicContact CE2-CB 4.36Å; F227-A322 HydrophobicContact CG-CB 3.53Å; F227-A322 HydrophobicContact CZ-CB 4.35Å; L235-A322 HydrophobicContact CD1-CB 3.71Å; E318-A322 VanDerWaalsContact O-CB 3.26Å; E318-A322 WeakPolarHBondContact O-CB 3.39Å; E318-A322 PolarHBondContact O-N 2.98Å; A322-M325 PolarHBondContact O-N 2.94Å; A322-F326 PolarHBondContact O-N 2.93Å; A322-F326 VanDerWaalsContact O-N 3.13Å
323	T	87.8	Confident	80.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.7	-41.3	177.7	-61.5	0	0	0	0	111.1	Y220 R313 F319 D320 E321 F326 E327 V339	Y220-T323 HydrophobicContact CE2-CG2 3.98Å; Y220-T323 WeakPolarHBondContact OH-CG2 3.3Å; Y220-T323 PolarHBondContact OH-OG1 3.48Å; R313-T323 VanDerWaalsContact NH1-CG2 3.34Å; F319-T323 WeakPolarHBondContact CE1-OG1 3.1Å; F319-T323 VanDerWaalsContact O-CB 3.3Å; F319-T323 WeakPolarHBondContact O-CB 3.26Å; F319-T323 PolarHBondContact O-N 2.96Å; F319-T323 PolarHBondContact O-OG1 3.47Å; D320-T323 PolarHBondContact O-N 2.76Å; E321-T323 PolarHBondContact O-N 2.98Å; T323-F326 PolarHBondContact O-N 2.65Å; T323-E327 VanDerWaalsContact O-CG 3.27Å; T323-E327 WeakPolarHBondContact O-CG 3.3Å; T323-E327 PolarHBondContact O-N 3.49Å; T323-V339 HydrophobicContact CG2-CB 4.3Å; T323-V339 HydrophobicContact CG2-CG2 4.1Å
324	Y	82.5	Confident	78.2	Confident	14 Å²	14	50.6 Å²	50.6	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-41.6	176.1	177.9	-107.2	0	0	0	112.4	D320 E321 F326 E327 T328 Q524 A527 V528	D320-Y324 VanDerWaalsContact O-CB 3.32Å; D320-Y324 WeakPolarHBondContact O-CB 3.48Å; D320-Y324 PolarHBondContact O-N 2.98Å; E321-Y324 PolarHBondContact O-N 2.97Å; Y324-F326 VanDerWaalsContact C-N 3.34Å; Y324-F326 PolarHBondContact O-N 2.77Å; Y324-E327 CarbonylContact O-C 3.21Å; Y324-E327 WeakPolarHBondContact O-CA 3.48Å; Y324-E327 WeakPolarHBondContact O-CB 3.28Å; Y324-E327 PolarHBondContact O-N 3.08Å; Y324-E327 VanDerWaalsContact O-N 3.08Å; Y324-T328 HydrophobicContact CD1-CG2 4.33Å; Y324-T328 HydrophobicContact CD2-CG2 4.45Å; Y324-T328 HydrophobicContact CE1-CG2 3.59Å; Y324-T328 HydrophobicContact CE2-CG2 3.72Å; Y324-T328 PolarHBondContact O-N 3.07Å; Y324-T328 WeakPolarHBondContact OH-CG2 3.43Å; Y324-Q524 HydrophobicContact CD2-CG 4.02Å; Y324-Q524 HydrophobicContact CE2-CG 3.41Å; Y324-Q524 VanDerWaalsContact CE2-CG 3.41Å; Y324-A527 HydrophobicContact CD1-CB 3.76Å; Y324-A527 HydrophobicContact CD2-CB 4.26Å; Y324-A527 HydrophobicContact CG-CB 3.57Å; Y324-V528 HydrophobicContact CD1-CG2 4.46Å; Y324-V528 HydrophobicContact CE1-CB 4.3Å; Y324-V528 HydrophobicContact CE1-CG2 3.39Å; Y324-V528 HydrophobicContact CE2-CG2 4.45Å; Y324-V528 WeakPolarHBondContact OH-CG2 3.3Å
325	M	81.6	Confident	76.8	Confident	20 Å²	20	54 Å²	54	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-41.9	177.8	-69.8	-57.2	-65.7	0	0	111.3	Y223 F227 E321 A322 E327 T328 E329 H531	Y223-M325 HydrophobicContact CE1-CB 4.09Å; F227-M325 HydrophobicContact CE2-CB 4.36Å; F227-M325 HydrophobicContact CE2-CG 4.14Å; E321-M325 WeakPolarHBondContact O-CG 3.26Å; E321-M325 PolarHBondContact O-N 2.61Å; A322-M325 PolarHBondContact O-N 2.94Å; M325-E327 PolarHBondContact O-N 3.17Å; M325-T328 PolarHBondContact O-N 3.49Å; M325-T328 PolarHBondContact O-OG1 3.1Å; M325-E329 WeakPolarHBondContact CE-OE1 3.4Å; M325-E329 PolarHBondContact O-N 2.98Å; M325-H531 HydrophobicContact SD-CB 4.28Å; M325-H531 VanDerWaalsContact SD-CD2 3.56Å
326	F	86.4	Confident	75.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.5	-43.7	169.3	178.7	-92.3	0	0	0	112.9	L219 Y220 Y223 M224 A322 T323 Y324 T328 E329 V330 F331 V339	L219-F326 HydrophobicContact CB-CE2 4.08Å; Y220-F326 VanDerWaalsContact CA-CE2 3.47Å; Y220-F326 HydrophobicContact CD2-CB 4.3Å; Y220-F326 AromaticContact CD2-CD1 3.59Å; Y220-F326 HydrophobicContact CD2-CD1 3.59Å; Y220-F326 HydrophobicContact CD2-CD2 4.14Å; Y220-F326 AromaticContact CD2-CE1 3.88Å; Y220-F326 HydrophobicContact CD2-CE1 3.88Å; Y220-F326 HydrophobicContact CD2-CE2 4.38Å; Y220-F326 AromaticContact CD2-CG 3.74Å; Y220-F326 HydrophobicContact CD2-CG 3.74Å; Y220-F326 HydrophobicContact CD2-CZ 4.28Å; Y220-F326 HydrophobicContact CE2-CD1 4.29Å; Y220-F326 HydrophobicContact CE2-CG 4.47Å; Y220-F326 HydrophobicContact CG-CD1 4.31Å; Y220-F326 HydrophobicContact CG-CE1 4.14Å; Y220-F326 HydrophobicContact CG-CZ 4.31Å; Y223-F326 HydrophobicContact CD1-CB 3.84Å; Y223-F326 HydrophobicContact CD1-CD2 4.43Å; Y223-F326 HydrophobicContact CD2-CD2 4.1Å; Y223-F326 HydrophobicContact CE1-CB 4.18Å; Y223-F326 HydrophobicContact CG-CB 4.08Å; Y223-F326 AromaticContact CG-CD2 3.82Å; Y223-F326 HydrophobicContact CG-CD2 3.82Å; Y223-F326 HydrophobicContact CG-CG 4.43Å; M224-F326 HydrophobicContact CE-CB 4.42Å; A322-F326 PolarHBondContact O-N 2.93Å; A322-F326 VanDerWaalsContact O-N 3.13Å; T323-F326 PolarHBondContact O-N 2.65Å; Y324-F326 VanDerWaalsContact C-N 3.34Å; Y324-F326 PolarHBondContact O-N 2.77Å; F326-T328 PolarHBondContact O-N 3.15Å; F326-E329 PolarHBondContact O-N 3.33Å; F326-V330 HydrophobicContact CD2-CB 3.96Å; F326-V330 HydrophobicContact CD2-CG2 3.59Å; F326-V330 HydrophobicContact CE1-CB 4.46Å; F326-V330 HydrophobicContact CE2-CB 3.67Å; F326-V330 HydrophobicContact CE2-CG1 3.8Å; F326-V330 HydrophobicContact CE2-CG2 3.52Å; F326-V330 HydrophobicContact CG-CB 4.48Å; F326-V330 HydrophobicContact CG-CG2 4.42Å; F326-V330 HydrophobicContact CZ-CB 3.93Å; F326-V330 HydrophobicContact CZ-CG1 3.81Å; F326-V330 HydrophobicContact CZ-CG2 4.29Å; F326-V330 PolarHBondContact O-N 3.17Å; F326-F331 HydrophobicContact CE1-CD1 4.27Å; F326-F331 HydrophobicContact CE1-CD2 4.41Å; F326-F331 AromaticContact CE1-CE1 3.86Å; F326-F331 HydrophobicContact CE1-CE1 3.86Å; F326-F331 AromaticContact CE1-CE2 4Å; F326-F331 HydrophobicContact CE1-CE2 4Å; F326-F331 AromaticContact CE1-CZ 3.71Å; F326-F331 HydrophobicContact CE1-CZ 3.71Å; F326-F331 HydrophobicContact CZ-CE1 4.23Å; F326-F331 HydrophobicContact CZ-CZ 4.43Å; F326-F331 PolarHBondContact O-N 3.16Å; F326-V339 HydrophobicContact CD1-CG2 3.79Å; F326-V339 HydrophobicContact CE1-CG2 3.98Å
327	E	82.1	Confident	74.1	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.037	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-21.7	175.1	-70.2	168.7	161.2	0	0	113.4	R313 T323 Y324 M325 F331 A338 V339	R313-E327 IonicContact CZ-OE1 2.94Å; R313-E327 IonicContact CZ-OE2 2.69Å; R313-E327 VanDerWaalsContact NH1-CD 3.35Å; R313-E327 IonicContact NH1-OE1 3.69Å; R313-E327 PolarHBondContact NH1-OE1 3.06Å; R313-E327 IonicContact NH1-OE2 2.62Å; R313-E327 PolarHBondContact NH1-OE2 3.05Å; R313-E327 IonicContact NH2-OE1 2.78Å; R313-E327 IonicContact NH2-OE2 3.86Å; R313-E327 PolarHBondContact NH2-OE2 3.43Å; R313-E327 VanDerWaalsContact NH2-OE2 3.09Å; T323-E327 VanDerWaalsContact O-CG 3.27Å; T323-E327 WeakPolarHBondContact O-CG 3.3Å; T323-E327 PolarHBondContact O-N 3.49Å; Y324-E327 CarbonylContact O-C 3.21Å; Y324-E327 WeakPolarHBondContact O-CA 3.48Å; Y324-E327 WeakPolarHBondContact O-CB 3.28Å; Y324-E327 PolarHBondContact O-N 3.08Å; Y324-E327 VanDerWaalsContact O-N 3.08Å; M325-E327 PolarHBondContact O-N 3.17Å; E327-F331 HydrophobicContact CG-CD2 4.34Å; E327-F331 WeakPolarHBondContact O-CB 3.38Å; E327-A338 VanDerWaalsContact OE1-CA 3.29Å; E327-A338 WeakPolarHBondContact OE1-CA 3.3Å; E327-A338 WeakPolarHBondContact OE1-CB 3.31Å; E327-V339 HydrophobicContact CG-CG2 3.87Å; E327-V339 PolarHBondContact OE1-N 2.73Å
328	T	75.6	Confident	73.6	Confident	27 Å²	27	47 Å²	47	17%	0.166	23%	0.23	C	C	.	.	H	α-helix	trans	-90.2	-47.1	173.2	65	0	0	0	0	113.4	Y324 M325 F326 K332 R333	Y324-T328 HydrophobicContact CD1-CG2 4.33Å; Y324-T328 HydrophobicContact CD2-CG2 4.45Å; Y324-T328 HydrophobicContact CE1-CG2 3.59Å; Y324-T328 HydrophobicContact CE2-CG2 3.72Å; Y324-T328 PolarHBondContact O-N 3.07Å; Y324-T328 WeakPolarHBondContact OH-CG2 3.43Å; M325-T328 PolarHBondContact O-N 3.49Å; M325-T328 PolarHBondContact O-OG1 3.1Å; F326-T328 PolarHBondContact O-N 3.15Å; T328-K332 WeakPolarHBondContact O-CA 3.39Å; T328-K332 PolarHBondContact O-N 3.13Å; T328-R333 PolarHBondContact O-N 3.02Å
329	E	77.1	Confident	73.4	Confident	103 Å²	103	43.6 Å²	43.6	48%	0.481	21%	0.214	S	C	.	.	H	α-helix	trans	-79	-49.2	-169.9	-68.7	176.8	-177.9	0	0	112.1	Y223 M325 F326	Y223-E329 WeakPolarHBondContact CE2-OE2 3.29Å; Y223-E329 VanDerWaalsContact CZ-OE2 3.26Å; Y223-E329 PolarHBondContact OH-OE1 3.02Å; Y223-E329 PolarHBondContact OH-OE2 3.1Å; M325-E329 WeakPolarHBondContact CE-OE1 3.4Å; M325-E329 PolarHBondContact O-N 2.98Å; F326-E329 PolarHBondContact O-N 3.33Å
330	V	74.1	Confident	72.9	Confident	37 Å²	37	45 Å²	45	22%	0.224	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-42.7	-175.3	-178.4	0	0	0	0	111.1	E215 L219 F326 K332	E215-V330 HydrophobicContact CG-CG1 4.09Å; L219-V330 HydrophobicContact CD1-CG1 4.26Å; F326-V330 HydrophobicContact CD2-CB 3.96Å; F326-V330 HydrophobicContact CD2-CG2 3.59Å; F326-V330 HydrophobicContact CE1-CB 4.46Å; F326-V330 HydrophobicContact CE2-CB 3.67Å; F326-V330 HydrophobicContact CE2-CG1 3.8Å; F326-V330 HydrophobicContact CE2-CG2 3.52Å; F326-V330 HydrophobicContact CG-CB 4.48Å; F326-V330 HydrophobicContact CG-CG2 4.42Å; F326-V330 HydrophobicContact CZ-CB 3.93Å; F326-V330 HydrophobicContact CZ-CG1 3.81Å; F326-V330 HydrophobicContact CZ-CG2 4.29Å; F326-V330 PolarHBondContact O-N 3.17Å; V330-K332 VanDerWaalsContact C-N 3.26Å; V330-K332 PolarHBondContact O-N 2.82Å
331	F	70.4	Confident	72.5	Confident	1 Å²	1	46.2 Å²	46.2	0%	0.004	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	2.7	178.6	-75	-5.7	0	0	0	114.5	E215 M216 F326 E327 K336 V339 Q342	E215-F331 HydrophobicContact CB-CE1 4.19Å; M216-F331 HydrophobicContact SD-CZ 4.09Å; F326-F331 HydrophobicContact CE1-CD1 4.27Å; F326-F331 HydrophobicContact CE1-CD2 4.41Å; F326-F331 AromaticContact CE1-CE1 3.86Å; F326-F331 HydrophobicContact CE1-CE1 3.86Å; F326-F331 AromaticContact CE1-CE2 4Å; F326-F331 HydrophobicContact CE1-CE2 4Å; F326-F331 AromaticContact CE1-CZ 3.71Å; F326-F331 HydrophobicContact CE1-CZ 3.71Å; F326-F331 HydrophobicContact CZ-CE1 4.23Å; F326-F331 HydrophobicContact CZ-CZ 4.43Å; F326-F331 PolarHBondContact O-N 3.16Å; E327-F331 HydrophobicContact CG-CD2 4.34Å; E327-F331 WeakPolarHBondContact O-CB 3.38Å; F331-K336 HydrophobicContact CB-CB 3.87Å; F331-K336 HydrophobicContact CD1-CB 4.25Å; F331-K336 HydrophobicContact CD1-CD 3.86Å; F331-K336 HydrophobicContact CD2-CB 4.44Å; F331-K336 HydrophobicContact CE1-CD 4.47Å; F331-K336 HydrophobicContact CG-CB 3.94Å; F331-K336 HydrophobicContact CG-CD 4.36Å; F331-V339 HydrophobicContact CE2-CB 4.48Å; F331-V339 HydrophobicContact CE2-CG2 3.77Å; F331-V339 HydrophobicContact CZ-CG2 4.39Å; F331-Q342 HydrophobicContact CD2-CG 4.35Å; F331-Q342 HydrophobicContact CE2-CB 4.14Å; F331-Q342 HydrophobicContact CE2-CG 3.68Å; F331-Q342 HydrophobicContact CZ-CB 4.13Å; F331-Q342 HydrophobicContact CZ-CG 3.84Å
332	K	63.7	Low	72.4	Confident	157 Å²	157	46 Å²	46	68%	0.683	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	70.8	174.4	-64.2	-174.7	179	-178.4	0	113	T328 V330 G334 K335	T328-K332 WeakPolarHBondContact O-CA 3.39Å; T328-K332 PolarHBondContact O-N 3.13Å; V330-K332 VanDerWaalsContact C-N 3.26Å; V330-K332 PolarHBondContact O-N 2.82Å; K332-G334 PolarHBondContact O-N 3.48Å; K332-K335 PolarHBondContact O-N 2.75Å
333	R	46.9	Very low	72.1	Confident	193 Å²	193	46 Å²	46	73%	0.728	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	33.4	70	168.3	-151.1	177.3	-158.9	-173.7	6.8	114.7	T328	T328-R333 PolarHBondContact O-N 3.02Å
334	G	46.5	Very low	71.6	Confident	53 Å²	53	47 Å²	47	55%	0.546	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	-12.9	169.8	0	0	0	0	0	116.2	K332 K336	K332-G334 PolarHBondContact O-N 3.48Å; G334-K336 PolarHBondContact O-N 3.27Å
335	K	51.2	Low	71.6	Confident	183 Å²	183	47.7 Å²	47.7	80%	0.796	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	-19.4	-178.9	-67.4	-168.4	175.8	-170	0	115.2	K332	K332-K335 PolarHBondContact O-N 2.75Å
336	K	52.6	Low	71.7	Confident	68 Å²	68	46.8 Å²	46.8	30%	0.296	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	10.3	175.9	-72.8	-177.7	168.6	-174	0	114.1	E215 F331 G334 Q342	E215-K336 IonicContact OE1-NZ 3.7Å; E215-K336 PolarHBondContact OE1-NZ 3.1Å; E215-K336 IonicContact OE2-NZ 3.46Å; E215-K336 PolarHBondContact OE2-NZ 3.25Å; F331-K336 HydrophobicContact CB-CB 3.87Å; F331-K336 HydrophobicContact CD1-CB 4.25Å; F331-K336 HydrophobicContact CD1-CD 3.86Å; F331-K336 HydrophobicContact CD2-CB 4.44Å; F331-K336 HydrophobicContact CE1-CD 4.47Å; F331-K336 HydrophobicContact CG-CB 3.94Å; F331-K336 HydrophobicContact CG-CD 4.36Å; G334-K336 PolarHBondContact O-N 3.27Å; K336-Q342 VanDerWaalsContact O-CD 3.3Å; K336-Q342 VanDerWaalsContact O-CG 3.23Å; K336-Q342 WeakPolarHBondContact O-CG 3.46Å; K336-Q342 PolarHBondContact O-NE2 3.27Å
337	G	63.1	Low	71.5	Confident	21 Å²	21	47.6 Å²	47.6	22%	0.216	23%	0.233	C	C	.	.			trans	64.4	-159.7	-176.7	0	0	0	0	0	113.8
338	A	72.3	Confident	71.3	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.008	23%	0.234	C	C	.	.			trans	-89.6	161.2	176.9	0	0	0	0	0	113.2	E327 I340 Q341 Q342 Y520	E327-A338 VanDerWaalsContact OE1-CA 3.29Å; E327-A338 WeakPolarHBondContact OE1-CA 3.3Å; E327-A338 WeakPolarHBondContact OE1-CB 3.31Å; A338-I340 PolarHBondContact O-N 3.3Å; A338-Q341 HydrophobicContact CB-CG 4.45Å; A338-Q341 WeakPolarHBondContact O-CB 3.14Å; A338-Q341 PolarHBondContact O-N 2.86Å; A338-Q342 WeakPolarHBondContact O-CG 3.28Å; A338-Q342 PolarHBondContact O-N 2.8Å; A338-Y520 HydrophobicContact CB-CE2 3.62Å; A338-Y520 WeakPolarHBondContact CB-OH 3.44Å; A338-Y520 PolarHBondContact N-OH 2.92Å
339	V	81.3	Confident	71.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-53	-43.7	171.5	172.7	0	0	0	0	111.1	M216 Y220 L309 T323 F326 E327 F331 Q341 Q342 L343	M216-V339 HydrophobicContact CE-CG1 3.71Å; M216-V339 HydrophobicContact SD-CG1 4.22Å; Y220-V339 HydrophobicContact CD1-CG1 4.29Å; Y220-V339 HydrophobicContact CD2-CG2 4.29Å; Y220-V339 HydrophobicContact CE1-CG1 3.86Å; Y220-V339 HydrophobicContact CE2-CG2 4.13Å; L309-V339 HydrophobicContact CD2-CG1 3.88Å; T323-V339 HydrophobicContact CG2-CB 4.3Å; T323-V339 HydrophobicContact CG2-CG2 4.1Å; F326-V339 HydrophobicContact CD1-CG2 3.79Å; F326-V339 HydrophobicContact CE1-CG2 3.98Å; E327-V339 HydrophobicContact CG-CG2 3.87Å; E327-V339 PolarHBondContact OE1-N 2.73Å; F331-V339 HydrophobicContact CE2-CB 4.48Å; F331-V339 HydrophobicContact CE2-CG2 3.77Å; F331-V339 HydrophobicContact CZ-CG2 4.39Å; V339-Q341 VanDerWaalsContact C-N 3.31Å; V339-Q341 PolarHBondContact O-N 3.24Å; V339-Q342 PolarHBondContact O-N 2.82Å; V339-Q342 VanDerWaalsContact O-N 3.17Å; V339-L343 PolarHBondContact O-N 2.64Å; V339-L343 VanDerWaalsContact O-N 3.08Å
340	I	79.5	Confident	71.9	Confident	29 Å²	29	42 Å²	42	15%	0.149	21%	0.206	C	C	.	.	H	α-helix	trans	-58.2	-41.8	177	-67.8	160.8	0	0	0	111.3	L306 L309 L310 A338	L306-I340 HydrophobicContact CD2-CB 4.49Å; L306-I340 HydrophobicContact CD2-CG2 3.68Å; L306-I340 WeakPolarHBondContact CD2-O 3.36Å; L309-I340 HydrophobicContact CD2-CG1 3.82Å; L309-I340 HydrophobicContact CG-CG1 4.22Å; L310-I340 HydrophobicContact CD2-CD1 3.72Å; L310-I340 HydrophobicContact CG-CD1 3.98Å; A338-I340 PolarHBondContact O-N 3.3Å
341	Q	76.2	Confident	72.1	Confident	39 Å²	39	40.3 Å²	40.3	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-74	-35.5	178	-67.7	165	-19.3	0	0	111.6	A338 V339 L343 D344 P416 G417 Y520	A338-Q341 HydrophobicContact CB-CG 4.45Å; A338-Q341 WeakPolarHBondContact O-CB 3.14Å; A338-Q341 PolarHBondContact O-N 2.86Å; V339-Q341 VanDerWaalsContact C-N 3.31Å; V339-Q341 PolarHBondContact O-N 3.24Å; Q341-L343 VanDerWaalsContact C-N 3.29Å; Q341-L343 PolarHBondContact O-N 3.38Å; Q341-D344 WeakPolarHBondContact O-CB 3.47Å; Q341-D344 PolarHBondContact O-N 3.38Å; Q341-P416 WeakPolarHBondContact O-CB 3.42Å; Q341-G417 PolarHBondContact O-N 2.86Å; Q341-Y520 PolarHBondContact OE1-OH 3.14Å
342	Q	80.8	Confident	72.6	Confident	12 Å²	12	41.5 Å²	41.5	6%	0.056	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-24.4	178.5	-76.7	-63.3	-49.1	0	0	113.2	Y212 F331 K336 A338 V339 D344 Q345	Y212-Q342 HydrophobicContact CD2-CB 4.34Å; Y212-Q342 HydrophobicContact CE2-CB 3.93Å; Y212-Q342 WeakPolarHBondContact CE2-O 3.49Å; Y212-Q342 PolarHBondContact OH-O 2.92Å; F331-Q342 HydrophobicContact CD2-CG 4.35Å; F331-Q342 HydrophobicContact CE2-CB 4.14Å; F331-Q342 HydrophobicContact CE2-CG 3.68Å; F331-Q342 HydrophobicContact CZ-CB 4.13Å; F331-Q342 HydrophobicContact CZ-CG 3.84Å; K336-Q342 VanDerWaalsContact O-CD 3.3Å; K336-Q342 VanDerWaalsContact O-CG 3.23Å; K336-Q342 WeakPolarHBondContact O-CG 3.46Å; K336-Q342 PolarHBondContact O-NE2 3.27Å; A338-Q342 WeakPolarHBondContact O-CG 3.28Å; A338-Q342 PolarHBondContact O-N 2.8Å; V339-Q342 PolarHBondContact O-N 2.82Å; V339-Q342 VanDerWaalsContact O-N 3.17Å; Q342-D344 PolarHBondContact O-N 2.96Å; Q342-D344 VanDerWaalsContact O-N 3.15Å; Q342-Q345 WeakPolarHBondContact O-CB 3.41Å; Q342-Q345 PolarHBondContact O-N 2.87Å
343	L	83.3	Confident	73.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.6	171.4	-69.2	-178.6	0	0	0	113.4	M216 I249 M253 F298 L306 L309 V339 Q341 Q345	M216-L343 HydrophobicContact CE-CD2 3.98Å; I249-L343 HydrophobicContact CD1-CD1 4.06Å; I249-L343 HydrophobicContact CD1-CD2 4.17Å; I249-L343 HydrophobicContact CG2-CD2 4.09Å; M253-L343 HydrophobicContact CE-CD2 4.11Å; F298-L343 WeakPolarHBondContact CE1-O 3.43Å; F298-L343 HydrophobicContact CE2-CD2 4.1Å; F298-L343 HydrophobicContact CZ-CB 4.1Å; F298-L343 HydrophobicContact CZ-CD2 3.89Å; F298-L343 HydrophobicContact CZ-CG 4.49Å; L306-L343 HydrophobicContact CD2-CB 4.15Å; L306-L343 HydrophobicContact CD2-CD1 4.02Å; L306-L343 HydrophobicContact CG-CD1 4.45Å; L309-L343 HydrophobicContact CD2-CD1 4.18Å; V339-L343 PolarHBondContact O-N 2.64Å; V339-L343 VanDerWaalsContact O-N 3.08Å; Q341-L343 VanDerWaalsContact C-N 3.29Å; Q341-L343 PolarHBondContact O-N 3.38Å; L343-Q345 PolarHBondContact O-N 2.98Å
344	D	76.3	Confident	75.5	Confident	20 Å²	20	25.7 Å²	25.7	11%	0.107	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.2	171.1	-72.5	-39.9	0	0	0	113.3	K302 Q341 Q342 V346 H347 Q348 G417	K302-D344 IonicContact NZ-OD1 3.83Å; K302-D344 PolarHBondContact NZ-OD1 3.34Å; Q341-D344 WeakPolarHBondContact O-CB 3.47Å; Q341-D344 PolarHBondContact O-N 3.38Å; Q342-D344 PolarHBondContact O-N 2.96Å; Q342-D344 VanDerWaalsContact O-N 3.15Å; D344-V346 PolarHBondContact O-N 3.29Å; D344-H347 WeakPolarHBondContact O-CB 3.5Å; D344-H347 PolarHBondContact O-N 3.41Å; D344-Q348 HydrophobicContact CB-CG 4.17Å; D344-Q348 WeakPolarHBondContact O-CG 3.3Å; D344-Q348 PolarHBondContact O-N 3.47Å; D344-G417 PolarHBondContact OD2-N 3.04Å
345	Q	81.7	Confident	77.1	Confident	30 Å²	30	23.4 Å²	23.4	14%	0.14	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-26.8	-170.3	-174.2	58.6	100.4	0	0	113.2	Y209 Y212 Q342 L343 N349 P416	Y209-Q345 HydrophobicContact CD2-CG 4.15Å; Y209-Q345 HydrophobicContact CE2-CG 4.41Å; Y212-Q345 HydrophobicContact CD1-CB 4.11Å; Y212-Q345 HydrophobicContact CD1-CG 3.78Å; Y212-Q345 HydrophobicContact CD2-CB 4.05Å; Y212-Q345 HydrophobicContact CD2-CG 4.06Å; Y212-Q345 HydrophobicContact CE1-CB 3.97Å; Y212-Q345 HydrophobicContact CE1-CG 4.14Å; Y212-Q345 HydrophobicContact CE2-CB 3.9Å; Y212-Q345 HydrophobicContact CE2-CG 4.4Å; Y212-Q345 HydrophobicContact CG-CB 4.16Å; Y212-Q345 HydrophobicContact CG-CG 3.75Å; Q342-Q345 WeakPolarHBondContact O-CB 3.41Å; Q342-Q345 PolarHBondContact O-N 2.87Å; L343-Q345 PolarHBondContact O-N 2.98Å; Q345-N349 PolarHBondContact NE2-ND2 3.41Å; Q345-N349 PolarHBondContact NE2-OD1 3.44Å; Q345-N349 WeakPolarHBondContact O-CB 3.21Å; Q345-N349 PolarHBondContact O-N 3.32Å; Q345-P416 HydrophobicContact CB-CG 4.15Å; Q345-P416 HydrophobicContact CG-CG 4.41Å; Q345-P416 VanDerWaalsContact OE1-CG 3.24Å
346	V	85.8	Confident	78.7	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-50.7	171.9	-179.9	0	0	0	0	111.2	Y209 Y212 M253 I256 C295 F298 L299 D344 F350	Y209-V346 HydrophobicContact CE2-CG2 4.41Å; Y209-V346 WeakPolarHBondContact OH-CA 3.17Å; Y209-V346 WeakPolarHBondContact OH-CG1 3.48Å; Y212-V346 HydrophobicContact CE1-CG2 3.9Å; M253-V346 HydrophobicContact CE-CG2 3.84Å; M253-V346 HydrophobicContact SD-CG2 4.03Å; I256-V346 HydrophobicContact CD1-CG1 4.47Å; C295-V346 HydrophobicContact CB-CG1 3.93Å; F298-V346 HydrophobicContact CD1-CB 3.67Å; F298-V346 HydrophobicContact CD1-CG1 3.67Å; F298-V346 HydrophobicContact CD1-CG2 3.72Å; F298-V346 HydrophobicContact CE1-CB 3.72Å; F298-V346 HydrophobicContact CE1-CG1 4.26Å; F298-V346 HydrophobicContact CE1-CG2 3.65Å; F298-V346 HydrophobicContact CG-CG2 4.46Å; F298-V346 HydrophobicContact CZ-CG2 4.36Å; L299-V346 HydrophobicContact CD2-CB 4.33Å; L299-V346 HydrophobicContact CD2-CG1 3.96Å; L299-V346 HydrophobicContact CG-CG1 4.22Å; D344-V346 PolarHBondContact O-N 3.29Å; V346-F350 WeakPolarHBondContact O-CB 3.38Å; V346-F350 PolarHBondContact O-N 3.06Å
347	H	81.6	Confident	80.4	Confident	17 Å²	17	11.6 Å²	11.6	8%	0.079	6%	0.06	C	C	.	.	H	α-helix	trans	-64.9	-46.7	177.4	-176.8	-132.2	0	0	0	110.4	L299 D344 N349 F350 M351 N389	L299-H347 HydrophobicContact CD2-CB 3.58Å; D344-H347 WeakPolarHBondContact O-CB 3.5Å; D344-H347 PolarHBondContact O-N 3.41Å; H347-N349 VanDerWaalsContact C-N 3.31Å; H347-N349 PolarHBondContact O-N 3.13Å; H347-F350 PolarHBondContact O-N 3.43Å; H347-M351 WeakPolarHBondContact O-CB 3.46Å; H347-M351 VanDerWaalsContact O-CG 3.27Å; H347-M351 WeakPolarHBondContact O-CG 3.35Å; H347-M351 PolarHBondContact O-N 2.89Å; H347-N389 PolarHBondContact NE2-OD1 2.82Å
348	Q	76.8	Confident	81.3	Confident	13 Å²	13	11.9 Å²	11.9	6%	0.061	6%	0.057	C	C	.	.	H	α-helix	trans	-63.7	-31.4	-178	-62.1	-66.7	9.4	0	0	113.2	D344 R352 L414 E415 R418	D344-Q348 HydrophobicContact CB-CG 4.17Å; D344-Q348 WeakPolarHBondContact O-CG 3.3Å; D344-Q348 PolarHBondContact O-N 3.47Å; Q348-R352 VanDerWaalsContact O-CB 3.29Å; Q348-R352 WeakPolarHBondContact O-CB 3.18Å; Q348-R352 PolarHBondContact O-N 3.42Å; Q348-R352 VanDerWaalsContact O-N 3.11Å; Q348-R352 PolarHBondContact O-NH1 3.08Å; Q348-L414 HydrophobicContact CB-CB 4.35Å; Q348-L414 VanDerWaalsContact OE1-CA 3.28Å; Q348-L414 VanDerWaalsContact OE1-CB 3.24Å; Q348-L414 VanDerWaalsContact OE1-CD2 3.29Å; Q348-E415 PolarHBondContact NE2-O 2.73Å; Q348-R418 PolarHBondContact NE2-O 3.09Å
349	N	84.1	Confident	81.8	Confident	5 Å²	5	13.4 Å²	13.4	3%	0.027	6%	0.062	C	C	.	.	H	α-helix	trans	-86.2	-37	175.3	-81.3	-18.6	0	0	0	113.8	Y209 Q345 H347 M351 R352 Y353	Y209-N349 WeakPolarHBondContact CB-ND2 3.46Å; Y209-N349 HydrophobicContact CD1-CB 4.2Å; Y209-N349 HydrophobicContact CD2-CB 4.04Å; Y209-N349 WeakPolarHBondContact CD2-ND2 3.25Å; Y209-N349 HydrophobicContact CE1-CB 4.36Å; Y209-N349 HydrophobicContact CE2-CB 4.2Å; Y209-N349 HydrophobicContact CG-CB 4.05Å; Q345-N349 PolarHBondContact NE2-ND2 3.41Å; Q345-N349 PolarHBondContact NE2-OD1 3.44Å; Q345-N349 WeakPolarHBondContact O-CB 3.21Å; Q345-N349 PolarHBondContact O-N 3.32Å; H347-N349 VanDerWaalsContact C-N 3.31Å; H347-N349 PolarHBondContact O-N 3.13Å; N349-M351 PolarHBondContact O-N 3.44Å; N349-R352 PolarHBondContact O-N 2.89Å; N349-R352 PolarHBondContact OD1-NH1 3.45Å; N349-Y353 WeakPolarHBondContact O-CD2 3.38Å; N349-Y353 WeakPolarHBondContact O-CE2 3.44Å; N349-Y353 PolarHBondContact O-N 2.79Å
350	F	82.4	Confident	82.1	Confident	4 Å²	4	13.4 Å²	13.4	2%	0.018	6%	0.062	C	C	.	.	H	α-helix	trans	-50.9	-43.2	166.5	177.4	-97.3	0	0	0	110.9	L292 C295 L299 V346 H347 V384 V388	L292-F350 HydrophobicContact CB-CD2 4.05Å; L292-F350 HydrophobicContact CB-CE2 3.98Å; C295-F350 HydrophobicContact CB-CD2 4.28Å; L299-F350 HydrophobicContact CD1-CD1 4.29Å; L299-F350 HydrophobicContact CD1-CG 4.32Å; V346-F350 WeakPolarHBondContact O-CB 3.38Å; V346-F350 PolarHBondContact O-N 3.06Å; H347-F350 PolarHBondContact O-N 3.43Å; F350-V384 HydrophobicContact CE2-CG1 3.73Å; F350-V384 HydrophobicContact CZ-CG1 3.67Å; F350-V388 HydrophobicContact CE1-CB 3.78Å; F350-V388 HydrophobicContact CE1-CG1 3.91Å; F350-V388 HydrophobicContact CE1-CG2 3.89Å; F350-V388 HydrophobicContact CZ-CB 3.97Å; F350-V388 HydrophobicContact CZ-CG1 4.36Å; F350-V388 HydrophobicContact CZ-CG2 3.53Å
351	M	76.9	Confident	82.6	Confident	1 Å²	1	12.7 Å²	12.7	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-64.5	-43.2	170.9	-75.7	-49	-45.4	0	0	114.8	H347 N349 Y353 K354 T385 T397 L414	H347-M351 WeakPolarHBondContact O-CB 3.46Å; H347-M351 VanDerWaalsContact O-CG 3.27Å; H347-M351 WeakPolarHBondContact O-CG 3.35Å; H347-M351 PolarHBondContact O-N 2.89Å; N349-M351 PolarHBondContact O-N 3.44Å; M351-Y353 VanDerWaalsContact C-N 3.34Å; M351-Y353 PolarHBondContact O-N 3.38Å; M351-K354 PolarHBondContact O-N 3.04Å; M351-T385 HydrophobicContact CE-CG2 3.69Å; M351-T385 HydrophobicContact SD-CG2 3.41Å; M351-T385 WeakPolarHBondContact SD-CG2 3.28Å; M351-T397 VanDerWaalsContact CE-CB 3.47Å; M351-T397 HydrophobicContact CE-CG2 3.26Å; M351-T397 HydrophobicContact SD-CG2 3.35Å; M351-T397 WeakPolarHBondContact SD-CG2 3.27Å; M351-L414 HydrophobicContact CB-CD1 3.62Å; M351-L414 HydrophobicContact CB-CD2 4.49Å
352	R	82	Confident	83.1	Confident	26 Å²	26	16.4 Å²	16.4	10%	0.098	8%	0.077	C	C	.	.	H	α-helix	trans	-65.2	-31.2	-170.2	-175.1	175.7	-86.9	96.8	-0.1	113.3	V205 Q348 N349 K354 L355 L356 N412 L414	V205-R352 VanDerWaalsContact CG1-CD 3.45Å; V205-R352 HydrophobicContact CG1-CG 4.23Å; Q348-R352 VanDerWaalsContact O-CB 3.29Å; Q348-R352 WeakPolarHBondContact O-CB 3.18Å; Q348-R352 PolarHBondContact O-N 3.42Å; Q348-R352 VanDerWaalsContact O-N 3.11Å; Q348-R352 PolarHBondContact O-NH1 3.08Å; N349-R352 PolarHBondContact O-N 2.89Å; N349-R352 PolarHBondContact OD1-NH1 3.45Å; R352-K354 VanDerWaalsContact C-N 3.29Å; R352-K354 PolarHBondContact O-N 3.25Å; R352-L355 PolarHBondContact O-N 3.43Å; R352-L355 VanDerWaalsContact O-N 3.1Å; R352-L356 HydrophobicContact CG-CD1 3.98Å; R352-L356 HydrophobicContact CG-CG 3.99Å; R352-L356 WeakPolarHBondContact O-CG 3.32Å; R352-L356 PolarHBondContact O-N 2.84Å; R352-N412 PolarHBondContact NH2-OD1 3.11Å; R352-L414 HydrophobicContact CB-CD1 4.1Å; R352-L414 PolarHBondContact NH1-O 3.42Å; R352-L414 PolarHBondContact NH2-O 3.41Å
353	Y	87.6	Confident	83.4	Confident	3 Å²	3	17.3 Å²	17.3	1%	0.012	8%	0.08	C	C	.	.	H	α-helix	trans	-56.9	-39.5	179.1	-60.3	-64.2	0	0	0	113.3	Q206 H260 L263 L292 N349 M351 M357	Q206-Y353 PolarHBondContact OE1-OH 2.79Å; H260-Y353 AromaticContact CE1-CE2 3.99Å; H260-Y353 AromaticContact CE1-CZ 3.94Å; H260-Y353 PolarHBondContact CE1-OH 3.27Å; H260-Y353 PolarHBondContact ND1-OH 2.86Å; L263-Y353 HydrophobicContact CD2-CE1 4.08Å; L292-Y353 HydrophobicContact CD1-CD2 3.66Å; L292-Y353 HydrophobicContact CD1-CE2 4.17Å; L292-Y353 HydrophobicContact CD1-CG 4.35Å; L292-Y353 HydrophobicContact CD2-CD2 4.19Å; L292-Y353 HydrophobicContact CD2-CE2 3.83Å; N349-Y353 WeakPolarHBondContact O-CD2 3.38Å; N349-Y353 WeakPolarHBondContact O-CE2 3.44Å; N349-Y353 PolarHBondContact O-N 2.79Å; M351-Y353 VanDerWaalsContact C-N 3.34Å; M351-Y353 PolarHBondContact O-N 3.38Å; Y353-M357 PolarHBondContact O-N 3.19Å
354	K	84.5	Confident	83.7	Confident	14 Å²	14	17.6 Å²	17.6	6%	0.061	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-47.3	176	-173.2	-160.3	176.6	-173.5	0	110.8	M351 R352 M357 L358 L381 E382	M351-K354 PolarHBondContact O-N 3.04Å; R352-K354 VanDerWaalsContact C-N 3.29Å; R352-K354 PolarHBondContact O-N 3.25Å; K354-M357 PolarHBondContact O-N 2.95Å; K354-L358 HydrophobicContact CD-CD1 4.27Å; K354-L358 HydrophobicContact CG-CD1 3.99Å; K354-L358 WeakPolarHBondContact O-CB 3.26Å; K354-L358 VanDerWaalsContact O-CG 3.3Å; K354-L358 WeakPolarHBondContact O-CG 3.46Å; K354-L358 PolarHBondContact O-N 3.36Å; K354-L381 HydrophobicContact CB-CB 4.23Å; K354-E382 VanDerWaalsContact CD-OE2 3.28Å; K354-E382 WeakPolarHBondContact CD-OE2 3.27Å; K354-E382 WeakPolarHBondContact CE-OE2 3.32Å; K354-E382 IonicContact NZ-OE1 4Å; K354-E382 PolarHBondContact NZ-OE1 3.36Å; K354-E382 IonicContact NZ-OE2 2.76Å; K354-E382 PolarHBondContact NZ-OE2 2.94Å
355	L	79.4	Confident	84.3	Confident	5 Å²	5	21.5 Å²	21.5	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-65.8	-38.7	-177.9	-58.3	-176.8	0	0	0	112.3	R352 L358 R359 T401 Y404 L414	R352-L355 PolarHBondContact O-N 3.43Å; R352-L355 VanDerWaalsContact O-N 3.1Å; L355-L358 HydrophobicContact CD2-CD1 4.32Å; L355-R359 WeakPolarHBondContact O-CB 3.47Å; L355-R359 PolarHBondContact O-N 2.97Å; L355-T401 HydrophobicContact CD2-CG2 3.83Å; L355-Y404 HydrophobicContact CB-CD1 4.01Å; L355-Y404 HydrophobicContact CB-CE1 3.77Å; L355-Y404 HydrophobicContact CD1-CD1 3.8Å; L355-Y404 HydrophobicContact CD1-CD2 4.15Å; L355-Y404 HydrophobicContact CD1-CE1 4.18Å; L355-Y404 HydrophobicContact CD1-CG 3.77Å; L355-Y404 HydrophobicContact CD2-CD1 4.08Å; L355-Y404 HydrophobicContact CG-CD1 4.19Å; L355-Y404 HydrophobicContact CG-CE1 4.43Å; L355-L414 HydrophobicContact CD1-CD1 3.48Å; L355-L414 VanDerWaalsContact CD1-CD1 3.48Å; L355-L414 HydrophobicContact CD1-CG 4.09Å; L355-L414 HydrophobicContact CG-CD1 4.49Å
356	L	84	Confident	84.4	Confident	3 Å²	3	25.6 Å²	25.6	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-65.3	-42.6	174.6	-65.8	173.6	0	0	0	111.7	E201 F202 V205 R352 R359 Y360	E201-L356 HydrophobicContact CB-CD2 4.14Å; E201-L356 HydrophobicContact CG-CD2 3.56Å; F202-L356 HydrophobicContact CD1-CB 3.94Å; F202-L356 HydrophobicContact CD1-CD1 3.72Å; F202-L356 HydrophobicContact CD1-CG 4.49Å; F202-L356 HydrophobicContact CD2-CB 4.41Å; F202-L356 HydrophobicContact CE1-CB 3.41Å; F202-L356 VanDerWaalsContact CE1-CB 3.41Å; F202-L356 HydrophobicContact CE1-CD1 4.01Å; F202-L356 HydrophobicContact CE1-CG 4.38Å; F202-L356 HydrophobicContact CE2-CB 3.95Å; F202-L356 HydrophobicContact CG-CB 4.41Å; F202-L356 HydrophobicContact CG-CD1 4.19Å; F202-L356 HydrophobicContact CZ-CB 3.43Å; F202-L356 VanDerWaalsContact CZ-CB 3.43Å; V205-L356 HydrophobicContact CB-CD1 4.17Å; V205-L356 HydrophobicContact CG1-CD1 4.14Å; V205-L356 HydrophobicContact CG2-CD1 4.14Å; R352-L356 HydrophobicContact CG-CD1 3.98Å; R352-L356 HydrophobicContact CG-CG 3.99Å; R352-L356 WeakPolarHBondContact O-CG 3.32Å; R352-L356 PolarHBondContact O-N 2.84Å; L356-R359 PolarHBondContact O-N 2.87Å; L356-Y360 VanDerWaalsContact O-CB 3.27Å; L356-Y360 WeakPolarHBondContact O-CB 3.2Å; L356-Y360 PolarHBondContact O-N 2.93Å
357	M	88.9	Confident	84.2	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-37.4	178.1	-168.8	56.3	65.6	0	0	112.4	F202 S282 I285 Y353 K354 Y360 S361 A374 A377 I378 L381	F202-M357 HydrophobicContact CE1-CE 4.36Å; F202-M357 HydrophobicContact CE2-CE 4.5Å; F202-M357 HydrophobicContact CZ-CB 4.26Å; F202-M357 HydrophobicContact CZ-CE 3.75Å; F202-M357 HydrophobicContact CZ-SD 4.5Å; S282-M357 PolarHBondContact OG-SD 3.37Å; I285-M357 HydrophobicContact CB-CE 3.47Å; I285-M357 VanDerWaalsContact CB-CE 3.47Å; I285-M357 HydrophobicContact CG1-CE 3.57Å; I285-M357 HydrophobicContact CG2-CE 3.85Å; Y353-M357 PolarHBondContact O-N 3.19Å; K354-M357 PolarHBondContact O-N 2.95Å; M357-Y360 PolarHBondContact O-N 2.87Å; M357-Y360 HydrophobicContact SD-CD1 3.61Å; M357-Y360 HydrophobicContact SD-CE1 4.21Å; M357-Y360 HydrophobicContact SD-CG 4.32Å; M357-S361 WeakPolarHBondContact O-CB 3.38Å; M357-S361 PolarHBondContact O-N 3.28Å; M357-A374 HydrophobicContact SD-CB 4.06Å; M357-A377 HydrophobicContact CE-CB 4.48Å; M357-A377 HydrophobicContact CG-CB 4.23Å; M357-I378 HydrophobicContact CB-CG1 3.93Å; M357-I378 HydrophobicContact CG-CD1 4.11Å; M357-I378 HydrophobicContact CG-CG1 3.61Å; M357-L381 HydrophobicContact CB-CD1 4.34Å
358	L	82.9	Confident	84.6	Confident	28 Å²	28	35.1 Å²	35.1	15%	0.147	18%	0.178	C	C	.	.	H	α-helix	trans	-58.6	-47.7	171.5	-81.8	169.6	0	0	0	111.9	K354 L355 S361 E362 I378 T401 Y405	K354-L358 HydrophobicContact CD-CD1 4.27Å; K354-L358 HydrophobicContact CG-CD1 3.99Å; K354-L358 WeakPolarHBondContact O-CB 3.26Å; K354-L358 VanDerWaalsContact O-CG 3.3Å; K354-L358 WeakPolarHBondContact O-CG 3.46Å; K354-L358 PolarHBondContact O-N 3.36Å; L355-L358 HydrophobicContact CD2-CD1 4.32Å; L358-S361 PolarHBondContact O-N 2.92Å; L358-E362 PolarHBondContact O-N 3.25Å; L358-I378 HydrophobicContact CD2-CD1 3.82Å; L358-I378 HydrophobicContact CD2-CG1 4.23Å; L358-I378 HydrophobicContact CD2-CG2 3.92Å; L358-I378 HydrophobicContact CG-CD1 4.17Å; L358-I378 HydrophobicContact CG-CG1 4.21Å; L358-I378 HydrophobicContact CG-CG2 4.29Å; L358-T401 HydrophobicContact CD1-CG2 3.94Å; L358-Y405 WeakPolarHBondContact CB-OH 3.45Å; L358-Y405 HydrophobicContact CD1-CE2 4.11Å; L358-Y405 WeakPolarHBondContact CD2-OH 3.26Å
359	R	81.7	Confident	85.3	Confident	33 Å²	33	39.3 Å²	39.3	13%	0.125	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-39.8	176.3	-174.7	-175	-176.3	-177.8	6	112.5	E201 L355 L356 E362 Y363	E201-R359 IonicContact OE1-NH1 3.96Å; E201-R359 IonicContact OE2-CZ 2.66Å; E201-R359 IonicContact OE2-NH1 2.83Å; E201-R359 PolarHBondContact OE2-NH1 3.21Å; L355-R359 WeakPolarHBondContact O-CB 3.47Å; L355-R359 PolarHBondContact O-N 2.97Å; L356-R359 PolarHBondContact O-N 2.87Å; R359-E362 WeakPolarHBondContact O-CB 3.48Å; R359-E362 PolarHBondContact O-N 3.4Å; R359-Y363 HydrophobicContact CG-CE2 4.03Å; R359-Y363 PolarHBondContact NE-OH 2.83Å
360	Y	88.6	Confident	85.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-45.7	176.4	174	-95.6	0	0	0	111.6	L195 A198 F202 W274 P279 N280 M281 S282 L356 M357 E362 Y363 L364 E370	L195-Y360 HydrophobicContact CD1-CD2 3.61Å; L195-Y360 HydrophobicContact CD1-CE2 3.57Å; L195-Y360 HydrophobicContact CD1-CG 4.31Å; A198-Y360 HydrophobicContact CB-CD2 4.38Å; F202-Y360 HydrophobicContact CE2-CG 4.47Å; W274-Y360 AromaticContact CH2-CE2 3.68Å; W274-Y360 HydrophobicContact CH2-CE2 3.68Å; W274-Y360 WeakPolarHBondContact CH2-OH 3.45Å; W274-Y360 HydrophobicContact CZ2-CE2 4.14Å; P279-Y360 WeakPolarHBondContact CB-OH 3.26Å; N280-Y360 PolarHBondContact N-OH 3.37Å; M281-Y360 HydrophobicContact CB-CE1 4.3Å; M281-Y360 HydrophobicContact CB-CE2 3.75Å; M281-Y360 WeakPolarHBondContact CB-OH 3.43Å; M281-Y360 PolarHBondContact N-OH 3.47Å; M281-Y360 VanDerWaalsContact N-OH 3.07Å; S282-Y360 VanDerWaalsContact OG-CE1 3.23Å; S282-Y360 WeakPolarHBondContact OG-CE1 3.4Å; L356-Y360 VanDerWaalsContact O-CB 3.27Å; L356-Y360 WeakPolarHBondContact O-CB 3.2Å; L356-Y360 PolarHBondContact O-N 2.93Å; M357-Y360 PolarHBondContact O-N 2.87Å; M357-Y360 HydrophobicContact SD-CD1 3.61Å; M357-Y360 HydrophobicContact SD-CE1 4.21Å; M357-Y360 HydrophobicContact SD-CG 4.32Å; Y360-E362 PolarHBondContact O-N 2.73Å; Y360-Y363 PolarHBondContact O-N 3.09Å; Y360-Y363 VanDerWaalsContact O-N 3.12Å; Y360-L364 HydrophobicContact CD1-CD1 4.09Å; Y360-L364 HydrophobicContact CD1-CG 4.47Å; Y360-L364 HydrophobicContact CE1-CD1 3.82Å; Y360-L364 HydrophobicContact CE1-CD2 4.21Å; Y360-L364 HydrophobicContact CE1-CG 4.3Å; Y360-E370 HydrophobicContact CE1-CG 4.2Å; Y360-E370 WeakPolarHBondContact CE1-OE1 3.32Å; Y360-E370 PolarHBondContact OH-OE1 3.33Å
361	S	90	Very high	86.2	Confident	13 Å²	13	40.7 Å²	40.7	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-29.3	177.9	-166.8	0	0	0	0	113.5	M357 L358 Y363 L364 K371	M357-S361 WeakPolarHBondContact O-CB 3.38Å; M357-S361 PolarHBondContact O-N 3.28Å; L358-S361 PolarHBondContact O-N 2.92Å; S361-Y363 PolarHBondContact O-N 3.5Å; S361-L364 PolarHBondContact O-N 2.85Å; S361-K371 WeakPolarHBondContact O-CE 3.15Å
362	E	86.1	Confident	86.9	Confident	117 Å²	117	46.7 Å²	46.7	55%	0.547	24%	0.235	S	C	.	.	H	α-helix	trans	-60.8	-29	174.9	-163.6	-172.4	155.8	0	0	113.1	L358 R359 Y360	L358-E362 PolarHBondContact O-N 3.25Å; R359-E362 WeakPolarHBondContact O-CB 3.48Å; R359-E362 PolarHBondContact O-N 3.4Å; Y360-E362 PolarHBondContact O-N 2.73Å
363	Y	86.6	Confident	87.5	Confident	31 Å²	31	48.5 Å²	48.5	12%	0.122	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	0.2	-177.8	-48.5	-35.6	0	0	0	113.6	R191 K194 A198 R359 Y360 S361	R191-Y363 WeakPolarHBondContact CD-O 3.39Å; R191-Y363 WeakPolarHBondContact CG-O 3.35Å; R191-Y363 PolarHBondContact NH1-O 3.39Å; K194-Y363 HydrophobicContact CB-CD1 4.28Å; K194-Y363 HydrophobicContact CB-CD2 3.76Å; K194-Y363 HydrophobicContact CB-CE1 4.41Å; K194-Y363 HydrophobicContact CB-CE2 3.85Å; K194-Y363 HydrophobicContact CB-CG 4Å; K194-Y363 HydrophobicContact CD-CE1 4.34Å; A198-Y363 HydrophobicContact CB-CD2 4.11Å; A198-Y363 HydrophobicContact CB-CE2 4.18Å; R359-Y363 HydrophobicContact CG-CE2 4.03Å; R359-Y363 PolarHBondContact NE-OH 2.83Å; Y360-Y363 PolarHBondContact O-N 3.09Å; Y360-Y363 VanDerWaalsContact O-N 3.12Å; S361-Y363 PolarHBondContact O-N 3.5Å
364	L	89.8	Confident	87.8	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.037	24%	0.243	C	C	.	.	S	Bend	trans	-81.2	141.3	172.2	-63	178	0	0	0	111	L195 P279 Y360 S361 E370 K371 A374	L195-L364 HydrophobicContact CD1-CD2 3.87Å; L195-L364 HydrophobicContact CD1-CG 4.47Å; L195-L364 HydrophobicContact CD2-CD2 3.95Å; P279-L364 HydrophobicContact CB-CD2 3.98Å; P279-L364 HydrophobicContact CG-CD2 3.69Å; Y360-L364 HydrophobicContact CD1-CD1 4.09Å; Y360-L364 HydrophobicContact CD1-CG 4.47Å; Y360-L364 HydrophobicContact CE1-CD1 3.82Å; Y360-L364 HydrophobicContact CE1-CD2 4.21Å; Y360-L364 HydrophobicContact CE1-CG 4.3Å; S361-L364 PolarHBondContact O-N 2.85Å; L364-E370 HydrophobicContact CD1-CB 4.5Å; L364-E370 HydrophobicContact CD1-CG 3.95Å; L364-E370 HydrophobicContact CD2-CG 4.13Å; L364-K371 HydrophobicContact CB-CB 4.07Å; L364-K371 HydrophobicContact CB-CD 3.93Å; L364-K371 HydrophobicContact CB-CG 4.07Å; L364-K371 HydrophobicContact CD1-CB 3.92Å; L364-K371 HydrophobicContact CD1-CG 4.2Å; L364-K371 PolarHBondContact O-NZ 3.17Å; L364-A374 HydrophobicContact CD1-CB 4.01Å
365	I	88.8	Confident	88.2	Confident	102 Å²	102	53.3 Å²	53.3	52%	0.523	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-61.5	142	172	-50.5	177.2	0	0	0	109	C368 K371	I365-C368 PolarHBondContact O-SG 3.44Å; I365-K371 VanDerWaalsContact O-CD 3.25Å; I365-K371 WeakPolarHBondContact O-CD 3.38Å
366	D	83.9	Confident	88.9	Confident	115 Å²	115	59 Å²	59	62%	0.615	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	155.7	173.4	-61.4	-57.7	0	0	0	112.3	C368 K371	D366-C368 PolarHBondContact O-N 2.93Å; D366-K371 IonicContact OD1-NZ 2.7Å; D366-K371 PolarHBondContact OD1-NZ 2.99Å
367	D	82.5	Confident	89.3	Confident	176 Å²	176	58.9 Å²	58.9	94%	0.941	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	19.7	179.8	-53.2	-27.7	0	0	0	116.5
368	C	89.3	Confident	89.4	Confident	41 Å²	41	60.1 Å²	60.1	28%	0.277	30%	0.299	S	S	.	.			trans	-93.7	145.4	174.5	87.4	0	0	0	0	113.4	I365 D366 E370 K371 E372	I365-C368 PolarHBondContact O-SG 3.44Å; D366-C368 PolarHBondContact O-N 2.93Å; C368-E370 VanDerWaalsContact C-N 3.25Å; C368-E370 PolarHBondContact O-N 3.27Å; C368-K371 WeakPolarHBondContact O-CA 3.49Å; C368-K371 WeakPolarHBondContact O-CB 3.47Å; C368-K371 PolarHBondContact O-N 3.25Å; C368-E372 PolarHBondContact O-N 3.39Å
369	D	91.1	Very high	89.8	Confident	101 Å²	101	64 Å²	64	54%	0.54	32%	0.317	S	S	.	.	H	α-helix	trans	-57	-29.2	-177.1	155.3	94.8	0	0	0	114.2	K373	D369-K373 WeakPolarHBondContact O-CD 3.44Å; D369-K373 VanDerWaalsContact O-CG 3.32Å; D369-K373 WeakPolarHBondContact O-CG 3.13Å; D369-K373 PolarHBondContact O-N 3.47Å; D369-K373 WeakPolarHBondContact OD1-CE 3.24Å; D369-K373 IonicContact OD1-NZ 3.97Å; D369-K373 PolarHBondContact OD1-NZ 3.46Å; D369-K373 IonicContact OD2-NZ 2.71Å; D369-K373 PolarHBondContact OD2-NZ 3.32Å
370	E	92.8	Very high	90.2	Very high	12 Å²	12	66 Å²	66	6%	0.056	33%	0.326	C	S	.	.	H	α-helix	trans	-75.8	-27.8	172.6	178.7	68.4	170	0	0	112.3	P279 N280 M281 S282 Y360 L364 C368 K373 A374	P279-E370 HydrophobicContact CB-CG 4.19Å; P279-E370 HydrophobicContact CG-CB 4.41Å; P279-E370 HydrophobicContact CG-CG 4.14Å; P279-E370 WeakPolarHBondContact O-CG 3.15Å; N280-E370 WeakPolarHBondContact CA-OE1 3.45Å; N280-E370 PolarHBondContact N-OE1 3.29Å; M281-E370 PolarHBondContact N-OE1 3.32Å; S282-E370 WeakPolarHBondContact CB-OE1 3.42Å; S282-E370 PolarHBondContact N-OE1 3.33Å; S282-E370 PolarHBondContact OG-OE1 3.19Å; Y360-E370 HydrophobicContact CE1-CG 4.2Å; Y360-E370 WeakPolarHBondContact CE1-OE1 3.32Å; Y360-E370 PolarHBondContact OH-OE1 3.33Å; L364-E370 HydrophobicContact CD1-CB 4.5Å; L364-E370 HydrophobicContact CD1-CG 3.95Å; L364-E370 HydrophobicContact CD2-CG 4.13Å; C368-E370 VanDerWaalsContact C-N 3.25Å; C368-E370 PolarHBondContact O-N 3.27Å; E370-K373 PolarHBondContact O-N 3.04Å; E370-A374 WeakPolarHBondContact O-CB 3.11Å; E370-A374 PolarHBondContact O-N 2.93Å
