A0A077ZCX8_TRITR Loading...

DNA replication licensing factor MCM8

AlphaFold DB , UniProt , Accession A0A077ZCX8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 849 aa.

						>A0A077ZCX8_TRITR|A0A077ZCX8
MAFRGIPHFKSRNSGTCFSYRSRSARGANRWSGNRFSGRKRPYFHRRASTSLSDETQSLNESSNNFSELDDSNAVSSPVLYVISDEEPPNAKPPRFAGWPIYFPCVKCEDKPETCALVEWCVEYLSNDADSPLNNFDSILAGRHFLVDVQHFFKHLTEERCLKVQQALRSNADDVISAMGLAMYELVIHRLDVGSIKLPKINARFWNFGPTVKIRDIQFSDCNRLVSFVGVVVRIGSCRPKCTRVAFLCESCNRRFSILLTDDVYITPSRCISKDCGGTLFEPLLETNDPTETVDWQQLRVQELVTEQDRSHSQENLALKTIDCELVDDLVGCCSSGSVVCITGVVKMKKNEEARKRYRWQYAMFISVTSVAVKKGLFSVAHSLSSSISRENELTIVEELMSNQNLFAQLVASFCPTIYGEHMVKAALVLSLFGASSKEFSLNRNTIHVLIIGDPGLGESGTIFNLFFCAFRKTHLLQACVDLSPIGVYVSGNTTTVSGLTVTIGHDSCGDSTIDAGALVISNDGCCCIDEFDKMTNQHKVLLEVMEQQQVSVFKAGTHSQFPAKVSVIAAINPAQGNYDRQMTVADNVKINSALLSRFDVIFLLLDEADEERDRRISAHVIQLRRPHSAAYLPFPEQPIDMDSLTSSALSSLKHRIQTEVEKGCLIPGPIFRKYIAFCRHSVNPHLSSAACNVLADFFQELNQEYTVQGIPSGTRQMESLIRLTQARARCELRDEATERDALDVIEILRSSMCQATNFAQHPFQQQSTKKQPKRGQQKIYRFIEALKREMVSKSDSSLEFPAAQLKQLAMELRLELSQPFECFLSKLNENGTLILKGHQRYALNPSLL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	28.6	Very low	251 Å²	251	167.6 Å²	167.6	100%	1.236	87%	0.871	S	S	*	*				0	112.3	0	-69.4	174	169.1	0	0	107.4
2	A	31.1	Very low	28.7	Very low	102 Å²	102	174.2 Å²	174.2	84%	0.843	88%	0.876	S	S	*	*			cis	-136.9	131.3	-8.4	0	0	0	0	0	106.8
3	F	25	Very low	28.6	Very low	219 Å²	219	174 Å²	174	96%	0.961	88%	0.879	S	S	*	*			trans	-101.1	120.9	173.9	-100	-91.5	0	0	0	108.8
4	R	31.6	Very low	28.9	Very low	254 Å²	254	169.4 Å²	169.4	96%	0.958	87%	0.871	S	S	*	*			trans	-157.8	134.9	159.3	-76	-169.2	175.9	-178.5	-1.3	106
5	G	30	Very low	28.7	Very low	74 Å²	74	163.4 Å²	163.4	76%	0.763	87%	0.868	S	S	*	*			cis	-175.7	144.9	0.8	0	0	0	0	0	107.7
6	I	24.9	Very low	28.8	Very low	154 Å²	154	161.5 Å²	161.5	79%	0.79	86%	0.864	S	S	*	*			trans	-85.7	149.6	168.1	-63.5	165.1	0	0	0	107.7
7	P	36.3	Very low	28.8	Very low	124 Å²	124	159.4 Å²	159.4	81%	0.805	86%	0.863	S	S	*	*			trans	-132.2	129.5	138	31.8	-17	0	0	0	112.5
8	H	25.1	Very low	28.6	Very low	166 Å²	166	161.6 Å²	161.6	77%	0.769	86%	0.864	S	S	*	*			trans	-86.7	166.3	165.2	-105.6	-82.2	0	0	0	111
9	F	25.8	Very low	28.6	Very low	183 Å²	183	158.7 Å²	158.7	80%	0.803	86%	0.857	S	S	*	*			trans	88.7	99.7	167.3	-79.5	-85.2	0	0	0	119.2
10	K	28.5	Very low	28.4	Very low	213 Å²	213	161.1 Å²	161.1	93%	0.926	86%	0.855	S	S	*	*				-148.2	119.2	117.8	-108.4	172.9	-175	176.7	0	110.9
11	S	27.7	Very low	28.3	Very low	104 Å²	104	163.5 Å²	163.5	73%	0.727	85%	0.853	S	S	*	*			trans	-66.1	132.6	170.3	55.3	0	0	0	0	111.5
12	R	30.3	Very low	28.2	Very low	246 Å²	246	156.4 Å²	156.4	93%	0.928	83%	0.828	S	S	*	*			trans	-134.1	115.3	153.3	-97.6	-175.6	173.1	176	-2.2	109.2	S14	R12-S14 PolarHBondContact O-N 3.14Å
13	N	27	Very low	28	Very low	172 Å²	172	162.2 Å²	162.2	92%	0.92	83%	0.828	S	S	*	*			trans	-58.9	123.4	162.7	-87	-20.2	0	0	0	109.9
14	S	32.8	Very low	28	Very low	110 Å²	110	157.5 Å²	157.5	77%	0.769	82%	0.822	S	S	*	*			trans	-148.2	97.4	147.3	57.1	0	0	0	0	107.2	R12	R12-S14 PolarHBondContact O-N 3.14Å
15	G	25.9	Very low	28.1	Very low	79 Å²	79	150 Å²	150	81%	0.814	81%	0.814	S	S	*	*			trans	-69.8	125.9	168.4	0	0	0	0	0	109.7
16	T	30.4	Very low	27.9	Very low	133 Å²	133	158.9 Å²	158.9	82%	0.816	82%	0.824	S	S	*	*			trans	-128.2	108.9	157.2	48	0	0	0	0	107.3
17	C	29.1	Very low	28.2	Very low	125 Å²	125	155 Å²	155	85%	0.845	82%	0.823	S	S	*	*			trans	-55	136	179.3	-65.5	0	0	0	0	112.2	S19	C17-S19 PolarHBondContact O-N 3.37Å
18	F	24.4	Very low	27.9	Very low	200 Å²	200	153.5 Å²	153.5	88%	0.877	82%	0.821	S	S	*	*			trans	-52.8	124.2	149.6	-87.3	-99.8	0	0	0	109.4
19	S	29	Very low	28.1	Very low	106 Å²	106	153 Å²	153	74%	0.741	82%	0.824	S	S	*	*			trans	-119.4	98.1	162.5	68.9	0	0	0	0	109.5	C17 R21	C17-S19 PolarHBondContact O-N 3.37Å; S19-R21 PolarHBondContact O-N 2.9Å
20	Y	25.2	Very low	28.2	Very low	207 Å²	207	155.8 Å²	155.8	81%	0.812	83%	0.829	S	S	*	*			trans	-55.5	125.1	150.9	-98.4	-102.7	0	0	0	108.5
21	R	26.1	Very low	28.1	Very low	212 Å²	212	157.5 Å²	157.5	80%	0.8	83%	0.83	S	S	*	*			trans	-118.9	82.4	162.9	-106.2	-173.3	179.6	-172.8	2.8	109.2	S19	S19-R21 PolarHBondContact O-N 2.9Å
22	S	25.2	Very low	28.1	Very low	102 Å²	102	158.3 Å²	158.3	71%	0.713	84%	0.835	S	S	*	*			trans	-73.6	122.4	148.7	49.6	0	0	0	0	108.6
23	R	28.3	Very low	28	Very low	224 Å²	224	149.7 Å²	149.7	85%	0.845	82%	0.823	S	S	*	*			trans	-135.9	105.5	159.2	-88.4	-170.3	174.5	-178.7	-2.9	109.5
24	S	24.2	Very low	28.2	Very low	119 Å²	119	148.5 Å²	148.5	83%	0.832	82%	0.817	S	S	*	*			trans	-121.4	118.2	161.5	55.9	0	0	0	0	108.4
25	A	33.5	Very low	28	Very low	96 Å²	96	154.1 Å²	154.1	79%	0.793	82%	0.821	S	S	*	*			trans	-173.4	102.3	156.1	0	0	0	0	0	105.9
26	R	27.1	Very low	27.9	Very low	261 Å²	261	160 Å²	160	99%	0.985	83%	0.825	S	S	*	*				53	120.9	84.2	-77.3	-167	-176.5	-175.7	3.1	115.2
27	G	29.9	Very low	27.7	Very low	74 Å²	74	159.5 Å²	159.5	76%	0.763	83%	0.826	S	S	*	*			trans	129.9	77.8	167.2	0	0	0	0	0	112.1
28	A	29.7	Very low	27.7	Very low	91 Å²	91	156.9 Å²	156.9	75%	0.752	82%	0.82	S	S	*	*				75.1	128.6	79.7	0	0	0	0	0	115.5
29	N	29.9	Very low	27.7	Very low	157 Å²	157	157.7 Å²	157.7	84%	0.84	82%	0.818	S	S	*	*			trans	83.3	125.3	166.9	-57.2	-18.9	0	0	0	116.1
30	R	28.7	Very low	27.5	Very low	241 Å²	241	160.8 Å²	160.8	91%	0.909	82%	0.818	S	S	*	*			cis	-158.7	145.6	39.2	-123.4	167.9	-174.1	178.6	0.6	111.6
31	W	25.3	Very low	27.8	Very low	249 Å²	249	162.3 Å²	162.3	94%	0.943	82%	0.822	S	S	*	*			trans	-55.4	161.6	159	-59.5	-15	0	0	0	111.3
32	S	27.6	Very low	28.1	Very low	121 Å²	121	157.8 Å²	157.8	85%	0.846	82%	0.82	S	S	*	*			cis	-170.9	163.2	33.7	46.6	0	0	0	0	109.8
33	G	29.6	Very low	28	Very low	65 Å²	65	163.4 Å²	163.4	67%	0.67	83%	0.827	S	S	*	*			trans	133.2	99.2	141	0	0	0	0	0	118.9
34	N	31	Very low	28	Very low	147 Å²	147	162.7 Å²	162.7	79%	0.786	83%	0.831	S	S	*	*			trans	72.1	135.9	147.9	-68.2	-15.2	0	0	0	118.5
35	R	27.5	Very low	28.1	Very low	227 Å²	227	165.7 Å²	165.7	86%	0.857	83%	0.831	S	S	*	*			cis	-159.1	143.5	9.4	-110.2	170.4	-159.8	-175.9	5.2	108.2
36	F	23.4	Very low	27.6	Very low	204 Å²	204	168.5 Å²	168.5	90%	0.895	82%	0.821	S	S	*	*			trans	-75.8	141	167.4	-107.2	-99.9	0	0	0	111.5
37	S	27.7	Very low	27.4	Very low	121 Å²	121	167.4 Å²	167.4	85%	0.846	82%	0.817	S	S	*	*				142.3	138.8	129	65	0	0	0	0	113.2
38	G	27.4	Very low	27	Very low	70 Å²	70	167.8 Å²	167.8	72%	0.722	81%	0.813	S	S	*	*			trans	123.4	77.6	148.5	0	0	0	0	0	119
39	R	24.8	Very low	26.7	Very low	217 Å²	217	168.8 Å²	168.8	82%	0.819	82%	0.815	S	S	*	*				58.6	127.7	128	-79.3	-176.4	175.9	-174	1.1	122.3
40	K	25.2	Very low	26.6	Very low	172 Å²	172	168.4 Å²	168.4	75%	0.748	82%	0.818	S	S	*	*				87	130.3	127.3	-73.4	-178.5	177.7	-168.2	0	119.5
41	R	32.3	Very low	26.3	Very low	238 Å²	238	162.2 Å²	162.2	90%	0.898	81%	0.812	S	S	*	*			trans	-42.9	157.6	163.8	-64	179.1	174.4	-175.5	-3	112.3
42	P	31.4	Very low	26.4	Very low	117 Å²	117	158.9 Å²	158.9	76%	0.76	81%	0.811	S	S	*	*				-145.7	161.9	122.2	31.9	-13.1	0	0	0	116.7
43	Y	23.8	Very low	26.2	Very low	220 Å²	220	157.6 Å²	157.6	86%	0.863	80%	0.803	S	S	*	*			trans	-48.8	155.4	163.9	-75.7	-103.1	0	0	0	114.4
44	F	27.9	Very low	26.1	Very low	209 Å²	209	162.8 Å²	162.8	92%	0.917	82%	0.815	S	S	*	*			trans	-120.6	123.4	162.5	-105.4	-82.9	0	0	0	110.8
45	H	25.4	Very low	25.7	Very low	182 Å²	182	163.9 Å²	163.9	84%	0.843	82%	0.815	S	S	*	*			trans	-120.2	140.9	158.7	-116.6	-58.1	0	0	0	108.9
46	R	23.1	Very low	25.6	Very low	156 Å²	156	158.7 Å²	158.7	59%	0.589	81%	0.809	S	S	*	*			trans	-40.1	149.3	170.2	-75.7	170.4	153.7	155.9	2.2	116.8	E250	R46-E250 IonicContact CZ-OE1 3.12Å; R46-E250 IonicContact CZ-OE2 3.53Å; R46-E250 VanDerWaalsContact NH1-CD 3.34Å; R46-E250 IonicContact NH1-OE1 2.71Å; R46-E250 PolarHBondContact NH1-OE1 3.09Å; R46-E250 IonicContact NH1-OE2 3.57Å; R46-E250 IonicContact NH2-OE1 2.99Å; R46-E250 PolarHBondContact NH2-OE1 2.99Å; R46-E250 IonicContact NH2-OE2 2.65Å; R46-E250 PolarHBondContact NH2-OE2 3.09Å
47	R	22.9	Very low	25.8	Very low	237 Å²	237	157.9 Å²	157.9	89%	0.894	81%	0.808	S	S	*	*				173.8	143	91.1	-116.5	174.5	-168.3	-177.5	3.8	113.7
48	A	23.3	Very low	25.7	Very low	83 Å²	83	156.4 Å²	156.4	69%	0.686	80%	0.798	S	S	*	*			trans	68.8	112.8	135.3	0	0	0	0	0	123.3
49	S	22	Very low	25.5	Very low	112 Å²	112	160.5 Å²	160.5	78%	0.783	80%	0.803	S	S	*	*				58.5	119.8	127	64.2	0	0	0	0	122.1
50	T	27.8	Very low	25.6	Very low	149 Å²	149	156.7 Å²	156.7	91%	0.914	80%	0.798	S	S	*	*			trans	-144.1	131.8	134.5	30.9	0	0	0	0	110.1
51	S	23	Very low	25.4	Very low	110 Å²	110	156.9 Å²	156.9	77%	0.769	80%	0.802	S	S	*	*			trans	-79.9	148.6	176.5	46.9	0	0	0	0	112.3
52	L	27.2	Very low	25.1	Very low	179 Å²	179	151.2 Å²	151.2	94%	0.937	80%	0.799	S	S	*	*			trans	-144.1	116.8	148.3	-105.7	145.9	0	0	0	107.8
53	S	24.5	Very low	24.6	Very low	95 Å²	95	150.9 Å²	150.9	66%	0.664	80%	0.799	S	S	*	*			trans	-84.5	141.9	177.9	45.4	0	0	0	0	111
54	D	25.8	Very low	24.7	Very low	174 Å²	174	148.2 Å²	148.2	93%	0.93	80%	0.8	S	S	*	*			trans	-132.5	111.5	144.3	-93.9	-27.3	0	0	0	107.9
55	E	24.3	Very low	24.4	Very low	169 Å²	169	145.8 Å²	145.8	79%	0.79	80%	0.796	S	S	*	*			trans	-72.8	156.8	165.3	-84.5	-176.9	163	0	0	109
56	T	24	Very low	24.4	Very low	119 Å²	119	146.9 Å²	146.9	73%	0.73	80%	0.799	S	S	*	*			cis	-177.2	153.5	28	21.2	0	0	0	0	108.2
57	Q	27.5	Very low	24.3	Very low	186 Å²	186	143.7 Å²	143.7	87%	0.869	80%	0.801	S	S	*	*				-173.5	110.5	125.3	-102.5	176.9	13.3	0	0	112.8
58	S	26.2	Very low	24.2	Very low	90 Å²	90	141 Å²	141	63%	0.629	80%	0.798	S	S	*	*			trans	41.2	115.4	138.1	54.4	0	0	0	0	120.8
59	L	23.2	Very low	24.2	Very low	157 Å²	157	144.5 Å²	144.5	82%	0.822	80%	0.804	S	S	*	*				76.6	107.3	77.4	-75.4	169.9	0	0	0	115
60	N	26.4	Very low	24.2	Very low	137 Å²	137	145.6 Å²	145.6	73%	0.733	80%	0.802	S	S	*	*				167	131.1	107	-93.7	-7.3	0	0	0	114.1
61	E	21.8	Very low	24	Very low	176 Å²	176	146.3 Å²	146.3	82%	0.822	80%	0.8	S	S	*	*			trans	13.2	128.6	144.9	-60.6	176.3	161.9	0	0	120.6
62	S	24.9	Very low	23.9	Very low	119 Å²	119	146.1 Å²	146.1	83%	0.832	80%	0.799	S	S	*	*				-176.2	139.5	107.1	34	0	0	0	0	112.8
63	S	21.8	Very low	23.7	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	80%	0.795	S	S	*	*			trans	-54.6	140.2	168.4	32	0	0	0	0	113.3
64	N	26.6	Very low	23.7	Very low	165 Å²	165	145.3 Å²	145.3	88%	0.882	80%	0.801	S	S	*	*			trans	-155.1	128.3	143.8	-99.3	-25.9	0	0	0	111.8
65	N	21.1	Very low	23.6	Very low	157 Å²	157	143.7 Å²	143.7	84%	0.84	80%	0.797	S	S	*	*			trans	-55.5	135.4	166	-64.7	-45.4	0	0	0	110.6
66	F	24.3	Very low	23.5	Very low	205 Å²	205	141.1 Å²	141.1	90%	0.899	80%	0.798	S	S	*	*			trans	-153.4	134.7	139.1	-136.8	-96.9	0	0	0	111.1
67	S	21.8	Very low	23.5	Very low	89 Å²	89	140.1 Å²	140.1	62%	0.622	80%	0.796	S	S	*	*			trans	-67.9	157	-175.9	43.7	0	0	0	0	114.4
68	E	21.7	Very low	23.6	Very low	181 Å²	181	135.7 Å²	135.7	85%	0.846	78%	0.783	S	S	*	*			trans	-7.8	129.5	151.8	-64.2	171.4	152.9	0	0	116.4
69	L	22.2	Very low	24	Very low	156 Å²	156	135.8 Å²	135.8	82%	0.817	78%	0.78	S	S	*	*				179.9	121.9	126.2	-91	154.3	0	0	0	110.6
70	D	21.9	Very low	24.8	Very low	136 Å²	136	130.7 Å²	130.7	73%	0.727	75%	0.753	S	S	*	*			trans	50.2	99.4	148.1	-59.6	-23.2	0	0	0	120.7
71	D	24.1	Very low	25.9	Very low	164 Å²	164	128.1 Å²	128.1	88%	0.877	73%	0.734	S	S	*	*			trans	-120.2	77.3	151.6	-99.7	-28.8	0	0	0	110.2	N73	D71-N73 VanDerWaalsContact C-N 3.26Å; D71-N73 PolarHBondContact O-N 3.4Å; D71-N73 VanDerWaalsContact O-N 3.09Å
72	S	21	Very low	27.3	Very low	106 Å²	106	122.2 Å²	122.2	74%	0.741	71%	0.709	S	S	*	*			trans	-74	79.3	159.3	55.4	0	0	0	0	109.3
73	N	22.1	Very low	28.5	Very low	161 Å²	161	119.6 Å²	119.6	86%	0.861	69%	0.686	S	S	*	*			trans	-171.4	70.9	162.4	-94.1	-29.1	0	0	0	110.9	D71	D71-N73 VanDerWaalsContact C-N 3.26Å; D71-N73 PolarHBondContact O-N 3.4Å; D71-N73 VanDerWaalsContact O-N 3.09Å
74	A	24.7	Very low	29.5	Very low	96 Å²	96	117.7 Å²	117.7	79%	0.793	67%	0.672	S	S	*	*			trans	-120.3	106.2	166.8	0	0	0	0	0	109.8	S76	A74-S76 PolarHBondContact O-N 3.05Å
75	V	23.8	Very low	30.2	Very low	140 Å²	140	115.7 Å²	115.7	85%	0.848	66%	0.662	S	S	*	*			trans	-43.6	124.9	169.7	174.5	0	0	0	0	110.1	S77	V75-S77 PolarHBondContact O-N 3.42Å; V75-S77 VanDerWaalsContact O-N 3.1Å
76	S	22.8	Very low	30.9	Very low	115 Å²	115	114.7 Å²	114.7	80%	0.804	65%	0.652	S	S	*	*			trans	-55.7	113.3	-172.7	66.8	0	0	0	0	111.9	A74	A74-S76 PolarHBondContact O-N 3.05Å
77	S	24.4	Very low	31.4	Very low	98 Å²	98	112.4 Å²	112.4	69%	0.685	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-72.8	142.9	163.7	-26	0	0	0	0	108.4	V75 V79	V75-S77 PolarHBondContact O-N 3.42Å; V75-S77 VanDerWaalsContact O-N 3.1Å; S77-V79 PolarHBondContact O-N 3.35Å
78	P	29	Very low	32.1	Very low	92 Å²	92	112.5 Å²	112.5	60%	0.597	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-64.1	123.8	175.1	27.3	-31.5	0	0	0	108.6	L80 I266	P78-L80 PolarHBondContact O-N 3.07Å; P78-I266 HydrophobicContact CB-CD1 3.95Å; P78-I266 HydrophobicContact CG-CD1 4.06Å
79	V	35	Very low	33.2	Very low	92 Å²	92	110.4 Å²	110.4	56%	0.558	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-65.2	116.9	178.5	179.6	0	0	0	0	108	S77 Y81	S77-V79 PolarHBondContact O-N 3.35Å; V79-Y81 HydrophobicContact CB-CE2 3.98Å; V79-Y81 HydrophobicContact CG1-CD1 4.29Å; V79-Y81 HydrophobicContact CG1-CE1 3.72Å; V79-Y81 HydrophobicContact CG1-CE2 3.98Å; V79-Y81 VanDerWaalsContact O-CD2 3.28Å; V79-Y81 WeakPolarHBondContact O-CD2 3.45Å; V79-Y81 VanDerWaalsContact O-CE2 3.29Å; V79-Y81 WeakPolarHBondContact O-CE2 3.46Å
80	L	38.7	Very low	34	Very low	51 Å²	51	110.7 Å²	110.7	27%	0.267	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-80.3	116.6	175.4	-84.4	167	0	0	0	109.5	P78 I258 I266 P268	P78-L80 PolarHBondContact O-N 3.07Å; L80-I258 HydrophobicContact CD2-CD1 4.15Å; L80-I258 HydrophobicContact CD2-CG2 4.04Å; L80-I266 HydrophobicContact CD1-CG2 4.22Å; L80-I266 HydrophobicContact CD2-CB 3.72Å; L80-I266 HydrophobicContact CD2-CD1 4.49Å; L80-I266 HydrophobicContact CD2-CG2 3.42Å; L80-I266 VanDerWaalsContact CD2-CG2 3.42Å; L80-I266 HydrophobicContact CG-CG2 3.97Å; L80-P268 HydrophobicContact CD1-CB 4.46Å
81	Y	51.1	Low	35.2	Very low	83 Å²	83	107 Å²	107	33%	0.325	64%	0.636	S	S	.	*			trans	-94.7	111.3	179.5	-62.8	-80.9	0	0	0	110.8	V79 C105 I258 L259	V79-Y81 HydrophobicContact CB-CE2 3.98Å; V79-Y81 HydrophobicContact CG1-CD1 4.29Å; V79-Y81 HydrophobicContact CG1-CE1 3.72Å; V79-Y81 HydrophobicContact CG1-CE2 3.98Å; V79-Y81 VanDerWaalsContact O-CD2 3.28Å; V79-Y81 WeakPolarHBondContact O-CD2 3.45Å; V79-Y81 VanDerWaalsContact O-CE2 3.29Å; V79-Y81 WeakPolarHBondContact O-CE2 3.46Å; Y81-C105 HydrophobicContact CE1-CB 4.03Å; Y81-C105 HydrophobicContact CE2-CB 4.28Å; Y81-C105 WeakPolarHBondContact CE2-SG 3.49Å; Y81-C105 VanDerWaalsContact CZ-SG 3.51Å; Y81-I258 WeakPolarHBondContact O-CA 3.36Å; Y81-L259 PolarHBondContact O-N 3.08Å
82	V	49.6	Very low	36.3	Very low	51 Å²	51	108.2 Å²	108.2	31%	0.309	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	119.4	-179.9	175	0	0	0	0	108	S84 F256 I258 I272	V82-S84 PolarHBondContact O-N 2.85Å; V82-F256 HydrophobicContact CG1-CB 4.34Å; V82-F256 HydrophobicContact CG1-CD2 4.49Å; V82-I258 HydrophobicContact CG2-CG1 4.22Å; V82-I272 HydrophobicContact CB-CD1 3.87Å; V82-I272 HydrophobicContact CB-CG1 3.96Å; V82-I272 HydrophobicContact CG1-CB 4.44Å; V82-I272 HydrophobicContact CG1-CD1 3.13Å; V82-I272 HydrophobicContact CG1-CG1 3.54Å; V82-I272 HydrophobicContact CG1-CG2 4.22Å; V82-I272 HydrophobicContact CG2-CD1 3.48Å; V82-I272 VanDerWaalsContact CG2-CD1 3.48Å; V82-I272 HydrophobicContact CG2-CG1 3.53Å
83	I	51.2	Low	37.9	Very low	65 Å²	65	108.8 Å²	108.8	33%	0.333	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.6	102.7	168.8	-57.2	173.9	0	0	0	106.5	S257 L259	I83-S257 PolarHBondContact N-O 3.3Å; I83-S257 PolarHBondContact O-OG 2.99Å; I83-L259 HydrophobicContact CD1-CB 3.92Å
84	S	42.9	Very low	39.7	Very low	69 Å²	69	104.2 Å²	104.2	48%	0.483	61%	0.613	S	S	.	*			trans	-87.1	130.1	165.6	49.7	0	0	0	0	109.1	V82 E86	V82-S84 PolarHBondContact O-N 2.85Å; S84-E86 PolarHBondContact O-N 2.98Å
85	D	41.8	Very low	41.7	Very low	123 Å²	123	107.6 Å²	107.6	66%	0.658	61%	0.605	S	S	*	*	S	Bend	trans	-66.1	-1.8	175.3	-70.8	-49.5	0	0	0	113.7	K197	D85-K197 IonicContact OD1-NZ 3.96Å
86	E	35.1	Very low	43.9	Very low	135 Å²	135	102 Å²	102	63%	0.631	57%	0.569	S	S	*	*			trans	-98.9	93.1	174.4	-68.8	173.1	-160.7	0	0	109.2	S84 R254	S84-E86 PolarHBondContact O-N 2.98Å; E86-R254 IonicContact OE1-NH2 3.02Å; E86-R254 PolarHBondContact OE1-NH2 3.34Å; E86-R254 IonicContact OE2-NH2 3.34Å; E86-R254 PolarHBondContact OE2-NH2 3.46Å
87	E	33.9	Very low	46	Very low	157 Å²	157	99.1 Å²	99.1	73%	0.734	55%	0.553	S	S	*	*			trans	-67.2	136	162.8	-78.2	-175.1	165.8	0	0	109
88	P	38.2	Very low	48.2	Very low	91 Å²	91	94.4 Å²	94.4	59%	0.591	52%	0.52	S	S	*	.			trans	-60.9	135.6	173.4	24.9	-31.1	0	0	0	108.9	N90 A91	P88-N90 PolarHBondContact O-N 3.32Å; P88-A91 HydrophobicContact CG-CB 4.4Å; P88-A91 PolarHBondContact O-N 2.9Å
89	P	42.8	Very low	50.4	Low	138 Å²	138	90.5 Å²	90.5	90%	0.896	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	8.9	-171.1	25.1	-34.9	0	0	0	115.4
90	N	40.3	Very low	52.1	Low	161 Å²	161	89.2 Å²	89.2	86%	0.861	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.6	15.3	-175.1	-109	-5.4	0	0	0	113.8	P88 K92	P88-N90 PolarHBondContact O-N 3.32Å; N90-K92 PolarHBondContact O-N 3.36Å
91	A	46.5	Very low	53.8	Low	60 Å²	60	89.7 Å²	89.7	50%	0.496	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-74.2	124.9	171.4	0	0	0	0	0	109.9	P88	P88-A91 HydrophobicContact CG-CB 4.4Å; P88-A91 PolarHBondContact O-N 2.9Å
92	K	48.3	Very low	54.8	Low	189 Å²	189	86.4 Å²	86.4	82%	0.822	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-56.8	136.8	169.4	-75.9	179.8	178.5	176.9	0	108.5	N90	N90-K92 PolarHBondContact O-N 3.36Å
93	P	54.1	Low	56.1	Low	117 Å²	117	84.7 Å²	84.7	76%	0.76	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-56.6	134.1	177.1	23.5	-32	0	0	0	108.7
94	P	59.8	Low	56.6	Low	65 Å²	65	84.2 Å²	84.2	42%	0.422	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-58.4	143.8	178.3	25.2	-32.9	0	0	0	109.3	F96 W99 P100	P94-F96 WeakPolarHBondContact CB-O 3.41Å; P94-F96 WeakPolarHBondContact CG-O 3.48Å; P94-F96 PolarHBondContact O-N 3.27Å; P94-W99 HydrophobicContact CB-CB 4.38Å; P94-P100 HydrophobicContact CG-CG 4.5Å
95	R	66.8	Low	57.4	Low	168 Å²	168	83.4 Å²	83.4	63%	0.634	46%	0.46	S	S	*	.	S	Bend	trans	-51.5	-27.7	-179.7	-177.1	176.5	177	165.5	-0.5	112.9	E119	R95-E119 IonicContact CZ-OE1 3.51Å; R95-E119 IonicContact NE-OE1 2.73Å; R95-E119 IonicContact NH2-OE1 3.96Å; R95-E119 PolarHBondContact NH2-OE1 2.95Å
96	F	68.6	Low	58.5	Low	21 Å²	21	79.5 Å²	79.5	9%	0.092	44%	0.44	C	S	.	.	S	Bend	trans	-125.7	127.4	171.6	-57.2	-74.5	0	0	0	107.9	P94 G98 W99 C115 V118 E119 L181 E185	P94-F96 WeakPolarHBondContact CB-O 3.41Å; P94-F96 WeakPolarHBondContact CG-O 3.48Å; P94-F96 PolarHBondContact O-N 3.27Å; F96-G98 PolarHBondContact O-N 2.95Å; F96-W99 HydrophobicContact CB-CB 4.31Å; F96-W99 AromaticContact CD2-CE3 3.74Å; F96-W99 HydrophobicContact CD2-CE3 3.74Å; F96-W99 HydrophobicContact CD2-CZ3 4.12Å; F96-W99 HydrophobicContact CE2-CE3 4.49Å; F96-W99 HydrophobicContact CE2-CZ3 4.45Å; F96-W99 WeakPolarHBondContact O-CB 3.45Å; F96-W99 PolarHBondContact O-N 3Å; F96-W99 VanDerWaalsContact O-N 3.16Å; F96-C115 HydrophobicContact CE2-CB 4.06Å; F96-V118 HydrophobicContact CD1-CG1 4.19Å; F96-V118 HydrophobicContact CE1-CG1 3.87Å; F96-V118 HydrophobicContact CE2-CG1 4.38Å; F96-V118 HydrophobicContact CZ-CB 4.29Å; F96-V118 HydrophobicContact CZ-CG1 3.97Å; F96-E119 HydrophobicContact CZ-CG 4.18Å; F96-L181 HydrophobicContact CB-CD1 4.31Å; F96-L181 HydrophobicContact CB-CD2 4.19Å; F96-L181 HydrophobicContact CG-CD2 4.4Å; F96-E185 WeakPolarHBondContact CA-OE1 3.47Å; F96-E185 HydrophobicContact CB-CG 4.26Å; F96-E185 WeakPolarHBondContact CB-OE1 3.5Å; F96-E185 HydrophobicContact CD1-CG 3.99Å
97	A	67.9	Low	59.9	Low	55 Å²	55	80 Å²	80	46%	0.455	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-32.9	-179.2	0	0	0	0	0	112.9	E185 I188	A97-E185 WeakPolarHBondContact CA-OE1 3.3Å; A97-E185 PolarHBondContact N-OE1 3.48Å; A97-E185 PolarHBondContact N-OE2 3.16Å; A97-I188 HydrophobicContact CB-CD1 3.89Å
98	G	70.8	Confident	61.2	Low	0 Å²	0	73.6 Å²	73.6	0%	0	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-4.2	178.8	0	0	0	0	0	115.5	F96 I101 L181 E185	F96-G98 PolarHBondContact O-N 2.95Å; G98-I101 WeakPolarHBondContact O-CB 3.3Å; G98-I101 PolarHBondContact O-N 2.99Å; G98-L181 VanDerWaalsContact CA-CD1 3.46Å; G98-E185 PolarHBondContact N-OE1 3Å
99	W	76	Confident	62.5	Low	10 Å²	10	77.2 Å²	77.2	4%	0.038	42%	0.421	C	S	.	.	H	α-helix	trans	-52.1	-44.4	-173.3	-169.3	-85.5	0	0	0	114.1	P94 F96 I101 Y102 F103 V106 C108 T114 C115 L181	P94-W99 HydrophobicContact CB-CB 4.38Å; F96-W99 HydrophobicContact CB-CB 4.31Å; F96-W99 AromaticContact CD2-CE3 3.74Å; F96-W99 HydrophobicContact CD2-CE3 3.74Å; F96-W99 HydrophobicContact CD2-CZ3 4.12Å; F96-W99 HydrophobicContact CE2-CE3 4.49Å; F96-W99 HydrophobicContact CE2-CZ3 4.45Å; F96-W99 WeakPolarHBondContact O-CB 3.45Å; F96-W99 PolarHBondContact O-N 3Å; F96-W99 VanDerWaalsContact O-N 3.16Å; W99-I101 PolarHBondContact O-N 3.34Å; W99-Y102 PolarHBondContact O-N 3.25Å; W99-F103 HydrophobicContact CD2-CB 4.4Å; W99-F103 HydrophobicContact CD2-CD2 4.13Å; W99-F103 HydrophobicContact CE3-CD2 4.14Å; W99-F103 AromaticContact CH2-CD2 3.93Å; W99-F103 HydrophobicContact CH2-CD2 3.93Å; W99-F103 HydrophobicContact CH2-CE2 4.31Å; W99-F103 HydrophobicContact CH2-CG 4.49Å; W99-F103 HydrophobicContact CZ2-CB 4.04Å; W99-F103 AromaticContact CZ2-CD2 3.91Å; W99-F103 HydrophobicContact CZ2-CD2 3.91Å; W99-F103 HydrophobicContact CZ2-CG 4.09Å; W99-F103 HydrophobicContact CZ3-CD2 4.05Å; W99-F103 HydrophobicContact CZ3-CE2 4.34Å; W99-F103 CarbonylContact O-C 3.31Å; W99-F103 PolarHBondContact O-N 3.3Å; W99-V106 PolarHBondContact NE1-O 2.97Å; W99-C108 HydrophobicContact CD2-CB 3.87Å; W99-C108 HydrophobicContact CE3-CB 4.01Å; W99-C108 HydrophobicContact CH2-CB 3.98Å; W99-C108 VanDerWaalsContact CZ2-CA 3.46Å; W99-C108 HydrophobicContact CZ2-CB 3.81Å; W99-C108 HydrophobicContact CZ3-CB 4.07Å; W99-T114 HydrophobicContact CH2-CG2 4.23Å; W99-C115 WeakPolarHBondContact CH2-SG 3.39Å; W99-C115 WeakPolarHBondContact CZ3-SG 3.49Å; W99-L181 HydrophobicContact CD2-CD2 4.44Å; W99-L181 HydrophobicContact CE3-CD2 3.53Å; W99-L181 HydrophobicContact CZ3-CD2 4.02Å
100	P	70.3	Confident	63.6	Low	65 Å²	65	75.8 Å²	75.8	42%	0.422	41%	0.406	S	S	.	.	H	α-helix	trans	-64.2	-22	-179.1	-20.2	33.1	0	0	0	114.3	P94 P104	P94-P100 HydrophobicContact CG-CG 4.5Å; P100-P104 WeakPolarHBondContact O-CA 3.38Å; P100-P104 WeakPolarHBondContact O-CB 3.36Å
101	I	73	Confident	65.2	Low	60 Å²	60	71.2 Å²	71.2	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-80.9	-37.3	-177.6	-61.1	170.3	0	0	0	110.9	G98 W99 Y184 K200	G98-I101 WeakPolarHBondContact O-CB 3.3Å; G98-I101 PolarHBondContact O-N 2.99Å; W99-I101 PolarHBondContact O-N 3.34Å; I101-Y184 HydrophobicContact CD1-CE1 4.15Å; I101-Y184 HydrophobicContact CD1-CE2 3.84Å; I101-Y184 VanDerWaalsContact CD1-CZ 3.49Å; I101-Y184 WeakPolarHBondContact CD1-OH 3.45Å; I101-K200 HydrophobicContact CG2-CB 3.79Å; I101-K200 HydrophobicContact CG2-CD 4.42Å; I101-K200 HydrophobicContact CG2-CG 4.07Å
102	Y	73.7	Confident	66.6	Low	15 Å²	15	72.9 Å²	72.9	6%	0.059	38%	0.384	C	S	.	.	H	α-helix	trans	-95.3	-35.3	-177	-69.8	-90.2	0	0	0	112.6	W99 P104 S177 G180 L181 Y184 K200 I201	W99-Y102 PolarHBondContact O-N 3.25Å; Y102-P104 VanDerWaalsContact C-CD 3.46Å; Y102-P104 WeakPolarHBondContact O-CD 3.4Å; Y102-S177 WeakPolarHBondContact CD1-O 3.46Å; Y102-G180 VanDerWaalsContact CZ-C 3.44Å; Y102-G180 PolarHBondContact OH-O 3Å; Y102-L181 HydrophobicContact CD2-CB 3.94Å; Y102-L181 HydrophobicContact CD2-CD1 3.95Å; Y102-L181 HydrophobicContact CE2-CB 4.35Å; Y102-L181 HydrophobicContact CE2-CD1 4.42Å; Y102-L181 HydrophobicContact CG-CB 4.11Å; Y102-Y184 HydrophobicContact CE2-CD2 4.28Å; Y102-Y184 HydrophobicContact CE2-CG 4.21Å; Y102-K200 HydrophobicContact CE1-CD 4.48Å; Y102-K200 HydrophobicContact CE1-CG 3.92Å; Y102-I201 WeakPolarHBondContact CE1-O 3.4Å; Y102-I201 WeakPolarHBondContact OH-CA 3.45Å; Y102-I201 PolarHBondContact OH-N 2.98Å; Y102-I201 PolarHBondContact OH-O 3.19Å
103	F	75.9	Confident	68	Low	14 Å²	14	71.5 Å²	71.5	6%	0.061	38%	0.381	C	S	.	.			trans	-127.6	68.8	179.6	-59.8	-71.3	0	0	0	110.6	W99 C105 T114 L181	W99-F103 HydrophobicContact CD2-CB 4.4Å; W99-F103 HydrophobicContact CD2-CD2 4.13Å; W99-F103 HydrophobicContact CE3-CD2 4.14Å; W99-F103 AromaticContact CH2-CD2 3.93Å; W99-F103 HydrophobicContact CH2-CD2 3.93Å; W99-F103 HydrophobicContact CH2-CE2 4.31Å; W99-F103 HydrophobicContact CH2-CG 4.49Å; W99-F103 HydrophobicContact CZ2-CB 4.04Å; W99-F103 AromaticContact CZ2-CD2 3.91Å; W99-F103 HydrophobicContact CZ2-CD2 3.91Å; W99-F103 HydrophobicContact CZ2-CG 4.09Å; W99-F103 HydrophobicContact CZ3-CD2 4.05Å; W99-F103 HydrophobicContact CZ3-CE2 4.34Å; W99-F103 CarbonylContact O-C 3.31Å; W99-F103 PolarHBondContact O-N 3.3Å; F103-C105 PolarHBondContact O-N 3.48Å; F103-T114 HydrophobicContact CE1-CG2 4.22Å; F103-T114 HydrophobicContact CE2-CG2 3.89Å; F103-T114 HydrophobicContact CZ-CG2 3.58Å; F103-L181 HydrophobicContact CE2-CD2 4.46Å
104	P	62.7	Low	69.1	Low	56 Å²	56	66.4 Å²	66.4	36%	0.364	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.9	-176.1	24.4	-34.2	0	0	0	113.6	P100 Y102 L259	P100-P104 WeakPolarHBondContact O-CA 3.38Å; P100-P104 WeakPolarHBondContact O-CB 3.36Å; Y102-P104 VanDerWaalsContact C-CD 3.46Å; Y102-P104 WeakPolarHBondContact O-CD 3.4Å; P104-L259 HydrophobicContact CB-CD2 3.68Å; P104-L259 HydrophobicContact CG-CD2 3.46Å; P104-L259 VanDerWaalsContact CG-CD2 3.46Å
105	C	58.5	Low	69.9	Low	52 Å²	52	63.5 Å²	63.5	35%	0.351	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	0.3	-169.9	-53	0	0	0	0	114.5	Y81 F103	Y81-C105 HydrophobicContact CE1-CB 4.03Å; Y81-C105 HydrophobicContact CE2-CB 4.28Å; Y81-C105 WeakPolarHBondContact CE2-SG 3.49Å; Y81-C105 VanDerWaalsContact CZ-SG 3.51Å; F103-C105 PolarHBondContact O-N 3.48Å
106	V	66.1	Low	70.6	Confident	40 Å²	40	56.9 Å²	56.9	24%	0.242	31%	0.31	C	S	.	.			trans	-134.9	133	-170.1	-171.5	0	0	0	0	108.9	W99 D110 K111	W99-V106 PolarHBondContact NE1-O 2.97Å; V106-D110 HydrophobicContact CG1-CB 4.01Å; V106-K111 HydrophobicContact CG1-CB 4.41Å; V106-K111 HydrophobicContact CG1-CD 4.06Å; V106-K111 HydrophobicContact CG1-CG 3.91Å
107	K	64.4	Low	71.3	Confident	147 Å²	147	56.7 Å²	56.7	64%	0.639	31%	0.31	S	S	*	.			trans	-78.9	145.2	171.2	-59.3	179.9	179	176.7	0	108.8	E109 D110	K107-E109 PolarHBondContact O-N 3.08Å; K107-E109 VanDerWaalsContact O-N 3.08Å; K107-D110 WeakPolarHBondContact CB-OD2 3.49Å; K107-D110 PolarHBondContact N-OD2 3.38Å; K107-D110 WeakPolarHBondContact O-CB 3.41Å; K107-D110 PolarHBondContact O-N 2.89Å
108	C	61.2	Low	71.9	Confident	21 Å²	21	54 Å²	54	14%	0.142	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-57.5	-27.1	177.5	173.4	0	0	0	0	112.3	W99 D110 K111 C115	W99-C108 HydrophobicContact CD2-CB 3.87Å; W99-C108 HydrophobicContact CE3-CB 4.01Å; W99-C108 HydrophobicContact CH2-CB 3.98Å; W99-C108 VanDerWaalsContact CZ2-CA 3.46Å; W99-C108 HydrophobicContact CZ2-CB 3.81Å; W99-C108 HydrophobicContact CZ3-CB 4.07Å; C108-D110 PolarHBondContact O-N 2.77Å; C108-K111 PolarHBondContact O-N 3.11Å; C108-C115 VanDerWaalsContact CA-SG 3.59Å; C108-C115 WeakPolarHBondContact CB-SG 3.5Å; C108-C115 PolarHBondContact O-SG 3.29Å; C108-C115 WeakPolarHBondContact SG-CB 3.47Å; C108-C115 CovalentContact SG-SG 2.08Å; C108-C115 PolarHBondContact SG-SG 3.17Å
109	E	64.2	Low	72.5	Confident	168 Å²	168	57.9 Å²	57.9	79%	0.785	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-63.1	-28.2	174.7	-63.3	176.5	179.9	0	0	113.2	K107	K107-E109 PolarHBondContact O-N 3.08Å; K107-E109 VanDerWaalsContact O-N 3.08Å
110	D	67.3	Low	72.8	Confident	108 Å²	108	59.3 Å²	59.3	58%	0.578	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-84.1	-13.9	-175.4	-57.2	-37	0	0	0	113.1	V106 K107 C108	V106-D110 HydrophobicContact CG1-CB 4.01Å; K107-D110 WeakPolarHBondContact CB-OD2 3.49Å; K107-D110 PolarHBondContact N-OD2 3.38Å; K107-D110 WeakPolarHBondContact O-CB 3.41Å; K107-D110 PolarHBondContact O-N 2.89Å; C108-D110 PolarHBondContact O-N 2.77Å
111	K	73.2	Confident	73.3	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.278	29%	0.291	S	S	.	.			trans	-135.1	75	179.7	-78.7	-167.4	176.9	-174.6	0	111.9	V106 C108 E113 T114 C115 D174	V106-K111 HydrophobicContact CG1-CB 4.41Å; V106-K111 HydrophobicContact CG1-CD 4.06Å; V106-K111 HydrophobicContact CG1-CG 3.91Å; C108-K111 PolarHBondContact O-N 3.11Å; K111-E113 VanDerWaalsContact C-N 3.27Å; K111-E113 PolarHBondContact O-N 3.48Å; K111-T114 PolarHBondContact O-N 3.14Å; K111-C115 PolarHBondContact O-N 3.38Å; K111-D174 IonicContact NZ-OD1 3.24Å; K111-D174 IonicContact NZ-OD2 3.46Å; K111-D174 PolarHBondContact NZ-OD2 3.4Å
112	P	76	Confident	73.8	Confident	95 Å²	95	55.1 Å²	55.1	62%	0.617	29%	0.287	S	S	*	.	H	α-helix	trans	-62.7	-33.1	-179.5	25.2	-34.1	0	0	0	112.8	T114 C115 A116	P112-T114 PolarHBondContact O-N 3.07Å; P112-C115 PolarHBondContact O-N 3.03Å; P112-A116 PolarHBondContact O-N 3.02Å
113	E	77.2	Confident	74.1	Confident	161 Å²	161	58.7 Å²	58.7	75%	0.752	30%	0.304	S	S	*	.	H	α-helix	trans	-64.1	-40.2	177.9	-62.7	-173.4	169.8	0	0	112.2	K111 A116 L117	K111-E113 VanDerWaalsContact C-N 3.27Å; K111-E113 PolarHBondContact O-N 3.48Å; E113-A116 PolarHBondContact O-N 3.31Å; E113-L117 WeakPolarHBondContact O-CB 3.41Å; E113-L117 PolarHBondContact O-N 3.11Å
114	T	77.1	Confident	74.3	Confident	10 Å²	10	58.8 Å²	58.8	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-69.3	-39.8	176.8	-49.1	0	0	0	0	111	W99 F103 K111 P112 A116 L117 V118	W99-T114 HydrophobicContact CH2-CG2 4.23Å; F103-T114 HydrophobicContact CE1-CG2 4.22Å; F103-T114 HydrophobicContact CE2-CG2 3.89Å; F103-T114 HydrophobicContact CZ-CG2 3.58Å; K111-T114 PolarHBondContact O-N 3.14Å; P112-T114 PolarHBondContact O-N 3.07Å; T114-A116 VanDerWaalsContact C-N 3.35Å; T114-A116 PolarHBondContact O-N 2.95Å; T114-L117 VanDerWaalsContact O-CB 3.32Å; T114-L117 WeakPolarHBondContact O-CB 3.48Å; T114-L117 PolarHBondContact O-N 2.87Å; T114-V118 WeakPolarHBondContact O-CG2 3.29Å; T114-V118 PolarHBondContact O-N 3.26Å
115	C	77.5	Confident	75	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.027	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-37.2	176.2	-58.3	0	0	0	0	111.5	F96 W99 C108 K111 P112 V118 E119	F96-C115 HydrophobicContact CE2-CB 4.06Å; W99-C115 WeakPolarHBondContact CH2-SG 3.39Å; W99-C115 WeakPolarHBondContact CZ3-SG 3.49Å; C108-C115 VanDerWaalsContact CA-SG 3.59Å; C108-C115 WeakPolarHBondContact CB-SG 3.5Å; C108-C115 PolarHBondContact O-SG 3.29Å; C108-C115 WeakPolarHBondContact SG-CB 3.47Å; C108-C115 CovalentContact SG-SG 2.08Å; C108-C115 PolarHBondContact SG-SG 3.17Å; K111-C115 PolarHBondContact O-N 3.38Å; P112-C115 PolarHBondContact O-N 3.03Å; C115-V118 PolarHBondContact O-N 3.26Å; C115-E119 PolarHBondContact O-N 3.25Å
116	A	81.7	Confident	75.8	Confident	28 Å²	28	57 Å²	57	23%	0.231	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-38.6	171.8	0	0	0	0	0	112.6	P112 E113 T114 V118 E119 W120	P112-A116 PolarHBondContact O-N 3.02Å; E113-A116 PolarHBondContact O-N 3.31Å; T114-A116 VanDerWaalsContact C-N 3.35Å; T114-A116 PolarHBondContact O-N 2.95Å; A116-V118 VanDerWaalsContact C-N 3.34Å; A116-V118 PolarHBondContact O-N 3.49Å; A116-E119 PolarHBondContact O-N 2.91Å; A116-W120 HydrophobicContact CB-CZ2 4.24Å; A116-W120 VanDerWaalsContact O-CG 3.25Å; A116-W120 PolarHBondContact O-N 3.3Å; A116-W120 VanDerWaalsContact O-N 3.1Å
117	L	82.1	Confident	76	Confident	17 Å²	17	59.9 Å²	59.9	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-42.9	174.5	-117.3	145.6	0	0	0	111.8	E113 T114 W120 C121 V164 A167 V175 A178	E113-L117 WeakPolarHBondContact O-CB 3.41Å; E113-L117 PolarHBondContact O-N 3.11Å; T114-L117 VanDerWaalsContact O-CB 3.32Å; T114-L117 WeakPolarHBondContact O-CB 3.48Å; T114-L117 PolarHBondContact O-N 2.87Å; L117-W120 HydrophobicContact CG-CE3 4.35Å; L117-W120 HydrophobicContact CG-CZ3 4.44Å; L117-W120 PolarHBondContact O-N 2.99Å; L117-C121 PolarHBondContact O-N 3.37Å; L117-C121 PolarHBondContact O-SG 3.3Å; L117-V164 HydrophobicContact CD2-CG2 4.18Å; L117-A167 HydrophobicContact CD1-CB 4.11Å; L117-V175 HydrophobicContact CD1-CG2 4.48Å; L117-V175 HydrophobicContact CD2-CG1 4.04Å; L117-V175 HydrophobicContact CD2-CG2 4.27Å; L117-A178 HydrophobicContact CB-CB 4.48Å
118	V	81.8	Confident	75.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-45.5	176.2	175.3	0	0	0	0	110.6	F96 T114 C115 A116 W120 C121 V122 A178 L181 A182	F96-V118 HydrophobicContact CD1-CG1 4.19Å; F96-V118 HydrophobicContact CE1-CG1 3.87Å; F96-V118 HydrophobicContact CE2-CG1 4.38Å; F96-V118 HydrophobicContact CZ-CB 4.29Å; F96-V118 HydrophobicContact CZ-CG1 3.97Å; T114-V118 WeakPolarHBondContact O-CG2 3.29Å; T114-V118 PolarHBondContact O-N 3.26Å; C115-V118 PolarHBondContact O-N 3.26Å; A116-V118 VanDerWaalsContact C-N 3.34Å; A116-V118 PolarHBondContact O-N 3.49Å; V118-W120 VanDerWaalsContact C-N 3.33Å; V118-W120 PolarHBondContact O-N 3.47Å; V118-C121 WeakPolarHBondContact O-CB 3.38Å; V118-C121 PolarHBondContact O-N 3.06Å; V118-C121 VanDerWaalsContact O-N 3.15Å; V118-V122 HydrophobicContact CG1-CG2 4.34Å; V118-V122 WeakPolarHBondContact O-CG2 3.37Å; V118-V122 PolarHBondContact O-N 3.46Å; V118-A178 HydrophobicContact CG2-CB 3.67Å; V118-L181 HydrophobicContact CG1-CD2 4.18Å; V118-L181 HydrophobicContact CG1-CG 4.24Å; V118-L181 HydrophobicContact CG2-CD2 3.89Å; V118-A182 HydrophobicContact CG1-CB 4.4Å
119	E	82.9	Confident	75.4	Confident	80 Å²	80	57.8 Å²	57.8	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-42.3	178.2	-69.9	174.9	172.8	0	0	112.2	R95 F96 C115 A116 C121 V122 E123	R95-E119 IonicContact CZ-OE1 3.51Å; R95-E119 IonicContact NE-OE1 2.73Å; R95-E119 IonicContact NH2-OE1 3.96Å; R95-E119 PolarHBondContact NH2-OE1 2.95Å; F96-E119 HydrophobicContact CZ-CG 4.18Å; C115-E119 PolarHBondContact O-N 3.25Å; A116-E119 PolarHBondContact O-N 2.91Å; E119-C121 VanDerWaalsContact C-N 3.33Å; E119-C121 PolarHBondContact O-N 2.99Å; E119-V122 PolarHBondContact O-N 2.82Å; E119-E123 PolarHBondContact O-N 2.72Å
120	W	81.8	Confident	74.9	Confident	41 Å²	41	56.8 Å²	56.8	16%	0.155	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-38	175.7	-56.6	-17.8	0	0	0	112.3	A116 L117 V118 E123 Y124 L156 R160 K163 V164	A116-W120 HydrophobicContact CB-CZ2 4.24Å; A116-W120 VanDerWaalsContact O-CG 3.25Å; A116-W120 PolarHBondContact O-N 3.3Å; A116-W120 VanDerWaalsContact O-N 3.1Å; L117-W120 HydrophobicContact CG-CE3 4.35Å; L117-W120 HydrophobicContact CG-CZ3 4.44Å; L117-W120 PolarHBondContact O-N 2.99Å; V118-W120 VanDerWaalsContact C-N 3.33Å; V118-W120 PolarHBondContact O-N 3.47Å; W120-E123 PolarHBondContact O-N 3.33Å; W120-Y124 PolarHBondContact O-N 3.31Å; W120-Y124 VanDerWaalsContact O-N 3.11Å; W120-L156 HydrophobicContact CB-CD2 4.28Å; W120-R160 HydrophobicContact CD2-CB 4.49Å; W120-R160 HydrophobicContact CD2-CG 4.18Å; W120-R160 HydrophobicContact CE3-CB 4.3Å; W120-R160 HydrophobicContact CE3-CG 4.42Å; W120-R160 HydrophobicContact CH2-CG 4.36Å; W120-R160 HydrophobicContact CZ2-CG 4.1Å; W120-R160 HydrophobicContact CZ3-CB 4.38Å; W120-K163 HydrophobicContact CH2-CB 4.38Å; W120-K163 HydrophobicContact CH2-CD 3.91Å; W120-K163 HydrophobicContact CZ3-CB 4.26Å; W120-V164 HydrophobicContact CE3-CG2 4.01Å; W120-V164 HydrophobicContact CZ3-CG2 4.16Å
121	C	81.7	Confident	74.4	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-40	174.8	-68.1	0	0	0	0	112	L117 V118 E119 Y124 L125 M179 A182	L117-C121 PolarHBondContact O-N 3.37Å; L117-C121 PolarHBondContact O-SG 3.3Å; V118-C121 WeakPolarHBondContact O-CB 3.38Å; V118-C121 PolarHBondContact O-N 3.06Å; V118-C121 VanDerWaalsContact O-N 3.15Å; E119-C121 VanDerWaalsContact C-N 3.33Å; E119-C121 PolarHBondContact O-N 2.99Å; C121-Y124 PolarHBondContact O-N 2.82Å; C121-L125 WeakPolarHBondContact O-CB 3.34Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.1Å; C121-L125 PolarHBondContact O-N 3.45Å; C121-M179 HydrophobicContact CB-CE 4.11Å; C121-M179 HydrophobicContact CB-SD 3.8Å; C121-M179 VanDerWaalsContact SG-CE 3.52Å; C121-A182 HydrophobicContact CB-CB 3.49Å; C121-A182 VanDerWaalsContact CB-CB 3.49Å
122	V	82.1	Confident	73.6	Confident	37 Å²	37	50.7 Å²	50.7	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-44.3	175.9	172	0	0	0	0	110.6	V118 E119 Y124 L125 S126 A182 L186	V118-V122 HydrophobicContact CG1-CG2 4.34Å; V118-V122 WeakPolarHBondContact O-CG2 3.37Å; V118-V122 PolarHBondContact O-N 3.46Å; E119-V122 PolarHBondContact O-N 2.82Å; V122-Y124 PolarHBondContact O-N 3.23Å; V122-L125 PolarHBondContact O-N 3.33Å; V122-S126 WeakPolarHBondContact O-CB 3.38Å; V122-S126 PolarHBondContact O-N 3.32Å; V122-S126 PolarHBondContact O-OG 3.02Å; V122-A182 HydrophobicContact CB-CB 4.46Å; V122-A182 HydrophobicContact CG2-CB 3.54Å; V122-L186 HydrophobicContact CG1-CD2 4.12Å; V122-L186 HydrophobicContact CG1-CG 4.4Å
123	E	81	Confident	72.6	Confident	89 Å²	89	47 Å²	47	42%	0.416	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-45.7	177.3	-173.1	179.2	-175.4	0	0	111.5	E119 W120 S126 N127 R160	E119-E123 PolarHBondContact O-N 2.72Å; W120-E123 PolarHBondContact O-N 3.33Å; E123-S126 PolarHBondContact O-N 2.83Å; E123-N127 PolarHBondContact O-N 3.26Å; E123-N127 PolarHBondContact O-ND2 3.49Å; E123-R160 IonicContact OE2-CZ 3.57Å; E123-R160 IonicContact OE2-NH1 3.51Å; E123-R160 PolarHBondContact OE2-NH1 2.73Å; E123-R160 IonicContact OE2-NH2 2.67Å