371	K	92.4	Very high	90.2	Very high	27 Å²	27	66.1 Å²	66.1	12%	0.117	33%	0.327	C	S	.	.	H	α-helix	trans	-75.8	-35.5	178.2	-163.1	167.9	-168.2	168.3	0	112	S361 L364 I365 D366 C368 A374 Q375	S361-K371 WeakPolarHBondContact O-CE 3.15Å; L364-K371 HydrophobicContact CB-CB 4.07Å; L364-K371 HydrophobicContact CB-CD 3.93Å; L364-K371 HydrophobicContact CB-CG 4.07Å; L364-K371 HydrophobicContact CD1-CB 3.92Å; L364-K371 HydrophobicContact CD1-CG 4.2Å; L364-K371 PolarHBondContact O-NZ 3.17Å; I365-K371 VanDerWaalsContact O-CD 3.25Å; I365-K371 WeakPolarHBondContact O-CD 3.38Å; D366-K371 IonicContact OD1-NZ 2.7Å; D366-K371 PolarHBondContact OD1-NZ 2.99Å; C368-K371 WeakPolarHBondContact O-CA 3.49Å; C368-K371 WeakPolarHBondContact O-CB 3.47Å; C368-K371 PolarHBondContact O-N 3.25Å; K371-A374 WeakPolarHBondContact O-CB 3.42Å; K371-A374 PolarHBondContact O-N 2.91Å; K371-Q375 WeakPolarHBondContact O-CG 3.24Å; K371-Q375 PolarHBondContact O-N 3.35Å
372	E	92.9	Very high	90	Very high	126 Å²	126	66.5 Å²	66.5	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-59.2	-50.2	167.7	-173.1	174.2	-161.3	0	0	110.4	C368 A374 Q375 E376	C368-E372 PolarHBondContact O-N 3.39Å; E372-A374 VanDerWaalsContact C-N 3.29Å; E372-A374 PolarHBondContact O-N 3.41Å; E372-Q375 WeakPolarHBondContact O-CB 3.31Å; E372-Q375 PolarHBondContact O-N 2.96Å; E372-E376 PolarHBondContact O-N 2.97Å
373	K	93.9	Very high	90	Very high	64 Å²	64	65.2 Å²	65.2	28%	0.278	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-33.4	175.3	-69.7	164.2	-166.3	165.4	0	113.3	D369 E370 A377	D369-K373 WeakPolarHBondContact O-CD 3.44Å; D369-K373 VanDerWaalsContact O-CG 3.32Å; D369-K373 WeakPolarHBondContact O-CG 3.13Å; D369-K373 PolarHBondContact O-N 3.47Å; D369-K373 WeakPolarHBondContact OD1-CE 3.24Å; D369-K373 IonicContact OD1-NZ 3.97Å; D369-K373 PolarHBondContact OD1-NZ 3.46Å; D369-K373 IonicContact OD2-NZ 2.71Å; D369-K373 PolarHBondContact OD2-NZ 3.32Å; E370-K373 PolarHBondContact O-N 3.04Å; K373-A377 VanDerWaalsContact O-CB 3.32Å; K373-A377 WeakPolarHBondContact O-CB 3.41Å; K373-A377 PolarHBondContact O-N 2.93Å
374	A	94	Very high	89.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-43.7	173.2	0	0	0	0	0	110.9	S282 M357 L364 E370 K371 E372 A377 I378	S282-A374 VanDerWaalsContact OG-CA 3.29Å; S282-A374 WeakPolarHBondContact OG-CA 3.41Å; S282-A374 VanDerWaalsContact OG-CB 3.29Å; S282-A374 WeakPolarHBondContact OG-CB 3.42Å; M357-A374 HydrophobicContact SD-CB 4.06Å; L364-A374 HydrophobicContact CD1-CB 4.01Å; E370-A374 WeakPolarHBondContact O-CB 3.11Å; E370-A374 PolarHBondContact O-N 2.93Å; K371-A374 WeakPolarHBondContact O-CB 3.42Å; K371-A374 PolarHBondContact O-N 2.91Å; E372-A374 VanDerWaalsContact C-N 3.29Å; E372-A374 PolarHBondContact O-N 3.41Å; A374-A377 PolarHBondContact O-N 3.44Å; A374-I378 WeakPolarHBondContact O-CB 3.41Å; A374-I378 VanDerWaalsContact O-CD1 3.29Å; A374-I378 WeakPolarHBondContact O-CD1 3.32Å; A374-I378 WeakPolarHBondContact O-CG1 3.35Å; A374-I378 PolarHBondContact O-N 3.35Å
375	Q	93.4	Very high	89.3	Confident	118 Å²	118	63.9 Å²	63.9	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-65.3	-43.5	176.7	-68.1	172	8.2	0	0	112	K371 E372 A377 I378 Q379	K371-Q375 WeakPolarHBondContact O-CG 3.24Å; K371-Q375 PolarHBondContact O-N 3.35Å; E372-Q375 WeakPolarHBondContact O-CB 3.31Å; E372-Q375 PolarHBondContact O-N 2.96Å; Q375-A377 PolarHBondContact O-N 2.9Å; Q375-I378 PolarHBondContact O-N 2.83Å; Q375-Q379 PolarHBondContact O-N 3.29Å
376	E	92.8	Very high	88.9	Confident	124 Å²	124	62.6 Å²	62.6	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-56.3	-48.2	171.6	-68.7	-166.1	136.5	0	0	111.9	E372 I378 Q379 K380	E372-E376 PolarHBondContact O-N 2.97Å; E376-I378 PolarHBondContact O-N 3.14Å; E376-Q379 PolarHBondContact O-N 3.19Å; E376-K380 PolarHBondContact O-N 3.44Å
377	A	92.9	Very high	88.6	Confident	2 Å²	2	59.3 Å²	59.3	2%	0.017	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-40.4	179.3	0	0	0	0	0	111.9	M357 K373 A374 Q375 K380 L381	M357-A377 HydrophobicContact CE-CB 4.48Å; M357-A377 HydrophobicContact CG-CB 4.23Å; K373-A377 VanDerWaalsContact O-CB 3.32Å; K373-A377 WeakPolarHBondContact O-CB 3.41Å; K373-A377 PolarHBondContact O-N 2.93Å; A374-A377 PolarHBondContact O-N 3.44Å; Q375-A377 PolarHBondContact O-N 2.9Å; A377-K380 PolarHBondContact O-N 2.87Å; A377-L381 WeakPolarHBondContact O-CB 3.43Å; A377-L381 WeakPolarHBondContact O-CD1 3.04Å; A377-L381 WeakPolarHBondContact O-CG 3.36Å; A377-L381 PolarHBondContact O-N 3.28Å
378	I	90.8	Very high	88.3	Confident	25 Å²	25	51 Å²	51	13%	0.128	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-46.1	174	-71.8	157.6	0	0	0	110.7	M357 L358 A374 Q375 E376 L381 E382	M357-I378 HydrophobicContact CB-CG1 3.93Å; M357-I378 HydrophobicContact CG-CD1 4.11Å; M357-I378 HydrophobicContact CG-CG1 3.61Å; L358-I378 HydrophobicContact CD2-CD1 3.82Å; L358-I378 HydrophobicContact CD2-CG1 4.23Å; L358-I378 HydrophobicContact CD2-CG2 3.92Å; L358-I378 HydrophobicContact CG-CD1 4.17Å; L358-I378 HydrophobicContact CG-CG1 4.21Å; L358-I378 HydrophobicContact CG-CG2 4.29Å; A374-I378 WeakPolarHBondContact O-CB 3.41Å; A374-I378 VanDerWaalsContact O-CD1 3.29Å; A374-I378 WeakPolarHBondContact O-CD1 3.32Å; A374-I378 WeakPolarHBondContact O-CG1 3.35Å; A374-I378 PolarHBondContact O-N 3.35Å; Q375-I378 PolarHBondContact O-N 2.83Å; E376-I378 PolarHBondContact O-N 3.14Å; I378-L381 PolarHBondContact O-N 3.09Å; I378-E382 WeakPolarHBondContact O-CB 3.48Å; I378-E382 PolarHBondContact O-N 2.91Å
379	Q	91.2	Very high	87.6	Confident	111 Å²	111	49.2 Å²	49.2	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-66.3	-41.4	-179.1	-169.4	62.3	59.1	0	0	111.8	Q375 E376 E382 N383	Q375-Q379 PolarHBondContact O-N 3.29Å; E376-Q379 PolarHBondContact O-N 3.19Å; Q379-E382 PolarHBondContact O-N 3.19Å; Q379-N383 PolarHBondContact NE2-OD1 3.28Å; Q379-N383 WeakPolarHBondContact O-CB 3.4Å; Q379-N383 PolarHBondContact O-N 3.25Å; Q379-N383 PolarHBondContact O-ND2 2.98Å; Q379-N383 PolarHBondContact O-OD1 2.86Å
380	K	89.8	Confident	86.9	Confident	74 Å²	74	51 Å²	51	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-58.1	-50.9	172	-75.7	-171.5	176.4	-163.2	0	111.8	G286 A289 D290 E376 A377 E382 N383 V384	G286-K380 WeakPolarHBondContact O-CD 3.47Å; G286-K380 PolarHBondContact O-NZ 3.27Å; A289-K380 HydrophobicContact CB-CB 3.94Å; A289-K380 HydrophobicContact CB-CD 4.32Å; D290-K380 WeakPolarHBondContact OD2-CD 3.43Å; D290-K380 WeakPolarHBondContact OD2-CE 3.33Å; D290-K380 IonicContact OD2-NZ 2.67Å; D290-K380 PolarHBondContact OD2-NZ 3.44Å; E376-K380 PolarHBondContact O-N 3.44Å; A377-K380 PolarHBondContact O-N 2.87Å; K380-E382 VanDerWaalsContact C-N 3.3Å; K380-E382 PolarHBondContact O-N 3.31Å; K380-N383 PolarHBondContact O-N 2.9Å; K380-V384 WeakPolarHBondContact O-CB 3.48Å; K380-V384 WeakPolarHBondContact O-CG2 3.26Å; K380-V384 PolarHBondContact O-N 2.66Å
381	L	88.9	Confident	85.8	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-40.3	179.9	-72.4	169.2	0	0	0	111.3	I285 A289 L292 K354 M357 A377 I378 T385	I285-L381 HydrophobicContact CG2-CD1 3.93Å; A289-L381 HydrophobicContact CB-CD2 3.69Å; A289-L381 HydrophobicContact CB-CG 3.95Å; L292-L381 HydrophobicContact CD1-CD2 3.51Å; K354-L381 HydrophobicContact CB-CB 4.23Å; M357-L381 HydrophobicContact CB-CD1 4.34Å; A377-L381 WeakPolarHBondContact O-CB 3.43Å; A377-L381 WeakPolarHBondContact O-CD1 3.04Å; A377-L381 WeakPolarHBondContact O-CG 3.36Å; A377-L381 PolarHBondContact O-N 3.28Å; I378-L381 PolarHBondContact O-N 3.09Å; L381-T385 WeakPolarHBondContact O-CB 3.01Å; L381-T385 PolarHBondContact O-N 2.87Å; L381-T385 PolarHBondContact O-OG1 3.01Å
382	E	86.2	Confident	84.7	Confident	21 Å²	21	57.5 Å²	57.5	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-46.4	177	-178.2	69.1	150.4	0	0	112.3	K354 I378 Q379 K380 V384 T385 Q386	K354-E382 VanDerWaalsContact CD-OE2 3.28Å; K354-E382 WeakPolarHBondContact CD-OE2 3.27Å; K354-E382 WeakPolarHBondContact CE-OE2 3.32Å; K354-E382 IonicContact NZ-OE1 4Å; K354-E382 PolarHBondContact NZ-OE1 3.36Å; K354-E382 IonicContact NZ-OE2 2.76Å; K354-E382 PolarHBondContact NZ-OE2 2.94Å; I378-E382 WeakPolarHBondContact O-CB 3.48Å; I378-E382 PolarHBondContact O-N 2.91Å; Q379-E382 PolarHBondContact O-N 3.19Å; K380-E382 VanDerWaalsContact C-N 3.3Å; K380-E382 PolarHBondContact O-N 3.31Å; E382-V384 VanDerWaalsContact C-N 3.3Å; E382-V384 PolarHBondContact O-N 2.86Å; E382-T385 CarbonylContact O-C 3.5Å; E382-T385 WeakPolarHBondContact O-CA 3.43Å; E382-T385 WeakPolarHBondContact O-CB 3.42Å; E382-T385 PolarHBondContact O-N 2.7Å; E382-Q386 VanDerWaalsContact CD-NE2 3.29Å; E382-Q386 HydrophobicContact CG-CG 4.05Å; E382-Q386 VanDerWaalsContact CG-NE2 3.34Å; E382-Q386 WeakPolarHBondContact O-CG 3.49Å; E382-Q386 PolarHBondContact O-N 2.89Å; E382-Q386 PolarHBondContact OE1-NE2 2.99Å
383	N	85.6	Confident	83.2	Confident	91 Å²	91	54.9 Å²	54.9	49%	0.487	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-45	177.9	-67.9	-8.5	0	0	0	111.4	Q379 K380 T385 A387	Q379-N383 PolarHBondContact NE2-OD1 3.28Å; Q379-N383 WeakPolarHBondContact O-CB 3.4Å; Q379-N383 PolarHBondContact O-N 3.25Å; Q379-N383 PolarHBondContact O-ND2 2.98Å; Q379-N383 PolarHBondContact O-OD1 2.86Å; K380-N383 PolarHBondContact O-N 2.9Å; N383-T385 VanDerWaalsContact C-N 3.33Å; N383-A387 PolarHBondContact O-N 3.38Å
384	V	81.3	Confident	81.8	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.048	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-36.4	176.8	172.1	0	0	0	0	111.3	K293 F350 K380 E382 V388	K293-V384 HydrophobicContact CG-CG1 4.08Å; F350-V384 HydrophobicContact CE2-CG1 3.73Å; F350-V384 HydrophobicContact CZ-CG1 3.67Å; K380-V384 WeakPolarHBondContact O-CB 3.48Å; K380-V384 WeakPolarHBondContact O-CG2 3.26Å; K380-V384 PolarHBondContact O-N 2.66Å; E382-V384 VanDerWaalsContact C-N 3.3Å; E382-V384 PolarHBondContact O-N 2.86Å; V384-V388 WeakPolarHBondContact O-CG2 3.46Å
385	T	80.3	Confident	80.1	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.012	31%	0.314	C	S	.	.	H	α-helix	trans	-69.6	-50.4	178.4	-68.3	0	0	0	0	112.8	M351 L381 E382 N383 A387 V388 N389 T397	M351-T385 HydrophobicContact CE-CG2 3.69Å; M351-T385 HydrophobicContact SD-CG2 3.41Å; M351-T385 WeakPolarHBondContact SD-CG2 3.28Å; L381-T385 WeakPolarHBondContact O-CB 3.01Å; L381-T385 PolarHBondContact O-N 2.87Å; L381-T385 PolarHBondContact O-OG1 3.01Å; E382-T385 CarbonylContact O-C 3.5Å; E382-T385 WeakPolarHBondContact O-CA 3.43Å; E382-T385 WeakPolarHBondContact O-CB 3.42Å; E382-T385 PolarHBondContact O-N 2.7Å; N383-T385 VanDerWaalsContact C-N 3.33Å; T385-A387 PolarHBondContact O-N 2.69Å; T385-V388 PolarHBondContact O-N 2.89Å; T385-N389 WeakPolarHBondContact CG2-ND2 3.35Å; T385-N389 PolarHBondContact O-N 3.37Å; T385-N389 VanDerWaalsContact O-N 3.08Å; T385-N389 PolarHBondContact O-ND2 2.97Å; T385-T397 HydrophobicContact CG2-CG2 3.9Å; T385-T397 WeakPolarHBondContact CG2-OG1 3.5Å
386	Q	81.7	Confident	78.4	Confident	74 Å²	74	57.3 Å²	57.3	35%	0.346	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-45	-176.7	-71.1	-177.2	2.9	0	0	111.4	E382 V388 N389 Q390	E382-Q386 VanDerWaalsContact CD-NE2 3.29Å; E382-Q386 HydrophobicContact CG-CG 4.05Å; E382-Q386 VanDerWaalsContact CG-NE2 3.34Å; E382-Q386 WeakPolarHBondContact O-CG 3.49Å; E382-Q386 PolarHBondContact O-N 2.89Å; E382-Q386 PolarHBondContact OE1-NE2 2.99Å; Q386-V388 PolarHBondContact O-N 2.84Å; Q386-N389 PolarHBondContact O-N 2.89Å; Q386-Q390 WeakPolarHBondContact O-CB 3.37Å; Q386-Q390 VanDerWaalsContact O-CG 3.3Å; Q386-Q390 WeakPolarHBondContact O-CG 3.44Å; Q386-Q390 PolarHBondContact O-N 2.72Å
387	A	78.1	Confident	77	Confident	46 Å²	46	51.6 Å²	51.6	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-57.7	-33.4	177.5	0	0	0	0	0	113.2	N383 T385 K391	N383-A387 PolarHBondContact O-N 3.38Å; T385-A387 PolarHBondContact O-N 2.69Å; A387-K391 WeakPolarHBondContact O-CB 3.5Å; A387-K391 PolarHBondContact O-N 3.15Å
388	V	74.6	Confident	75.7	Confident	1 Å²	1	56 Å²	56	1%	0.006	31%	0.305	C	S	.	.	H	α-helix	trans	-75.5	-46.9	175.6	168.4	0	0	0	0	111.9	Q296 L299 F350 V384 T385 Q386 Q390 K391 M392	Q296-V388 HydrophobicContact CG-CG2 3.72Å; L299-V388 HydrophobicContact CB-CG1 4.4Å; L299-V388 HydrophobicContact CD1-CG1 3.78Å; F350-V388 HydrophobicContact CE1-CB 3.78Å; F350-V388 HydrophobicContact CE1-CG1 3.91Å; F350-V388 HydrophobicContact CE1-CG2 3.89Å; F350-V388 HydrophobicContact CZ-CB 3.97Å; F350-V388 HydrophobicContact CZ-CG1 4.36Å; F350-V388 HydrophobicContact CZ-CG2 3.53Å; V384-V388 WeakPolarHBondContact O-CG2 3.46Å; T385-V388 PolarHBondContact O-N 2.89Å; Q386-V388 PolarHBondContact O-N 2.84Å; V388-Q390 VanDerWaalsContact C-N 3.35Å; V388-Q390 PolarHBondContact O-N 2.82Å; V388-K391 PolarHBondContact O-N 2.91Å; V388-M392 HydrophobicContact CG1-CG 4.17Å; V388-M392 WeakPolarHBondContact O-CB 3.27Å; V388-M392 WeakPolarHBondContact O-CG 3.22Å; V388-M392 PolarHBondContact O-N 3.17Å
389	N	76.3	Confident	74.8	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.027	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-37.6	-177.5	-66.9	-73.1	0	0	0	112.1	H347 T385 Q386 K391 M392 G393 L394 T397	H347-N389 PolarHBondContact NE2-OD1 2.82Å; T385-N389 WeakPolarHBondContact CG2-ND2 3.35Å; T385-N389 PolarHBondContact O-N 3.37Å; T385-N389 VanDerWaalsContact O-N 3.08Å; T385-N389 PolarHBondContact O-ND2 2.97Å; Q386-N389 PolarHBondContact O-N 2.89Å; N389-K391 PolarHBondContact O-N 2.92Å; N389-M392 CarbonylContact O-C 3.57Å; N389-M392 PolarHBondContact O-N 2.85Å; N389-G393 PolarHBondContact O-N 3.23Å; N389-G393 VanDerWaalsContact O-N 3.14Å; N389-L394 HydrophobicContact CB-CB 4.21Å; N389-L394 PolarHBondContact O-N 3.48Å; N389-T397 VanDerWaalsContact ND2-CG2 3.28Å; N389-T397 WeakPolarHBondContact ND2-CG2 3.38Å
390	Q	75.4	Confident	73.8	Confident	139 Å²	139	56 Å²	56	65%	0.65	31%	0.306	S	S	*	.	H	α-helix	trans	-55.7	-50.4	170.5	-72.9	170.5	-3.6	0	0	111.8	Q386 V388 M392 G393	Q386-Q390 WeakPolarHBondContact O-CB 3.37Å; Q386-Q390 VanDerWaalsContact O-CG 3.3Å; Q386-Q390 WeakPolarHBondContact O-CG 3.44Å; Q386-Q390 PolarHBondContact O-N 2.72Å; V388-Q390 VanDerWaalsContact C-N 3.35Å; V388-Q390 PolarHBondContact O-N 2.82Å; Q390-M392 VanDerWaalsContact C-N 3.27Å; Q390-M392 PolarHBondContact O-N 3.43Å; Q390-G393 PolarHBondContact O-N 2.98Å; Q390-G393 VanDerWaalsContact O-N 3.15Å
391	K	69.9	Low	72.8	Confident	134 Å²	134	53.1 Å²	53.1	58%	0.583	29%	0.294	S	S	*	.	H	α-helix	trans	-66.2	-29.1	179.4	-170.5	177.5	175.3	-159.8	0	113.1	D300 A387 V388 N389 G393	D300-K391 VanDerWaalsContact OD1-CD 3.23Å; D300-K391 WeakPolarHBondContact OD1-CD 3.49Å; D300-K391 WeakPolarHBondContact OD1-CE 3.24Å; D300-K391 IonicContact OD1-NZ 2.67Å; D300-K391 PolarHBondContact OD1-NZ 3.25Å; D300-K391 IonicContact OD2-NZ 2.71Å; D300-K391 PolarHBondContact OD2-NZ 3.28Å; A387-K391 WeakPolarHBondContact O-CB 3.5Å; A387-K391 PolarHBondContact O-N 3.15Å; V388-K391 PolarHBondContact O-N 2.91Å; N389-K391 PolarHBondContact O-N 2.92Å; K391-G393 VanDerWaalsContact C-N 3.32Å
392	M	69	Low	72.2	Confident	41 Å²	41	58.4 Å²	58.4	20%	0.202	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.1	175.4	-71.3	-66.6	-65.9	0	0	114.3	L299 K302 V388 N389 Q390 L394	L299-M392 HydrophobicContact CB-SD 4.34Å; L299-M392 VanDerWaalsContact O-CE 3.28Å; L299-M392 WeakPolarHBondContact O-CE 3.42Å; K302-M392 HydrophobicContact CB-CE 4.45Å; V388-M392 HydrophobicContact CG1-CG 4.17Å; V388-M392 WeakPolarHBondContact O-CB 3.27Å; V388-M392 WeakPolarHBondContact O-CG 3.22Å; V388-M392 PolarHBondContact O-N 3.17Å; N389-M392 CarbonylContact O-C 3.57Å; N389-M392 PolarHBondContact O-N 2.85Å; Q390-M392 VanDerWaalsContact C-N 3.27Å; Q390-M392 PolarHBondContact O-N 3.43Å; M392-L394 HydrophobicContact CB-CB 4.31Å; M392-L394 HydrophobicContact CB-CD1 3.73Å; M392-L394 HydrophobicContact CB-CG 3.76Å; M392-L394 HydrophobicContact CE-CD1 4.37Å; M392-L394 HydrophobicContact CG-CD1 4.35Å; M392-L394 PolarHBondContact O-N 2.98Å
393	G	61.8	Low	71.8	Confident	70 Å²	70	57.5 Å²	57.5	72%	0.722	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	22.9	-171	0	0	0	0	0	113.8	N389 Q390 K391	N389-G393 PolarHBondContact O-N 3.23Å; N389-G393 VanDerWaalsContact O-N 3.14Å; Q390-G393 PolarHBondContact O-N 2.98Å; Q390-G393 VanDerWaalsContact O-N 3.15Å; K391-G393 VanDerWaalsContact C-N 3.32Å
394	L	63.7	Low	71.1	Confident	65 Å²	65	53.9 Å²	53.9	34%	0.34	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-93.8	147	-179.7	-66.8	173.4	0	0	0	110.7	N389 M392	N389-L394 HydrophobicContact CB-CB 4.21Å; N389-L394 PolarHBondContact O-N 3.48Å; M392-L394 HydrophobicContact CB-CB 4.31Å; M392-L394 HydrophobicContact CB-CD1 3.73Å; M392-L394 HydrophobicContact CB-CG 3.76Å; M392-L394 HydrophobicContact CE-CD1 4.37Å; M392-L394 HydrophobicContact CG-CD1 4.35Å; M392-L394 PolarHBondContact O-N 2.98Å
395	P	58.8	Low	70.6	Confident	88 Å²	88	57.3 Å²	57.3	57%	0.571	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-60.2	157.5	178.3	26.1	-35.1	0	0	0	111.8	T397	P395-T397 PolarHBondContact O-N 2.87Å
396	T	57.8	Low	70.5	Confident	81 Å²	81	59.6 Å²	59.6	50%	0.497	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-60.7	135.2	179.7	49.9	0	0	0	0	110.7	E398 E399	T396-E398 PolarHBondContact O-N 2.91Å; T396-E399 PolarHBondContact O-N 3.06Å
397	T	62.7	Low	70.2	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.018	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-3.3	-174.6	40.8	0	0	0	0	114.1	M351 T385 N389 P395 E399 L400 T401	M351-T397 VanDerWaalsContact CE-CB 3.47Å; M351-T397 HydrophobicContact CE-CG2 3.26Å; M351-T397 HydrophobicContact SD-CG2 3.35Å; M351-T397 WeakPolarHBondContact SD-CG2 3.27Å; T385-T397 HydrophobicContact CG2-CG2 3.9Å; T385-T397 WeakPolarHBondContact CG2-OG1 3.5Å; N389-T397 VanDerWaalsContact ND2-CG2 3.28Å; N389-T397 WeakPolarHBondContact ND2-CG2 3.38Å; P395-T397 PolarHBondContact O-N 2.87Å; T397-E399 VanDerWaalsContact C-N 3.3Å; T397-E399 PolarHBondContact O-N 2.84Å; T397-L400 PolarHBondContact O-N 3.11Å; T397-T401 VanDerWaalsContact O-CB 3.27Å; T397-T401 WeakPolarHBondContact O-CB 3.28Å; T397-T401 PolarHBondContact O-N 2.7Å; T397-T401 PolarHBondContact O-OG1 2.83Å
398	E	65.8	Low	69.7	Low	96 Å²	96	57.8 Å²	57.8	45%	0.449	30%	0.297	S	S	.	.	H	α-helix	trans	-55.3	-41	168.6	-160.4	-169.2	161	0	0	112.1	T396 T401 K402	T396-E398 PolarHBondContact O-N 2.91Å; E398-T401 PolarHBondContact O-N 3.28Å; E398-K402 VanDerWaalsContact CD-NZ 3.33Å; E398-K402 HydrophobicContact CG-CD 4.29Å; E398-K402 WeakPolarHBondContact O-CB 3.48Å; E398-K402 VanDerWaalsContact O-CG 3.25Å; E398-K402 WeakPolarHBondContact O-CG 3.34Å; E398-K402 PolarHBondContact O-N 3.01Å; E398-K402 WeakPolarHBondContact OE1-CE 3.47Å; E398-K402 IonicContact OE1-NZ 3.49Å; E398-K402 PolarHBondContact OE1-NZ 3.47Å
399	E	71.9	Confident	69.1	Low	92 Å²	92	58.5 Å²	58.5	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-65.1	-49	178.6	-65.2	-158.6	128.2	0	0	112.2	T396 T397 T401 K402 L403	T396-E399 PolarHBondContact O-N 3.06Å; T397-E399 VanDerWaalsContact C-N 3.3Å; T397-E399 PolarHBondContact O-N 2.84Å; E399-T401 VanDerWaalsContact C-N 3.29Å; E399-T401 PolarHBondContact O-N 3.48Å; E399-K402 PolarHBondContact O-N 3.29Å; E399-L403 WeakPolarHBondContact O-CB 3.3Å; E399-L403 PolarHBondContact O-N 2.63Å
400	L	70.4	Confident	68.4	Low	44 Å²	44	60.2 Å²	60.2	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-66.4	-32.4	177.2	-64.5	174.8	0	0	0	111.7	T397 Y404 V413 L414 L420	T397-L400 PolarHBondContact O-N 3.11Å; L400-Y404 VanDerWaalsContact O-CB 3.28Å; L400-Y404 WeakPolarHBondContact O-CB 3.25Å; L400-Y404 PolarHBondContact O-N 2.76Å; L400-V413 HydrophobicContact CD2-CG1 3.9Å; L400-L414 HydrophobicContact CD1-CD2 4.33Å; L400-L420 HydrophobicContact CD2-CB 3.97Å; L400-L420 HydrophobicContact CD2-CD2 4.06Å
401	T	68	Low	68.2	Low	12 Å²	12	54.2 Å²	54.2	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-52.1	173.5	-57.6	0	0	0	0	110.8	L355 L358 T397 E398 E399 L403 Y404 Y405	L355-T401 HydrophobicContact CD2-CG2 3.83Å; L358-T401 HydrophobicContact CD1-CG2 3.94Å; T397-T401 VanDerWaalsContact O-CB 3.27Å; T397-T401 WeakPolarHBondContact O-CB 3.28Å; T397-T401 PolarHBondContact O-N 2.7Å; T397-T401 PolarHBondContact O-OG1 2.83Å; E398-T401 PolarHBondContact O-N 3.28Å; E399-T401 VanDerWaalsContact C-N 3.29Å; E399-T401 PolarHBondContact O-N 3.48Å; T401-L403 VanDerWaalsContact C-N 3.26Å; T401-L403 PolarHBondContact O-N 3.45Å; T401-Y404 PolarHBondContact O-N 2.92Å; T401-Y405 HydrophobicContact CG2-CD2 3.83Å; T401-Y405 HydrophobicContact CG2-CE2 3.83Å; T401-Y405 WeakPolarHBondContact O-CB 3.21Å; T401-Y405 WeakPolarHBondContact O-CD2 3.43Å; T401-Y405 PolarHBondContact O-N 3.47Å
402	K	76.4	Confident	68.2	Low	114 Å²	114	49.3 Å²	49.3	50%	0.496	26%	0.262	S	S	.	.	H	α-helix	trans	-55	-43.2	174.1	-76.2	168.3	178.8	167.7	0	111.1	E398 E399 Y405 R406	E398-K402 VanDerWaalsContact CD-NZ 3.33Å; E398-K402 HydrophobicContact CG-CD 4.29Å; E398-K402 WeakPolarHBondContact O-CB 3.48Å; E398-K402 VanDerWaalsContact O-CG 3.25Å; E398-K402 WeakPolarHBondContact O-CG 3.34Å; E398-K402 PolarHBondContact O-N 3.01Å; E398-K402 WeakPolarHBondContact OE1-CE 3.47Å; E398-K402 IonicContact OE1-NZ 3.49Å; E398-K402 PolarHBondContact OE1-NZ 3.47Å; E399-K402 PolarHBondContact O-N 3.29Å; K402-Y405 PolarHBondContact O-N 3.39Å; K402-R406 VanDerWaalsContact O-CG 3.32Å; K402-R406 WeakPolarHBondContact O-CG 3.45Å; K402-R406 PolarHBondContact O-N 3.08Å
403	L	77.6	Confident	68.3	Low	1 Å²	1	47.6 Å²	47.6	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-46.4	-179.6	-173.6	59.7	0	0	0	112.2	E399 T401 Y405 R406 F407 V413 L420 V440 F442 F457	E399-L403 WeakPolarHBondContact O-CB 3.3Å; E399-L403 PolarHBondContact O-N 2.63Å; T401-L403 VanDerWaalsContact C-N 3.26Å; T401-L403 PolarHBondContact O-N 3.45Å; L403-Y405 VanDerWaalsContact C-N 3.32Å; L403-Y405 PolarHBondContact O-N 3.02Å; L403-R406 PolarHBondContact O-N 3.1Å; L403-F407 HydrophobicContact CD1-CD2 4.03Å; L403-F407 HydrophobicContact CD1-CE2 3.67Å; L403-F407 HydrophobicContact CG-CD2 4.03Å; L403-F407 HydrophobicContact CG-CE2 3.91Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 3.3Å; L403-F407 PolarHBondContact O-N 3.32Å; L403-V413 HydrophobicContact CD2-CG1 4.24Å; L403-V413 HydrophobicContact CG-CG2 4.38Å; L403-L420 HydrophobicContact CD2-CD1 3.95Å; L403-L420 HydrophobicContact CD2-CD2 3.96Å; L403-V440 HydrophobicContact CD1-CG1 3.95Å; L403-V440 HydrophobicContact CD1-CG2 3.91Å; L403-V440 HydrophobicContact CD2-CG1 3.77Å; L403-V440 HydrophobicContact CG-CG1 4.44Å; L403-F442 HydrophobicContact CD2-CE1 4.3Å; L403-F442 HydrophobicContact CD2-CZ 3.84Å; L403-F457 HydrophobicContact CD1-CE2 3.92Å; L403-F457 HydrophobicContact CD1-CZ 4.23Å
404	Y	71.4	Confident	68.5	Low	15 Å²	15	44.4 Å²	44.4	6%	0.059	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-41.4	174.9	179.3	-101.5	0	0	0	112.1	L355 L400 T401 F407 Q408 C409 V413	L355-Y404 HydrophobicContact CB-CD1 4.01Å; L355-Y404 HydrophobicContact CB-CE1 3.77Å; L355-Y404 HydrophobicContact CD1-CD1 3.8Å; L355-Y404 HydrophobicContact CD1-CD2 4.15Å; L355-Y404 HydrophobicContact CD1-CE1 4.18Å; L355-Y404 HydrophobicContact CD1-CG 3.77Å; L355-Y404 HydrophobicContact CD2-CD1 4.08Å; L355-Y404 HydrophobicContact CG-CD1 4.19Å; L355-Y404 HydrophobicContact CG-CE1 4.43Å; L400-Y404 VanDerWaalsContact O-CB 3.28Å; L400-Y404 WeakPolarHBondContact O-CB 3.25Å; L400-Y404 PolarHBondContact O-N 2.76Å; T401-Y404 PolarHBondContact O-N 2.92Å; Y404-F407 CarbonylContact O-C 3.51Å; Y404-F407 PolarHBondContact O-N 2.65Å; Y404-Q408 PolarHBondContact O-N 2.82Å; Y404-C409 HydrophobicContact CE1-CB 3.93Å; Y404-C409 WeakPolarHBondContact CE1-SG 3.23Å; Y404-C409 HydrophobicContact CE2-CB 4.41Å; Y404-C409 PolarHBondContact O-N 2.74Å; Y404-V413 HydrophobicContact CD2-CB 4.41Å; Y404-V413 HydrophobicContact CD2-CG2 4.27Å
405	Y	69.8	Low	68.9	Low	81 Å²	81	43.5 Å²	43.5	32%	0.318	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-45.8	171.6	-89.9	-58.8	0	0	0	112.8	L358 T401 K402 L403 F407 Q408 Q456	L358-Y405 WeakPolarHBondContact CB-OH 3.45Å; L358-Y405 HydrophobicContact CD1-CE2 4.11Å; L358-Y405 WeakPolarHBondContact CD2-OH 3.26Å; T401-Y405 HydrophobicContact CG2-CD2 3.83Å; T401-Y405 HydrophobicContact CG2-CE2 3.83Å; T401-Y405 WeakPolarHBondContact O-CB 3.21Å; T401-Y405 WeakPolarHBondContact O-CD2 3.43Å; T401-Y405 PolarHBondContact O-N 3.47Å; K402-Y405 PolarHBondContact O-N 3.39Å; L403-Y405 VanDerWaalsContact C-N 3.32Å; L403-Y405 PolarHBondContact O-N 3.02Å; Y405-F407 PolarHBondContact O-N 3.09Å; Y405-Q408 WeakPolarHBondContact O-CA 3.42Å; Y405-Q408 PolarHBondContact O-N 3.49Å; Y405-Q456 PolarHBondContact O-NE2 3.24Å; Y405-Q456 PolarHBondContact O-OE1 3Å
406	R	79.1	Confident	69.1	Low	50 Å²	50	40.6 Å²	40.6	19%	0.189	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-25.9	176.9	-72	178.9	85.9	-169	11.5	112.9	K402 L403 Q408 Y438 G455 Q456 F457	K402-R406 VanDerWaalsContact O-CG 3.32Å; K402-R406 WeakPolarHBondContact O-CG 3.45Å; K402-R406 PolarHBondContact O-N 3.08Å; L403-R406 PolarHBondContact O-N 3.1Å; R406-Q408 PolarHBondContact O-N 3.47Å; R406-Y438 VanDerWaalsContact NH1-CD2 3.33Å; R406-G455 PolarHBondContact NE-O 3.06Å; R406-Q456 VanDerWaalsContact CA-OE1 3.25Å; R406-Q456 PolarHBondContact O-OE1 2.99Å; R406-F457 HydrophobicContact CB-CD1 4.45Å; R406-F457 HydrophobicContact CB-CD2 3.97Å; R406-F457 HydrophobicContact CB-CE1 4.29Å; R406-F457 HydrophobicContact CB-CE2 3.79Å; R406-F457 HydrophobicContact CB-CG 4.3Å; R406-F457 HydrophobicContact CB-CZ 3.96Å; R406-F457 VanDerWaalsContact O-CB 3.25Å; R406-F457 WeakPolarHBondContact O-CB 3.4Å; R406-F457 WeakPolarHBondContact O-CD2 3.5Å; R406-F457 WeakPolarHBondContact O-CG 3.49Å; R406-F457 PolarHBondContact O-N 3.19Å
407	F	75.2	Confident	69.5	Low	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	6.6	167.8	-82.1	-67.8	0	0	0	113.8	L403 Y404 Y405 C409 Q410 F411 V413 V440 F442 W447 F457 I459	L403-F407 HydrophobicContact CD1-CD2 4.03Å; L403-F407 HydrophobicContact CD1-CE2 3.67Å; L403-F407 HydrophobicContact CG-CD2 4.03Å; L403-F407 HydrophobicContact CG-CE2 3.91Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 3.3Å; L403-F407 PolarHBondContact O-N 3.32Å; Y404-F407 CarbonylContact O-C 3.51Å; Y404-F407 PolarHBondContact O-N 2.65Å; Y405-F407 PolarHBondContact O-N 3.09Å; F407-C409 PolarHBondContact O-N 3.41Å; F407-C409 VanDerWaalsContact O-N 3.16Å; F407-Q410 WeakPolarHBondContact O-CB 3.07Å; F407-Q410 PolarHBondContact O-N 2.86Å; F407-F411 HydrophobicContact CB-CB 3.96Å; F407-F411 HydrophobicContact CD1-CB 3.56Å; F407-F411 HydrophobicContact CD1-CD1 4.14Å; F407-F411 HydrophobicContact CD1-CG 4.16Å; F407-F411 HydrophobicContact CD2-CB 4.4Å; F407-F411 AromaticContact CD2-CD1 3.89Å; F407-F411 HydrophobicContact CD2-CD1 3.89Å; F407-F411 HydrophobicContact CE1-CB 4.15Å; F407-F411 HydrophobicContact CE1-CD1 4.09Å; F407-F411 HydrophobicContact CE1-CG 4.29Å; F407-F411 AromaticContact CE2-CD1 3.82Å; F407-F411 HydrophobicContact CE2-CD1 3.82Å; F407-F411 HydrophobicContact CE2-CE1 4.41Å; F407-F411 HydrophobicContact CG-CB 3.74Å; F407-F411 HydrophobicContact CG-CD1 4.07Å; F407-F411 HydrophobicContact CG-CG 4.36Å; F407-F411 AromaticContact CZ-CD1 3.94Å; F407-F411 HydrophobicContact CZ-CD1 3.94Å; F407-F411 HydrophobicContact CZ-CE1 4.5Å; F407-V413 HydrophobicContact CD2-CG2 3.83Å; F407-V413 HydrophobicContact CE2-CG2 4.37Å; F407-V440 HydrophobicContact CZ-CG2 4.41Å; F407-F442 HydrophobicContact CE2-CE2 4.48Å; F407-W447 AromaticContact CE1-CD2 3.68Å; F407-W447 HydrophobicContact CE1-CD2 3.68Å; F407-W447 AromaticContact CE1-CE2 3.63Å; F407-W447 HydrophobicContact CE1-CE3 4.08Å; F407-W447 HydrophobicContact CE1-CG 4.03Å; F407-W447 HydrophobicContact CE1-CH2 4.39Å; F407-W447 HydrophobicContact CE1-CZ2 4.01Å; F407-W447 HydrophobicContact CE1-CZ3 4.43Å; F407-W447 AromaticContact CE1-NE1 3.92Å; F407-W447 HydrophobicContact CZ-CB 4.27Å; F407-W447 AromaticContact CZ-CD1 3.74Å; F407-W447 AromaticContact CZ-CD2 3.95Å; F407-W447 HydrophobicContact CZ-CD2 3.95Å; F407-W447 AromaticContact CZ-CG 3.76Å; F407-W447 HydrophobicContact CZ-CG 3.76Å; F407-W447 AromaticContact CZ-NE1 3.85Å; F407-F457 AromaticContact CD1-CD2 3.75Å; F407-F457 HydrophobicContact CD1-CD2 3.75Å; F407-F457 HydrophobicContact CD1-CE2 4.36Å; F407-F457 HydrophobicContact CD2-CD2 4.14Å; F407-F457 HydrophobicContact CD2-CE2 4.01Å; F407-F457 AromaticContact CE1-CD2 3.78Å; F407-F457 HydrophobicContact CE1-CD2 3.78Å; F407-F457 HydrophobicContact CE1-CE2 4.17Å; F407-F457 HydrophobicContact CE2-CD2 4.19Å; F407-F457 AromaticContact CE2-CE2 3.82Å; F407-F457 HydrophobicContact CE2-CE2 3.82Å; F407-F457 AromaticContact CG-CD2 3.91Å; F407-F457 HydrophobicContact CG-CD2 3.91Å; F407-F457 HydrophobicContact CG-CE2 4.26Å; F407-F457 AromaticContact CZ-CD2 4Å; F407-F457 HydrophobicContact CZ-CD2 4Å; F407-F457 AromaticContact CZ-CE2 3.89Å; F407-F457 HydrophobicContact CZ-CE2 3.89Å; F407-I459 HydrophobicContact CD1-CD1 3.7Å; F407-I459 HydrophobicContact CE1-CD1 4.32Å
408	Q	66.9	Low	70.2	Confident	81 Å²	81	37.5 Å²	37.5	38%	0.379	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	28.6	-179.6	-55.4	179.6	23.2	0	0	113.7	Y404 Y405 R406 Q410 Q456 F457	Y404-Q408 PolarHBondContact O-N 2.82Å; Y405-Q408 WeakPolarHBondContact O-CA 3.42Å; Y405-Q408 PolarHBondContact O-N 3.49Å; R406-Q408 PolarHBondContact O-N 3.47Å; Q408-Q410 HydrophobicContact CB-CG 4.01Å; Q408-Q410 WeakPolarHBondContact O-CG 3.41Å; Q408-Q410 PolarHBondContact O-N 3.2Å; Q408-Q410 VanDerWaalsContact O-N 3.12Å; Q408-Q456 HydrophobicContact CG-CB 4.36Å; Q408-Q456 VanDerWaalsContact CG-OE1 3.27Å; Q408-F457 PolarHBondContact NE2-O 3.37Å
409	C	62.7	Low	70.8	Confident	16 Å²	16	36.6 Å²	36.6	11%	0.108	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	6.8	-167.8	-49.3	0	0	0	0	115.2	Y404 F407	Y404-C409 HydrophobicContact CE1-CB 3.93Å; Y404-C409 WeakPolarHBondContact CE1-SG 3.23Å; Y404-C409 HydrophobicContact CE2-CB 4.41Å; Y404-C409 PolarHBondContact O-N 2.74Å; F407-C409 PolarHBondContact O-N 3.41Å; F407-C409 VanDerWaalsContact O-N 3.16Å
410	Q	62	Low	71.3	Confident	42 Å²	42	34 Å²	34	20%	0.196	17%	0.169	C	C	.	.			trans	-83.8	-16.9	-174.7	-58.1	172.7	15.5	0	0	113.5	S160 L162 F407 Q408 I459	S160-Q410 WeakPolarHBondContact CB-O 3.3Å; L162-Q410 HydrophobicContact CD1-CB 4.33Å; L162-Q410 HydrophobicContact CD1-CG 4.03Å; L162-Q410 HydrophobicContact CD2-CG 3.93Å; L162-Q410 HydrophobicContact CG-CB 4.42Å; L162-Q410 HydrophobicContact CG-CG 3.9Å; F407-Q410 WeakPolarHBondContact O-CB 3.07Å; F407-Q410 PolarHBondContact O-N 2.86Å; Q408-Q410 HydrophobicContact CB-CG 4.01Å; Q408-Q410 WeakPolarHBondContact O-CG 3.41Å; Q408-Q410 PolarHBondContact O-N 3.2Å; Q408-Q410 VanDerWaalsContact O-N 3.12Å; Q410-I459 HydrophobicContact CB-CG1 4.43Å
411	F	71.2	Confident	72	Confident	12 Å²	12	34.7 Å²	34.7	5%	0.053	17%	0.172	C	C	.	.	S	Bend	trans	-118.5	134.7	176.5	176.1	-110.5	0	0	0	111.6	F407 V413 F442 W447	F407-F411 HydrophobicContact CB-CB 3.96Å; F407-F411 HydrophobicContact CD1-CB 3.56Å; F407-F411 HydrophobicContact CD1-CD1 4.14Å; F407-F411 HydrophobicContact CD1-CG 4.16Å; F407-F411 HydrophobicContact CD2-CB 4.4Å; F407-F411 AromaticContact CD2-CD1 3.89Å; F407-F411 HydrophobicContact CD2-CD1 3.89Å; F407-F411 HydrophobicContact CE1-CB 4.15Å; F407-F411 HydrophobicContact CE1-CD1 4.09Å; F407-F411 HydrophobicContact CE1-CG 4.29Å; F407-F411 AromaticContact CE2-CD1 3.82Å; F407-F411 HydrophobicContact CE2-CD1 3.82Å; F407-F411 HydrophobicContact CE2-CE1 4.41Å; F407-F411 HydrophobicContact CG-CB 3.74Å; F407-F411 HydrophobicContact CG-CD1 4.07Å; F407-F411 HydrophobicContact CG-CG 4.36Å; F407-F411 AromaticContact CZ-CD1 3.94Å; F407-F411 HydrophobicContact CZ-CD1 3.94Å; F407-F411 HydrophobicContact CZ-CE1 4.5Å; F411-V413 HydrophobicContact CD1-CG2 3.95Å; F411-V413 HydrophobicContact CE1-CG2 4.37Å; F411-V413 PolarHBondContact O-N 3.37Å; F411-F442 HydrophobicContact CE1-CD2 4.29Å; F411-F442 AromaticContact CE1-CE2 3.6Å; F411-F442 HydrophobicContact CE1-CE2 3.6Å; F411-F442 AromaticContact CE1-CZ 3.82Å; F411-F442 HydrophobicContact CE1-CZ 3.82Å; F411-F442 HydrophobicContact CZ-CE2 4.26Å; F411-W447 HydrophobicContact CB-CZ2 4.27Å; F411-W447 AromaticContact CD1-NE1 3.65Å; F411-W447 AromaticContact CD2-CE2 4Å; F411-W447 AromaticContact CD2-CZ2 3.71Å; F411-W447 HydrophobicContact CD2-CZ2 3.71Å; F411-W447 AromaticContact CD2-NE1 3.66Å; F411-W447 AromaticContact CE1-NE1 3.45Å; F411-W447 HydrophobicContact CE2-CZ2 4.22Å; F411-W447 AromaticContact CE2-NE1 3.46Å; F411-W447 AromaticContact CG-CZ2 3.94Å; F411-W447 HydrophobicContact CG-CZ2 3.94Å; F411-W447 AromaticContact CG-NE1 3.76Å; F411-W447 AromaticContact CZ-NE1 3.34Å; F411-W447 VanDerWaalsContact CZ-NE1 3.34Å
412	N	69.3	Low	73	Confident	32 Å²	32	37.3 Å²	37.3	17%	0.171	18%	0.181	C	C	.	.			trans	-77.5	84	-179.5	-173	28.9	0	0	0	111.9	R352 L414 E415 R418	R352-N412 PolarHBondContact NH2-OD1 3.11Å; N412-L414 PolarHBondContact O-N 2.97Å; N412-E415 WeakPolarHBondContact ND2-CB 3.28Å; N412-E415 PolarHBondContact ND2-OE2 2.97Å; N412-R418 PolarHBondContact O-NH1 3.15Å
413	V	71.7	Confident	73.7	Confident	4 Å²	4	34 Å²	34	2%	0.024	17%	0.167	C	C	.	.	S	Bend	trans	-61.4	-32.4	176.8	178.6	0	0	0	0	111.9	L400 L403 Y404 F407 F411 E415 F442	L400-V413 HydrophobicContact CD2-CG1 3.9Å; L403-V413 HydrophobicContact CD2-CG1 4.24Å; L403-V413 HydrophobicContact CG-CG2 4.38Å; Y404-V413 HydrophobicContact CD2-CB 4.41Å; Y404-V413 HydrophobicContact CD2-CG2 4.27Å; F407-V413 HydrophobicContact CD2-CG2 3.83Å; F407-V413 HydrophobicContact CE2-CG2 4.37Å; F411-V413 HydrophobicContact CD1-CG2 3.95Å; F411-V413 HydrophobicContact CE1-CG2 4.37Å; F411-V413 PolarHBondContact O-N 3.37Å; V413-E415 PolarHBondContact O-N 2.79Å; V413-F442 HydrophobicContact CG1-CE1 4.15Å; V413-F442 HydrophobicContact CG1-CZ 4.3Å
414	L	66.8	Low	74.4	Confident	3 Å²	3	35 Å²	35	2%	0.016	17%	0.174	C	C	.	.	S	Bend	trans	-98.7	50.9	-172.6	-57.8	-174.5	0	0	0	113.5	Q348 M351 R352 L355 L400 N412	Q348-L414 HydrophobicContact CB-CB 4.35Å; Q348-L414 VanDerWaalsContact OE1-CA 3.28Å; Q348-L414 VanDerWaalsContact OE1-CB 3.24Å; Q348-L414 VanDerWaalsContact OE1-CD2 3.29Å; M351-L414 HydrophobicContact CB-CD1 3.62Å; M351-L414 HydrophobicContact CB-CD2 4.49Å; R352-L414 HydrophobicContact CB-CD1 4.1Å; R352-L414 PolarHBondContact NH1-O 3.42Å; R352-L414 PolarHBondContact NH2-O 3.41Å; L355-L414 HydrophobicContact CD1-CD1 3.48Å; L355-L414 VanDerWaalsContact CD1-CD1 3.48Å; L355-L414 HydrophobicContact CD1-CG 4.09Å; L355-L414 HydrophobicContact CG-CD1 4.49Å; L400-L414 HydrophobicContact CD1-CD2 4.33Å; N412-L414 PolarHBondContact O-N 2.97Å
415	E	70.9	Confident	75.4	Confident	47 Å²	47	40.5 Å²	40.5	22%	0.22	20%	0.201	C	C	.	.			trans	-89.1	144.9	-179.6	-157.2	161.9	109.4	0	0	111.8	Q348 N412 V413 G417 R418	Q348-E415 PolarHBondContact NE2-O 2.73Å; N412-E415 WeakPolarHBondContact ND2-CB 3.28Å; N412-E415 PolarHBondContact ND2-OE2 2.97Å; V413-E415 PolarHBondContact O-N 2.79Å; E415-G417 PolarHBondContact O-N 3.35Å; E415-R418 HydrophobicContact CB-CB 3.81Å; E415-R418 VanDerWaalsContact CB-NH1 3.34Å; E415-R418 VanDerWaalsContact CD-CZ 3.48Å; E415-R418 VanDerWaalsContact O-CB 3.32Å; E415-R418 WeakPolarHBondContact O-CB 3.46Å; E415-R418 PolarHBondContact O-N 3.03Å; E415-R418 IonicContact OE1-CZ 3.6Å; E415-R418 IonicContact OE1-NH1 2.73Å; E415-R418 PolarHBondContact OE1-NH1 3.36Å; E415-R418 IonicContact OE1-NH2 3.86Å; E415-R418 PolarHBondContact OE1-NH2 3.17Å; E415-R418 IonicContact OE2-CZ 2.67Å; E415-R418 IonicContact OE2-NH1 3.22Å; E415-R418 PolarHBondContact OE2-NH1 3.18Å; E415-R418 IonicContact OE2-NH2 3.73Å; E415-R418 PolarHBondContact OE2-NH2 3Å
416	P	62.7	Low	76.6	Confident	26 Å²	26	37 Å²	37	17%	0.169	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	130.2	178.3	-26.9	37.1	0	0	0	112.4	Q341 Q345 R418	Q341-P416 WeakPolarHBondContact O-CB 3.42Å; Q345-P416 HydrophobicContact CB-CG 4.15Å; Q345-P416 HydrophobicContact CG-CG 4.41Å; Q345-P416 VanDerWaalsContact OE1-CG 3.24Å; P416-R418 PolarHBondContact O-N 3.28Å
417	G	66.7	Low	77.2	Confident	17 Å²	17	38 Å²	38	18%	0.175	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	-1.7	-172.1	0	0	0	0	0	116.1	Q341 D344 E415 T443	Q341-G417 PolarHBondContact O-N 2.86Å; D344-G417 PolarHBondContact OD2-N 3.04Å; E415-G417 PolarHBondContact O-N 3.35Å; G417-T443 PolarHBondContact O-OG1 3.46Å
418	R	78.3	Confident	78	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.011	20%	0.2	C	C	.	.			trans	-87.9	117.6	170.4	-174.6	172.4	-68.2	131.2	16.4	109.7	Q348 N412 E415 P416 F442 T443 D444	Q348-R418 PolarHBondContact NE2-O 3.09Å; N412-R418 PolarHBondContact O-NH1 3.15Å; E415-R418 HydrophobicContact CB-CB 3.81Å; E415-R418 VanDerWaalsContact CB-NH1 3.34Å; E415-R418 VanDerWaalsContact CD-CZ 3.48Å; E415-R418 VanDerWaalsContact O-CB 3.32Å; E415-R418 WeakPolarHBondContact O-CB 3.46Å; E415-R418 PolarHBondContact O-N 3.03Å; E415-R418 IonicContact OE1-CZ 3.6Å; E415-R418 IonicContact OE1-NH1 2.73Å; E415-R418 PolarHBondContact OE1-NH1 3.36Å; E415-R418 IonicContact OE1-NH2 3.86Å; E415-R418 PolarHBondContact OE1-NH2 3.17Å; E415-R418 IonicContact OE2-CZ 2.67Å; E415-R418 IonicContact OE2-NH1 3.22Å; E415-R418 PolarHBondContact OE2-NH1 3.18Å; E415-R418 IonicContact OE2-NH2 3.73Å; E415-R418 PolarHBondContact OE2-NH2 3Å; P416-R418 PolarHBondContact O-N 3.28Å; R418-F442 HydrophobicContact CG-CB 3.91Å; R418-F442 HydrophobicContact CG-CD1 3.52Å; R418-F442 HydrophobicContact CG-CE1 4.24Å; R418-F442 HydrophobicContact CG-CG 3.87Å; R418-T443 WeakPolarHBondContact CA-OG1 3.28Å; R418-D444 IonicContact CZ-OD2 2.65Å; R418-D444 VanDerWaalsContact CZ-OD2 3.24Å; R418-D444 IonicContact NE-OD1 3.09Å; R418-D444 PolarHBondContact NE-OD1 3.42Å; R418-D444 VanDerWaalsContact NE-OD1 3.11Å; R418-D444 IonicContact NE-OD2 2.68Å; R418-D444 PolarHBondContact NE-OD2 3.39Å; R418-D444 IonicContact NH2-OD2 2.87Å; R418-D444 PolarHBondContact NH2-OD2 3.49Å
419	V	76.9	Confident	79.1	Confident	77 Å²	77	38.8 Å²	38.8	47%	0.467	20%	0.198	S	C	.	.			trans	-126.7	137.9	176.1	-175.3	0	0	0	0	108.6	F442 T443	V419-F442 CarbonylContact O-C 3.56Å; V419-F442 VanDerWaalsContact O-CA 3.23Å; V419-F442 WeakPolarHBondContact O-CA 3.2Å; V419-T443 HydrophobicContact CB-CG2 3.93Å; V419-T443 PolarHBondContact N-OG1 3.32Å; V419-T443 PolarHBondContact O-N 3.31Å; V419-T443 VanDerWaalsContact O-N 3.09Å
420	L	83.3	Confident	80.1	Confident	36 Å²	36	39.6 Å²	39.6	19%	0.188	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	125.9	172.3	178.8	65.9	0	0	0	109	L400 L403 V440 F442	L400-L420 HydrophobicContact CD2-CB 3.97Å; L400-L420 HydrophobicContact CD2-CD2 4.06Å; L403-L420 HydrophobicContact CD2-CD1 3.95Å; L403-L420 HydrophobicContact CD2-CD2 3.96Å; L420-V440 HydrophobicContact CD1-CG1 3.54Å; L420-F442 HydrophobicContact CB-CD1 4.33Å; L420-F442 HydrophobicContact CB-CE1 4.19Å; L420-F442 HydrophobicContact CD1-CD1 4.49Å; L420-F442 HydrophobicContact CD1-CE1 4.19Å; L420-F442 HydrophobicContact CD1-CZ 4.46Å
421	I	85.6	Confident	80.8	Confident	59 Å²	59	50.1 Å²	50.1	30%	0.303	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-48.3	179.5	-57.6	179.5	0	0	0	110.2	L441 T443 D509 A513	I421-L441 HydrophobicContact CB-CB 4.49Å; I421-L441 HydrophobicContact CB-CD2 4.15Å; I421-L441 HydrophobicContact CB-CG 4.04Å; I421-L441 HydrophobicContact CD1-CD2 4.5Å; I421-L441 HydrophobicContact CD1-CG 4.3Å; I421-L441 HydrophobicContact CG2-CD2 4.08Å; I421-L441 PolarHBondContact N-O 3.34Å; I421-T443 HydrophobicContact CD1-CG2 3.97Å; I421-T443 HydrophobicContact CG1-CG2 4.23Å; I421-D509 HydrophobicContact CG2-CB 3.93Å; I421-A513 HydrophobicContact CD1-CB 3.63Å
422	R	88.6	Confident	81.3	Confident	67 Å²	67	58.9 Å²	58.9	25%	0.253	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	151.1	-178.6	-169.6	173	-67.6	-102	-1	111.7	L441 W506 D509	R422-L441 HydrophobicContact CB-CB 4.5Å; R422-L441 PolarHBondContact N-O 3.34Å; R422-L441 PolarHBondContact O-N 2.87Å; R422-W506 HydrophobicContact CB-CH2 4.24Å; R422-W506 HydrophobicContact CB-CZ2 4.22Å; R422-W506 HydrophobicContact CG-CD2 4.41Å; R422-W506 HydrophobicContact CG-CH2 4.19Å; R422-W506 HydrophobicContact CG-CZ2 3.67Å; R422-D509 IonicContact CZ-OD2 2.75Å; R422-D509 IonicContact NE-OD2 3.75Å; R422-D509 PolarHBondContact NE-OD2 3.06Å; R422-D509 IonicContact NH2-OD2 2.78Å; R422-D509 PolarHBondContact NH2-OD2 3.26Å