124	Y	79.3	Confident	71.5	Confident	17 Å²	17	44.5 Å²	44.5	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-59.6	-51.4	175.4	170.4	-107.1	0	0	0	112.4	W120 C121 V122 S126 N127 H151 F152 H155	W120-Y124 PolarHBondContact O-N 3.31Å; W120-Y124 VanDerWaalsContact O-N 3.11Å; C121-Y124 PolarHBondContact O-N 2.82Å; V122-Y124 PolarHBondContact O-N 3.23Å; Y124-S126 PolarHBondContact O-N 3.07Å; Y124-N127 PolarHBondContact O-N 3.03Å; Y124-H151 AromaticContact CE2-ND1 3.59Å; Y124-H151 AromaticContact CZ-ND1 3.68Å; Y124-H151 PolarHBondContact OH-ND1 3.47Å; Y124-F152 AromaticContact CD1-CD2 3.6Å; Y124-F152 HydrophobicContact CD1-CD2 3.6Å; Y124-F152 HydrophobicContact CD1-CE2 4.02Å; Y124-F152 AromaticContact CD2-CD2 3.87Å; Y124-F152 HydrophobicContact CD2-CD2 3.87Å; Y124-F152 HydrophobicContact CE1-CB 4.49Å; Y124-F152 AromaticContact CE1-CD2 3.94Å; Y124-F152 HydrophobicContact CE1-CD2 3.94Å; Y124-F152 HydrophobicContact CE2-CD2 4.17Å; Y124-F152 AromaticContact CG-CD2 3.57Å; Y124-F152 HydrophobicContact CG-CD2 3.57Å; Y124-F152 AromaticContact CG-CE2 3.9Å; Y124-F152 HydrophobicContact CG-CE2 3.9Å; Y124-H155 HydrophobicContact CD2-CB 3.67Å; Y124-H155 AromaticContact CD2-CG 3.67Å; Y124-H155 HydrophobicContact CE2-CB 3.91Å
125	L	77.8	Confident	70.8	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-22.3	-176.6	-70	173.1	0	0	0	113.4	C121 V122 S131 P132 F145 M179 A182 M183 L186	C121-L125 WeakPolarHBondContact O-CB 3.34Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.1Å; C121-L125 PolarHBondContact O-N 3.45Å; V122-L125 PolarHBondContact O-N 3.33Å; L125-S131 WeakPolarHBondContact O-CB 3.08Å; L125-S131 PolarHBondContact O-OG 3.46Å; L125-P132 HydrophobicContact CD2-CG 4.29Å; L125-F145 HydrophobicContact CD2-CE2 4.27Å; L125-M179 HydrophobicContact CD1-SD 4.07Å; L125-M179 HydrophobicContact CG-SD 4.31Å; L125-A182 HydrophobicContact CD1-CB 3.99Å; L125-M183 HydrophobicContact CD1-CB 4.13Å; L125-M183 HydrophobicContact CD1-CE 3.82Å; L125-M183 HydrophobicContact CD2-CE 3.67Å; L125-M183 HydrophobicContact CG-CE 4.26Å; L125-L186 HydrophobicContact CB-CD1 3.34Å; L125-L186 HydrophobicContact CD1-CD1 4Å; L125-L186 HydrophobicContact CG-CD1 4.34Å
126	S	75.9	Confident	70.2	Confident	66 Å²	66	50.4 Å²	50.4	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-84.6	-28.9	179.9	-56.6	0	0	0	0	113.6	V122 E123 Y124 L186	V122-S126 WeakPolarHBondContact O-CB 3.38Å; V122-S126 PolarHBondContact O-N 3.32Å; V122-S126 PolarHBondContact O-OG 3.02Å; E123-S126 PolarHBondContact O-N 2.83Å; Y124-S126 PolarHBondContact O-N 3.07Å; S126-L186 WeakPolarHBondContact OG-CD2 3.45Å
127	N	70	Confident	69.3	Low	101 Å²	101	55.1 Å²	55.1	54%	0.54	30%	0.304	S	S	.	.	H	α-helix	trans	-89.8	-19.3	-172.9	-76.1	-19.1	0	0	0	114.1	E123 Y124 A129	E123-N127 PolarHBondContact O-N 3.26Å; E123-N127 PolarHBondContact O-ND2 3.49Å; Y124-N127 PolarHBondContact O-N 3.03Å; N127-A129 PolarHBondContact O-N 3.18Å
128	D	60	Low	68.6	Low	38 Å²	38	57.8 Å²	57.8	20%	0.203	33%	0.325	C	S	.	.			trans	-75.8	125.3	-172.5	-118.8	-22.9	0	0	0	112.5	D130 S131 H151	D128-D130 PolarHBondContact O-N 3.27Å; D128-S131 WeakPolarHBondContact O-CB 3.42Å; D128-S131 PolarHBondContact O-N 3.44Å; D128-H151 IonicContact OD1-CE1 3.35Å; D128-H151 PolarHBondContact OD1-CE1 2.91Å; D128-H151 IonicContact OD2-CE1 2.67Å; D128-H151 PolarHBondContact OD2-CE1 2.89Å; D128-H151 IonicContact OD2-ND1 2.75Å; D128-H151 PolarHBondContact OD2-ND1 3.47Å
129	A	53.2	Low	67.9	Low	87 Å²	87	58.1 Å²	58.1	72%	0.719	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-26.9	173.6	0	0	0	0	0	112	N127 S131 N134	N127-A129 PolarHBondContact O-N 3.18Å; A129-S131 VanDerWaalsContact C-N 3.32Å; A129-N134 PolarHBondContact O-ND2 3.13Å
130	D	54.1	Low	67.2	Low	147 Å²	147	57.3 Å²	57.3	79%	0.786	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	25.6	169.7	-71.3	-36.9	0	0	0	111.8	D128	D128-D130 PolarHBondContact O-N 3.27Å
131	S	55.8	Low	66.7	Low	7 Å²	7	59.5 Å²	59.5	5%	0.049	35%	0.351	C	S	.	.			trans	-54.5	134	178.8	177.7	0	0	0	0	108.8	L125 D128 A129 L133 N134	L125-S131 WeakPolarHBondContact O-CB 3.08Å; L125-S131 PolarHBondContact O-OG 3.46Å; D128-S131 WeakPolarHBondContact O-CB 3.42Å; D128-S131 PolarHBondContact O-N 3.44Å; A129-S131 VanDerWaalsContact C-N 3.32Å; S131-L133 PolarHBondContact O-N 3.38Å; S131-L133 WeakPolarHBondContact OG-CB 3.33Å; S131-L133 PolarHBondContact OG-N 3.08Å; S131-N134 WeakPolarHBondContact O-CB 3.15Å; S131-N134 PolarHBondContact O-N 3.03Å
132	P	56.3	Low	66	Low	36 Å²	36	60.7 Å²	60.7	23%	0.234	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-57.3	-15.8	178.4	24.7	-34.8	0	0	0	111.9	L125 N134 N135 I139 F145 M183	L125-P132 HydrophobicContact CD2-CG 4.29Å; P132-N134 PolarHBondContact O-N 2.8Å; P132-N134 VanDerWaalsContact O-N 3.16Å; P132-N135 CarbonylContact O-C 3.54Å; P132-N135 PolarHBondContact O-N 3.32Å; P132-I139 HydrophobicContact CB-CD1 4.08Å; P132-I139 WeakPolarHBondContact O-CD1 3.31Å; P132-F145 HydrophobicContact CB-CB 4.34Å; P132-F145 HydrophobicContact CG-CD2 4.15Å; P132-M183 HydrophobicContact CG-CE 3.59Å
133	L	54.2	Low	65.7	Low	19 Å²	19	65 Å²	65	10%	0.099	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-56.2	-19.7	167.5	-72.6	168.9	0	0	0	114.8	S131 N135 F136 M183 L186 V187	S131-L133 PolarHBondContact O-N 3.38Å; S131-L133 WeakPolarHBondContact OG-CB 3.33Å; S131-L133 PolarHBondContact OG-N 3.08Å; L133-N135 PolarHBondContact O-N 3.33Å; L133-F136 HydrophobicContact CD2-CD2 4.35Å; L133-F136 PolarHBondContact O-N 3.09Å; L133-M183 HydrophobicContact CD2-SD 3.99Å; L133-M183 HydrophobicContact CG-SD 4.26Å; L133-L186 HydrophobicContact CD1-CB 4.34Å; L133-L186 HydrophobicContact CD1-CD1 4.22Å; L133-L186 HydrophobicContact CD2-CB 4.47Å; L133-V187 HydrophobicContact CD2-CG2 4.48Å
134	N	55.1	Low	65.9	Low	107 Å²	107	63.7 Å²	63.7	57%	0.572	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-64.7	-27.7	171.3	-73.2	-17.2	0	0	0	111.7	A129 S131 P132	A129-N134 PolarHBondContact O-ND2 3.13Å; S131-N134 WeakPolarHBondContact O-CB 3.15Å; S131-N134 PolarHBondContact O-N 3.03Å; P132-N134 PolarHBondContact O-N 2.8Å; P132-N134 VanDerWaalsContact O-N 3.16Å
135	N	61.9	Low	66.2	Low	107 Å²	107	63.1 Å²	63.1	57%	0.572	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-104.2	46.7	173.8	-71.1	-26.3	0	0	0	111.3	P132 L133 D137 S138 I139	P132-N135 CarbonylContact O-C 3.54Å; P132-N135 PolarHBondContact O-N 3.32Å; L133-N135 PolarHBondContact O-N 3.33Å; N135-D137 VanDerWaalsContact C-N 3.27Å; N135-D137 PolarHBondContact O-N 2.85Å; N135-S138 WeakPolarHBondContact O-CA 3.47Å; N135-S138 WeakPolarHBondContact O-CB 3.31Å; N135-S138 PolarHBondContact O-N 3.38Å; N135-I139 PolarHBondContact O-N 2.96Å; N135-I139 VanDerWaalsContact O-N 3.1Å
136	F	64.8	Low	66.5	Low	31 Å²	31	68.4 Å²	68.4	14%	0.136	40%	0.395	C	S	.	.	H	α-helix	trans	-49.2	-45.5	-177.6	-172.8	-105.8	0	0	0	113.5	L133 S138 I139 L140 V187 R190 L191	L133-F136 HydrophobicContact CD2-CD2 4.35Å; L133-F136 PolarHBondContact O-N 3.09Å; F136-S138 VanDerWaalsContact C-N 3.29Å; F136-S138 PolarHBondContact O-N 3.3Å; F136-I139 PolarHBondContact O-N 3.07Å; F136-L140 HydrophobicContact CD1-CD1 3.71Å; F136-L140 HydrophobicContact CE1-CD1 3.18Å; F136-L140 HydrophobicContact CE1-CG 4.13Å; F136-L140 HydrophobicContact CE2-CD1 4.49Å; F136-L140 HydrophobicContact CZ-CD1 3.61Å; F136-L140 HydrophobicContact CZ-CG 4.18Å; F136-L140 PolarHBondContact O-N 2.85Å; F136-V187 HydrophobicContact CE2-CB 4.24Å; F136-V187 HydrophobicContact CE2-CG1 3.88Å; F136-V187 HydrophobicContact CE2-CG2 4.01Å; F136-V187 HydrophobicContact CZ-CG1 4.07Å; F136-R190 HydrophobicContact CE2-CB 4.36Å; F136-R190 HydrophobicContact CE2-CG 4.46Å; F136-L191 HydrophobicContact CE1-CD2 4.13Å; F136-L191 HydrophobicContact CE1-CG 4.32Å; F136-L191 HydrophobicContact CZ-CD1 3.94Å; F136-L191 HydrophobicContact CZ-CD2 4.04Å; F136-L191 HydrophobicContact CZ-CG 3.73Å
137	D	64.4	Low	66.9	Low	127 Å²	127	65.4 Å²	65.4	68%	0.679	37%	0.374	S	S	*	.	H	α-helix	trans	-64.8	-33.4	179.1	-65.5	-27.7	0	0	0	112.5	N135 A141	N135-D137 VanDerWaalsContact C-N 3.27Å; N135-D137 PolarHBondContact O-N 2.85Å; D137-A141 VanDerWaalsContact O-CB 3.23Å; D137-A141 WeakPolarHBondContact O-CB 3.44Å; D137-A141 PolarHBondContact O-N 3.47Å
138	S	65.8	Low	67.6	Low	74 Å²	74	62.3 Å²	62.3	52%	0.517	36%	0.357	S	S	.	.	H	α-helix	trans	-73.4	-33.8	178.4	-55.9	0	0	0	0	111.6	N135 F136 G142	N135-S138 WeakPolarHBondContact O-CA 3.47Å; N135-S138 WeakPolarHBondContact O-CB 3.31Å; N135-S138 PolarHBondContact O-N 3.38Å; F136-S138 VanDerWaalsContact C-N 3.29Å; F136-S138 PolarHBondContact O-N 3.3Å; S138-G142 WeakPolarHBondContact O-CA 3.2Å; S138-G142 PolarHBondContact O-N 3Å
139	I	67.7	Low	68.7	Low	6 Å²	6	60.5 Å²	60.5	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-43.6	174.3	-62.6	171.8	0	0	0	110.1	P132 N135 F136 R143 F145 M183 I201	P132-I139 HydrophobicContact CB-CD1 4.08Å; P132-I139 WeakPolarHBondContact O-CD1 3.31Å; N135-I139 PolarHBondContact O-N 2.96Å; N135-I139 VanDerWaalsContact O-N 3.1Å; F136-I139 PolarHBondContact O-N 3.07Å; I139-R143 VanDerWaalsContact O-CA 3.24Å; I139-R143 WeakPolarHBondContact O-CA 3.34Å; I139-R143 PolarHBondContact O-N 3.22Å; I139-F145 HydrophobicContact CD1-CB 4.44Å; I139-F145 HydrophobicContact CG1-CB 4.35Å; I139-M183 HydrophobicContact CD1-SD 4.36Å; I139-I201 HydrophobicContact CG2-CD1 4.32Å; I139-I201 HydrophobicContact CG2-CG2 4.14Å
140	L	69	Low	70.1	Confident	64 Å²	64	60.2 Å²	60.2	34%	0.335	33%	0.331	S	S	.	.	H	α-helix	trans	-65.3	-41	177.8	-77.3	173.9	0	0	0	112.2	F136 V187 L191 L198	F136-L140 HydrophobicContact CD1-CD1 3.71Å; F136-L140 HydrophobicContact CE1-CD1 3.18Å; F136-L140 HydrophobicContact CE1-CG 4.13Å; F136-L140 HydrophobicContact CE2-CD1 4.49Å; F136-L140 HydrophobicContact CZ-CD1 3.61Å; F136-L140 HydrophobicContact CZ-CG 4.18Å; F136-L140 PolarHBondContact O-N 2.85Å; L140-V187 HydrophobicContact CD2-CG1 4.15Å; L140-L191 HydrophobicContact CD2-CD1 4.39Å; L140-L198 HydrophobicContact CD2-CD2 3.64Å
141	A	70	Confident	71.4	Confident	87 Å²	87	56.7 Å²	56.7	72%	0.719	31%	0.31	S	S	*	.	H	α-helix	trans	-72.4	-44.7	177.9	0	0	0	0	0	112.4	D137	D137-A141 VanDerWaalsContact O-CB 3.23Å; D137-A141 WeakPolarHBondContact O-CB 3.44Å; D137-A141 PolarHBondContact O-N 3.47Å
142	G	67.8	Low	72.7	Confident	25 Å²	25	56.4 Å²	56.4	26%	0.258	31%	0.308	S	S	.	.	H	α-helix	trans	-84.8	-20.7	-175.1	0	0	0	0	0	114.6	S138 H144	S138-G142 WeakPolarHBondContact O-CA 3.2Å; S138-G142 PolarHBondContact O-N 3Å; G142-H144 PolarHBondContact O-N 3.45Å; G142-H144 PolarHBondContact O-ND1 2.94Å
143	R	76.5	Confident	74	Confident	127 Å²	127	56.3 Å²	56.3	48%	0.479	30%	0.304	S	S	.	.	S	Bend	trans	56.7	22.1	-174.7	-54.6	179.6	-177.2	171.8	-0.4	114.6	I139 P199 I201 N202	I139-R143 VanDerWaalsContact O-CA 3.24Å; I139-R143 WeakPolarHBondContact O-CA 3.34Å; I139-R143 PolarHBondContact O-N 3.22Å; R143-P199 HydrophobicContact CG-CG 4.44Å; R143-I201 WeakPolarHBondContact O-CA 3.37Å; R143-N202 PolarHBondContact O-N 2.74Å
144	H	84	Confident	75.3	Confident	61 Å²	61	63.5 Å²	63.5	28%	0.282	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	158.4	177.3	64.5	-87.4	0	0	0	111.3	G142 N202 R204 D329	G142-H144 PolarHBondContact O-N 3.45Å; G142-H144 PolarHBondContact O-ND1 2.94Å; H144-N202 VanDerWaalsContact CA-O 3.22Å; H144-N202 WeakPolarHBondContact CA-O 3.23Å; H144-N202 HydrophobicContact CB-CB 4.35Å; H144-R204 HydrophobicContact CB-CG 4.04Å; H144-D329 IonicContact CD2-OD2 3.74Å; H144-D329 IonicContact CE1-OD2 3.94Å; H144-D329 IonicContact CG-OD1 3.46Å; H144-D329 IonicContact CG-OD2 3.63Å; H144-D329 IonicContact ND1-OD1 3.41Å; H144-D329 IonicContact ND1-OD2 2.96Å; H144-D329 IonicContact NE2-OD2 2.66Å
145	F	85.9	Confident	76.4	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.8	171.7	68	-78.6	0	0	0	110.9	L125 P132 I139 V147 M179 M183 I201 N202 A203 R204	L125-F145 HydrophobicContact CD2-CE2 4.27Å; P132-F145 HydrophobicContact CB-CB 4.34Å; P132-F145 HydrophobicContact CG-CD2 4.15Å; I139-F145 HydrophobicContact CD1-CB 4.44Å; I139-F145 HydrophobicContact CG1-CB 4.35Å; F145-V147 HydrophobicContact CD2-CG2 3.6Å; F145-V147 HydrophobicContact CE2-CG2 3.25Å; F145-V147 HydrophobicContact CZ-CG2 4.21Å; F145-M179 HydrophobicContact CE2-CG 4.18Å; F145-M179 HydrophobicContact CZ-CG 3.99Å; F145-M183 HydrophobicContact CD1-CB 4.2Å; F145-M183 HydrophobicContact CD1-CE 4.31Å; F145-M183 HydrophobicContact CD1-CG 3.87Å; F145-M183 HydrophobicContact CD2-CE 3.75Å; F145-M183 HydrophobicContact CE1-CB 3.45Å; F145-M183 VanDerWaalsContact CE1-CB 3.45Å; F145-M183 HydrophobicContact CE1-CE 4.35Å; F145-M183 HydrophobicContact CE1-CG 3.66Å; F145-M183 HydrophobicContact CE2-CB 4.4Å; F145-M183 HydrophobicContact CE2-CE 3.76Å; F145-M183 HydrophobicContact CG-CE 4.02Å; F145-M183 HydrophobicContact CG-CG 4.47Å; F145-M183 HydrophobicContact CZ-CB 3.57Å; F145-M183 HydrophobicContact CZ-CE 4.08Å; F145-M183 HydrophobicContact CZ-CG 4.08Å; F145-I201 HydrophobicContact CD1-CG2 3.65Å; F145-I201 HydrophobicContact CE1-CG2 3.89Å; F145-N202 PolarHBondContact N-O 2.97Å; F145-N202 VanDerWaalsContact N-O 3.12Å; F145-A203 HydrophobicContact CE1-CB 3.84Å; F145-A203 HydrophobicContact CE2-CB 4.33Å; F145-A203 HydrophobicContact CZ-CB 3.65Å; F145-R204 WeakPolarHBondContact O-CB 3.39Å; F145-R204 PolarHBondContact O-N 3.11Å
146	L	83.1	Confident	77.3	Confident	114 Å²	114	57.9 Å²	57.9	60%	0.597	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	136.7	179.9	-68.8	164.9	0	0	0	110.6	R204	L146-R204 WeakPolarHBondContact CA-O 3.41Å; L146-R204 HydrophobicContact CD2-CB 3.84Å
147	V	84.7	Confident	78.1	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.018	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116	176.2	-179.2	0	0	0	0	109.2	F145 V149 M179 R204 W206	F145-V147 HydrophobicContact CD2-CG2 3.6Å; F145-V147 HydrophobicContact CE2-CG2 3.25Å; F145-V147 HydrophobicContact CZ-CG2 4.21Å; V147-V149 PolarHBondContact O-N 3.41Å; V147-M179 HydrophobicContact CG1-CE 4.2Å; V147-M179 HydrophobicContact CG2-CG 4.04Å; V147-R204 PolarHBondContact N-O 2.74Å; V147-W206 PolarHBondContact O-N 2.83Å
148	D	84.4	Confident	78.8	Confident	35 Å²	35	63 Å²	63	19%	0.187	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.4	170.2	-173	-25.1	0	0	0	108.8	Q150 H151 F152 W206 N207	D148-Q150 VanDerWaalsContact C-N 3.3Å; D148-Q150 PolarHBondContact O-N 3.41Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.47Å; D148-Q150 PolarHBondContact OD1-N 3.15Å; D148-H151 HydrophobicContact CB-CB 3.77Å; D148-H151 PolarHBondContact O-N 2.98Å; D148-H151 PolarHBondContact OD1-N 3.36Å; D148-F152 WeakPolarHBondContact O-CB 3.41Å; D148-F152 PolarHBondContact O-N 2.96Å; D148-W206 VanDerWaalsContact CA-NE1 3.3Å; D148-W206 HydrophobicContact CB-CZ2 3.76Å; D148-W206 WeakPolarHBondContact OD2-CZ2 3.24Å; D148-N207 WeakPolarHBondContact OD1-CB 3.46Å; D148-N207 PolarHBondContact OD1-ND2 3.27Å; D148-N207 PolarHBondContact OD2-ND2 3.17Å
149	V	84.6	Confident	79.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-32.1	-176.3	-175.9	0	0	0	0	111.9	V147 F153 F205 W206 F208	V147-V149 PolarHBondContact O-N 3.41Å; V149-F153 HydrophobicContact CG1-CD2 3.99Å; V149-F153 HydrophobicContact CG1-CE1 4.43Å; V149-F153 HydrophobicContact CG1-CE2 3.43Å; V149-F153 VanDerWaalsContact CG1-CE2 3.43Å; V149-F153 HydrophobicContact CG1-CZ 3.67Å; V149-F153 WeakPolarHBondContact O-CD2 2.96Å; V149-F153 WeakPolarHBondContact O-CG 3.48Å; V149-F153 PolarHBondContact O-N 3.3Å; V149-F205 HydrophobicContact CG2-CB 3.78Å; V149-F205 HydrophobicContact CG2-CD1 3.43Å; V149-F205 VanDerWaalsContact CG2-CD1 3.43Å; V149-F205 HydrophobicContact CG2-CE1 4.35Å; V149-F205 HydrophobicContact CG2-CG 3.97Å; V149-W206 WeakPolarHBondContact CG2-O 3.2Å; V149-W206 PolarHBondContact N-O 3.09Å; V149-F208 HydrophobicContact CB-CD2 4.47Å; V149-F208 HydrophobicContact CG1-CD2 3.81Å; V149-F208 HydrophobicContact CG2-CB 4.49Å
150	Q	82.5	Confident	80.4	Confident	82 Å²	82	70.3 Å²	70.3	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-71.6	-38.8	176.3	-69.7	178.7	15	0	0	111.4	D148 F152 F153 K154 N207	D148-Q150 VanDerWaalsContact C-N 3.3Å; D148-Q150 PolarHBondContact O-N 3.41Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.47Å; D148-Q150 PolarHBondContact OD1-N 3.15Å; Q150-F152 VanDerWaalsContact C-N 3.34Å; Q150-F153 PolarHBondContact O-N 2.86Å; Q150-K154 WeakPolarHBondContact O-CG 3.26Å; Q150-K154 PolarHBondContact O-N 2.92Å; Q150-K154 VanDerWaalsContact O-N 3.15Å; Q150-N207 VanDerWaalsContact CD-ND2 3.33Å; Q150-N207 WeakPolarHBondContact CG-O 3.41Å; Q150-N207 PolarHBondContact NE2-O 3.49Å; Q150-N207 PolarHBondContact NE2-OD1 3.37Å; Q150-N207 PolarHBondContact OE1-ND2 3.3Å
151	H	81.7	Confident	81	Confident	73 Å²	73	68 Å²	68	34%	0.338	34%	0.339	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.1	-168.9	-104.7	0	0	0	111	Y124 D128 D148 F153 K154 H155	Y124-H151 AromaticContact CE2-ND1 3.59Å; Y124-H151 AromaticContact CZ-ND1 3.68Å; Y124-H151 PolarHBondContact OH-ND1 3.47Å; D128-H151 IonicContact OD1-CE1 3.35Å; D128-H151 PolarHBondContact OD1-CE1 2.91Å; D128-H151 IonicContact OD2-CE1 2.67Å; D128-H151 PolarHBondContact OD2-CE1 2.89Å; D128-H151 IonicContact OD2-ND1 2.75Å; D128-H151 PolarHBondContact OD2-ND1 3.47Å; D148-H151 HydrophobicContact CB-CB 3.77Å; D148-H151 PolarHBondContact O-N 2.98Å; D148-H151 PolarHBondContact OD1-N 3.36Å; H151-F153 VanDerWaalsContact C-N 3.32Å; H151-F153 PolarHBondContact O-N 3.35Å; H151-K154 WeakPolarHBondContact O-CB 3.07Å; H151-K154 PolarHBondContact O-N 3.04Å; H151-H155 PolarHBondContact O-N 3.47Å
152	F	82.6	Confident	81.7	Confident	1 Å²	1	68.6 Å²	68.6	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-56.9	-44.2	176.2	-178.3	-127.7	0	0	0	112.2	Y124 D148 Q150 K154 H155 L156 V164 M179	Y124-F152 AromaticContact CD1-CD2 3.6Å; Y124-F152 HydrophobicContact CD1-CD2 3.6Å; Y124-F152 HydrophobicContact CD1-CE2 4.02Å; Y124-F152 AromaticContact CD2-CD2 3.87Å; Y124-F152 HydrophobicContact CD2-CD2 3.87Å; Y124-F152 HydrophobicContact CE1-CB 4.49Å; Y124-F152 AromaticContact CE1-CD2 3.94Å; Y124-F152 HydrophobicContact CE1-CD2 3.94Å; Y124-F152 HydrophobicContact CE2-CD2 4.17Å; Y124-F152 AromaticContact CG-CD2 3.57Å; Y124-F152 HydrophobicContact CG-CD2 3.57Å; Y124-F152 AromaticContact CG-CE2 3.9Å; Y124-F152 HydrophobicContact CG-CE2 3.9Å; D148-F152 WeakPolarHBondContact O-CB 3.41Å; D148-F152 PolarHBondContact O-N 2.96Å; Q150-F152 VanDerWaalsContact C-N 3.34Å; F152-K154 VanDerWaalsContact C-N 3.32Å; F152-K154 PolarHBondContact O-N 2.99Å; F152-H155 PolarHBondContact O-N 2.75Å; F152-L156 HydrophobicContact CD1-CD1 3.97Å; F152-L156 HydrophobicContact CD2-CD1 4.13Å; F152-L156 HydrophobicContact CE1-CD1 3.74Å; F152-L156 HydrophobicContact CE2-CD1 3.89Å; F152-L156 HydrophobicContact CE2-CG 4.29Å; F152-L156 HydrophobicContact CG-CD1 4.18Å; F152-L156 HydrophobicContact CZ-CD1 3.7Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 WeakPolarHBondContact O-CD1 3.41Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3Å; F152-V164 HydrophobicContact CE1-CG1 3.83Å; F152-M179 HydrophobicContact CD1-CE 4.16Å; F152-M179 HydrophobicContact CD2-CE 3.91Å; F152-M179 HydrophobicContact CE1-CE 3.82Å; F152-M179 HydrophobicContact CE2-CE 3.6Å; F152-M179 HydrophobicContact CG-CE 4.18Å; F152-M179 HydrophobicContact CZ-CE 3.54Å
153	F	82.7	Confident	82.5	Confident	34 Å²	34	73.1 Å²	73.1	15%	0.149	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-32.7	175.9	-69.6	-38.4	0	0	0	114	V149 Q150 H151 L156 V164 Q165 L168 F208	V149-F153 HydrophobicContact CG1-CD2 3.99Å; V149-F153 HydrophobicContact CG1-CE1 4.43Å; V149-F153 HydrophobicContact CG1-CE2 3.43Å; V149-F153 VanDerWaalsContact CG1-CE2 3.43Å; V149-F153 HydrophobicContact CG1-CZ 3.67Å; V149-F153 WeakPolarHBondContact O-CD2 2.96Å; V149-F153 WeakPolarHBondContact O-CG 3.48Å; V149-F153 PolarHBondContact O-N 3.3Å; Q150-F153 PolarHBondContact O-N 2.86Å; H151-F153 VanDerWaalsContact C-N 3.32Å; H151-F153 PolarHBondContact O-N 3.35Å; F153-L156 HydrophobicContact CD1-CD1 4.46Å; F153-V164 HydrophobicContact CE1-CG1 3.95Å; F153-Q165 HydrophobicContact CD1-CG 4.3Å; F153-Q165 HydrophobicContact CE1-CG 3.64Å; F153-Q165 HydrophobicContact CE2-CG 4.36Å; F153-Q165 HydrophobicContact CZ-CG 3.68Å; F153-L168 HydrophobicContact CE1-CD1 4.03Å; F153-L168 HydrophobicContact CZ-CD1 3.63Å; F153-F208 HydrophobicContact CE2-CE2 4.43Å
154	K	82.2	Confident	82.8	Confident	170 Å²	170	67.1 Å²	67.1	74%	0.739	32%	0.319	S	S	*	.	H	α-helix	trans	-71	-31.4	178.3	-73.3	175.4	-179.3	179.7	0	113	Q150 H151 F152	Q150-K154 WeakPolarHBondContact O-CG 3.26Å; Q150-K154 PolarHBondContact O-N 2.92Å; Q150-K154 VanDerWaalsContact O-N 3.15Å; H151-K154 WeakPolarHBondContact O-CB 3.07Å; H151-K154 PolarHBondContact O-N 3.04Å; F152-K154 VanDerWaalsContact C-N 3.32Å; F152-K154 PolarHBondContact O-N 2.99Å
155	H	79	Confident	82.8	Confident	78 Å²	78	67.3 Å²	67.3	36%	0.361	32%	0.321	S	S	.	.	H	α-helix	trans	-80.4	-19.5	180	-166.7	-69.7	0	0	0	112.5	Y124 H151 F152	Y124-H155 HydrophobicContact CD2-CB 3.67Å; Y124-H155 AromaticContact CD2-CG 3.67Å; Y124-H155 HydrophobicContact CE2-CB 3.91Å; H151-H155 PolarHBondContact O-N 3.47Å; F152-H155 PolarHBondContact O-N 2.75Å
156	L	80.3	Confident	82.8	Confident	18 Å²	18	72.4 Å²	72.4	9%	0.094	34%	0.344	C	S	.	.	S	Bend	trans	-81.7	138.9	176.9	-72.6	156.1	0	0	0	111.1	W120 F152 F153 R160 C161 V164	W120-L156 HydrophobicContact CB-CD2 4.28Å; F152-L156 HydrophobicContact CD1-CD1 3.97Å; F152-L156 HydrophobicContact CD2-CD1 4.13Å; F152-L156 HydrophobicContact CE1-CD1 3.74Å; F152-L156 HydrophobicContact CE2-CD1 3.89Å; F152-L156 HydrophobicContact CE2-CG 4.29Å; F152-L156 HydrophobicContact CG-CD1 4.18Å; F152-L156 HydrophobicContact CZ-CD1 3.7Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 WeakPolarHBondContact O-CD1 3.41Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3Å; F153-L156 HydrophobicContact CD1-CD1 4.46Å; L156-R160 HydrophobicContact CB-CB 4.41Å; L156-R160 HydrophobicContact CD2-CB 3.87Å; L156-C161 HydrophobicContact CB-CB 4.1Å; L156-V164 HydrophobicContact CD1-CB 4.5Å; L156-V164 HydrophobicContact CD1-CG2 4.13Å
157	T	80.5	Confident	82.8	Confident	83 Å²	83	67.8 Å²	67.8	51%	0.509	32%	0.323	S	S	.	.			trans	-56.7	147.3	165.4	55.4	0	0	0	0	110.6	E159 R160 C161	T157-E159 VanDerWaalsContact C-N 3.29Å; T157-E159 PolarHBondContact O-N 2.82Å; T157-E159 VanDerWaalsContact O-N 3.12Å; T157-R160 PolarHBondContact O-N 3.45Å; T157-R160 WeakPolarHBondContact OG1-CB 3.43Å; T157-R160 WeakPolarHBondContact OG1-CD 3.44Å; T157-R160 VanDerWaalsContact OG1-CG 3.24Å; T157-R160 WeakPolarHBondContact OG1-CG 2.81Å; T157-C161 PolarHBondContact O-N 3.42Å
158	E	80.6	Confident	82.8	Confident	182 Å²	182	67.9 Å²	67.9	85%	0.85	32%	0.323	S	S	*	.	H	α-helix	trans	-48.9	-44.1	-175.2	-72.2	-172.2	160.1	0	0	114.1	C161 L162	E158-C161 PolarHBondContact O-N 3.23Å; E158-L162 PolarHBondContact O-N 3.13Å
159	E	82.8	Confident	82.7	Confident	155 Å²	155	73.5 Å²	73.5	72%	0.724	34%	0.342	S	S	*	.	H	α-helix	trans	-63.4	-43.6	178.6	-66.3	-170.6	170	0	0	113.1	T157 L162 K163	T157-E159 VanDerWaalsContact C-N 3.29Å; T157-E159 PolarHBondContact O-N 2.82Å; T157-E159 VanDerWaalsContact O-N 3.12Å; E159-L162 PolarHBondContact O-N 3.08Å; E159-K163 PolarHBondContact O-N 3.04Å
160	R	83.8	Confident	82.7	Confident	79 Å²	79	76.8 Å²	76.8	30%	0.298	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-41.5	176.8	-66.4	-179.5	-174.5	-175.7	1.4	110.4	W120 E123 L156 T157 L162 K163 V164	W120-R160 HydrophobicContact CD2-CB 4.49Å; W120-R160 HydrophobicContact CD2-CG 4.18Å; W120-R160 HydrophobicContact CE3-CB 4.3Å; W120-R160 HydrophobicContact CE3-CG 4.42Å; W120-R160 HydrophobicContact CH2-CG 4.36Å; W120-R160 HydrophobicContact CZ2-CG 4.1Å; W120-R160 HydrophobicContact CZ3-CB 4.38Å; E123-R160 IonicContact OE2-CZ 3.57Å; E123-R160 IonicContact OE2-NH1 3.51Å; E123-R160 PolarHBondContact OE2-NH1 2.73Å; E123-R160 IonicContact OE2-NH2 2.67Å; L156-R160 HydrophobicContact CB-CB 4.41Å; L156-R160 HydrophobicContact CD2-CB 3.87Å; T157-R160 PolarHBondContact O-N 3.45Å; T157-R160 WeakPolarHBondContact OG1-CB 3.43Å; T157-R160 WeakPolarHBondContact OG1-CD 3.44Å; T157-R160 VanDerWaalsContact OG1-CG 3.24Å; T157-R160 WeakPolarHBondContact OG1-CG 2.81Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 2.9Å; R160-K163 PolarHBondContact O-N 3.06Å; R160-V164 VanDerWaalsContact O-CG2 3.32Å; R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 3.38Å
161	C	81.8	Confident	82.9	Confident	16 Å²	16	76.4 Å²	76.4	11%	0.108	37%	0.365	C	S	.	.	H	α-helix	trans	-58	-44.7	176.5	-177.2	0	0	0	0	111.3	L156 T157 E158 K163 V164 Q165	L156-C161 HydrophobicContact CB-CB 4.1Å; T157-C161 PolarHBondContact O-N 3.42Å; E158-C161 PolarHBondContact O-N 3.23Å; C161-K163 PolarHBondContact O-N 3.42Å; C161-V164 PolarHBondContact O-N 3.1Å; C161-Q165 WeakPolarHBondContact O-CB 3.44Å; C161-Q165 VanDerWaalsContact O-CG 3.29Å; C161-Q165 WeakPolarHBondContact O-CG 3.44Å; C161-Q165 PolarHBondContact O-N 2.95Å; C161-Q165 PolarHBondContact SG-NE2 3.28Å; C161-Q165 VanDerWaalsContact SG-NE2 3.4Å
162	L	83.3	Confident	83.2	Confident	98 Å²	98	72.9 Å²	72.9	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-61.1	-44	177.6	-163.3	85.2	0	0	0	111.9	E158 E159 R160 Q165 Q166	E158-L162 PolarHBondContact O-N 3.13Å; E159-L162 PolarHBondContact O-N 3.08Å; R160-L162 VanDerWaalsContact C-N 3.32Å; R160-L162 PolarHBondContact O-N 2.9Å; L162-Q165 PolarHBondContact O-N 2.75Å; L162-Q166 WeakPolarHBondContact O-CG 3.44Å; L162-Q166 PolarHBondContact O-N 3.37Å
163	K	84.7	Confident	83.4	Confident	121 Å²	121	75.4 Å²	75.4	53%	0.526	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-44.3	177.2	-73.1	-178	178.9	178.1	0	112.1	W120 E159 R160 C161 Q165 Q166 A167	W120-K163 HydrophobicContact CH2-CB 4.38Å; W120-K163 HydrophobicContact CH2-CD 3.91Å; W120-K163 HydrophobicContact CZ3-CB 4.26Å; E159-K163 PolarHBondContact O-N 3.04Å; R160-K163 PolarHBondContact O-N 3.06Å; C161-K163 PolarHBondContact O-N 3.42Å; K163-Q165 VanDerWaalsContact C-N 3.35Å; K163-Q166 PolarHBondContact O-N 3.14Å; K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 3.14Å
164	V	84.1	Confident	83.5	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.3	174.9	0	0	0	0	110.8	L117 W120 F152 F153 L156 R160 C161 Q166 A167 L168	L117-V164 HydrophobicContact CD2-CG2 4.18Å; W120-V164 HydrophobicContact CE3-CG2 4.01Å; W120-V164 HydrophobicContact CZ3-CG2 4.16Å; F152-V164 HydrophobicContact CE1-CG1 3.83Å; F153-V164 HydrophobicContact CE1-CG1 3.95Å; L156-V164 HydrophobicContact CD1-CB 4.5Å; L156-V164 HydrophobicContact CD1-CG2 4.13Å; R160-V164 VanDerWaalsContact O-CG2 3.32Å; R160-V164 WeakPolarHBondContact O-CG2 3.48Å; R160-V164 PolarHBondContact O-N 3.38Å; C161-V164 PolarHBondContact O-N 3.1Å; V164-Q166 VanDerWaalsContact C-N 3.33Å; V164-Q166 PolarHBondContact O-N 2.95Å; V164-A167 PolarHBondContact O-N 3.08Å; V164-L168 HydrophobicContact CG1-CD1 4.11Å; V164-L168 HydrophobicContact CG1-CG 4.49Å; V164-L168 WeakPolarHBondContact O-CB 3.46Å; V164-L168 WeakPolarHBondContact O-CG 3.37Å; V164-L168 PolarHBondContact O-N 2.9Å
165	Q	84	Confident	83.8	Confident	65 Å²	65	67.5 Å²	67.5	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-63.2	-38.2	175.4	-75.3	-179.3	8.5	0	0	112.5	F153 C161 L162 K163 R169	F153-Q165 HydrophobicContact CD1-CG 4.3Å; F153-Q165 HydrophobicContact CE1-CG 3.64Å; F153-Q165 HydrophobicContact CE2-CG 4.36Å; F153-Q165 HydrophobicContact CZ-CG 3.68Å; C161-Q165 WeakPolarHBondContact O-CB 3.44Å; C161-Q165 VanDerWaalsContact O-CG 3.29Å; C161-Q165 WeakPolarHBondContact O-CG 3.44Å; C161-Q165 PolarHBondContact O-N 2.95Å; C161-Q165 PolarHBondContact SG-NE2 3.28Å; C161-Q165 VanDerWaalsContact SG-NE2 3.4Å; L162-Q165 PolarHBondContact O-N 2.75Å; K163-Q165 VanDerWaalsContact C-N 3.35Å; Q165-R169 VanDerWaalsContact O-CG 3.32Å; Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 3.34Å
166	Q	84.8	Confident	84.3	Confident	113 Å²	113	64.9 Å²	64.9	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-65.6	-43.7	173.2	-74.1	174.4	-1.4	0	0	111.3	L162 K163 V164 L168 R169 S170	L162-Q166 WeakPolarHBondContact O-CG 3.44Å; L162-Q166 PolarHBondContact O-N 3.37Å; K163-Q166 PolarHBondContact O-N 3.14Å; V164-Q166 VanDerWaalsContact C-N 3.33Å; V164-Q166 PolarHBondContact O-N 2.95Å; Q166-L168 PolarHBondContact O-N 3.06Å; Q166-R169 WeakPolarHBondContact O-CA 3.49Å; Q166-R169 WeakPolarHBondContact O-CB 3.37Å; Q166-R169 PolarHBondContact O-N 3.11Å; Q166-S170 PolarHBondContact O-N 2.99Å; Q166-S170 PolarHBondContact O-OG 3.15Å
167	A	84.2	Confident	84.6	Confident	18 Å²	18	65.2 Å²	65.2	15%	0.149	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-40.1	176.9	0	0	0	0	0	112.4	L117 K163 V164 R169 S170 N171 V175	L117-A167 HydrophobicContact CD1-CB 4.11Å; K163-A167 WeakPolarHBondContact O-CB 3.47Å; K163-A167 PolarHBondContact O-N 3.14Å; V164-A167 PolarHBondContact O-N 3.08Å; A167-R169 PolarHBondContact O-N 2.94Å; A167-S170 PolarHBondContact O-N 2.63Å; A167-S170 PolarHBondContact O-OG 3.38Å; A167-N171 CarbonylContact O-C 3.58Å; A167-N171 PolarHBondContact O-N 3.03Å; A167-V175 HydrophobicContact CB-CG2 3.58Å
168	L	84.3	Confident	84.9	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-21.9	173.6	-75	169.7	0	0	0	113.4	F153 V164 Q166 A172 V175 F205 L225	F153-L168 HydrophobicContact CE1-CD1 4.03Å; F153-L168 HydrophobicContact CZ-CD1 3.63Å; V164-L168 HydrophobicContact CG1-CD1 4.11Å; V164-L168 HydrophobicContact CG1-CG 4.49Å; V164-L168 WeakPolarHBondContact O-CB 3.46Å; V164-L168 WeakPolarHBondContact O-CG 3.37Å; V164-L168 PolarHBondContact O-N 2.9Å; Q166-L168 PolarHBondContact O-N 3.06Å; L168-A172 HydrophobicContact CD2-CB 4.36Å; L168-V175 HydrophobicContact CD2-CB 3.89Å; L168-V175 HydrophobicContact CD2-CG1 3.8Å; L168-V175 HydrophobicContact CD2-CG2 4.21Å; L168-V175 HydrophobicContact CG-CB 4.44Å; L168-V175 HydrophobicContact CG-CG1 4.17Å; L168-V175 HydrophobicContact CG-CG2 4.31Å; L168-F205 HydrophobicContact CD2-CE1 4.4Å; L168-L225 HydrophobicContact CD2-CB 4.42Å; L168-L225 HydrophobicContact CD2-CD2 4.13Å; L168-L225 PolarHBondContact O-N 3.48Å
169	R	82.6	Confident	85.2	Confident	154 Å²	154	52.6 Å²	52.6	58%	0.581	26%	0.258	S	S	*	.	H	α-helix	trans	-86	-30.9	175.1	-72.6	176.4	-173.8	-175.5	3.6	113.2	Q165 Q166 A167	Q165-R169 VanDerWaalsContact O-CG 3.32Å; Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 3.34Å; Q166-R169 WeakPolarHBondContact O-CA 3.49Å; Q166-R169 WeakPolarHBondContact O-CB 3.37Å; Q166-R169 PolarHBondContact O-N 3.11Å; A167-R169 PolarHBondContact O-N 2.94Å
170	S	85	Confident	85.4	Confident	69 Å²	69	45.2 Å²	45.2	48%	0.483	22%	0.223	S	C	.	.	H	α-helix	trans	-92.5	-52.9	-179	54.8	0	0	0	0	112.7	Q166 A167 N223	Q166-S170 PolarHBondContact O-N 2.99Å; Q166-S170 PolarHBondContact O-OG 3.15Å; A167-S170 PolarHBondContact O-N 2.63Å; A167-S170 PolarHBondContact O-OG 3.38Å; S170-N223 WeakPolarHBondContact O-CB 3.4Å
171	N	86	Confident	85.5	Confident	73 Å²	73	41.5 Å²	41.5	39%	0.39	21%	0.209	S	C	.	.			trans	-143.6	80.9	-176.3	-75.4	-31.7	0	0	0	110.6	A167 D173 D174	A167-N171 CarbonylContact O-C 3.58Å; A167-N171 PolarHBondContact O-N 3.03Å; N171-D173 VanDerWaalsContact C-N 3.28Å; N171-D173 PolarHBondContact O-N 3.27Å; N171-D174 HydrophobicContact CB-CB 4.36Å; N171-D174 PolarHBondContact O-N 3.36Å
172	A	87.5	Confident	85.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-33.1	179.9	0	0	0	0	0	113.4	L168 D174 V175 I176 N223 L225 V345	L168-A172 HydrophobicContact CD2-CB 4.36Å; A172-D174 VanDerWaalsContact C-N 3.28Å; A172-D174 PolarHBondContact O-N 3.17Å; A172-V175 PolarHBondContact O-N 3.08Å; A172-V175 VanDerWaalsContact O-N 3.13Å; A172-I176 WeakPolarHBondContact O-CG1 3.3Å; A172-I176 PolarHBondContact O-N 3.14Å; A172-N223 WeakPolarHBondContact CB-O 3.41Å; A172-N223 PolarHBondContact N-O 3.24Å; A172-L225 HydrophobicContact CB-CB 3.86Å; A172-V345 HydrophobicContact CB-CG1 4.34Å; A172-V345 HydrophobicContact CB-CG2 3.73Å
173	D	86.4	Confident	85.6	Confident	54 Å²	54	36 Å²	36	29%	0.289	18%	0.179	S	C	.	.	H	α-helix	trans	-60	-37	179.3	-80.1	-18.4	0	0	0	112.4	N171 I176 S177 K347	N171-D173 VanDerWaalsContact C-N 3.28Å; N171-D173 PolarHBondContact O-N 3.27Å; D173-I176 PolarHBondContact O-N 2.9Å; D173-S177 VanDerWaalsContact O-CB 3.24Å; D173-S177 WeakPolarHBondContact O-CB 3.4Å; D173-S177 PolarHBondContact O-N 3.38Å; D173-S177 PolarHBondContact O-OG 3.43Å; D173-K347 IonicContact OD1-NZ 2.75Å; D173-K347 WeakPolarHBondContact OD2-CE 3.47Å; D173-K347 IonicContact OD2-NZ 3.61Å; D173-K347 PolarHBondContact OD2-NZ 3.42Å
174	D	85.9	Confident	85.5	Confident	37 Å²	37	30.8 Å²	30.8	20%	0.198	16%	0.156	C	C	.	.	H	α-helix	trans	-66.4	-39.8	177.4	-79.8	-4.9	0	0	0	110.5	K111 N171 A172 S177 A178	K111-D174 IonicContact NZ-OD1 3.24Å; K111-D174 IonicContact NZ-OD2 3.46Å; K111-D174 PolarHBondContact NZ-OD2 3.4Å; N171-D174 HydrophobicContact CB-CB 4.36Å; N171-D174 PolarHBondContact O-N 3.36Å; A172-D174 VanDerWaalsContact C-N 3.28Å; A172-D174 PolarHBondContact O-N 3.17Å; D174-S177 PolarHBondContact O-N 3.2Å; D174-A178 VanDerWaalsContact O-CB 3.22Å; D174-A178 WeakPolarHBondContact O-CB 3.3Å; D174-A178 PolarHBondContact O-N 2.94Å
175	V	88.1	Confident	85.4	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-69	-43.5	178.1	-177.9	0	0	0	0	111.2	L117 A167 L168 A172 S177 A178 M179 F205	L117-V175 HydrophobicContact CD1-CG2 4.48Å; L117-V175 HydrophobicContact CD2-CG1 4.04Å; L117-V175 HydrophobicContact CD2-CG2 4.27Å; A167-V175 HydrophobicContact CB-CG2 3.58Å; L168-V175 HydrophobicContact CD2-CB 3.89Å; L168-V175 HydrophobicContact CD2-CG1 3.8Å; L168-V175 HydrophobicContact CD2-CG2 4.21Å; L168-V175 HydrophobicContact CG-CB 4.44Å; L168-V175 HydrophobicContact CG-CG1 4.17Å; L168-V175 HydrophobicContact CG-CG2 4.31Å; A172-V175 PolarHBondContact O-N 3.08Å; A172-V175 VanDerWaalsContact O-N 3.13Å; V175-S177 VanDerWaalsContact C-N 3.31Å; V175-S177 PolarHBondContact O-N 3.32Å; V175-A178 PolarHBondContact O-N 3.03Å; V175-M179 WeakPolarHBondContact O-CB 3.39Å; V175-M179 PolarHBondContact O-N 3.38Å; V175-F205 HydrophobicContact CG1-CE1 4.36Å; V175-F205 HydrophobicContact CG1-CZ 4.31Å
176	I	88.9	Confident	85.2	Confident	23 Å²	23	30.8 Å²	30.8	12%	0.118	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-43.5	176.9	-65	165.3	0	0	0	110.1	A172 D173 M179 G180 A203 F205 L225 V345 T369	A172-I176 WeakPolarHBondContact O-CG1 3.3Å; A172-I176 PolarHBondContact O-N 3.14Å; D173-I176 PolarHBondContact O-N 2.9Å; I176-M179 PolarHBondContact O-N 3.05Å; I176-G180 PolarHBondContact O-N 3.38Å; I176-A203 HydrophobicContact CG2-CB 4.42Å; I176-F205 HydrophobicContact CB-CE2 4.11Å; I176-F205 HydrophobicContact CG1-CD2 3.9Å; I176-F205 HydrophobicContact CG1-CE2 3.79Å; I176-F205 HydrophobicContact CG1-CG 4.39Å; I176-F205 HydrophobicContact CG1-CZ 4.16Å; I176-F205 HydrophobicContact CG2-CD2 4.42Å; I176-F205 HydrophobicContact CG2-CE2 4.21Å; I176-L225 HydrophobicContact CD1-CD1 4.31Å; I176-V345 HydrophobicContact CD1-CG2 3.72Å; I176-T369 HydrophobicContact CD1-CG2 4.07Å; I176-T369 HydrophobicContact CG2-CG2 4.42Å
177	S	86.6	Confident	84.9	Confident	25 Å²	25	25.4 Å²	25.4	18%	0.175	13%	0.132	C	C	.	.	H	α-helix	trans	-68.3	-38.5	178.7	-59.4	0	0	0	0	112	Y102 D173 D174 V175 M179 G180 L181	Y102-S177 WeakPolarHBondContact CD1-O 3.46Å; D173-S177 VanDerWaalsContact O-CB 3.24Å; D173-S177 WeakPolarHBondContact O-CB 3.4Å; D173-S177 PolarHBondContact O-N 3.38Å; D173-S177 PolarHBondContact O-OG 3.43Å; D174-S177 PolarHBondContact O-N 3.2Å; V175-S177 VanDerWaalsContact C-N 3.31Å; V175-S177 PolarHBondContact O-N 3.32Å; S177-M179 VanDerWaalsContact C-N 3.35Å; S177-G180 PolarHBondContact O-N 3.44Å; S177-L181 WeakPolarHBondContact O-CB 3.38Å; S177-L181 PolarHBondContact O-N 2.89Å
178	A	86.8	Confident	84.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-40.7	174	0	0	0	0	0	112.2	L117 V118 D174 V175 L181 A182	L117-A178 HydrophobicContact CB-CB 4.48Å; V118-A178 HydrophobicContact CG2-CB 3.67Å; D174-A178 VanDerWaalsContact O-CB 3.22Å; D174-A178 WeakPolarHBondContact O-CB 3.3Å; D174-A178 PolarHBondContact O-N 2.94Å; V175-A178 PolarHBondContact O-N 3.03Å; A178-L181 PolarHBondContact O-N 3.23Å; A178-A182 WeakPolarHBondContact O-CB 3.32Å; A178-A182 PolarHBondContact O-N 3.23Å
179	M	87.7	Confident	84.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-41.5	175.3	-173.7	62.5	79.3	0	0	111.8	C121 L125 F145 V147 F152 V175 I176 S177 A182 M183 A203 F205	C121-M179 HydrophobicContact CB-CE 4.11Å; C121-M179 HydrophobicContact CB-SD 3.8Å; C121-M179 VanDerWaalsContact SG-CE 3.52Å; L125-M179 HydrophobicContact CD1-SD 4.07Å; L125-M179 HydrophobicContact CG-SD 4.31Å; F145-M179 HydrophobicContact CE2-CG 4.18Å; F145-M179 HydrophobicContact CZ-CG 3.99Å; V147-M179 HydrophobicContact CG1-CE 4.2Å; V147-M179 HydrophobicContact CG2-CG 4.04Å; F152-M179 HydrophobicContact CD1-CE 4.16Å; F152-M179 HydrophobicContact CD2-CE 3.91Å; F152-M179 HydrophobicContact CE1-CE 3.82Å; F152-M179 HydrophobicContact CE2-CE 3.6Å; F152-M179 HydrophobicContact CG-CE 4.18Å; F152-M179 HydrophobicContact CZ-CE 3.54Å; V175-M179 WeakPolarHBondContact O-CB 3.39Å; V175-M179 PolarHBondContact O-N 3.38Å; I176-M179 PolarHBondContact O-N 3.05Å; S177-M179 VanDerWaalsContact C-N 3.35Å; M179-A182 PolarHBondContact O-N 3.2Å; M179-M183 PolarHBondContact O-N 3.33Å; M179-A203 HydrophobicContact CB-CB 4.1Å; M179-A203 HydrophobicContact CG-CB 3.96Å; M179-F205 HydrophobicContact CB-CE2 3.97Å; M179-F205 HydrophobicContact CB-CZ 3.91Å; M179-F205 HydrophobicContact CG-CE2 4.08Å; M179-F205 HydrophobicContact CG-CZ 4.13Å
180	G	86.5	Confident	84	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-43.5	173.4	0	0	0	0	0	112.4	Y102 I176 S177 M183 Y184	Y102-G180 VanDerWaalsContact CZ-C 3.44Å; Y102-G180 PolarHBondContact OH-O 3Å; I176-G180 PolarHBondContact O-N 3.38Å; S177-G180 PolarHBondContact O-N 3.44Å; G180-M183 PolarHBondContact O-N 2.65Å; G180-Y184 PolarHBondContact O-N 2.81Å