423	Q	91.8	Very high	82.2	Confident	45 Å²	45	62.4 Å²	62.4	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.8	166.8	58	-176.1	-10.5	0	0	110.5	Y438 L439	Q423-Y438 HydrophobicContact CB-CE1 3.76Å; Q423-Y438 HydrophobicContact CG-CE1 4.36Å; Q423-Y438 PolarHBondContact OE1-OH 3.41Å; Q423-L439 VanDerWaalsContact CA-O 3.22Å; Q423-L439 WeakPolarHBondContact CA-O 3.27Å; Q423-L439 WeakPolarHBondContact CB-O 3.43Å
424	S	91.7	Very high	83.1	Confident	21 Å²	21	66.3 Å²	66.3	15%	0.147	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	166.7	173.2	73.5	0	0	0	0	112.5	L439 E502 W506	S424-L439 PolarHBondContact N-O 3.28Å; S424-L439 PolarHBondContact O-N 3Å; S424-E502 VanDerWaalsContact CB-OE1 3.24Å; S424-E502 WeakPolarHBondContact CB-OE1 3.49Å; S424-E502 PolarHBondContact OG-OE1 3.38Å; S424-W506 WeakPolarHBondContact OG-CZ2 3.32Å; S424-W506 PolarHBondContact OG-NE1 3.22Å
425	E	92.9	Very high	84.2	Confident	132 Å²	132	68 Å²	68	62%	0.617	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	131.5	172.5	-75.4	-176.9	-178.4	0	0	110.7	Y438	E425-Y438 HydrophobicContact CG-CD2 3.32Å; E425-Y438 HydrophobicContact CG-CE2 3.6Å; E425-Y438 HydrophobicContact CG-CG 4.42Å; E425-Y438 WeakPolarHBondContact OE1-CD2 3.26Å
426	V	94.3	Very high	85.2	Confident	6 Å²	6	70.1 Å²	70.1	4%	0.036	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	156.8	-173.2	-53	0	0	0	0	110.8	R437 L439 I495 F497	V426-R437 HydrophobicContact CG2-CB 4.08Å; V426-R437 PolarHBondContact N-O 3.36Å; V426-R437 PolarHBondContact O-N 3.17Å; V426-R437 VanDerWaalsContact O-O 3.11Å; V426-L439 HydrophobicContact CB-CG 4.49Å; V426-L439 HydrophobicContact CG1-CD1 3.9Å; V426-L439 HydrophobicContact CG1-CG 3.94Å; V426-L439 HydrophobicContact CG2-CD1 4.14Å; V426-L439 HydrophobicContact CG2-CD2 4.1Å; V426-L439 HydrophobicContact CG2-CG 3.68Å; V426-I495 HydrophobicContact CB-CG2 3.75Å; V426-I495 HydrophobicContact CG1-CG2 4.06Å; V426-I495 HydrophobicContact CG2-CD1 4.35Å; V426-I495 HydrophobicContact CG2-CG2 3.72Å; V426-F497 HydrophobicContact CG1-CD1 3.61Å; V426-F497 HydrophobicContact CG1-CE1 3.58Å
427	M	92.5	Very high	86.7	Confident	71 Å²	71	70 Å²	70	35%	0.35	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.8	168.4	-63.4	-57.5	-72.2	0	0	109.6	L434 P436 I496	M427-L434 HydrophobicContact CE-CB 3.78Å; M427-P436 HydrophobicContact SD-CB 3.93Å; M427-I496 HydrophobicContact CB-CB 4.36Å; M427-I496 PolarHBondContact N-O 3.4Å; M427-I496 PolarHBondContact O-N 3.22Å
428	K	92	Very high	88	Confident	24 Å²	24	70.5 Å²	70.5	10%	0.104	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.4	173.5	-174.1	-164.9	177.1	-59.8	0	109.7	T430 Q435 R437 Y463 A493 I495	K428-T430 PolarHBondContact O-N 2.99Å; K428-Q435 PolarHBondContact N-O 3.08Å; K428-Q435 PolarHBondContact O-N 3.15Å; K428-R437 HydrophobicContact CB-CB 4.45Å; K428-R437 HydrophobicContact CB-CG 3.74Å; K428-R437 HydrophobicContact CD-CG 4.33Å; K428-Y463 VanDerWaalsContact CE-OH 3.3Å; K428-Y463 WeakPolarHBondContact CE-OH 3.41Å; K428-A493 HydrophobicContact CD-CB 4.39Å; K428-A493 HydrophobicContact CG-CB 4.49Å; K428-I495 HydrophobicContact CB-CD1 4.24Å; K428-I495 HydrophobicContact CG-CD1 4.06Å
429	Q	90.1	Very high	88.8	Confident	74 Å²	74	70.4 Å²	70.4	35%	0.346	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134.1	168.3	-174.7	62.6	49.4	0	0	110.5	L434 L494	Q429-L434 HydrophobicContact CB-CD2 4.36Å; Q429-L494 HydrophobicContact CB-CB 4.16Å; Q429-L494 HydrophobicContact CB-CD2 4.19Å; Q429-L494 HydrophobicContact CG-CD2 4.49Å; Q429-L494 PolarHBondContact N-O 2.99Å; Q429-L494 VanDerWaalsContact N-O 3.1Å
430	T	82.9	Confident	89.5	Confident	34 Å²	34	66.8 Å²	66.8	21%	0.209	31%	0.311	C	S	.	.			trans	-116.8	-178.3	170.5	76.9	0	0	0	0	110.6	K428 K432 E433 Q435	K428-T430 PolarHBondContact O-N 2.99Å; T430-K432 PolarHBondContact O-N 3.24Å; T430-K432 PolarHBondContact OG1-N 2.89Å; T430-E433 WeakPolarHBondContact CB-O 3.39Å; T430-E433 PolarHBondContact N-O 3.37Å; T430-E433 PolarHBondContact OG1-N 2.89Å; T430-E433 PolarHBondContact OG1-O 2.75Å; T430-Q435 HydrophobicContact CG2-CB 4.32Å; T430-Q435 HydrophobicContact CG2-CG 3.86Å
431	R	77.8	Confident	89.9	Confident	262 Å²	262	65 Å²	65	99%	0.989	30%	0.302	S	S	*	.	S	Bend	trans	-69.4	-8.5	175	-67.4	-174.8	-180	173.3	-1.1	114.1
432	K	79.8	Confident	90	Very high	197 Å²	197	62.2 Å²	62.2	86%	0.857	29%	0.288	S	S	*	.	S	Bend	trans	-126.1	-41	-176.6	-64.4	-166.5	174.9	-167.7	0	113.4	T430	T430-K432 PolarHBondContact O-N 3.24Å; T430-K432 PolarHBondContact OG1-N 2.89Å
433	E	89.6	Confident	89.8	Confident	105 Å²	105	61 Å²	61	49%	0.491	29%	0.287	S	S	.	.	S	Bend	trans	-154.9	165.7	-167.1	67.6	-163.8	-177.1	0	0	111.8	T430 Q435	T430-E433 WeakPolarHBondContact CB-O 3.39Å; T430-E433 PolarHBondContact N-O 3.37Å; T430-E433 PolarHBondContact OG1-N 2.89Å; T430-E433 PolarHBondContact OG1-O 2.75Å; E433-Q435 HydrophobicContact CG-CG 3.73Å; E433-Q435 WeakPolarHBondContact OE1-CG 3.47Å; E433-Q435 PolarHBondContact OE1-NE2 3.39Å
434	L	90.3	Very high	89.3	Confident	87 Å²	87	59.4 Å²	59.4	46%	0.455	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	134.3	162.5	-66.9	172.8	0	0	0	109.4	M427 Q429 I496	M427-L434 HydrophobicContact CE-CB 3.78Å; Q429-L434 HydrophobicContact CB-CD2 4.36Å; L434-I496 HydrophobicContact CD2-CD1 3.55Å
435	Q	90.8	Very high	89.1	Confident	37 Å²	37	59.9 Å²	59.9	17%	0.173	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.4	173.6	-61.9	-171.9	-10.5	0	0	111.6	K428 T430 E433 R437	K428-Q435 PolarHBondContact N-O 3.08Å; K428-Q435 PolarHBondContact O-N 3.15Å; T430-Q435 HydrophobicContact CG2-CB 4.32Å; T430-Q435 HydrophobicContact CG2-CG 3.86Å; E433-Q435 HydrophobicContact CG-CG 3.73Å; E433-Q435 WeakPolarHBondContact OE1-CG 3.47Å; E433-Q435 PolarHBondContact OE1-NE2 3.39Å; Q435-R437 VanDerWaalsContact CB-NH1 3.26Å; Q435-R437 VanDerWaalsContact OE1-NH1 3.08Å
436	P	91.4	Very high	89.1	Confident	92 Å²	92	53.6 Å²	53.6	60%	0.597	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	143.8	176.2	27.5	-34.6	0	0	0	111.6	M427	M427-P436 HydrophobicContact SD-CB 3.93Å
437	R	93.9	Very high	89	Confident	25 Å²	25	54.1 Å²	54.1	9%	0.094	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.9	175.4	-70.6	-61.8	-177.1	-74.9	-2.5	109.8	V426 K428 Q435 I448 C449	V426-R437 HydrophobicContact CG2-CB 4.08Å; V426-R437 PolarHBondContact N-O 3.36Å; V426-R437 PolarHBondContact O-N 3.17Å; V426-R437 VanDerWaalsContact O-O 3.11Å; K428-R437 HydrophobicContact CB-CB 4.45Å; K428-R437 HydrophobicContact CB-CG 3.74Å; K428-R437 HydrophobicContact CD-CG 4.33Å; Q435-R437 VanDerWaalsContact CB-NH1 3.26Å; Q435-R437 VanDerWaalsContact OE1-NH1 3.08Å; R437-I448 HydrophobicContact CB-CG2 4.38Å; R437-I448 HydrophobicContact CG-CG2 4.26Å; R437-C449 WeakPolarHBondContact CA-O 3.41Å; R437-C449 WeakPolarHBondContact CD-O 3.42Å
438	Y	93.5	Very high	88.9	Confident	27 Å²	27	50.8 Å²	50.8	11%	0.106	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.1	171.5	-158.2	-88.2	0	0	0	108	R406 Q423 E425 V440 C449 F457	R406-Y438 VanDerWaalsContact NH1-CD2 3.33Å; Q423-Y438 HydrophobicContact CB-CE1 3.76Å; Q423-Y438 HydrophobicContact CG-CE1 4.36Å; Q423-Y438 PolarHBondContact OE1-OH 3.41Å; E425-Y438 HydrophobicContact CG-CD2 3.32Å; E425-Y438 HydrophobicContact CG-CE2 3.6Å; E425-Y438 HydrophobicContact CG-CG 4.42Å; E425-Y438 WeakPolarHBondContact OE1-CD2 3.26Å; Y438-V440 HydrophobicContact CD1-CG2 3.72Å; Y438-V440 HydrophobicContact CE1-CG2 4Å; Y438-C449 PolarHBondContact N-O 3.38Å; Y438-C449 WeakPolarHBondContact O-CB 3.29Å; Y438-C449 PolarHBondContact O-N 3.03Å; Y438-F457 AromaticContact CD1-CE1 3.78Å; Y438-F457 HydrophobicContact CD1-CE1 3.78Å; Y438-F457 AromaticContact CD1-CZ 3.51Å; Y438-F457 HydrophobicContact CD1-CZ 3.51Å; Y438-F457 HydrophobicContact CE1-CZ 4.1Å; Y438-F457 AromaticContact CG-CE1 3.79Å; Y438-F457 HydrophobicContact CG-CE1 3.79Å; Y438-F457 HydrophobicContact CG-CZ 4.03Å
439	L	94.9	Very high	88.9	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	143.1	173.1	-64	-169.4	0	0	0	110.5	Q423 S424 V426 I448 I495 F497 W506	Q423-L439 VanDerWaalsContact CA-O 3.22Å; Q423-L439 WeakPolarHBondContact CA-O 3.27Å; Q423-L439 WeakPolarHBondContact CB-O 3.43Å; S424-L439 PolarHBondContact N-O 3.28Å; S424-L439 PolarHBondContact O-N 3Å; V426-L439 HydrophobicContact CB-CG 4.49Å; V426-L439 HydrophobicContact CG1-CD1 3.9Å; V426-L439 HydrophobicContact CG1-CG 3.94Å; V426-L439 HydrophobicContact CG2-CD1 4.14Å; V426-L439 HydrophobicContact CG2-CD2 4.1Å; V426-L439 HydrophobicContact CG2-CG 3.68Å; L439-I448 HydrophobicContact CD2-CB 4.17Å; L439-I448 HydrophobicContact CD2-CG1 3.82Å; L439-I448 HydrophobicContact CD2-CG2 4.02Å; L439-I495 HydrophobicContact CD1-CG2 4.19Å; L439-I495 HydrophobicContact CD2-CD1 4.41Å; L439-F497 HydrophobicContact CD1-CE1 4.06Å; L439-F497 HydrophobicContact CD1-CZ 4.22Å; L439-W506 HydrophobicContact CB-CH2 3.28Å; L439-W506 HydrophobicContact CB-CZ2 3.7Å; L439-W506 HydrophobicContact CB-CZ3 3.94Å; L439-W506 HydrophobicContact CD1-CD2 4.38Å; L439-W506 HydrophobicContact CD1-CE3 4.12Å; L439-W506 HydrophobicContact CD1-CH2 3.89Å; L439-W506 HydrophobicContact CD1-CZ2 4.11Å; L439-W506 HydrophobicContact CD1-CZ3 3.84Å; L439-W506 HydrophobicContact CG-CH2 4.24Å
440	V	92.1	Very high	89	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	111.5	172.8	-167.1	0	0	0	0	108.1	L403 F407 L420 Y438 F442 W447 F457	L403-V440 HydrophobicContact CD1-CG1 3.95Å; L403-V440 HydrophobicContact CD1-CG2 3.91Å; L403-V440 HydrophobicContact CD2-CG1 3.77Å; L403-V440 HydrophobicContact CG-CG1 4.44Å; F407-V440 HydrophobicContact CZ-CG2 4.41Å; L420-V440 HydrophobicContact CD1-CG1 3.54Å; Y438-V440 HydrophobicContact CD1-CG2 3.72Å; Y438-V440 HydrophobicContact CE1-CG2 4Å; V440-F442 HydrophobicContact CB-CE2 4.24Å; V440-F442 HydrophobicContact CG1-CD2 4.16Å; V440-F442 HydrophobicContact CG1-CE2 3.45Å; V440-F442 VanDerWaalsContact CG1-CE2 3.45Å; V440-F442 HydrophobicContact CG1-CZ 3.69Å; V440-W447 HydrophobicContact CB-CB 4.1Å; V440-W447 PolarHBondContact N-O 3.01Å; V440-W447 VanDerWaalsContact N-O 3.12Å; V440-W447 PolarHBondContact O-N 3.22Å; V440-F457 HydrophobicContact CG2-CE2 4.28Å; V440-F457 HydrophobicContact CG2-CZ 4.2Å
441	L	91.9	Very high	89.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120.6	178.9	179.3	58.7	0	0	0	110.5	I421 R422 L446 L467 W506 D509 L510	I421-L441 HydrophobicContact CB-CB 4.49Å; I421-L441 HydrophobicContact CB-CD2 4.15Å; I421-L441 HydrophobicContact CB-CG 4.04Å; I421-L441 HydrophobicContact CD1-CD2 4.5Å; I421-L441 HydrophobicContact CD1-CG 4.3Å; I421-L441 HydrophobicContact CG2-CD2 4.08Å; I421-L441 PolarHBondContact N-O 3.34Å; R422-L441 HydrophobicContact CB-CB 4.5Å; R422-L441 PolarHBondContact N-O 3.34Å; R422-L441 PolarHBondContact O-N 2.87Å; L441-L446 HydrophobicContact CB-CD1 4.2Å; L441-L446 HydrophobicContact CD1-CB 4.27Å; L441-L446 HydrophobicContact CD1-CD1 4.31Å; L441-L467 HydrophobicContact CD1-CD1 4.05Å; L441-L467 HydrophobicContact CD1-CD2 3.91Å; L441-W506 HydrophobicContact CB-CH2 4.16Å; L441-W506 HydrophobicContact CB-CZ3 3.76Å; L441-W506 HydrophobicContact CD2-CZ3 4.38Å; L441-D509 HydrophobicContact CD2-CB 4.06Å; L441-L510 HydrophobicContact CD1-CD2 3.55Å; L441-L510 HydrophobicContact CD2-CD2 3.85Å; L441-L510 HydrophobicContact CD2-CG 4.12Å; L441-L510 HydrophobicContact CG-CD2 4.35Å
442	F	88.3	Confident	89.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	169.3	167.6	-62.5	-82.9	0	0	0	111	L403 F407 F411 V413 R418 V419 L420 V440 D444 Y445 W447 L467	L403-F442 HydrophobicContact CD2-CE1 4.3Å; L403-F442 HydrophobicContact CD2-CZ 3.84Å; F407-F442 HydrophobicContact CE2-CE2 4.48Å; F411-F442 HydrophobicContact CE1-CD2 4.29Å; F411-F442 AromaticContact CE1-CE2 3.6Å; F411-F442 HydrophobicContact CE1-CE2 3.6Å; F411-F442 AromaticContact CE1-CZ 3.82Å; F411-F442 HydrophobicContact CE1-CZ 3.82Å; F411-F442 HydrophobicContact CZ-CE2 4.26Å; V413-F442 HydrophobicContact CG1-CE1 4.15Å; V413-F442 HydrophobicContact CG1-CZ 4.3Å; R418-F442 HydrophobicContact CG-CB 3.91Å; R418-F442 HydrophobicContact CG-CD1 3.52Å; R418-F442 HydrophobicContact CG-CE1 4.24Å; R418-F442 HydrophobicContact CG-CG 3.87Å; V419-F442 CarbonylContact O-C 3.56Å; V419-F442 VanDerWaalsContact O-CA 3.23Å; V419-F442 WeakPolarHBondContact O-CA 3.2Å; L420-F442 HydrophobicContact CB-CD1 4.33Å; L420-F442 HydrophobicContact CB-CE1 4.19Å; L420-F442 HydrophobicContact CD1-CD1 4.49Å; L420-F442 HydrophobicContact CD1-CE1 4.19Å; L420-F442 HydrophobicContact CD1-CZ 4.46Å; V440-F442 HydrophobicContact CB-CE2 4.24Å; V440-F442 HydrophobicContact CG1-CD2 4.16Å; V440-F442 HydrophobicContact CG1-CE2 3.45Å; V440-F442 VanDerWaalsContact CG1-CE2 3.45Å; V440-F442 HydrophobicContact CG1-CZ 3.69Å; F442-D444 WeakPolarHBondContact CB-OD1 3.46Å; F442-D444 PolarHBondContact O-N 3.18Å; F442-Y445 PolarHBondContact N-O 3.39Å; F442-W447 AromaticContact CE2-CD1 3.91Å; F442-L467 WeakPolarHBondContact O-CD1 3.17Å
443	T	83.4	Confident	89.5	Confident	41 Å²	41	37.5 Å²	37.5	25%	0.252	20%	0.204	S	C	.	.	S	Bend	trans	-59	-8.7	172.3	45.3	0	0	0	0	115.5	G417 R418 V419 I421	G417-T443 PolarHBondContact O-OG1 3.46Å; R418-T443 WeakPolarHBondContact CA-OG1 3.28Å; V419-T443 HydrophobicContact CB-CG2 3.93Å; V419-T443 PolarHBondContact N-OG1 3.32Å; V419-T443 PolarHBondContact O-N 3.31Å; V419-T443 VanDerWaalsContact O-N 3.09Å; I421-T443 HydrophobicContact CD1-CG2 3.97Å; I421-T443 HydrophobicContact CG1-CG2 4.23Å
444	D	80.4	Confident	88.8	Confident	12 Å²	12	36.8 Å²	36.8	6%	0.064	21%	0.21	C	C	.	.	S	Bend	trans	-134	-34.5	-175.7	62.5	-13.5	0	0	0	114.8	R418 F442 L467	R418-D444 IonicContact CZ-OD2 2.65Å; R418-D444 VanDerWaalsContact CZ-OD2 3.24Å; R418-D444 IonicContact NE-OD1 3.09Å; R418-D444 PolarHBondContact NE-OD1 3.42Å; R418-D444 VanDerWaalsContact NE-OD1 3.11Å; R418-D444 IonicContact NE-OD2 2.68Å; R418-D444 PolarHBondContact NE-OD2 3.39Å; R418-D444 IonicContact NH2-OD2 2.87Å; R418-D444 PolarHBondContact NH2-OD2 3.49Å; F442-D444 WeakPolarHBondContact CB-OD1 3.46Å; F442-D444 PolarHBondContact O-N 3.18Å; D444-L467 PolarHBondContact O-N 3.18Å
445	Y	88.8	Confident	88.3	Confident	31 Å²	31	34 Å²	34	12%	0.122	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	140.7	178.9	-68.6	-80.9	0	0	0	113	F442 R464 I465 P466	F442-Y445 PolarHBondContact N-O 3.39Å; Y445-R464 HydrophobicContact CD1-CB 3.94Å; Y445-R464 HydrophobicContact CD1-CG 3.97Å; Y445-R464 HydrophobicContact CE1-CG 4.2Å; Y445-R464 HydrophobicContact CG-CB 4.42Å; Y445-I465 WeakPolarHBondContact CA-O 3.36Å; Y445-P466 HydrophobicContact CD1-CB 4.22Å; Y445-P466 HydrophobicContact CD1-CG 4.35Å; Y445-P466 HydrophobicContact CE1-CB 3.93Å; Y445-P466 HydrophobicContact CE1-CG 3.88Å
446	L	91.6	Very high	87.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120	156.1	176.4	64.3	0	0	0	109.3	L441 I448 R464 I465 L467 M470 I486 W506	L441-L446 HydrophobicContact CB-CD1 4.2Å; L441-L446 HydrophobicContact CD1-CB 4.27Å; L441-L446 HydrophobicContact CD1-CD1 4.31Å; L446-I448 HydrophobicContact CG-CG1 4.4Å; L446-R464 CarbonylContact O-C 3.56Å; L446-R464 WeakPolarHBondContact O-CA 3.44Å; L446-I465 PolarHBondContact N-O 2.58Å; L446-I465 PolarHBondContact O-N 2.87Å; L446-L467 HydrophobicContact CB-CD2 4.05Å; L446-M470 HydrophobicContact CB-SD 4.22Å; L446-M470 HydrophobicContact CD2-CE 3.84Å; L446-M470 HydrophobicContact CD2-SD 3.85Å; L446-I486 HydrophobicContact CD2-CD1 3.61Å; L446-W506 HydrophobicContact CD1-CZ3 3.87Å
447	W	92.1	Very high	87.6	Confident	17 Å²	17	30.4 Å²	30.4	6%	0.064	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137.5	167.9	-88	101.1	0	0	0	111.1	F407 F411 V440 F442 I459 R464	F407-W447 AromaticContact CE1-CD2 3.68Å; F407-W447 HydrophobicContact CE1-CD2 3.68Å; F407-W447 AromaticContact CE1-CE2 3.63Å; F407-W447 HydrophobicContact CE1-CE3 4.08Å; F407-W447 HydrophobicContact CE1-CG 4.03Å; F407-W447 HydrophobicContact CE1-CH2 4.39Å; F407-W447 HydrophobicContact CE1-CZ2 4.01Å; F407-W447 HydrophobicContact CE1-CZ3 4.43Å; F407-W447 AromaticContact CE1-NE1 3.92Å; F407-W447 HydrophobicContact CZ-CB 4.27Å; F407-W447 AromaticContact CZ-CD1 3.74Å; F407-W447 AromaticContact CZ-CD2 3.95Å; F407-W447 HydrophobicContact CZ-CD2 3.95Å; F407-W447 AromaticContact CZ-CG 3.76Å; F407-W447 HydrophobicContact CZ-CG 3.76Å; F407-W447 AromaticContact CZ-NE1 3.85Å; F411-W447 HydrophobicContact CB-CZ2 4.27Å; F411-W447 AromaticContact CD1-NE1 3.65Å; F411-W447 AromaticContact CD2-CE2 4Å; F411-W447 AromaticContact CD2-CZ2 3.71Å; F411-W447 HydrophobicContact CD2-CZ2 3.71Å; F411-W447 AromaticContact CD2-NE1 3.66Å; F411-W447 AromaticContact CE1-NE1 3.45Å; F411-W447 HydrophobicContact CE2-CZ2 4.22Å; F411-W447 AromaticContact CE2-NE1 3.46Å; F411-W447 AromaticContact CG-CZ2 3.94Å; F411-W447 HydrophobicContact CG-CZ2 3.94Å; F411-W447 AromaticContact CG-NE1 3.76Å; F411-W447 AromaticContact CZ-NE1 3.34Å; F411-W447 VanDerWaalsContact CZ-NE1 3.34Å; V440-W447 HydrophobicContact CB-CB 4.1Å; V440-W447 PolarHBondContact N-O 3.01Å; V440-W447 VanDerWaalsContact N-O 3.12Å; V440-W447 PolarHBondContact O-N 3.22Å; F442-W447 AromaticContact CE2-CD1 3.91Å; W447-I459 HydrophobicContact CH2-CG2 4.46Å; W447-R464 HydrophobicContact CD2-CB 3.75Å; W447-R464 HydrophobicContact CE3-CB 4.12Å; W447-R464 HydrophobicContact CG-CB 4.14Å; W447-R464 HydrophobicContact CH2-CB 4.45Å; W447-R464 HydrophobicContact CZ2-CB 4.12Å; W447-R464 HydrophobicContact CZ2-CG 4.3Å; W447-R464 HydrophobicContact CZ3-CB 4.45Å
448	I	91.9	Very high	87.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	91.6	171.2	-51.7	-171.8	0	0	0	107.4	R437 L439 L446 Y463 I465 A493	R437-I448 HydrophobicContact CB-CG2 4.38Å; R437-I448 HydrophobicContact CG-CG2 4.26Å; L439-I448 HydrophobicContact CD2-CB 4.17Å; L439-I448 HydrophobicContact CD2-CG1 3.82Å; L439-I448 HydrophobicContact CD2-CG2 4.02Å; L446-I448 HydrophobicContact CG-CG1 4.4Å; I448-Y463 HydrophobicContact CB-CE1 4.1Å; I448-Y463 HydrophobicContact CB-CE2 4.15Å; I448-Y463 HydrophobicContact CD1-CE2 3.81Å; I448-Y463 HydrophobicContact CG1-CE2 4.25Å; I448-Y463 HydrophobicContact CG2-CE1 4.13Å; I448-Y463 PolarHBondContact N-O 2.88Å; I448-Y463 PolarHBondContact O-N 2.88Å; I448-I465 HydrophobicContact CD1-CD1 4.07Å; I448-A493 HydrophobicContact CD1-CB 4.13Å
449	C	91.8	Very high	86.5	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.1	-170.7	-67	0	0	0	0	112.8	R437 Y438 F457 S462	R437-C449 WeakPolarHBondContact CA-O 3.41Å; R437-C449 WeakPolarHBondContact CD-O 3.42Å; Y438-C449 PolarHBondContact N-O 3.38Å; Y438-C449 WeakPolarHBondContact O-CB 3.29Å; Y438-C449 PolarHBondContact O-N 3.03Å; C449-F457 HydrophobicContact CB-CB 4.24Å; C449-F457 HydrophobicContact CB-CD1 3.59Å; C449-F457 HydrophobicContact CB-CD2 4.12Å; C449-F457 HydrophobicContact CB-CE1 3.87Å; C449-F457 HydrophobicContact CB-CE2 4.37Å; C449-F457 HydrophobicContact CB-CG 3.73Å; C449-F457 HydrophobicContact CB-CZ 4.26Å; C449-S462 WeakPolarHBondContact CA-OG 3.35Å
450	R	91.2	Very high	85.7	Confident	88 Å²	88	38.1 Å²	38.1	33%	0.332	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-88.6	125.8	162.8	-179.7	-179.3	-179.1	101.2	5.5	108	F457 D458 S462	R450-F457 CarbonylContact O-C 3.56Å; R450-F457 WeakPolarHBondContact O-CA 3.35Å; R450-D458 HydrophobicContact CB-CB 4.33Å; R450-D458 HydrophobicContact CG-CB 4.46Å; R450-D458 PolarHBondContact O-N 3.23Å; R450-S462 PolarHBondContact N-OG 2.93Å
451	V	87.4	Confident	85.3	Confident	45 Å²	45	46 Å²	46	27%	0.273	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-83.9	140.1	173.3	-163.5	0	0	0	0	109.3	G455 Q456 F457	V451-G455 WeakPolarHBondContact CG1-O 3.44Å; V451-Q456 CarbonylContact C-O 3.57Å; V451-Q456 WeakPolarHBondContact CA-O 3.23Å; V451-F457 HydrophobicContact CG2-CD1 4.3Å; V451-F457 HydrophobicContact CG2-CE1 4.31Å
452	S	85.3	Confident	85.2	Confident	40 Å²	40	46.5 Å²	46.5	28%	0.28	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-91.1	173.3	171.4	70.4	0	0	0	0	111.1	S454 G455 Q456	S452-S454 PolarHBondContact O-N 3Å; S452-S454 VanDerWaalsContact O-N 3.16Å; S452-S454 PolarHBondContact OG-N 3.11Å; S452-S454 PolarHBondContact OG-OG 3.1Å; S452-G455 PolarHBondContact O-N 2.95Å; S452-G455 VanDerWaalsContact O-N 3.08Å; S452-Q456 PolarHBondContact N-O 3.03Å; S452-Q456 PolarHBondContact OG-O 3.05Å; S452-Q456 VanDerWaalsContact OG-O 3.07Å
453	S	79.6	Confident	85.1	Confident	140 Å²	140	47.7 Å²	47.7	98%	0.979	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18	176.1	44.5	0	0	0	0	114.4
454	S	75.3	Confident	85.3	Confident	89 Å²	89	49.4 Å²	49.4	62%	0.622	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	12.4	175.1	55.7	0	0	0	0	113.8	S452 Q456	S452-S454 PolarHBondContact O-N 3Å; S452-S454 VanDerWaalsContact O-N 3.16Å; S452-S454 PolarHBondContact OG-N 3.11Å; S452-S454 PolarHBondContact OG-OG 3.1Å; S454-Q456 PolarHBondContact O-N 3.06Å; S454-Q456 VanDerWaalsContact O-N 3.07Å
455	G	79.5	Confident	85.7	Confident	30 Å²	30	48.8 Å²	48.8	31%	0.309	26%	0.26	S	S	.	.	S	Bend	trans	73.7	-8.2	-177.2	0	0	0	0	0	114.9	R406 V451 S452	R406-G455 PolarHBondContact NE-O 3.06Å; V451-G455 WeakPolarHBondContact CG1-O 3.44Å; S452-G455 PolarHBondContact O-N 2.95Å; S452-G455 VanDerWaalsContact O-N 3.08Å
456	Q	82.2	Confident	85.5	Confident	52 Å²	52	49 Å²	49	24%	0.243	27%	0.265	C	S	.	.			trans	-72.5	154	177.3	-69.2	-68	-14.4	0	0	112	Y405 R406 Q408 V451 S452 S454	Y405-Q456 PolarHBondContact O-NE2 3.24Å; Y405-Q456 PolarHBondContact O-OE1 3Å; R406-Q456 VanDerWaalsContact CA-OE1 3.25Å; R406-Q456 PolarHBondContact O-OE1 2.99Å; Q408-Q456 HydrophobicContact CG-CB 4.36Å; Q408-Q456 VanDerWaalsContact CG-OE1 3.27Å; V451-Q456 CarbonylContact C-O 3.57Å; V451-Q456 WeakPolarHBondContact CA-O 3.23Å; S452-Q456 PolarHBondContact N-O 3.03Å; S452-Q456 PolarHBondContact OG-O 3.05Å; S452-Q456 VanDerWaalsContact OG-O 3.07Å; S454-Q456 PolarHBondContact O-N 3.06Å; S454-Q456 VanDerWaalsContact O-N 3.07Å
457	F	85.1	Confident	85.3	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-83.2	129.2	173	-58.5	-34.5	0	0	0	111	L403 R406 F407 Q408 Y438 V440 C449 R450 V451 I459	L403-F457 HydrophobicContact CD1-CE2 3.92Å; L403-F457 HydrophobicContact CD1-CZ 4.23Å; R406-F457 HydrophobicContact CB-CD1 4.45Å; R406-F457 HydrophobicContact CB-CD2 3.97Å; R406-F457 HydrophobicContact CB-CE1 4.29Å; R406-F457 HydrophobicContact CB-CE2 3.79Å; R406-F457 HydrophobicContact CB-CG 4.3Å; R406-F457 HydrophobicContact CB-CZ 3.96Å; R406-F457 VanDerWaalsContact O-CB 3.25Å; R406-F457 WeakPolarHBondContact O-CB 3.4Å; R406-F457 WeakPolarHBondContact O-CD2 3.5Å; R406-F457 WeakPolarHBondContact O-CG 3.49Å; R406-F457 PolarHBondContact O-N 3.19Å; F407-F457 AromaticContact CD1-CD2 3.75Å; F407-F457 HydrophobicContact CD1-CD2 3.75Å; F407-F457 HydrophobicContact CD1-CE2 4.36Å; F407-F457 HydrophobicContact CD2-CD2 4.14Å; F407-F457 HydrophobicContact CD2-CE2 4.01Å; F407-F457 AromaticContact CE1-CD2 3.78Å; F407-F457 HydrophobicContact CE1-CD2 3.78Å; F407-F457 HydrophobicContact CE1-CE2 4.17Å; F407-F457 HydrophobicContact CE2-CD2 4.19Å; F407-F457 AromaticContact CE2-CE2 3.82Å; F407-F457 HydrophobicContact CE2-CE2 3.82Å; F407-F457 AromaticContact CG-CD2 3.91Å; F407-F457 HydrophobicContact CG-CD2 3.91Å; F407-F457 HydrophobicContact CG-CE2 4.26Å; F407-F457 AromaticContact CZ-CD2 4Å; F407-F457 HydrophobicContact CZ-CD2 4Å; F407-F457 AromaticContact CZ-CE2 3.89Å; F407-F457 HydrophobicContact CZ-CE2 3.89Å; Q408-F457 PolarHBondContact NE2-O 3.37Å; Y438-F457 AromaticContact CD1-CE1 3.78Å; Y438-F457 HydrophobicContact CD1-CE1 3.78Å; Y438-F457 AromaticContact CD1-CZ 3.51Å; Y438-F457 HydrophobicContact CD1-CZ 3.51Å; Y438-F457 HydrophobicContact CE1-CZ 4.1Å; Y438-F457 AromaticContact CG-CE1 3.79Å; Y438-F457 HydrophobicContact CG-CE1 3.79Å; Y438-F457 HydrophobicContact CG-CZ 4.03Å; V440-F457 HydrophobicContact CG2-CE2 4.28Å; V440-F457 HydrophobicContact CG2-CZ 4.2Å; C449-F457 HydrophobicContact CB-CB 4.24Å; C449-F457 HydrophobicContact CB-CD1 3.59Å; C449-F457 HydrophobicContact CB-CD2 4.12Å; C449-F457 HydrophobicContact CB-CE1 3.87Å; C449-F457 HydrophobicContact CB-CE2 4.37Å; C449-F457 HydrophobicContact CB-CG 3.73Å; C449-F457 HydrophobicContact CB-CZ 4.26Å; R450-F457 CarbonylContact O-C 3.56Å; R450-F457 WeakPolarHBondContact O-CA 3.35Å; V451-F457 HydrophobicContact CG2-CD1 4.3Å; V451-F457 HydrophobicContact CG2-CE1 4.31Å; F457-I459 HydrophobicContact CB-CD1 3.73Å; F457-I459 PolarHBondContact O-N 3.4Å; F457-I459 VanDerWaalsContact O-N 3.07Å
458	D	84.3	Confident	84.7	Confident	29 Å²	29	51 Å²	51	16%	0.155	28%	0.275	C	S	.	.			trans	-75.6	87.8	169.5	176.4	-11.8	0	0	0	107.9	R450 N460 R461 S462	R450-D458 HydrophobicContact CB-CB 4.33Å; R450-D458 HydrophobicContact CG-CB 4.46Å; R450-D458 PolarHBondContact O-N 3.23Å; D458-N460 VanDerWaalsContact C-N 3.25Å; D458-N460 PolarHBondContact O-N 3.41Å; D458-R461 HydrophobicContact CB-CB 4.49Å; D458-R461 CarbonylContact O-C 3.59Å; D458-R461 PolarHBondContact O-N 2.86Å; D458-R461 VanDerWaalsContact O-N 3.08Å; D458-R461 WeakPolarHBondContact OD1-CG 3.41Å; D458-R461 PolarHBondContact OD1-N 3.3Å; D458-R461 VanDerWaalsContact OD1-N 3.12Å; D458-R461 WeakPolarHBondContact OD2-CD 3.34Å; D458-R461 VanDerWaalsContact OD2-CG 3.31Å; D458-R461 WeakPolarHBondContact OD2-CG 3.38Å; D458-R461 IonicContact OD2-CZ 2.65Å; D458-R461 IonicContact OD2-NE 2.74Å; D458-R461 IonicContact OD2-NH1 3.71Å; D458-R461 PolarHBondContact OD2-NH1 3.49Å; D458-S462 VanDerWaalsContact O-CB 3.26Å; D458-S462 WeakPolarHBondContact O-CB 3.42Å; D458-S462 PolarHBondContact O-N 2.67Å; D458-S462 PolarHBondContact O-OG 2.78Å
459	I	79.3	Confident	84.2	Confident	33 Å²	33	56.2 Å²	56.2	17%	0.169	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.4	-172.9	-56.7	-51.3	0	0	0	111.8	F407 Q410 W447 F457 R461 S462	F407-I459 HydrophobicContact CD1-CD1 3.7Å; F407-I459 HydrophobicContact CE1-CD1 4.32Å; Q410-I459 HydrophobicContact CB-CG1 4.43Å; W447-I459 HydrophobicContact CH2-CG2 4.46Å; F457-I459 HydrophobicContact CB-CD1 3.73Å; F457-I459 PolarHBondContact O-N 3.4Å; F457-I459 VanDerWaalsContact O-N 3.07Å; I459-R461 VanDerWaalsContact C-N 3.26Å; I459-R461 PolarHBondContact O-N 3.28Å; I459-S462 PolarHBondContact O-N 2.66Å
460	N	78.4	Confident	84	Confident	154 Å²	154	56.5 Å²	56.5	82%	0.824	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.3	177.7	-69.1	-32	0	0	0	113.8	D458	D458-N460 VanDerWaalsContact C-N 3.25Å; D458-N460 PolarHBondContact O-N 3.41Å
461	R	84.2	Confident	83.9	Confident	164 Å²	164	60 Å²	60	62%	0.619	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-6.4	175.9	-57	-168.1	-172.4	122.6	-10	114.2	D458 I459	D458-R461 HydrophobicContact CB-CB 4.49Å; D458-R461 CarbonylContact O-C 3.59Å; D458-R461 PolarHBondContact O-N 2.86Å; D458-R461 VanDerWaalsContact O-N 3.08Å; D458-R461 WeakPolarHBondContact OD1-CG 3.41Å; D458-R461 PolarHBondContact OD1-N 3.3Å; D458-R461 VanDerWaalsContact OD1-N 3.12Å; D458-R461 WeakPolarHBondContact OD2-CD 3.34Å; D458-R461 VanDerWaalsContact OD2-CG 3.31Å; D458-R461 WeakPolarHBondContact OD2-CG 3.38Å; D458-R461 IonicContact OD2-CZ 2.65Å; D458-R461 IonicContact OD2-NE 2.74Å; D458-R461 IonicContact OD2-NH1 3.71Å; D458-R461 PolarHBondContact OD2-NH1 3.49Å; I459-R461 VanDerWaalsContact C-N 3.26Å; I459-R461 PolarHBondContact O-N 3.28Å
462	S	88.3	Confident	84.1	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.084	31%	0.31	C	S	.	.			trans	-82.5	167.1	169.8	-58.9	0	0	0	0	110.5	C449 R450 D458 I459	C449-S462 WeakPolarHBondContact CA-OG 3.35Å; R450-S462 PolarHBondContact N-OG 2.93Å; D458-S462 VanDerWaalsContact O-CB 3.26Å; D458-S462 WeakPolarHBondContact O-CB 3.42Å; D458-S462 PolarHBondContact O-N 2.67Å; D458-S462 PolarHBondContact O-OG 2.78Å; I459-S462 PolarHBondContact O-N 2.66Å
463	Y	87	Confident	84.4	Confident	24 Å²	24	62.3 Å²	62.3	9%	0.094	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	147.1	174.7	55.3	-77.2	0	0	0	112.3	K428 I448 I465 K491	K428-Y463 VanDerWaalsContact CE-OH 3.3Å; K428-Y463 WeakPolarHBondContact CE-OH 3.41Å; I448-Y463 HydrophobicContact CB-CE1 4.1Å; I448-Y463 HydrophobicContact CB-CE2 4.15Å; I448-Y463 HydrophobicContact CD1-CE2 3.81Å; I448-Y463 HydrophobicContact CG1-CE2 4.25Å; I448-Y463 HydrophobicContact CG2-CE1 4.13Å; I448-Y463 PolarHBondContact N-O 2.88Å; I448-Y463 PolarHBondContact O-N 2.88Å; Y463-I465 HydrophobicContact CD2-CG1 4.24Å; Y463-I465 HydrophobicContact CE2-CD1 4.23Å; Y463-I465 HydrophobicContact CE2-CG1 4.4Å; Y463-K491 HydrophobicContact CD1-CD 3.93Å; Y463-K491 HydrophobicContact CD2-CB 4.12Å; Y463-K491 HydrophobicContact CD2-CD 3.8Å; Y463-K491 HydrophobicContact CD2-CG 4.28Å; Y463-K491 HydrophobicContact CE1-CD 3.78Å; Y463-K491 VanDerWaalsContact CE1-NZ 3.29Å; Y463-K491 HydrophobicContact CE2-CB 3.85Å; Y463-K491 HydrophobicContact CE2-CD 3.63Å; Y463-K491 HydrophobicContact CE2-CG 3.76Å; Y463-K491 HydrophobicContact CG-CD 3.94Å
464	R	87.8	Confident	84.8	Confident	77 Å²	77	60.4 Å²	60.4	29%	0.291	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	141.6	173.4	62.5	-175.8	179.4	167.7	2.1	111.5	Y445 L446 W447	Y445-R464 HydrophobicContact CD1-CB 3.94Å; Y445-R464 HydrophobicContact CD1-CG 3.97Å; Y445-R464 HydrophobicContact CE1-CG 4.2Å; Y445-R464 HydrophobicContact CG-CB 4.42Å; L446-R464 CarbonylContact O-C 3.56Å; L446-R464 WeakPolarHBondContact O-CA 3.44Å; W447-R464 HydrophobicContact CD2-CB 3.75Å; W447-R464 HydrophobicContact CE3-CB 4.12Å; W447-R464 HydrophobicContact CG-CB 4.14Å; W447-R464 HydrophobicContact CH2-CB 4.45Å; W447-R464 HydrophobicContact CZ2-CB 4.12Å; W447-R464 HydrophobicContact CZ2-CG 4.3Å; W447-R464 HydrophobicContact CZ3-CB 4.45Å
465	I	88.2	Confident	85.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.3	173.4	-56	178.7	0	0	0	107.5	Y445 L446 I448 Y463 L467 M470 I486	Y445-I465 WeakPolarHBondContact CA-O 3.36Å; L446-I465 PolarHBondContact N-O 2.58Å; L446-I465 PolarHBondContact O-N 2.87Å; I448-I465 HydrophobicContact CD1-CD1 4.07Å; Y463-I465 HydrophobicContact CD2-CG1 4.24Å; Y463-I465 HydrophobicContact CE2-CD1 4.23Å; Y463-I465 HydrophobicContact CE2-CG1 4.4Å; I465-L467 PolarHBondContact O-N 2.81Å; I465-M470 HydrophobicContact CB-SD 4.38Å; I465-M470 HydrophobicContact CG2-CB 3.81Å; I465-M470 HydrophobicContact CG2-CG 4.01Å; I465-M470 HydrophobicContact CG2-SD 3.98Å; I465-I486 HydrophobicContact CD1-CG2 3.9Å
466	P	86.2	Confident	85	Confident	35 Å²	35	64.4 Å²	64.4	23%	0.227	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	128	171.6	-7.1	19	0	0	0	109.4	Y445 E468 Y469 M470	Y445-P466 HydrophobicContact CD1-CB 4.22Å; Y445-P466 HydrophobicContact CD1-CG 4.35Å; Y445-P466 HydrophobicContact CE1-CB 3.93Å; Y445-P466 HydrophobicContact CE1-CG 3.88Å; P466-E468 PolarHBondContact O-N 2.93Å; P466-E468 VanDerWaalsContact O-N 3.09Å; P466-Y469 HydrophobicContact CB-CD2 4.35Å; P466-Y469 HydrophobicContact CG-CD2 4.26Å; P466-Y469 PolarHBondContact O-N 3.06Å; P466-Y469 VanDerWaalsContact O-N 3.07Å; P466-M470 PolarHBondContact O-N 3.41Å
467	L	86.8	Confident	84.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.2	-175.6	-67	-175.6	0	0	0	113.3	L441 F442 D444 L446 I465 Y469 M470 L510 A513 Q514	L441-L467 HydrophobicContact CD1-CD1 4.05Å; L441-L467 HydrophobicContact CD1-CD2 3.91Å; F442-L467 WeakPolarHBondContact O-CD1 3.17Å; D444-L467 PolarHBondContact O-N 3.18Å; L446-L467 HydrophobicContact CB-CD2 4.05Å; I465-L467 PolarHBondContact O-N 2.81Å; L467-Y469 VanDerWaalsContact C-N 3.31Å; L467-Y469 PolarHBondContact O-N 3.26Å; L467-M470 HydrophobicContact CD2-SD 4.18Å; L467-M470 PolarHBondContact O-N 3.03Å; L467-L510 HydrophobicContact CD2-CD2 3.99Å; L467-A513 HydrophobicContact CD1-CB 3.67Å; L467-Q514 HydrophobicContact CB-CG 4.32Å; L467-Q514 PolarHBondContact O-NE2 2.9Å
468	E	79.3	Confident	84	Confident	58 Å²	58	73.2 Å²	73.2	27%	0.271	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-61	-34.5	176.1	-169.4	179.1	143.7	0	0	113.6	P466 K521	P466-E468 PolarHBondContact O-N 2.93Å; P466-E468 VanDerWaalsContact O-N 3.09Å; E468-K521 IonicContact OE1-NZ 3.54Å; E468-K521 PolarHBondContact OE1-NZ 2.97Å; E468-K521 WeakPolarHBondContact OE2-CE 3.48Å; E468-K521 IonicContact OE2-NZ 3.65Å; E468-K521 PolarHBondContact OE2-NZ 2.83Å
469	Y	80.9	Confident	83.5	Confident	111 Å²	111	80 Å²	80	44%	0.435	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-111.9	19.3	-176	-48.9	-44.3	0	0	0	112.7	P466 L467 S488	P466-Y469 HydrophobicContact CB-CD2 4.35Å; P466-Y469 HydrophobicContact CG-CD2 4.26Å; P466-Y469 PolarHBondContact O-N 3.06Å; P466-Y469 VanDerWaalsContact O-N 3.07Å; L467-Y469 VanDerWaalsContact C-N 3.31Å; L467-Y469 PolarHBondContact O-N 3.26Å; Y469-S488 PolarHBondContact O-OG 2.81Å
470	M	87.5	Confident	83.5	Confident	5 Å²	5	83.4 Å²	83.4	3%	0.025	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.8	175.6	-170.1	168	124.8	0	0	110	L446 I465 P466 L467 F472 I486 L510 Q514	L446-M470 HydrophobicContact CB-SD 4.22Å; L446-M470 HydrophobicContact CD2-CE 3.84Å; L446-M470 HydrophobicContact CD2-SD 3.85Å; I465-M470 HydrophobicContact CB-SD 4.38Å; I465-M470 HydrophobicContact CG2-CB 3.81Å; I465-M470 HydrophobicContact CG2-CG 4.01Å; I465-M470 HydrophobicContact CG2-SD 3.98Å; P466-M470 PolarHBondContact O-N 3.41Å; L467-M470 HydrophobicContact CD2-SD 4.18Å; L467-M470 PolarHBondContact O-N 3.03Å; M470-F472 HydrophobicContact CE-CB 4.23Å; M470-F472 HydrophobicContact CE-CD1 3.74Å; M470-F472 HydrophobicContact CE-CG 4.36Å; M470-I486 HydrophobicContact CE-CD1 4.25Å; M470-I486 HydrophobicContact CE-CG1 4.36Å; M470-I486 HydrophobicContact CE-CG2 3.85Å; M470-I486 HydrophobicContact CG-CG2 3.79Å; M470-I486 HydrophobicContact SD-CG2 3.64Å; M470-L510 HydrophobicContact CE-CD1 3.71Å; M470-L510 HydrophobicContact CE-CD2 3.58Å; M470-L510 HydrophobicContact CE-CG 4.23Å; M470-Q514 PolarHBondContact O-NE2 2.69Å
471	K	89.7	Confident	83.7	Confident	162 Å²	162	78.5 Å²	78.5	70%	0.704	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	151.1	157.8	-67.6	-172.3	175.3	-169.6	0	108	R487	K471-R487 HydrophobicContact CB-CB 4.38Å; K471-R487 PolarHBondContact N-O 3.35Å; K471-R487 PolarHBondContact O-N 2.83Å
472	F	91.6	Very high	84	Confident	43 Å²	43	76.6 Å²	76.6	19%	0.189	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.5	170.7	55.8	-92.7	0	0	0	109.8	M470 L484 Q485 I486 T507 L510 T511 Q514	M470-F472 HydrophobicContact CE-CB 4.23Å; M470-F472 HydrophobicContact CE-CD1 3.74Å; M470-F472 HydrophobicContact CE-CG 4.36Å; F472-L484 HydrophobicContact CB-CD1 4.3Å; F472-L484 HydrophobicContact CB-CD2 4.4Å; F472-L484 HydrophobicContact CB-CG 4.33Å; F472-L484 HydrophobicContact CD2-CD1 4.27Å; F472-Q485 CarbonylContact C-O 3.56Å; F472-Q485 WeakPolarHBondContact CA-O 3.08Å; F472-I486 HydrophobicContact CB-CG1 4.43Å; F472-T507 HydrophobicContact CD2-CG2 3.94Å; F472-T507 HydrophobicContact CE2-CG2 3.64Å; F472-L510 HydrophobicContact CD1-CB 4.13Å; F472-L510 HydrophobicContact CD1-CD1 4.35Å; F472-L510 HydrophobicContact CE1-CB 3.7Å; F472-L510 HydrophobicContact CE2-CB 4.37Å; F472-L510 HydrophobicContact CG-CD1 4.41Å; F472-L510 HydrophobicContact CZ-CB 3.83Å; F472-T511 WeakPolarHBondContact CZ-OG1 3.26Å; F472-Q514 HydrophobicContact CE1-CG 4.28Å
473	E	90.4	Very high	84.1	Confident	91 Å²	91	76.2 Å²	76.2	43%	0.425	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	122.9	-165.3	-169.6	167.7	-166.2	0	0	107.6	Q485 R487	E473-Q485 HydrophobicContact CB-CB 4.36Å; E473-Q485 PolarHBondContact N-O 2.84Å; E473-Q485 PolarHBondContact O-N 3.18Å; E473-R487 IonicContact OE1-NH1 2.98Å; E473-R487 IonicContact OE2-CZ 3.73Å; E473-R487 IonicContact OE2-NH1 3.79Å; E473-R487 PolarHBondContact OE2-NH1 3.21Å
474	R	88.6	Confident	84.4	Confident	99 Å²	99	75.1 Å²	75.1	37%	0.374	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	140.2	173.6	-72.7	-175	175.9	155.4	1.9	108.1	L484 T507 D508	R474-L484 HydrophobicContact CG-CD1 4.35Å; R474-T507 HydrophobicContact CG-CG2 4.05Å; R474-T507 PolarHBondContact NE-OG1 3.38Å; R474-D508 IonicContact NH2-OD1 2.69Å; R474-D508 PolarHBondContact NH2-OD1 2.9Å
475	M	84.7	Confident	84.6	Confident	33 Å²	33	73.9 Å²	73.9	16%	0.163	33%	0.334	C	S	.	.			trans	-89.4	138.4	166.9	-55.1	-59.4	-55.3	0	0	108.9	E477 R480 C483 Q485 L494 R503	M475-E477 VanDerWaalsContact CE-OE2 3.31Å; M475-E477 WeakPolarHBondContact CE-OE2 3.45Å; M475-R480 HydrophobicContact CB-CB 3.85Å; M475-R480 WeakPolarHBondContact CB-O 3.35Å; M475-R480 HydrophobicContact CG-CB 4.31Å; M475-C483 HydrophobicContact CB-CB 4.26Å; M475-C483 HydrophobicContact CG-CB 3.78Å; M475-C483 PolarHBondContact N-O 2.99Å; M475-Q485 HydrophobicContact SD-CB 4.31Å; M475-L494 HydrophobicContact CG-CD1 4.22Å; M475-L494 HydrophobicContact SD-CD1 4.43Å; M475-R503 PolarHBondContact O-NH1 3.37Å
476	E	75.7	Confident	84.8	Confident	171 Å²	171	74 Å²	74	80%	0.799	33%	0.334	S	S	*	.			trans	-113.6	-4.7	-174.9	-61.9	-178	166.4	0	0	113.1
477	E	77.9	Confident	85	Confident	94 Å²	94	77.9 Å²	77.9	44%	0.439	35%	0.345	S	S	.	.	S	Bend	trans	-69.6	133.8	169.9	-55.2	156	127.9	0	0	109.9	M475 E479 R480 I481	M475-E477 VanDerWaalsContact CE-OE2 3.31Å; M475-E477 WeakPolarHBondContact CE-OE2 3.45Å; E477-E479 PolarHBondContact O-N 3.1Å; E477-R480 HydrophobicContact CB-CB 4.37Å; E477-R480 CarbonylContact O-C 3.27Å; E477-R480 VanDerWaalsContact O-C 3.27Å; E477-R480 WeakPolarHBondContact O-CA 3.49Å; E477-R480 PolarHBondContact O-N 3.27Å; E477-R480 IonicContact OE1-CZ 2.76Å; E477-R480 IonicContact OE1-NH1 4Å; E477-R480 PolarHBondContact OE1-NH1 3.38Å; E477-R480 VanDerWaalsContact OE2-CD 3.25Å; E477-R480 WeakPolarHBondContact OE2-CD 3.29Å; E477-R480 IonicContact OE2-CZ 3.81Å; E477-R480 IonicContact OE2-NE 3.64Å; E477-R480 IonicContact OE2-NH1 3.72Å; E477-R480 PolarHBondContact OE2-NH1 3.22Å; E477-I481 PolarHBondContact O-N 2.65Å
478	D	68.1	Low	85	Confident	142 Å²	142	78.8 Å²	78.8	76%	0.759	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-51.6	-48.4	-174.1	-66	-49.4	0	0	0	113.8	R480 I481	D478-R480 PolarHBondContact O-N 2.97Å; D478-R480 VanDerWaalsContact O-N 3.14Å; D478-I481 WeakPolarHBondContact O-CG2 3.39Å; D478-I481 PolarHBondContact O-N 3.3Å
479	E	72.8	Confident	84.9	Confident	171 Å²	171	85.3 Å²	85.3	80%	0.799	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-59.4	-27.8	177.4	-63.4	-170	159.4	0	0	113	E477	E477-E479 PolarHBondContact O-N 3.1Å
480	R	78.6	Confident	84.5	Confident	105 Å²	105	85.3 Å²	85.3	40%	0.396	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-110	7.1	-175.3	-52.3	-159.6	-169.6	117.1	7.3	113.2	M475 E477 D478 R482 C483	M475-R480 HydrophobicContact CB-CB 3.85Å; M475-R480 WeakPolarHBondContact CB-O 3.35Å; M475-R480 HydrophobicContact CG-CB 4.31Å; E477-R480 HydrophobicContact CB-CB 4.37Å; E477-R480 CarbonylContact O-C 3.27Å; E477-R480 VanDerWaalsContact O-C 3.27Å; E477-R480 WeakPolarHBondContact O-CA 3.49Å; E477-R480 PolarHBondContact O-N 3.27Å; E477-R480 IonicContact OE1-CZ 2.76Å; E477-R480 IonicContact OE1-NH1 4Å; E477-R480 PolarHBondContact OE1-NH1 3.38Å; E477-R480 VanDerWaalsContact OE2-CD 3.25Å; E477-R480 WeakPolarHBondContact OE2-CD 3.29Å; E477-R480 IonicContact OE2-CZ 3.81Å; E477-R480 IonicContact OE2-NE 3.64Å; E477-R480 IonicContact OE2-NH1 3.72Å; E477-R480 PolarHBondContact OE2-NH1 3.22Å; D478-R480 PolarHBondContact O-N 2.97Å; D478-R480 VanDerWaalsContact O-N 3.14Å; R480-R482 PolarHBondContact O-N 2.76Å; R480-C483 HydrophobicContact CB-CB 4.36Å; R480-C483 WeakPolarHBondContact O-CA 3.5Å; R480-C483 WeakPolarHBondContact O-CB 3.29Å; R480-C483 PolarHBondContact O-N 2.83Å; R480-C483 PolarHBondContact O-SG 3.44Å; R480-C483 VanDerWaalsContact O-SG 3.4Å
481	I	84.6	Confident	84.2	Confident	51 Å²	51	89.6 Å²	89.6	26%	0.262	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.2	-177.6	-151.5	-178.6	0	0	0	112.6	E477 D478 C483 E500 R503	E477-I481 PolarHBondContact O-N 2.65Å; D478-I481 WeakPolarHBondContact O-CG2 3.39Å; D478-I481 PolarHBondContact O-N 3.3Å; I481-C483 PolarHBondContact O-N 2.66Å; I481-E500 HydrophobicContact CB-CG 4.49Å; I481-E500 HydrophobicContact CD1-CG 4.22Å; I481-E500 HydrophobicContact CG1-CG 3.9Å; I481-E500 HydrophobicContact CG2-CG 4.24Å; I481-R503 PolarHBondContact O-NE 3.19Å; I481-R503 PolarHBondContact O-NH1 2.97Å; I481-R503 PolarHBondContact O-NH2 3.29Å
482	R	88.8	Confident	84	Confident	124 Å²	124	85.2 Å²	85.2	47%	0.468	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	2.6	172.3	-71.8	176.9	-77.1	166.1	-3.4	114.8	R480 I496 F497	R480-R482 PolarHBondContact O-N 2.76Å; R482-I496 HydrophobicContact CB-CG2 4.38Å; R482-F497 PolarHBondContact O-N 3.49Å