181	L	85.8	Confident	83.5	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-43.2	175.9	178.3	61.3	0	0	0	112	F96 G98 W99 Y102 F103 V118 S177 A178 M183 Y184 E185	F96-L181 HydrophobicContact CB-CD1 4.31Å; F96-L181 HydrophobicContact CB-CD2 4.19Å; F96-L181 HydrophobicContact CG-CD2 4.4Å; G98-L181 VanDerWaalsContact CA-CD1 3.46Å; W99-L181 HydrophobicContact CD2-CD2 4.44Å; W99-L181 HydrophobicContact CE3-CD2 3.53Å; W99-L181 HydrophobicContact CZ3-CD2 4.02Å; Y102-L181 HydrophobicContact CD2-CB 3.94Å; Y102-L181 HydrophobicContact CD2-CD1 3.95Å; Y102-L181 HydrophobicContact CE2-CB 4.35Å; Y102-L181 HydrophobicContact CE2-CD1 4.42Å; Y102-L181 HydrophobicContact CG-CB 4.11Å; F103-L181 HydrophobicContact CE2-CD2 4.46Å; V118-L181 HydrophobicContact CG1-CD2 4.18Å; V118-L181 HydrophobicContact CG1-CG 4.24Å; V118-L181 HydrophobicContact CG2-CD2 3.89Å; S177-L181 WeakPolarHBondContact O-CB 3.38Å; S177-L181 PolarHBondContact O-N 2.89Å; A178-L181 PolarHBondContact O-N 3.23Å; L181-M183 VanDerWaalsContact C-N 3.29Å; L181-M183 PolarHBondContact O-N 3.29Å; L181-Y184 WeakPolarHBondContact O-CB 3.37Å; L181-Y184 PolarHBondContact O-N 3.45Å; L181-Y184 VanDerWaalsContact O-N 3.09Å; L181-E185 HydrophobicContact CD1-CG 4.42Å; L181-E185 WeakPolarHBondContact O-CG 3.31Å; L181-E185 PolarHBondContact O-N 3.18Å
182	A	85.8	Confident	82.4	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.5	-42.9	176.7	0	0	0	0	0	112	V118 C121 V122 L125 A178 M179 L186	V118-A182 HydrophobicContact CG1-CB 4.4Å; C121-A182 HydrophobicContact CB-CB 3.49Å; C121-A182 VanDerWaalsContact CB-CB 3.49Å; V122-A182 HydrophobicContact CB-CB 4.46Å; V122-A182 HydrophobicContact CG2-CB 3.54Å; L125-A182 HydrophobicContact CD1-CB 3.99Å; A178-A182 WeakPolarHBondContact O-CB 3.32Å; A178-A182 PolarHBondContact O-N 3.23Å; M179-A182 PolarHBondContact O-N 3.2Å; A182-L186 WeakPolarHBondContact O-CG 3.17Å; A182-L186 PolarHBondContact O-N 3.17Å
183	M	82.4	Confident	81	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.8	-41.3	174.3	-175.4	58	71.7	0	0	112.1	L125 P132 L133 I139 F145 M179 G180 L181 E185 L186 V187 I201	L125-M183 HydrophobicContact CD1-CB 4.13Å; L125-M183 HydrophobicContact CD1-CE 3.82Å; L125-M183 HydrophobicContact CD2-CE 3.67Å; L125-M183 HydrophobicContact CG-CE 4.26Å; P132-M183 HydrophobicContact CG-CE 3.59Å; L133-M183 HydrophobicContact CD2-SD 3.99Å; L133-M183 HydrophobicContact CG-SD 4.26Å; I139-M183 HydrophobicContact CD1-SD 4.36Å; F145-M183 HydrophobicContact CD1-CB 4.2Å; F145-M183 HydrophobicContact CD1-CE 4.31Å; F145-M183 HydrophobicContact CD1-CG 3.87Å; F145-M183 HydrophobicContact CD2-CE 3.75Å; F145-M183 HydrophobicContact CE1-CB 3.45Å; F145-M183 VanDerWaalsContact CE1-CB 3.45Å; F145-M183 HydrophobicContact CE1-CE 4.35Å; F145-M183 HydrophobicContact CE1-CG 3.66Å; F145-M183 HydrophobicContact CE2-CB 4.4Å; F145-M183 HydrophobicContact CE2-CE 3.76Å; F145-M183 HydrophobicContact CG-CE 4.02Å; F145-M183 HydrophobicContact CG-CG 4.47Å; F145-M183 HydrophobicContact CZ-CB 3.57Å; F145-M183 HydrophobicContact CZ-CE 4.08Å; F145-M183 HydrophobicContact CZ-CG 4.08Å; M179-M183 PolarHBondContact O-N 3.33Å; G180-M183 PolarHBondContact O-N 2.65Å; L181-M183 VanDerWaalsContact C-N 3.29Å; L181-M183 PolarHBondContact O-N 3.29Å; M183-E185 VanDerWaalsContact C-N 3.33Å; M183-E185 PolarHBondContact O-N 3.48Å; M183-L186 PolarHBondContact O-N 3.19Å; M183-V187 HydrophobicContact CG-CG2 4.26Å; M183-V187 VanDerWaalsContact O-CG2 3.28Å; M183-V187 WeakPolarHBondContact O-CG2 3.19Å; M183-V187 PolarHBondContact O-N 3.33Å; M183-V187 HydrophobicContact SD-CG2 4.19Å; M183-I201 HydrophobicContact CG-CD1 4.42Å; M183-I201 HydrophobicContact CG-CG2 4.27Å
184	Y	83	Confident	79.4	Confident	10 Å²	10	43.3 Å²	43.3	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-44.8	178.4	-171.4	-91	0	0	0	112.1	I101 Y102 G180 L181 L186 V187 I188 L198 I201	I101-Y184 HydrophobicContact CD1-CE1 4.15Å; I101-Y184 HydrophobicContact CD1-CE2 3.84Å; I101-Y184 VanDerWaalsContact CD1-CZ 3.49Å; I101-Y184 WeakPolarHBondContact CD1-OH 3.45Å; Y102-Y184 HydrophobicContact CE2-CD2 4.28Å; Y102-Y184 HydrophobicContact CE2-CG 4.21Å; G180-Y184 PolarHBondContact O-N 2.81Å; L181-Y184 WeakPolarHBondContact O-CB 3.37Å; L181-Y184 PolarHBondContact O-N 3.45Å; L181-Y184 VanDerWaalsContact O-N 3.09Å; Y184-L186 PolarHBondContact O-N 3.1Å; Y184-V187 PolarHBondContact O-N 2.95Å; Y184-I188 HydrophobicContact CD1-CD1 3.62Å; Y184-I188 HydrophobicContact CD1-CG1 4.25Å; Y184-I188 HydrophobicContact CE1-CD1 3.09Å; Y184-I188 HydrophobicContact CE1-CG1 4.01Å; Y184-I188 WeakPolarHBondContact O-CG1 3.23Å; Y184-I188 PolarHBondContact O-N 3.32Å; Y184-L198 HydrophobicContact CD2-CB 4.24Å; Y184-L198 HydrophobicContact CE2-CB 3.32Å; Y184-L198 WeakPolarHBondContact CE2-O 3.37Å; Y184-L198 WeakPolarHBondContact OH-CB 3.41Å; Y184-L198 PolarHBondContact OH-N 3.27Å; Y184-L198 PolarHBondContact OH-O 3.11Å; Y184-L198 VanDerWaalsContact OH-O 3.1Å; Y184-I201 HydrophobicContact CD2-CD1 4.39Å; Y184-I201 HydrophobicContact CD2-CG1 4.45Å
185	E	81.5	Confident	77.9	Confident	38 Å²	38	47 Å²	47	18%	0.178	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-44	175.6	-67.4	-59.4	135.5	0	0	112	F96 A97 G98 L181 M183 V187 I188 H189	F96-E185 WeakPolarHBondContact CA-OE1 3.47Å; F96-E185 HydrophobicContact CB-CG 4.26Å; F96-E185 WeakPolarHBondContact CB-OE1 3.5Å; F96-E185 HydrophobicContact CD1-CG 3.99Å; A97-E185 WeakPolarHBondContact CA-OE1 3.3Å; A97-E185 PolarHBondContact N-OE1 3.48Å; A97-E185 PolarHBondContact N-OE2 3.16Å; G98-E185 PolarHBondContact N-OE1 3Å; L181-E185 HydrophobicContact CD1-CG 4.42Å; L181-E185 WeakPolarHBondContact O-CG 3.31Å; L181-E185 PolarHBondContact O-N 3.18Å; M183-E185 VanDerWaalsContact C-N 3.33Å; M183-E185 PolarHBondContact O-N 3.48Å; E185-V187 VanDerWaalsContact C-N 3.33Å; E185-V187 PolarHBondContact O-N 3.23Å; E185-I188 PolarHBondContact O-N 3.22Å; E185-H189 WeakPolarHBondContact O-CB 3.43Å; E185-H189 PolarHBondContact O-N 3.25Å
186	L	79.5	Confident	76.4	Confident	28 Å²	28	52.7 Å²	52.7	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-39.1	177.9	-71.3	170.4	0	0	0	112.4	V122 L125 S126 L133 A182 M183 Y184 R190	V122-L186 HydrophobicContact CG1-CD2 4.12Å; V122-L186 HydrophobicContact CG1-CG 4.4Å; L125-L186 HydrophobicContact CB-CD1 3.34Å; L125-L186 HydrophobicContact CD1-CD1 4Å; L125-L186 HydrophobicContact CG-CD1 4.34Å; S126-L186 WeakPolarHBondContact OG-CD2 3.45Å; L133-L186 HydrophobicContact CD1-CB 4.34Å; L133-L186 HydrophobicContact CD1-CD1 4.22Å; L133-L186 HydrophobicContact CD2-CB 4.47Å; A182-L186 WeakPolarHBondContact O-CG 3.17Å; A182-L186 PolarHBondContact O-N 3.17Å; M183-L186 PolarHBondContact O-N 3.19Å; Y184-L186 PolarHBondContact O-N 3.1Å; L186-R190 WeakPolarHBondContact O-CB 3.42Å; L186-R190 PolarHBondContact O-N 3.36Å; L186-R190 VanDerWaalsContact O-N 3.11Å
187	V	78.9	Confident	75.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-43.4	177.2	169.4	0	0	0	0	111.1	L133 F136 L140 M183 Y184 E185 R190 L191 L198 I201	L133-V187 HydrophobicContact CD2-CG2 4.48Å; F136-V187 HydrophobicContact CE2-CB 4.24Å; F136-V187 HydrophobicContact CE2-CG1 3.88Å; F136-V187 HydrophobicContact CE2-CG2 4.01Å; F136-V187 HydrophobicContact CZ-CG1 4.07Å; L140-V187 HydrophobicContact CD2-CG1 4.15Å; M183-V187 HydrophobicContact CG-CG2 4.26Å; M183-V187 VanDerWaalsContact O-CG2 3.28Å; M183-V187 WeakPolarHBondContact O-CG2 3.19Å; M183-V187 PolarHBondContact O-N 3.33Å; M183-V187 HydrophobicContact SD-CG2 4.19Å; Y184-V187 PolarHBondContact O-N 2.95Å; E185-V187 VanDerWaalsContact C-N 3.33Å; E185-V187 PolarHBondContact O-N 3.23Å; V187-R190 PolarHBondContact O-N 3.14Å; V187-L191 HydrophobicContact CG1-CD1 3.71Å; V187-L191 PolarHBondContact O-N 3.04Å; V187-L198 HydrophobicContact CG1-CD1 4.17Å; V187-L198 HydrophobicContact CG1-CD2 3.82Å; V187-I201 HydrophobicContact CB-CD1 4.36Å; V187-I201 HydrophobicContact CG1-CD1 4.49Å; V187-I201 HydrophobicContact CG2-CD1 4Å
188	I	79.7	Confident	74.3	Confident	53 Å²	53	59.5 Å²	59.5	27%	0.272	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-48.9	174.9	-77.5	-176.1	0	0	0	110.8	A97 Y184 E185 R190 L191 D192 L198	A97-I188 HydrophobicContact CB-CD1 3.89Å; Y184-I188 HydrophobicContact CD1-CD1 3.62Å; Y184-I188 HydrophobicContact CD1-CG1 4.25Å; Y184-I188 HydrophobicContact CE1-CD1 3.09Å; Y184-I188 HydrophobicContact CE1-CG1 4.01Å; Y184-I188 WeakPolarHBondContact O-CG1 3.23Å; Y184-I188 PolarHBondContact O-N 3.32Å; E185-I188 PolarHBondContact O-N 3.22Å; I188-R190 PolarHBondContact O-N 3.1Å; I188-L191 PolarHBondContact O-N 3.12Å; I188-L191 VanDerWaalsContact O-N 3.14Å; I188-D192 PolarHBondContact O-N 2.99Å; I188-L198 HydrophobicContact CD1-CD1 4.33Å; I188-L198 HydrophobicContact CG1-CD1 3.48Å; I188-L198 VanDerWaalsContact CG1-CD1 3.48Å
189	H	78	Confident	73.6	Confident	160 Å²	160	62.3 Å²	62.3	74%	0.741	34%	0.339	S	S	*	.	H	α-helix	trans	-61.4	-28.3	-179.1	-168.7	-69.2	0	0	0	112	E185	E185-H189 WeakPolarHBondContact O-CB 3.43Å; E185-H189 PolarHBondContact O-N 3.25Å
190	R	74.3	Confident	73.2	Confident	148 Å²	148	66.9 Å²	66.9	56%	0.558	36%	0.359	S	S	*	.	H	α-helix	trans	-82.7	-29.5	177.3	-166.9	168.2	-177	151.7	-2.5	113.7	F136 L186 V187 I188	F136-R190 HydrophobicContact CE2-CB 4.36Å; F136-R190 HydrophobicContact CE2-CG 4.46Å; L186-R190 WeakPolarHBondContact O-CB 3.42Å; L186-R190 PolarHBondContact O-N 3.36Å; L186-R190 VanDerWaalsContact O-N 3.11Å; V187-R190 PolarHBondContact O-N 3.14Å; I188-R190 PolarHBondContact O-N 3.1Å
191	L	73.3	Confident	73	Confident	65 Å²	65	67.1 Å²	67.1	34%	0.34	36%	0.36	S	S	.	.	H	α-helix	trans	-79.1	-25.8	-179.1	-81	158.7	0	0	0	113	F136 L140 V187 I188 V193 L198	F136-L191 HydrophobicContact CE1-CD2 4.13Å; F136-L191 HydrophobicContact CE1-CG 4.32Å; F136-L191 HydrophobicContact CZ-CD1 3.94Å; F136-L191 HydrophobicContact CZ-CD2 4.04Å; F136-L191 HydrophobicContact CZ-CG 3.73Å; L140-L191 HydrophobicContact CD2-CD1 4.39Å; V187-L191 HydrophobicContact CG1-CD1 3.71Å; V187-L191 PolarHBondContact O-N 3.04Å; I188-L191 PolarHBondContact O-N 3.12Å; I188-L191 VanDerWaalsContact O-N 3.14Å; L191-V193 WeakPolarHBondContact O-CG2 3.28Å; L191-V193 PolarHBondContact O-N 3.36Å; L191-L198 HydrophobicContact CD1-CD1 3.93Å; L191-L198 HydrophobicContact CD1-CD2 4.1Å; L191-L198 HydrophobicContact CD1-CG 4.49Å
192	D	64.8	Low	73.1	Confident	155 Å²	155	68.8 Å²	68.8	83%	0.829	37%	0.369	S	S	*	.			trans	52.3	24.4	176.5	-133.1	10.9	0	0	0	113.9	I188	I188-D192 PolarHBondContact O-N 2.99Å
193	V	57.4	Low	73.1	Confident	83 Å²	83	69 Å²	69	50%	0.503	37%	0.371	S	S	.	.			trans	-114	96	178.1	-159.9	0	0	0	0	109.3	L191 S195 I196	L191-V193 WeakPolarHBondContact O-CG2 3.28Å; L191-V193 PolarHBondContact O-N 3.36Å; V193-S195 PolarHBondContact O-N 3.25Å; V193-I196 HydrophobicContact CB-CD1 4.43Å; V193-I196 HydrophobicContact CG1-CD1 4.2Å; V193-I196 HydrophobicContact CG1-CG1 4.31Å
194	G	52.8	Low	73.4	Confident	84 Å²	84	69.9 Å²	69.9	87%	0.866	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	27.6	-175.4	0	0	0	0	0	116.9
195	S	54.8	Low	73.6	Confident	115 Å²	115	69.4 Å²	69.4	80%	0.804	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.1	3.4	-175.8	-53.7	0	0	0	0	116.5	V193	V193-S195 PolarHBondContact O-N 3.25Å
196	I	57	Low	73.7	Confident	119 Å²	119	72.9 Å²	72.9	61%	0.61	38%	0.384	S	S	*	.			trans	-100	112.7	177.3	-55.9	175.8	0	0	0	108.9	V193 L198	V193-I196 HydrophobicContact CB-CD1 4.43Å; V193-I196 HydrophobicContact CG1-CD1 4.2Å; V193-I196 HydrophobicContact CG1-CG1 4.31Å; I196-L198 PolarHBondContact O-N 3.37Å
197	K	61.4	Low	73.7	Confident	174 Å²	174	74.3 Å²	74.3	76%	0.757	39%	0.392	S	S	*	.			trans	-63.5	99.6	168.4	-74.2	-176.3	178.7	179.9	0	108.1	D85	D85-K197 IonicContact OD1-NZ 3.96Å
198	L	68.5	Low	73.8	Confident	18 Å²	18	75.9 Å²	75.9	9%	0.094	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-67.6	137.7	174.9	-88	133.6	0	0	0	109.6	L140 Y184 V187 I188 L191 I196	L140-L198 HydrophobicContact CD2-CD2 3.64Å; Y184-L198 HydrophobicContact CD2-CB 4.24Å; Y184-L198 HydrophobicContact CE2-CB 3.32Å; Y184-L198 WeakPolarHBondContact CE2-O 3.37Å; Y184-L198 WeakPolarHBondContact OH-CB 3.41Å; Y184-L198 PolarHBondContact OH-N 3.27Å; Y184-L198 PolarHBondContact OH-O 3.11Å; Y184-L198 VanDerWaalsContact OH-O 3.1Å; V187-L198 HydrophobicContact CG1-CD1 4.17Å; V187-L198 HydrophobicContact CG1-CD2 3.82Å; I188-L198 HydrophobicContact CD1-CD1 4.33Å; I188-L198 HydrophobicContact CG1-CD1 3.48Å; I188-L198 VanDerWaalsContact CG1-CD1 3.48Å; L191-L198 HydrophobicContact CD1-CD1 3.93Å; L191-L198 HydrophobicContact CD1-CD2 4.1Å; L191-L198 HydrophobicContact CD1-CG 4.49Å; I196-L198 PolarHBondContact O-N 3.37Å
199	P	73	Confident	73.6	Confident	58 Å²	58	75 Å²	75	38%	0.377	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-65.3	157.8	173	28.5	-33.7	0	0	0	110.6	R143 I201	R143-P199 HydrophobicContact CG-CG 4.44Å; P199-I201 PolarHBondContact O-N 3.21Å
200	K	78.8	Confident	73.7	Confident	97 Å²	97	72.4 Å²	72.4	42%	0.422	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-57.2	129.7	177.8	-176.6	175.7	177.3	172.7	0	110.8	I101 Y102	I101-K200 HydrophobicContact CG2-CB 3.79Å; I101-K200 HydrophobicContact CG2-CD 4.42Å; I101-K200 HydrophobicContact CG2-CG 4.07Å; Y102-K200 HydrophobicContact CE1-CD 4.48Å; Y102-K200 HydrophobicContact CE1-CG 3.92Å
201	I	83.2	Confident	74.1	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.026	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-97.9	123.3	174.6	-56.7	176.2	0	0	0	109.1	Y102 I139 R143 F145 M183 Y184 V187 P199	Y102-I201 WeakPolarHBondContact CE1-O 3.4Å; Y102-I201 WeakPolarHBondContact OH-CA 3.45Å; Y102-I201 PolarHBondContact OH-N 2.98Å; Y102-I201 PolarHBondContact OH-O 3.19Å; I139-I201 HydrophobicContact CG2-CD1 4.32Å; I139-I201 HydrophobicContact CG2-CG2 4.14Å; R143-I201 WeakPolarHBondContact O-CA 3.37Å; F145-I201 HydrophobicContact CD1-CG2 3.65Å; F145-I201 HydrophobicContact CE1-CG2 3.89Å; M183-I201 HydrophobicContact CG-CD1 4.42Å; M183-I201 HydrophobicContact CG-CG2 4.27Å; Y184-I201 HydrophobicContact CD2-CD1 4.39Å; Y184-I201 HydrophobicContact CD2-CG1 4.45Å; V187-I201 HydrophobicContact CB-CD1 4.36Å; V187-I201 HydrophobicContact CG1-CD1 4.49Å; V187-I201 HydrophobicContact CG2-CD1 4Å; P199-I201 PolarHBondContact O-N 3.21Å
202	N	86.1	Confident	74.7	Confident	35 Å²	35	66.8 Å²	66.8	19%	0.187	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.4	-178.2	-67.1	-38.3	0	0	0	111.6	R143 H144 F145	R143-N202 PolarHBondContact O-N 2.74Å; H144-N202 VanDerWaalsContact CA-O 3.22Å; H144-N202 WeakPolarHBondContact CA-O 3.23Å; H144-N202 HydrophobicContact CB-CB 4.35Å; F145-N202 PolarHBondContact N-O 2.97Å; F145-N202 VanDerWaalsContact N-O 3.12Å
203	A	87.2	Confident	75.7	Confident	5 Å²	5	62.3 Å²	62.3	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.2	172.7	0	0	0	0	0	110.5	F145 I176 M179 F205 T369	F145-A203 HydrophobicContact CE1-CB 3.84Å; F145-A203 HydrophobicContact CE2-CB 4.33Å; F145-A203 HydrophobicContact CZ-CB 3.65Å; I176-A203 HydrophobicContact CG2-CB 4.42Å; M179-A203 HydrophobicContact CB-CB 4.1Å; M179-A203 HydrophobicContact CG-CB 3.96Å; A203-F205 HydrophobicContact CB-CD2 4.35Å; A203-F205 HydrophobicContact CB-CE2 3.93Å; A203-T369 WeakPolarHBondContact O-CG2 3.4Å
204	R	88.3	Confident	77.1	Confident	17 Å²	17	58.7 Å²	58.7	6%	0.064	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	96.6	-175.9	-58.6	-70.5	-178.4	-160.9	1.2	110	H144 F145 L146 V147 W206 V327 D329 L330 T369	H144-R204 HydrophobicContact CB-CG 4.04Å; F145-R204 WeakPolarHBondContact O-CB 3.39Å; F145-R204 PolarHBondContact O-N 3.11Å; L146-R204 WeakPolarHBondContact CA-O 3.41Å; L146-R204 HydrophobicContact CD2-CB 3.84Å; V147-R204 PolarHBondContact N-O 2.74Å; R204-W206 PolarHBondContact O-N 2.82Å; R204-V327 PolarHBondContact NH2-O 2.73Å; R204-V327 VanDerWaalsContact NH2-O 3.1Å; R204-D329 IonicContact CZ-OD1 3.13Å; R204-D329 VanDerWaalsContact CZ-OD1 3.28Å; R204-D329 IonicContact CZ-OD2 2.72Å; R204-D329 IonicContact NE-OD1 2.82Å; R204-D329 PolarHBondContact NE-OD1 3.41Å; R204-D329 IonicContact NE-OD2 3.75Å; R204-D329 PolarHBondContact NE-OD2 3.13Å; R204-D329 IonicContact NH2-OD1 3.37Å; R204-D329 PolarHBondContact NH2-OD1 2.67Å; R204-D329 IonicContact NH2-OD2 3.44Å; R204-L330 VanDerWaalsContact NH1-CD1 3.3Å; R204-T369 WeakPolarHBondContact CD-O 3.34Å; R204-T369 PolarHBondContact NH1-O 3.25Å
205	F	88	Confident	78.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.3	-178.3	-77.3	-125.1	0	0	0	110.3	V149 L168 V175 I176 M179 A203 L225 T369 S370	V149-F205 HydrophobicContact CG2-CB 3.78Å; V149-F205 HydrophobicContact CG2-CD1 3.43Å; V149-F205 VanDerWaalsContact CG2-CD1 3.43Å; V149-F205 HydrophobicContact CG2-CE1 4.35Å; V149-F205 HydrophobicContact CG2-CG 3.97Å; L168-F205 HydrophobicContact CD2-CE1 4.4Å; V175-F205 HydrophobicContact CG1-CE1 4.36Å; V175-F205 HydrophobicContact CG1-CZ 4.31Å; I176-F205 HydrophobicContact CB-CE2 4.11Å; I176-F205 HydrophobicContact CG1-CD2 3.9Å; I176-F205 HydrophobicContact CG1-CE2 3.79Å; I176-F205 HydrophobicContact CG1-CG 4.39Å; I176-F205 HydrophobicContact CG1-CZ 4.16Å; I176-F205 HydrophobicContact CG2-CD2 4.42Å; I176-F205 HydrophobicContact CG2-CE2 4.21Å; M179-F205 HydrophobicContact CB-CE2 3.97Å; M179-F205 HydrophobicContact CB-CZ 3.91Å; M179-F205 HydrophobicContact CG-CE2 4.08Å; M179-F205 HydrophobicContact CG-CZ 4.13Å; A203-F205 HydrophobicContact CB-CD2 4.35Å; A203-F205 HydrophobicContact CB-CE2 3.93Å; F205-L225 HydrophobicContact CD1-CD2 4.32Å; F205-T369 HydrophobicContact CB-CG2 3.99Å; F205-T369 HydrophobicContact CD2-CG2 4.17Å; F205-T369 HydrophobicContact CG-CG2 4.46Å; F205-S370 WeakPolarHBondContact O-CB 3.48Å; F205-S370 PolarHBondContact O-OG 2.79Å
206	W	81.9	Confident	80.2	Confident	111 Å²	111	56.4 Å²	56.4	42%	0.42	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	165.5	176.2	81.8	-77.5	0	0	0	111.5	V147 D148 V149 R204 F208	V147-W206 PolarHBondContact O-N 2.83Å; D148-W206 VanDerWaalsContact CA-NE1 3.3Å; D148-W206 HydrophobicContact CB-CZ2 3.76Å; D148-W206 WeakPolarHBondContact OD2-CZ2 3.24Å; V149-W206 WeakPolarHBondContact CG2-O 3.2Å; V149-W206 PolarHBondContact N-O 3.09Å; R204-W206 PolarHBondContact O-N 2.82Å; W206-F208 VanDerWaalsContact C-N 3.31Å; W206-F208 PolarHBondContact O-N 3.43Å
207	N	80.2	Confident	81.6	Confident	59 Å²	59	51.3 Å²	51.3	32%	0.316	26%	0.264	S	S	.	.			trans	62.6	27.9	179.9	-159	23.8	0	0	0	115.7	D148 Q150 G209	D148-N207 WeakPolarHBondContact OD1-CB 3.46Å; D148-N207 PolarHBondContact OD1-ND2 3.27Å; D148-N207 PolarHBondContact OD2-ND2 3.17Å; Q150-N207 VanDerWaalsContact CD-ND2 3.33Å; Q150-N207 WeakPolarHBondContact CG-O 3.41Å; Q150-N207 PolarHBondContact NE2-O 3.49Å; Q150-N207 PolarHBondContact NE2-OD1 3.37Å; Q150-N207 PolarHBondContact OE1-ND2 3.3Å; N207-G209 PolarHBondContact O-N 3.07Å
208	F	82	Confident	82.8	Confident	32 Å²	32	48.9 Å²	48.9	14%	0.14	26%	0.255	C	S	.	.			trans	-72.5	116.1	172.8	-174.4	-111	0	0	0	110.7	V149 F153 W206 L225 S227 T343	V149-F208 HydrophobicContact CB-CD2 4.47Å; V149-F208 HydrophobicContact CG1-CD2 3.81Å; V149-F208 HydrophobicContact CG2-CB 4.49Å; F153-F208 HydrophobicContact CE2-CE2 4.43Å; W206-F208 VanDerWaalsContact C-N 3.31Å; W206-F208 PolarHBondContact O-N 3.43Å; F208-L225 HydrophobicContact CB-CD2 4.25Å; F208-L225 HydrophobicContact CD1-CD2 4.15Å; F208-L225 HydrophobicContact CD1-CG 4.26Å; F208-L225 HydrophobicContact CD2-CD2 3.99Å; F208-L225 HydrophobicContact CE1-CB 4.44Å; F208-L225 HydrophobicContact CE1-CG 4.48Å; F208-L225 WeakPolarHBondContact CE1-O 3.29Å; F208-L225 HydrophobicContact CE2-CD2 4.35Å; F208-L225 HydrophobicContact CG-CD2 3.86Å; F208-L225 HydrophobicContact CG-CG 4.46Å; F208-S227 WeakPolarHBondContact O-CB 3.37Å; F208-S227 PolarHBondContact O-OG 2.94Å; F208-T343 HydrophobicContact CB-CG2 3.85Å
209	G	75.6	Confident	83.6	Confident	36 Å²	36	55 Å²	55	37%	0.371	28%	0.281	S	S	.	.	S	Bend	trans	-118	155.4	175.7	0	0	0	0	0	111.8	N207	N207-G209 PolarHBondContact O-N 3.07Å
210	P	79.6	Confident	84.3	Confident	104 Å²	104	56.5 Å²	56.5	68%	0.675	29%	0.293	S	S	*	.	S	Bend	cis	-79.7	153.4	3.4	31.4	-35	0	0	0	114
211	T	82.3	Confident	84.7	Confident	49 Å²	49	52.9 Å²	52.9	30%	0.301	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-71.3	133.6	172.7	48.1	0	0	0	0	110.7	S227 V229	T211-S227 CarbonylContact C-O 3.56Å; T211-S227 WeakPolarHBondContact CA-O 3.43Å; T211-V229 HydrophobicContact CG2-CG2 4.24Å
212	V	86.7	Confident	84.9	Confident	47 Å²	47	54.4 Å²	54.4	29%	0.285	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-101.5	143.3	179.9	-171.7	0	0	0	0	109	D216 I217 S227 F228	V212-D216 HydrophobicContact CG1-CB 4.15Å; V212-I217 HydrophobicContact CG1-CG1 4.28Å; V212-S227 PolarHBondContact N-O 3.25Å; V212-F228 WeakPolarHBondContact O-CB 3.31Å
213	K	84.9	Confident	85.1	Confident	61 Å²	61	55.8 Å²	55.8	27%	0.265	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-71.9	142.3	171.7	-73	-174.1	178	-177.6	0	110.1	R215 D216 E303 D309	K213-R215 PolarHBondContact O-N 3.16Å; K213-R215 VanDerWaalsContact O-N 3.16Å; K213-D216 HydrophobicContact CB-CB 4.47Å; K213-D216 PolarHBondContact O-N 2.67Å; K213-E303 WeakPolarHBondContact CB-OE1 3.3Å; K213-D309 IonicContact NZ-OD1 3.46Å; K213-D309 PolarHBondContact NZ-OD1 3.28Å; K213-D309 IonicContact NZ-OD2 3.53Å; K213-D309 PolarHBondContact NZ-OD2 3.28Å
214	I	87.4	Confident	85.3	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61	-30.9	-178.9	-59.8	-177.2	0	0	0	110.3	D216 F228 V301 E303 K320 I322	I214-D216 VanDerWaalsContact C-N 3.28Å; I214-D216 PolarHBondContact O-N 3.48Å; I214-F228 HydrophobicContact CD1-CD2 3.57Å; I214-F228 HydrophobicContact CD1-CE2 3.78Å; I214-F228 HydrophobicContact CG1-CB 4.33Å; I214-F228 HydrophobicContact CG1-CD2 3.48Å; I214-F228 VanDerWaalsContact CG1-CD2 3.48Å; I214-F228 HydrophobicContact CG1-CE2 4.09Å; I214-F228 HydrophobicContact CG1-CG 4.12Å; I214-V301 HydrophobicContact CD1-CG1 4.29Å; I214-E303 HydrophobicContact CB-CB 4.1Å; I214-E303 HydrophobicContact CB-CG 4.35Å; I214-E303 HydrophobicContact CD1-CB 4.06Å; I214-E303 HydrophobicContact CG1-CB 4.31Å; I214-E303 PolarHBondContact N-OE1 3.18Å; I214-E303 VanDerWaalsContact N-OE1 3.08Å; I214-K320 HydrophobicContact CG2-CB 4.25Å; I214-I322 HydrophobicContact CD1-CG2 4.16Å; I214-I322 HydrophobicContact CG2-CB 4.02Å; I214-I322 HydrophobicContact CG2-CG2 3.96Å
215	R	84.7	Confident	85.4	Confident	60 Å²	60	58.6 Å²	58.6	23%	0.226	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-61.5	-36.3	176	-175	169.8	-55.8	146.9	21.2	114.5	K213 I217 E303 L317 K320	K213-R215 PolarHBondContact O-N 3.16Å; K213-R215 VanDerWaalsContact O-N 3.16Å; R215-I217 VanDerWaalsContact C-N 3.31Å; R215-E303 PolarHBondContact N-OE1 2.71Å; R215-E303 IonicContact NH2-OE2 3.54Å; R215-E303 PolarHBondContact NH2-OE2 3.17Å; R215-L317 VanDerWaalsContact CZ-CG 3.47Å; R215-L317 VanDerWaalsContact NH1-CD2 3.27Å; R215-L317 VanDerWaalsContact NH1-CG 3.35Å; R215-K320 HydrophobicContact CG-CD 4.45Å; R215-K320 PolarHBondContact O-NZ 2.82Å
216	D	86.8	Confident	85.6	Confident	91 Å²	91	58.8 Å²	58.8	49%	0.487	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-85	-11.1	-169.8	-61.7	-19.9	0	0	0	112.1	V212 K213 I214 Q218	V212-D216 HydrophobicContact CG1-CB 4.15Å; K213-D216 HydrophobicContact CB-CB 4.47Å; K213-D216 PolarHBondContact O-N 2.67Å; I214-D216 VanDerWaalsContact C-N 3.28Å; I214-D216 PolarHBondContact O-N 3.48Å; D216-Q218 PolarHBondContact O-N 3.08Å
217	I	87.6	Confident	86.1	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.062	29%	0.289	C	S	.	.			trans	-65.3	116.6	173.5	-56.7	176.4	0	0	0	108.5	V212 R215 F228 I322 V346 M364 I366	V212-I217 HydrophobicContact CG1-CG1 4.28Å; R215-I217 VanDerWaalsContact C-N 3.31Å; I217-F228 HydrophobicContact CD1-CD1 4.36Å; I217-I322 HydrophobicContact CD1-CD1 4.18Å; I217-V346 HydrophobicContact CG2-CG1 4.48Å; I217-V346 HydrophobicContact CG2-CG2 4.17Å; I217-M364 HydrophobicContact CG2-CE 3.83Å; I217-I366 HydrophobicContact CD1-CD1 4.15Å
218	Q	86.9	Confident	86.6	Confident	123 Å²	123	50.9 Å²	50.9	58%	0.575	27%	0.274	S	S	*	.			trans	-118.7	170.4	-179	-70.6	-171.9	1	0	0	111.4	D216 S220 D221 M364	D216-Q218 PolarHBondContact O-N 3.08Å; Q218-S220 PolarHBondContact O-N 3.09Å; Q218-S220 VanDerWaalsContact O-N 3.16Å; Q218-D221 PolarHBondContact N-OD2 3.43Å; Q218-D221 PolarHBondContact O-N 3.29Å; Q218-M364 WeakPolarHBondContact O-CE 3.41Å
219	F	84.8	Confident	86.9	Confident	146 Å²	146	50.2 Å²	50.2	64%	0.64	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-54.6	-31.4	173.7	179.3	-81.9	0	0	0	112.4	D221 C222 M348	F219-D221 PolarHBondContact O-N 3.4Å; F219-C222 WeakPolarHBondContact O-CB 3.34Å; F219-C222 PolarHBondContact O-N 3.47Å; F219-C222 VanDerWaalsContact O-N 3.09Å; F219-M348 HydrophobicContact CB-CE 4.14Å; F219-M348 HydrophobicContact CD1-CE 4.37Å; F219-M348 HydrophobicContact CD2-CE 2.99Å; F219-M348 HydrophobicContact CD2-SD 3.46Å; F219-M348 WeakPolarHBondContact CD2-SD 3.35Å; F219-M348 HydrophobicContact CE2-CE 3.27Å; F219-M348 HydrophobicContact CE2-SD 3.17Å; F219-M348 WeakPolarHBondContact CE2-SD 3.48Å; F219-M348 HydrophobicContact CG-CE 3.6Å; F219-M348 HydrophobicContact CZ-CE 4.06Å; F219-M348 HydrophobicContact CZ-SD 4.1Å
220	S	87.3	Confident	87.6	Confident	90 Å²	90	48.5 Å²	48.5	63%	0.629	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-60.5	-20.7	176.5	49.4	0	0	0	0	114.1	Q218 C222	Q218-S220 PolarHBondContact O-N 3.09Å; Q218-S220 VanDerWaalsContact O-N 3.16Å; S220-C222 VanDerWaalsContact C-N 3.31Å
221	D	87.2	Confident	88.1	Confident	21 Å²	21	43.8 Å²	43.8	11%	0.112	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-90.9	12.1	177.8	-58.8	-61	0	0	0	112.8	Q218 F219 N223 R224 V226 V346	Q218-D221 PolarHBondContact N-OD2 3.43Å; Q218-D221 PolarHBondContact O-N 3.29Å; F219-D221 PolarHBondContact O-N 3.4Å; D221-N223 PolarHBondContact O-N 3.02Å; D221-R224 HydrophobicContact CB-CB 4.47Å; D221-R224 VanDerWaalsContact O-CB 3.27Å; D221-R224 WeakPolarHBondContact O-CB 3.32Å; D221-R224 PolarHBondContact O-N 3.12Å; D221-R224 VanDerWaalsContact O-N 3.16Å; D221-R224 IonicContact OD1-CZ 2.67Å; D221-R224 IonicContact OD1-NH1 3.86Å; D221-R224 PolarHBondContact OD1-NH1 2.99Å; D221-V226 HydrophobicContact CB-CG1 4.5Å; D221-V346 HydrophobicContact CB-CG2 4.48Å; D221-V346 WeakPolarHBondContact O-CB 3.31Å
222	C	87.9	Confident	88.5	Confident	38 Å²	38	41.4 Å²	41.4	26%	0.257	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	138.1	173.5	-162.5	0	0	0	0	111.1	F219 S220 R224 M348	F219-C222 WeakPolarHBondContact O-CB 3.34Å; F219-C222 PolarHBondContact O-N 3.47Å; F219-C222 VanDerWaalsContact O-N 3.09Å; S220-C222 VanDerWaalsContact C-N 3.31Å; C222-R224 PolarHBondContact O-N 3.33Å; C222-R224 VanDerWaalsContact O-N 3.12Å; C222-M348 HydrophobicContact CB-CE 3.62Å
223	N	89.8	Confident	88.7	Confident	64 Å²	64	40.4 Å²	40.4	34%	0.342	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	7	-176.3	-59.1	-17.8	0	0	0	115.8	S170 A172 D221 V346	S170-N223 WeakPolarHBondContact O-CB 3.4Å; A172-N223 WeakPolarHBondContact CB-O 3.41Å; A172-N223 PolarHBondContact N-O 3.24Å; D221-N223 PolarHBondContact O-N 3.02Å; N223-V346 PolarHBondContact N-O 3.27Å
224	R	91	Very high	89	Confident	80 Å²	80	41 Å²	41	30%	0.302	20%	0.204	S	C	.	.			trans	-91.5	145.9	174.6	178	169.6	179.4	-166.4	5.1	111.4	D221 C222 V226 V346	D221-R224 HydrophobicContact CB-CB 4.47Å; D221-R224 VanDerWaalsContact O-CB 3.27Å; D221-R224 WeakPolarHBondContact O-CB 3.32Å; D221-R224 PolarHBondContact O-N 3.12Å; D221-R224 VanDerWaalsContact O-N 3.16Å; D221-R224 IonicContact OD1-CZ 2.67Å; D221-R224 IonicContact OD1-NH1 3.86Å; D221-R224 PolarHBondContact OD1-NH1 2.99Å; C222-R224 PolarHBondContact O-N 3.33Å; C222-R224 VanDerWaalsContact O-N 3.12Å; R224-V226 HydrophobicContact CG-CG1 4.49Å; R224-V346 PolarHBondContact O-N 3.27Å
225	L	91.3	Very high	89.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.2	169	-165.5	72.2	0	0	0	109.9	L168 A172 I176 F205 F208 T343 V345	L168-L225 HydrophobicContact CD2-CB 4.42Å; L168-L225 HydrophobicContact CD2-CD2 4.13Å; L168-L225 PolarHBondContact O-N 3.48Å; A172-L225 HydrophobicContact CB-CB 3.86Å; I176-L225 HydrophobicContact CD1-CD1 4.31Å; F205-L225 HydrophobicContact CD1-CD2 4.32Å; F208-L225 HydrophobicContact CB-CD2 4.25Å; F208-L225 HydrophobicContact CD1-CD2 4.15Å; F208-L225 HydrophobicContact CD1-CG 4.26Å; F208-L225 HydrophobicContact CD2-CD2 3.99Å; F208-L225 HydrophobicContact CE1-CB 4.44Å; F208-L225 HydrophobicContact CE1-CG 4.48Å; F208-L225 WeakPolarHBondContact CE1-O 3.29Å; F208-L225 HydrophobicContact CE2-CD2 4.35Å; F208-L225 HydrophobicContact CG-CD2 3.86Å; F208-L225 HydrophobicContact CG-CG 4.46Å; L225-T343 HydrophobicContact CD1-CG2 4.05Å; L225-T343 HydrophobicContact CD2-CG2 4.16Å; L225-T343 HydrophobicContact CG-CG2 4.04Å; L225-V345 HydrophobicContact CD1-CG2 4.01Å
226	V	92.1	Very high	89.4	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.03	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.2	176.6	-62.1	0	0	0	0	110.3	D221 R224 F228 T343 G344 V346 I366	D221-V226 HydrophobicContact CB-CG1 4.5Å; R224-V226 HydrophobicContact CG-CG1 4.49Å; V226-F228 HydrophobicContact CG2-CD1 4.49Å; V226-T343 WeakPolarHBondContact O-CA 3.3Å; V226-G344 PolarHBondContact N-O 3.23Å; V226-G344 PolarHBondContact O-N 3.05Å; V226-V346 HydrophobicContact CB-CG2 4.36Å; V226-V346 HydrophobicContact CG1-CG2 3.87Å; V226-V346 HydrophobicContact CG2-CG2 3.53Å; V226-I366 HydrophobicContact CG2-CD1 4.08Å
227	S	91.7	Very high	89.5	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.9	171	-167.4	0	0	0	0	109.2	F208 T211 V212 I342 T343	F208-S227 WeakPolarHBondContact O-CB 3.37Å; F208-S227 PolarHBondContact O-OG 2.94Å; T211-S227 CarbonylContact C-O 3.56Å; T211-S227 WeakPolarHBondContact CA-O 3.43Å; V212-S227 PolarHBondContact N-O 3.25Å; S227-I342 VanDerWaalsContact CA-O 3.31Å; S227-I342 WeakPolarHBondContact CA-O 3.27Å; S227-T343 PolarHBondContact OG-OG1 3.21Å; S227-T343 VanDerWaalsContact OG-OG1 3.1Å
228	F	91.3	Very high	89.6	Confident	1 Å²	1	39 Å²	39	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.2	-179.9	65.3	-81.4	0	0	0	110.8	V212 I214 I217 V226 V301 I322 C341 I342 I366	V212-F228 WeakPolarHBondContact O-CB 3.31Å; I214-F228 HydrophobicContact CD1-CD2 3.57Å; I214-F228 HydrophobicContact CD1-CE2 3.78Å; I214-F228 HydrophobicContact CG1-CB 4.33Å; I214-F228 HydrophobicContact CG1-CD2 3.48Å; I214-F228 VanDerWaalsContact CG1-CD2 3.48Å; I214-F228 HydrophobicContact CG1-CE2 4.09Å; I214-F228 HydrophobicContact CG1-CG 4.12Å; I217-F228 HydrophobicContact CD1-CD1 4.36Å; V226-F228 HydrophobicContact CG2-CD1 4.49Å; F228-V301 HydrophobicContact CE2-CB 4.32Å; F228-V301 HydrophobicContact CE2-CG1 3.9Å; F228-I322 HydrophobicContact CE2-CG2 3.89Å; F228-I322 HydrophobicContact CZ-CG2 3.95Å; F228-C341 WeakPolarHBondContact O-CA 3.31Å; F228-I342 HydrophobicContact CD1-CB 4.48Å; F228-I342 HydrophobicContact CE1-CB 3.8Å; F228-I342 HydrophobicContact CE1-CG2 3.69Å; F228-I342 HydrophobicContact CE2-CB 4.24Å; F228-I342 HydrophobicContact CE2-CD1 4.3Å; F228-I342 HydrophobicContact CZ-CB 3.69Å; F228-I342 HydrophobicContact CZ-CD1 4.02Å; F228-I342 HydrophobicContact CZ-CG1 4.41Å; F228-I342 HydrophobicContact CZ-CG2 3.77Å; F228-I342 PolarHBondContact N-O 3.21Å; F228-I342 PolarHBondContact O-N 2.73Å; F228-I366 HydrophobicContact CD1-CD1 3.93Å; F228-I366 HydrophobicContact CE1-CD1 3.17Å; F228-I366 HydrophobicContact CE1-CG1 4.45Å; F228-I366 HydrophobicContact CE1-CG2 4.37Å; F228-I366 HydrophobicContact CZ-CD1 3.67Å
229	V	88.7	Confident	89.7	Confident	19 Å²	19	35.5 Å²	35.5	12%	0.115	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.1	179.7	-177.2	0	0	0	0	108.8	T211 V339 V340 C341	T211-V229 HydrophobicContact CG2-CG2 4.24Å; V229-V339 HydrophobicContact CG1-CG1 3.94Å; V229-V340 WeakPolarHBondContact CA-O 3.43Å; V229-C341 HydrophobicContact CG2-CB 4.2Å
230	G	89.7	Confident	89.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	178.3	178.3	0	0	0	0	0	113.1	Q302 V339 V340	G230-Q302 CarbonylContact C-O 3.53Å; G230-Q302 WeakPolarHBondContact CA-O 3.32Å; G230-V339 WeakPolarHBondContact O-CA 3.46Å; G230-V340 PolarHBondContact N-O 2.98Å; G230-V340 PolarHBondContact O-N 3.26Å
231	V	89.5	Confident	89.7	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.5	176.9	-178.9	0	0	0	0	109.8	V233 V301 Q302 L304 V339 I521	V231-V233 PolarHBondContact O-N 2.7Å; V231-V301 CarbonylContact O-C 3.56Å; V231-V301 WeakPolarHBondContact O-CA 3.46Å; V231-Q302 PolarHBondContact N-O 3.04Å; V231-Q302 PolarHBondContact O-N 2.65Å; V231-L304 HydrophobicContact CG2-CD1 3.34Å; V231-V339 HydrophobicContact CG2-CG2 4.09Å; V231-I521 HydrophobicContact CG1-CG1 4.27Å; V231-I521 HydrophobicContact CG1-CG2 4.18Å
232	V	92.2	Very high	89.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	112.7	173.2	-176.6	0	0	0	0	109.5	I235 L299 V301 G337 S338 V340	V232-I235 HydrophobicContact CG1-CD1 3.93Å; V232-I235 HydrophobicContact CG1-CG1 3.55Å; V232-L299 HydrophobicContact CG1-CD2 4.18Å; V232-V301 HydrophobicContact CG2-CG2 4.34Å; V232-G337 PolarHBondContact O-N 2.8Å; V232-S338 PolarHBondContact N-O 2.83Å; V232-V340 HydrophobicContact CG2-CB 4.42Å; V232-V340 HydrophobicContact CG2-CG1 3.85Å; V232-V340 HydrophobicContact CG2-CG2 3.62Å
233	V	90.6	Very high	89.2	Confident	26 Å²	26	32 Å²	32	16%	0.158	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-45.9	-179.5	-178	0	0	0	0	111.4	V231 R300 Q302 D515 A516	V231-V233 PolarHBondContact O-N 2.7Å; V233-R300 PolarHBondContact N-O 3.36Å; V233-Q302 HydrophobicContact CG2-CB 3.42Å; V233-Q302 VanDerWaalsContact CG2-CB 3.42Å; V233-Q302 HydrophobicContact CG2-CG 4.41Å; V233-D515 CarbonylContact O-C 3.52Å; V233-D515 WeakPolarHBondContact O-CA 3.22Å; V233-A516 PolarHBondContact O-N 2.89Å
234	R	91	Very high	88.8	Confident	74 Å²	74	30.7 Å²	30.7	28%	0.279	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.8	179.1	178.4	177	-83.4	175.6	-5.8	110.6	L299 R300 I514 D515	R234-L299 WeakPolarHBondContact O-CA 3.24Å; R234-R300 HydrophobicContact CB-CB 3.76Å; R234-R300 PolarHBondContact N-O 3.48Å; R234-R300 PolarHBondContact O-N 3.07Å; R234-I514 WeakPolarHBondContact CA-O 3.19Å; R234-D515 WeakPolarHBondContact CB-OD1 3.47Å; R234-D515 WeakPolarHBondContact CD-OD1 3.25Å; R234-D515 WeakPolarHBondContact CG-OD1 3.39Å; R234-D515 IonicContact CZ-OD1 3.87Å; R234-D515 IonicContact CZ-OD2 2.7Å; R234-D515 IonicContact NE-OD1 2.89Å; R234-D515 PolarHBondContact NE-OD1 2.83Å; R234-D515 IonicContact NE-OD2 3.42Å; R234-D515 IonicContact NH2-OD1 3.48Å; R234-D515 PolarHBondContact NH2-OD1 2.97Å; R234-D515 IonicContact NH2-OD2 3.48Å; R234-D515 PolarHBondContact NH2-OD2 2.92Å
235	I	90.6	Very high	88.4	Confident	18 Å²	18	27 Å²	27	9%	0.092	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.1	168.6	-59.8	-169	0	0	0	108.8	V232 L299 C334 S335 S336 I514	V232-I235 HydrophobicContact CG1-CD1 3.93Å; V232-I235 HydrophobicContact CG1-CG1 3.55Å; I235-L299 HydrophobicContact CB-CD2 4.22Å; I235-L299 HydrophobicContact CD1-CD2 4.26Å; I235-L299 HydrophobicContact CG1-CD2 3.74Å; I235-L299 HydrophobicContact CG2-CD2 4.07Å; I235-C334 WeakPolarHBondContact CD1-O 3.32Å; I235-S335 VanDerWaalsContact CD1-C 3.48Å; I235-S336 WeakPolarHBondContact CD1-OG 3.44Å; I235-S336 WeakPolarHBondContact CG1-OG 3.46Å; I235-I514 PolarHBondContact N-O 3.28Å; I235-I514 PolarHBondContact O-N 3.38Å
236	G	90.2	Very high	88.1	Confident	14 Å²	14	27 Å²	27	14%	0.144	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-81	164.1	171.5	0	0	0	0	0	112.9	Q297 Q298	G236-Q297 WeakPolarHBondContact O-CG 3.23Å; G236-Q297 PolarHBondContact O-NE2 3.22Å; G236-Q298 PolarHBondContact N-O 3.39Å
237	S	88.6	Confident	87.8	Confident	28 Å²	28	26.8 Å²	26.8	20%	0.196	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-62.8	150.2	169.1	50.3	0	0	0	0	111.1	D511	S237-D511 WeakPolarHBondContact OG-CB 3.13Å; S237-D511 VanDerWaalsContact OG-CG 3.28Å; S237-D511 PolarHBondContact OG-OD2 3.35Å
238	C	89.3	Confident	87.6	Confident	65 Å²	65	28.1 Å²	28.1	44%	0.439	16%	0.157	S	C	.	.	P	Polyproline II helix	trans	-69.8	130	166.1	-179.2	0	0	0	0	108.8	W296 V331	C238-W296 WeakPolarHBondContact CA-O 3.44Å; C238-V331 HydrophobicContact CB-CG1 4.05Å
239	R	88.3	Confident	87.3	Confident	51 Å²	51	28 Å²	28	19%	0.192	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.4	175.6	-58	-176.5	176.4	143.7	9.7	109.7	W296 D507 D511	R239-W296 HydrophobicContact CB-CE3 4.03Å; R239-W296 HydrophobicContact CG-CE3 4.34Å; R239-W296 HydrophobicContact CG-CZ3 4.4Å; R239-W296 PolarHBondContact N-O 2.93Å; R239-W296 WeakPolarHBondContact O-CA 3.46Å; R239-W296 WeakPolarHBondContact O-CB 3.49Å; R239-W296 PolarHBondContact O-N 3.39Å; R239-D507 IonicContact CZ-OD2 3.09Å; R239-D507 IonicContact NH1-OD2 2.72Å; R239-D507 PolarHBondContact NH1-OD2 3.37Å; R239-D507 VanDerWaalsContact NH1-OD2 3.11Å; R239-D507 IonicContact NH2-OD2 3.32Å; R239-D507 PolarHBondContact NH2-OD2 3.4Å; R239-D511 IonicContact CZ-OD2 3.03Å; R239-D511 IonicContact NE-OD2 2.92Å; R239-D511 PolarHBondContact NE-OD2 3.45Å; R239-D511 IonicContact NH2-OD2 2.56Å; R239-D511 PolarHBondContact NH2-OD2 3.28Å; R239-D511 VanDerWaalsContact NH2-OD2 3.09Å
240	P	88	Confident	87.1	Confident	95 Å²	95	29.8 Å²	29.8	62%	0.617	16%	0.164	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	131	170.8	30.3	-33.1	0	0	0	110.1	T293	P240-T293 HydrophobicContact CB-CG2 4.41Å