483	C	90.5	Very high	83.9	Confident	5 Å²	5	83.3 Å²	83.3	3%	0.034	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	150.2	-174.3	-55.2	0	0	0	0	113.5	M475 R480 I481 L494 I495 R503	M475-C483 HydrophobicContact CB-CB 4.26Å; M475-C483 HydrophobicContact CG-CB 3.78Å; M475-C483 PolarHBondContact N-O 2.99Å; R480-C483 HydrophobicContact CB-CB 4.36Å; R480-C483 WeakPolarHBondContact O-CA 3.5Å; R480-C483 WeakPolarHBondContact O-CB 3.29Å; R480-C483 PolarHBondContact O-N 2.83Å; R480-C483 PolarHBondContact O-SG 3.44Å; R480-C483 VanDerWaalsContact O-SG 3.4Å; I481-C483 PolarHBondContact O-N 2.66Å; C483-L494 HydrophobicContact CB-CD1 3.92Å; C483-L494 HydrophobicContact CB-CG 4.41Å; C483-I495 CarbonylContact C-O 3.57Å; C483-I495 WeakPolarHBondContact CA-O 3.07Å; C483-R503 WeakPolarHBondContact O-CG 3.26Å
484	L	93.2	Very high	84	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.1	168.5	-173.6	74.8	0	0	0	108.6	F472 R474 I486 I495 F497 T507 L510	F472-L484 HydrophobicContact CB-CD1 4.3Å; F472-L484 HydrophobicContact CB-CD2 4.4Å; F472-L484 HydrophobicContact CB-CG 4.33Å; F472-L484 HydrophobicContact CD2-CD1 4.27Å; R474-L484 HydrophobicContact CG-CD1 4.35Å; L484-I486 HydrophobicContact CD2-CD1 4.32Å; L484-I486 HydrophobicContact CD2-CG1 4.18Å; L484-I486 HydrophobicContact CG-CG1 4.35Å; L484-I495 PolarHBondContact N-O 3.09Å; L484-I495 PolarHBondContact O-N 3.01Å; L484-F497 HydrophobicContact CB-CE2 3.72Å; L484-F497 HydrophobicContact CD2-CE2 4.29Å; L484-F497 HydrophobicContact CD2-CZ 4.5Å; L484-T507 HydrophobicContact CD1-CG2 4.4Å; L484-L510 HydrophobicContact CD2-CD1 3.77Å
485	Q	92.5	Very high	84.2	Confident	52 Å²	52	76.4 Å²	76.4	24%	0.243	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.8	172.2	-164.6	-174.8	126.4	0	0	109.1	F472 E473 M475 R487 L494	F472-Q485 CarbonylContact C-O 3.56Å; F472-Q485 WeakPolarHBondContact CA-O 3.08Å; E473-Q485 HydrophobicContact CB-CB 4.36Å; E473-Q485 PolarHBondContact N-O 2.84Å; E473-Q485 PolarHBondContact O-N 3.18Å; M475-Q485 HydrophobicContact SD-CB 4.31Å; Q485-R487 HydrophobicContact CG-CG 4.16Å; Q485-R487 VanDerWaalsContact OE1-CZ 3.25Å; Q485-R487 VanDerWaalsContact OE1-NE 3.13Å; Q485-L494 HydrophobicContact CB-CD1 3.99Å; Q485-L494 HydrophobicContact CG-CD1 4.39Å
486	I	92.4	Very high	84.6	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.9	176.5	-58.1	-179	0	0	0	108.4	L446 I465 M470 F472 L484 S492 A493 I495	L446-I486 HydrophobicContact CD2-CD1 3.61Å; I465-I486 HydrophobicContact CD1-CG2 3.9Å; M470-I486 HydrophobicContact CE-CD1 4.25Å; M470-I486 HydrophobicContact CE-CG1 4.36Å; M470-I486 HydrophobicContact CE-CG2 3.85Å; M470-I486 HydrophobicContact CG-CG2 3.79Å; M470-I486 HydrophobicContact SD-CG2 3.64Å; F472-I486 HydrophobicContact CB-CG1 4.43Å; L484-I486 HydrophobicContact CD2-CD1 4.32Å; L484-I486 HydrophobicContact CD2-CG1 4.18Å; L484-I486 HydrophobicContact CG-CG1 4.35Å; I486-S492 CarbonylContact O-C 3.6Å; I486-S492 VanDerWaalsContact O-CA 3.23Å; I486-S492 WeakPolarHBondContact O-CA 3.15Å; I486-S492 WeakPolarHBondContact O-CB 3.15Å; I486-A493 PolarHBondContact N-O 2.92Å; I486-A493 PolarHBondContact O-N 2.92Å; I486-I495 HydrophobicContact CD1-CG1 3.85Å; I486-I495 HydrophobicContact CG1-CG1 4.44Å
487	R	90.1	Very high	85.5	Confident	118 Å²	118	68.9 Å²	68.9	45%	0.445	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.2	-174.2	-54.2	172.6	92.6	149.9	4	109.1	K471 E473 Q485	K471-R487 HydrophobicContact CB-CB 4.38Å; K471-R487 PolarHBondContact N-O 3.35Å; K471-R487 PolarHBondContact O-N 2.83Å; E473-R487 IonicContact OE1-NH1 2.98Å; E473-R487 IonicContact OE2-CZ 3.73Å; E473-R487 IonicContact OE2-NH1 3.79Å; E473-R487 PolarHBondContact OE2-NH1 3.21Å; Q485-R487 HydrophobicContact CG-CG 4.16Å; Q485-R487 VanDerWaalsContact OE1-CZ 3.25Å; Q485-R487 VanDerWaalsContact OE1-NE 3.13Å
488	S	86.7	Confident	86.2	Confident	19 Å²	19	68.6 Å²	68.6	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157	177.3	-174.6	0	0	0	0	110.9	Y469 V490 K491	Y469-S488 PolarHBondContact O-OG 2.81Å; S488-V490 PolarHBondContact O-N 3.26Å; S488-K491 PolarHBondContact O-N 3.3Å
489	R	77.8	Confident	87.3	Confident	194 Å²	194	64 Å²	64	73%	0.732	31%	0.311	S	S	*	.	S	Bend	trans	-58.2	-25.7	174.7	-68.1	-177.2	175.3	-179.9	-2.7	113.3
490	V	72.8	Confident	88.2	Confident	112 Å²	112	59.2 Å²	59.2	68%	0.679	29%	0.288	S	S	*	.	S	Bend	trans	-87.6	-49.2	179.7	180	0	0	0	0	111.8	S488	S488-V490 PolarHBondContact O-N 3.26Å
491	K	80.6	Confident	88.8	Confident	94 Å²	94	61.7 Å²	61.7	41%	0.409	30%	0.302	S	S	.	.			trans	-165.7	132.5	-171.3	-161.7	158.3	172.4	-174.3	0	111	Y463 S488	Y463-K491 HydrophobicContact CD1-CD 3.93Å; Y463-K491 HydrophobicContact CD2-CB 4.12Å; Y463-K491 HydrophobicContact CD2-CD 3.8Å; Y463-K491 HydrophobicContact CD2-CG 4.28Å; Y463-K491 HydrophobicContact CE1-CD 3.78Å; Y463-K491 VanDerWaalsContact CE1-NZ 3.29Å; Y463-K491 HydrophobicContact CE2-CB 3.85Å; Y463-K491 HydrophobicContact CE2-CD 3.63Å; Y463-K491 HydrophobicContact CE2-CG 3.76Å; Y463-K491 HydrophobicContact CG-CD 3.94Å; S488-K491 PolarHBondContact O-N 3.3Å
492	S	85.8	Confident	89.2	Confident	70 Å²	70	60.5 Å²	60.5	49%	0.49	30%	0.295	S	S	.	.			trans	-100.9	152.5	173.4	-57.1	0	0	0	0	111.6	I486	I486-S492 CarbonylContact O-C 3.6Å; I486-S492 VanDerWaalsContact O-CA 3.23Å; I486-S492 WeakPolarHBondContact O-CA 3.15Å; I486-S492 WeakPolarHBondContact O-CB 3.15Å
493	A	89.4	Confident	89.4	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.033	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	131.9	-178.7	0	0	0	0	0	110.6	K428 I448 I486 I495	K428-A493 HydrophobicContact CD-CB 4.39Å; K428-A493 HydrophobicContact CG-CB 4.49Å; I448-A493 HydrophobicContact CD1-CB 4.13Å; I486-A493 PolarHBondContact N-O 2.92Å; I486-A493 PolarHBondContact O-N 2.92Å; A493-I495 HydrophobicContact CB-CD1 4.13Å
494	L	92.1	Very high	89.5	Confident	44 Å²	44	56.9 Å²	56.9	23%	0.23	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.1	158.6	-174.7	71	0	0	0	107.4	Q429 M475 C483 Q485	Q429-L494 HydrophobicContact CB-CB 4.16Å; Q429-L494 HydrophobicContact CB-CD2 4.19Å; Q429-L494 HydrophobicContact CG-CD2 4.49Å; Q429-L494 PolarHBondContact N-O 2.99Å; Q429-L494 VanDerWaalsContact N-O 3.1Å; M475-L494 HydrophobicContact CG-CD1 4.22Å; M475-L494 HydrophobicContact SD-CD1 4.43Å; C483-L494 HydrophobicContact CB-CD1 3.92Å; C483-L494 HydrophobicContact CB-CG 4.41Å; Q485-L494 HydrophobicContact CB-CD1 3.99Å; Q485-L494 HydrophobicContact CG-CD1 4.39Å
495	I	94.2	Very high	89.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.5	175.6	-57.4	-58	0	0	0	108.3	V426 K428 L439 C483 L484 I486 A493 F497	V426-I495 HydrophobicContact CB-CG2 3.75Å; V426-I495 HydrophobicContact CG1-CG2 4.06Å; V426-I495 HydrophobicContact CG2-CD1 4.35Å; V426-I495 HydrophobicContact CG2-CG2 3.72Å; K428-I495 HydrophobicContact CB-CD1 4.24Å; K428-I495 HydrophobicContact CG-CD1 4.06Å; L439-I495 HydrophobicContact CD1-CG2 4.19Å; L439-I495 HydrophobicContact CD2-CD1 4.41Å; C483-I495 CarbonylContact C-O 3.57Å; C483-I495 WeakPolarHBondContact CA-O 3.07Å; L484-I495 PolarHBondContact N-O 3.09Å; L484-I495 PolarHBondContact O-N 3.01Å; I486-I495 HydrophobicContact CD1-CG1 3.85Å; I486-I495 HydrophobicContact CG1-CG1 4.44Å; A493-I495 HydrophobicContact CB-CD1 4.13Å; I495-F497 HydrophobicContact CB-CE2 4.39Å; I495-F497 HydrophobicContact CB-CZ 4.46Å; I495-F497 HydrophobicContact CG2-CD1 4.38Å; I495-F497 HydrophobicContact CG2-CD2 4.28Å; I495-F497 HydrophobicContact CG2-CE1 3.94Å; I495-F497 HydrophobicContact CG2-CE2 3.83Å; I495-F497 HydrophobicContact CG2-CZ 3.66Å
496	I	92.8	Very high	89.6	Confident	39 Å²	39	58 Å²	58	20%	0.2	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	123	175.6	-42.7	-170.6	0	0	0	107.5	M427 L434 R482	M427-I496 HydrophobicContact CB-CB 4.36Å; M427-I496 PolarHBondContact N-O 3.4Å; M427-I496 PolarHBondContact O-N 3.22Å; L434-I496 HydrophobicContact CD2-CD1 3.55Å; R482-I496 HydrophobicContact CB-CG2 4.38Å
497	F	94	Very high	89.6	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.035	29%	0.292	C	S	.	.			trans	-94.4	167.8	-179.1	-65.6	-77.2	0	0	0	111.7	V426 L439 R482 L484 I495 S499 E502 R503 W506	V426-F497 HydrophobicContact CG1-CD1 3.61Å; V426-F497 HydrophobicContact CG1-CE1 3.58Å; L439-F497 HydrophobicContact CD1-CE1 4.06Å; L439-F497 HydrophobicContact CD1-CZ 4.22Å; R482-F497 PolarHBondContact O-N 3.49Å; L484-F497 HydrophobicContact CB-CE2 3.72Å; L484-F497 HydrophobicContact CD2-CE2 4.29Å; L484-F497 HydrophobicContact CD2-CZ 4.5Å; I495-F497 HydrophobicContact CB-CE2 4.39Å; I495-F497 HydrophobicContact CB-CZ 4.46Å; I495-F497 HydrophobicContact CG2-CD1 4.38Å; I495-F497 HydrophobicContact CG2-CD2 4.28Å; I495-F497 HydrophobicContact CG2-CE1 3.94Å; I495-F497 HydrophobicContact CG2-CE2 3.83Å; I495-F497 HydrophobicContact CG2-CZ 3.66Å; F497-S499 VanDerWaalsContact C-N 3.28Å; F497-S499 PolarHBondContact O-N 2.73Å; F497-E502 HydrophobicContact CB-CB 4.14Å; F497-E502 HydrophobicContact CB-CG 4Å; F497-E502 HydrophobicContact CD1-CG 3.68Å; F497-E502 HydrophobicContact CE1-CG 4.48Å; F497-E502 HydrophobicContact CG-CG 4.08Å; F497-R503 HydrophobicContact CB-CB 4.38Å; F497-R503 HydrophobicContact CD2-CB 3.72Å; F497-R503 HydrophobicContact CD2-CG 3.97Å; F497-R503 HydrophobicContact CE2-CB 4.42Å; F497-R503 HydrophobicContact CE2-CG 4.39Å; F497-R503 HydrophobicContact CG-CB 4.34Å; F497-W506 AromaticContact CD1-CD1 3.79Å; F497-W506 HydrophobicContact CD1-CG 4.34Å; F497-W506 HydrophobicContact CE1-CB 4.07Å; F497-W506 AromaticContact CE1-CD1 3.28Å; F497-W506 AromaticContact CE1-CD2 3.82Å; F497-W506 HydrophobicContact CE1-CD2 3.82Å; F497-W506 AromaticContact CE1-CE2 3.88Å; F497-W506 AromaticContact CE1-CG 3.47Å; F497-W506 HydrophobicContact CE1-CG 3.47Å; F497-W506 VanDerWaalsContact CE1-CG 3.47Å; F497-W506 AromaticContact CE1-NE1 3.49Å; F497-W506 HydrophobicContact CE2-CB 4.31Å; F497-W506 HydrophobicContact CZ-CB 3.71Å; F497-W506 AromaticContact CZ-CD1 3.87Å; F497-W506 HydrophobicContact CZ-CD2 4.04Å; F497-W506 AromaticContact CZ-CG 3.6Å; F497-W506 HydrophobicContact CZ-CG 3.6Å
498	S	91.9	Very high	89.8	Confident	88 Å²	88	56.9 Å²	56.9	62%	0.615	29%	0.292	S	S	*	.	S	Bend	trans	-59.3	-42.1	176.5	61.7	0	0	0	0	112	E502	S498-E502 WeakPolarHBondContact CB-OE2 3.49Å; S498-E502 PolarHBondContact N-OE2 3Å; S498-E502 PolarHBondContact OG-OE2 2.59Å
499	S	92.1	Very high	90.1	Very high	46 Å²	46	57.6 Å²	57.6	32%	0.322	30%	0.295	S	S	.	.	S	Bend	trans	-144.5	160.4	-171.1	61.1	0	0	0	0	111	F497 K501 E502 R503	F497-S499 VanDerWaalsContact C-N 3.28Å; F497-S499 PolarHBondContact O-N 2.73Å; S499-K501 VanDerWaalsContact C-N 3.28Å; S499-K501 PolarHBondContact O-N 3.48Å; S499-E502 PolarHBondContact O-N 3.29Å; S499-E502 WeakPolarHBondContact OG-CB 3.24Å; S499-E502 PolarHBondContact OG-N 3.26Å; S499-R503 PolarHBondContact O-N 3.07Å; S499-R503 VanDerWaalsContact O-N 3.12Å
500	E	91.3	Very high	90.8	Very high	69 Å²	69	48.4 Å²	48.4	32%	0.322	26%	0.26	S	S	.	.	H	α-helix	trans	-67.7	-33	175.5	-156.8	-135.5	141.5	0	0	111.7	I481 E502 R503 N504	I481-E500 HydrophobicContact CB-CG 4.49Å; I481-E500 HydrophobicContact CD1-CG 4.22Å; I481-E500 HydrophobicContact CG1-CG 3.9Å; I481-E500 HydrophobicContact CG2-CG 4.24Å; E500-E502 VanDerWaalsContact C-N 3.3Å; E500-E502 PolarHBondContact O-N 3.35Å; E500-R503 WeakPolarHBondContact O-CB 3.48Å; E500-R503 PolarHBondContact O-N 3.25Å; E500-R503 VanDerWaalsContact O-N 3.12Å; E500-R503 IonicContact OE1-CZ 3.51Å; E500-R503 IonicContact OE1-NE 3.28Å; E500-R503 IonicContact OE1-NH2 3.48Å; E500-R503 PolarHBondContact OE1-NH2 3.3Å; E500-N504 WeakPolarHBondContact O-CB 3.47Å; E500-N504 VanDerWaalsContact O-CG 3.28Å; E500-N504 PolarHBondContact O-N 3.35Å; E500-N504 PolarHBondContact O-ND2 3.46Å; E500-N504 PolarHBondContact OE1-ND2 3.1Å; E500-N504 PolarHBondContact OE1-OD1 3.48Å
501	K	91.4	Very high	91.7	Very high	157 Å²	157	46.5 Å²	46.5	68%	0.683	25%	0.249	S	C	*	.	H	α-helix	trans	-57.3	-42.1	172.6	-171.8	173.9	-177.8	175.5	0	111.8	S499 Q505	S499-K501 VanDerWaalsContact C-N 3.28Å; S499-K501 PolarHBondContact O-N 3.48Å; K501-Q505 VanDerWaalsContact O-CG 3.31Å; K501-Q505 WeakPolarHBondContact O-CG 3.46Å; K501-Q505 PolarHBondContact O-N 2.82Å; K501-Q505 VanDerWaalsContact O-N 3.16Å
502	E	92.6	Very high	92	Very high	26 Å²	26	48.6 Å²	48.6	12%	0.121	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-46.5	172.5	-179	-179.4	-164.7	0	0	111.5	S424 F497 S498 S499 E500 N504 Q505 W506	S424-E502 VanDerWaalsContact CB-OE1 3.24Å; S424-E502 WeakPolarHBondContact CB-OE1 3.49Å; S424-E502 PolarHBondContact OG-OE1 3.38Å; F497-E502 HydrophobicContact CB-CB 4.14Å; F497-E502 HydrophobicContact CB-CG 4Å; F497-E502 HydrophobicContact CD1-CG 3.68Å; F497-E502 HydrophobicContact CE1-CG 4.48Å; F497-E502 HydrophobicContact CG-CG 4.08Å; S498-E502 WeakPolarHBondContact CB-OE2 3.49Å; S498-E502 PolarHBondContact N-OE2 3Å; S498-E502 PolarHBondContact OG-OE2 2.59Å; S499-E502 PolarHBondContact O-N 3.29Å; S499-E502 WeakPolarHBondContact OG-CB 3.24Å; S499-E502 PolarHBondContact OG-N 3.26Å; E500-E502 VanDerWaalsContact C-N 3.3Å; E500-E502 PolarHBondContact O-N 3.35Å; E502-N504 VanDerWaalsContact C-N 3.29Å; E502-N504 PolarHBondContact O-N 3.34Å; E502-Q505 PolarHBondContact O-N 2.68Å; E502-W506 PolarHBondContact O-N 3.13Å
503	R	93.3	Very high	92.1	Very high	12 Å²	12	45.5 Å²	45.5	5%	0.045	24%	0.237	C	C	.	.	H	α-helix	trans	-53.4	-45	175.9	-175.4	-78.8	-61.8	-106.3	11.9	111.8	M475 I481 C483 F497 S499 E500 T507	M475-R503 PolarHBondContact O-NH1 3.37Å; I481-R503 PolarHBondContact O-NE 3.19Å; I481-R503 PolarHBondContact O-NH1 2.97Å; I481-R503 PolarHBondContact O-NH2 3.29Å; C483-R503 WeakPolarHBondContact O-CG 3.26Å; F497-R503 HydrophobicContact CB-CB 4.38Å; F497-R503 HydrophobicContact CD2-CB 3.72Å; F497-R503 HydrophobicContact CD2-CG 3.97Å; F497-R503 HydrophobicContact CE2-CB 4.42Å; F497-R503 HydrophobicContact CE2-CG 4.39Å; F497-R503 HydrophobicContact CG-CB 4.34Å; S499-R503 PolarHBondContact O-N 3.07Å; S499-R503 VanDerWaalsContact O-N 3.12Å; E500-R503 WeakPolarHBondContact O-CB 3.48Å; E500-R503 PolarHBondContact O-N 3.25Å; E500-R503 VanDerWaalsContact O-N 3.12Å; E500-R503 IonicContact OE1-CZ 3.51Å; E500-R503 IonicContact OE1-NE 3.28Å; E500-R503 IonicContact OE1-NH2 3.48Å; E500-R503 PolarHBondContact OE1-NH2 3.3Å; R503-T507 PolarHBondContact O-N 3.19Å; R503-T507 VanDerWaalsContact O-N 3.07Å; R503-T507 PolarHBondContact O-OG1 3.48Å
504	N	92.8	Very high	92.1	Very high	41 Å²	41	46.1 Å²	46.1	22%	0.219	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-53.8	-179.4	-69	-16.7	0	0	0	110.7	E500 E502 W506 T507 D508	E500-N504 WeakPolarHBondContact O-CB 3.47Å; E500-N504 VanDerWaalsContact O-CG 3.28Å; E500-N504 PolarHBondContact O-N 3.35Å; E500-N504 PolarHBondContact O-ND2 3.46Å; E500-N504 PolarHBondContact OE1-ND2 3.1Å; E500-N504 PolarHBondContact OE1-OD1 3.48Å; E502-N504 VanDerWaalsContact C-N 3.29Å; E502-N504 PolarHBondContact O-N 3.34Å; N504-W506 VanDerWaalsContact C-N 3.32Å; N504-W506 PolarHBondContact O-N 3.43Å; N504-T507 WeakPolarHBondContact O-CA 3.15Å; N504-T507 VanDerWaalsContact O-CB 3.28Å; N504-T507 WeakPolarHBondContact O-CB 3.21Å; N504-T507 PolarHBondContact O-N 3.01Å; N504-D508 PolarHBondContact O-N 3.3Å; N504-D508 VanDerWaalsContact O-OD2 3.11Å
505	Q	93.3	Very high	91.7	Very high	76 Å²	76	51.8 Å²	51.8	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-53.4	-44.8	176.4	-72.4	178.6	11.6	0	0	113.2	K501 E502 T507 D508 D509	K501-Q505 VanDerWaalsContact O-CG 3.31Å; K501-Q505 WeakPolarHBondContact O-CG 3.46Å; K501-Q505 PolarHBondContact O-N 2.82Å; K501-Q505 VanDerWaalsContact O-N 3.16Å; E502-Q505 PolarHBondContact O-N 2.68Å; Q505-T507 VanDerWaalsContact C-N 3.3Å; Q505-T507 PolarHBondContact O-N 3.2Å; Q505-D508 PolarHBondContact O-N 2.99Å; Q505-D509 PolarHBondContact O-N 2.94Å
506	W	94.7	Very high	90.9	Very high	1 Å²	1	55.5 Å²	55.5	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-62.8	-35.3	175	-90.7	94.7	0	0	0	112.9	R422 S424 L439 L441 L446 F497 E502 N504 L510	R422-W506 HydrophobicContact CB-CH2 4.24Å; R422-W506 HydrophobicContact CB-CZ2 4.22Å; R422-W506 HydrophobicContact CG-CD2 4.41Å; R422-W506 HydrophobicContact CG-CH2 4.19Å; R422-W506 HydrophobicContact CG-CZ2 3.67Å; S424-W506 WeakPolarHBondContact OG-CZ2 3.32Å; S424-W506 PolarHBondContact OG-NE1 3.22Å; L439-W506 HydrophobicContact CB-CH2 3.28Å; L439-W506 HydrophobicContact CB-CZ2 3.7Å; L439-W506 HydrophobicContact CB-CZ3 3.94Å; L439-W506 HydrophobicContact CD1-CD2 4.38Å; L439-W506 HydrophobicContact CD1-CE3 4.12Å; L439-W506 HydrophobicContact CD1-CH2 3.89Å; L439-W506 HydrophobicContact CD1-CZ2 4.11Å; L439-W506 HydrophobicContact CD1-CZ3 3.84Å; L439-W506 HydrophobicContact CG-CH2 4.24Å; L441-W506 HydrophobicContact CB-CH2 4.16Å; L441-W506 HydrophobicContact CB-CZ3 3.76Å; L441-W506 HydrophobicContact CD2-CZ3 4.38Å; L446-W506 HydrophobicContact CD1-CZ3 3.87Å; F497-W506 AromaticContact CD1-CD1 3.79Å; F497-W506 HydrophobicContact CD1-CG 4.34Å; F497-W506 HydrophobicContact CE1-CB 4.07Å; F497-W506 AromaticContact CE1-CD1 3.28Å; F497-W506 AromaticContact CE1-CD2 3.82Å; F497-W506 HydrophobicContact CE1-CD2 3.82Å; F497-W506 AromaticContact CE1-CE2 3.88Å; F497-W506 AromaticContact CE1-CG 3.47Å; F497-W506 HydrophobicContact CE1-CG 3.47Å; F497-W506 VanDerWaalsContact CE1-CG 3.47Å; F497-W506 AromaticContact CE1-NE1 3.49Å; F497-W506 HydrophobicContact CE2-CB 4.31Å; F497-W506 HydrophobicContact CZ-CB 3.71Å; F497-W506 AromaticContact CZ-CD1 3.87Å; F497-W506 HydrophobicContact CZ-CD2 4.04Å; F497-W506 AromaticContact CZ-CG 3.6Å; F497-W506 HydrophobicContact CZ-CG 3.6Å; E502-W506 PolarHBondContact O-N 3.13Å; N504-W506 VanDerWaalsContact C-N 3.32Å; N504-W506 PolarHBondContact O-N 3.43Å; W506-L510 VanDerWaalsContact O-CB 3.26Å; W506-L510 WeakPolarHBondContact O-CB 3.35Å; W506-L510 WeakPolarHBondContact O-CD1 3.38Å; W506-L510 WeakPolarHBondContact O-CG 3.29Å; W506-L510 PolarHBondContact O-N 3.35Å; W506-L510 VanDerWaalsContact O-N 3.12Å
507	T	92.5	Very high	90.1	Very high	8 Å²	8	57.2 Å²	57.2	5%	0.049	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-41.4	175.9	-46.9	0	0	0	0	111.2	F472 R474 L484 R503 N504 Q505 L510 T511	F472-T507 HydrophobicContact CD2-CG2 3.94Å; F472-T507 HydrophobicContact CE2-CG2 3.64Å; R474-T507 HydrophobicContact CG-CG2 4.05Å; R474-T507 PolarHBondContact NE-OG1 3.38Å; L484-T507 HydrophobicContact CD1-CG2 4.4Å; R503-T507 PolarHBondContact O-N 3.19Å; R503-T507 VanDerWaalsContact O-N 3.07Å; R503-T507 PolarHBondContact O-OG1 3.48Å; N504-T507 WeakPolarHBondContact O-CA 3.15Å; N504-T507 VanDerWaalsContact O-CB 3.28Å; N504-T507 WeakPolarHBondContact O-CB 3.21Å; N504-T507 PolarHBondContact O-N 3.01Å; Q505-T507 VanDerWaalsContact C-N 3.3Å; Q505-T507 PolarHBondContact O-N 3.2Å; T507-L510 PolarHBondContact O-N 2.69Å; T507-T511 WeakPolarHBondContact O-CB 3.46Å; T507-T511 PolarHBondContact O-N 3.12Å; T507-T511 PolarHBondContact O-OG1 3.25Å
508	D	93	Very high	89.3	Confident	87 Å²	87	61.6 Å²	61.6	47%	0.465	30%	0.301	S	S	.	.	H	α-helix	trans	-69.9	-44.2	-175.5	-54.9	-30.4	0	0	0	110.5	R474 N504 Q505 T511 K512	R474-D508 IonicContact NH2-OD1 2.69Å; R474-D508 PolarHBondContact NH2-OD1 2.9Å; N504-D508 PolarHBondContact O-N 3.3Å; N504-D508 VanDerWaalsContact O-OD2 3.11Å; Q505-D508 PolarHBondContact O-N 2.99Å; D508-T511 WeakPolarHBondContact O-CB 3.29Å; D508-T511 PolarHBondContact O-N 3.44Å; D508-K512 WeakPolarHBondContact O-CB 3.46Å; D508-K512 PolarHBondContact O-N 2.9Å
509	D	92.8	Very high	88.3	Confident	34 Å²	34	58.9 Å²	58.9	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-41.4	173.2	-78.1	-27.8	0	0	0	112.5	I421 R422 L441 Q505 T511 K512 A513	I421-D509 HydrophobicContact CG2-CB 3.93Å; R422-D509 IonicContact CZ-OD2 2.75Å; R422-D509 IonicContact NE-OD2 3.75Å; R422-D509 PolarHBondContact NE-OD2 3.06Å; R422-D509 IonicContact NH2-OD2 2.78Å; R422-D509 PolarHBondContact NH2-OD2 3.26Å; L441-D509 HydrophobicContact CD2-CB 4.06Å; Q505-D509 PolarHBondContact O-N 2.94Å; D509-T511 VanDerWaalsContact C-N 3.32Å; D509-T511 PolarHBondContact O-N 2.92Å; D509-K512 PolarHBondContact O-N 2.89Å; D509-A513 VanDerWaalsContact O-CB 3.26Å; D509-A513 WeakPolarHBondContact O-CB 3.28Å; D509-A513 PolarHBondContact O-N 2.71Å
510	L	93.1	Very high	87.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-36.7	174.3	-78.3	172.5	0	0	0	112.3	L441 L467 M470 F472 L484 W506 T507 Q514	L441-L510 HydrophobicContact CD1-CD2 3.55Å; L441-L510 HydrophobicContact CD2-CD2 3.85Å; L441-L510 HydrophobicContact CD2-CG 4.12Å; L441-L510 HydrophobicContact CG-CD2 4.35Å; L467-L510 HydrophobicContact CD2-CD2 3.99Å; M470-L510 HydrophobicContact CE-CD1 3.71Å; M470-L510 HydrophobicContact CE-CD2 3.58Å; M470-L510 HydrophobicContact CE-CG 4.23Å; F472-L510 HydrophobicContact CD1-CB 4.13Å; F472-L510 HydrophobicContact CD1-CD1 4.35Å; F472-L510 HydrophobicContact CE1-CB 3.7Å; F472-L510 HydrophobicContact CE2-CB 4.37Å; F472-L510 HydrophobicContact CG-CD1 4.41Å; F472-L510 HydrophobicContact CZ-CB 3.83Å; L484-L510 HydrophobicContact CD2-CD1 3.77Å; W506-L510 VanDerWaalsContact O-CB 3.26Å; W506-L510 WeakPolarHBondContact O-CB 3.35Å; W506-L510 WeakPolarHBondContact O-CD1 3.38Å; W506-L510 WeakPolarHBondContact O-CG 3.29Å; W506-L510 PolarHBondContact O-N 3.35Å; W506-L510 VanDerWaalsContact O-N 3.12Å; T507-L510 PolarHBondContact O-N 2.69Å; L510-Q514 WeakPolarHBondContact O-CB 3.21Å; L510-Q514 WeakPolarHBondContact O-CG 3.5Å; L510-Q514 PolarHBondContact O-N 3.06Å
511	T	91.5	Very high	85.9	Confident	72 Å²	72	59.3 Å²	59.3	44%	0.442	28%	0.276	S	S	.	.	H	α-helix	trans	-66.2	-48.2	177.2	-58.3	0	0	0	0	110.5	F472 T507 D508 D509 Q514 Y515	F472-T511 WeakPolarHBondContact CZ-OG1 3.26Å; T507-T511 WeakPolarHBondContact O-CB 3.46Å; T507-T511 PolarHBondContact O-N 3.12Å; T507-T511 PolarHBondContact O-OG1 3.25Å; D508-T511 WeakPolarHBondContact O-CB 3.29Å; D508-T511 PolarHBondContact O-N 3.44Å; D509-T511 VanDerWaalsContact C-N 3.32Å; D509-T511 PolarHBondContact O-N 2.92Å; T511-Q514 PolarHBondContact O-N 2.9Å; T511-Y515 WeakPolarHBondContact O-CB 3.18Å; T511-Y515 PolarHBondContact O-N 3.06Å
512	K	87.9	Confident	84.9	Confident	139 Å²	139	60.9 Å²	60.9	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-59.6	-52.7	175.7	-176	178.9	178.4	-177.5	0	111.8	D508 D509 Q514 Y515 D516	D508-K512 WeakPolarHBondContact O-CB 3.46Å; D508-K512 PolarHBondContact O-N 2.9Å; D509-K512 PolarHBondContact O-N 2.89Å; K512-Q514 VanDerWaalsContact C-N 3.29Å; K512-Q514 PolarHBondContact O-N 3.35Å; K512-Y515 WeakPolarHBondContact O-CB 3.36Å; K512-Y515 PolarHBondContact O-N 3.08Å; K512-D516 PolarHBondContact O-N 3.19Å
513	A	87.4	Confident	83.5	Confident	5 Å²	5	64.1 Å²	64.1	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-38.6	179.6	0	0	0	0	0	112.6	I421 L467 D509 R517	I421-A513 HydrophobicContact CD1-CB 3.63Å; L467-A513 HydrophobicContact CD1-CB 3.67Å; D509-A513 VanDerWaalsContact O-CB 3.26Å; D509-A513 WeakPolarHBondContact O-CB 3.28Å; D509-A513 PolarHBondContact O-N 2.71Å; A513-R517 WeakPolarHBondContact O-CB 3.45Å; A513-R517 PolarHBondContact O-N 3.21Å; A513-R517 VanDerWaalsContact O-N 3.09Å
514	Q	88.5	Confident	82	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.075	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-39	172.5	-80.5	-156.1	7.1	0	0	113.4	L467 M470 F472 L510 T511 K512 K518	L467-Q514 HydrophobicContact CB-CG 4.32Å; L467-Q514 PolarHBondContact O-NE2 2.9Å; M470-Q514 PolarHBondContact O-NE2 2.69Å; F472-Q514 HydrophobicContact CE1-CG 4.28Å; L510-Q514 WeakPolarHBondContact O-CB 3.21Å; L510-Q514 WeakPolarHBondContact O-CG 3.5Å; L510-Q514 PolarHBondContact O-N 3.06Å; T511-Q514 PolarHBondContact O-N 2.9Å; K512-Q514 VanDerWaalsContact C-N 3.29Å; K512-Q514 PolarHBondContact O-N 3.35Å; Q514-K518 WeakPolarHBondContact O-CB 3.35Å; Q514-K518 VanDerWaalsContact O-CD 3.31Å; Q514-K518 WeakPolarHBondContact O-CD 3.4Å; Q514-K518 WeakPolarHBondContact O-CG 3.43Å; Q514-K518 PolarHBondContact O-N 2.79Å
515	Y	84.4	Confident	80.5	Confident	163 Å²	163	67.9 Å²	67.9	64%	0.639	31%	0.314	S	S	*	.	H	α-helix	trans	-61.4	-49.4	176.9	179.6	-87.8	0	0	0	110.7	T511 K512 R517 K518 S519	T511-Y515 WeakPolarHBondContact O-CB 3.18Å; T511-Y515 PolarHBondContact O-N 3.06Å; K512-Y515 WeakPolarHBondContact O-CB 3.36Å; K512-Y515 PolarHBondContact O-N 3.08Å; Y515-R517 PolarHBondContact O-N 3.18Å; Y515-K518 PolarHBondContact O-N 3.45Å; Y515-K518 VanDerWaalsContact O-N 3.15Å; Y515-S519 WeakPolarHBondContact O-CB 3.27Å; Y515-S519 PolarHBondContact O-N 2.93Å
516	D	77.1	Confident	79.2	Confident	79 Å²	79	67.1 Å²	67.1	42%	0.422	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-42.4	180	-66.3	-27.2	0	0	0	111.8	K512 K518 S519 Y520	K512-D516 PolarHBondContact O-N 3.19Å; D516-K518 VanDerWaalsContact C-N 3.34Å; D516-K518 PolarHBondContact O-N 3.45Å; D516-S519 PolarHBondContact O-N 3.23Å; D516-S519 PolarHBondContact O-OG 3.38Å; D516-S519 VanDerWaalsContact O-OG 3.12Å; D516-Y520 WeakPolarHBondContact O-CB 3.35Å; D516-Y520 PolarHBondContact O-N 2.96Å; D516-Y520 VanDerWaalsContact O-N 3.1Å
517	R	77.2	Confident	77.4	Confident	75 Å²	75	67.1 Å²	67.1	28%	0.283	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-36.8	175.3	-168.6	67.4	177.5	-162.8	-0.8	112.5	A513 Y515 K521	A513-R517 WeakPolarHBondContact O-CB 3.45Å; A513-R517 PolarHBondContact O-N 3.21Å; A513-R517 VanDerWaalsContact O-N 3.09Å; Y515-R517 PolarHBondContact O-N 3.18Å; R517-K521 PolarHBondContact O-N 2.93Å
518	K	77.5	Confident	75.9	Confident	99 Å²	99	68.6 Å²	68.6	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-75.7	-40.6	178.1	-70.9	164.8	-166.5	167.5	0	112.2	Q514 Y515 D516 Y520 K521 R522	Q514-K518 WeakPolarHBondContact O-CB 3.35Å; Q514-K518 VanDerWaalsContact O-CD 3.31Å; Q514-K518 WeakPolarHBondContact O-CD 3.4Å; Q514-K518 WeakPolarHBondContact O-CG 3.43Å; Q514-K518 PolarHBondContact O-N 2.79Å; Y515-K518 PolarHBondContact O-N 3.45Å; Y515-K518 VanDerWaalsContact O-N 3.15Å; D516-K518 VanDerWaalsContact C-N 3.34Å; D516-K518 PolarHBondContact O-N 3.45Å; K518-Y520 VanDerWaalsContact C-N 3.31Å; K518-Y520 PolarHBondContact O-N 3.15Å; K518-K521 PolarHBondContact O-N 3.35Å; K518-R522 WeakPolarHBondContact O-CG 3.28Å; K518-R522 PolarHBondContact O-N 3.03Å
519	S	70.4	Confident	74.6	Confident	31 Å²	31	69.9 Å²	69.9	22%	0.217	33%	0.327	C	S	.	.	H	α-helix	trans	-66.1	-34.5	178.8	78	0	0	0	0	111.8	Y515 D516 R523	Y515-S519 WeakPolarHBondContact O-CB 3.27Å; Y515-S519 PolarHBondContact O-N 2.93Å; D516-S519 PolarHBondContact O-N 3.23Å; D516-S519 PolarHBondContact O-OG 3.38Å; D516-S519 VanDerWaalsContact O-OG 3.12Å; S519-R523 PolarHBondContact O-N 2.71Å; S519-R523 PolarHBondContact O-NE 3.49Å
520	Y	66.8	Low	73.2	Confident	44 Å²	44	72.3 Å²	72.3	17%	0.173	33%	0.334	C	S	.	.	H	α-helix	trans	-61.2	-53.2	169.6	173.9	-103.1	0	0	0	112.2	A338 Q341 D516 K518 R522 R523 Q524	A338-Y520 HydrophobicContact CB-CE2 3.62Å; A338-Y520 WeakPolarHBondContact CB-OH 3.44Å; A338-Y520 PolarHBondContact N-OH 2.92Å; Q341-Y520 PolarHBondContact OE1-OH 3.14Å; D516-Y520 WeakPolarHBondContact O-CB 3.35Å; D516-Y520 PolarHBondContact O-N 2.96Å; D516-Y520 VanDerWaalsContact O-N 3.1Å; K518-Y520 VanDerWaalsContact C-N 3.31Å; K518-Y520 PolarHBondContact O-N 3.15Å; Y520-R522 VanDerWaalsContact C-N 3.33Å; Y520-R522 PolarHBondContact O-N 2.83Å; Y520-R523 PolarHBondContact O-N 2.85Å; Y520-Q524 PolarHBondContact O-N 2.83Å; Y520-Q524 VanDerWaalsContact O-N 3.15Å
521	K	66.8	Low	71.6	Confident	81 Å²	81	74.3 Å²	74.3	35%	0.352	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-33.1	178.8	-91.7	-163.2	165.1	-174.8	0	113.9	E468 R517 K518 Q524 S525	E468-K521 IonicContact OE1-NZ 3.54Å; E468-K521 PolarHBondContact OE1-NZ 2.97Å; E468-K521 WeakPolarHBondContact OE2-CE 3.48Å; E468-K521 IonicContact OE2-NZ 3.65Å; E468-K521 PolarHBondContact OE2-NZ 2.83Å; R517-K521 PolarHBondContact O-N 2.93Å; K518-K521 PolarHBondContact O-N 3.35Å; K521-Q524 PolarHBondContact O-N 3.14Å; K521-S525 PolarHBondContact O-N 3.39Å
522	R	68.7	Low	70.4	Confident	189 Å²	189	74.2 Å²	74.2	71%	0.713	34%	0.34	S	S	*	.	H	α-helix	trans	-60.6	-51.7	174.5	-77.2	-179.8	178	-176.4	-1.2	111.6	K518 Y520 Q524 S525 T526	K518-R522 WeakPolarHBondContact O-CG 3.28Å; K518-R522 PolarHBondContact O-N 3.03Å; Y520-R522 VanDerWaalsContact C-N 3.33Å; Y520-R522 PolarHBondContact O-N 2.83Å; R522-Q524 VanDerWaalsContact C-N 3.3Å; R522-Q524 PolarHBondContact O-N 3.02Å; R522-S525 PolarHBondContact O-N 3.46Å; R522-S525 VanDerWaalsContact O-N 3.09Å; R522-T526 PolarHBondContact O-N 3.2Å; R522-T526 PolarHBondContact O-OG1 2.89Å
523	R	64.6	Low	69.4	Low	94 Å²	94	71.1 Å²	71.1	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-55.1	-45.9	176	-75.2	179.8	-78	175.7	-4.3	111.7	L310 S519 Y520 S525 T526 A527	L310-R523 VanDerWaalsContact CD2-NH1 3.33Å; S519-R523 PolarHBondContact O-N 2.71Å; S519-R523 PolarHBondContact O-NE 3.49Å; Y520-R523 PolarHBondContact O-N 2.85Å; R523-S525 VanDerWaalsContact C-N 3.33Å; R523-S525 PolarHBondContact O-N 3.46Å; R523-T526 PolarHBondContact O-N 3.36Å; R523-A527 PolarHBondContact O-N 3.41Å
524	Q	60.6	Low	68.2	Low	55 Å²	55	73.9 Å²	73.9	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-56.7	-43.5	176.3	-161.6	179.7	45.5	0	0	112.7	Y324 Y520 K521 R522 V528	Y324-Q524 HydrophobicContact CD2-CG 4.02Å; Y324-Q524 HydrophobicContact CE2-CG 3.41Å; Y324-Q524 VanDerWaalsContact CE2-CG 3.41Å; Y520-Q524 PolarHBondContact O-N 2.83Å; Y520-Q524 VanDerWaalsContact O-N 3.15Å; K521-Q524 PolarHBondContact O-N 3.14Å; R522-Q524 VanDerWaalsContact C-N 3.3Å; R522-Q524 PolarHBondContact O-N 3.02Å; Q524-V528 WeakPolarHBondContact O-CG2 3.12Å; Q524-V528 PolarHBondContact O-N 3.42Å
525	S	61.3	Low	67.1	Low	78 Å²	78	78.3 Å²	78.3	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-69.7	-34.8	178.1	-165	0	0	0	0	113.2	K521 R522 R523 Q529	K521-S525 PolarHBondContact O-N 3.39Å; R522-S525 PolarHBondContact O-N 3.46Å; R522-S525 VanDerWaalsContact O-N 3.09Å; R523-S525 VanDerWaalsContact C-N 3.33Å; R523-S525 PolarHBondContact O-N 3.46Å; S525-Q529 PolarHBondContact O-N 2.71Å
526	T	65.9	Low	66.3	Low	59 Å²	59	77.5 Å²	77.5	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-69	-36.8	177.3	-55.5	0	0	0	0	111.8	R522 R523 Q529 R530	R522-T526 PolarHBondContact O-N 3.2Å; R522-T526 PolarHBondContact O-OG1 2.89Å; R523-T526 PolarHBondContact O-N 3.36Å; T526-Q529 PolarHBondContact O-N 3.5Å; T526-R530 WeakPolarHBondContact O-CG 3.26Å; T526-R530 PolarHBondContact O-N 2.87Å; T526-R530 VanDerWaalsContact O-N 3.11Å
527	A	57.1	Low	65.8	Low	1 Å²	1	79.6 Å²	79.6	1%	0.008	37%	0.366	C	S	.	.	H	α-helix	trans	-64.1	-43.4	174.5	0	0	0	0	0	112.3	Y324 R523 Q529 R530 H531	Y324-A527 HydrophobicContact CD1-CB 3.76Å; Y324-A527 HydrophobicContact CD2-CB 4.26Å; Y324-A527 HydrophobicContact CG-CB 3.57Å; R523-A527 PolarHBondContact O-N 3.41Å; A527-Q529 PolarHBondContact O-N 3.37Å; A527-R530 PolarHBondContact O-N 3.01Å; A527-H531 PolarHBondContact O-N 2.69Å; A527-H531 VanDerWaalsContact O-N 3.08Å
528	V	61.3	Low	64.9	Low	40 Å²	40	81.4 Å²	81.4	24%	0.242	38%	0.379	C	S	.	.	H	α-helix	trans	-54.2	-52	172.5	175.2	0	0	0	0	111.2	Y324 Q524 R530 H531 D532	Y324-V528 HydrophobicContact CD1-CG2 4.46Å; Y324-V528 HydrophobicContact CE1-CB 4.3Å; Y324-V528 HydrophobicContact CE1-CG2 3.39Å; Y324-V528 HydrophobicContact CE2-CG2 4.45Å; Y324-V528 WeakPolarHBondContact OH-CG2 3.3Å; Q524-V528 WeakPolarHBondContact O-CG2 3.12Å; Q524-V528 PolarHBondContact O-N 3.42Å; V528-R530 VanDerWaalsContact C-N 3.34Å; V528-R530 PolarHBondContact O-N 2.8Å; V528-H531 PolarHBondContact O-N 2.74Å; V528-D532 PolarHBondContact O-N 3.26Å
529	Q	65.2	Low	63.8	Low	114 Å²	114	80.6 Å²	80.6	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-42.4	-174.4	-175.9	-178.9	-23.2	0	0	111.5	S525 T526 A527 D532 E533	S525-Q529 PolarHBondContact O-N 2.71Å; T526-Q529 PolarHBondContact O-N 3.5Å; A527-Q529 PolarHBondContact O-N 3.37Å; Q529-D532 PolarHBondContact O-N 3.02Å; Q529-E533 HydrophobicContact CG-CG 4.49Å; Q529-E533 WeakPolarHBondContact CG-OE1 3.38Å; Q529-E533 PolarHBondContact NE2-OE1 3.15Å; Q529-E533 WeakPolarHBondContact O-CB 3.4Å; Q529-E533 VanDerWaalsContact O-CG 3.32Å; Q529-E533 WeakPolarHBondContact O-CG 3.24Å; Q529-E533 PolarHBondContact O-N 3.43Å
530	R	63.2	Low	63.3	Low	84 Å²	84	85.8 Å²	85.8	32%	0.317	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.2	-72.2	174.8	-173.9	158.9	2.9	112.3	T526 A527 V528 D532 E533 N534	T526-R530 WeakPolarHBondContact O-CG 3.26Å; T526-R530 PolarHBondContact O-N 2.87Å; T526-R530 VanDerWaalsContact O-N 3.11Å; A527-R530 PolarHBondContact O-N 3.01Å; V528-R530 VanDerWaalsContact C-N 3.34Å; V528-R530 PolarHBondContact O-N 2.8Å; R530-D532 PolarHBondContact O-N 2.75Å; R530-E533 PolarHBondContact O-N 3.24Å; R530-N534 VanDerWaalsContact O-CB 3.3Å; R530-N534 WeakPolarHBondContact O-CB 3.33Å; R530-N534 PolarHBondContact O-N 2.83Å; R530-N534 PolarHBondContact O-ND2 3.39Å
531	H	60.3	Low	62.7	Low	42 Å²	42	90 Å²	90	19%	0.194	42%	0.423	C	S	.	.	H	α-helix	trans	-59	-46.5	175.5	169	-90.3	0	0	0	111.6	E321 M325 A527 V528 E533 N534 K535	E321-H531 HydrophobicContact CG-CB 4.15Å; E321-H531 WeakPolarHBondContact OE1-CA 3.38Å; E321-H531 IonicContact OE1-CD2 2.67Å; M325-H531 HydrophobicContact SD-CB 4.28Å; M325-H531 VanDerWaalsContact SD-CD2 3.56Å; A527-H531 PolarHBondContact O-N 2.69Å; A527-H531 VanDerWaalsContact O-N 3.08Å; V528-H531 PolarHBondContact O-N 2.74Å; H531-E533 VanDerWaalsContact C-N 3.33Å; H531-E533 PolarHBondContact O-N 2.74Å; H531-N534 PolarHBondContact O-N 3.17Å; H531-K535 VanDerWaalsContact O-CB 3.26Å; H531-K535 WeakPolarHBondContact O-CB 3.44Å; H531-K535 PolarHBondContact O-N 3.12Å
532	D	65.5	Low	61.9	Low	70 Å²	70	91.8 Å²	91.8	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-69.1	-31.2	-179.8	-74.3	-8.4	0	0	0	112.4	V528 Q529 R530 K536	V528-D532 PolarHBondContact O-N 3.26Å; Q529-D532 PolarHBondContact O-N 3.02Å; R530-D532 PolarHBondContact O-N 2.75Å; D532-K536 WeakPolarHBondContact O-CB 3.5Å; D532-K536 VanDerWaalsContact O-CD 3.31Å; D532-K536 WeakPolarHBondContact O-CD 3.15Å; D532-K536 WeakPolarHBondContact O-CG 3.18Å; D532-K536 PolarHBondContact O-N 3.07Å
533	E	67.5	Low	61	Low	75 Å²	75	90.4 Å²	90.4	35%	0.35	44%	0.439	S	S	.	.	H	α-helix	trans	-69	-42.5	169.4	-75.9	172.7	-164.4	0	0	112.4	Q529 R530 H531 K536 K537	Q529-E533 HydrophobicContact CG-CG 4.49Å; Q529-E533 WeakPolarHBondContact CG-OE1 3.38Å; Q529-E533 PolarHBondContact NE2-OE1 3.15Å; Q529-E533 WeakPolarHBondContact O-CB 3.4Å; Q529-E533 VanDerWaalsContact O-CG 3.32Å; Q529-E533 WeakPolarHBondContact O-CG 3.24Å; Q529-E533 PolarHBondContact O-N 3.43Å; R530-E533 PolarHBondContact O-N 3.24Å; H531-E533 VanDerWaalsContact C-N 3.33Å; H531-E533 PolarHBondContact O-N 2.74Å; E533-K536 PolarHBondContact O-N 3.36Å; E533-K537 VanDerWaalsContact O-CG 3.3Å; E533-K537 WeakPolarHBondContact O-CG 3.32Å; E533-K537 PolarHBondContact O-N 3.3Å
534	N	61.3	Low	60.1	Low	62 Å²	62	91.6 Å²	91.6	33%	0.332	45%	0.452	S	S	.	.	H	α-helix	trans	-68.5	-40.2	178.8	-72.7	-17.5	0	0	0	111.3	E321 R530 H531 K536 K537 M538	E321-N534 PolarHBondContact OE2-ND2 3.43Å; R530-N534 VanDerWaalsContact O-CB 3.3Å; R530-N534 WeakPolarHBondContact O-CB 3.33Å; R530-N534 PolarHBondContact O-N 2.83Å; R530-N534 PolarHBondContact O-ND2 3.39Å; H531-N534 PolarHBondContact O-N 3.17Å; N534-K536 PolarHBondContact O-N 2.88Å; N534-K537 PolarHBondContact O-N 3.35Å; N534-K537 PolarHBondContact OD1-NZ 3.33Å; N534-M538 WeakPolarHBondContact O-CB 3.22Å; N534-M538 PolarHBondContact O-N 2.99Å
535	K	65.6	Low	58.8	Low	109 Å²	109	93.7 Å²	93.7	47%	0.474	47%	0.469	S	S	.	.	H	α-helix	trans	-60.6	-41.3	169.1	-175.3	174	179.8	176.7	0	111.9	H531 M538 N539	H531-K535 VanDerWaalsContact O-CB 3.26Å; H531-K535 WeakPolarHBondContact O-CB 3.44Å; H531-K535 PolarHBondContact O-N 3.12Å; K535-M538 PolarHBondContact O-N 3.11Å; K535-N539 WeakPolarHBondContact O-CB 3.23Å; K535-N539 VanDerWaalsContact O-CG 3.32Å; K535-N539 PolarHBondContact O-N 3.29Å; K535-N539 PolarHBondContact O-OD1 3.32Å
536	K	69	Low	57.6	Low	147 Å²	147	95.6 Å²	95.6	64%	0.639	48%	0.479	S	S	*	.	H	α-helix	trans	-65.4	-39.5	173.1	-75.6	164.8	-170	171.2	0	112.4	D532 E533 N534 K540	D532-K536 WeakPolarHBondContact O-CB 3.5Å; D532-K536 VanDerWaalsContact O-CD 3.31Å; D532-K536 WeakPolarHBondContact O-CD 3.15Å; D532-K536 WeakPolarHBondContact O-CG 3.18Å; D532-K536 PolarHBondContact O-N 3.07Å; E533-K536 PolarHBondContact O-N 3.36Å; N534-K536 PolarHBondContact O-N 2.88Å; K536-K540 VanDerWaalsContact O-CB 3.23Å; K536-K540 WeakPolarHBondContact O-CB 3.17Å; K536-K540 PolarHBondContact O-N 2.93Å
537	K	66.8	Low	56.1	Low	123 Å²	123	102.1 Å²	102.1	54%	0.535	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-46.5	174.4	-69.5	165.6	-158.7	159.8	0	111.3	E533 N534 K540 L541	E533-K537 VanDerWaalsContact O-CG 3.3Å; E533-K537 WeakPolarHBondContact O-CG 3.32Å; E533-K537 PolarHBondContact O-N 3.3Å; N534-K537 PolarHBondContact O-N 3.35Å; N534-K537 PolarHBondContact OD1-NZ 3.33Å; K537-K540 PolarHBondContact O-N 3.4Å; K537-L541 WeakPolarHBondContact O-CB 3.43Å; K537-L541 PolarHBondContact O-N 3.07Å
538	M	56.6	Low	54.8	Low	112 Å²	112	108.2 Å²	108.2	55%	0.552	54%	0.542	S	S	*	.	H	α-helix	trans	-62.3	-46.8	177.4	-173.6	177.4	70.6	0	0	111.6	N534 K535 K540 L541 L542	N534-M538 WeakPolarHBondContact O-CB 3.22Å; N534-M538 PolarHBondContact O-N 2.99Å; K535-M538 PolarHBondContact O-N 3.11Å; M538-K540 VanDerWaalsContact C-N 3.31Å; M538-K540 PolarHBondContact O-N 3.41Å; M538-L541 PolarHBondContact O-N 2.75Å; M538-L542 HydrophobicContact CG-CD1 4.39Å; M538-L542 WeakPolarHBondContact O-CG 3.39Å; M538-L542 PolarHBondContact O-N 3.01Å
539	N	56.3	Low	53.4	Low	82 Å²	82	112 Å²	112	44%	0.439	57%	0.568	S	S	.	*	H	α-helix	trans	-62.7	-36.6	173.8	-75.2	20.5	0	0	0	112.2	K535 L542 M543	K535-N539 WeakPolarHBondContact O-CB 3.23Å; K535-N539 VanDerWaalsContact O-CG 3.32Å; K535-N539 PolarHBondContact O-N 3.29Å; K535-N539 PolarHBondContact O-OD1 3.32Å; N539-L542 PolarHBondContact O-N 2.91Å; N539-M543 WeakPolarHBondContact O-CB 3.5Å; N539-M543 WeakPolarHBondContact O-CG 3.19Å; N539-M543 PolarHBondContact O-N 3.02Å; N539-M543 VanDerWaalsContact O-N 3.09Å
540	K	59.5	Low	52	Low	141 Å²	141	113.9 Å²	113.9	61%	0.613	58%	0.581	S	S	*	*	H	α-helix	trans	-68.8	-35.3	175.6	-171.6	175.3	-178.8	-178.3	0	111.9	K536 K537 M538 M543 L544	K536-K540 VanDerWaalsContact O-CB 3.23Å; K536-K540 WeakPolarHBondContact O-CB 3.17Å; K536-K540 PolarHBondContact O-N 2.93Å; K537-K540 PolarHBondContact O-N 3.4Å; M538-K540 VanDerWaalsContact C-N 3.31Å; M538-K540 PolarHBondContact O-N 3.41Å; K540-M543 CarbonylContact O-C 3.56Å; K540-M543 PolarHBondContact O-N 3.28Å; K540-M543 VanDerWaalsContact O-N 3.14Å; K540-L544 HydrophobicContact CG-CD1 4Å; K540-L544 HydrophobicContact CG-CG 4.46Å; K540-L544 WeakPolarHBondContact O-CB 3.06Å; K540-L544 VanDerWaalsContact O-CG 3.25Å; K540-L544 WeakPolarHBondContact O-CG 3.27Å; K540-L544 PolarHBondContact O-N 3.41Å
541	L	53.4	Low	50.3	Low	132 Å²	132	114.5 Å²	114.5	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-66.2	-40.2	174.4	-163.8	69.8	0	0	0	111.2	K537 M538 M543 L544	K537-L541 WeakPolarHBondContact O-CB 3.43Å; K537-L541 PolarHBondContact O-N 3.07Å; M538-L541 PolarHBondContact O-N 2.75Å; L541-M543 PolarHBondContact O-N 3.09Å; L541-L544 PolarHBondContact O-N 2.93Å
542	L	50.6	Low	48.7	Very low	118 Å²	118	117.6 Å²	117.6	62%	0.618	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-11.9	171	-72.3	163.4	0	0	0	114.2	M538 N539	M538-L542 HydrophobicContact CG-CD1 4.39Å; M538-L542 WeakPolarHBondContact O-CG 3.39Å; M538-L542 PolarHBondContact O-N 3.01Å; N539-L542 PolarHBondContact O-N 2.91Å
543	M	48.8	Very low	47.1	Very low	161 Å²	161	122.1 Å²	122.1	79%	0.793	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	11.6	177	-67.3	-89.5	164.6	0	0	112.1	N539 K540 L541	N539-M543 WeakPolarHBondContact O-CB 3.5Å; N539-M543 WeakPolarHBondContact O-CG 3.19Å; N539-M543 PolarHBondContact O-N 3.02Å; N539-M543 VanDerWaalsContact O-N 3.09Å; K540-M543 CarbonylContact O-C 3.56Å; K540-M543 PolarHBondContact O-N 3.28Å; K540-M543 VanDerWaalsContact O-N 3.14Å; L541-M543 PolarHBondContact O-N 3.09Å
544	L	45.6	Very low	45.1	Very low	118 Å²	118	126.4 Å²	126.4	62%	0.618	68%	0.679	S	S	*	*			trans	-119.8	4.3	177.2	-77	171.2	0	0	0	112.8	K540 L541	K540-L544 HydrophobicContact CG-CD1 4Å; K540-L544 HydrophobicContact CG-CG 4.46Å; K540-L544 WeakPolarHBondContact O-CB 3.06Å; K540-L544 VanDerWaalsContact O-CG 3.25Å; K540-L544 WeakPolarHBondContact O-CG 3.27Å; K540-L544 PolarHBondContact O-N 3.41Å; L541-L544 PolarHBondContact O-N 2.93Å