241	K	85.5	Confident	86.9	Confident	41 Å²	41	33.6 Å²	33.6	18%	0.178	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.4	173.4	176.4	177.6	179.7	179.4	0	108.9	T243 D263 T293 V294 W296	K241-T243 PolarHBondContact O-N 3.5Å; K241-D263 WeakPolarHBondContact CE-OD1 3.43Å; K241-D263 IonicContact NZ-OD1 3.36Å; K241-D263 PolarHBondContact NZ-OD1 2.99Å; K241-D263 IonicContact NZ-OD2 2.79Å; K241-D263 PolarHBondContact NZ-OD2 2.9Å; K241-T293 CarbonylContact O-C 3.48Å; K241-T293 VanDerWaalsContact O-CA 3.29Å; K241-T293 WeakPolarHBondContact O-CA 3.37Å; K241-V294 HydrophobicContact CB-CG2 4.03Å; K241-V294 HydrophobicContact CD-CG2 4.46Å; K241-V294 HydrophobicContact CG-CG2 4.37Å; K241-V294 PolarHBondContact N-O 3.22Å; K241-V294 PolarHBondContact O-N 2.93Å; K241-W296 HydrophobicContact CB-CB 3.69Å; K241-W296 HydrophobicContact CB-CG 4.38Å; K241-W296 HydrophobicContact CD-CB 4.23Å; K241-W296 HydrophobicContact CD-CG 4.24Å
242	C	83.4	Confident	86.7	Confident	42 Å²	42	35.8 Å²	35.8	28%	0.284	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128	175.8	-59.2	0	0	0	0	110	V245 L260	C242-V245 HydrophobicContact CB-CG2 3.69Å; C242-L260 HydrophobicContact CB-CD1 4.05Å
243	T	80.6	Confident	86.3	Confident	43 Å²	43	41.3 Å²	41.3	26%	0.264	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-39.3	170.9	53.2	0	0	0	0	110.5	K241 L260 E292 V294	K241-T243 PolarHBondContact O-N 3.5Å; T243-L260 PolarHBondContact O-N 3.47Å; T243-E292 PolarHBondContact N-O 3.19Å; T243-E292 PolarHBondContact OG1-O 3.39Å; T243-V294 HydrophobicContact CG2-CB 4.43Å; T243-V294 HydrophobicContact CG2-CG1 3.86Å; T243-V294 HydrophobicContact CG2-CG2 3.72Å
244	R	82.1	Confident	85.8	Confident	37 Å²	37	45.3 Å²	45.3	14%	0.14	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.3	175.4	-172	166.4	72.8	119.8	-4.9	109.3	S257 I258 L259 P290 T291 E292	R244-S257 PolarHBondContact NH1-OG 2.89Å; R244-I258 WeakPolarHBondContact CA-O 3.29Å; R244-L259 HydrophobicContact CB-CD1 4.43Å; R244-P290 PolarHBondContact NE-O 2.92Å; R244-P290 PolarHBondContact NH2-O 3.47Å; R244-T291 CarbonylContact O-C 3.55Å; R244-T291 VanDerWaalsContact O-CA 3.32Å; R244-T291 WeakPolarHBondContact O-CA 3.48Å; R244-T291 WeakPolarHBondContact O-CG2 3.31Å; R244-E292 HydrophobicContact CB-CB 4.15Å; R244-E292 IonicContact CZ-OE1 3.1Å; R244-E292 PolarHBondContact N-O 2.87Å; R244-E292 IonicContact NE-OE1 3.41Å; R244-E292 PolarHBondContact NE-OE1 3.13Å; R244-E292 VanDerWaalsContact NE-OE1 3.1Å; R244-E292 IonicContact NH2-OE1 3.47Å; R244-E292 PolarHBondContact NH2-OE1 2.84Å; R244-E292 PolarHBondContact O-N 3.49Å
245	V	82.6	Confident	85.3	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126	178	-178.7	0	0	0	0	109.3	C242 F247 S257 I258 L260 Y265 P283	C242-V245 HydrophobicContact CB-CG2 3.69Å; V245-F247 HydrophobicContact CB-CE2 3.86Å; V245-F247 HydrophobicContact CB-CZ 4.2Å; V245-F247 HydrophobicContact CG1-CD2 4.15Å; V245-F247 HydrophobicContact CG1-CE1 4.13Å; V245-F247 HydrophobicContact CG1-CE2 3.61Å; V245-F247 HydrophobicContact CG1-CZ 3.61Å; V245-S257 CarbonylContact O-C 3.59Å; V245-S257 WeakPolarHBondContact O-CA 3.49Å; V245-I258 PolarHBondContact N-O 3.39Å; V245-I258 PolarHBondContact O-N 3.35Å; V245-L260 HydrophobicContact CG2-CD1 3.69Å; V245-L260 HydrophobicContact CG2-CG 4.22Å; V245-Y265 HydrophobicContact CG1-CE2 4.34Å; V245-Y265 HydrophobicContact CG2-CE2 4.34Å; V245-P283 HydrophobicContact CG1-CB 4.33Å
246	A	85	Confident	84.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.6	170.8	0	0	0	0	0	110.4	F256 L284 P290 T291	A246-F256 CarbonylContact C-O 3.57Å; A246-F256 WeakPolarHBondContact CA-O 3.46Å; A246-L284 HydrophobicContact CB-CB 3.99Å; A246-L284 HydrophobicContact CB-CD1 4.32Å; A246-L284 PolarHBondContact O-N 3.36Å; A246-P290 HydrophobicContact CB-CB 4.49Å; A246-P290 HydrophobicContact CB-CG 3.65Å; A246-T291 WeakPolarHBondContact CB-OG1 3.43Å; A246-T291 PolarHBondContact N-OG1 3Å
247	F	84.8	Confident	84.4	Confident	1 Å²	1	49.1 Å²	49.1	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.8	176.8	-69.3	-81.2	0	0	0	110.1	V245 R255 F256 I258 Y265 P268 F281 E282 P283	V245-F247 HydrophobicContact CB-CE2 3.86Å; V245-F247 HydrophobicContact CB-CZ 4.2Å; V245-F247 HydrophobicContact CG1-CD2 4.15Å; V245-F247 HydrophobicContact CG1-CE1 4.13Å; V245-F247 HydrophobicContact CG1-CE2 3.61Å; V245-F247 HydrophobicContact CG1-CZ 3.61Å; F247-R255 WeakPolarHBondContact O-CA 3.34Å; F247-F256 HydrophobicContact CB-CD2 4.18Å; F247-F256 HydrophobicContact CB-CE1 4.18Å; F247-F256 HydrophobicContact CB-CE2 3.71Å; F247-F256 HydrophobicContact CB-CZ 3.72Å; F247-F256 HydrophobicContact CD2-CE2 4.17Å; F247-F256 HydrophobicContact CG-CE2 4.27Å; F247-F256 PolarHBondContact N-O 3.21Å; F247-F256 PolarHBondContact O-N 3.42Å; F247-I258 HydrophobicContact CD2-CB 4.39Å; F247-I258 HydrophobicContact CD2-CD1 3.78Å; F247-I258 HydrophobicContact CD2-CG1 4.21Å; F247-I258 HydrophobicContact CE2-CB 4.17Å; F247-I258 HydrophobicContact CE2-CD1 3.79Å; F247-I258 HydrophobicContact CE2-CG1 4.33Å; F247-Y265 HydrophobicContact CZ-CE2 4.12Å; F247-P268 HydrophobicContact CD1-CG 4.34Å; F247-P268 HydrophobicContact CD2-CG 4.21Å; F247-P268 HydrophobicContact CG-CG 4.11Å; F247-F281 HydrophobicContact CB-CB 4.41Å; F247-F281 HydrophobicContact CD1-CB 4.08Å; F247-E282 CarbonylContact C-O 3.56Å; F247-E282 WeakPolarHBondContact CA-O 3.43Å; F247-P283 HydrophobicContact CD1-CB 4.21Å; F247-P283 HydrophobicContact CE1-CB 4.01Å
248	L	87.6	Confident	83.8	Confident	30 Å²	30	47.9 Å²	47.9	16%	0.157	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.8	169.2	-176	71.9	0	0	0	108.8	E250 N253 R255 F281 E282 L284	L248-E250 PolarHBondContact O-N 3.02Å; L248-N253 HydrophobicContact CD1-CB 4.49Å; L248-N253 VanDerWaalsContact CD1-O 3.29Å; L248-N253 WeakPolarHBondContact CD1-O 3.21Å; L248-R255 HydrophobicContact CD1-CG 3.66Å; L248-F281 WeakPolarHBondContact O-CA 3.45Å; L248-E282 PolarHBondContact N-O 3.36Å; L248-E282 PolarHBondContact O-N 3.09Å; L248-L284 HydrophobicContact CB-CD1 4.16Å; L248-L284 HydrophobicContact CB-CD2 4.06Å; L248-L284 HydrophobicContact CB-CG 4.04Å
249	C	85.9	Confident	83.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	122.2	170.7	178.8	0	0	0	0	110.1	S251 C252 N253 R254 F256 C271 F281	C249-S251 PolarHBondContact O-N 2.94Å; C249-C252 VanDerWaalsContact CB-SG 3.54Å; C249-C252 PolarHBondContact SG-SG 3.32Å; C249-N253 WeakPolarHBondContact O-CA 3.32Å; C249-N253 PolarHBondContact O-N 3.35Å; C249-R254 PolarHBondContact N-O 3.17Å; C249-F256 HydrophobicContact CB-CE1 4.31Å; C249-C271 VanDerWaalsContact SG-SG 3.67Å; C249-F281 HydrophobicContact CB-CD1 4.03Å; C249-F281 HydrophobicContact CB-CE1 4.02Å
250	E	84.6	Confident	82.4	Confident	56 Å²	56	45.5 Å²	45.5	26%	0.262	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-20.2	-178.7	-62.6	-168.7	118	0	0	113.8	R46 L248 L280	R46-E250 IonicContact CZ-OE1 3.12Å; R46-E250 IonicContact CZ-OE2 3.53Å; R46-E250 VanDerWaalsContact NH1-CD 3.34Å; R46-E250 IonicContact NH1-OE1 2.71Å; R46-E250 PolarHBondContact NH1-OE1 3.09Å; R46-E250 IonicContact NH1-OE2 3.57Å; R46-E250 IonicContact NH2-OE1 2.99Å; R46-E250 PolarHBondContact NH2-OE1 2.99Å; R46-E250 IonicContact NH2-OE2 2.65Å; R46-E250 PolarHBondContact NH2-OE2 3.09Å; L248-E250 PolarHBondContact O-N 3.02Å; E250-L280 HydrophobicContact CB-CB 4.47Å; E250-L280 HydrophobicContact CG-CB 4.39Å; E250-L280 PolarHBondContact N-O 3.09Å; E250-L280 WeakPolarHBondContact OE2-CB 3.33Å
251	S	84.9	Confident	81.3	Confident	79 Å²	79	42.9 Å²	42.9	55%	0.552	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-38	-177.5	-39.4	0	0	0	0	112.3	C249 G278	C249-S251 PolarHBondContact O-N 2.94Å; S251-G278 WeakPolarHBondContact OG-CA 3.03Å
252	C	85.2	Confident	80.1	Confident	50 Å²	50	47.7 Å²	47.7	34%	0.338	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-0	-176.7	66.5	0	0	0	0	114.2	C249 R254 C276	C249-C252 VanDerWaalsContact CB-SG 3.54Å; C249-C252 PolarHBondContact SG-SG 3.32Å; C252-R254 PolarHBondContact O-N 3.27Å; C252-C276 HydrophobicContact CB-CB 4.11Å; C252-C276 VanDerWaalsContact CB-SG 3.58Å
253	N	82.7	Confident	79.2	Confident	116 Å²	116	50 Å²	50	62%	0.62	25%	0.253	S	S	*	.			trans	51.7	20	-174.9	-70.4	-24.5	0	0	0	114.9	L248 C249	L248-N253 HydrophobicContact CD1-CB 4.49Å; L248-N253 VanDerWaalsContact CD1-O 3.29Å; L248-N253 WeakPolarHBondContact CD1-O 3.21Å; C249-N253 WeakPolarHBondContact O-CA 3.32Å; C249-N253 PolarHBondContact O-N 3.35Å
254	R	80.1	Confident	78.5	Confident	111 Å²	111	51.8 Å²	51.8	42%	0.419	26%	0.264	S	S	.	.			trans	-78.5	130.1	176.6	-161.3	164.6	-170	166.6	2.9	109.5	E86 C249 C252	E86-R254 IonicContact OE1-NH2 3.02Å; E86-R254 PolarHBondContact OE1-NH2 3.34Å; E86-R254 IonicContact OE2-NH2 3.34Å; E86-R254 PolarHBondContact OE2-NH2 3.46Å; C249-R254 PolarHBondContact N-O 3.17Å; C252-R254 PolarHBondContact O-N 3.27Å
255	R	81.7	Confident	78	Confident	166 Å²	166	55.9 Å²	55.9	63%	0.626	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.4	172.3	-62.8	-178.3	-179.1	161.3	-3.8	109.3	F247 L248 L284	F247-R255 WeakPolarHBondContact O-CA 3.34Å; L248-R255 HydrophobicContact CD1-CG 3.66Å; R255-L284 HydrophobicContact CG-CD1 3.91Å
256	F	82.4	Confident	77.5	Confident	18 Å²	18	57.5 Å²	57.5	8%	0.079	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.3	173	59.4	-93.3	0	0	0	109.3	V82 A246 F247 C249 I258 P268 I272 F281	V82-F256 HydrophobicContact CG1-CB 4.34Å; V82-F256 HydrophobicContact CG1-CD2 4.49Å; A246-F256 CarbonylContact C-O 3.57Å; A246-F256 WeakPolarHBondContact CA-O 3.46Å; F247-F256 HydrophobicContact CB-CD2 4.18Å; F247-F256 HydrophobicContact CB-CE1 4.18Å; F247-F256 HydrophobicContact CB-CE2 3.71Å; F247-F256 HydrophobicContact CB-CZ 3.72Å; F247-F256 HydrophobicContact CD2-CE2 4.17Å; F247-F256 HydrophobicContact CG-CE2 4.27Å; F247-F256 PolarHBondContact N-O 3.21Å; F247-F256 PolarHBondContact O-N 3.42Å; C249-F256 HydrophobicContact CB-CE1 4.31Å; F256-I258 HydrophobicContact CD2-CD1 4.33Å; F256-I258 HydrophobicContact CD2-CG1 4.18Å; F256-I258 HydrophobicContact CE2-CD1 3.78Å; F256-I258 HydrophobicContact CE2-CG1 4.13Å; F256-P268 HydrophobicContact CE2-CB 4.16Å; F256-P268 HydrophobicContact CE2-CG 3.77Å; F256-P268 HydrophobicContact CZ-CB 4.14Å; F256-P268 HydrophobicContact CZ-CG 3.69Å; F256-I272 HydrophobicContact CB-CD1 3.57Å; F256-I272 HydrophobicContact CD1-CD1 3.58Å; F256-I272 HydrophobicContact CD2-CD1 3.03Å; F256-I272 HydrophobicContact CE1-CD1 3.92Å; F256-I272 HydrophobicContact CE2-CD1 3.38Å; F256-I272 HydrophobicContact CG-CD1 3.1Å; F256-I272 HydrophobicContact CZ-CD1 3.81Å; F256-F281 AromaticContact CE1-CD1 3.85Å; F256-F281 HydrophobicContact CE1-CD1 3.85Å; F256-F281 HydrophobicContact CE1-CE1 4.04Å; F256-F281 AromaticContact CZ-CD1 3.61Å; F256-F281 HydrophobicContact CZ-CD1 3.61Å; F256-F281 AromaticContact CZ-CE1 3.87Å; F256-F281 HydrophobicContact CZ-CE1 3.87Å; F256-F281 HydrophobicContact CZ-CG 4.39Å
257	S	78.2	Confident	77.1	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	139.7	179.2	67.5	0	0	0	0	111	I83 R244 V245	I83-S257 PolarHBondContact N-O 3.3Å; I83-S257 PolarHBondContact O-OG 2.99Å; R244-S257 PolarHBondContact NH1-OG 2.89Å; V245-S257 CarbonylContact O-C 3.59Å; V245-S257 WeakPolarHBondContact O-CA 3.49Å
258	I	76.7	Confident	76.9	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.9	174.2	-67.9	168.6	0	0	0	107.5	L80 Y81 V82 R244 V245 F247 F256 L260 P268	L80-I258 HydrophobicContact CD2-CD1 4.15Å; L80-I258 HydrophobicContact CD2-CG2 4.04Å; Y81-I258 WeakPolarHBondContact O-CA 3.36Å; V82-I258 HydrophobicContact CG2-CG1 4.22Å; R244-I258 WeakPolarHBondContact CA-O 3.29Å; V245-I258 PolarHBondContact N-O 3.39Å; V245-I258 PolarHBondContact O-N 3.35Å; F247-I258 HydrophobicContact CD2-CB 4.39Å; F247-I258 HydrophobicContact CD2-CD1 3.78Å; F247-I258 HydrophobicContact CD2-CG1 4.21Å; F247-I258 HydrophobicContact CE2-CB 4.17Å; F247-I258 HydrophobicContact CE2-CD1 3.79Å; F247-I258 HydrophobicContact CE2-CG1 4.33Å; F256-I258 HydrophobicContact CD2-CD1 4.33Å; F256-I258 HydrophobicContact CD2-CG1 4.18Å; F256-I258 HydrophobicContact CE2-CD1 3.78Å; F256-I258 HydrophobicContact CE2-CG1 4.13Å; I258-L260 HydrophobicContact CG2-CD2 4.47Å; I258-P268 HydrophobicContact CD1-CB 3.83Å; I258-P268 HydrophobicContact CD1-CG 3.77Å
259	L	75.6	Confident	76.6	Confident	42 Å²	42	64.4 Å²	64.4	22%	0.22	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	126.6	169.2	-171.8	73	0	0	0	108.6	Y81 I83 P104 R244 T261	Y81-L259 PolarHBondContact O-N 3.08Å; I83-L259 HydrophobicContact CD1-CB 3.92Å; P104-L259 HydrophobicContact CB-CD2 3.68Å; P104-L259 HydrophobicContact CG-CD2 3.46Å; P104-L259 VanDerWaalsContact CG-CD2 3.46Å; R244-L259 HydrophobicContact CB-CD1 4.43Å; L259-T261 HydrophobicContact CD2-CG2 4.45Å; L259-T261 PolarHBondContact O-N 2.81Å
260	L	73.2	Confident	76.4	Confident	23 Å²	23	74 Å²	74	12%	0.12	37%	0.373	C	S	.	.			trans	-84.3	101.3	177	-60.5	178.9	0	0	0	108.7	C242 T243 V245 I258 Y265	C242-L260 HydrophobicContact CB-CD1 4.05Å; T243-L260 PolarHBondContact O-N 3.47Å; V245-L260 HydrophobicContact CG2-CD1 3.69Å; V245-L260 HydrophobicContact CG2-CG 4.22Å; I258-L260 HydrophobicContact CG2-CD2 4.47Å; L260-Y265 HydrophobicContact CD1-CD2 4.45Å
261	T	64.1	Low	76.2	Confident	40 Å²	40	72 Å²	72	25%	0.245	37%	0.365	C	S	.	.	S	Bend	trans	-85.2	136	167.9	53.3	0	0	0	0	109	L259	L259-T261 HydrophobicContact CD2-CG2 4.45Å; L259-T261 PolarHBondContact O-N 2.81Å
262	D	60.6	Low	75.9	Confident	143 Å²	143	71.4 Å²	71.4	77%	0.765	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	23.5	178.9	-50.9	-36.4	0	0	0	117.2	V264	D262-V264 PolarHBondContact O-N 3.22Å
263	D	63.8	Low	75.3	Confident	89 Å²	89	70 Å²	70	48%	0.476	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	15.2	171.1	-54.9	-31.6	0	0	0	115.4	K241	K241-D263 WeakPolarHBondContact CE-OD1 3.43Å; K241-D263 IonicContact NZ-OD1 3.36Å; K241-D263 PolarHBondContact NZ-OD1 2.99Å; K241-D263 IonicContact NZ-OD2 2.79Å; K241-D263 PolarHBondContact NZ-OD2 2.9Å
264	V	67.6	Low	74.8	Confident	82 Å²	82	74.6 Å²	74.6	50%	0.497	36%	0.36	S	S	.	.			trans	-95.6	124.8	174.3	-177.1	0	0	0	0	108.4	D262 I266	D262-V264 PolarHBondContact O-N 3.22Å; V264-I266 HydrophobicContact CB-CG1 4.31Å; V264-I266 HydrophobicContact CG1-CG1 3.97Å; V264-I266 PolarHBondContact O-N 3.04Å
265	Y	70.8	Confident	74.8	Confident	122 Å²	122	76.8 Å²	76.8	48%	0.478	38%	0.38	S	S	.	.			trans	-70.4	113.3	169.8	178.6	-101.3	0	0	0	109.4	V245 F247 L260 T267	V245-Y265 HydrophobicContact CG1-CE2 4.34Å; V245-Y265 HydrophobicContact CG2-CE2 4.34Å; F247-Y265 HydrophobicContact CZ-CE2 4.12Å; L260-Y265 HydrophobicContact CD1-CD2 4.45Å; Y265-T267 HydrophobicContact CD1-CG2 4.31Å; Y265-T267 HydrophobicContact CE1-CG2 3.42Å; Y265-T267 VanDerWaalsContact CE1-CG2 3.42Å
266	I	72.8	Confident	74.7	Confident	35 Å²	35	69.8 Å²	69.8	18%	0.179	36%	0.356	C	S	.	.			trans	-115.6	120.6	178.6	-49.7	172.6	0	0	0	108.9	P78 L80 V264	P78-I266 HydrophobicContact CB-CD1 3.95Å; P78-I266 HydrophobicContact CG-CD1 4.06Å; L80-I266 HydrophobicContact CD1-CG2 4.22Å; L80-I266 HydrophobicContact CD2-CB 3.72Å; L80-I266 HydrophobicContact CD2-CD1 4.49Å; L80-I266 HydrophobicContact CD2-CG2 3.42Å; L80-I266 VanDerWaalsContact CD2-CG2 3.42Å; L80-I266 HydrophobicContact CG-CG2 3.97Å; V264-I266 HydrophobicContact CB-CG1 4.31Å; V264-I266 HydrophobicContact CG1-CG1 3.97Å; V264-I266 PolarHBondContact O-N 3.04Å
267	T	76.3	Confident	74.5	Confident	82 Å²	82	72.7 Å²	72.7	50%	0.503	39%	0.391	S	S	.	.			trans	-82	134.5	169.6	51.8	0	0	0	0	110.3	Y265 S269	Y265-T267 HydrophobicContact CD1-CG2 4.31Å; Y265-T267 HydrophobicContact CE1-CG2 3.42Å; Y265-T267 VanDerWaalsContact CE1-CG2 3.42Å; T267-S269 PolarHBondContact O-N 3.47Å
268	P	79.5	Confident	74.5	Confident	9 Å²	9	72.8 Å²	72.8	6%	0.058	39%	0.393	C	S	.	.			trans	-59.5	139.2	174.2	21.6	-28.6	0	0	0	111.3	L80 F247 F256 I258 F281	L80-P268 HydrophobicContact CD1-CB 4.46Å; F247-P268 HydrophobicContact CD1-CG 4.34Å; F247-P268 HydrophobicContact CD2-CG 4.21Å; F247-P268 HydrophobicContact CG-CG 4.11Å; F256-P268 HydrophobicContact CE2-CB 4.16Å; F256-P268 HydrophobicContact CE2-CG 3.77Å; F256-P268 HydrophobicContact CZ-CB 4.14Å; F256-P268 HydrophobicContact CZ-CG 3.69Å; I258-P268 HydrophobicContact CD1-CB 3.83Å; I258-P268 HydrophobicContact CD1-CG 3.77Å; P268-F281 HydrophobicContact CB-CD2 4.13Å; P268-F281 HydrophobicContact CB-CE2 4.1Å; P268-F281 HydrophobicContact CB-CG 4.45Å; P268-F281 HydrophobicContact CB-CZ 4.42Å; P268-F281 HydrophobicContact CG-CB 4.07Å; P268-F281 HydrophobicContact CG-CD1 4.08Å; P268-F281 HydrophobicContact CG-CD2 3.65Å; P268-F281 HydrophobicContact CG-CE2 4.12Å; P268-F281 HydrophobicContact CG-CG 3.64Å; P268-F281 WeakPolarHBondContact O-CD2 3.34Å; P268-F281 WeakPolarHBondContact O-CE2 3.26Å
269	S	81.5	Confident	74.8	Confident	86 Å²	86	77.2 Å²	77.2	60%	0.601	42%	0.42	S	S	*	.	S	Bend	trans	-90.2	-22.7	177.9	56.1	0	0	0	0	113.1	T267	T267-S269 PolarHBondContact O-N 3.47Å
270	R	82.2	Confident	75.1	Confident	201 Å²	201	80 Å²	80	76%	0.758	43%	0.434	S	S	*	.	S	Bend	trans	-145	151.9	-179.3	-65.7	-175.2	-176.7	173.1	1.1	110.2
271	C	80.7	Confident	75.5	Confident	15 Å²	15	80.5 Å²	80.5	10%	0.101	44%	0.436	C	S	.	.			trans	-69.3	149	178.6	-170.4	0	0	0	0	110.3	C249 S273 C276 G278 F281	C249-C271 VanDerWaalsContact SG-SG 3.67Å; C271-S273 VanDerWaalsContact C-N 3.34Å; C271-C276 HydrophobicContact CB-CB 4Å; C271-G278 PolarHBondContact N-O 3.17Å; C271-G278 VanDerWaalsContact N-O 3.07Å; C271-F281 HydrophobicContact CB-CE1 4.01Å; C271-F281 HydrophobicContact CB-CZ 4.26Å; C271-F281 VanDerWaalsContact N-CZ 3.35Å
272	I	77.7	Confident	76.4	Confident	66 Å²	66	83.6 Å²	83.6	34%	0.338	45%	0.447	S	S	.	.	S	Bend	trans	-72.1	-29.7	177.2	-73.5	131.4	0	0	0	112.8	V82 F256 K274	V82-I272 HydrophobicContact CB-CD1 3.87Å; V82-I272 HydrophobicContact CB-CG1 3.96Å; V82-I272 HydrophobicContact CG1-CB 4.44Å; V82-I272 HydrophobicContact CG1-CD1 3.13Å; V82-I272 HydrophobicContact CG1-CG1 3.54Å; V82-I272 HydrophobicContact CG1-CG2 4.22Å; V82-I272 HydrophobicContact CG2-CD1 3.48Å; V82-I272 VanDerWaalsContact CG2-CD1 3.48Å; V82-I272 HydrophobicContact CG2-CG1 3.53Å; F256-I272 HydrophobicContact CB-CD1 3.57Å; F256-I272 HydrophobicContact CD1-CD1 3.58Å; F256-I272 HydrophobicContact CD2-CD1 3.03Å; F256-I272 HydrophobicContact CE1-CD1 3.92Å; F256-I272 HydrophobicContact CE2-CD1 3.38Å; F256-I272 HydrophobicContact CG-CD1 3.1Å; F256-I272 HydrophobicContact CZ-CD1 3.81Å; I272-K274 PolarHBondContact O-N 3.48Å
273	S	73.3	Confident	77.4	Confident	21 Å²	21	78.9 Å²	78.9	15%	0.147	42%	0.424	C	S	.	.	S	Bend	trans	-67.3	119.9	177.3	-148.7	0	0	0	0	108.3	C271 D275 C276	C271-S273 VanDerWaalsContact C-N 3.34Å; S273-D275 PolarHBondContact O-N 3.5Å; S273-D275 VanDerWaalsContact O-N 3.08Å; S273-C276 PolarHBondContact O-N 2.96Å
274	K	72.7	Confident	78.3	Confident	212 Å²	212	75.6 Å²	75.6	92%	0.922	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.7	178.7	-66.1	-176.9	179.9	179.2	0	112.3	I272 C276	I272-K274 PolarHBondContact O-N 3.48Å; K274-C276 VanDerWaalsContact C-N 3.34Å