545	T	34.6	Very low	43.7	Very low	100 Å²	100	132.6 Å²	132.6	61%	0.613	71%	0.707	S	S	*	*	S	Bend	trans	-66.2	125.1	159.1	44.9	0	0	0	0	108.8	E547	T545-E547 PolarHBondContact O-N 2.97Å
546	P	35.2	Very low	41.7	Very low	118 Å²	118	138.4 Å²	138.4	77%	0.766	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-60.8	129.6	179.2	-23.4	33.9	0	0	0	111.7
547	E	34.3	Very low	40	Very low	196 Å²	196	135.7 Å²	135.7	92%	0.916	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-67.9	131.6	166.4	-66	-175.6	155	0	0	109.3	T545	T545-E547 PolarHBondContact O-N 2.97Å
548	V	30	Very low	38	Very low	129 Å²	129	137.1 Å²	137.1	78%	0.782	73%	0.732	S	S	*	*			trans	-116.6	138.4	168	178.9	0	0	0	0	106.4
549	P	32.8	Very low	36.4	Very low	120 Å²	120	138.1 Å²	138.1	78%	0.779	74%	0.738	S	S	*	*			trans	-68.7	161	-154.1	-24.6	36.5	0	0	0	116.6
550	D	34.1	Very low	34.8	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	75%	0.751	S	S	*	*			trans	-58	133.3	175.6	-176.8	18.8	0	0	0	113.5
551	A	27.7	Very low	33.1	Very low	97 Å²	97	141.1 Å²	141.1	80%	0.802	76%	0.76	S	S	*	*			trans	-170	97.5	159.2	0	0	0	0	0	110.1
552	S	27.8	Very low	31.7	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	76%	0.755	S	S	*	*			trans	-133.9	28.3	165.9	61.9	0	0	0	0	114.8	L554	S552-L554 PolarHBondContact O-N 3.49Å; S552-L554 VanDerWaalsContact O-N 3.09Å
553	D	30.6	Very low	30.4	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	77%	0.767	S	S	*	*			trans	-71.8	92.9	155.1	-91.2	-25.5	0	0	0	109.3
554	L	27.3	Very low	29.3	Very low	164 Å²	164	141.6 Å²	141.6	86%	0.859	76%	0.764	S	S	*	*			trans	-136.2	100.2	160.2	-83.3	-176.8	0	0	0	110.9	S552	S552-L554 PolarHBondContact O-N 3.49Å; S552-L554 VanDerWaalsContact O-N 3.09Å
555	E	31.5	Very low	28.3	Very low	193 Å²	193	147.8 Å²	147.8	90%	0.902	78%	0.78	S	S	*	*			trans	-63.3	143.3	152.9	-65.6	-165.8	118	0	0	110.4
556	R	22.8	Very low	27.9	Very low	230 Å²	230	147.4 Å²	147.4	87%	0.868	78%	0.781	S	S	*	*			trans	-41	145.6	160.1	159.5	-165.1	-59.7	-174.9	3.4	111.5
557	P	34.3	Very low	27.3	Very low	90 Å²	90	149.9 Å²	149.9	58%	0.584	78%	0.784	S	S	*	*			cis	-145.1	-169.8	28.1	26.4	0.4	0	0	0	117.6
558	Q	23.8	Very low	26.7	Very low	154 Å²	154	145.2 Å²	145.2	72%	0.72	77%	0.773	S	S	*	*			trans	75.2	150.5	160.5	-42.1	-55.4	-24.2	0	0	116.7
559	L	23	Very low	26.3	Very low	133 Å²	133	144 Å²	144	70%	0.696	77%	0.769	S	S	*	*			cis	-162	161	-16.4	-108.3	167.2	0	0	0	109.5
560	I	23.3	Very low	25.8	Very low	138 Å²	138	146.5 Å²	146.5	71%	0.708	77%	0.771	S	S	*	*			trans	50.8	100.3	153.8	-61.3	158.1	0	0	0	116.2
561	D	22.8	Very low	25.4	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	76%	0.761	S	S	*	*				78.9	139.2	70.8	-170.5	38.1	0	0	0	116.7
562	S	23.9	Very low	25.3	Very low	84 Å²	84	146.6 Å²	146.6	59%	0.587	76%	0.759	S	S	*	*			trans	89.5	120.2	158.7	83.2	0	0	0	0	122.1
563	R	24.4	Very low	25.2	Very low	229 Å²	229	147.5 Å²	147.5	86%	0.864	76%	0.755	S	S	*	*			trans	73	91.8	135.1	-66.3	171.6	-178.7	-167.2	0.5	122.3
564	S	26.3	Very low	24.9	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	75%	0.746	S	S	*	*				36	120.6	115	64.8	0	0	0	0	121.5
565	R	24.7	Very low	24.9	Very low	249 Å²	249	145.5 Å²	145.5	94%	0.94	74%	0.74	S	S	*	*				-164.6	169.3	118.8	-116.2	-180	179.2	-171.9	-0.9	115.1
566	S	24.9	Very low	24.5	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	73%	0.732	S	S	*	*			trans	-97.1	174.8	-169.7	49.5	0	0	0	0	114.8
567	M	22.9	Very low	24.7	Very low	171 Å²	171	135.2 Å²	135.2	84%	0.842	73%	0.725	S	S	*	*			trans	82.2	150.8	163.7	-50.7	-154.4	79	0	0	115.2
568	S	22.4	Very low	24.4	Very low	98 Å²	98	137.4 Å²	137.4	69%	0.685	74%	0.736	S	S	*	*			cis	-170.9	153.3	-8.2	37	0	0	0	0	112.8
569	C	21.6	Very low	25	Very low	103 Å²	103	135.3 Å²	135.3	70%	0.696	74%	0.736	S	S	*	*			trans	49.1	161	140.5	-135.5	0	0	0	0	123.6
570	E	22.7	Very low	25.1	Very low	173 Å²	173	135.2 Å²	135.2	81%	0.808	74%	0.741	S	S	*	*			trans	67.1	147.7	161.6	-81.4	136.5	-116.3	0	0	117.8
571	S	25.3	Very low	25.3	Very low	86 Å²	86	134.6 Å²	134.6	60%	0.601	74%	0.744	S	S	*	*			cis	-167.6	146.4	-0.7	45.9	0	0	0	0	112.9
572	Q	25	Very low	26.2	Very low	164 Å²	164	132.8 Å²	132.8	77%	0.766	74%	0.74	S	S	*	*			trans	65.8	162.5	143.8	-67.2	-178.8	-78.6	0	0	119.6
573	D	25.3	Very low	26.2	Very low	126 Å²	126	137.2 Å²	137.2	67%	0.674	76%	0.756	S	S	*	*			cis	-172.4	168.1	-18.1	-96.1	-3.6	0	0	0	107.2
574	E	25.4	Very low	26.2	Very low	146 Å²	146	133 Å²	133	68%	0.682	75%	0.751	S	S	*	*			cis	-163.2	166.3	-13.8	-118.1	-75	56.4	0	0	109.7
575	L	25.8	Very low	26.3	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	75%	0.751	S	S	*	*			trans	63.9	152.4	166	-96.1	67	0	0	0	117.7
576	S	24.2	Very low	26.3	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	74%	0.744	S	S	*	*			cis	-161.5	-169.5	-2.9	58	0	0	0	0	107.9
577	S	26.1	Very low	26.3	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	75%	0.754	S	S	*	*			cis	-160.5	178	3.1	-153.7	0	0	0	0	111.1
578	V	27.8	Very low	26.5	Very low	135 Å²	135	130 Å²	130	82%	0.818	75%	0.752	S	S	*	*			trans	-161.2	179.5	-177.7	-100.3	0	0	0	0	109.8
579	P	37.8	Very low	26.6	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	75%	0.749	S	S	*	*			cis	-137.6	-159	6.4	29.8	-3.3	0	0	0	116.4
580	V	24	Very low	26.7	Very low	131 Å²	131	135 Å²	135	79%	0.794	76%	0.758	S	S	*	*			trans	98.8	142.1	152	-152	0	0	0	0	120.4
581	T	28.2	Very low	26.8	Very low	125 Å²	125	132 Å²	132	77%	0.767	75%	0.752	S	S	*	*			trans	-123.5	-152.1	-179.4	57.8	0	0	0	0	109.5
582	P	40.7	Very low	26.8	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	77%	0.767	S	S	*	*			cis	-121.4	-175.1	-36.4	40.7	-26.7	0	0	0	112.2
583	L	24.8	Very low	26.6	Very low	177 Å²	177	131.3 Å²	131.3	93%	0.927	76%	0.761	S	S	*	*			trans	-168.9	179.4	140.6	-110.2	167.9	0	0	0	112.4
584	D	25.3	Very low	26.5	Very low	140 Å²	140	136 Å²	136	75%	0.749	78%	0.775	S	S	*	*			trans	-140	-175.1	-145.4	-156.9	-1.9	0	0	0	114.7
585	N	28	Very low	26.5	Very low	139 Å²	139	132.5 Å²	132.5	74%	0.743	78%	0.778	S	S	*	*			trans	100	132.5	160	-66.2	2.8	0	0	0	119.9
586	G	25	Very low	26.4	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	79%	0.785	S	S	*	*			trans	169.8	69.9	177.1	0	0	0	0	0	112.6
587	E	25	Very low	26.4	Very low	179 Å²	179	136.1 Å²	136.1	84%	0.836	79%	0.789	S	S	*	*			trans	-71.8	178.3	177.5	-57.5	176.4	121.7	0	0	110.7
588	I	26.9	Very low	26.4	Very low	158 Å²	158	137.1 Å²	137.1	81%	0.81	79%	0.791	S	S	*	*			cis	-155.3	132.7	49.1	-63.3	173.4	0	0	0	111.9
589	D	23.8	Very low	26.3	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	79%	0.792	S	S	*	*			trans	17.8	138.8	141.7	-155.9	31	0	0	0	124	T591	D589-T591 WeakPolarHBondContact OD1-CG2 3.23Å
590	E	24.2	Very low	25.7	Very low	190 Å²	190	144 Å²	144	89%	0.888	80%	0.8	S	S	*	*				-159	156.2	109.3	-116.1	-172.9	167.8	0	0	111.9
591	T	23.7	Very low	25.7	Very low	110 Å²	110	141.3 Å²	141.3	68%	0.675	80%	0.799	S	S	*	*			trans	-113.4	-168.7	-160.7	49.2	0	0	0	0	115.8	D589	D589-T591 WeakPolarHBondContact OD1-CG2 3.23Å
592	L	25.6	Very low	26	Very low	174 Å²	174	141 Å²	141	91%	0.911	80%	0.802	S	S	*	*			trans	96.5	131.1	179.3	-54.4	170.8	0	0	0	115.2
593	G	21.8	Very low	25.3	Very low	62 Å²	62	139.2 Å²	139.2	64%	0.639	80%	0.804	S	S	*	*			cis	168.2	168.7	-6	0	0	0	0	0	112.9
594	F	23.4	Very low	25.5	Very low	224 Å²	224	140.2 Å²	140.2	98%	0.982	80%	0.801	S	S	*	*			trans	79.7	139.9	175.5	-63.8	-81.9	0	0	0	120.4
595	G	24.7	Very low	25.5	Very low	72 Å²	72	142.4 Å²	142.4	74%	0.742	80%	0.804	S	S	*	*			trans	132.1	35.4	135.3	0	0	0	0	0	121.5	V597	G595-V597 PolarHBondContact O-N 3.41Å
596	E	22.5	Very low	25.6	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	80%	0.804	S	S	*	*			trans	-76.5	121.1	169	-172.8	179.2	-175.8	0	0	111.9
597	V	26.3	Very low	25.9	Very low	136 Å²	136	142.7 Å²	142.7	82%	0.824	80%	0.799	S	S	*	*			trans	-140	151.2	167.9	-177.3	0	0	0	0	109.6	G595	G595-V597 PolarHBondContact O-N 3.41Å
598	T	24.1	Very low	26.4	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	79%	0.792	S	S	*	*			trans	-95.5	167.1	-155.8	49.9	0	0	0	0	117
599	R	26.6	Very low	26.9	Very low	224 Å²	224	140.4 Å²	140.4	85%	0.845	80%	0.796	S	S	*	*			trans	-31.1	141	177.1	-69.2	173.4	164.6	166.4	-4.9	118.9
600	N	24.9	Very low	28.1	Very low	166 Å²	166	139.4 Å²	139.4	89%	0.888	79%	0.789	S	S	*	*				134.2	132	127.6	-75.8	-34.8	0	0	0	114.1
601	G	25	Very low	29.4	Very low	76 Å²	76	135 Å²	135	78%	0.784	77%	0.77	S	S	*	*			trans	171.3	65.1	179.3	0	0	0	0	0	113.7	G603	G601-G603 VanDerWaalsContact C-N 3.29Å; G601-G603 PolarHBondContact O-N 2.9Å
602	S	33.6	Very low	30.7	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	76%	0.761	S	S	*	*			trans	-78.2	67.2	-173.4	49.4	0	0	0	0	114.1	K604	S602-K604 PolarHBondContact O-N 3.48Å; S602-K604 VanDerWaalsContact O-N 3.1Å
603	G	26.8	Very low	32.2	Very low	73 Å²	73	128 Å²	128	75%	0.753	73%	0.725	S	S	*	*			trans	-61.7	105.4	175.3	0	0	0	0	0	113.1	G601 K605	G601-G603 VanDerWaalsContact C-N 3.29Å; G601-G603 PolarHBondContact O-N 2.9Å; G603-K605 PolarHBondContact O-N 2.92Å
604	K	27.9	Very low	34.2	Very low	198 Å²	198	128.2 Å²	128.2	86%	0.861	71%	0.714	S	S	*	*			trans	-72.8	111.2	178.6	-68.7	167.6	-176.9	164	0	110.7	S602	S602-K604 PolarHBondContact O-N 3.48Å; S602-K604 VanDerWaalsContact O-N 3.1Å
605	K	26.6	Very low	36.9	Very low	186 Å²	186	121.3 Å²	121.3	81%	0.809	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-58.1	132.6	167	-67.7	-177.1	178.6	179.8	0	109.8	G603	G603-K605 PolarHBondContact O-N 2.92Å
606	P	28.5	Very low	39.3	Very low	115 Å²	115	119.9 Å²	119.9	75%	0.747	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-66.6	149.7	170.9	28.8	-33.8	0	0	0	110.5
607	P	32.5	Very low	41.9	Very low	108 Å²	108	113.3 Å²	113.3	70%	0.701	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-69.7	142.9	176.8	30.3	-34.3	0	0	0	110.8	E609	P607-E609 PolarHBondContact O-N 2.97Å
608	S	34	Very low	44.3	Very low	99 Å²	99	110.7 Å²	110.7	69%	0.692	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-61.9	123.5	176.7	45.1	0	0	0	0	111.8	M610	S608-M610 WeakPolarHBondContact O-CG 3.37Å; S608-M610 PolarHBondContact O-N 3.26Å
609	E	37.5	Very low	46.8	Very low	189 Å²	189	110.3 Å²	110.3	88%	0.883	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.4	170.8	-66.5	-163.7	128.9	0	0	109.8	P607 I611	P607-E609 PolarHBondContact O-N 2.97Å; E609-I611 PolarHBondContact O-N 3.34Å
610	M	50.3	Low	49.4	Very low	97 Å²	97	101.2 Å²	101.2	48%	0.478	57%	0.573	S	S	.	*			trans	-92.1	110.5	-168	-60.4	179.4	134	0	0	110.7	S608 S660 K661	S608-M610 WeakPolarHBondContact O-CG 3.37Å; S608-M610 PolarHBondContact O-N 3.26Å; M610-S660 WeakPolarHBondContact SD-CB 3.42Å; M610-S660 PolarHBondContact SD-OG 2.89Å; M610-K661 HydrophobicContact CB-CB 3.53Å; M610-K661 WeakPolarHBondContact O-CB 3.47Å
611	I	51.2	Low	52.5	Low	98 Å²	98	93.3 Å²	93.3	50%	0.503	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-65.7	134.2	-170.5	-55.4	177.6	0	0	0	111.8	E609 K661	E609-I611 PolarHBondContact O-N 3.34Å; I611-K661 WeakPolarHBondContact O-CD 3.45Å
612	K	50.8	Low	55.5	Low	111 Å²	111	91.9 Å²	91.9	48%	0.483	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-78.3	145.3	174.9	-65.9	172.3	-176	166.6	0	110.7	Y662	K612-Y662 HydrophobicContact CD-CE1 4.38Å
613	P	58.1	Low	58.3	Low	24 Å²	24	86.7 Å²	86.7	16%	0.156	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-71.7	147.5	-179	32.7	-37.9	0	0	0	112	R643 D644	P613-R643 VanDerWaalsContact CD-O 3.29Å; P613-R643 WeakPolarHBondContact CD-O 3.3Å; P613-R643 WeakPolarHBondContact CG-O 3.38Å; P613-D644 WeakPolarHBondContact CB-O 3.42Å; P613-D644 WeakPolarHBondContact CG-O 3.39Å
614	V	63.8	Low	61.5	Low	67 Å²	67	83.2 Å²	83.2	41%	0.406	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-66.2	130.6	164.1	-174.1	0	0	0	0	108.4	G646	V614-G646 WeakPolarHBondContact O-CA 3.46Å
615	W	79.7	Confident	64.6	Low	79 Å²	79	73.8 Å²	73.8	30%	0.299	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-86.3	140.5	178.2	-76.5	16.3	0	0	0	110.7	H641 R643	W615-H641 HydrophobicContact CD2-CB 3.35Å; W615-H641 AromaticContact CD2-CD2 3.92Å; W615-H641 AromaticContact CD2-CG 3.5Å; W615-H641 VanDerWaalsContact CD2-CG 3.5Å; W615-H641 HydrophobicContact CE3-CB 3.5Å; W615-H641 AromaticContact CE3-CD2 3.81Å; W615-H641 AromaticContact CE3-CE1 3.85Å; W615-H641 AromaticContact CE3-CG 3.24Å; W615-H641 AromaticContact CE3-ND1 3.31Å; W615-H641 VanDerWaalsContact CE3-ND1 3.31Å; W615-H641 HydrophobicContact CG-CB 3.82Å; W615-H641 AromaticContact CG-CD2 3.88Å; W615-H641 AromaticContact CG-CG 3.91Å; W615-H641 HydrophobicContact CH2-CB 4.21Å; W615-H641 HydrophobicContact CZ2-CB 4.07Å; W615-H641 HydrophobicContact CZ3-CB 3.93Å; W615-H641 AromaticContact CZ3-CG 3.86Å; W615-H641 AromaticContact CZ3-ND1 3.6Å; W615-R643 HydrophobicContact CZ2-CG 4.18Å
616	L	73.8	Confident	67.8	Low	42 Å²	42	64.9 Å²	64.9	22%	0.22	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-70.1	130.6	174.3	-70.3	-179.3	0	0	0	110.4	I620 L625 H641 G646 W647	L616-I620 HydrophobicContact CB-CG2 4.16Å; L616-L625 HydrophobicContact CD1-CD1 3.46Å; L616-L625 VanDerWaalsContact CD1-CD1 3.46Å; L616-H641 PolarHBondContact O-CD2 3.49Å; L616-H641 PolarHBondContact O-NE2 3.36Å; L616-G646 PolarHBondContact N-O 2.99Å; L616-W647 HydrophobicContact CD1-CD2 4.29Å; L616-W647 HydrophobicContact CD1-CG 4.29Å
617	P	77.1	Confident	70.8	Confident	50 Å²	50	64.7 Å²	64.7	33%	0.325	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-56.5	140.8	-180	-28.5	36.1	0	0	0	113.2	N619 I620	P617-N619 VanDerWaalsContact CB-OD1 3.31Å; P617-N619 WeakPolarHBondContact CB-OD1 3.4Å; P617-N619 PolarHBondContact O-N 3.35Å; P617-N619 VanDerWaalsContact O-N 3.1Å; P617-I620 HydrophobicContact CB-CB 4.48Å; P617-I620 WeakPolarHBondContact O-CB 3.45Å; P617-I620 WeakPolarHBondContact O-CG2 3.4Å; P617-I620 PolarHBondContact O-N 3.41Å
618	D	76.8	Confident	73.3	Confident	80 Å²	80	62.9 Å²	62.9	43%	0.428	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.3	-176.3	-98.2	21.8	0	0	0	113.3	S621 R639 H641	D618-S621 VanDerWaalsContact O-O 3.14Å; D618-R639 PolarHBondContact O-NE 3.38Å; D618-R639 PolarHBondContact O-NH2 3.44Å; D618-R639 VanDerWaalsContact O-NH2 3.09Å; D618-R639 WeakPolarHBondContact OD1-CD 3.5Å; D618-R639 VanDerWaalsContact OD2-CD 3.23Å; D618-R639 WeakPolarHBondContact OD2-CD 3.34Å; D618-H641 IonicContact OD1-CE1 2.91Å; D618-H641 PolarHBondContact OD1-CE1 3.39Å; D618-H641 IonicContact OD1-NE2 3.22Å; D618-H641 PolarHBondContact OD1-NE2 3.07Å
619	N	78.1	Confident	76	Confident	117 Å²	117	58.5 Å²	58.5	63%	0.626	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-7.9	178.4	63.8	-2.4	0	0	0	114.3	P617 S621 A772	P617-N619 VanDerWaalsContact CB-OD1 3.31Å; P617-N619 WeakPolarHBondContact CB-OD1 3.4Å; P617-N619 PolarHBondContact O-N 3.35Å; P617-N619 VanDerWaalsContact O-N 3.1Å; N619-S621 VanDerWaalsContact C-N 3.25Å; N619-S621 PolarHBondContact O-N 3.27Å; N619-A772 VanDerWaalsContact O-CB 3.24Å; N619-A772 WeakPolarHBondContact O-CB 3.22Å
620	I	81.4	Confident	78.4	Confident	33 Å²	33	54.4 Å²	54.4	17%	0.169	30%	0.304	C	S	.	.	S	Bend	trans	-72.3	-21.8	-177.1	-146	178	0	0	0	112.3	L616 P617 E773 L774	L616-I620 HydrophobicContact CB-CG2 4.16Å; P617-I620 HydrophobicContact CB-CB 4.48Å; P617-I620 WeakPolarHBondContact O-CB 3.45Å; P617-I620 WeakPolarHBondContact O-CG2 3.4Å; P617-I620 PolarHBondContact O-N 3.41Å; I620-E773 HydrophobicContact CG1-CB 4.38Å; I620-E773 PolarHBondContact O-N 2.82Å; I620-L774 HydrophobicContact CD1-CD1 4.04Å; I620-L774 HydrophobicContact CD1-CG 4.36Å; I620-L774 HydrophobicContact CG1-CD1 4.21Å; I620-L774 HydrophobicContact CG1-CG 4.14Å; I620-L774 HydrophobicContact CG2-CD1 4.01Å; I620-L774 PolarHBondContact O-N 3.12Å
621	S	88.8	Confident	80.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.			trans	-148.7	151.3	168.1	-171.3	0	0	0	0	113	D618 N619 E623 R639 D775	D618-S621 VanDerWaalsContact O-O 3.14Å; N619-S621 VanDerWaalsContact C-N 3.25Å; N619-S621 PolarHBondContact O-N 3.27Å; S621-E623 WeakPolarHBondContact OG-CG 3.49Å; S621-E623 PolarHBondContact OG-N 2.94Å; S621-E623 VanDerWaalsContact OG-N 3.1Å; S621-E623 PolarHBondContact OG-O 3.39Å; S621-R639 PolarHBondContact O-NH2 3.32Å; S621-D775 WeakPolarHBondContact CA-OD1 3.48Å; S621-D775 WeakPolarHBondContact CB-OD1 3.49Å; S621-D775 PolarHBondContact OG-OD1 2.93Å
622	N	89.1	Confident	82.3	Confident	46 Å²	46	49.1 Å²	49.1	25%	0.246	28%	0.277	C	S	.	.	S	Bend	trans	-96.6	7.7	170	-60.8	-73.9	0	0	0	112.9	E632 F633 K771 A772 D775	N622-E632 CarbonylContact O-C 3.57Å; N622-E632 WeakPolarHBondContact O-CA 3.47Å; N622-F633 PolarHBondContact O-N 3.1Å; N622-K771 VanDerWaalsContact ND2-CB 3.3Å; N622-K771 WeakPolarHBondContact ND2-CB 3.01Å; N622-A772 VanDerWaalsContact ND2-CB 3.26Å; N622-A772 WeakPolarHBondContact ND2-CB 3.21Å; N622-A772 PolarHBondContact ND2-N 2.95Å; N622-D775 PolarHBondContact N-OD1 2.76Å; N622-D775 PolarHBondContact ND2-OD2 3.46Å
623	E	92.4	Very high	84.1	Confident	8 Å²	8	44.6 Å²	44.6	4%	0.037	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-147.8	163.5	-178	53.5	174.4	-140.6	0	0	113	S621 L625 T631 F633 R730 S776	S621-E623 WeakPolarHBondContact OG-CG 3.49Å; S621-E623 PolarHBondContact OG-N 2.94Å; S621-E623 VanDerWaalsContact OG-N 3.1Å; S621-E623 PolarHBondContact OG-O 3.39Å; E623-L625 PolarHBondContact O-N 2.66Å; E623-T631 WeakPolarHBondContact CA-O 3.48Å; E623-F633 WeakPolarHBondContact O-CE2 3.05Å; E623-R730 IonicContact OE1-CZ 3.43Å; E623-R730 IonicContact OE1-NH1 3.61Å; E623-R730 PolarHBondContact OE1-NH1 2.71Å; E623-R730 IonicContact OE1-NH2 2.78Å; E623-R730 PolarHBondContact OE1-NH2 2.79Å; E623-S776 VanDerWaalsContact OE1-CB 3.29Å; E623-S776 WeakPolarHBondContact OE1-CB 3.4Å; E623-S776 PolarHBondContact OE1-N 3.05Å; E623-S776 PolarHBondContact OE1-OG 3.26Å
624	C	93.5	Very high	85.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.271	C	S	.	.			trans	-63	121.8	-178.9	-172.6	0	0	0	0	112.2	M626 C629 T631 F633 C650 R730	C624-M626 PolarHBondContact O-N 3.38Å; C624-C629 HydrophobicContact CB-CB 4.17Å; C624-C629 VanDerWaalsContact SG-SG 3.67Å; C624-T631 PolarHBondContact N-O 3.13Å; C624-F633 HydrophobicContact CB-CZ 4.41Å; C624-C650 HydrophobicContact CB-CB 4.01Å; C624-C650 PolarHBondContact SG-N 3.07Å; C624-C650 VanDerWaalsContact SG-SG 3.63Å; C624-R730 PolarHBondContact O-NH2 3.47Å
625	L	93.3	Very high	86	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.289	C	S	.	.			trans	-78.3	18.5	-176.7	-62.5	178	0	0	0	114.7	L616 E623 W647 L648 R730 L774	L616-L625 HydrophobicContact CD1-CD1 3.46Å; L616-L625 VanDerWaalsContact CD1-CD1 3.46Å; E623-L625 PolarHBondContact O-N 2.66Å; L625-W647 HydrophobicContact CB-CE3 3.53Å; L625-W647 HydrophobicContact CB-CZ3 3.77Å; L625-W647 HydrophobicContact CD1-CE3 4.38Å; L625-W647 WeakPolarHBondContact O-CZ3 3.42Å; L625-L648 WeakPolarHBondContact CB-O 3.31Å; L625-L648 HydrophobicContact CD1-CB 3.83Å; L625-L648 HydrophobicContact CG-CB 4.29Å; L625-L648 PolarHBondContact N-O 2.86Å; L625-R730 WeakPolarHBondContact O-CB 3.18Å; L625-R730 PolarHBondContact O-N 2.84Å; L625-R730 VanDerWaalsContact O-N 3.15Å; L625-L774 HydrophobicContact CD1-CD1 4.02Å; L625-L774 HydrophobicContact CD2-CB 3.73Å; L625-L774 HydrophobicContact CD2-CD1 4.34Å
626	M	93.6	Very high	86	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-88.3	136.7	170.8	-58.1	-52.1	-67.6	0	0	109	C624 C629 I649 C653 C670 F727 R728	C624-M626 PolarHBondContact O-N 3.38Å; M626-C629 HydrophobicContact CB-CB 3.99Å; M626-C629 WeakPolarHBondContact O-CB 3.38Å; M626-C629 PolarHBondContact O-N 2.85Å; M626-C629 VanDerWaalsContact O-N 3.1Å; M626-I649 HydrophobicContact CG-CG2 3.86Å; M626-I649 HydrophobicContact SD-CG2 3.7Å; M626-C653 HydrophobicContact CG-CB 3.63Å; M626-C653 VanDerWaalsContact CG-SG 3.58Å; M626-C670 HydrophobicContact CE-CB 4.22Å; M626-C670 HydrophobicContact SD-CB 3.85Å; M626-F727 HydrophobicContact CB-CB 4.28Å; M626-F727 HydrophobicContact CB-CD2 4.29Å; M626-F727 HydrophobicContact CE-CB 4.21Å; M626-F727 WeakPolarHBondContact CE-O 3.44Å; M626-R728 WeakPolarHBondContact CA-O 3.37Å; M626-R728 VanDerWaalsContact CE-C 3.49Å; M626-R728 WeakPolarHBondContact CE-O 3.44Å
627	E	89.8	Confident	86.6	Confident	111 Å²	111	53.9 Å²	53.9	52%	0.519	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	143.5	170.4	-170	162.2	-129.9	0	0	110.6	C629 F727 R728	E627-C629 PolarHBondContact O-N 3.39Å; E627-C629 VanDerWaalsContact O-N 3.17Å; E627-F727 WeakPolarHBondContact O-CD2 3.32Å; E627-R728 PolarHBondContact N-O 3.37Å
628	G	85.5	Confident	86.9	Confident	70 Å²	70	60 Å²	60	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-5	-171.8	0	0	0	0	0	115.7
629	C	91.7	Very high	87.5	Confident	6 Å²	6	59.4 Å²	59.4	4%	0.041	32%	0.315	C	S	.	.			trans	-105	116.4	-179.9	-165	0	0	0	0	112.8	C624 M626 E627 C653 F727	C624-C629 HydrophobicContact CB-CB 4.17Å; C624-C629 VanDerWaalsContact SG-SG 3.67Å; M626-C629 HydrophobicContact CB-CB 3.99Å; M626-C629 WeakPolarHBondContact O-CB 3.38Å; M626-C629 PolarHBondContact O-N 2.85Å; M626-C629 VanDerWaalsContact O-N 3.1Å; E627-C629 PolarHBondContact O-N 3.39Å; E627-C629 VanDerWaalsContact O-N 3.17Å; C629-C653 VanDerWaalsContact SG-SG 3.61Å; C629-F727 HydrophobicContact CB-CD2 4.12Å; C629-F727 HydrophobicContact CB-CE2 4.07Å
630	S	86.9	Confident	88.3	Confident	104 Å²	104	56.1 Å²	56.1	73%	0.727	30%	0.296	S	S	*	.			trans	-102.4	21	179.6	54.1	0	0	0	0	113.9	E632	S630-E632 PolarHBondContact O-N 3.36Å
631	T	91.4	Very high	88.8	Confident	22 Å²	22	55.5 Å²	55.5	14%	0.135	29%	0.292	C	S	.	.			trans	-73.3	99.8	-177.6	-59.9	0	0	0	0	111.1	E623 C624 N637 C650	E623-T631 WeakPolarHBondContact CA-O 3.48Å; C624-T631 PolarHBondContact N-O 3.13Å; T631-N637 HydrophobicContact CG2-CB 4.2Å; T631-C650 HydrophobicContact CG2-CB 3.65Å
632	E	91.5	Very high	89.1	Confident	62 Å²	62	55.5 Å²	55.5	29%	0.29	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-62.1	135.4	168.2	-67	-167.4	-138.6	0	0	110.5	N622 S630 N637 K771 K777	N622-E632 CarbonylContact O-C 3.57Å; N622-E632 WeakPolarHBondContact O-CA 3.47Å; S630-E632 PolarHBondContact O-N 3.36Å; E632-N637 VanDerWaalsContact O-CB 3.32Å; E632-N637 WeakPolarHBondContact O-CB 3.38Å; E632-N637 PolarHBondContact O-ND2 2.82Å; E632-N637 VanDerWaalsContact O-ND2 3.16Å; E632-K771 IonicContact OE2-NZ 2.88Å; E632-K771 PolarHBondContact OE2-NZ 2.84Å; E632-K777 IonicContact OE1-NZ 3.26Å; E632-K777 PolarHBondContact OE1-NZ 2.77Å
633	F	90.5	Very high	89.3	Confident	16 Å²	16	56 Å²	56	7%	0.07	29%	0.291	C	S	.	.			trans	-82.6	134.2	178.3	-66.1	-54.7	0	0	0	111.5	N622 E623 C624 N637 R639 L648 C650	N622-F633 PolarHBondContact O-N 3.1Å; E623-F633 WeakPolarHBondContact O-CE2 3.05Å; C624-F633 HydrophobicContact CB-CZ 4.41Å; F633-N637 VanDerWaalsContact CA-O 3.29Å; F633-N637 WeakPolarHBondContact CA-O 3.38Å; F633-N637 WeakPolarHBondContact CD1-O 3.38Å; F633-R639 HydrophobicContact CB-CG 4.03Å; F633-R639 HydrophobicContact CD1-CB 4.47Å; F633-R639 HydrophobicContact CD1-CG 3.72Å; F633-R639 HydrophobicContact CD2-CG 3.59Å; F633-R639 HydrophobicContact CE1-CB 4.46Å; F633-R639 HydrophobicContact CE1-CG 3.98Å; F633-R639 HydrophobicContact CE2-CG 3.87Å; F633-R639 HydrophobicContact CG-CG 3.52Å; F633-R639 HydrophobicContact CZ-CG 4.06Å; F633-L648 HydrophobicContact CD2-CD2 4.26Å; F633-L648 HydrophobicContact CE2-CD2 3.6Å; F633-L648 HydrophobicContact CE2-CG 3.64Å; F633-L648 HydrophobicContact CZ-CD2 4.35Å; F633-L648 HydrophobicContact CZ-CG 3.88Å; F633-C650 HydrophobicContact CE1-CB 4.06Å
634	N	84.9	Confident	89.2	Confident	82 Å²	82	56.6 Å²	56.6	44%	0.439	29%	0.294	S	S	.	.	S	Bend	trans	-157.2	-168.4	178.4	60	51.6	0	0	0	110.1	I636 N637	N634-I636 PolarHBondContact O-N 3.46Å; N634-I636 WeakPolarHBondContact OD1-CA 3.49Å; N634-I636 WeakPolarHBondContact OD1-CB 3.27Å; N634-I636 PolarHBondContact OD1-N 3.26Å; N634-N637 PolarHBondContact N-O 2.93Å; N634-N637 CarbonylContact O-C 3.6Å; N634-N637 PolarHBondContact O-N 3.3Å; N634-N637 VanDerWaalsContact O-O 3.05Å; N634-N637 PolarHBondContact OD1-N 2.98Å
635	I	76.9	Confident	89	Confident	152 Å²	152	58 Å²	58	78%	0.779	30%	0.304	S	S	*	.	S	Bend	trans	-58.3	-32.8	-177.7	-58.4	174.9	0	0	0	112.2
636	I	78.4	Confident	88.7	Confident	138 Å²	138	58 Å²	58	71%	0.708	30%	0.304	S	S	*	.	S	Bend	trans	-87.5	-50	178.6	-55.9	170.1	0	0	0	110.2	N634 R638	N634-I636 PolarHBondContact O-N 3.46Å; N634-I636 WeakPolarHBondContact OD1-CA 3.49Å; N634-I636 WeakPolarHBondContact OD1-CB 3.27Å; N634-I636 PolarHBondContact OD1-N 3.26Å; I636-R638 PolarHBondContact O-N 3.37Å; I636-R638 VanDerWaalsContact O-N 3.15Å
637	N	86	Confident	88.5	Confident	35 Å²	35	60.4 Å²	60.4	19%	0.187	31%	0.313	C	S	.	.	S	Bend	trans	-86.5	75.7	176.3	-72.3	-20.3	0	0	0	110.2	T631 E632 F633 N634	T631-N637 HydrophobicContact CG2-CB 4.2Å; E632-N637 VanDerWaalsContact O-CB 3.32Å; E632-N637 WeakPolarHBondContact O-CB 3.38Å; E632-N637 PolarHBondContact O-ND2 2.82Å; E632-N637 VanDerWaalsContact O-ND2 3.16Å; F633-N637 VanDerWaalsContact CA-O 3.29Å; F633-N637 WeakPolarHBondContact CA-O 3.38Å; F633-N637 WeakPolarHBondContact CD1-O 3.38Å; N634-N637 PolarHBondContact N-O 2.93Å; N634-N637 CarbonylContact O-C 3.6Å; N634-N637 PolarHBondContact O-N 3.3Å; N634-N637 VanDerWaalsContact O-O 3.05Å; N634-N637 PolarHBondContact OD1-N 2.98Å
638	R	84.4	Confident	88.7	Confident	179 Å²	179	55.1 Å²	55.1	68%	0.675	29%	0.289	S	S	*	.			trans	-66.9	147.2	179.4	-61.9	-173	-178.3	-170.2	1.1	112.1	I636	I636-R638 PolarHBondContact O-N 3.37Å; I636-R638 VanDerWaalsContact O-N 3.15Å
639	R	89.6	Confident	89.2	Confident	67 Å²	67	51.9 Å²	51.9	25%	0.253	25%	0.254	S	S	.	.			trans	-67.7	145	173.1	-73.6	172.5	173.5	87	-4.2	111.5	D618 S621 F633 L648	D618-R639 PolarHBondContact O-NE 3.38Å; D618-R639 PolarHBondContact O-NH2 3.44Å; D618-R639 VanDerWaalsContact O-NH2 3.09Å; D618-R639 WeakPolarHBondContact OD1-CD 3.5Å; D618-R639 VanDerWaalsContact OD2-CD 3.23Å; D618-R639 WeakPolarHBondContact OD2-CD 3.34Å; S621-R639 PolarHBondContact O-NH2 3.32Å; F633-R639 HydrophobicContact CB-CG 4.03Å; F633-R639 HydrophobicContact CD1-CB 4.47Å; F633-R639 HydrophobicContact CD1-CG 3.72Å; F633-R639 HydrophobicContact CD2-CG 3.59Å; F633-R639 HydrophobicContact CE1-CB 4.46Å; F633-R639 HydrophobicContact CE1-CG 3.98Å; F633-R639 HydrophobicContact CE2-CG 3.87Å; F633-R639 HydrophobicContact CG-CG 3.52Å; F633-R639 HydrophobicContact CZ-CG 4.06Å; R639-L648 HydrophobicContact CB-CD1 3.94Å; R639-L648 HydrophobicContact CG-CD1 4.08Å; R639-L648 HydrophobicContact CG-CD2 4.33Å; R639-L648 HydrophobicContact CG-CG 4.32Å
640	H	93.7	Very high	89.4	Confident	47 Å²	47	51.6 Å²	51.6	22%	0.218	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	139.7	171.5	-54.2	-35.3	0	0	0	109.6	I649 K654	H640-I649 HydrophobicContact CB-CG1 4.17Å; H640-I649 WeakPolarHBondContact CB-O 3.35Å; H640-I649 PolarHBondContact N-O 3.41Å; H640-I649 WeakPolarHBondContact O-CG1 3.48Å; H640-I649 PolarHBondContact O-N 3.4Å; H640-I649 VanDerWaalsContact O-O 3.13Å; H640-K654 VanDerWaalsContact CD2-CD 3.49Å; H640-K654 WeakPolarHBondContact CD2-CD 3.5Å
641	H	92.2	Very high	89.8	Confident	21 Å²	21	51.3 Å²	51.3	10%	0.097	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.3	172.7	-54.9	77.4	0	0	0	112.5	W615 L616 D618 R643 W647 L648	W615-H641 HydrophobicContact CD2-CB 3.35Å; W615-H641 AromaticContact CD2-CD2 3.92Å; W615-H641 AromaticContact CD2-CG 3.5Å; W615-H641 VanDerWaalsContact CD2-CG 3.5Å; W615-H641 HydrophobicContact CE3-CB 3.5Å; W615-H641 AromaticContact CE3-CD2 3.81Å; W615-H641 AromaticContact CE3-CE1 3.85Å; W615-H641 AromaticContact CE3-CG 3.24Å; W615-H641 AromaticContact CE3-ND1 3.31Å; W615-H641 VanDerWaalsContact CE3-ND1 3.31Å; W615-H641 HydrophobicContact CG-CB 3.82Å; W615-H641 AromaticContact CG-CD2 3.88Å; W615-H641 AromaticContact CG-CG 3.91Å; W615-H641 HydrophobicContact CH2-CB 4.21Å; W615-H641 HydrophobicContact CZ2-CB 4.07Å; W615-H641 HydrophobicContact CZ3-CB 3.93Å; W615-H641 AromaticContact CZ3-CG 3.86Å; W615-H641 AromaticContact CZ3-ND1 3.6Å; L616-H641 PolarHBondContact O-CD2 3.49Å; L616-H641 PolarHBondContact O-NE2 3.36Å; D618-H641 IonicContact OD1-CE1 2.91Å; D618-H641 PolarHBondContact OD1-CE1 3.39Å; D618-H641 IonicContact OD1-NE2 3.22Å; D618-H641 PolarHBondContact OD1-NE2 3.07Å; H641-R643 WeakPolarHBondContact O-CD 3.24Å; H641-R643 PolarHBondContact O-N 2.78Å; H641-R643 PolarHBondContact O-NH1 2.67Å; H641-W647 CarbonylContact C-O 3.29Å; H641-W647 WeakPolarHBondContact CA-O 3.46Å; H641-L648 WeakPolarHBondContact NE2-CD1 3.14Å
642	C	95.1	Very high	90	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.247	C	C	.	.			trans	-67.7	123.3	166.4	179.7	0	0	0	0	110.4	D644 C645 G646 W647 V669 C670	C642-D644 PolarHBondContact O-N 2.76Å; C642-D644 PolarHBondContact SG-N 2.94Å; C642-D644 VanDerWaalsContact SG-N 3.36Å; C642-C645 WeakPolarHBondContact CB-SG 3.49Å; C642-C645 PolarHBondContact SG-N 3.48Å; C642-C645 VanDerWaalsContact SG-N 3.39Å; C642-C645 PolarHBondContact SG-SG 2.71Å; C642-G646 WeakPolarHBondContact O-CA 3.18Å; C642-G646 PolarHBondContact O-N 2.77Å; C642-W647 PolarHBondContact N-O 2.91Å; C642-V669 VanDerWaalsContact SG-CA 3.58Å; C642-C670 HydrophobicContact CB-CB 4.04Å; C642-C670 PolarHBondContact SG-N 3.31Å
643	R	93.3	Very high	90.3	Very high	55 Å²	55	50.8 Å²	50.8	21%	0.208	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.2	176.4	-79.8	55.1	169.1	162.9	9	113	P613 W615 H641 L659 K661 Y662 Q667 N668	P613-R643 VanDerWaalsContact CD-O 3.29Å; P613-R643 WeakPolarHBondContact CD-O 3.3Å; P613-R643 WeakPolarHBondContact CG-O 3.38Å; W615-R643 HydrophobicContact CZ2-CG 4.18Å; H641-R643 WeakPolarHBondContact O-CD 3.24Å; H641-R643 PolarHBondContact O-N 2.78Å; H641-R643 PolarHBondContact O-NH1 2.67Å; R643-L659 HydrophobicContact CB-CD1 3.8Å; R643-K661 WeakPolarHBondContact O-CE 3.45Å; R643-Y662 HydrophobicContact CB-CE2 4.06Å; R643-Q667 HydrophobicContact CB-CB 3.99Å; R643-Q667 HydrophobicContact CG-CB 4.32Å; R643-N668 WeakPolarHBondContact CB-O 3.46Å; R643-N668 WeakPolarHBondContact CD-O 3.47Å; R643-N668 PolarHBondContact N-O 3.32Å
644	D	91.3	Very high	90.6	Very high	21 Å²	21	53.3 Å²	53.3	11%	0.112	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-46.9	176	-169.7	47.2	0	0	0	114	P613 C642 L659 K661 V669 C673 R676 H677	P613-D644 WeakPolarHBondContact CB-O 3.42Å; P613-D644 WeakPolarHBondContact CG-O 3.39Å; C642-D644 PolarHBondContact O-N 2.76Å; C642-D644 PolarHBondContact SG-N 2.94Å; C642-D644 VanDerWaalsContact SG-N 3.36Å; D644-L659 HydrophobicContact CB-CD1 4Å; D644-L659 HydrophobicContact CB-CD2 3.96Å; D644-K661 PolarHBondContact O-NZ 3.1Å; D644-K661 WeakPolarHBondContact OD1-CE 3.38Å; D644-K661 IonicContact OD1-NZ 2.67Å; D644-K661 PolarHBondContact OD1-NZ 3.47Å; D644-V669 HydrophobicContact CB-CG1 4.02Å; D644-C673 HydrophobicContact CB-CB 3.94Å; D644-C673 PolarHBondContact OD2-SG 3.44Å; D644-R676 IonicContact OD2-NH1 2.91Å; D644-R676 PolarHBondContact OD2-NH1 2.91Å; D644-R676 VanDerWaalsContact OD2-NH1 3.08Å; D644-H677 IonicContact OD1-NE2 2.79Å; D644-H677 PolarHBondContact OD1-NE2 3.47Å; D644-H677 IonicContact OD2-CD2 2.72Å; D644-H677 IonicContact OD2-CE1 3.28Å; D644-H677 IonicContact OD2-NE2 3.5Å; D644-H677 PolarHBondContact OD2-NE2 3.48Å
645	C	87.9	Confident	91.2	Very high	31 Å²	31	49.4 Å²	49.4	21%	0.209	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-6.5	-178.3	67.5	0	0	0	0	116	C642 W647 C670 C673 H729	C642-C645 WeakPolarHBondContact CB-SG 3.49Å; C642-C645 PolarHBondContact SG-N 3.48Å; C642-C645 VanDerWaalsContact SG-N 3.39Å; C642-C645 PolarHBondContact SG-SG 2.71Å; C645-W647 VanDerWaalsContact C-N 3.34Å; C645-W647 PolarHBondContact O-N 2.94Å; C645-W647 VanDerWaalsContact SG-CD1 3.5Å; C645-C670 VanDerWaalsContact SG-SG 3.62Å; C645-C673 VanDerWaalsContact SG-SG 3.69Å; C645-H729 PolarHBondContact SG-NE2 2.82Å
646	G	87.9	Confident	92.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.198	C	C	.	.			trans	82.1	-3.6	179.1	0	0	0	0	0	116.9	V614 L616 C642	V614-G646 WeakPolarHBondContact O-CA 3.46Å; L616-G646 PolarHBondContact N-O 2.99Å; C642-G646 WeakPolarHBondContact O-CA 3.18Å; C642-G646 PolarHBondContact O-N 2.77Å
647	W	90.2	Very high	93	Very high	50 Å²	50	38 Å²	38	19%	0.189	16%	0.164	C	C	.	.			trans	-66.7	144.8	-174.5	-80.3	57	0	0	0	114.2	L616 L625 H641 C642 C645 H729 R730 V732	L616-W647 HydrophobicContact CD1-CD2 4.29Å; L616-W647 HydrophobicContact CD1-CG 4.29Å; L625-W647 HydrophobicContact CB-CE3 3.53Å; L625-W647 HydrophobicContact CB-CZ3 3.77Å; L625-W647 HydrophobicContact CD1-CE3 4.38Å; L625-W647 WeakPolarHBondContact O-CZ3 3.42Å; H641-W647 CarbonylContact C-O 3.29Å; H641-W647 WeakPolarHBondContact CA-O 3.46Å; C642-W647 PolarHBondContact N-O 2.91Å; C645-W647 VanDerWaalsContact C-N 3.34Å; C645-W647 PolarHBondContact O-N 2.94Å; C645-W647 VanDerWaalsContact SG-CD1 3.5Å; W647-H729 AromaticContact CD1-CD2 3.92Å; W647-H729 AromaticContact CD1-NE2 3.91Å; W647-H729 HydrophobicContact CD2-CB 4.16Å; W647-H729 AromaticContact CD2-CD2 3.19Å; W647-H729 AromaticContact CD2-CG 3.8Å; W647-H729 AromaticContact CD2-NE2 3.95Å; W647-H729 AromaticContact CE2-CD2 3.69Å; W647-H729 AromaticContact CE2-CG 3.84Å; W647-H729 HydrophobicContact CE3-CB 3.95Å; W647-H729 AromaticContact CE3-CD2 3.44Å; W647-H729 VanDerWaalsContact CE3-CD2 3.44Å; W647-H729 AromaticContact CE3-CG 3.98Å; W647-H729 AromaticContact CG-CD2 3.42Å; W647-H729 VanDerWaalsContact CG-CD2 3.42Å; W647-H729 AromaticContact CG-NE2 3.66Å; W647-H729 HydrophobicContact CH2-CB 3.69Å; W647-H729 HydrophobicContact CZ2-CB 3.85Å; W647-H729 HydrophobicContact CZ3-CB 3.72Å; W647-R730 VanDerWaalsContact CH2-O 3.29Å; W647-R730 WeakPolarHBondContact CH2-O 3.24Å; W647-R730 HydrophobicContact CZ3-CB 4.44Å; W647-V732 HydrophobicContact CH2-CG2 3.89Å; W647-V732 HydrophobicContact CZ3-CG2 4.48Å
648	L	92.4	Very high	93.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	111.1	-178.1	-161.6	69.2	0	0	0	111	L625 F633 R639 H641	L625-L648 WeakPolarHBondContact CB-O 3.31Å; L625-L648 HydrophobicContact CD1-CB 3.83Å; L625-L648 HydrophobicContact CG-CB 4.29Å; L625-L648 PolarHBondContact N-O 2.86Å; F633-L648 HydrophobicContact CD2-CD2 4.26Å; F633-L648 HydrophobicContact CE2-CD2 3.6Å; F633-L648 HydrophobicContact CE2-CG 3.64Å; F633-L648 HydrophobicContact CZ-CD2 4.35Å; F633-L648 HydrophobicContact CZ-CG 3.88Å; R639-L648 HydrophobicContact CB-CD1 3.94Å; R639-L648 HydrophobicContact CG-CD1 4.08Å; R639-L648 HydrophobicContact CG-CD2 4.33Å; R639-L648 HydrophobicContact CG-CG 4.32Å; H641-L648 WeakPolarHBondContact NE2-CD1 3.14Å
649	I	96.4	Very high	93.9	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.5	-169.7	60.4	175	0	0	0	112.5	M626 H640 C653 K654 C670	M626-I649 HydrophobicContact CG-CG2 3.86Å; M626-I649 HydrophobicContact SD-CG2 3.7Å; H640-I649 HydrophobicContact CB-CG1 4.17Å; H640-I649 WeakPolarHBondContact CB-O 3.35Å; H640-I649 PolarHBondContact N-O 3.41Å; H640-I649 WeakPolarHBondContact O-CG1 3.48Å; H640-I649 PolarHBondContact O-N 3.4Å; H640-I649 VanDerWaalsContact O-O 3.13Å; I649-C653 HydrophobicContact CB-CB 4.08Å; I649-C653 HydrophobicContact CG2-CB 4.43Å; I649-K654 HydrophobicContact CD1-CB 4.1Å; I649-C670 HydrophobicContact CD1-CB 3.88Å; I649-C670 HydrophobicContact CG2-CB 3.89Å
650	C	96	Very high	93.7	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	12%	0.123	C	C	.	.			trans	-86.3	172	173.9	72	0	0	0	0	112.7	C624 T631 F633 F652 C653 K654	C624-C650 HydrophobicContact CB-CB 4.01Å; C624-C650 PolarHBondContact SG-N 3.07Å; C624-C650 VanDerWaalsContact SG-SG 3.63Å; T631-C650 HydrophobicContact CG2-CB 3.65Å; F633-C650 HydrophobicContact CE1-CB 4.06Å; C650-F652 PolarHBondContact O-N 3.48Å; C650-F652 VanDerWaalsContact O-N 3.15Å; C650-C653 PolarHBondContact O-N 3.3Å; C650-K654 WeakPolarHBondContact O-CB 3.29Å; C650-K654 PolarHBondContact O-N 3.09Å; C650-K654 VanDerWaalsContact O-N 3.16Å
651	K	95.4	Very high	93.3	Very high	97 Å²	97	26 Å²	26	42%	0.422	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.7	176.7	70.5	-171.7	-178.5	-168	0	114.6
652	F	96.6	Very high	93.1	Very high	74 Å²	74	27.2 Å²	27.2	33%	0.325	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-35.4	-179.6	-53.9	-70.6	0	0	0	112.6	C650 K654 P722 V723 N724	C650-F652 PolarHBondContact O-N 3.48Å; C650-F652 VanDerWaalsContact O-N 3.15Å; F652-K654 VanDerWaalsContact C-N 3.32Å; F652-P722 WeakPolarHBondContact O-CB 3.32Å; F652-V723 HydrophobicContact CB-CB 4.23Å; F652-V723 HydrophobicContact CD1-CB 4.41Å; F652-V723 HydrophobicContact CD1-CG2 4.38Å; F652-V723 PolarHBondContact O-N 3.06Å; F652-N724 PolarHBondContact O-N 2.62Å
653	C	97.1	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.1	176.4	-66	0	0	0	0	113.9	M626 C629 I649 C650 C670 S671 N724	M626-C653 HydrophobicContact CG-CB 3.63Å; M626-C653 VanDerWaalsContact CG-SG 3.58Å; C629-C653 VanDerWaalsContact SG-SG 3.61Å; I649-C653 HydrophobicContact CB-CB 4.08Å; I649-C653 HydrophobicContact CG2-CB 4.43Å; C650-C653 PolarHBondContact O-N 3.3Å; C653-C670 CarbonylContact O-C 3.57Å; C653-C670 WeakPolarHBondContact O-CA 3.39Å; C653-S671 PolarHBondContact O-N 2.81Å; C653-N724 PolarHBondContact SG-ND2 3.45Å; C653-N724 VanDerWaalsContact SG-ND2 3.45Å
654	K	96.8	Very high	92.7	Very high	69 Å²	69	29.1 Å²	29.1	30%	0.3	14%	0.138	S	C	.	.			trans	-87.5	105.7	-179.5	177.1	-161.9	167.8	-172.2	0	111.2	H640 I649 C650 F652 N668 V669	H640-K654 VanDerWaalsContact CD2-CD 3.49Å; H640-K654 WeakPolarHBondContact CD2-CD 3.5Å; I649-K654 HydrophobicContact CD1-CB 4.1Å; C650-K654 WeakPolarHBondContact O-CB 3.29Å; C650-K654 PolarHBondContact O-N 3.09Å; C650-K654 VanDerWaalsContact O-N 3.16Å; F652-K654 VanDerWaalsContact C-N 3.32Å; K654-N668 WeakPolarHBondContact CE-OD1 3.32Å; K654-N668 HydrophobicContact CG-CB 4.28Å; K654-V669 CarbonylContact C-O 3.55Å; K654-V669 WeakPolarHBondContact CA-O 3.34Å
655	G	97.1	Very high	92.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-172.6	162.9	0	0	0	0	0	112.4	N668 V669 K720	G655-N668 WeakPolarHBondContact O-CA 3.48Å; G655-V669 PolarHBondContact N-O 3.17Å; G655-V669 PolarHBondContact O-N 3.06Å; G655-K720 CarbonylContact C-O 3.44Å; G655-K720 WeakPolarHBondContact CA-O 3.43Å
656	Q	97.9	Very high	93	Very high	51 Å²	51	32 Å²	32	24%	0.238	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.3	167.8	-53.3	-178.8	-74	0	0	110.6	K666 Q667 N668 F674 F719 K720	Q656-K666 HydrophobicContact CB-CD 4.34Å; Q656-K666 HydrophobicContact CB-CG 3.87Å; Q656-Q667 CarbonylContact C-O 3.55Å; Q656-Q667 WeakPolarHBondContact CA-O 3.18Å; Q656-N668 PolarHBondContact NE2-OD1 2.83Å; Q656-F674 WeakPolarHBondContact O-CD2 3.46Å; Q656-F674 VanDerWaalsContact O-CE2 3.26Å; Q656-F674 WeakPolarHBondContact O-CE2 3.47Å; Q656-F719 CarbonylContact O-C 3.5Å; Q656-F719 WeakPolarHBondContact O-CA 3.37Å; Q656-K720 HydrophobicContact CB-CB 4.05Å; Q656-K720 HydrophobicContact CG-CB 4.31Å; Q656-K720 PolarHBondContact N-O 2.85Å; Q656-K720 PolarHBondContact O-N 3.22Å
657	A	96.4	Very high	93.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.7	177.7	0	0	0	0	0	110.3	L659 Q667 V669 F674 H677 F719	A657-L659 PolarHBondContact O-N 3.32Å; A657-Q667 PolarHBondContact N-O 3.04Å; A657-Q667 PolarHBondContact O-N 3.45Å; A657-V669 HydrophobicContact CB-CG1 4.43Å; A657-V669 HydrophobicContact CB-CG2 3.94Å; A657-F674 HydrophobicContact CB-CD2 4.35Å; A657-H677 HydrophobicContact CB-CB 4.02Å; A657-F719 HydrophobicContact CB-CD1 4.02Å; A657-F719 HydrophobicContact CB-CE1 3.93Å
658	P	95.5	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.5	170.3	26.9	-29	0	0	0	110.1	F664 T665 L686 F687 L718 F719	P658-F664 WeakPolarHBondContact CB-O 3.35Å; P658-T665 WeakPolarHBondContact CA-O 3.41Å; P658-L686 HydrophobicContact CG-CD2 3.95Å; P658-F687 HydrophobicContact CB-CE1 4.31Å; P658-F687 HydrophobicContact CB-CZ 4.23Å; P658-F687 HydrophobicContact CG-CE1 4.37Å; P658-F687 HydrophobicContact CG-CZ 3.82Å; P658-L718 HydrophobicContact CB-CB 3.9Å; P658-L718 HydrophobicContact CB-CD1 3.92Å; P658-L718 HydrophobicContact CG-CB 3.78Å; P658-L718 HydrophobicContact CG-CD1 4.26Å; P658-F719 VanDerWaalsContact CD-CZ 3.5Å; P658-F719 HydrophobicContact CG-CE1 4.31Å; P658-F719 HydrophobicContact CG-CE2 3.89Å; P658-F719 HydrophobicContact CG-CZ 3.73Å
659	L	92.6	Very high	93.9	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.158	C	C	.	.			trans	-113.8	124	179.1	-66.3	-176.1	0	0	0	111.1	R643 D644 A657 K661 Y662 F664 T665 Q667 V669 H677	R643-L659 HydrophobicContact CB-CD1 3.8Å; D644-L659 HydrophobicContact CB-CD1 4Å; D644-L659 HydrophobicContact CB-CD2 3.96Å; A657-L659 PolarHBondContact O-N 3.32Å; L659-K661 VanDerWaalsContact C-N 3.27Å; L659-K661 HydrophobicContact CB-CG 4.4Å; L659-K661 PolarHBondContact O-N 2.97Å; L659-Y662 HydrophobicContact CB-CD2 3.86Å; L659-Y662 HydrophobicContact CD1-CD2 4.02Å; L659-Y662 HydrophobicContact CD1-CE2 4.1Å; L659-Y662 CarbonylContact O-C 3.59Å; L659-Y662 WeakPolarHBondContact O-CA 3.46Å; L659-Y662 PolarHBondContact O-N 3.28Å; L659-F664 VanDerWaalsContact O-CA 3.28Å; L659-F664 WeakPolarHBondContact O-CA 3.28Å; L659-F664 PolarHBondContact O-N 3.09Å; L659-T665 PolarHBondContact N-O 3.38Å; L659-Q667 HydrophobicContact CB-CB 4.39Å; L659-Q667 HydrophobicContact CB-CG 4.3Å; L659-Q667 HydrophobicContact CD1-CB 3.64Å; L659-Q667 HydrophobicContact CD1-CG 4.2Å; L659-Q667 HydrophobicContact CG-CB 3.94Å; L659-Q667 HydrophobicContact CG-CG 4.4Å; L659-V669 HydrophobicContact CD1-CG1 4.17Å; L659-V669 HydrophobicContact CD2-CG1 4.2Å; L659-V669 HydrophobicContact CG-CG1 4.45Å; L659-H677 WeakPolarHBondContact CD2-NE2 3.34Å
660	S	86.8	Confident	94	Very high	35 Å²	35	33 Å²	33	25%	0.245	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-53.1	-41.5	179.2	56.1	0	0	0	0	113.2	M610 Y662 D663 F664	M610-S660 WeakPolarHBondContact SD-CB 3.42Å; M610-S660 PolarHBondContact SD-OG 2.89Å; S660-Y662 PolarHBondContact O-N 3.34Å; S660-Y662 VanDerWaalsContact O-N 3.1Å; S660-D663 PolarHBondContact O-N 3.11Å; S660-D663 VanDerWaalsContact O-N 3.12Å; S660-F664 VanDerWaalsContact CB-CE1 3.41Å; S660-F664 VanDerWaalsContact CB-CZ 3.45Å
661	K	84.6	Confident	94	Very high	40 Å²	40	33 Å²	33	17%	0.174	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-69	3.4	174.1	64.8	-164.4	177.2	-158.5	0	116.6	M610 I611 R643 D644 L659	M610-K661 HydrophobicContact CB-CB 3.53Å; M610-K661 WeakPolarHBondContact O-CB 3.47Å; I611-K661 WeakPolarHBondContact O-CD 3.45Å; R643-K661 WeakPolarHBondContact O-CE 3.45Å; D644-K661 PolarHBondContact O-NZ 3.1Å; D644-K661 WeakPolarHBondContact OD1-CE 3.38Å; D644-K661 IonicContact OD1-NZ 2.67Å; D644-K661 PolarHBondContact OD1-NZ 3.47Å; L659-K661 VanDerWaalsContact C-N 3.27Å; L659-K661 HydrophobicContact CB-CG 4.4Å; L659-K661 PolarHBondContact O-N 2.97Å
662	Y	87.3	Confident	94	Very high	46 Å²	46	30.3 Å²	30.3	18%	0.18	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-132.1	39.8	170.9	-64.4	-93.2	0	0	0	109.8	K612 R643 L659 S660 F664 T665 Q667	K612-Y662 HydrophobicContact CD-CE1 4.38Å; R643-Y662 HydrophobicContact CB-CE2 4.06Å; L659-Y662 HydrophobicContact CB-CD2 3.86Å; L659-Y662 HydrophobicContact CD1-CD2 4.02Å; L659-Y662 HydrophobicContact CD1-CE2 4.1Å; L659-Y662 CarbonylContact O-C 3.59Å; L659-Y662 WeakPolarHBondContact O-CA 3.46Å; L659-Y662 PolarHBondContact O-N 3.28Å; S660-Y662 PolarHBondContact O-N 3.34Å; S660-Y662 VanDerWaalsContact O-N 3.1Å; Y662-F664 PolarHBondContact O-N 2.99Å; Y662-F664 VanDerWaalsContact O-N 3.16Å; Y662-T665 WeakPolarHBondContact CB-OG1 3.43Å; Y662-T665 VanDerWaalsContact O-CB 3.32Å; Y662-T665 WeakPolarHBondContact O-CB 3.41Å; Y662-T665 VanDerWaalsContact O-CG2 3.32Å; Y662-T665 WeakPolarHBondContact O-CG2 3.12Å; Y662-T665 PolarHBondContact O-N 3.04Å; Y662-T665 PolarHBondContact O-OG1 3.33Å; Y662-Q667 HydrophobicContact CD1-CG 4.27Å; Y662-Q667 HydrophobicContact CD2-CG 3.8Å; Y662-Q667 HydrophobicContact CE2-CG 4.43Å; Y662-Q667 HydrophobicContact CG-CG 3.71Å
663	D	89.4	Confident	94	Very high	74 Å²	74	26.8 Å²	26.8	40%	0.396	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	34	-179.7	-58.6	-68.9	0	0	0	113.6	S660 T665 G705 K706	S660-D663 PolarHBondContact O-N 3.11Å; S660-D663 VanDerWaalsContact O-N 3.12Å; D663-T665 PolarHBondContact O-N 2.65Å; D663-G705 PolarHBondContact O-N 3.2Å; D663-K706 VanDerWaalsContact OD2-CG 3.26Å; D663-K706 WeakPolarHBondContact OD2-CG 3.29Å
664	F	92.1	Very high	94	Very high	20 Å²	20	27.1 Å²	27.1	9%	0.088	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	14	-174	-59.4	-83.6	0	0	0	115.5	P658 L659 S660 Y662 L686 F687 P688 I704	P658-F664 WeakPolarHBondContact CB-O 3.35Å; L659-F664 VanDerWaalsContact O-CA 3.28Å; L659-F664 WeakPolarHBondContact O-CA 3.28Å; L659-F664 PolarHBondContact O-N 3.09Å; S660-F664 VanDerWaalsContact CB-CE1 3.41Å; S660-F664 VanDerWaalsContact CB-CZ 3.45Å; Y662-F664 PolarHBondContact O-N 2.99Å; Y662-F664 VanDerWaalsContact O-N 3.16Å; F664-L686 WeakPolarHBondContact CE1-O 3.23Å; F664-F687 HydrophobicContact CB-CD1 4.4Å; F664-F687 HydrophobicContact CB-CE1 4.09Å; F664-F687 AromaticContact CD1-CD1 3.78Å; F664-F687 HydrophobicContact CD1-CD1 3.78Å; F664-F687 AromaticContact CD1-CE1 3.91Å; F664-F687 HydrophobicContact CD1-CE1 3.91Å; F664-F687 HydrophobicContact CE1-CD1 4.31Å; F664-F687 HydrophobicContact CG-CD1 4.11Å; F664-F687 HydrophobicContact CG-CE1 4.23Å; F664-P688 HydrophobicContact CE2-CG 4.26Å; F664-P688 VanDerWaalsContact CZ-CD 3.41Å; F664-P688 HydrophobicContact CZ-CG 4.01Å; F664-I704 HydrophobicContact CB-CB 4.23Å; F664-I704 HydrophobicContact CB-CG2 3.72Å
665	T	91.5	Very high	94	Very high	44 Å²	44	24.8 Å²	24.8	27%	0.27	12%	0.123	S	C	.	.			trans	-64.7	154.3	171.1	63.8	0	0	0	0	112	P658 L659 Y662 D663 Q667	P658-T665 WeakPolarHBondContact CA-O 3.41Å; L659-T665 PolarHBondContact N-O 3.38Å; Y662-T665 WeakPolarHBondContact CB-OG1 3.43Å; Y662-T665 VanDerWaalsContact O-CB 3.32Å; Y662-T665 WeakPolarHBondContact O-CB 3.41Å; Y662-T665 VanDerWaalsContact O-CG2 3.32Å; Y662-T665 WeakPolarHBondContact O-CG2 3.12Å; Y662-T665 PolarHBondContact O-N 3.04Å; Y662-T665 PolarHBondContact O-OG1 3.33Å; D663-T665 PolarHBondContact O-N 2.65Å; T665-Q667 PolarHBondContact O-N 3.36Å; T665-Q667 PolarHBondContact OG1-NE2 3.05Å
666	K	93.7	Very high	93.9	Very high	70 Å²	70	30.1 Å²	30.1	30%	0.304	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	111.1	-178.5	-177.7	167.4	-159.5	165.5	0	111.6	Q656 K717 L718 F719	Q656-K666 HydrophobicContact CB-CD 4.34Å; Q656-K666 HydrophobicContact CB-CG 3.87Å; K666-K717 PolarHBondContact NZ-O 3.47Å; K666-L718 WeakPolarHBondContact CD-O 3.41Å; K666-L718 WeakPolarHBondContact CE-O 3.12Å; K666-L718 VanDerWaalsContact CG-O 3.29Å; K666-L718 WeakPolarHBondContact CG-O 3.27Å; K666-F719 PolarHBondContact NZ-O 2.97Å
667	Q	96.2	Very high	93.8	Very high	42 Å²	42	28.8 Å²	28.8	20%	0.196	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	153.4	-176.4	-64.3	-59.9	-30.4	0	0	112.4	R643 Q656 A657 L659 Y662 T665	R643-Q667 HydrophobicContact CB-CB 3.99Å; R643-Q667 HydrophobicContact CG-CB 4.32Å; Q656-Q667 CarbonylContact C-O 3.55Å; Q656-Q667 WeakPolarHBondContact CA-O 3.18Å; A657-Q667 PolarHBondContact N-O 3.04Å; A657-Q667 PolarHBondContact O-N 3.45Å; L659-Q667 HydrophobicContact CB-CB 4.39Å; L659-Q667 HydrophobicContact CB-CG 4.3Å; L659-Q667 HydrophobicContact CD1-CB 3.64Å; L659-Q667 HydrophobicContact CD1-CG 4.2Å; L659-Q667 HydrophobicContact CG-CB 3.94Å; L659-Q667 HydrophobicContact CG-CG 4.4Å; Y662-Q667 HydrophobicContact CD1-CG 4.27Å; Y662-Q667 HydrophobicContact CD2-CG 3.8Å; Y662-Q667 HydrophobicContact CE2-CG 4.43Å; Y662-Q667 HydrophobicContact CG-CG 3.71Å; T665-Q667 PolarHBondContact O-N 3.36Å; T665-Q667 PolarHBondContact OG1-NE2 3.05Å
668	N	96.1	Very high	93.7	Very high	29 Å²	29	32.3 Å²	32.3	16%	0.155	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	132.9	179.7	-54.3	-50.2	0	0	0	111.3	R643 K654 G655 Q656	R643-N668 WeakPolarHBondContact CB-O 3.46Å; R643-N668 WeakPolarHBondContact CD-O 3.47Å; R643-N668 PolarHBondContact N-O 3.32Å; K654-N668 WeakPolarHBondContact CE-OD1 3.32Å; K654-N668 HydrophobicContact CG-CB 4.28Å; G655-N668 WeakPolarHBondContact O-CA 3.48Å; Q656-N668 PolarHBondContact NE2-OD1 2.83Å
669	V	96.9	Very high	93.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	157.9	-177.7	-71.5	0	0	0	0	112	C642 D644 K654 G655 A657 L659 C673 F674	C642-V669 VanDerWaalsContact SG-CA 3.58Å; D644-V669 HydrophobicContact CB-CG1 4.02Å; K654-V669 CarbonylContact C-O 3.55Å; K654-V669 WeakPolarHBondContact CA-O 3.34Å; G655-V669 PolarHBondContact N-O 3.17Å; G655-V669 PolarHBondContact O-N 3.06Å; A657-V669 HydrophobicContact CB-CG1 4.43Å; A657-V669 HydrophobicContact CB-CG2 3.94Å; L659-V669 HydrophobicContact CD1-CG1 4.17Å; L659-V669 HydrophobicContact CD2-CG1 4.2Å; L659-V669 HydrophobicContact CG-CG1 4.45Å; V669-C673 HydrophobicContact CB-CB 3.94Å; V669-C673 HydrophobicContact CG1-CB 4.2Å; V669-F674 HydrophobicContact CG2-CB 3.8Å; V669-F674 HydrophobicContact CG2-CD2 4.21Å
670	C	97.6	Very high	93.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.			trans	-72.7	170.3	164.8	65	0	0	0	0	110.7	M626 C642 C645 I649 C653 C673 F674 H729	M626-C670 HydrophobicContact CE-CB 4.22Å; M626-C670 HydrophobicContact SD-CB 3.85Å; C642-C670 HydrophobicContact CB-CB 4.04Å; C642-C670 PolarHBondContact SG-N 3.31Å; C645-C670 VanDerWaalsContact SG-SG 3.62Å; I649-C670 HydrophobicContact CD1-CB 3.88Å; I649-C670 HydrophobicContact CG2-CB 3.89Å; C653-C670 CarbonylContact O-C 3.57Å; C653-C670 WeakPolarHBondContact O-CA 3.39Å; C670-C673 PolarHBondContact O-N 2.89Å; C670-C673 VanDerWaalsContact SG-CB 3.56Å; C670-C673 PolarHBondContact SG-N 3.37Å; C670-C673 VanDerWaalsContact SG-N 3.42Å; C670-F674 WeakPolarHBondContact O-CB 3.37Å; C670-F674 PolarHBondContact O-N 3.29Å; C670-H729 PolarHBondContact SG-NE2 3.24Å
671	S	96.3	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-49.5	178.5	-167.3	0	0	0	0	113	C653 C673 F674 D675 N724 Y725 G726	C653-S671 PolarHBondContact O-N 2.81Å; S671-C673 VanDerWaalsContact C-N 3.3Å; S671-C673 PolarHBondContact O-N 2.88Å; S671-F674 CarbonylContact O-C 3.58Å; S671-F674 WeakPolarHBondContact O-CA 3.28Å; S671-F674 WeakPolarHBondContact O-CB 3.37Å; S671-F674 PolarHBondContact O-N 3.49Å; S671-D675 VanDerWaalsContact O-CG 3.25Å; S671-D675 PolarHBondContact O-N 2.89Å; S671-D675 PolarHBondContact OG-OD1 3.48Å; S671-N724 VanDerWaalsContact CB-O 3.3Å; S671-N724 WeakPolarHBondContact CB-O 3.15Å; S671-N724 PolarHBondContact OG-O 2.93Å; S671-Y725 WeakPolarHBondContact OG-CA 3.43Å; S671-G726 PolarHBondContact OG-N 3.29Å
672	E	95.9	Very high	94	Very high	41 Å²	41	45.4 Å²	45.4	19%	0.192	21%	0.206	C	C	.	.	H	α-helix	trans	-59.6	-39.3	-178.7	-170.4	-168.7	109.4	0	0	113	R676 F727 R728 H729	E672-R676 WeakPolarHBondContact O-CB 3.36Å; E672-R676 PolarHBondContact O-N 2.92Å; E672-R676 IonicContact OE1-NH2 3.64Å; E672-R676 PolarHBondContact OE1-NH2 3.43Å; E672-F727 PolarHBondContact N-O 3.39Å; E672-R728 WeakPolarHBondContact OE2-CD 3.37Å; E672-H729 VanDerWaalsContact CD-CE1 3.45Å; E672-H729 IonicContact OE1-CE1 2.81Å; E672-H729 PolarHBondContact OE1-CE1 2.88Å; E672-H729 IonicContact OE1-ND1 3.19Å; E672-H729 PolarHBondContact OE1-ND1 3.21Å; E672-H729 IonicContact OE2-CE1 3.67Å; E672-H729 IonicContact OE2-CG 2.88Å; E672-H729 PolarHBondContact OE2-N 3.28Å; E672-H729 VanDerWaalsContact OE2-N 3.16Å; E672-H729 IonicContact OE2-ND1 3.63Å; E672-H729 PolarHBondContact OE2-ND1 2.85Å
673	C	96	Very high	94.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-37.1	172.4	-75.4	0	0	0	0	112.2	D644 C645 V669 C670 S671 R676 H677	D644-C673 HydrophobicContact CB-CB 3.94Å; D644-C673 PolarHBondContact OD2-SG 3.44Å; C645-C673 VanDerWaalsContact SG-SG 3.69Å; V669-C673 HydrophobicContact CB-CB 3.94Å; V669-C673 HydrophobicContact CG1-CB 4.2Å; C670-C673 PolarHBondContact O-N 2.89Å; C670-C673 VanDerWaalsContact SG-CB 3.56Å; C670-C673 PolarHBondContact SG-N 3.37Å; C670-C673 VanDerWaalsContact SG-N 3.42Å; S671-C673 VanDerWaalsContact C-N 3.3Å; S671-C673 PolarHBondContact O-N 2.88Å; C673-R676 PolarHBondContact O-N 2.95Å; C673-R676 PolarHBondContact SG-NH1 2.9Å; C673-H677 PolarHBondContact O-CD2 2.97Å; C673-H677 PolarHBondContact O-N 2.83Å
674	F	97.6	Very high	93.9	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-50.5	173.2	-179.4	-92.9	0	0	0	111	Q656 A657 V669 C670 S671 R676 H677 Y678 F719 K720 A721 Y725	Q656-F674 WeakPolarHBondContact O-CD2 3.46Å; Q656-F674 VanDerWaalsContact O-CE2 3.26Å; Q656-F674 WeakPolarHBondContact O-CE2 3.47Å; A657-F674 HydrophobicContact CB-CD2 4.35Å; V669-F674 HydrophobicContact CG2-CB 3.8Å; V669-F674 HydrophobicContact CG2-CD2 4.21Å; C670-F674 WeakPolarHBondContact O-CB 3.37Å; C670-F674 PolarHBondContact O-N 3.29Å; S671-F674 CarbonylContact O-C 3.58Å; S671-F674 WeakPolarHBondContact O-CA 3.28Å; S671-F674 WeakPolarHBondContact O-CB 3.37Å; S671-F674 PolarHBondContact O-N 3.49Å; F674-R676 VanDerWaalsContact C-N 3.29Å; F674-R676 PolarHBondContact O-N 2.95Å; F674-H677 PolarHBondContact O-N 3.21Å; F674-Y678 HydrophobicContact CE1-CD1 4.47Å; F674-Y678 HydrophobicContact CE1-CG 4.3Å; F674-Y678 HydrophobicContact CZ-CG 4.37Å; F674-Y678 WeakPolarHBondContact O-CB 3.23Å; F674-Y678 PolarHBondContact O-N 3.26Å; F674-F719 HydrophobicContact CD2-CD1 4.39Å; F674-F719 HydrophobicContact CE2-CB 3.98Å; F674-F719 AromaticContact CE2-CD1 3.72Å; F674-F719 HydrophobicContact CE2-CD1 3.72Å; F674-F719 HydrophobicContact CE2-CG 4.34Å; F674-F719 HydrophobicContact CZ-CB 4.26Å; F674-F719 HydrophobicContact CZ-CD1 4.18Å; F674-K720 VanDerWaalsContact CE2-C 3.45Å; F674-K720 VanDerWaalsContact CE2-O 3.3Å; F674-K720 WeakPolarHBondContact CE2-O 3.46Å; F674-A721 HydrophobicContact CE1-CB 3.87Å; F674-A721 HydrophobicContact CZ-CB 3.9Å; F674-Y725 AromaticContact CD1-CD2 3.95Å; F674-Y725 HydrophobicContact CD1-CD2 3.95Å; F674-Y725 AromaticContact CD1-CE2 3.7Å; F674-Y725 HydrophobicContact CD1-CE2 3.7Å; F674-Y725 HydrophobicContact CE1-CD2 4.08Å; F674-Y725 AromaticContact CE1-CE2 3.73Å; F674-Y725 HydrophobicContact CE1-CE2 3.73Å
675	D	96.1	Very high	93.7	Very high	20 Å²	20	50.9 Å²	50.9	11%	0.107	26%	0.256	C	S	.	.	H	α-helix	trans	-54.2	-46.4	176.2	-58.7	0.9	0	0	0	110.8	S671 Y678 K679 Y725 R728	S671-D675 VanDerWaalsContact O-CG 3.25Å; S671-D675 PolarHBondContact O-N 2.89Å; S671-D675 PolarHBondContact OG-OD1 3.48Å; D675-Y678 PolarHBondContact O-N 3.12Å; D675-K679 WeakPolarHBondContact O-CB 3.27Å; D675-K679 PolarHBondContact O-N 3.43Å; D675-Y725 WeakPolarHBondContact OD1-CE2 3.47Å; D675-R728 IonicContact OD2-CZ 3.51Å; D675-R728 IonicContact OD2-NH1 3.46Å; D675-R728 PolarHBondContact OD2-NH1 2.98Å; D675-R728 IonicContact OD2-NH2 2.73Å; D675-R728 PolarHBondContact OD2-NH2 2.71Å
676	R	95.5	Very high	93.5	Very high	112 Å²	112	49.7 Å²	49.7	42%	0.423	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-49.2	-178.1	-165.2	-171.4	-55.1	140.5	-0.6	112.5	D644 E672 C673 F674 A680	D644-R676 IonicContact OD2-NH1 2.91Å; D644-R676 PolarHBondContact OD2-NH1 2.91Å; D644-R676 VanDerWaalsContact OD2-NH1 3.08Å; E672-R676 WeakPolarHBondContact O-CB 3.36Å; E672-R676 PolarHBondContact O-N 2.92Å; E672-R676 IonicContact OE1-NH2 3.64Å; E672-R676 PolarHBondContact OE1-NH2 3.43Å; C673-R676 PolarHBondContact O-N 2.95Å; C673-R676 PolarHBondContact SG-NH1 2.9Å; F674-R676 VanDerWaalsContact C-N 3.29Å; F674-R676 PolarHBondContact O-N 2.95Å; R676-A680 WeakPolarHBondContact O-CB 3.32Å; R676-A680 PolarHBondContact O-N 3.03Å
677	H	95.3	Very high	93.4	Very high	22 Å²	22	47.1 Å²	47.1	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-73.5	-33.4	178.7	-70.4	-64.3	0	0	0	112.2	D644 A657 L659 C673 F674 A680 Y681 F719	D644-H677 IonicContact OD1-NE2 2.79Å; D644-H677 PolarHBondContact OD1-NE2 3.47Å; D644-H677 IonicContact OD2-CD2 2.72Å; D644-H677 IonicContact OD2-CE1 3.28Å; D644-H677 IonicContact OD2-NE2 3.5Å; D644-H677 PolarHBondContact OD2-NE2 3.48Å; A657-H677 HydrophobicContact CB-CB 4.02Å; L659-H677 WeakPolarHBondContact CD2-NE2 3.34Å; C673-H677 PolarHBondContact O-CD2 2.97Å; C673-H677 PolarHBondContact O-N 2.83Å; F674-H677 PolarHBondContact O-N 3.21Å; H677-A680 PolarHBondContact O-N 3.29Å; H677-Y681 PolarHBondContact O-N 2.67Å; H677-F719 HydrophobicContact CB-CE1 4.41Å
678	Y	94.6	Very high	92.9	Very high	74 Å²	74	47.5 Å²	47.5	29%	0.29	24%	0.243	S	C	.	.	H	α-helix	trans	-70.7	-35.3	176.1	-173.8	-118.5	0	0	0	112.3	F674 D675 Y681 K682 F719	F674-Y678 HydrophobicContact CE1-CD1 4.47Å; F674-Y678 HydrophobicContact CE1-CG 4.3Å; F674-Y678 HydrophobicContact CZ-CG 4.37Å; F674-Y678 WeakPolarHBondContact O-CB 3.23Å; F674-Y678 PolarHBondContact O-N 3.26Å; D675-Y678 PolarHBondContact O-N 3.12Å; Y678-Y681 HydrophobicContact CD2-CD1 4.12Å; Y678-Y681 HydrophobicContact CE2-CD1 4.1Å; Y678-Y681 HydrophobicContact CE2-CE1 4.46Å; Y678-Y681 PolarHBondContact O-N 2.72Å; Y678-K682 HydrophobicContact CE1-CD 4.31Å; Y678-K682 PolarHBondContact O-N 2.77Å; Y678-K682 VanDerWaalsContact O-N 3.1Å; Y678-K682 WeakPolarHBondContact OH-CE 3.5Å; Y678-F719 AromaticContact CD2-CD1 3.84Å; Y678-F719 HydrophobicContact CD2-CD1 3.84Å; Y678-F719 HydrophobicContact CD2-CD2 4.37Å; Y678-F719 HydrophobicContact CD2-CE1 4.03Å; Y678-F719 HydrophobicContact CD2-CG 4.03Å; Y678-F719 HydrophobicContact CD2-CZ 4.39Å; Y678-F719 HydrophobicContact CG-CD1 4.45Å
679	K	93.1	Very high	92.3	Very high	130 Å²	130	51 Å²	51	57%	0.565	27%	0.27	S	S	*	.	H	α-helix	trans	-62.7	-51.7	167.1	175.5	168.8	176.2	176.5	0	110.9	D675 Y681 K682 D683	D675-K679 WeakPolarHBondContact O-CB 3.27Å; D675-K679 PolarHBondContact O-N 3.43Å; K679-Y681 PolarHBondContact O-N 2.73Å; K679-Y681 VanDerWaalsContact O-N 3.09Å; K679-K682 PolarHBondContact O-N 3.32Å; K679-D683 WeakPolarHBondContact CE-OD2 3.43Å; K679-D683 VanDerWaalsContact CG-OD2 3.22Å; K679-D683 WeakPolarHBondContact CG-OD2 3.22Å; K679-D683 WeakPolarHBondContact O-CB 3.49Å; K679-D683 VanDerWaalsContact O-CG 3.25Å; K679-D683 PolarHBondContact O-N 3.22Å
680	A	90.3	Very high	91.6	Very high	21 Å²	21	58.7 Å²	58.7	17%	0.174	30%	0.303	C	S	.	.	H	α-helix	trans	-56.9	-28.9	178.1	0	0	0	0	0	113.6	R676 H677 G684 V685 L686	R676-A680 WeakPolarHBondContact O-CB 3.32Å; R676-A680 PolarHBondContact O-N 3.03Å; H677-A680 PolarHBondContact O-N 3.29Å; A680-G684 PolarHBondContact O-N 3.46Å; A680-V685 HydrophobicContact CB-CG2 4.07Å; A680-V685 WeakPolarHBondContact O-CG2 3.49Å; A680-V685 PolarHBondContact O-N 3.11Å; A680-V685 VanDerWaalsContact O-N 3.09Å; A680-L686 HydrophobicContact CB-CB 4.05Å; A680-L686 HydrophobicContact CB-CD1 4.2Å; A680-L686 WeakPolarHBondContact O-CB 3.37Å; A680-L686 PolarHBondContact O-N 2.95Å
681	Y	92.4	Very high	90.9	Very high	55 Å²	55	60.2 Å²	60.2	22%	0.216	31%	0.311	C	S	.	.	H	α-helix	trans	-71.5	-46.6	171.1	166.3	-120.5	0	0	0	112.8	H677 Y678 K679 D683 G684 F687 P715 R716 F719	H677-Y681 PolarHBondContact O-N 2.67Å; Y678-Y681 HydrophobicContact CD2-CD1 4.12Å; Y678-Y681 HydrophobicContact CE2-CD1 4.1Å; Y678-Y681 HydrophobicContact CE2-CE1 4.46Å; Y678-Y681 PolarHBondContact O-N 2.72Å; K679-Y681 PolarHBondContact O-N 2.73Å; K679-Y681 VanDerWaalsContact O-N 3.09Å; Y681-D683 VanDerWaalsContact C-N 3.3Å; Y681-D683 PolarHBondContact O-N 3.3Å; Y681-G684 PolarHBondContact O-N 3.42Å; Y681-G684 VanDerWaalsContact O-N 3.11Å; Y681-F687 HydrophobicContact CD2-CD2 4.36Å; Y681-F687 AromaticContact CD2-CE2 3.85Å; Y681-F687 HydrophobicContact CD2-CE2 3.85Å; Y681-F687 HydrophobicContact CE2-CE2 4.41Å; Y681-P715 HydrophobicContact CD2-CB 4.39Å; Y681-P715 HydrophobicContact CE2-CB 3.77Å; Y681-P715 HydrophobicContact CE2-CG 3.82Å; Y681-R716 VanDerWaalsContact OH-CG 3.29Å; Y681-R716 WeakPolarHBondContact OH-CG 3.37Å; Y681-F719 HydrophobicContact CD1-CD2 4.26Å; Y681-F719 AromaticContact CD1-CE2 3.66Å; Y681-F719 HydrophobicContact CD1-CE2 3.66Å; Y681-F719 HydrophobicContact CD1-CZ 4.13Å; Y681-F719 HydrophobicContact CD2-CE2 4.36Å; Y681-F719 HydrophobicContact CE1-CE2 4.32Å; Y681-F719 AromaticContact CG-CE2 3.69Å; Y681-F719 HydrophobicContact CG-CE2 3.69Å; Y681-F719 AromaticContact CG-CZ 3.96Å; Y681-F719 HydrophobicContact CG-CZ 3.96Å
682	K	90	Very high	90.4	Very high	145 Å²	145	63.2 Å²	63.2	63%	0.63	33%	0.326	S	S	*	.	H	α-helix	trans	-61.1	-38.9	175.1	-76.8	-175	169.6	-174.5	0	112.7	Y678 K679 G684	Y678-K682 HydrophobicContact CE1-CD 4.31Å; Y678-K682 PolarHBondContact O-N 2.77Å; Y678-K682 VanDerWaalsContact O-N 3.1Å; Y678-K682 WeakPolarHBondContact OH-CE 3.5Å; K679-K682 PolarHBondContact O-N 3.32Å; K682-G684 PolarHBondContact O-N 3.36Å
683	D	89.1	Confident	89.9	Confident	91 Å²	91	63.4 Å²	63.4	49%	0.487	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	1.6	178.1	-59.5	-4.1	0	0	0	112.2	K679 Y681 V685	K679-D683 WeakPolarHBondContact CE-OD2 3.43Å; K679-D683 VanDerWaalsContact CG-OD2 3.22Å; K679-D683 WeakPolarHBondContact CG-OD2 3.22Å; K679-D683 WeakPolarHBondContact O-CB 3.49Å; K679-D683 VanDerWaalsContact O-CG 3.25Å; K679-D683 PolarHBondContact O-N 3.22Å; Y681-D683 VanDerWaalsContact C-N 3.3Å; Y681-D683 PolarHBondContact O-N 3.3Å; D683-V685 HydrophobicContact CB-CG2 4.19Å; D683-V685 PolarHBondContact O-N 3.36Å; D683-V685 VanDerWaalsContact O-N 3.08Å
684	G	86.3	Confident	89.3	Confident	55 Å²	55	68.1 Å²	68.1	57%	0.567	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-10.9	177.8	0	0	0	0	0	116	A680 Y681 K682	A680-G684 PolarHBondContact O-N 3.46Å; Y681-G684 PolarHBondContact O-N 3.42Å; Y681-G684 VanDerWaalsContact O-N 3.11Å; K682-G684 PolarHBondContact O-N 3.36Å
685	V	87.8	Confident	88.5	Confident	110 Å²	110	72.2 Å²	72.2	67%	0.667	38%	0.376	S	S	*	.			trans	-82.7	-11.8	-171.1	-64	0	0	0	0	115.5	A680 D683	A680-V685 HydrophobicContact CB-CG2 4.07Å; A680-V685 WeakPolarHBondContact O-CG2 3.49Å; A680-V685 PolarHBondContact O-N 3.11Å; A680-V685 VanDerWaalsContact O-N 3.09Å; D683-V685 HydrophobicContact CB-CG2 4.19Å; D683-V685 PolarHBondContact O-N 3.36Å; D683-V685 VanDerWaalsContact O-N 3.08Å
686	L	87.3	Confident	87.5	Confident	19 Å²	19	77.9 Å²	77.9	10%	0.099	42%	0.417	C	S	.	.	S	Bend	trans	-66.9	-39.3	-173.5	-175.7	61.6	0	0	0	113.8	P658 F664 A680 F719	P658-L686 HydrophobicContact CG-CD2 3.95Å; F664-L686 WeakPolarHBondContact CE1-O 3.23Å; A680-L686 HydrophobicContact CB-CB 4.05Å; A680-L686 HydrophobicContact CB-CD1 4.2Å; A680-L686 WeakPolarHBondContact O-CB 3.37Å; A680-L686 PolarHBondContact O-N 2.95Å; L686-F719 HydrophobicContact CD2-CZ 3.84Å
687	F	90.2	Very high	86.6	Confident	16 Å²	16	77.2 Å²	77.2	7%	0.07	42%	0.422	C	S	.	.	S	Bend	trans	-106	125.8	-174.8	-61.7	-81.1	0	0	0	110.8	P658 F664 Y681 M692 V702 P715 L718	P658-F687 HydrophobicContact CB-CE1 4.31Å; P658-F687 HydrophobicContact CB-CZ 4.23Å; P658-F687 HydrophobicContact CG-CE1 4.37Å; P658-F687 HydrophobicContact CG-CZ 3.82Å; F664-F687 HydrophobicContact CB-CD1 4.4Å; F664-F687 HydrophobicContact CB-CE1 4.09Å; F664-F687 AromaticContact CD1-CD1 3.78Å; F664-F687 HydrophobicContact CD1-CD1 3.78Å; F664-F687 AromaticContact CD1-CE1 3.91Å; F664-F687 HydrophobicContact CD1-CE1 3.91Å; F664-F687 HydrophobicContact CE1-CD1 4.31Å; F664-F687 HydrophobicContact CG-CD1 4.11Å; F664-F687 HydrophobicContact CG-CE1 4.23Å; Y681-F687 HydrophobicContact CD2-CD2 4.36Å; Y681-F687 AromaticContact CD2-CE2 3.85Å; Y681-F687 HydrophobicContact CD2-CE2 3.85Å; Y681-F687 HydrophobicContact CE2-CE2 4.41Å; F687-M692 HydrophobicContact CB-CG 4.34Å; F687-V702 HydrophobicContact CB-CG1 4.26Å; F687-V702 HydrophobicContact CD1-CB 4.13Å; F687-V702 HydrophobicContact CD1-CG1 3.86Å; F687-V702 HydrophobicContact CD1-CG2 4.42Å; F687-V702 HydrophobicContact CD2-CG1 3.98Å; F687-V702 HydrophobicContact CE1-CB 4.17Å; F687-V702 HydrophobicContact CE1-CG1 4.12Å; F687-V702 HydrophobicContact CE1-CG2 3.94Å; F687-V702 HydrophobicContact CE2-CG1 4.24Å; F687-V702 HydrophobicContact CG-CG1 3.77Å; F687-V702 HydrophobicContact CZ-CG1 4.31Å; F687-V702 HydrophobicContact CZ-CG2 4.12Å; F687-P715 HydrophobicContact CE2-CB 3.7Å; F687-P715 HydrophobicContact CZ-CB 3.9Å; F687-L718 HydrophobicContact CE1-CD1 4.25Å; F687-L718 HydrophobicContact CZ-CD1 4.1Å
688	P	86.3	Confident	85.4	Confident	49 Å²	49	84.4 Å²	84.4	32%	0.318	46%	0.456	S	S	.	.			trans	-60.7	141	172.5	-23.7	34.1	0	0	0	111.3	F664 K690 N691	F664-P688 HydrophobicContact CE2-CG 4.26Å; F664-P688 VanDerWaalsContact CZ-CD 3.41Å; F664-P688 HydrophobicContact CZ-CG 4.01Å; P688-K690 HydrophobicContact CB-CD 4.41Å; P688-K690 HydrophobicContact CB-CG 3.78Å; P688-K690 PolarHBondContact O-N 3.39Å; P688-N691 WeakPolarHBondContact O-CA 3.29Å; P688-N691 WeakPolarHBondContact O-CB 3.29Å; P688-N691 PolarHBondContact O-N 3.35Å
689	S	83.6	Confident	84.7	Confident	104 Å²	104	83.6 Å²	83.6	73%	0.727	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-54.9	-33.6	-176.4	-32.9	0	0	0	0	113.4	N691 M692	S689-N691 PolarHBondContact O-N 3.2Å; S689-M692 PolarHBondContact O-N 3.45Å
690	K	82.3	Confident	84.3	Confident	160 Å²	160	81.3 Å²	81.3	70%	0.696	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-60.5	-17.4	173	58	163.2	-172.9	-178	0	115.2	P688	P688-K690 HydrophobicContact CB-CD 4.41Å; P688-K690 HydrophobicContact CB-CG 3.78Å; P688-K690 PolarHBondContact O-N 3.39Å
691	N	83.8	Confident	84.2	Confident	32 Å²	32	82 Å²	82	17%	0.171	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-99.6	-14.6	176.4	-76.1	72.3	0	0	0	111.9	P688 S689 V702 K703	P688-N691 WeakPolarHBondContact O-CA 3.29Å; P688-N691 WeakPolarHBondContact O-CB 3.29Å; P688-N691 PolarHBondContact O-N 3.35Å; S689-N691 PolarHBondContact O-N 3.2Å; N691-V702 WeakPolarHBondContact O-CA 3.36Å; N691-K703 PolarHBondContact ND2-O 3.32Å; N691-K703 PolarHBondContact O-N 3.25Å
692	M	85.7	Confident	84.1	Confident	64 Å²	64	79.4 Å²	79.4	32%	0.315	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	153.1	177.3	-67.6	163	59.9	0	0	111.5	F687 S689 I700 L701	F687-M692 HydrophobicContact CB-CG 4.34Å; S689-M692 PolarHBondContact O-N 3.45Å; M692-I700 HydrophobicContact CB-CG2 4.48Å; M692-I700 HydrophobicContact CE-CD1 4.44Å; M692-I700 HydrophobicContact CE-CG2 4.04Å; M692-I700 HydrophobicContact CG-CG2 4.36Å; M692-L701 CarbonylContact C-O 3.57Å
693	I	84.6	Confident	84.1	Confident	45 Å²	45	76.4 Å²	76.4	23%	0.231	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.1	166.1	-45	175.8	0	0	0	106	I700 L701 K703 I712	I693-I700 WeakPolarHBondContact O-CA 3.4Å; I693-L701 HydrophobicContact CB-CB 4.4Å; I693-L701 PolarHBondContact N-O 2.82Å; I693-L701 PolarHBondContact O-N 3.01Å; I693-K703 HydrophobicContact CD1-CD 4.33Å; I693-K703 VanDerWaalsContact CD1-CE 3.41Å; I693-K703 HydrophobicContact CD1-CG 4Å; I693-K703 HydrophobicContact CG1-CD 4.33Å; I693-K703 HydrophobicContact CG1-CG 4.18Å; I693-I712 HydrophobicContact CD1-CD1 3.78Å; I693-I712 HydrophobicContact CD1-CG1 4.07Å; I693-I712 HydrophobicContact CD1-CG2 3.66Å
694	V	83.5	Confident	84	Confident	98 Å²	98	72.3 Å²	72.3	59%	0.594	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.7	168	-171.5	0	0	0	0	107.1	T699 I700	V694-T699 WeakPolarHBondContact CA-O 3.23Å; V694-I700 HydrophobicContact CG2-CG1 4.41Å
695	Q	81.9	Confident	83.9	Confident	94 Å²	94	70.7 Å²	70.7	44%	0.439	39%	0.39	S	S	.	.			trans	-91.6	170.2	174	-60.4	-162.2	-79.4	0	0	110.8	D697 E698 T699 L701	Q695-D697 VanDerWaalsContact CB-OD1 3.29Å; Q695-D697 WeakPolarHBondContact CB-OD1 3.4Å; Q695-D697 PolarHBondContact O-N 3.28Å; Q695-D697 VanDerWaalsContact O-N 3.13Å; Q695-E698 PolarHBondContact O-N 3.1Å; Q695-T699 PolarHBondContact N-O 2.94Å; Q695-T699 PolarHBondContact OE1-OG1 3.15Å; Q695-L701 HydrophobicContact CG-CD1 4.28Å
696	S	73.3	Confident	83.5	Confident	139 Å²	139	72.2 Å²	72.2	97%	0.972	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-4.6	-176.6	51.1	0	0	0	0	114.8
697	D	77.4	Confident	82.7	Confident	99 Å²	99	82 Å²	82	53%	0.529	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	20.6	176.5	65	-8.9	0	0	0	112.1	Q695 T699	Q695-D697 VanDerWaalsContact CB-OD1 3.29Å; Q695-D697 WeakPolarHBondContact CB-OD1 3.4Å; Q695-D697 PolarHBondContact O-N 3.28Å; Q695-D697 VanDerWaalsContact O-N 3.13Å; D697-T699 PolarHBondContact O-N 3.29Å; D697-T699 VanDerWaalsContact O-N 3.09Å; D697-T699 WeakPolarHBondContact OD1-CB 3.34Å; D697-T699 WeakPolarHBondContact OD1-CG2 3.38Å; D697-T699 PolarHBondContact OD1-N 3.31Å; D697-T699 VanDerWaalsContact OD1-N 3.07Å; D697-T699 PolarHBondContact OD1-OG1 2.95Å; D697-T699 WeakPolarHBondContact OD2-CG2 3.27Å; D697-T699 PolarHBondContact OD2-OG1 3.35Å
698	E	71.1	Confident	81.8	Confident	173 Å²	173	89 Å²	89	81%	0.808	46%	0.461	S	S	*	.	S	Bend	trans	62.1	4.3	-174	-52.8	-169.3	148.6	0	0	115.4	Q695	Q695-E698 PolarHBondContact O-N 3.1Å
699	T	79.1	Confident	81.3	Confident	56 Å²	56	92.7 Å²	92.7	34%	0.344	48%	0.478	S	S	.	.			trans	-72.2	139.6	178.7	66.3	0	0	0	0	111.9	V694 Q695 D697	V694-T699 WeakPolarHBondContact CA-O 3.23Å; Q695-T699 PolarHBondContact N-O 2.94Å; Q695-T699 PolarHBondContact OE1-OG1 3.15Å; D697-T699 PolarHBondContact O-N 3.29Å; D697-T699 VanDerWaalsContact O-N 3.09Å; D697-T699 WeakPolarHBondContact OD1-CB 3.34Å; D697-T699 WeakPolarHBondContact OD1-CG2 3.38Å; D697-T699 PolarHBondContact OD1-N 3.31Å; D697-T699 VanDerWaalsContact OD1-N 3.07Å; D697-T699 PolarHBondContact OD1-OG1 2.95Å; D697-T699 WeakPolarHBondContact OD2-CG2 3.27Å; D697-T699 PolarHBondContact OD2-OG1 3.35Å
700	I	83.4	Confident	81.2	Confident	82 Å²	82	93.8 Å²	93.8	42%	0.421	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	111.9	-179	-60.3	167.9	0	0	0	109.6	M692 I693 V694 P715	M692-I700 HydrophobicContact CB-CG2 4.48Å; M692-I700 HydrophobicContact CE-CD1 4.44Å; M692-I700 HydrophobicContact CE-CG2 4.04Å; M692-I700 HydrophobicContact CG-CG2 4.36Å; I693-I700 WeakPolarHBondContact O-CA 3.4Å; V694-I700 HydrophobicContact CG2-CG1 4.41Å; I700-P715 WeakPolarHBondContact O-CD 3.26Å
701	L	88.8	Confident	81.6	Confident	36 Å²	36	91.8 Å²	91.8	19%	0.188	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	155.8	170.5	-58.4	179	0	0	0	110.5	M692 I693 Q695 I712 D714	M692-L701 CarbonylContact C-O 3.57Å; I693-L701 HydrophobicContact CB-CB 4.4Å; I693-L701 PolarHBondContact N-O 2.82Å; I693-L701 PolarHBondContact O-N 3.01Å; Q695-L701 HydrophobicContact CG-CD1 4.28Å; L701-I712 HydrophobicContact CB-CG2 3.81Å; L701-I712 HydrophobicContact CD1-CG2 3.83Å; L701-I712 HydrophobicContact CG-CG2 4.44Å; L701-D714 HydrophobicContact CD2-CB 4.24Å
702	V	90.5	Very high	81.9	Confident	1 Å²	1	94.9 Å²	94.9	1%	0.006	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.4	178.7	-66.5	0	0	0	0	112.2	F687 N691 I704 V713 P715 L718	F687-V702 HydrophobicContact CB-CG1 4.26Å; F687-V702 HydrophobicContact CD1-CB 4.13Å; F687-V702 HydrophobicContact CD1-CG1 3.86Å; F687-V702 HydrophobicContact CD1-CG2 4.42Å; F687-V702 HydrophobicContact CD2-CG1 3.98Å; F687-V702 HydrophobicContact CE1-CB 4.17Å; F687-V702 HydrophobicContact CE1-CG1 4.12Å; F687-V702 HydrophobicContact CE1-CG2 3.94Å; F687-V702 HydrophobicContact CE2-CG1 4.24Å; F687-V702 HydrophobicContact CG-CG1 3.77Å; F687-V702 HydrophobicContact CZ-CG1 4.31Å; F687-V702 HydrophobicContact CZ-CG2 4.12Å; N691-V702 WeakPolarHBondContact O-CA 3.36Å; V702-I704 HydrophobicContact CB-CG2 4.46Å; V702-I704 HydrophobicContact CG2-CG2 4Å; V702-V713 WeakPolarHBondContact CG2-O 3.19Å; V702-V713 PolarHBondContact N-O 3.02Å; V702-V713 PolarHBondContact O-N 2.57Å; V702-P715 HydrophobicContact CG1-CB 4.16Å; V702-P715 HydrophobicContact CG1-CG 4.32Å; V702-P715 HydrophobicContact CG2-CB 3.86Å; V702-P715 HydrophobicContact CG2-CG 4.48Å; V702-L718 HydrophobicContact CG2-CD1 3.81Å
703	K	89.6	Confident	82.1	Confident	81 Å²	81	92.6 Å²	92.6	35%	0.352	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.2	169.6	-67.2	173.3	-178.8	167.2	0	108.7	N691 I693 E711 I712	N691-K703 PolarHBondContact ND2-O 3.32Å; N691-K703 PolarHBondContact O-N 3.25Å; I693-K703 HydrophobicContact CD1-CD 4.33Å; I693-K703 VanDerWaalsContact CD1-CE 3.41Å; I693-K703 HydrophobicContact CD1-CG 4Å; I693-K703 HydrophobicContact CG1-CD 4.33Å; I693-K703 HydrophobicContact CG1-CG 4.18Å; K703-E711 WeakPolarHBondContact CA-O 3.33Å; K703-I712 HydrophobicContact CG-CG1 4.14Å
704	I	88.2	Confident	82.4	Confident	6 Å²	6	92.5 Å²	92.5	3%	0.031	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	167.3	177.7	69.7	178.2	0	0	0	110.2	F664 V702 K710 E711 V713 L718	F664-I704 HydrophobicContact CB-CB 4.23Å; F664-I704 HydrophobicContact CB-CG2 3.72Å; V702-I704 HydrophobicContact CB-CG2 4.46Å; V702-I704 HydrophobicContact CG2-CG2 4Å; I704-K710 VanDerWaalsContact O-CA 3.3Å; I704-K710 WeakPolarHBondContact O-CA 3.32Å; I704-E711 HydrophobicContact CG1-CB 3.97Å; I704-E711 PolarHBondContact N-O 3.09Å; I704-E711 PolarHBondContact O-N 3.29Å; I704-V713 HydrophobicContact CD1-CB 4.4Å; I704-V713 HydrophobicContact CD1-CG2 3.67Å; I704-V713 HydrophobicContact CG1-CG2 4.04Å; I704-L718 HydrophobicContact CD1-CD1 4.16Å; I704-L718 HydrophobicContact CD1-CD2 3.63Å; I704-L718 HydrophobicContact CG2-CD1 3.96Å
705	G	83.7	Confident	82.6	Confident	20 Å²	20	88 Å²	88	21%	0.206	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	174.4	179.9	0	0	0	0	0	114.4	D663 D709	D663-G705 PolarHBondContact O-N 3.2Å; G705-D709 CarbonylContact C-O 3.52Å; G705-D709 VanDerWaalsContact C-O 3.3Å; G705-D709 WeakPolarHBondContact CA-O 3.17Å
706	K	78.9	Confident	83	Confident	142 Å²	142	92.4 Å²	92.4	62%	0.617	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	167	-170.3	-76.3	-175.7	176.5	-176.9	0	112	D663 N708 D709 K710	D663-K706 VanDerWaalsContact OD2-CG 3.26Å; D663-K706 WeakPolarHBondContact OD2-CG 3.29Å; K706-N708 PolarHBondContact O-N 3.38Å; K706-D709 PolarHBondContact N-O 2.97Å; K706-D709 CarbonylContact O-C 3.57Å; K706-D709 VanDerWaalsContact O-C 3.29Å; K706-D709 PolarHBondContact O-N 3.31Å; K706-K710 WeakPolarHBondContact O-CG 3.46Å
707	R	71.4	Confident	83.8	Confident	225 Å²	225	92.4 Å²	92.4	85%	0.849	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.9	-173.8	-161.1	172.4	-171.9	163.9	-0.3	114.6
708	N	69.8	Low	84.5	Confident	162 Å²	162	88.1 Å²	88.1	87%	0.866	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-4.5	-176.8	-56.2	10.7	0	0	0	113.3	K706	K706-N708 PolarHBondContact O-N 3.38Å
709	D	76.1	Confident	85.7	Confident	128 Å²	128	80.9 Å²	80.9	68%	0.684	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.7	86.6	-173.2	178.9	26.3	0	0	0	107.6	G705 K706	G705-D709 CarbonylContact C-O 3.52Å; G705-D709 VanDerWaalsContact C-O 3.3Å; G705-D709 WeakPolarHBondContact CA-O 3.17Å; K706-D709 PolarHBondContact N-O 2.97Å; K706-D709 CarbonylContact O-C 3.57Å; K706-D709 VanDerWaalsContact O-C 3.29Å; K706-D709 PolarHBondContact O-N 3.31Å
710	K	82.6	Confident	86.6	Confident	127 Å²	127	84.6 Å²	84.6	55%	0.552	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.3	-171.7	-67.6	-166.5	-179.3	-174.6	0	111.7	I704 K706	I704-K710 VanDerWaalsContact O-CA 3.3Å; I704-K710 WeakPolarHBondContact O-CA 3.32Å; K706-K710 WeakPolarHBondContact O-CG 3.46Å
711	E	89.6	Confident	87.1	Confident	118 Å²	118	83.4 Å²	83.4	55%	0.551	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	146.9	172.2	-151.1	-170.8	162	0	0	110	K703 I704 V713	K703-E711 WeakPolarHBondContact CA-O 3.33Å; I704-E711 HydrophobicContact CG1-CB 3.97Å; I704-E711 PolarHBondContact N-O 3.09Å; I704-E711 PolarHBondContact O-N 3.29Å; E711-V713 HydrophobicContact CB-CG2 3.82Å; E711-V713 HydrophobicContact CG-CG2 3.53Å; E711-V713 WeakPolarHBondContact OE1-CG2 3.3Å
712	I	89.9	Confident	87.5	Confident	97 Å²	97	82.1 Å²	82.1	50%	0.497	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.9	169.8	-62.1	173.3	0	0	0	106.9	I693 L701 K703	I693-I712 HydrophobicContact CD1-CD1 3.78Å; I693-I712 HydrophobicContact CD1-CG1 4.07Å; I693-I712 HydrophobicContact CD1-CG2 3.66Å; L701-I712 HydrophobicContact CB-CG2 3.81Å; L701-I712 HydrophobicContact CD1-CG2 3.83Å; L701-I712 HydrophobicContact CG-CG2 4.44Å; K703-I712 HydrophobicContact CG-CG1 4.14Å
713	V	90.9	Very high	87.7	Confident	15 Å²	15	87.4 Å²	87.4	9%	0.091	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.4	-169.2	-159.9	0	0	0	0	110.9	V702 I704 E711 K717 L718	V702-V713 WeakPolarHBondContact CG2-O 3.19Å; V702-V713 PolarHBondContact N-O 3.02Å; V702-V713 PolarHBondContact O-N 2.57Å; I704-V713 HydrophobicContact CD1-CB 4.4Å; I704-V713 HydrophobicContact CD1-CG2 3.67Å; I704-V713 HydrophobicContact CG1-CG2 4.04Å; E711-V713 HydrophobicContact CB-CG2 3.82Å; E711-V713 HydrophobicContact CG-CG2 3.53Å; E711-V713 WeakPolarHBondContact OE1-CG2 3.3Å; V713-K717 HydrophobicContact CG1-CB 4.22Å; V713-K717 HydrophobicContact CG1-CD 4.47Å; V713-L718 HydrophobicContact CB-CD2 4.27Å; V713-L718 HydrophobicContact CG1-CD2 4.01Å
714	D	90.3	Very high	87.9	Confident	44 Å²	44	85.1 Å²	85.1	24%	0.235	41%	0.411	C	S	.	.			trans	-61.6	119.8	162.1	161.9	15.2	0	0	0	109.1	L701 R716 K717	L701-D714 HydrophobicContact CD2-CB 4.24Å; D714-R716 PolarHBondContact O-N 3.34Å; D714-R716 VanDerWaalsContact O-N 3.09Å; D714-R716 WeakPolarHBondContact OD1-CB 3.37Å; D714-R716 VanDerWaalsContact OD1-CG 3.3Å; D714-R716 WeakPolarHBondContact OD1-CG 3.47Å; D714-R716 PolarHBondContact OD1-N 2.69Å; D714-K717 HydrophobicContact CB-CD 4.01Å; D714-K717 HydrophobicContact CB-CG 4.11Å; D714-K717 WeakPolarHBondContact O-CB 3.43Å; D714-K717 PolarHBondContact O-N 3.49Å
715	P	88.4	Confident	88.1	Confident	4 Å²	4	90.7 Å²	90.7	3%	0.026	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-59.5	-24.9	-176.6	23.8	-33.4	0	0	0	113.2	Y681 F687 I700 V702 K717 L718 F719	Y681-P715 HydrophobicContact CD2-CB 4.39Å; Y681-P715 HydrophobicContact CE2-CB 3.77Å; Y681-P715 HydrophobicContact CE2-CG 3.82Å; F687-P715 HydrophobicContact CE2-CB 3.7Å; F687-P715 HydrophobicContact CZ-CB 3.9Å; I700-P715 WeakPolarHBondContact O-CD 3.26Å; V702-P715 HydrophobicContact CG1-CB 4.16Å; V702-P715 HydrophobicContact CG1-CG 4.32Å; V702-P715 HydrophobicContact CG2-CB 3.86Å; V702-P715 HydrophobicContact CG2-CG 4.48Å; P715-K717 VanDerWaalsContact C-N 3.29Å; P715-K717 PolarHBondContact O-N 3.3Å; P715-L718 WeakPolarHBondContact O-CB 3.35Å; P715-L718 PolarHBondContact O-N 2.97Å; P715-L718 VanDerWaalsContact O-N 3.14Å; P715-F719 WeakPolarHBondContact O-CD2 3.35Å
716	R	89.1	Confident	88.4	Confident	185 Å²	185	91.2 Å²	91.2	70%	0.698	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-62.4	-37.1	176.5	-59.1	172.2	176.8	176.5	1.6	111.4	Y681 D714 L718 F719	Y681-R716 VanDerWaalsContact OH-CG 3.29Å; Y681-R716 WeakPolarHBondContact OH-CG 3.37Å; D714-R716 PolarHBondContact O-N 3.34Å; D714-R716 VanDerWaalsContact O-N 3.09Å; D714-R716 WeakPolarHBondContact OD1-CB 3.37Å; D714-R716 VanDerWaalsContact OD1-CG 3.3Å; D714-R716 WeakPolarHBondContact OD1-CG 3.47Å; D714-R716 PolarHBondContact OD1-N 2.69Å; R716-L718 PolarHBondContact O-N 2.95Å; R716-F719 PolarHBondContact O-N 2.8Å
717	K	91.6	Very high	89.2	Confident	140 Å²	140	87.6 Å²	87.6	61%	0.609	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-66.7	-17.3	178.3	-61.2	177.7	-172.5	174.3	0	112.9	K666 V713 D714 P715 F719	K666-K717 PolarHBondContact NZ-O 3.47Å; V713-K717 HydrophobicContact CG1-CB 4.22Å; V713-K717 HydrophobicContact CG1-CD 4.47Å; D714-K717 HydrophobicContact CB-CD 4.01Å; D714-K717 HydrophobicContact CB-CG 4.11Å; D714-K717 WeakPolarHBondContact O-CB 3.43Å; D714-K717 PolarHBondContact O-N 3.49Å; P715-K717 VanDerWaalsContact C-N 3.29Å; P715-K717 PolarHBondContact O-N 3.3Å; K717-F719 VanDerWaalsContact C-N 3.31Å
718	L	92.4	Very high	90.2	Very high	8 Å²	8	82.1 Å²	82.1	4%	0.042	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-79.3	-13.6	179	-53.5	179.9	0	0	0	113.2	P658 K666 F687 V702 I704 V713 P715 R716	P658-L718 HydrophobicContact CB-CB 3.9Å; P658-L718 HydrophobicContact CB-CD1 3.92Å; P658-L718 HydrophobicContact CG-CB 3.78Å; P658-L718 HydrophobicContact CG-CD1 4.26Å; K666-L718 WeakPolarHBondContact CD-O 3.41Å; K666-L718 WeakPolarHBondContact CE-O 3.12Å; K666-L718 VanDerWaalsContact CG-O 3.29Å; K666-L718 WeakPolarHBondContact CG-O 3.27Å; F687-L718 HydrophobicContact CE1-CD1 4.25Å; F687-L718 HydrophobicContact CZ-CD1 4.1Å; V702-L718 HydrophobicContact CG2-CD1 3.81Å; I704-L718 HydrophobicContact CD1-CD1 4.16Å; I704-L718 HydrophobicContact CD1-CD2 3.63Å; I704-L718 HydrophobicContact CG2-CD1 3.96Å; V713-L718 HydrophobicContact CB-CD2 4.27Å; V713-L718 HydrophobicContact CG1-CD2 4.01Å; P715-L718 WeakPolarHBondContact O-CB 3.35Å; P715-L718 PolarHBondContact O-N 2.97Å; P715-L718 VanDerWaalsContact O-N 3.14Å; R716-L718 PolarHBondContact O-N 2.95Å
719	F	95.9	Very high	91.2	Very high	22 Å²	22	76 Å²	76	10%	0.096	37%	0.368	C	S	.	.			trans	-94	153.5	175.8	-67.1	-86	0	0	0	112.3	Q656 A657 P658 K666 F674 H677 Y678 Y681 L686 P715 R716 K717	Q656-F719 CarbonylContact O-C 3.5Å; Q656-F719 WeakPolarHBondContact O-CA 3.37Å; A657-F719 HydrophobicContact CB-CD1 4.02Å; A657-F719 HydrophobicContact CB-CE1 3.93Å; P658-F719 VanDerWaalsContact CD-CZ 3.5Å; P658-F719 HydrophobicContact CG-CE1 4.31Å; P658-F719 HydrophobicContact CG-CE2 3.89Å; P658-F719 HydrophobicContact CG-CZ 3.73Å; K666-F719 PolarHBondContact NZ-O 2.97Å; F674-F719 HydrophobicContact CD2-CD1 4.39Å; F674-F719 HydrophobicContact CE2-CB 3.98Å; F674-F719 AromaticContact CE2-CD1 3.72Å; F674-F719 HydrophobicContact CE2-CD1 3.72Å; F674-F719 HydrophobicContact CE2-CG 4.34Å; F674-F719 HydrophobicContact CZ-CB 4.26Å; F674-F719 HydrophobicContact CZ-CD1 4.18Å; H677-F719 HydrophobicContact CB-CE1 4.41Å; Y678-F719 AromaticContact CD2-CD1 3.84Å; Y678-F719 HydrophobicContact CD2-CD1 3.84Å; Y678-F719 HydrophobicContact CD2-CD2 4.37Å; Y678-F719 HydrophobicContact CD2-CE1 4.03Å; Y678-F719 HydrophobicContact CD2-CG 4.03Å; Y678-F719 HydrophobicContact CD2-CZ 4.39Å; Y678-F719 HydrophobicContact CG-CD1 4.45Å; Y681-F719 HydrophobicContact CD1-CD2 4.26Å; Y681-F719 AromaticContact CD1-CE2 3.66Å; Y681-F719 HydrophobicContact CD1-CE2 3.66Å; Y681-F719 HydrophobicContact CD1-CZ 4.13Å; Y681-F719 HydrophobicContact CD2-CE2 4.36Å; Y681-F719 HydrophobicContact CE1-CE2 4.32Å; Y681-F719 AromaticContact CG-CE2 3.69Å; Y681-F719 HydrophobicContact CG-CE2 3.69Å; Y681-F719 AromaticContact CG-CZ 3.96Å; Y681-F719 HydrophobicContact CG-CZ 3.96Å; L686-F719 HydrophobicContact CD2-CZ 3.84Å; P715-F719 WeakPolarHBondContact O-CD2 3.35Å; R716-F719 PolarHBondContact O-N 2.8Å; K717-F719 VanDerWaalsContact C-N 3.31Å
720	K	96.8	Very high	91.6	Very high	133 Å²	133	71.7 Å²	71.7	58%	0.578	34%	0.342	S	S	*	.	B	Isolated β-bridge	trans	-153.4	115.5	161.9	-177	172.9	-178.7	169.8	0	107.9	G655 Q656 F674	G655-K720 CarbonylContact C-O 3.44Å; G655-K720 WeakPolarHBondContact CA-O 3.43Å; Q656-K720 HydrophobicContact CB-CB 4.05Å; Q656-K720 HydrophobicContact CG-CB 4.31Å; Q656-K720 PolarHBondContact N-O 2.85Å; Q656-K720 PolarHBondContact O-N 3.22Å; F674-K720 VanDerWaalsContact CE2-C 3.45Å; F674-K720 VanDerWaalsContact CE2-O 3.3Å; F674-K720 WeakPolarHBondContact CE2-O 3.46Å
721	A	94.7	Very high	91.5	Very high	57 Å²	57	69.5 Å²	69.5	47%	0.471	34%	0.336	S	S	.	.			trans	-63.6	147.5	-179.4	0	0	0	0	0	111.7	F674	F674-A721 HydrophobicContact CE1-CB 3.87Å; F674-A721 HydrophobicContact CZ-CB 3.9Å
722	P	96.3	Very high	90.6	Very high	9 Å²	9	65.6 Å²	65.6	6%	0.058	32%	0.32	C	S	.	.			trans	-65.1	164.7	161.6	32.5	-37.2	0	0	0	110.6	F652 Y725	F652-P722 WeakPolarHBondContact O-CB 3.32Å; P722-Y725 HydrophobicContact CG-CD2 4.4Å
723	V	95.7	Very high	89.5	Confident	113 Å²	113	68 Å²	68	69%	0.685	33%	0.329	S	S	*	.	S	Bend	trans	-71.5	-44.4	168.1	179.8	0	0	0	0	109.8	F652 Y725	F652-V723 HydrophobicContact CB-CB 4.23Å; F652-V723 HydrophobicContact CD1-CB 4.41Å; F652-V723 HydrophobicContact CD1-CG2 4.38Å; F652-V723 PolarHBondContact O-N 3.06Å; V723-Y725 VanDerWaalsContact C-N 3.25Å; V723-Y725 PolarHBondContact O-N 2.8Å
724	N	94.6	Very high	88.5	Confident	33 Å²	33	71.8 Å²	71.8	18%	0.176	35%	0.346	C	S	.	.	S	Bend	trans	-88.1	65.6	178	-62.2	12.6	0	0	0	109.5	F652 C653 S671 F727	F652-N724 PolarHBondContact O-N 2.62Å; C653-N724 PolarHBondContact SG-ND2 3.45Å; C653-N724 VanDerWaalsContact SG-ND2 3.45Å; S671-N724 VanDerWaalsContact CB-O 3.3Å; S671-N724 WeakPolarHBondContact CB-O 3.15Å; S671-N724 PolarHBondContact OG-O 2.93Å; N724-F727 HydrophobicContact CB-CD1 4.23Å; N724-F727 HydrophobicContact CB-CD2 3.8Å; N724-F727 HydrophobicContact CB-CE1 4.31Å; N724-F727 HydrophobicContact CB-CE2 3.89Å; N724-F727 HydrophobicContact CB-CG 4Å; N724-F727 HydrophobicContact CB-CZ 4.15Å
725	Y	92	Very high	87.5	Confident	122 Å²	122	71.6 Å²	71.6	48%	0.478	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	152.3	178.4	-178	-94.6	0	0	0	112.1	S671 F674 D675 P722 V723 F727	S671-Y725 WeakPolarHBondContact OG-CA 3.43Å; F674-Y725 AromaticContact CD1-CD2 3.95Å; F674-Y725 HydrophobicContact CD1-CD2 3.95Å; F674-Y725 AromaticContact CD1-CE2 3.7Å; F674-Y725 HydrophobicContact CD1-CE2 3.7Å; F674-Y725 HydrophobicContact CE1-CD2 4.08Å; F674-Y725 AromaticContact CE1-CE2 3.73Å; F674-Y725 HydrophobicContact CE1-CE2 3.73Å; D675-Y725 WeakPolarHBondContact OD1-CE2 3.47Å; P722-Y725 HydrophobicContact CG-CD2 4.4Å; V723-Y725 VanDerWaalsContact C-N 3.25Å; V723-Y725 PolarHBondContact O-N 2.8Å; Y725-F727 WeakPolarHBondContact O-CD1 3.41Å; Y725-F727 PolarHBondContact O-N 3.12Å; Y725-F727 VanDerWaalsContact O-N 3.17Å
726	G	90.1	Very high	86.7	Confident	32 Å²	32	77.4 Å²	77.4	33%	0.33	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	-12.4	-176.9	0	0	0	0	0	116	S671 R728	S671-G726 PolarHBondContact OG-N 3.29Å; G726-R728 PolarHBondContact O-NH1 3.44Å
727	F	94.3	Very high	85.8	Confident	66 Å²	66	71.8 Å²	71.8	29%	0.289	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-64.4	141.8	-176.9	-78.5	30.7	0	0	0	111.4	M626 E627 C629 E672 N724 Y725	M626-F727 HydrophobicContact CB-CB 4.28Å; M626-F727 HydrophobicContact CB-CD2 4.29Å; M626-F727 HydrophobicContact CE-CB 4.21Å; M626-F727 WeakPolarHBondContact CE-O 3.44Å; E627-F727 WeakPolarHBondContact O-CD2 3.32Å; C629-F727 HydrophobicContact CB-CD2 4.12Å; C629-F727 HydrophobicContact CB-CE2 4.07Å; E672-F727 PolarHBondContact N-O 3.39Å; N724-F727 HydrophobicContact CB-CD1 4.23Å; N724-F727 HydrophobicContact CB-CD2 3.8Å; N724-F727 HydrophobicContact CB-CE1 4.31Å; N724-F727 HydrophobicContact CB-CE2 3.89Å; N724-F727 HydrophobicContact CB-CG 4Å; N724-F727 HydrophobicContact CB-CZ 4.15Å; Y725-F727 WeakPolarHBondContact O-CD1 3.41Å; Y725-F727 PolarHBondContact O-N 3.12Å; Y725-F727 VanDerWaalsContact O-N 3.17Å
728	R	92.9	Very high	85	Confident	110 Å²	110	68.8 Å²	68.8	42%	0.415	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-103.3	163.6	-177.2	-66.6	-71.4	168.5	-99.6	4	112.3	M626 E627 E672 D675 G726 R730	M626-R728 WeakPolarHBondContact CA-O 3.37Å; M626-R728 VanDerWaalsContact CE-C 3.49Å; M626-R728 WeakPolarHBondContact CE-O 3.44Å; E627-R728 PolarHBondContact N-O 3.37Å; E672-R728 WeakPolarHBondContact OE2-CD 3.37Å; D675-R728 IonicContact OD2-CZ 3.51Å; D675-R728 IonicContact OD2-NH1 3.46Å; D675-R728 PolarHBondContact OD2-NH1 2.98Å; D675-R728 IonicContact OD2-NH2 2.73Å; D675-R728 PolarHBondContact OD2-NH2 2.71Å; G726-R728 PolarHBondContact O-NH1 3.44Å; R728-R730 PolarHBondContact O-N 3.18Å
729	H	90.4	Very high	84.5	Confident	33 Å²	33	69 Å²	69	15%	0.153	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-63.6	129.6	169.8	-64.3	121	0	0	0	110.5	C645 W647 C670 E672	C645-H729 PolarHBondContact SG-NE2 2.82Å; W647-H729 AromaticContact CD1-CD2 3.92Å; W647-H729 AromaticContact CD1-NE2 3.91Å; W647-H729 HydrophobicContact CD2-CB 4.16Å; W647-H729 AromaticContact CD2-CD2 3.19Å; W647-H729 AromaticContact CD2-CG 3.8Å; W647-H729 AromaticContact CD2-NE2 3.95Å; W647-H729 AromaticContact CE2-CD2 3.69Å; W647-H729 AromaticContact CE2-CG 3.84Å; W647-H729 HydrophobicContact CE3-CB 3.95Å; W647-H729 AromaticContact CE3-CD2 3.44Å; W647-H729 VanDerWaalsContact CE3-CD2 3.44Å; W647-H729 AromaticContact CE3-CG 3.98Å; W647-H729 AromaticContact CG-CD2 3.42Å; W647-H729 VanDerWaalsContact CG-CD2 3.42Å; W647-H729 AromaticContact CG-NE2 3.66Å; W647-H729 HydrophobicContact CH2-CB 3.69Å; W647-H729 HydrophobicContact CZ2-CB 3.85Å; W647-H729 HydrophobicContact CZ3-CB 3.72Å; C670-H729 PolarHBondContact SG-NE2 3.24Å; E672-H729 VanDerWaalsContact CD-CE1 3.45Å; E672-H729 IonicContact OE1-CE1 2.81Å; E672-H729 PolarHBondContact OE1-CE1 2.88Å; E672-H729 IonicContact OE1-ND1 3.19Å; E672-H729 PolarHBondContact OE1-ND1 3.21Å; E672-H729 IonicContact OE2-CE1 3.67Å; E672-H729 IonicContact OE2-CG 2.88Å; E672-H729 PolarHBondContact OE2-N 3.28Å; E672-H729 VanDerWaalsContact OE2-N 3.16Å; E672-H729 IonicContact OE2-ND1 3.63Å; E672-H729 PolarHBondContact OE2-ND1 2.85Å
730	R	85	Confident	83.9	Confident	37 Å²	37	70.6 Å²	70.6	14%	0.14	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-61.6	138.9	178.5	-179	-168.8	-63	-175.4	-10.8	111.2	E623 C624 L625 W647 R728 V732 L774	E623-R730 IonicContact OE1-CZ 3.43Å; E623-R730 IonicContact OE1-NH1 3.61Å; E623-R730 PolarHBondContact OE1-NH1 2.71Å; E623-R730 IonicContact OE1-NH2 2.78Å; E623-R730 PolarHBondContact OE1-NH2 2.79Å; C624-R730 PolarHBondContact O-NH2 3.47Å; L625-R730 WeakPolarHBondContact O-CB 3.18Å; L625-R730 PolarHBondContact O-N 2.84Å; L625-R730 VanDerWaalsContact O-N 3.15Å; W647-R730 VanDerWaalsContact CH2-O 3.29Å; W647-R730 WeakPolarHBondContact CH2-O 3.24Å; W647-R730 HydrophobicContact CZ3-CB 4.44Å; R728-R730 PolarHBondContact O-N 3.18Å; R730-V732 PolarHBondContact O-N 2.94Å; R730-V732 VanDerWaalsContact O-N 3.12Å; R730-L774 PolarHBondContact NH1-O 2.83Å
731	N	79.9	Confident	83.5	Confident	82 Å²	82	64.8 Å²	64.8	44%	0.439	33%	0.333	S	S	.	.			trans	-64.3	114.4	172	-165.7	-8	0	0	0	111.3	E733 E734	N731-E733 PolarHBondContact OD1-N 3.45Å; N731-E734 HydrophobicContact CB-CB 4.49Å; N731-E734 VanDerWaalsContact ND2-CB 3.28Å; N731-E734 WeakPolarHBondContact ND2-CB 3.16Å; N731-E734 PolarHBondContact ND2-OE2 2.86Å; N731-E734 PolarHBondContact OD1-N 3.32Å
732	V	70.5	Confident	83.2	Confident	35 Å²	35	64.3 Å²	64.3	21%	0.212	32%	0.32	C	S	.	.			trans	-93.8	-29.6	-178.3	158.2	0	0	0	0	112.1	W647 R730 L774	W647-V732 HydrophobicContact CH2-CG2 3.89Å; W647-V732 HydrophobicContact CZ3-CG2 4.48Å; R730-V732 PolarHBondContact O-N 2.94Å; R730-V732 VanDerWaalsContact O-N 3.12Å; V732-L774 HydrophobicContact CB-CD2 4.26Å; V732-L774 HydrophobicContact CG1-CD1 4.48Å; V732-L774 HydrophobicContact CG1-CD2 3.44Å; V732-L774 VanDerWaalsContact CG1-CD2 3.44Å; V732-L774 HydrophobicContact CG2-CD1 4.07Å; V732-L774 HydrophobicContact CG2-CD2 3.95Å
733	E	66.9	Low	82.7	Confident	147 Å²	147	64.6 Å²	64.6	69%	0.687	33%	0.325	S	S	*	.	S	Bend	trans	-85.2	-34.1	-166.5	-64	176.3	165.3	0	0	111.6	N731 K735 R736 A737	N731-E733 PolarHBondContact OD1-N 3.45Å; E733-K735 VanDerWaalsContact C-N 3.33Å; E733-K735 PolarHBondContact O-N 2.82Å; E733-R736 WeakPolarHBondContact O-CB 3.37Å; E733-R736 PolarHBondContact O-N 3.39Å; E733-A737 PolarHBondContact O-N 2.81Å
734	E	71.8	Confident	82.4	Confident	95 Å²	95	64.1 Å²	64.1	44%	0.444	31%	0.31	S	S	.	.	H	α-helix	trans	-56	-41.2	175.5	175.5	171.5	-168.4	0	0	113.4	N731 R736 A737 Q738	N731-E734 HydrophobicContact CB-CB 4.49Å; N731-E734 VanDerWaalsContact ND2-CB 3.28Å; N731-E734 WeakPolarHBondContact ND2-CB 3.16Å; N731-E734 PolarHBondContact ND2-OE2 2.86Å; N731-E734 PolarHBondContact OD1-N 3.32Å; E734-R736 PolarHBondContact O-N 3.34Å; E734-A737 PolarHBondContact O-N 2.9Å; E734-A737 VanDerWaalsContact O-N 3.08Å; E734-Q738 VanDerWaalsContact CG-NE2 3.35Å; E734-Q738 PolarHBondContact O-N 3.19Å; E734-Q738 PolarHBondContact OE1-NE2 3.06Å
735	K	68.7	Low	82.3	Confident	41 Å²	41	62.5 Å²	62.5	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-58.2	-32.7	175.5	-175.2	-177.5	177.3	-174.4	0	112.5	E733 L759 E773 D775	E733-K735 VanDerWaalsContact C-N 3.33Å; E733-K735 PolarHBondContact O-N 2.82Å; K735-L759 HydrophobicContact CG-CD2 4.06Å; K735-E773 PolarHBondContact NZ-O 3.17Å; K735-D775 PolarHBondContact NZ-O 2.77Å
736	R	70.3	Confident	82.2	Confident	126 Å²	126	58.5 Å²	58.5	48%	0.475	29%	0.286	S	S	.	.	H	α-helix	trans	-80.8	-41.4	173.9	-68.6	178.6	174.4	167.9	-4.6	111.2	E733 E734 Q738 S739 F742 E773	E733-R736 WeakPolarHBondContact O-CB 3.37Å; E733-R736 PolarHBondContact O-N 3.39Å; E734-R736 PolarHBondContact O-N 3.34Å; R736-Q738 VanDerWaalsContact C-N 3.29Å; R736-Q738 PolarHBondContact O-N 3.39Å; R736-S739 PolarHBondContact O-N 3.07Å; R736-S739 PolarHBondContact O-OG 2.96Å; R736-F742 HydrophobicContact CG-CD1 4.19Å; R736-F742 HydrophobicContact CG-CE1 4.48Å; R736-E773 IonicContact CZ-OE1 2.71Å; R736-E773 IonicContact NE-OE1 3.52Å; R736-E773 IonicContact NH2-OE1 3.74Å; R736-E773 PolarHBondContact NH2-OE1 2.87Å
737	A	71.1	Confident	82.2	Confident	67 Å²	67	58.2 Å²	58.2	55%	0.554	28%	0.277	S	S	*	.	H	α-helix	trans	-59	-37	-179.8	0	0	0	0	0	113.1	E733 E734 S739 R762	E733-A737 PolarHBondContact O-N 2.81Å; E734-A737 PolarHBondContact O-N 2.9Å; E734-A737 VanDerWaalsContact O-N 3.08Å; A737-S739 VanDerWaalsContact C-N 3.26Å; A737-S739 PolarHBondContact O-N 2.89Å; A737-R762 PolarHBondContact O-NH1 3.2Å
738	Q	73.9	Confident	81.8	Confident	76 Å²	76	60.8 Å²	60.8	36%	0.355	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-1.3	177.1	-67.2	169.9	2.3	0	0	114.3	E734 R736 R762	E734-Q738 VanDerWaalsContact CG-NE2 3.35Å; E734-Q738 PolarHBondContact O-N 3.19Å; E734-Q738 PolarHBondContact OE1-NE2 3.06Å; R736-Q738 VanDerWaalsContact C-N 3.29Å; R736-Q738 PolarHBondContact O-N 3.39Å; Q738-R762 WeakPolarHBondContact O-CB 3.45Å; Q738-R762 PolarHBondContact O-N 3.22Å
739	S	83.1	Confident	81	Confident	14 Å²	14	59.1 Å²	59.1	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	146.5	-179.8	72.3	0	0	0	0	113.4	R736 A737 L760 R762	R736-S739 PolarHBondContact O-N 3.07Å; R736-S739 PolarHBondContact O-OG 2.96Å; A737-S739 VanDerWaalsContact C-N 3.26Å; A737-S739 PolarHBondContact O-N 2.89Å; S739-L760 CarbonylContact C-O 3.43Å; S739-L760 WeakPolarHBondContact CA-O 3.25Å; S739-R762 PolarHBondContact O-NH2 2.88Å
740	I	83.9	Confident	79.7	Confident	54 Å²	54	65.3 Å²	65.3	28%	0.277	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-49	166.7	-56.6	-176.5	0	0	0	109.2	L760 R762 L765 A834 K838	I740-L760 HydrophobicContact CB-CD2 4.45Å; I740-L760 HydrophobicContact CB-CG 4.39Å; I740-L760 HydrophobicContact CD1-CD2 4.11Å; I740-L760 HydrophobicContact CD1-CG 4.16Å; I740-L760 HydrophobicContact CG1-CG 4.49Å; I740-L760 PolarHBondContact N-O 2.94Å; I740-R762 HydrophobicContact CG1-CB 3.92Å; I740-R762 HydrophobicContact CG1-CG 4.22Å; I740-L765 HydrophobicContact CD1-CD2 3.95Å; I740-A834 HydrophobicContact CG2-CB 3.82Å; I740-K838 HydrophobicContact CD1-CG 4.44Å
741	V	87.3	Confident	78.6	Confident	12 Å²	12	73.2 Å²	73.2	7%	0.073	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.3	172.5	58.7	0	0	0	0	108.5	L759 L760 K830 W831 A834	V741-L759 CarbonylContact O-C 3.54Å; V741-L759 WeakPolarHBondContact O-CA 3.26Å; V741-L760 HydrophobicContact CG1-CB 3.93Å; V741-L760 PolarHBondContact O-N 3.46Å; V741-K830 HydrophobicContact CG2-CB 4.11Å; V741-W831 HydrophobicContact CG1-CD2 3.94Å; V741-W831 HydrophobicContact CG1-CE3 3.53Å; V741-W831 HydrophobicContact CG1-CH2 3.99Å; V741-W831 HydrophobicContact CG1-CZ2 4.36Å; V741-W831 HydrophobicContact CG1-CZ3 3.56Å; V741-W831 HydrophobicContact CG2-CD2 3.91Å; V741-W831 HydrophobicContact CG2-CE3 4.38Å; V741-W831 HydrophobicContact CG2-CG 4.17Å; V741-W831 HydrophobicContact CG2-CZ2 4.27Å; V741-A834 HydrophobicContact CB-CB 3.95Å; V741-A834 HydrophobicContact CG1-CB 3.55Å
742	F	88.5	Confident	78.5	Confident	47 Å²	47	73.5 Å²	73.5	21%	0.206	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	139.1	172.5	173.8	-118.1	0	0	0	109.7	R736 H757 A758 L759 E773	R736-F742 HydrophobicContact CG-CD1 4.19Å; R736-F742 HydrophobicContact CG-CE1 4.48Å; F742-H757 HydrophobicContact CE2-CB 3.86Å; F742-H757 HydrophobicContact CZ-CB 4.06Å; F742-A758 WeakPolarHBondContact CA-O 3.38Å; F742-A758 VanDerWaalsContact CD2-O 3.24Å; F742-A758 WeakPolarHBondContact CD2-O 3.14Å; F742-L759 HydrophobicContact CB-CB 4.09Å; F742-L759 HydrophobicContact CD2-CB 3.74Å; F742-L759 HydrophobicContact CD2-CD2 4.39Å; F742-L759 HydrophobicContact CG-CB 4.34Å; F742-E773 HydrophobicContact CE1-CG 4.04Å; F742-E773 WeakPolarHBondContact CE1-OE1 3.45Å; F742-E773 HydrophobicContact CZ-CB 4.42Å; F742-E773 HydrophobicContact CZ-CG 3.92Å
743	G	85.9	Confident	79.2	Confident	15 Å²	15	75.5 Å²	75.5	16%	0.155	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	173.3	176.4	0	0	0	0	0	114.5	H757 A758	G743-H757 CarbonylContact O-C 3.59Å; G743-H757 WeakPolarHBondContact O-CA 3.21Å; G743-A758 PolarHBondContact N-O 3.47Å; G743-A758 PolarHBondContact O-N 3.19Å
744	R	89.3	Confident	80.2	Confident	102 Å²	102	70.6 Å²	70.6	39%	0.385	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.8	169.4	178.4	171	165.3	-87.7	-4	109.5	Y746 V755 R756 D823	R744-Y746 PolarHBondContact NH1-OH 3.29Å; R744-Y746 VanDerWaalsContact NH1-OH 3.1Å; R744-Y746 VanDerWaalsContact NH2-CZ 3.34Å; R744-Y746 PolarHBondContact NH2-OH 3.27Å; R744-V755 HydrophobicContact CG-CG1 3.95Å; R744-R756 WeakPolarHBondContact CA-O 3.49Å; R744-D823 IonicContact CZ-OD2 2.61Å; R744-D823 IonicContact NH1-OD1 2.77Å; R744-D823 IonicContact NH1-OD2 3.8Å; R744-D823 PolarHBondContact NH1-OD2 3.1Å
745	V	91.9	Very high	81	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.4	-178.9	-56.7	0	0	0	0	110.7	R756 A758 F769 F820 V822 W831	V745-R756 HydrophobicContact CG2-CB 4.16Å; V745-R756 PolarHBondContact N-O 3.44Å; V745-R756 PolarHBondContact O-N 3.11Å; V745-R756 VanDerWaalsContact O-O 3.12Å; V745-A758 HydrophobicContact CG1-CB 4.09Å; V745-A758 HydrophobicContact CG2-CB 3.66Å; V745-F769 HydrophobicContact CG2-CD1 4.05Å; V745-F769 HydrophobicContact CG2-CE1 3.97Å; V745-F820 HydrophobicContact CB-CD2 3.81Å; V745-F820 HydrophobicContact CB-CE2 4.47Å; V745-F820 HydrophobicContact CB-CG 4.47Å; V745-F820 HydrophobicContact CG1-CD2 3.77Å; V745-F820 HydrophobicContact CG1-CE2 3.93Å; V745-F820 HydrophobicContact CG2-CD2 4.35Å; V745-V822 HydrophobicContact CG1-CG2 4.24Å; V745-W831 HydrophobicContact CG1-CZ2 3.89Å
746	Y	91.5	Very high	82.1	Confident	38 Å²	38	69.9 Å²	69.9	15%	0.149	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	94.6	173.6	-57.6	-105.6	0	0	0	107.5	R744 R748 V755 F820 R821 D823	R744-Y746 PolarHBondContact NH1-OH 3.29Å; R744-Y746 VanDerWaalsContact NH1-OH 3.1Å; R744-Y746 VanDerWaalsContact NH2-CZ 3.34Å; R744-Y746 PolarHBondContact NH2-OH 3.27Å; Y746-R748 PolarHBondContact O-N 3.35Å; Y746-V755 HydrophobicContact CD1-CG2 3.95Å; Y746-V755 HydrophobicContact CE1-CG2 3.9Å; Y746-F820 CarbonylContact O-C 3.5Å; Y746-F820 VanDerWaalsContact O-CA 3.24Å; Y746-F820 WeakPolarHBondContact O-CA 3.39Å; Y746-R821 PolarHBondContact N-O 3.07Å; Y746-R821 PolarHBondContact O-N 2.73Å; Y746-D823 HydrophobicContact CE2-CB 3.71Å; Y746-D823 VanDerWaalsContact CE2-CG 3.5Å; Y746-D823 VanDerWaalsContact CE2-OD2 3.23Å; Y746-D823 WeakPolarHBondContact CE2-OD2 3.35Å; Y746-D823 PolarHBondContact OH-OD2 2.61Å
747	L	89.3	Confident	83.1	Confident	25 Å²	25	65.6 Å²	65.6	13%	0.131	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	117.3	178.3	179.1	61.9	0	0	0	108.6	T754 R756 F769 L780 F820	L747-T754 PolarHBondContact N-O 3.34Å; L747-T754 PolarHBondContact O-N 3.16Å; L747-T754 PolarHBondContact O-OG1 3.32Å; L747-R756 HydrophobicContact CB-CG 3.9Å; L747-R756 HydrophobicContact CD2-CG 4.19Å; L747-F769 HydrophobicContact CB-CD1 4.47Å; L747-F769 HydrophobicContact CB-CE1 4.47Å; L747-F769 HydrophobicContact CD1-CD1 4.36Å; L747-F769 HydrophobicContact CD1-CE1 3.84Å; L747-F769 HydrophobicContact CD1-CZ 3.99Å; L747-F769 HydrophobicContact CD2-CD1 4.15Å; L747-F769 HydrophobicContact CD2-CE1 4.45Å; L747-F769 HydrophobicContact CD2-CG 4.34Å; L747-F769 HydrophobicContact CG-CE1 4.48Å; L747-L780 HydrophobicContact CD2-CD2 4.46Å; L747-F820 HydrophobicContact CD1-CB 4.33Å
748	R	85.1	Confident	84	Confident	120 Å²	120	62.4 Å²	62.4	45%	0.453	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.1	-173.3	-169.1	177.7	-173	-174.1	4.6	109.9	Y746 E753 S819	Y746-R748 PolarHBondContact O-N 3.35Å; R748-E753 HydrophobicContact CB-CG 4.34Å; R748-E753 HydrophobicContact CG-CG 4.18Å; R748-S819 WeakPolarHBondContact CB-O 3.24Å; R748-S819 PolarHBondContact N-O 2.84Å
749	S	76.9	Confident	84.8	Confident	76 Å²	76	59 Å²	59	53%	0.531	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	166.8	168.8	-168.3	0	0	0	0	109.4	K751 T752	S749-K751 PolarHBondContact O-N 3.47Å; S749-T752 WeakPolarHBondContact CA-O 3.38Å; S749-T752 WeakPolarHBondContact CB-O 3.42Å; S749-T752 PolarHBondContact N-O 2.84Å; S749-T752 PolarHBondContact O-N 2.77Å
750	R	62.6	Low	85.2	Confident	163 Å²	163	58.4 Å²	58.4	62%	0.615	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-10.7	-171.2	-62.1	-175.6	179.9	-157.1	-1.4	115.6	D815	R750-D815 PolarHBondContact NH2-O 3.23Å
751	K	62.3	Low	85.3	Confident	202 Å²	202	58 Å²	58	88%	0.878	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	-8.8	178.2	-61.6	-171.3	178.8	-175.3	0	115.1	S749	S749-K751 PolarHBondContact O-N 3.47Å
752	T	77	Confident	85.1	Confident	88 Å²	88	63.4 Å²	63.4	54%	0.54	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	147.1	-171.7	48.8	0	0	0	0	111.6	S749	S749-T752 WeakPolarHBondContact CA-O 3.38Å; S749-T752 WeakPolarHBondContact CB-O 3.42Å; S749-T752 PolarHBondContact N-O 2.84Å; S749-T752 PolarHBondContact O-N 2.77Å
753	E	85.2	Confident	84.8	Confident	77 Å²	77	66.8 Å²	66.8	36%	0.36	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	147.5	161.9	-69.5	-171.9	151.1	0	0	110.5	R748 R821	R748-E753 HydrophobicContact CB-CG 4.34Å; R748-E753 HydrophobicContact CG-CG 4.18Å; E753-R821 IonicContact OE1-CZ 2.91Å; E753-R821 IonicContact OE1-NE 2.72Å; E753-R821 PolarHBondContact OE1-NE 3.41Å; E753-R821 IonicContact OE1-NH2 2.65Å; E753-R821 IonicContact OE2-CZ 3.15Å; E753-R821 IonicContact OE2-NE 2.73Å; E753-R821 PolarHBondContact OE2-NE 2.73Å; E753-R821 IonicContact OE2-NH2 3.37Å; E753-R821 PolarHBondContact OE2-NH2 2.93Å
754	T	88.1	Confident	84.7	Confident	44 Å²	44	68.3 Å²	68.3	27%	0.27	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.2	175.1	63.9	0	0	0	0	111.3	L747 R756	L747-T754 PolarHBondContact N-O 3.34Å; L747-T754 PolarHBondContact O-N 3.16Å; L747-T754 PolarHBondContact O-OG1 3.32Å; T754-R756 PolarHBondContact O-N 2.87Å; T754-R756 PolarHBondContact OG1-NH2 3.05Å
755	V	88.4	Confident	84.5	Confident	61 Å²	61	65.3 Å²	65.3	37%	0.37	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.2	176.4	-179.4	0	0	0	0	109.6	R744 Y746	R744-V755 HydrophobicContact CG-CG1 3.95Å; Y746-V755 HydrophobicContact CD1-CG2 3.95Å; Y746-V755 HydrophobicContact CE1-CG2 3.9Å
756	R	91.9	Very high	84.4	Confident	61 Å²	61	68.4 Å²	68.4	23%	0.23	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	167.2	176.5	-64.3	-64.9	177	-100.6	-0.4	109.6	R744 V745 L747 T754 F769 Y770	R744-R756 WeakPolarHBondContact CA-O 3.49Å; V745-R756 HydrophobicContact CG2-CB 4.16Å; V745-R756 PolarHBondContact N-O 3.44Å; V745-R756 PolarHBondContact O-N 3.11Å; V745-R756 VanDerWaalsContact O-O 3.12Å; L747-R756 HydrophobicContact CB-CG 3.9Å; L747-R756 HydrophobicContact CD2-CG 4.19Å; T754-R756 PolarHBondContact O-N 2.87Å; T754-R756 PolarHBondContact OG1-NH2 3.05Å; R756-F769 HydrophobicContact CB-CB 4.47Å; R756-F769 HydrophobicContact CB-CD1 4.23Å; R756-Y770 WeakPolarHBondContact CA-O 3.35Å; R756-Y770 VanDerWaalsContact CD-O 3.29Å; R756-Y770 WeakPolarHBondContact CD-O 3.28Å
757	H	90.8	Very high	84.3	Confident	36 Å²	36	66.6 Å²	66.6	17%	0.167	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.1	165.5	-64	81.6	0	0	0	107.8	F742 G743 F769 Y770	F742-H757 HydrophobicContact CE2-CB 3.86Å; F742-H757 HydrophobicContact CZ-CB 4.06Å; G743-H757 CarbonylContact O-C 3.59Å; G743-H757 WeakPolarHBondContact O-CA 3.21Å; H757-F769 CarbonylContact O-C 3.52Å; H757-F769 WeakPolarHBondContact O-CA 3.31Å; H757-Y770 PolarHBondContact N-O 3.4Å; H757-Y770 VanDerWaalsContact N-O 3.08Å; H757-Y770 PolarHBondContact O-N 3.16Å
758	A	90.9	Very high	84.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.3	-176.2	0	0	0	0	0	110.9	F742 G743 V745 V768 F769 W831	F742-A758 WeakPolarHBondContact CA-O 3.38Å; F742-A758 VanDerWaalsContact CD2-O 3.24Å; F742-A758 WeakPolarHBondContact CD2-O 3.14Å; G743-A758 PolarHBondContact N-O 3.47Å; G743-A758 PolarHBondContact O-N 3.19Å; V745-A758 HydrophobicContact CG1-CB 4.09Å; V745-A758 HydrophobicContact CG2-CB 3.66Å; A758-V768 CarbonylContact C-O 3.3Å; A758-V768 VanDerWaalsContact CA-O 3.27Å; A758-V768 WeakPolarHBondContact CA-O 3.2Å; A758-F769 HydrophobicContact CB-CD1 3.65Å; A758-F769 HydrophobicContact CB-CE1 3.79Å; A758-F769 HydrophobicContact CB-CG 4.32Å; A758-W831 HydrophobicContact CB-CH2 3.7Å; A758-W831 HydrophobicContact CB-CZ2 3.9Å; A758-W831 WeakPolarHBondContact O-CZ2 3.31Å
759	L	91	Very high	84.7	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	151.3	164.2	58.6	91	0	0	0	111.2	K735 V741 F742 R761 L767 V768 Y770	K735-L759 HydrophobicContact CG-CD2 4.06Å; V741-L759 CarbonylContact O-C 3.54Å; V741-L759 WeakPolarHBondContact O-CA 3.26Å; F742-L759 HydrophobicContact CB-CB 4.09Å; F742-L759 HydrophobicContact CD2-CB 3.74Å; F742-L759 HydrophobicContact CD2-CD2 4.39Å; F742-L759 HydrophobicContact CG-CB 4.34Å; L759-R761 HydrophobicContact CD1-CB 3.9Å; L759-L767 CarbonylContact O-C 3.53Å; L759-L767 WeakPolarHBondContact O-CA 3.31Å; L759-V768 HydrophobicContact CD1-CB 4.07Å; L759-V768 HydrophobicContact CD1-CG2 4.36Å; L759-V768 HydrophobicContact CG-CB 4.31Å; L759-V768 PolarHBondContact N-O 3.29Å; L759-V768 PolarHBondContact O-N 3.29Å; L759-Y770 HydrophobicContact CD2-CE2 3.66Å; L759-Y770 HydrophobicContact CG-CE2 4.01Å
760	L	90.3	Very high	85.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.5	156.8	176.1	55.7	0	0	0	108.1	S739 I740 V741 L765 I784	S739-L760 CarbonylContact C-O 3.43Å; S739-L760 WeakPolarHBondContact CA-O 3.25Å; I740-L760 HydrophobicContact CB-CD2 4.45Å; I740-L760 HydrophobicContact CB-CG 4.39Å; I740-L760 HydrophobicContact CD1-CD2 4.11Å; I740-L760 HydrophobicContact CD1-CG 4.16Å; I740-L760 HydrophobicContact CG1-CG 4.49Å; I740-L760 PolarHBondContact N-O 2.94Å; V741-L760 HydrophobicContact CG1-CB 3.93Å; V741-L760 PolarHBondContact O-N 3.46Å; L760-L765 HydrophobicContact CD1-CD2 4.48Å; L760-I784 HydrophobicContact CD1-CD1 3.54Å; L760-I784 HydrophobicContact CD1-CG1 4.03Å; L760-I784 HydrophobicContact CD2-CD1 3.96Å; L760-I784 HydrophobicContact CG-CD1 4.42Å
761	R	88.1	Confident	86.6	Confident	46 Å²	46	53.6 Å²	53.6	17%	0.174	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	139	178.4	-168.9	-178.9	-61	121.9	-2.4	110.1	L759 D764 L765 K766 E781	L759-R761 HydrophobicContact CD1-CB 3.9Å; R761-D764 WeakPolarHBondContact CB-OD1 3.33Å; R761-D764 WeakPolarHBondContact CD-OD1 3.45Å; R761-D764 IonicContact CZ-OD2 2.69Å; R761-D764 IonicContact NH1-OD1 2.65Å; R761-D764 PolarHBondContact NH1-OD1 2.83Å; R761-D764 IonicContact NH1-OD2 3.35Å; R761-D764 PolarHBondContact NH1-OD2 3.46Å; R761-L765 WeakPolarHBondContact O-CA 3.28Å; R761-L765 PolarHBondContact O-N 3.27Å; R761-K766 PolarHBondContact N-O 2.83Å; R761-E781 IonicContact NH1-OE2 2.66Å; R761-E781 IonicContact NH2-OE2 2.83Å
762	R	82.6	Confident	87.8	Confident	126 Å²	126	44.1 Å²	44.1	48%	0.475	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.2	-176.2	-174.2	178.2	-65.4	98.8	6.2	113.1	A737 Q738 S739 I740	A737-R762 PolarHBondContact O-NH1 3.2Å; Q738-R762 WeakPolarHBondContact O-CB 3.45Å; Q738-R762 PolarHBondContact O-N 3.22Å; S739-R762 PolarHBondContact O-NH2 2.88Å; I740-R762 HydrophobicContact CG1-CB 3.92Å; I740-R762 HydrophobicContact CG1-CG 4.22Å
763	D	82.3	Confident	88.2	Confident	117 Å²	117	41.9 Å²	41.9	63%	0.626	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-26.3	-161	-39	-58	0	0	0	113.4
764	D	83.8	Confident	88.2	Confident	47 Å²	47	39.1 Å²	39.1	25%	0.251	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129	5.5	-176.8	70.6	-2	0	0	0	114.3	R761 K766 L783	R761-D764 WeakPolarHBondContact CB-OD1 3.33Å; R761-D764 WeakPolarHBondContact CD-OD1 3.45Å; R761-D764 IonicContact CZ-OD2 2.69Å; R761-D764 IonicContact NH1-OD1 2.65Å; R761-D764 PolarHBondContact NH1-OD1 2.83Å; R761-D764 IonicContact NH1-OD2 3.35Å; R761-D764 PolarHBondContact NH1-OD2 3.46Å; D764-K766 PolarHBondContact O-N 2.85Å; D764-K766 VanDerWaalsContact O-N 3.16Å; D764-K766 WeakPolarHBondContact OD1-CB 3.06Å; D764-K766 PolarHBondContact OD1-N 3.12Å; D764-K766 WeakPolarHBondContact OD2-CD 3.49Å; D764-K766 WeakPolarHBondContact OD2-CE 3.35Å; D764-K766 WeakPolarHBondContact OD2-CG 3.31Å; D764-K766 IonicContact OD2-NZ 3.08Å; D764-K766 PolarHBondContact OD2-NZ 3.3Å; D764-L783 WeakPolarHBondContact O-CD1 3.25Å
765	L	85.3	Confident	88.3	Confident	39 Å²	39	37.2 Å²	37.2	20%	0.204	17%	0.173	C	C	.	.			trans	45.2	42.2	-174.7	-59.6	178.8	0	0	0	113.6	I740 L760 R761 I784 K838	I740-L765 HydrophobicContact CD1-CD2 3.95Å; L760-L765 HydrophobicContact CD1-CD2 4.48Å; R761-L765 WeakPolarHBondContact O-CA 3.28Å; R761-L765 PolarHBondContact O-N 3.27Å; L765-I784 HydrophobicContact CB-CG1 4.31Å; L765-I784 WeakPolarHBondContact O-CG1 3.4Å; L765-I784 PolarHBondContact O-N 3.32Å; L765-K838 HydrophobicContact CD1-CD 4.2Å; L765-K838 HydrophobicContact CD2-CD 3.99Å; L765-K838 HydrophobicContact CD2-CG 4.13Å
766	K	88.8	Confident	88.1	Confident	66 Å²	66	37.7 Å²	37.7	29%	0.287	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.9	166.8	-66.5	-169.2	-166.3	106.8	0	111.8	R761 D764 V768 L782 L783	R761-K766 PolarHBondContact N-O 2.83Å; D764-K766 PolarHBondContact O-N 2.85Å; D764-K766 VanDerWaalsContact O-N 3.16Å; D764-K766 WeakPolarHBondContact OD1-CB 3.06Å; D764-K766 PolarHBondContact OD1-N 3.12Å; D764-K766 WeakPolarHBondContact OD2-CD 3.49Å; D764-K766 WeakPolarHBondContact OD2-CE 3.35Å; D764-K766 WeakPolarHBondContact OD2-CG 3.31Å; D764-K766 IonicContact OD2-NZ 3.08Å; D764-K766 PolarHBondContact OD2-NZ 3.3Å; K766-V768 HydrophobicContact CB-CG2 3.87Å; K766-L782 CarbonylContact C-O 3.19Å; K766-L782 VanDerWaalsContact CA-O 3.25Å; K766-L782 WeakPolarHBondContact CA-O 3.36Å; K766-L783 HydrophobicContact CG-CD1 4.33Å
767	L	90.4	Very high	87.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.1	163.8	-179.8	62	0	0	0	108.2	L759 F769 L782 I784 L802 F820 W831	L759-L767 CarbonylContact O-C 3.53Å; L759-L767 WeakPolarHBondContact O-CA 3.31Å; L767-F769 HydrophobicContact CD1-CZ 4.45Å; L767-F769 HydrophobicContact CD2-CE2 3.92Å; L767-F769 HydrophobicContact CD2-CZ 3.85Å; L767-F769 HydrophobicContact CG-CE2 3.73Å; L767-F769 HydrophobicContact CG-CZ 3.95Å; L767-L782 PolarHBondContact N-O 2.95Å; L767-L782 PolarHBondContact O-N 2.9Å; L767-I784 HydrophobicContact CB-CG2 3.73Å; L767-I784 HydrophobicContact CD2-CG2 4.23Å; L767-L802 HydrophobicContact CD2-CD2 4.1Å; L767-F820 HydrophobicContact CD2-CE1 4.07Å; L767-W831 HydrophobicContact CD1-CH2 3.86Å; L767-W831 HydrophobicContact CD1-CZ3 3.62Å
768	V	91.3	Very high	87.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.9	-170.2	-179.4	0	0	0	0	111.1	A758 L759 K766 Y770 L780 E781	A758-V768 CarbonylContact C-O 3.3Å; A758-V768 VanDerWaalsContact CA-O 3.27Å; A758-V768 WeakPolarHBondContact CA-O 3.2Å; L759-V768 HydrophobicContact CD1-CB 4.07Å; L759-V768 HydrophobicContact CD1-CG2 4.36Å; L759-V768 HydrophobicContact CG-CB 4.31Å; L759-V768 PolarHBondContact N-O 3.29Å; L759-V768 PolarHBondContact O-N 3.29Å; K766-V768 HydrophobicContact CB-CG2 3.87Å; V768-Y770 HydrophobicContact CB-CE2 4.21Å; V768-Y770 HydrophobicContact CG1-CD2 4.31Å; V768-Y770 HydrophobicContact CG1-CE1 4.19Å; V768-Y770 HydrophobicContact CG1-CE2 3.54Å; V768-Y770 VanDerWaalsContact CG1-CZ 3.45Å; V768-Y770 WeakPolarHBondContact CG1-OH 3.41Å; V768-L780 WeakPolarHBondContact CA-O 3.37Å; V768-E781 HydrophobicContact CB-CG 4.41Å; V768-E781 HydrophobicContact CG1-CG 3.89Å; V768-E781 HydrophobicContact CG2-CB 4.19Å; V768-E781 HydrophobicContact CG2-CG 3.91Å
769	F	91.3	Very high	87.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.3	179.9	-58.2	-98.9	0	0	0	111.4	V745 L747 R756 H757 A758 L767 S778 V779 L780 I818 F820	V745-F769 HydrophobicContact CG2-CD1 4.05Å; V745-F769 HydrophobicContact CG2-CE1 3.97Å; L747-F769 HydrophobicContact CB-CD1 4.47Å; L747-F769 HydrophobicContact CB-CE1 4.47Å; L747-F769 HydrophobicContact CD1-CD1 4.36Å; L747-F769 HydrophobicContact CD1-CE1 3.84Å; L747-F769 HydrophobicContact CD1-CZ 3.99Å; L747-F769 HydrophobicContact CD2-CD1 4.15Å; L747-F769 HydrophobicContact CD2-CE1 4.45Å; L747-F769 HydrophobicContact CD2-CG 4.34Å; L747-F769 HydrophobicContact CG-CE1 4.48Å; R756-F769 HydrophobicContact CB-CB 4.47Å; R756-F769 HydrophobicContact CB-CD1 4.23Å; H757-F769 CarbonylContact O-C 3.52Å; H757-F769 WeakPolarHBondContact O-CA 3.31Å; A758-F769 HydrophobicContact CB-CD1 3.65Å; A758-F769 HydrophobicContact CB-CE1 3.79Å; A758-F769 HydrophobicContact CB-CG 4.32Å; L767-F769 HydrophobicContact CD1-CZ 4.45Å; L767-F769 HydrophobicContact CD2-CE2 3.92Å; L767-F769 HydrophobicContact CD2-CZ 3.85Å; L767-F769 HydrophobicContact CG-CE2 3.73Å; L767-F769 HydrophobicContact CG-CZ 3.95Å; F769-S778 CarbonylContact O-C 3.57Å; F769-S778 WeakPolarHBondContact O-CA 3.36Å; F769-V779 PolarHBondContact O-N 2.9Å; F769-L780 HydrophobicContact CB-CB 4.33Å; F769-L780 HydrophobicContact CD2-CB 3.93Å; F769-L780 HydrophobicContact CD2-CD2 3.84Å; F769-L780 HydrophobicContact CD2-CG 3.96Å; F769-L780 HydrophobicContact CE2-CD2 3.91Å; F769-L780 HydrophobicContact CE2-CG 4.37Å; F769-L780 HydrophobicContact CG-CB 4.5Å; F769-L780 PolarHBondContact N-O 3.26Å; F769-I818 HydrophobicContact CZ-CG2 4.34Å; F769-F820 HydrophobicContact CE1-CD1 4.3Å; F769-F820 HydrophobicContact CE1-CG 4.43Å; F769-F820 HydrophobicContact CZ-CD1 4.11Å
770	Y	91.3	Very high	87.1	Confident	14 Å²	14	46.6 Å²	46.6	6%	0.055	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	157.1	178	-59.3	-88.8	0	0	0	111.3	R756 H757 L759 V768 A772 D775 K777	R756-Y770 WeakPolarHBondContact CA-O 3.35Å; R756-Y770 VanDerWaalsContact CD-O 3.29Å; R756-Y770 WeakPolarHBondContact CD-O 3.28Å; H757-Y770 PolarHBondContact N-O 3.4Å; H757-Y770 VanDerWaalsContact N-O 3.08Å; H757-Y770 PolarHBondContact O-N 3.16Å; L759-Y770 HydrophobicContact CD2-CE2 3.66Å; L759-Y770 HydrophobicContact CG-CE2 4.01Å; V768-Y770 HydrophobicContact CB-CE2 4.21Å; V768-Y770 HydrophobicContact CG1-CD2 4.31Å; V768-Y770 HydrophobicContact CG1-CE1 4.19Å; V768-Y770 HydrophobicContact CG1-CE2 3.54Å; V768-Y770 VanDerWaalsContact CG1-CZ 3.45Å; V768-Y770 WeakPolarHBondContact CG1-OH 3.41Å; Y770-A772 VanDerWaalsContact CB-O 3.25Å; Y770-A772 WeakPolarHBondContact CB-O 3.42Å; Y770-D775 HydrophobicContact CD1-CB 4.44Å; Y770-D775 VanDerWaalsContact CD1-O 3.28Å; Y770-D775 WeakPolarHBondContact CD1-O 3.33Å; Y770-K777 WeakPolarHBondContact CD1-O 3.47Å
771	K	87.1	Confident	87	Confident	97 Å²	97	50.5 Å²	50.5	42%	0.422	25%	0.249	S	C	.	.	S	Bend	trans	-67.4	-53.5	174.1	-56.8	176.2	-171.9	167.9	0	109.7	N622 E632 D775 V779	N622-K771 VanDerWaalsContact ND2-CB 3.3Å; N622-K771 WeakPolarHBondContact ND2-CB 3.01Å; E632-K771 IonicContact OE2-NZ 2.88Å; E632-K771 PolarHBondContact OE2-NZ 2.84Å; K771-D775 WeakPolarHBondContact CB-OD2 3.31Å; K771-V779 HydrophobicContact CB-CG2 4.34Å; K771-V779 HydrophobicContact CG-CG2 3.43Å; K771-V779 VanDerWaalsContact CG-CG2 3.43Å
772	A	87.3	Confident	86.9	Confident	3 Å²	3	49.6 Å²	49.6	3%	0.025	25%	0.248	C	C	.	.	S	Bend	trans	-124.7	172.1	172.6	0	0	0	0	0	112	N619 N622 Y770 D775	N619-A772 VanDerWaalsContact O-CB 3.24Å; N619-A772 WeakPolarHBondContact O-CB 3.22Å; N622-A772 VanDerWaalsContact ND2-CB 3.26Å; N622-A772 WeakPolarHBondContact ND2-CB 3.21Å; N622-A772 PolarHBondContact ND2-N 2.95Å; Y770-A772 VanDerWaalsContact CB-O 3.25Å; Y770-A772 WeakPolarHBondContact CB-O 3.42Å; A772-D775 WeakPolarHBondContact CB-OD2 3.32Å; A772-D775 PolarHBondContact N-OD2 3.34Å
773	E	85.5	Confident	87	Confident	41 Å²	41	48.2 Å²	48.2	19%	0.192	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-48.7	-171	169.1	159.9	-143.2	0	0	113.4	I620 K735 R736 F742	I620-E773 HydrophobicContact CG1-CB 4.38Å; I620-E773 PolarHBondContact O-N 2.82Å; K735-E773 PolarHBondContact NZ-O 3.17Å; R736-E773 IonicContact CZ-OE1 2.71Å; R736-E773 IonicContact NE-OE1 3.52Å; R736-E773 IonicContact NH2-OE1 3.74Å; R736-E773 PolarHBondContact NH2-OE1 2.87Å; F742-E773 HydrophobicContact CE1-CG 4.04Å; F742-E773 WeakPolarHBondContact CE1-OE1 3.45Å; F742-E773 HydrophobicContact CZ-CB 4.42Å; F742-E773 HydrophobicContact CZ-CG 3.92Å
774	L	86.8	Confident	87.1	Confident	19 Å²	19	42.7 Å²	42.7	10%	0.099	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	5.9	-173.5	-56.4	-173.3	0	0	0	114.6	I620 L625 R730 V732 S776	I620-L774 HydrophobicContact CD1-CD1 4.04Å; I620-L774 HydrophobicContact CD1-CG 4.36Å; I620-L774 HydrophobicContact CG1-CD1 4.21Å; I620-L774 HydrophobicContact CG1-CG 4.14Å; I620-L774 HydrophobicContact CG2-CD1 4.01Å; I620-L774 PolarHBondContact O-N 3.12Å; L625-L774 HydrophobicContact CD1-CD1 4.02Å; L625-L774 HydrophobicContact CD2-CB 3.73Å; L625-L774 HydrophobicContact CD2-CD1 4.34Å; R730-L774 PolarHBondContact NH1-O 2.83Å; V732-L774 HydrophobicContact CB-CD2 4.26Å; V732-L774 HydrophobicContact CG1-CD1 4.48Å; V732-L774 HydrophobicContact CG1-CD2 3.44Å; V732-L774 VanDerWaalsContact CG1-CD2 3.44Å; V732-L774 HydrophobicContact CG2-CD1 4.07Å; V732-L774 HydrophobicContact CG2-CD2 3.95Å; L774-S776 PolarHBondContact O-N 2.68Å
775	D	88.3	Confident	86.9	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	24%	0.242	C	C	.	.			trans	-64.3	134.3	175	-64	-12.7	0	0	0	110.1	S621 N622 K735 Y770 K771 A772	S621-D775 WeakPolarHBondContact CA-OD1 3.48Å; S621-D775 WeakPolarHBondContact CB-OD1 3.49Å; S621-D775 PolarHBondContact OG-OD1 2.93Å; N622-D775 PolarHBondContact N-OD1 2.76Å; N622-D775 PolarHBondContact ND2-OD2 3.46Å; K735-D775 PolarHBondContact NZ-O 2.77Å; Y770-D775 HydrophobicContact CD1-CB 4.44Å; Y770-D775 VanDerWaalsContact CD1-O 3.28Å; Y770-D775 WeakPolarHBondContact CD1-O 3.33Å; K771-D775 WeakPolarHBondContact CB-OD2 3.31Å; A772-D775 WeakPolarHBondContact CB-OD2 3.32Å; A772-D775 PolarHBondContact N-OD2 3.34Å
776	S	84.3	Confident	86.4	Confident	71 Å²	71	48.1 Å²	48.1	50%	0.497	24%	0.24	S	C	.	.	S	Bend	trans	-77.9	-36.1	175	60.5	0	0	0	0	111.7	E623 L774	E623-S776 VanDerWaalsContact OE1-CB 3.29Å; E623-S776 WeakPolarHBondContact OE1-CB 3.4Å; E623-S776 PolarHBondContact OE1-N 3.05Å; E623-S776 PolarHBondContact OE1-OG 3.26Å; L774-S776 PolarHBondContact O-N 2.68Å
777	K	84.9	Confident	86.2	Confident	123 Å²	123	46.7 Å²	46.7	54%	0.535	23%	0.233	S	C	.	.	S	Bend	trans	-85.1	122.2	-176.2	-174.1	174	173	-173.6	0	111.7	E632 Y770	E632-K777 IonicContact OE1-NZ 3.26Å; E632-K777 PolarHBondContact OE1-NZ 2.77Å; Y770-K777 WeakPolarHBondContact CD1-O 3.47Å
778	S	87.9	Confident	85.8	Confident	38 Å²	38	48.7 Å²	48.7	27%	0.266	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	159.2	173.7	45.3	0	0	0	0	112.4	F769 E781	F769-S778 CarbonylContact O-C 3.57Å; F769-S778 WeakPolarHBondContact O-CA 3.36Å; S778-E781 VanDerWaalsContact CB-OE1 3.3Å; S778-E781 WeakPolarHBondContact CB-OE1 3.35Å; S778-E781 WeakPolarHBondContact OG-CG 3.25Å; S778-E781 PolarHBondContact OG-OE1 2.89Å
779	V	87.1	Confident	85.7	Confident	69 Å²	69	49.5 Å²	49.5	42%	0.418	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-33.6	173.8	-179.9	0	0	0	0	110.6	F769 K771	F769-V779 PolarHBondContact O-N 2.9Å; K771-V779 HydrophobicContact CB-CG2 4.34Å; K771-V779 HydrophobicContact CG-CG2 3.43Å; K771-V779 VanDerWaalsContact CG-CG2 3.43Å
780	L	84.6	Confident	85.4	Confident	59 Å²	59	53.3 Å²	53.3	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	132.7	177.5	173.8	61.7	0	0	0	107.5	L747 V768 F769 I818	L747-L780 HydrophobicContact CD2-CD2 4.46Å; V768-L780 WeakPolarHBondContact CA-O 3.37Å; F769-L780 HydrophobicContact CB-CB 4.33Å; F769-L780 HydrophobicContact CD2-CB 3.93Å; F769-L780 HydrophobicContact CD2-CD2 3.84Å; F769-L780 HydrophobicContact CD2-CG 3.96Å; F769-L780 HydrophobicContact CE2-CD2 3.91Å; F769-L780 HydrophobicContact CE2-CG 4.37Å; F769-L780 HydrophobicContact CG-CB 4.5Å; F769-L780 PolarHBondContact N-O 3.26Å; L780-I818 HydrophobicContact CD2-CD1 4.4Å
781	E	88.8	Confident	85.3	Confident	82 Å²	82	55.6 Å²	55.6	38%	0.383	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.2	166.2	-54.3	-152.6	-173.4	0	0	108.3	R761 V768 S778	R761-E781 IonicContact NH1-OE2 2.66Å; R761-E781 IonicContact NH2-OE2 2.83Å; V768-E781 HydrophobicContact CB-CG 4.41Å; V768-E781 HydrophobicContact CG1-CG 3.89Å; V768-E781 HydrophobicContact CG2-CB 4.19Å; V768-E781 HydrophobicContact CG2-CG 3.91Å; S778-E781 VanDerWaalsContact CB-OE1 3.3Å; S778-E781 WeakPolarHBondContact CB-OE1 3.35Å; S778-E781 WeakPolarHBondContact OG-CG 3.25Å; S778-E781 PolarHBondContact OG-OE1 2.89Å
782	L	85.1	Confident	85.3	Confident	26 Å²	26	53.3 Å²	53.3	14%	0.136	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	126.3	178.8	-166.9	82.3	0	0	0	109.7	K766 L767 I784 Y787 I818	K766-L782 CarbonylContact C-O 3.19Å; K766-L782 VanDerWaalsContact CA-O 3.25Å; K766-L782 WeakPolarHBondContact CA-O 3.36Å; L767-L782 PolarHBondContact N-O 2.95Å; L767-L782 PolarHBondContact O-N 2.9Å; L782-I784 HydrophobicContact CD2-CG2 3.96Å; L782-I784 PolarHBondContact O-N 2.91Å; L782-Y787 HydrophobicContact CD2-CE1 4.05Å; L782-Y787 HydrophobicContact CD2-CE2 4.17Å; L782-Y787 HydrophobicContact CG-CE2 4.47Å; L782-I818 HydrophobicContact CD1-CD1 3.56Å; L782-I818 HydrophobicContact CD2-CD1 3.48Å; L782-I818 VanDerWaalsContact CD2-CD1 3.48Å; L782-I818 HydrophobicContact CG-CD1 4.02Å
783	L	84.5	Confident	85.3	Confident	98 Å²	98	57.3 Å²	57.3	51%	0.513	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	111.3	166.7	-178.3	66.3	0	0	0	108.1	D764 K766 Y785 Y787	D764-L783 WeakPolarHBondContact O-CD1 3.25Å; K766-L783 HydrophobicContact CG-CD1 4.33Å; L783-Y785 PolarHBondContact O-N 2.63Å; L783-Y787 WeakPolarHBondContact O-CE2 3.46Å
784	I	85	Confident	85.2	Confident	1 Å²	1	59 Å²	59	1%	0.005	30%	0.301	C	S	.	.			trans	-82.4	6.9	-176.1	54.5	160.2	0	0	0	113.9	L760 L765 L767 L782 G786 Y787 L802 F835 L839	L760-I784 HydrophobicContact CD1-CD1 3.54Å; L760-I784 HydrophobicContact CD1-CG1 4.03Å; L760-I784 HydrophobicContact CD2-CD1 3.96Å; L760-I784 HydrophobicContact CG-CD1 4.42Å; L765-I784 HydrophobicContact CB-CG1 4.31Å; L765-I784 WeakPolarHBondContact O-CG1 3.4Å; L765-I784 PolarHBondContact O-N 3.32Å; L767-I784 HydrophobicContact CB-CG2 3.73Å; L767-I784 HydrophobicContact CD2-CG2 4.23Å; L782-I784 HydrophobicContact CD2-CG2 3.96Å; L782-I784 PolarHBondContact O-N 2.91Å; I784-G786 PolarHBondContact O-N 2.82Å; I784-Y787 WeakPolarHBondContact O-CB 3.42Å; I784-Y787 WeakPolarHBondContact O-CD2 3.44Å; I784-Y787 PolarHBondContact O-N 2.89Å; I784-Y787 VanDerWaalsContact O-N 3.16Å; I784-L802 HydrophobicContact CB-CD2 4.39Å; I784-L802 HydrophobicContact CG2-CD2 3.58Å; I784-F835 HydrophobicContact CD1-CD1 4.35Å; I784-F835 HydrophobicContact CD1-CE1 4.22Å; I784-L839 HydrophobicContact CB-CD1 4.49Å; I784-L839 HydrophobicContact CB-CD2 4.18Å; I784-L839 HydrophobicContact CD1-CD1 3.99Å; I784-L839 HydrophobicContact CD1-CD2 4Å; I784-L839 HydrophobicContact CD1-CG 4.08Å; I784-L839 HydrophobicContact CG1-CD2 4.3Å; I784-L839 WeakPolarHBondContact O-CD2 3.32Å
785	Y	80	Confident	84.7	Confident	183 Å²	183	66.8 Å²	66.8	72%	0.718	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	129.3	176.9	-168.7	-92.9	0	0	0	111.2	L783 Y787	L783-Y785 PolarHBondContact O-N 2.63Å; Y785-Y787 VanDerWaalsContact C-N 3.3Å; Y785-Y787 PolarHBondContact O-N 3.49Å
786	G	74.5	Confident	84.2	Confident	16 Å²	16	70.8 Å²	70.8	17%	0.165	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	9.7	-178.3	0	0	0	0	0	115.3	I784 H804 R805	I784-G786 PolarHBondContact O-N 2.82Å; G786-H804 PolarHBondContact O-CD2 2.79Å; G786-H804 VanDerWaalsContact O-CD2 3.29Å; G786-R805 WeakPolarHBondContact O-CB 3.32Å; G786-R805 WeakPolarHBondContact O-CD 3.34Å; G786-R805 WeakPolarHBondContact O-CG 3.32Å; G786-R805 PolarHBondContact O-N 2.99Å
787	Y	84.1	Confident	84.3	Confident	36 Å²	36	68 Å²	68	14%	0.141	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	142.9	167.8	-75.7	-105.6	0	0	0	111.1	L782 L783 I784 Y785 L802 V803 H804 L839	L782-Y787 HydrophobicContact CD2-CE1 4.05Å; L782-Y787 HydrophobicContact CD2-CE2 4.17Å; L782-Y787 HydrophobicContact CG-CE2 4.47Å; L783-Y787 WeakPolarHBondContact O-CE2 3.46Å; I784-Y787 WeakPolarHBondContact O-CB 3.42Å; I784-Y787 WeakPolarHBondContact O-CD2 3.44Å; I784-Y787 PolarHBondContact O-N 2.89Å; I784-Y787 VanDerWaalsContact O-N 3.16Å; Y785-Y787 VanDerWaalsContact C-N 3.3Å; Y785-Y787 PolarHBondContact O-N 3.49Å; Y787-L802 HydrophobicContact CD1-CB 3.89Å; Y787-V803 CarbonylContact C-O 3.11Å; Y787-V803 WeakPolarHBondContact CA-O 3.37Å; Y787-H804 HydrophobicContact CD1-CB 4.05Å; Y787-H804 HydrophobicContact CD2-CB 4.43Å; Y787-H804 AromaticContact CD2-CD2 3.72Å; Y787-H804 HydrophobicContact CE1-CB 3.75Å; Y787-H804 HydrophobicContact CE2-CB 4.16Å; Y787-H804 AromaticContact CE2-CD2 3.67Å; Y787-H804 HydrophobicContact CG-CB 4.39Å; Y787-L839 WeakPolarHBondContact O-CD2 3.22Å
788	F	82.9	Confident	84.6	Confident	43 Å²	43	65.6 Å²	65.6	19%	0.189	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	153	154.2	-62.3	-70.6	0	0	0	109	L802 V803 R805 E840 D842	F788-L802 WeakPolarHBondContact O-CA 3.24Å; F788-V803 PolarHBondContact N-O 3.49Å; F788-V803 PolarHBondContact O-N 2.69Å; F788-R805 HydrophobicContact CD2-CG 3.92Å; F788-R805 HydrophobicContact CE2-CB 4.41Å; F788-R805 HydrophobicContact CE2-CG 3.34Å; F788-R805 HydrophobicContact CZ-CG 3.72Å; F788-E840 VanDerWaalsContact CA-O 3.28Å; F788-E840 WeakPolarHBondContact CA-O 3.19Å; F788-E840 HydrophobicContact CD1-CB 3.75Å; F788-E840 HydrophobicContact CE1-CB 3.89Å; F788-D842 HydrophobicContact CB-CB 4.08Å
789	Y	87.8	Confident	84.7	Confident	16 Å²	16	64.3 Å²	64.3	6%	0.063	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.1	166.8	82.9	-76.3	0	0	0	111.4	E791 E801 F835 L839 E840 L841 D842	Y789-E791 HydrophobicContact CE2-CG 4.37Å; Y789-E801 CarbonylContact C-O 3.42Å; Y789-E801 WeakPolarHBondContact CA-O 3.36Å; Y789-F835 HydrophobicContact CD1-CB 3.87Å; Y789-F835 HydrophobicContact CD2-CB 3.92Å; Y789-F835 HydrophobicContact CD2-CD2 4.28Å; Y789-F835 HydrophobicContact CD2-CG 4.45Å; Y789-F835 HydrophobicContact CE1-CB 3.97Å; Y789-F835 HydrophobicContact CE2-CB 4.03Å; Y789-F835 HydrophobicContact CG-CB 3.84Å; Y789-F835 HydrophobicContact CG-CG 4.38Å; Y789-L839 HydrophobicContact CD1-CB 3.79Å; Y789-L839 HydrophobicContact CE1-CB 4.46Å; Y789-E840 WeakPolarHBondContact CD1-O 3.46Å; Y789-E840 PolarHBondContact N-O 2.97Å; Y789-L841 HydrophobicContact CD2-CD1 4.3Å; Y789-L841 HydrophobicContact CE1-CB 4.47Å; Y789-L841 HydrophobicContact CE1-CD1 4.07Å; Y789-L841 HydrophobicContact CE2-CD1 3.79Å; Y789-L841 WeakPolarHBondContact O-CA 3.31Å; Y789-D842 PolarHBondContact O-N 2.68Å
790	R	85.2	Confident	84.9	Confident	80 Å²	80	61 Å²	61	30%	0.302	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.1	166.3	-176.8	-171.9	-62.4	142.4	-4	107.7	F800 E801 D842	R790-F800 WeakPolarHBondContact O-CA 3.49Å; R790-E801 HydrophobicContact CB-CB 4.38Å; R790-E801 IonicContact CZ-OE2 3.88Å; R790-E801 PolarHBondContact N-O 2.78Å; R790-E801 IonicContact NH1-OE2 2.73Å; R790-E801 PolarHBondContact NH1-OE2 3.3Å; R790-E801 PolarHBondContact O-N 2.59Å; R790-D842 IonicContact CZ-OD2 2.61Å; R790-D842 IonicContact NE-OD2 3.87Å; R790-D842 IonicContact NH2-OD2 2.73Å; R790-D842 PolarHBondContact NH2-OD2 2.94Å
791	E	89	Confident	85.1	Confident	62 Å²	62	60 Å²	60	29%	0.29	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	146.1	167.8	58.8	-176.1	-151.5	0	0	110.1	Y789 W798 L799 F800 S832	Y789-E791 HydrophobicContact CE2-CG 4.37Å; E791-W798 HydrophobicContact CB-CE3 4.18Å; E791-W798 HydrophobicContact CB-CZ3 4.36Å; E791-W798 HydrophobicContact CG-CE3 4.46Å; E791-W798 HydrophobicContact CG-CZ3 4.15Å; E791-L799 CarbonylContact C-O 3.58Å; E791-L799 WeakPolarHBondContact CA-O 3.47Å; E791-F800 HydrophobicContact CB-CD1 4.01Å; E791-F800 HydrophobicContact CB-CE1 3.84Å; E791-S832 WeakPolarHBondContact OE2-CB 3.2Å; E791-S832 PolarHBondContact OE2-OG 3.31Å
792	T	88.4	Confident	85	Confident	50 Å²	50	56 Å²	56	31%	0.307	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	120.6	-179.5	-62.1	0	0	0	0	109.3	L799	T792-L799 PolarHBondContact N-O 2.75Å; T792-L799 PolarHBondContact O-N 3.12Å
793	P	85.8	Confident	84.9	Confident	87 Å²	87	55.9 Å²	55.9	57%	0.565	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	143.8	175.1	29.7	-34.4	0	0	0	110.5	W798	P793-W798 HydrophobicContact CB-CD2 4.49Å; P793-W798 HydrophobicContact CB-CH2 4.47Å; P793-W798 HydrophobicContact CB-CZ2 4.21Å
794	L	85.3	Confident	84.6	Confident	75 Å²	75	54 Å²	54	39%	0.393	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	158	176.4	-64.2	176.9	0	0	0	109.2	D796 G797 L799 R821	L794-D796 PolarHBondContact O-N 3.12Å; L794-G797 PolarHBondContact N-O 3.48Å; L794-G797 PolarHBondContact O-N 3.39Å; L794-G797 VanDerWaalsContact O-N 3.1Å; L794-L799 HydrophobicContact CD1-CB 3.85Å; L794-L799 HydrophobicContact CG-CB 4.34Å; L794-R821 HydrophobicContact CD1-CG 4.42Å
795	D	76.1	Confident	83.8	Confident	184 Å²	184	59.5 Å²	59.5	98%	0.984	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.4	176.8	-55.5	-30.9	0	0	0	113.1
796	D	77.1	Confident	83.1	Confident	88 Å²	88	56.9 Å²	56.9	47%	0.471	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	25.1	179.8	82.3	-26.2	0	0	0	114.1	L794 R821	L794-D796 PolarHBondContact O-N 3.12Å; D796-R821 PolarHBondContact O-NH1 2.79Å; D796-R821 WeakPolarHBondContact OD1-CD 3.39Å; D796-R821 IonicContact OD1-CZ 2.88Å; D796-R821 IonicContact OD1-NE 2.74Å; D796-R821 IonicContact OD1-NH1 3.11Å; D796-R821 PolarHBondContact OD1-NH1 3.29Å; D796-R821 IonicContact OD2-CZ 3.81Å; D796-R821 IonicContact OD2-NE 2.87Å; D796-R821 IonicContact OD2-NH1 3.27Å; D796-R821 PolarHBondContact OD2-NH1 3.2Å; D796-R821 IonicContact OD2-NH2 3.81Å; D796-R821 PolarHBondContact OD2-NH2 2.93Å
797	G	86.6	Confident	82.5	Confident	11 Å²	11	58.7 Å²	58.7	11%	0.113	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.8	-147	169	0	0	0	0	0	114.6	L794 V822	L794-G797 PolarHBondContact N-O 3.48Å; L794-G797 PolarHBondContact O-N 3.39Å; L794-G797 VanDerWaalsContact O-N 3.1Å; G797-V822 CarbonylContact C-O 3.55Å; G797-V822 VanDerWaalsContact CA-O 3.24Å; G797-V822 WeakPolarHBondContact CA-O 3.33Å
798	W	89.9	Confident	81	Confident	73 Å²	73	63.3 Å²	63.3	28%	0.277	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.8	175.4	-74.9	65.1	0	0	0	109.9	E791 P793 F800 R821 V822 A828	E791-W798 HydrophobicContact CB-CE3 4.18Å; E791-W798 HydrophobicContact CB-CZ3 4.36Å; E791-W798 HydrophobicContact CG-CE3 4.46Å; E791-W798 HydrophobicContact CG-CZ3 4.15Å; P793-W798 HydrophobicContact CB-CD2 4.49Å; P793-W798 HydrophobicContact CB-CH2 4.47Å; P793-W798 HydrophobicContact CB-CZ2 4.21Å; W798-F800 HydrophobicContact CB-CE2 3.91Å; W798-F800 HydrophobicContact CB-CZ 4.36Å; W798-R821 CarbonylContact O-C 3.42Å; W798-R821 VanDerWaalsContact O-CA 3.28Å; W798-R821 WeakPolarHBondContact O-CA 3.22Å; W798-V822 PolarHBondContact N-O 3.48Å; W798-V822 PolarHBondContact O-N 2.84Å; W798-A828 HydrophobicContact CB-CB 3.61Å; W798-A828 HydrophobicContact CD2-CB 4.17Å; W798-A828 HydrophobicContact CG-CB 3.48Å; W798-A828 VanDerWaalsContact CG-CB 3.48Å
799	L	90.4	Very high	79.5	Confident	11 Å²	11	69.6 Å²	69.6	6%	0.058	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.6	171.9	-177.5	67	0	0	0	109.3	E791 T792 L794 E801 R821	E791-L799 CarbonylContact C-O 3.58Å; E791-L799 WeakPolarHBondContact CA-O 3.47Å; T792-L799 PolarHBondContact N-O 2.75Å; T792-L799 PolarHBondContact O-N 3.12Å; L794-L799 HydrophobicContact CD1-CB 3.85Å; L794-L799 HydrophobicContact CG-CB 4.34Å; L799-E801 HydrophobicContact CD2-CG 4.06Å; L799-E801 HydrophobicContact CG-CG 4.05Å; L799-R821 HydrophobicContact CD1-CB 4.38Å
800	F	91.4	Very high	77.7	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129	167.9	-65.5	-87.7	0	0	0	108.6	R790 E791 W798 S819 F820 V822 A828 W831 S832 F835	R790-F800 WeakPolarHBondContact O-CA 3.49Å; E791-F800 HydrophobicContact CB-CD1 4.01Å; E791-F800 HydrophobicContact CB-CE1 3.84Å; W798-F800 HydrophobicContact CB-CE2 3.91Å; W798-F800 HydrophobicContact CB-CZ 4.36Å; F800-S819 CarbonylContact O-C 3.55Å; F800-S819 VanDerWaalsContact O-CA 3.26Å; F800-S819 WeakPolarHBondContact O-CA 3.46Å; F800-F820 HydrophobicContact CB-CD1 4.48Å; F800-F820 HydrophobicContact CB-CE1 4.12Å; F800-F820 HydrophobicContact CB-CE2 4.18Å; F800-F820 HydrophobicContact CB-CZ 3.97Å; F800-F820 HydrophobicContact CD2-CE2 4.03Å; F800-F820 HydrophobicContact CD2-CZ 4.46Å; F800-F820 HydrophobicContact CG-CE2 4.35Å; F800-F820 HydrophobicContact CG-CZ 4.34Å; F800-F820 PolarHBondContact N-O 3.31Å; F800-F820 PolarHBondContact O-N 3.07Å; F800-V822 HydrophobicContact CD2-CG2 3.84Å; F800-V822 HydrophobicContact CE2-CB 4.27Å; F800-V822 HydrophobicContact CE2-CG2 3.75Å; F800-A828 HydrophobicContact CE2-CB 4.3Å; F800-A828 HydrophobicContact CZ-CB 4.34Å; F800-W831 HydrophobicContact CD2-CB 4.39Å; F800-W831 HydrophobicContact CE1-CB 4.1Å; F800-W831 HydrophobicContact CE2-CB 3.82Å; F800-W831 HydrophobicContact CZ-CB 3.66Å; F800-S832 WeakPolarHBondContact CE1-OG 3.35Å; F800-S832 WeakPolarHBondContact CZ-OG 3.42Å; F800-F835 HydrophobicContact CB-CE2 4.29Å; F800-F835 AromaticContact CD1-CD2 3.83Å; F800-F835 HydrophobicContact CD1-CD2 3.83Å; F800-F835 AromaticContact CD1-CE2 3.9Å; F800-F835 HydrophobicContact CD1-CE2 3.9Å; F800-F835 HydrophobicContact CE1-CD2 4.24Å; F800-F835 HydrophobicContact CG-CE2 4.15Å
801	E	89.6	Confident	75.9	Confident	37 Å²	37	76.7 Å²	76.7	17%	0.173	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.1	174.6	-52.5	-169.3	124.9	0	0	109.1	Y789 R790 L799 V817	Y789-E801 CarbonylContact C-O 3.42Å; Y789-E801 WeakPolarHBondContact CA-O 3.36Å; R790-E801 HydrophobicContact CB-CB 4.38Å; R790-E801 IonicContact CZ-OE2 3.88Å; R790-E801 PolarHBondContact N-O 2.78Å; R790-E801 IonicContact NH1-OE2 2.73Å; R790-E801 PolarHBondContact NH1-OE2 3.3Å; R790-E801 PolarHBondContact O-N 2.59Å; L799-E801 HydrophobicContact CD2-CG 4.06Å; L799-E801 HydrophobicContact CG-CG 4.05Å; E801-V817 HydrophobicContact CB-CG1 3.98Å
802	L	87.1	Confident	73.9	Confident	0 Å²	0	81.2 Å²	81.2	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.6	177.3	-74.6	79.8	0	0	0	109.7	L767 I784 Y787 F788 I818 F820 F835 L839	L767-L802 HydrophobicContact CD2-CD2 4.1Å; I784-L802 HydrophobicContact CB-CD2 4.39Å; I784-L802 HydrophobicContact CG2-CD2 3.58Å; Y787-L802 HydrophobicContact CD1-CB 3.89Å; F788-L802 WeakPolarHBondContact O-CA 3.24Å; L802-I818 PolarHBondContact N-O 3.08Å; L802-I818 PolarHBondContact O-N 2.84Å; L802-F820 HydrophobicContact CD1-CE1 3.94Å; L802-F835 HydrophobicContact CD1-CE2 4.32Å; L802-F835 HydrophobicContact CD1-CZ 4.08Å; L802-F835 HydrophobicContact CD2-CE1 4.17Å; L802-F835 HydrophobicContact CD2-CZ 4.31Å; L802-L839 HydrophobicContact CD2-CD1 4.05Å
803	V	81.8	Confident	71.8	Confident	22 Å²	22	82.6 Å²	82.6	13%	0.133	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.5	-175.1	-168.9	0	0	0	0	109.6	Y787 F788 V817	Y787-V803 CarbonylContact C-O 3.11Å; Y787-V803 WeakPolarHBondContact CA-O 3.37Å; F788-V803 PolarHBondContact N-O 3.49Å; F788-V803 PolarHBondContact O-N 2.69Å; V803-V817 HydrophobicContact CG2-CG1 4.24Å; V803-V817 HydrophobicContact CG2-CG2 4.11Å
804	H	79.3	Confident	70	Confident	58 Å²	58	86.2 Å²	86.2	27%	0.269	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	138.9	-175.4	-174	-114.2	0	0	0	112.7	G786 Y787 N806 Q807	G786-H804 PolarHBondContact O-CD2 2.79Å; G786-H804 VanDerWaalsContact O-CD2 3.29Å; Y787-H804 HydrophobicContact CD1-CB 4.05Å; Y787-H804 HydrophobicContact CD2-CB 4.43Å; Y787-H804 AromaticContact CD2-CD2 3.72Å; Y787-H804 HydrophobicContact CE1-CB 3.75Å; Y787-H804 HydrophobicContact CE2-CB 4.16Å; Y787-H804 AromaticContact CE2-CD2 3.67Å; Y787-H804 HydrophobicContact CG-CB 4.39Å; H804-N806 PolarHBondContact ND1-N 2.67Å; H804-N806 PolarHBondContact O-N 3Å; H804-N806 VanDerWaalsContact O-N 3.1Å; H804-Q807 VanDerWaalsContact O-CB 3.26Å; H804-Q807 WeakPolarHBondContact O-CB 3.39Å; H804-Q807 PolarHBondContact O-N 3.3Å
805	R	68.7	Low	68.4	Low	118 Å²	118	87.1 Å²	87.1	45%	0.445	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-36.3	-179.6	-85.3	169.5	180	-178.6	-0.1	115.1	G786 F788 E840	G786-R805 WeakPolarHBondContact O-CB 3.32Å; G786-R805 WeakPolarHBondContact O-CD 3.34Å; G786-R805 WeakPolarHBondContact O-CG 3.32Å; G786-R805 PolarHBondContact O-N 2.99Å; F788-R805 HydrophobicContact CD2-CG 3.92Å; F788-R805 HydrophobicContact CE2-CB 4.41Å; F788-R805 HydrophobicContact CE2-CG 3.34Å; F788-R805 HydrophobicContact CZ-CG 3.72Å; R805-E840 IonicContact CZ-OE1 2.99Å; R805-E840 IonicContact CZ-OE2 2.76Å; R805-E840 IonicContact NH2-OE1 3.11Å; R805-E840 PolarHBondContact NH2-OE1 3.5Å; R805-E840 IonicContact NH2-OE2 3.47Å; R805-E840 PolarHBondContact NH2-OE2 2.96Å
806	N	64.8	Low	67.6	Low	128 Å²	128	84.4 Å²	84.4	68%	0.684	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	12.3	-175.9	-58.2	-7.7	0	0	0	113.2	H804 I808	H804-N806 PolarHBondContact ND1-N 2.67Å; H804-N806 PolarHBondContact O-N 3Å; H804-N806 VanDerWaalsContact O-N 3.1Å; N806-I808 PolarHBondContact O-N 3.03Å; N806-I808 VanDerWaalsContact O-N 3.13Å
807	Q	60.8	Low	67.5	Low	53 Å²	53	82.2 Å²	82.2	25%	0.248	41%	0.409	C	S	.	.			trans	-78.3	95.3	179	-172.7	172.6	-15.5	0	0	110.3	H804 R809 D815	H804-Q807 VanDerWaalsContact O-CB 3.26Å; H804-Q807 WeakPolarHBondContact O-CB 3.39Å; H804-Q807 PolarHBondContact O-N 3.3Å; Q807-R809 PolarHBondContact O-N 3.46Å; Q807-R809 VanDerWaalsContact O-N 3.15Å; Q807-D815 PolarHBondContact NE2-OD1 2.87Å; Q807-D815 VanDerWaalsContact NE2-OD1 3.1Å
808	I	53	Low	67.4	Low	134 Å²	134	83 Å²	83	69%	0.687	41%	0.41	S	S	*	.			trans	-63.8	114.6	175.7	-52.2	177.5	0	0	0	108.5	N806 T810	N806-I808 PolarHBondContact O-N 3.03Å; N806-I808 VanDerWaalsContact O-N 3.13Å; I808-T810 HydrophobicContact CG2-CG2 3.73Å; I808-T810 PolarHBondContact O-N 2.82Å
809	R	52.3	Low	67.4	Low	175 Å²	175	80.3 Å²	80.3	66%	0.66	40%	0.402	S	S	*	.			trans	-69.7	100.6	171.2	-69.6	-177.2	-179.2	157.7	4.3	108.9	Q807 T844	Q807-R809 PolarHBondContact O-N 3.46Å; Q807-R809 VanDerWaalsContact O-N 3.15Å; R809-T844 PolarHBondContact NH2-OG1 3.27Å
810	T	48.5	Very low	67.5	Low	66 Å²	66	79.8 Å²	79.8	41%	0.405	40%	0.399	S	S	.	.			trans	-119.3	140.9	163	83.2	0	0	0	0	108.4	I808 D812 T813	I808-T810 HydrophobicContact CG2-CG2 3.73Å; I808-T810 PolarHBondContact O-N 2.82Å; T810-D812 PolarHBondContact O-N 2.93Å; T810-T813 PolarHBondContact O-N 3.3Å; T810-T813 VanDerWaalsContact O-N 3.08Å; T810-T813 PolarHBondContact O-OG1 2.83Å; T810-T813 VanDerWaalsContact O-OG1 3.05Å; T810-T813 WeakPolarHBondContact OG1-CB 3.45Å; T810-T813 WeakPolarHBondContact OG1-CG2 3.49Å; T810-T813 PolarHBondContact OG1-OG1 2.71Å
811	D	48.8	Very low	67.5	Low	178 Å²	178	80.6 Å²	80.6	95%	0.952	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.4	-165.7	-62.6	-55.7	0	0	0	114.4
812	D	47	Very low	67.6	Low	158 Å²	158	78.9 Å²	78.9	85%	0.845	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-17	177.1	-76.3	-55.1	0	0	0	114.4	T810 K814	T810-D812 PolarHBondContact O-N 2.93Å; D812-K814 PolarHBondContact O-N 3.3Å
813	T	43.4	Very low	67.4	Low	78 Å²	78	82.1 Å²	82.1	48%	0.479	41%	0.412	S	S	.	.	S	Bend	trans	-84.9	82.6	-177.5	51.7	0	0	0	0	112.1	T810 D815	T810-T813 PolarHBondContact O-N 3.3Å; T810-T813 VanDerWaalsContact O-N 3.08Å; T810-T813 PolarHBondContact O-OG1 2.83Å; T810-T813 VanDerWaalsContact O-OG1 3.05Å; T810-T813 WeakPolarHBondContact OG1-CB 3.45Å; T810-T813 WeakPolarHBondContact OG1-CG2 3.49Å; T810-T813 PolarHBondContact OG1-OG1 2.71Å; T813-D815 PolarHBondContact O-N 3.07Å
814	K	49.1	Very low	67.4	Low	163 Å²	163	83.4 Å²	83.4	71%	0.709	42%	0.418	S	S	*	.			trans	-5.8	102.8	161.3	-72	177.4	-176.2	165.7	0	114.6	D812 D816	D812-K814 PolarHBondContact O-N 3.3Å; K814-D816 PolarHBondContact O-N 3.33Å
815	D	51.1	Low	67.4	Low	95 Å²	95	83.2 Å²	83.2	51%	0.508	42%	0.423	S	S	.	.			trans	-59.6	121.8	174	-70.8	-59.2	0	0	0	113.7	R750 Q807 T813 V817	R750-D815 PolarHBondContact NH2-O 3.23Å; Q807-D815 PolarHBondContact NE2-OD1 2.87Å; Q807-D815 VanDerWaalsContact NE2-OD1 3.1Å; T813-D815 PolarHBondContact O-N 3.07Å; D815-V817 VanDerWaalsContact C-N 3.28Å; D815-V817 HydrophobicContact CB-CG2 4.17Å; D815-V817 PolarHBondContact O-N 2.84Å
816	D	59.4	Low	68	Low	126 Å²	126	79.9 Å²	79.9	67%	0.674	42%	0.42	S	S	*	.			trans	-96.4	44.1	169	-77.6	-26.6	0	0	0	110.9	K814 I818	K814-D816 PolarHBondContact O-N 3.33Å; D816-I818 PolarHBondContact O-N 2.65Å
817	V	75.3	Confident	68.8	Low	43 Å²	43	75.6 Å²	75.6	26%	0.261	40%	0.401	S	S	.	.			trans	-69.3	115.1	172.1	174.4	0	0	0	0	109.2	E801 V803 D815 S819	E801-V817 HydrophobicContact CB-CG1 3.98Å; V803-V817 HydrophobicContact CG2-CG1 4.24Å; V803-V817 HydrophobicContact CG2-CG2 4.11Å; D815-V817 VanDerWaalsContact C-N 3.28Å; D815-V817 HydrophobicContact CB-CG2 4.17Å; D815-V817 PolarHBondContact O-N 2.84Å; V817-S819 PolarHBondContact O-N 2.95Å
818	I	85	Confident	70.1	Confident	28 Å²	28	73.1 Å²	73.1	14%	0.144	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	106.6	178.4	-74.9	168	0	0	0	108	F769 L780 L782 L802 D816	F769-I818 HydrophobicContact CZ-CG2 4.34Å; L780-I818 HydrophobicContact CD2-CD1 4.4Å; L782-I818 HydrophobicContact CD1-CD1 3.56Å; L782-I818 HydrophobicContact CD2-CD1 3.48Å; L782-I818 VanDerWaalsContact CD2-CD1 3.48Å; L782-I818 HydrophobicContact CG-CD1 4.02Å; L802-I818 PolarHBondContact N-O 3.08Å; L802-I818 PolarHBondContact O-N 2.84Å; D816-I818 PolarHBondContact O-N 2.65Å
819	S	88.6	Confident	71.7	Confident	16 Å²	16	73.6 Å²	73.6	11%	0.112	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133	-178.1	50.4	0	0	0	0	111.3	R748 F800 V817	R748-S819 WeakPolarHBondContact CB-O 3.24Å; R748-S819 PolarHBondContact N-O 2.84Å; F800-S819 CarbonylContact O-C 3.55Å; F800-S819 VanDerWaalsContact O-CA 3.26Å; F800-S819 WeakPolarHBondContact O-CA 3.46Å; V817-S819 PolarHBondContact O-N 2.95Å
820	F	92.1	Very high	73.4	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	146.1	173.8	68.7	-92.3	0	0	0	111.6	V745 Y746 L747 L767 F769 F800 L802 V822 W831 F835	V745-F820 HydrophobicContact CB-CD2 3.81Å; V745-F820 HydrophobicContact CB-CE2 4.47Å; V745-F820 HydrophobicContact CB-CG 4.47Å; V745-F820 HydrophobicContact CG1-CD2 3.77Å; V745-F820 HydrophobicContact CG1-CE2 3.93Å; V745-F820 HydrophobicContact CG2-CD2 4.35Å; Y746-F820 CarbonylContact O-C 3.5Å; Y746-F820 VanDerWaalsContact O-CA 3.24Å; Y746-F820 WeakPolarHBondContact O-CA 3.39Å; L747-F820 HydrophobicContact CD1-CB 4.33Å; L767-F820 HydrophobicContact CD2-CE1 4.07Å; F769-F820 HydrophobicContact CE1-CD1 4.3Å; F769-F820 HydrophobicContact CE1-CG 4.43Å; F769-F820 HydrophobicContact CZ-CD1 4.11Å; F800-F820 HydrophobicContact CB-CD1 4.48Å; F800-F820 HydrophobicContact CB-CE1 4.12Å; F800-F820 HydrophobicContact CB-CE2 4.18Å; F800-F820 HydrophobicContact CB-CZ 3.97Å; F800-F820 HydrophobicContact CD2-CE2 4.03Å; F800-F820 HydrophobicContact CD2-CZ 4.46Å; F800-F820 HydrophobicContact CG-CE2 4.35Å; F800-F820 HydrophobicContact CG-CZ 4.34Å; F800-F820 PolarHBondContact N-O 3.31Å; F800-F820 PolarHBondContact O-N 3.07Å; L802-F820 HydrophobicContact CD1-CE1 3.94Å; F820-V822 HydrophobicContact CD2-CG2 4.08Å; F820-V822 HydrophobicContact CE2-CG2 3.89Å; F820-W831 HydrophobicContact CE2-CD2 4.02Å; F820-W831 HydrophobicContact CE2-CE3 4.15Å; F820-W831 HydrophobicContact CE2-CG 4.45Å; F820-W831 HydrophobicContact CE2-CZ3 4.46Å; F820-W831 HydrophobicContact CZ-CD2 4.1Å; F820-W831 AromaticContact CZ-CE3 3.75Å; F820-W831 HydrophobicContact CZ-CE3 3.75Å; F820-W831 HydrophobicContact CZ-CH2 4.45Å; F820-W831 AromaticContact CZ-CZ3 3.94Å; F820-W831 HydrophobicContact CZ-CZ3 3.94Å; F820-F835 HydrophobicContact CE1-CE2 4.29Å; F820-F835 HydrophobicContact CE1-CZ 4.05Å; F820-F835 AromaticContact CZ-CE2 3.78Å; F820-F835 HydrophobicContact CZ-CE2 3.78Å; F820-F835 AromaticContact CZ-CZ 3.77Å; F820-F835 HydrophobicContact CZ-CZ 3.77Å
821	R	92.6	Very high	75.4	Confident	17 Å²	17	68.4 Å²	68.4	6%	0.064	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.8	-179.8	-175	176.3	57.4	93.7	-7.8	111.4	Y746 E753 L794 D796 W798 L799	Y746-R821 PolarHBondContact N-O 3.07Å; Y746-R821 PolarHBondContact O-N 2.73Å; E753-R821 IonicContact OE1-CZ 2.91Å; E753-R821 IonicContact OE1-NE 2.72Å; E753-R821 PolarHBondContact OE1-NE 3.41Å; E753-R821 IonicContact OE1-NH2 2.65Å; E753-R821 IonicContact OE2-CZ 3.15Å; E753-R821 IonicContact OE2-NE 2.73Å; E753-R821 PolarHBondContact OE2-NE 2.73Å; E753-R821 IonicContact OE2-NH2 3.37Å; E753-R821 PolarHBondContact OE2-NH2 2.93Å; L794-R821 HydrophobicContact CD1-CG 4.42Å; D796-R821 PolarHBondContact O-NH1 2.79Å; D796-R821 WeakPolarHBondContact OD1-CD 3.39Å; D796-R821 IonicContact OD1-CZ 2.88Å; D796-R821 IonicContact OD1-NE 2.74Å; D796-R821 IonicContact OD1-NH1 3.11Å; D796-R821 PolarHBondContact OD1-NH1 3.29Å; D796-R821 IonicContact OD2-CZ 3.81Å; D796-R821 IonicContact OD2-NE 2.87Å; D796-R821 IonicContact OD2-NH1 3.27Å; D796-R821 PolarHBondContact OD2-NH1 3.2Å; D796-R821 IonicContact OD2-NH2 3.81Å; D796-R821 PolarHBondContact OD2-NH2 2.93Å; W798-R821 CarbonylContact O-C 3.42Å; W798-R821 VanDerWaalsContact O-CA 3.28Å; W798-R821 WeakPolarHBondContact O-CA 3.22Å; L799-R821 HydrophobicContact CD1-CB 4.38Å
822	V	91.4	Very high	77.3	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.6	177.7	-175.9	0	0	0	0	108.1	V745 G797 W798 F800 F820 A828 W831	V745-V822 HydrophobicContact CG1-CG2 4.24Å; G797-V822 CarbonylContact C-O 3.55Å; G797-V822 VanDerWaalsContact CA-O 3.24Å; G797-V822 WeakPolarHBondContact CA-O 3.33Å; W798-V822 PolarHBondContact N-O 3.48Å; W798-V822 PolarHBondContact O-N 2.84Å; F800-V822 HydrophobicContact CD2-CG2 3.84Å; F800-V822 HydrophobicContact CE2-CB 4.27Å; F800-V822 HydrophobicContact CE2-CG2 3.75Å; F820-V822 HydrophobicContact CD2-CG2 4.08Å; F820-V822 HydrophobicContact CE2-CG2 3.89Å; V822-A828 HydrophobicContact CB-CB 4.47Å; V822-A828 HydrophobicContact CG1-CB 4.38Å; V822-W831 HydrophobicContact CG2-CG 4.23Å
823	D	83.4	Confident	79.2	Confident	67 Å²	67	56.2 Å²	56.2	36%	0.358	31%	0.307	S	S	.	.	S	Bend	trans	-81.5	-18.6	-171.6	54.6	-1.2	0	0	0	114.8	R744 Y746	R744-D823 IonicContact CZ-OD2 2.61Å; R744-D823 IonicContact NH1-OD1 2.77Å; R744-D823 IonicContact NH1-OD2 3.8Å; R744-D823 PolarHBondContact NH1-OD2 3.1Å; Y746-D823 HydrophobicContact CE2-CB 3.71Å; Y746-D823 VanDerWaalsContact CE2-CG 3.5Å; Y746-D823 VanDerWaalsContact CE2-OD2 3.23Å; Y746-D823 WeakPolarHBondContact CE2-OD2 3.35Å; Y746-D823 PolarHBondContact OH-OD2 2.61Å
824	N	80.9	Confident	81.2	Confident	49 Å²	49	52.8 Å²	52.8	26%	0.262	29%	0.287	S	S	.	.			trans	-108.2	125.4	178.6	-178.8	-45.6	0	0	0	111.2	D268 A826 S827 A828	D268-N824 PolarHBondContact OD2-ND2 2.89Å; N824-A826 PolarHBondContact O-N 2.97Å; N824-A826 WeakPolarHBondContact OD1-CA 3.4Å; N824-A826 WeakPolarHBondContact OD1-CB 3.37Å; N824-A826 PolarHBondContact OD1-N 2.8Å; N824-S827 CarbonylContact O-C 3.58Å; N824-S827 WeakPolarHBondContact O-CA 3.34Å; N824-S827 WeakPolarHBondContact O-CB 3.26Å; N824-S827 PolarHBondContact O-N 3.4Å; N824-S827 PolarHBondContact OD1-N 2.77Å; N824-A828 PolarHBondContact O-N 3.42Å
825	S	79.8	Confident	83.1	Confident	55 Å²	55	45 Å²	45	39%	0.385	25%	0.254	S	S	.	.	H	α-helix	trans	-57.3	-39.6	178	-179.5	0	0	0	0	114	S827 A828 K829	S825-S827 VanDerWaalsContact C-N 3.27Å; S825-S827 PolarHBondContact O-N 3Å; S825-A828 PolarHBondContact O-N 3.27Å; S825-K829 WeakPolarHBondContact O-CG 3.23Å; S825-K829 PolarHBondContact O-N 3.14Å
826	A	80.6	Confident	84.7	Confident	47 Å²	47	43.5 Å²	43.5	39%	0.388	25%	0.254	S	S	.	.	H	α-helix	trans	-72.8	-17.4	174.7	0	0	0	0	0	113.5	N824 K830	N824-A826 PolarHBondContact O-N 2.97Å; N824-A826 WeakPolarHBondContact OD1-CA 3.4Å; N824-A826 WeakPolarHBondContact OD1-CB 3.37Å; N824-A826 PolarHBondContact OD1-N 2.8Å; A826-K830 WeakPolarHBondContact O-CD 3.45Å; A826-K830 WeakPolarHBondContact O-CE 3.46Å; A826-K830 WeakPolarHBondContact O-CG 3.3Å
827	S	82.5	Confident	85.7	Confident	39 Å²	39	42.1 Å²	42.1	27%	0.273	25%	0.246	S	C	.	.	H	α-helix	trans	-84.1	-40.8	165.7	-65.8	0	0	0	0	111.3	N824 S825 K829 K830 W831	N824-S827 CarbonylContact O-C 3.58Å; N824-S827 WeakPolarHBondContact O-CA 3.34Å; N824-S827 WeakPolarHBondContact O-CB 3.26Å; N824-S827 PolarHBondContact O-N 3.4Å; N824-S827 PolarHBondContact OD1-N 2.77Å; S825-S827 VanDerWaalsContact C-N 3.27Å; S825-S827 PolarHBondContact O-N 3Å; S827-K829 PolarHBondContact O-N 3.33Å; S827-K830 WeakPolarHBondContact O-CB 3.41Å; S827-K830 PolarHBondContact O-N 3.04Å; S827-W831 VanDerWaalsContact O-CD1 3.29Å; S827-W831 PolarHBondContact O-N 2.82Å; S827-W831 VanDerWaalsContact O-N 3.11Å
828	A	86.9	Confident	85.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.7	-50	176.2	0	0	0	0	0	111	W798 F800 V822 N824 S825 K830 W831 S832	W798-A828 HydrophobicContact CB-CB 3.61Å; W798-A828 HydrophobicContact CD2-CB 4.17Å; W798-A828 HydrophobicContact CG-CB 3.48Å; W798-A828 VanDerWaalsContact CG-CB 3.48Å; F800-A828 HydrophobicContact CE2-CB 4.3Å; F800-A828 HydrophobicContact CZ-CB 4.34Å; V822-A828 HydrophobicContact CB-CB 4.47Å; V822-A828 HydrophobicContact CG1-CB 4.38Å; N824-A828 PolarHBondContact O-N 3.42Å; S825-A828 PolarHBondContact O-N 3.27Å; A828-K830 PolarHBondContact O-N 2.88Å; A828-W831 CarbonylContact O-C 3.58Å; A828-W831 WeakPolarHBondContact O-CA 3.08Å; A828-W831 WeakPolarHBondContact O-CB 3.38Å; A828-W831 PolarHBondContact O-N 3.24Å; A828-S832 PolarHBondContact O-N 3.48Å; A828-S832 PolarHBondContact O-OG 3.06Å
829	K	86.9	Confident	85.6	Confident	144 Å²	144	43.9 Å²	43.9	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-53.9	-29.9	174.8	-71.7	177.2	-178.4	-176.1	0	114	S825 S827 A833	S825-K829 WeakPolarHBondContact O-CG 3.23Å; S825-K829 PolarHBondContact O-N 3.14Å; S827-K829 PolarHBondContact O-N 3.33Å; K829-A833 VanDerWaalsContact O-CB 3.26Å; K829-A833 WeakPolarHBondContact O-CB 3.12Å; K829-A833 PolarHBondContact O-N 2.88Å
830	K	87.1	Confident	84.9	Confident	131 Å²	131	48.4 Å²	48.4	57%	0.57	27%	0.27	S	S	*	.	H	α-helix	trans	-77.4	-36.4	175	-65.7	167.5	-174.6	165.9	0	112.4	V741 A826 S827 A828 A834	V741-K830 HydrophobicContact CG2-CB 4.11Å; A826-K830 WeakPolarHBondContact O-CD 3.45Å; A826-K830 WeakPolarHBondContact O-CE 3.46Å; A826-K830 WeakPolarHBondContact O-CG 3.3Å; S827-K830 WeakPolarHBondContact O-CB 3.41Å; S827-K830 PolarHBondContact O-N 3.04Å; A828-K830 PolarHBondContact O-N 2.88Å; K830-A834 WeakPolarHBondContact O-CB 3.41Å; K830-A834 PolarHBondContact O-N 2.97Å
831	W	90.9	Very high	84	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-67.4	-47.3	171.7	-76	103.3	0	0	0	111.2	V741 V745 A758 L767 F800 F820 V822 S827 A828 A833 A834 F835	V741-W831 HydrophobicContact CG1-CD2 3.94Å; V741-W831 HydrophobicContact CG1-CE3 3.53Å; V741-W831 HydrophobicContact CG1-CH2 3.99Å; V741-W831 HydrophobicContact CG1-CZ2 4.36Å; V741-W831 HydrophobicContact CG1-CZ3 3.56Å; V741-W831 HydrophobicContact CG2-CD2 3.91Å; V741-W831 HydrophobicContact CG2-CE3 4.38Å; V741-W831 HydrophobicContact CG2-CG 4.17Å; V741-W831 HydrophobicContact CG2-CZ2 4.27Å; V745-W831 HydrophobicContact CG1-CZ2 3.89Å; A758-W831 HydrophobicContact CB-CH2 3.7Å; A758-W831 HydrophobicContact CB-CZ2 3.9Å; A758-W831 WeakPolarHBondContact O-CZ2 3.31Å; L767-W831 HydrophobicContact CD1-CH2 3.86Å; L767-W831 HydrophobicContact CD1-CZ3 3.62Å; F800-W831 HydrophobicContact CD2-CB 4.39Å; F800-W831 HydrophobicContact CE1-CB 4.1Å; F800-W831 HydrophobicContact CE2-CB 3.82Å; F800-W831 HydrophobicContact CZ-CB 3.66Å; F820-W831 HydrophobicContact CE2-CD2 4.02Å; F820-W831 HydrophobicContact CE2-CE3 4.15Å; F820-W831 HydrophobicContact CE2-CG 4.45Å; F820-W831 HydrophobicContact CE2-CZ3 4.46Å; F820-W831 HydrophobicContact CZ-CD2 4.1Å; F820-W831 AromaticContact CZ-CE3 3.75Å; F820-W831 HydrophobicContact CZ-CE3 3.75Å; F820-W831 HydrophobicContact CZ-CH2 4.45Å; F820-W831 AromaticContact CZ-CZ3 3.94Å; F820-W831 HydrophobicContact CZ-CZ3 3.94Å; V822-W831 HydrophobicContact CG2-CG 4.23Å; S827-W831 VanDerWaalsContact O-CD1 3.29Å; S827-W831 PolarHBondContact O-N 2.82Å; S827-W831 VanDerWaalsContact O-N 3.11Å; A828-W831 CarbonylContact O-C 3.58Å; A828-W831 WeakPolarHBondContact O-CA 3.08Å; A828-W831 WeakPolarHBondContact O-CB 3.38Å; A828-W831 PolarHBondContact O-N 3.24Å; W831-A833 PolarHBondContact O-N 2.93Å; W831-A834 PolarHBondContact O-N 3.28Å; W831-F835 HydrophobicContact CB-CE2 4.41Å; W831-F835 HydrophobicContact CE3-CE1 4.43Å; W831-F835 AromaticContact CE3-CE2 3.79Å; W831-F835 HydrophobicContact CE3-CE2 3.79Å; W831-F835 AromaticContact CE3-CZ 3.67Å; W831-F835 HydrophobicContact CE3-CZ 3.67Å; W831-F835 AromaticContact CZ3-CZ 3.97Å; W831-F835 HydrophobicContact CZ3-CZ 3.97Å; W831-F835 VanDerWaalsContact O-CD2 3.27Å; W831-F835 WeakPolarHBondContact O-CD2 3.36Å; W831-F835 WeakPolarHBondContact O-CG 3.42Å; W831-F835 PolarHBondContact O-N 3.12Å
832	S	88.6	Confident	83	Confident	19 Å²	19	53.5 Å²	53.5	13%	0.133	30%	0.298	C	S	.	.	H	α-helix	trans	-53.6	-50.2	172.5	-57.2	0	0	0	0	111.8	E791 F800 A828 F835 A836	E791-S832 WeakPolarHBondContact OE2-CB 3.2Å; E791-S832 PolarHBondContact OE2-OG 3.31Å; F800-S832 WeakPolarHBondContact CE1-OG 3.35Å; F800-S832 WeakPolarHBondContact CZ-OG 3.42Å; A828-S832 PolarHBondContact O-N 3.48Å; A828-S832 PolarHBondContact O-OG 3.06Å; S832-F835 PolarHBondContact O-N 3.08Å; S832-A836 VanDerWaalsContact O-CB 3.27Å; S832-A836 WeakPolarHBondContact O-CB 3.25Å; S832-A836 PolarHBondContact O-N 3.44Å
833	A	87	Confident	81.2	Confident	60 Å²	60	58.3 Å²	58.3	50%	0.496	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-40.6	178.1	0	0	0	0	0	113	K829 W831 F835 D837	K829-A833 VanDerWaalsContact O-CB 3.26Å; K829-A833 WeakPolarHBondContact O-CB 3.12Å; K829-A833 PolarHBondContact O-N 2.88Å; W831-A833 PolarHBondContact O-N 2.93Å; A833-F835 VanDerWaalsContact C-N 3.33Å; A833-F835 PolarHBondContact O-N 2.87Å; A833-D837 VanDerWaalsContact O-CB 3.29Å; A833-D837 WeakPolarHBondContact O-CB 3.37Å; A833-D837 PolarHBondContact O-N 3.16Å; A833-D837 VanDerWaalsContact O-N 3.15Å
834	A	86.6	Confident	79.9	Confident	7 Å²	7	58.2 Å²	58.2	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-69.7	-27.8	178.5	0	0	0	0	0	113.3	I740 V741 K830 W831	I740-A834 HydrophobicContact CG2-CB 3.82Å; V741-A834 HydrophobicContact CB-CB 3.95Å; V741-A834 HydrophobicContact CG1-CB 3.55Å; K830-A834 WeakPolarHBondContact O-CB 3.41Å; K830-A834 PolarHBondContact O-N 2.97Å; W831-A834 PolarHBondContact O-N 3.28Å
835	F	89.1	Confident	78.2	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-82.3	-44.7	171.8	-67.2	-44	0	0	0	112.1	I784 Y789 F800 L802 F820 W831 S832 A833 D837 K838 L839	I784-F835 HydrophobicContact CD1-CD1 4.35Å; I784-F835 HydrophobicContact CD1-CE1 4.22Å; Y789-F835 HydrophobicContact CD1-CB 3.87Å; Y789-F835 HydrophobicContact CD2-CB 3.92Å; Y789-F835 HydrophobicContact CD2-CD2 4.28Å; Y789-F835 HydrophobicContact CD2-CG 4.45Å; Y789-F835 HydrophobicContact CE1-CB 3.97Å; Y789-F835 HydrophobicContact CE2-CB 4.03Å; Y789-F835 HydrophobicContact CG-CB 3.84Å; Y789-F835 HydrophobicContact CG-CG 4.38Å; F800-F835 HydrophobicContact CB-CE2 4.29Å; F800-F835 AromaticContact CD1-CD2 3.83Å; F800-F835 HydrophobicContact CD1-CD2 3.83Å; F800-F835 AromaticContact CD1-CE2 3.9Å; F800-F835 HydrophobicContact CD1-CE2 3.9Å; F800-F835 HydrophobicContact CE1-CD2 4.24Å; F800-F835 HydrophobicContact CG-CE2 4.15Å; L802-F835 HydrophobicContact CD1-CE2 4.32Å; L802-F835 HydrophobicContact CD1-CZ 4.08Å; L802-F835 HydrophobicContact CD2-CE1 4.17Å; L802-F835 HydrophobicContact CD2-CZ 4.31Å; F820-F835 HydrophobicContact CE1-CE2 4.29Å; F820-F835 HydrophobicContact CE1-CZ 4.05Å; F820-F835 AromaticContact CZ-CE2 3.78Å; F820-F835 HydrophobicContact CZ-CE2 3.78Å; F820-F835 AromaticContact CZ-CZ 3.77Å; F820-F835 HydrophobicContact CZ-CZ 3.77Å; W831-F835 HydrophobicContact CB-CE2 4.41Å; W831-F835 HydrophobicContact CE3-CE1 4.43Å; W831-F835 AromaticContact CE3-CE2 3.79Å; W831-F835 HydrophobicContact CE3-CE2 3.79Å; W831-F835 AromaticContact CE3-CZ 3.67Å; W831-F835 HydrophobicContact CE3-CZ 3.67Å; W831-F835 AromaticContact CZ3-CZ 3.97Å; W831-F835 HydrophobicContact CZ3-CZ 3.97Å; W831-F835 VanDerWaalsContact O-CD2 3.27Å; W831-F835 WeakPolarHBondContact O-CD2 3.36Å; W831-F835 WeakPolarHBondContact O-CG 3.42Å; W831-F835 PolarHBondContact O-N 3.12Å; S832-F835 PolarHBondContact O-N 3.08Å; A833-F835 VanDerWaalsContact C-N 3.33Å; A833-F835 PolarHBondContact O-N 2.87Å; F835-D837 PolarHBondContact O-N 3.02Å; F835-D837 VanDerWaalsContact O-N 3.17Å; F835-K838 CarbonylContact O-C 3.53Å; F835-K838 PolarHBondContact O-N 3.08Å; F835-L839 HydrophobicContact CB-CD1 4.39Å; F835-L839 HydrophobicContact CD1-CD1 3.62Å; F835-L839 HydrophobicContact CD1-CG 4.36Å; F835-L839 HydrophobicContact CE1-CD1 4.21Å; F835-L839 HydrophobicContact CG-CD1 4.23Å; F835-L839 WeakPolarHBondContact O-CA 3.35Å; F835-L839 PolarHBondContact O-N 2.84Å
836	A	84.2	Confident	76.1	Confident	62 Å²	62	72 Å²	72	51%	0.512	42%	0.418	S	S	.	.	H	α-helix	trans	-58.6	-29.8	177.4	0	0	0	0	0	113.6	S832 K838	S832-A836 VanDerWaalsContact O-CB 3.27Å; S832-A836 WeakPolarHBondContact O-CB 3.25Å; S832-A836 PolarHBondContact O-N 3.44Å; A836-K838 VanDerWaalsContact C-N 3.33Å
837	D	80.4	Confident	75.9	Confident	97 Å²	97	73.3 Å²	73.3	52%	0.519	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-14	175.3	175.9	47.8	0	0	0	113.4	A833 F835	A833-D837 VanDerWaalsContact O-CB 3.29Å; A833-D837 WeakPolarHBondContact O-CB 3.37Å; A833-D837 PolarHBondContact O-N 3.16Å; A833-D837 VanDerWaalsContact O-N 3.15Å; F835-D837 PolarHBondContact O-N 3.02Å; F835-D837 VanDerWaalsContact O-N 3.17Å
838	K	77.3	Confident	75.5	Confident	88 Å²	88	75.1 Å²	75.1	38%	0.383	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	-12.8	-168.2	-63.9	-67.4	162.4	-87.4	0	116.7	I740 L765 F835 A836	I740-K838 HydrophobicContact CD1-CG 4.44Å; L765-K838 HydrophobicContact CD1-CD 4.2Å; L765-K838 HydrophobicContact CD2-CD 3.99Å; L765-K838 HydrophobicContact CD2-CG 4.13Å; F835-K838 CarbonylContact O-C 3.53Å; F835-K838 PolarHBondContact O-N 3.08Å; A836-K838 VanDerWaalsContact C-N 3.33Å
839	L	80.9	Confident	74.9	Confident	20 Å²	20	79.2 Å²	79.2	11%	0.105	45%	0.451	C	S	.	.	S	Bend	trans	-135	152.5	-180	-59.7	-178	0	0	0	109.5	I784 Y787 Y789 L802 F835	I784-L839 HydrophobicContact CB-CD1 4.49Å; I784-L839 HydrophobicContact CB-CD2 4.18Å; I784-L839 HydrophobicContact CD1-CD1 3.99Å; I784-L839 HydrophobicContact CD1-CD2 4Å; I784-L839 HydrophobicContact CD1-CG 4.08Å; I784-L839 HydrophobicContact CG1-CD2 4.3Å; I784-L839 WeakPolarHBondContact O-CD2 3.32Å; Y787-L839 WeakPolarHBondContact O-CD2 3.22Å; Y789-L839 HydrophobicContact CD1-CB 3.79Å; Y789-L839 HydrophobicContact CE1-CB 4.46Å; L802-L839 HydrophobicContact CD2-CD1 4.05Å; F835-L839 HydrophobicContact CB-CD1 4.39Å; F835-L839 HydrophobicContact CD1-CD1 3.62Å; F835-L839 HydrophobicContact CD1-CG 4.36Å; F835-L839 HydrophobicContact CE1-CD1 4.21Å; F835-L839 HydrophobicContact CG-CD1 4.23Å; F835-L839 WeakPolarHBondContact O-CA 3.35Å; F835-L839 PolarHBondContact O-N 2.84Å
840	E	74.5	Confident	74.2	Confident	112 Å²	112	75.4 Å²	75.4	52%	0.523	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	149.4	170	-76.2	162.5	-137.3	0	0	110.9	F788 Y789 R805	F788-E840 VanDerWaalsContact CA-O 3.28Å; F788-E840 WeakPolarHBondContact CA-O 3.19Å; F788-E840 HydrophobicContact CD1-CB 3.75Å; F788-E840 HydrophobicContact CE1-CB 3.89Å; Y789-E840 WeakPolarHBondContact CD1-O 3.46Å; Y789-E840 PolarHBondContact N-O 2.97Å; R805-E840 IonicContact CZ-OE1 2.99Å; R805-E840 IonicContact CZ-OE2 2.76Å; R805-E840 IonicContact NH2-OE1 3.11Å; R805-E840 PolarHBondContact NH2-OE1 3.5Å; R805-E840 IonicContact NH2-OE2 3.47Å; R805-E840 PolarHBondContact NH2-OE2 2.96Å
841	L	72.9	Confident	73.4	Confident	103 Å²	103	71.9 Å²	71.9	54%	0.539	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	140.1	171.6	-162.6	77.7	0	0	0	109.8	Y789 P843	Y789-L841 HydrophobicContact CD2-CD1 4.3Å; Y789-L841 HydrophobicContact CE1-CB 4.47Å; Y789-L841 HydrophobicContact CE1-CD1 4.07Å; Y789-L841 HydrophobicContact CE2-CD1 3.79Å; Y789-L841 WeakPolarHBondContact O-CA 3.31Å; L841-P843 VanDerWaalsContact O-CD 3.28Å; L841-P843 WeakPolarHBondContact O-CD 3.36Å
842	D	70.3	Confident	72.2	Confident	20 Å²	20	76.6 Å²	76.6	11%	0.107	46%	0.461	C	S	.	.			trans	-62.3	115.5	174.5	175.5	6.2	0	0	0	111	F788 Y789 R790 T844	F788-D842 HydrophobicContact CB-CB 4.08Å; Y789-D842 PolarHBondContact O-N 2.68Å; R790-D842 IonicContact CZ-OD2 2.61Å; R790-D842 IonicContact NE-OD2 3.87Å; R790-D842 IonicContact NH2-OD2 2.73Å; R790-D842 PolarHBondContact NH2-OD2 2.94Å; D842-T844 PolarHBondContact O-N 2.69Å; D842-T844 WeakPolarHBondContact OD1-CB 3.46Å; D842-T844 PolarHBondContact OD1-N 3.27Å; D842-T844 PolarHBondContact OD1-OG1 2.65Å; D842-T844 PolarHBondContact OD2-OG1 3.06Å
843	P	55.3	Low	71.1	Confident	102 Å²	102	80.7 Å²	80.7	66%	0.662	48%	0.484	S	S	*	.			trans	-77.3	-3.4	-178.6	32.9	-36	0	0	0	113.5	L841 R845	L841-P843 VanDerWaalsContact O-CD 3.28Å; L841-P843 WeakPolarHBondContact O-CD 3.36Å; P843-R845 VanDerWaalsContact C-N 3.29Å; P843-R845 PolarHBondContact O-N 2.82Å
844	T	55.7	Low	69.8	Low	66 Å²	66	82.3 Å²	82.3	41%	0.405	48%	0.483	S	S	.	.	S	Bend	trans	-85.5	62.3	-171.9	65.6	0	0	0	0	114.3	R809 D842	R809-T844 PolarHBondContact NH2-OG1 3.27Å; D842-T844 PolarHBondContact O-N 2.69Å; D842-T844 WeakPolarHBondContact OD1-CB 3.46Å; D842-T844 PolarHBondContact OD1-N 3.27Å; D842-T844 PolarHBondContact OD1-OG1 2.65Å; D842-T844 PolarHBondContact OD2-OG1 3.06Å
845	R	45.5	Very low	68.4	Low	242 Å²	242	88.6 Å²	88.6	91%	0.913	52%	0.519	S	S	*	.			trans	136.8	111.2	159.2	-80	170	179.9	-175.8	0.4	111.4	P843	P843-R845 VanDerWaalsContact C-N 3.29Å; P843-R845 PolarHBondContact O-N 2.82Å
846	G	35.2	Very low	66.6	Low	151 Å²	151	96.6 Å²	96.6	100%	1.557	57%	0.566	S	S	*	*			trans	-92.7	0	143.1	0	0	0	0	0	110.3

Retrieved 846 of 846 residues in 353.7 ms (Link to these results)

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