275	D	79.2	Confident	78.7	Confident	156 Å²	156	77.5 Å²	77.5	83%	0.834	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.8	-179.6	-43.6	-52.3	0	0	0	113.6	S273	S273-D275 PolarHBondContact O-N 3.5Å; S273-D275 VanDerWaalsContact O-N 3.08Å
276	C	78.9	Confident	78.8	Confident	20 Å²	20	78.8 Å²	78.8	14%	0.135	42%	0.424	C	S	.	.			trans	-117.4	115.3	-175.7	-175.1	0	0	0	0	111.5	C252 C271 S273 K274 G278	C252-C276 HydrophobicContact CB-CB 4.11Å; C252-C276 VanDerWaalsContact CB-SG 3.58Å; C271-C276 HydrophobicContact CB-CB 4Å; S273-C276 PolarHBondContact O-N 2.96Å; K274-C276 VanDerWaalsContact C-N 3.34Å; C276-G278 PolarHBondContact O-N 3.42Å; C276-G278 PolarHBondContact SG-N 3.1Å
277	G	78.8	Confident	78.3	Confident	78 Å²	78	84.1 Å²	84.1	80%	0.804	46%	0.458	S	S	*	.			trans	-82.8	16	173.5	0	0	0	0	0	114.8
278	G	79	Confident	77.7	Confident	5 Å²	5	87.8 Å²	87.8	5%	0.052	48%	0.475	C	S	.	.			trans	-63.2	137.3	-176.4	0	0	0	0	0	112.9	S251 C271 C276 F281	S251-G278 WeakPolarHBondContact OG-CA 3.03Å; C271-G278 PolarHBondContact N-O 3.17Å; C271-G278 VanDerWaalsContact N-O 3.07Å; C276-G278 PolarHBondContact O-N 3.42Å; C276-G278 PolarHBondContact SG-N 3.1Å; G278-F281 VanDerWaalsContact O-CZ 3.24Å; G278-F281 WeakPolarHBondContact O-CZ 3.44Å
279	T	82.9	Confident	77.1	Confident	95 Å²	95	88.6 Å²	88.6	58%	0.583	48%	0.479	S	S	*	.			trans	-119.3	-5.3	179.1	55.1	0	0	0	0	113.4	F281	T279-F281 VanDerWaalsContact C-CE2 3.4Å; T279-F281 WeakPolarHBondContact O-CE2 3.38Å
280	L	80.8	Confident	76.7	Confident	100 Å²	100	86.7 Å²	86.7	52%	0.524	46%	0.464	S	S	.	.			trans	-105.4	126.4	178.8	-69.3	162.4	0	0	0	109.8	E250	E250-L280 HydrophobicContact CB-CB 4.47Å; E250-L280 HydrophobicContact CG-CB 4.39Å; E250-L280 PolarHBondContact N-O 3.09Å; E250-L280 WeakPolarHBondContact OE2-CB 3.33Å
281	F	83.1	Confident	76.5	Confident	33 Å²	33	78.4 Å²	78.4	15%	0.145	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131	-176.7	-50.9	-80.4	0	0	0	109.8	F247 L248 C249 F256 P268 C271 G278 T279	F247-F281 HydrophobicContact CB-CB 4.41Å; F247-F281 HydrophobicContact CD1-CB 4.08Å; L248-F281 WeakPolarHBondContact O-CA 3.45Å; C249-F281 HydrophobicContact CB-CD1 4.03Å; C249-F281 HydrophobicContact CB-CE1 4.02Å; F256-F281 AromaticContact CE1-CD1 3.85Å; F256-F281 HydrophobicContact CE1-CD1 3.85Å; F256-F281 HydrophobicContact CE1-CE1 4.04Å; F256-F281 AromaticContact CZ-CD1 3.61Å; F256-F281 HydrophobicContact CZ-CD1 3.61Å; F256-F281 AromaticContact CZ-CE1 3.87Å; F256-F281 HydrophobicContact CZ-CE1 3.87Å; F256-F281 HydrophobicContact CZ-CG 4.39Å; P268-F281 HydrophobicContact CB-CD2 4.13Å; P268-F281 HydrophobicContact CB-CE2 4.1Å; P268-F281 HydrophobicContact CB-CG 4.45Å; P268-F281 HydrophobicContact CB-CZ 4.42Å; P268-F281 HydrophobicContact CG-CB 4.07Å; P268-F281 HydrophobicContact CG-CD1 4.08Å; P268-F281 HydrophobicContact CG-CD2 3.65Å; P268-F281 HydrophobicContact CG-CE2 4.12Å; P268-F281 HydrophobicContact CG-CG 3.64Å; P268-F281 WeakPolarHBondContact O-CD2 3.34Å; P268-F281 WeakPolarHBondContact O-CE2 3.26Å; C271-F281 HydrophobicContact CB-CE1 4.01Å; C271-F281 HydrophobicContact CB-CZ 4.26Å; C271-F281 VanDerWaalsContact N-CZ 3.35Å; G278-F281 VanDerWaalsContact O-CZ 3.24Å; G278-F281 WeakPolarHBondContact O-CZ 3.44Å; T279-F281 VanDerWaalsContact C-CE2 3.4Å; T279-F281 WeakPolarHBondContact O-CE2 3.38Å
282	E	82.8	Confident	76.4	Confident	105 Å²	105	82.3 Å²	82.3	49%	0.491	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.2	174.5	-174.5	170.7	-164	0	0	108.9	F247 L248 L284	F247-E282 CarbonylContact C-O 3.56Å; F247-E282 WeakPolarHBondContact CA-O 3.43Å; L248-E282 PolarHBondContact N-O 3.36Å; L248-E282 PolarHBondContact O-N 3.09Å; E282-L284 PolarHBondContact O-N 3.21Å
283	P	82	Confident	76.8	Confident	44 Å²	44	83 Å²	83	29%	0.286	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	126.4	173.3	29.4	-32	0	0	0	109.6	V245 F247 L285	V245-P283 HydrophobicContact CG1-CB 4.33Å; F247-P283 HydrophobicContact CD1-CB 4.21Å; F247-P283 HydrophobicContact CE1-CB 4.01Å; P283-L285 HydrophobicContact CB-CG 4.36Å; P283-L285 PolarHBondContact O-N 3.28Å
284	L	81.9	Confident	77.4	Confident	21 Å²	21	83.6 Å²	83.6	11%	0.11	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	108.5	177	-69.8	178.9	0	0	0	108.6	A246 L248 R255 E282 D289 T291	A246-L284 HydrophobicContact CB-CB 3.99Å; A246-L284 HydrophobicContact CB-CD1 4.32Å; A246-L284 PolarHBondContact O-N 3.36Å; L248-L284 HydrophobicContact CB-CD1 4.16Å; L248-L284 HydrophobicContact CB-CD2 4.06Å; L248-L284 HydrophobicContact CB-CG 4.04Å; R255-L284 HydrophobicContact CG-CD1 3.91Å; E282-L284 PolarHBondContact O-N 3.21Å; L284-D289 HydrophobicContact CB-CB 3.82Å; L284-D289 WeakPolarHBondContact CB-OD2 3.43Å; L284-T291 WeakPolarHBondContact O-CB 3.44Å; L284-T291 PolarHBondContact O-OG1 2.87Å
285	L	76.2	Confident	78.3	Confident	121 Å²	121	77.4 Å²	77.4	63%	0.634	44%	0.44	S	S	*	.			trans	-116.6	9.9	-172.5	-61.7	174.4	0	0	0	112.8	P283 T291	P283-L285 HydrophobicContact CB-CG 4.36Å; P283-L285 PolarHBondContact O-N 3.28Å; L285-T291 HydrophobicContact CD2-CG2 4.33Å
286	E	72.5	Confident	78.9	Confident	150 Å²	150	71.3 Å²	71.3	70%	0.701	41%	0.405	S	S	*	.	S	Bend	trans	-83.5	157.4	-179.6	-56.4	-171.8	168.1	0	0	111.3	N288 D289	E286-N288 PolarHBondContact O-N 2.72Å; E286-D289 WeakPolarHBondContact CB-OD2 3.45Å; E286-D289 PolarHBondContact N-OD2 3.21Å; E286-D289 WeakPolarHBondContact O-CB 3.32Å; E286-D289 PolarHBondContact O-N 2.84Å
287	T	62.4	Low	79.6	Confident	146 Å²	146	71.1 Å²	71.1	90%	0.896	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.3	-171	-20.5	0	0	0	0	114.9
288	N	64.9	Low	80.2	Confident	160 Å²	160	69.9 Å²	69.9	86%	0.856	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-3.5	-179.1	-65.2	-29.4	0	0	0	113	E286	E286-N288 PolarHBondContact O-N 2.72Å
289	D	66.5	Low	80.9	Confident	26 Å²	26	69.7 Å²	69.7	14%	0.139	37%	0.374	C	S	.	.	S	Bend	trans	-82.4	153.9	-179.9	-66.8	-44.6	0	0	0	110.7	L284 E286 T291	L284-D289 HydrophobicContact CB-CB 3.82Å; L284-D289 WeakPolarHBondContact CB-OD2 3.43Å; E286-D289 WeakPolarHBondContact CB-OD2 3.45Å; E286-D289 PolarHBondContact N-OD2 3.21Å; E286-D289 WeakPolarHBondContact O-CB 3.32Å; E286-D289 PolarHBondContact O-N 2.84Å; D289-T291 PolarHBondContact O-N 3.31Å
290	P	71.6	Confident	81.4	Confident	46 Å²	46	68.9 Å²	68.9	30%	0.299	36%	0.36	S	S	.	.	S	Bend	trans	-74.9	32.9	-179	28.1	-29	0	0	0	113.2	R244 A246	R244-P290 PolarHBondContact NE-O 2.92Å; R244-P290 PolarHBondContact NH2-O 3.47Å; A246-P290 HydrophobicContact CB-CB 4.49Å; A246-P290 HydrophobicContact CB-CG 3.65Å
291	T	78.3	Confident	82	Confident	27 Å²	27	64.1 Å²	64.1	17%	0.166	34%	0.335	C	S	.	.			trans	-90.5	120	174.3	-68.1	0	0	0	0	108.7	R244 A246 L284 L285 D289	R244-T291 CarbonylContact O-C 3.55Å; R244-T291 VanDerWaalsContact O-CA 3.32Å; R244-T291 WeakPolarHBondContact O-CA 3.48Å; R244-T291 WeakPolarHBondContact O-CG2 3.31Å; A246-T291 WeakPolarHBondContact CB-OG1 3.43Å; A246-T291 PolarHBondContact N-OG1 3Å; L284-T291 WeakPolarHBondContact O-CB 3.44Å; L284-T291 PolarHBondContact O-OG1 2.87Å; L285-T291 HydrophobicContact CD2-CG2 4.33Å; D289-T291 PolarHBondContact O-N 3.31Å
292	E	80	Confident	82.3	Confident	97 Å²	97	64.8 Å²	64.8	45%	0.453	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.6	-178.5	-70.8	168.7	-148.7	0	0	109.9	T243 R244	T243-E292 PolarHBondContact N-O 3.19Å; T243-E292 PolarHBondContact OG1-O 3.39Å; R244-E292 HydrophobicContact CB-CB 4.15Å; R244-E292 IonicContact CZ-OE1 3.1Å; R244-E292 PolarHBondContact N-O 2.87Å; R244-E292 IonicContact NE-OE1 3.41Å; R244-E292 PolarHBondContact NE-OE1 3.13Å; R244-E292 VanDerWaalsContact NE-OE1 3.1Å; R244-E292 IonicContact NH2-OE1 3.47Å; R244-E292 PolarHBondContact NH2-OE1 2.84Å; R244-E292 PolarHBondContact O-N 3.49Å
293	T	84.9	Confident	82.5	Confident	81 Å²	81	60.4 Å²	60.4	50%	0.497	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	148.6	175.7	56.7	0	0	0	0	110.4	P240 K241	P240-T293 HydrophobicContact CB-CG2 4.41Å; K241-T293 CarbonylContact O-C 3.48Å; K241-T293 VanDerWaalsContact O-CA 3.29Å; K241-T293 WeakPolarHBondContact O-CA 3.37Å
294	V	87.2	Confident	82.3	Confident	33 Å²	33	59.4 Å²	59.4	20%	0.2	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146	171.9	-63.3	0	0	0	0	108.9	K241 T243 W296 V327	K241-V294 HydrophobicContact CB-CG2 4.03Å; K241-V294 HydrophobicContact CD-CG2 4.46Å; K241-V294 HydrophobicContact CG-CG2 4.37Å; K241-V294 PolarHBondContact N-O 3.22Å; K241-V294 PolarHBondContact O-N 2.93Å; T243-V294 HydrophobicContact CG2-CB 4.43Å; T243-V294 HydrophobicContact CG2-CG1 3.86Å; T243-V294 HydrophobicContact CG2-CG2 3.72Å; V294-W296 PolarHBondContact O-N 3.46Å; V294-V327 HydrophobicContact CB-CG1 4.16Å; V294-V327 HydrophobicContact CG2-CG1 3.67Å
295	D	91.4	Very high	81.7	Confident	82 Å²	82	61.6 Å²	61.6	44%	0.439	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135	175.6	-72.7	-18.9	0	0	0	110	V327 D328 V331	D295-V327 CarbonylContact O-C 3.58Å; D295-V327 WeakPolarHBondContact O-CA 3.46Å; D295-D328 PolarHBondContact O-N 2.9Å; D295-V331 HydrophobicContact CB-CB 4.46Å; D295-V331 HydrophobicContact CB-CG2 4.09Å
296	W	91.6	Very high	81.1	Confident	28 Å²	28	57 Å²	57	11%	0.106	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140	-179.8	173	92.7	0	0	0	109.7	C238 R239 K241 V294 Q298 E325 L326	C238-W296 WeakPolarHBondContact CA-O 3.44Å; R239-W296 HydrophobicContact CB-CE3 4.03Å; R239-W296 HydrophobicContact CG-CE3 4.34Å; R239-W296 HydrophobicContact CG-CZ3 4.4Å; R239-W296 PolarHBondContact N-O 2.93Å; R239-W296 WeakPolarHBondContact O-CA 3.46Å; R239-W296 WeakPolarHBondContact O-CB 3.49Å; R239-W296 PolarHBondContact O-N 3.39Å; K241-W296 HydrophobicContact CB-CB 3.69Å; K241-W296 HydrophobicContact CB-CG 4.38Å; K241-W296 HydrophobicContact CD-CB 4.23Å; K241-W296 HydrophobicContact CD-CG 4.24Å; V294-W296 PolarHBondContact O-N 3.46Å; W296-Q298 HydrophobicContact CH2-CB 3.61Å; W296-Q298 HydrophobicContact CH2-CG 4.46Å; W296-Q298 HydrophobicContact CZ2-CB 3.91Å; W296-Q298 HydrophobicContact CZ3-CB 4.22Å; W296-E325 HydrophobicContact CZ2-CG 4.22Å; W296-E325 PolarHBondContact NE1-OE2 3.46Å; W296-E325 VanDerWaalsContact NE1-OE2 3.14Å; W296-L326 WeakPolarHBondContact CA-O 3.44Å
297	Q	92.1	Very high	80.1	Confident	15 Å²	15	52.5 Å²	52.5	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	137.1	177.7	-172.7	175.8	33.9	0	0	110.6	G236 L326 V331	G236-Q297 WeakPolarHBondContact O-CG 3.23Å; G236-Q297 PolarHBondContact O-NE2 3.22Å; Q297-L326 HydrophobicContact CB-CB 4.35Å; Q297-L326 PolarHBondContact N-O 3.02Å; Q297-L326 PolarHBondContact O-N 3.3Å; Q297-V331 HydrophobicContact CB-CB 4.41Å; Q297-V331 HydrophobicContact CB-CG1 3.91Å; Q297-V331 HydrophobicContact CB-CG2 3.94Å
298	Q	91.9	Very high	79.5	Confident	52 Å²	52	52.2 Å²	52.2	24%	0.243	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	132.2	174.9	-169.5	174.5	-3.5	0	0	110.8	G236 W296 D323	G236-Q298 PolarHBondContact N-O 3.39Å; W296-Q298 HydrophobicContact CH2-CB 3.61Å; W296-Q298 HydrophobicContact CH2-CG 4.46Å; W296-Q298 HydrophobicContact CZ2-CB 3.91Å; W296-Q298 HydrophobicContact CZ3-CB 4.22Å; Q298-D323 PolarHBondContact NE2-OD2 3.36Å
299	L	93.4	Very high	78.8	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147	171.7	-61	-179.9	0	0	0	110	V232 R234 I235 D323 C324 L326 C334	V232-L299 HydrophobicContact CG1-CD2 4.18Å; R234-L299 WeakPolarHBondContact O-CA 3.24Å; I235-L299 HydrophobicContact CB-CD2 4.22Å; I235-L299 HydrophobicContact CD1-CD2 4.26Å; I235-L299 HydrophobicContact CG1-CD2 3.74Å; I235-L299 HydrophobicContact CG2-CD2 4.07Å; L299-D323 CarbonylContact O-C 3.55Å; L299-D323 WeakPolarHBondContact O-CA 3.45Å; L299-C324 HydrophobicContact CB-CB 4.26Å; L299-C324 PolarHBondContact N-O 3.38Å; L299-C324 PolarHBondContact O-N 3.35Å; L299-L326 HydrophobicContact CD1-CD1 3.33Å; L299-L326 HydrophobicContact CD1-CD2 3.94Å; L299-L326 HydrophobicContact CD1-CG 3.69Å; L299-L326 HydrophobicContact CD2-CD1 4.19Å; L299-L326 HydrophobicContact CG-CD1 3.68Å; L299-L326 HydrophobicContact CG-CG 3.97Å; L299-C334 VanDerWaalsContact CD1-SG 3.53Å
300	R	93.3	Very high	78	Confident	77 Å²	77	49.3 Å²	49.3	29%	0.291	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.1	165.1	-173.7	163.2	-75.2	169.6	-1	109.4	V233 R234 T321 D323	V233-R300 PolarHBondContact N-O 3.36Å; R234-R300 HydrophobicContact CB-CB 3.76Å; R234-R300 PolarHBondContact N-O 3.48Å; R234-R300 PolarHBondContact O-N 3.07Å; R300-T321 HydrophobicContact CG-CG2 4.38Å; R300-D323 IonicContact CZ-OD1 3.96Å; R300-D323 IonicContact CZ-OD2 3.94Å; R300-D323 IonicContact NE-OD1 3.42Å; R300-D323 PolarHBondContact NE-OD1 3.45Å; R300-D323 IonicContact NH2-OD1 2.78Å; R300-D323 PolarHBondContact NH2-OD1 3.22Å; R300-D323 IonicContact NH2-OD2 2.73Å; R300-D323 PolarHBondContact NH2-OD2 2.76Å
301	V	93.6	Very high	76.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.2	-177.2	179.1	0	0	0	0	109.1	I214 F228 V231 V232 T321 I322 V340 I342	I214-V301 HydrophobicContact CD1-CG1 4.29Å; F228-V301 HydrophobicContact CE2-CB 4.32Å; F228-V301 HydrophobicContact CE2-CG1 3.9Å; V231-V301 CarbonylContact O-C 3.56Å; V231-V301 WeakPolarHBondContact O-CA 3.46Å; V232-V301 HydrophobicContact CG2-CG2 4.34Å; V301-T321 CarbonylContact O-C 3.54Å; V301-T321 VanDerWaalsContact O-CA 3.26Å; V301-T321 WeakPolarHBondContact O-CA 3.29Å; V301-I322 HydrophobicContact CB-CG2 4.43Å; V301-I322 PolarHBondContact N-O 3.36Å; V301-I322 PolarHBondContact O-N 3Å; V301-V340 HydrophobicContact CG1-CG2 4.47Å; V301-V340 HydrophobicContact CG2-CG2 4.42Å; V301-I342 HydrophobicContact CB-CD1 4.35Å; V301-I342 HydrophobicContact CG1-CD1 4.42Å; V301-I342 HydrophobicContact CG2-CD1 3.42Å; V301-I342 VanDerWaalsContact CG2-CD1 3.42Å
302	Q	90.8	Very high	75	Confident	47 Å²	47	56.9 Å²	56.9	22%	0.22	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	144.5	178.6	-175.1	176.7	18.1	0	0	110.8	G230 V231 V233 L319 T321	G230-Q302 CarbonylContact C-O 3.53Å; G230-Q302 WeakPolarHBondContact CA-O 3.32Å; V231-Q302 PolarHBondContact N-O 3.04Å; V231-Q302 PolarHBondContact O-N 2.65Å; V233-Q302 HydrophobicContact CG2-CB 3.42Å; V233-Q302 VanDerWaalsContact CG2-CB 3.42Å; V233-Q302 HydrophobicContact CG2-CG 4.41Å; Q302-L319 HydrophobicContact CG-CB 4.07Å; Q302-L319 VanDerWaalsContact NE2-CB 3.32Å; Q302-T321 HydrophobicContact CB-CG2 4.02Å; Q302-T321 HydrophobicContact CG-CG2 4.12Å
303	E	87.3	Confident	73	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.6	175	-171.2	166.3	-129.2	0	0	111.5	K213 I214 R215 K320	K213-E303 WeakPolarHBondContact CB-OE1 3.3Å; I214-E303 HydrophobicContact CB-CB 4.1Å; I214-E303 HydrophobicContact CB-CG 4.35Å; I214-E303 HydrophobicContact CD1-CB 4.06Å; I214-E303 HydrophobicContact CG1-CB 4.31Å; I214-E303 PolarHBondContact N-OE1 3.18Å; I214-E303 VanDerWaalsContact N-OE1 3.08Å; R215-E303 PolarHBondContact N-OE1 2.71Å; R215-E303 IonicContact NH2-OE2 3.54Å; R215-E303 PolarHBondContact NH2-OE2 3.17Å; E303-K320 PolarHBondContact N-O 3.13Å
304	L	77	Confident	70.9	Confident	24 Å²	24	60.6 Å²	60.6	13%	0.126	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-84.2	133.5	171.4	-147.4	87.1	0	0	0	109.8	V231 T306 V380 L384	V231-L304 HydrophobicContact CG2-CD1 3.34Å; L304-T306 PolarHBondContact O-N 3.14Å; L304-V380 HydrophobicContact CD2-CG1 4.2Å; L304-L384 HydrophobicContact CB-CD2 4.07Å; L304-L384 HydrophobicContact CD2-CD1 3.5Å; L304-L384 HydrophobicContact CD2-CD2 3.61Å; L304-L384 HydrophobicContact CD2-CG 4.09Å; L304-L384 HydrophobicContact CG-CD2 4.45Å
305	V	69.3	Low	69	Low	66 Å²	66	68.3 Å²	68.3	40%	0.4	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68.8	120	179	-177.1	0	0	0	0	109.5	L319	V305-L319 HydrophobicContact CG2-CD1 3.91Å; V305-L319 HydrophobicContact CG2-CD2 3.6Å; V305-L319 HydrophobicContact CG2-CG 4.28Å
306	T	62.6	Low	67.1	Low	24 Å²	24	71.7 Å²	71.7	15%	0.147	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-102.7	150.1	167.7	40.9	0	0	0	0	112.1	L304 Q308 D309 L384	L304-T306 PolarHBondContact O-N 3.14Å; T306-Q308 PolarHBondContact O-N 3.33Å; T306-D309 PolarHBondContact N-OD2 3.12Å; T306-D309 WeakPolarHBondContact O-CB 3.37Å; T306-D309 PolarHBondContact O-N 2.95Å; T306-D309 PolarHBondContact OG1-OD2 3.3Å; T306-L384 HydrophobicContact CG2-CB 4.37Å; T306-L384 HydrophobicContact CG2-CD2 3.58Å
307	E	51.7	Low	65.5	Low	57 Å²	57	73.3 Å²	73.3	27%	0.266	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-53	-36.3	-179	-113.8	170.6	-140.4	0	0	114	D309 R310 P670 R673	E307-D309 PolarHBondContact O-N 3.41Å; E307-D309 VanDerWaalsContact O-N 3.13Å; E307-R310 PolarHBondContact O-N 3.06Å; E307-R310 VanDerWaalsContact O-N 3.08Å; E307-P670 WeakPolarHBondContact OE2-CD 3.35Å; E307-P670 WeakPolarHBondContact OE2-CG 2.9Å; E307-R673 VanDerWaalsContact CG-NH2 3.31Å; E307-R673 IonicContact OE1-CZ 3.87Å; E307-R673 IonicContact OE1-NH1 3.13Å; E307-R673 IonicContact OE1-NH2 3.89Å; E307-R673 PolarHBondContact OE1-NH2 3.29Å; E307-R673 IonicContact OE2-NH1 3.41Å; E307-R673 IonicContact OE2-NH2 2.73Å
308	Q	49.5	Very low	64.3	Low	139 Å²	139	76.6 Å²	76.6	65%	0.65	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-60.1	-24.6	178.9	-68.4	-179.7	-11.4	0	0	113.1	T306 R310 S311	T306-Q308 PolarHBondContact O-N 3.33Å; Q308-R310 VanDerWaalsContact C-N 3.32Å; Q308-S311 PolarHBondContact O-OG 3.33Å
309	D	50.7	Low	63.5	Low	26 Å²	26	77.1 Å²	77.1	14%	0.139	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-80.1	-17.6	-178.5	-56.8	-50.5	0	0	0	112.4	K213 T306 E307 L317	K213-D309 IonicContact NZ-OD1 3.46Å; K213-D309 PolarHBondContact NZ-OD1 3.28Å; K213-D309 IonicContact NZ-OD2 3.53Å; K213-D309 PolarHBondContact NZ-OD2 3.28Å; T306-D309 PolarHBondContact N-OD2 3.12Å; T306-D309 WeakPolarHBondContact O-CB 3.37Å; T306-D309 PolarHBondContact O-N 2.95Å; T306-D309 PolarHBondContact OG1-OD2 3.3Å; E307-D309 PolarHBondContact O-N 3.41Å; E307-D309 VanDerWaalsContact O-N 3.13Å; D309-L317 HydrophobicContact CB-CD2 3.85Å
310	R	49.5	Very low	63.2	Low	99 Å²	99	81.7 Å²	81.7	37%	0.374	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-26.1	-179.5	-65.6	-168.3	-178	177.5	12.1	113.6	E307 Q308 H312 D482	E307-R310 PolarHBondContact O-N 3.06Å; E307-R310 VanDerWaalsContact O-N 3.08Å; Q308-R310 VanDerWaalsContact C-N 3.32Å; R310-H312 PolarHBondContact O-N 2.65Å; R310-D482 IonicContact CZ-OD1 3.7Å; R310-D482 IonicContact CZ-OD2 3.32Å; R310-D482 IonicContact NH1-OD1 2.81Å; R310-D482 PolarHBondContact NH1-OD1 3.31Å; R310-D482 IonicContact NH1-OD2 3.07Å; R310-D482 PolarHBondContact NH1-OD2 3.13Å; R310-D482 IonicContact NH2-OD1 2.71Å; R310-D482 PolarHBondContact NH2-OD1 3.39Å
311	S	45.9	Very low	63	Low	89 Å²	89	81.6 Å²	81.6	62%	0.622	43%	0.433	S	S	*	.	S	Bend	trans	-65	-19.9	176.5	40.3	0	0	0	0	113.3	Q308 S313	Q308-S311 PolarHBondContact O-OG 3.33Å; S311-S313 PolarHBondContact O-N 2.88Å
312	H	42.6	Very low	63	Low	143 Å²	143	82.4 Å²	82.4	66%	0.662	44%	0.437	S	S	*	.	S	Bend	trans	-96.1	70.2	174.9	-70	-57.6	0	0	0	111.9	R310 Q314	R310-H312 PolarHBondContact O-N 2.65Å; H312-Q314 VanDerWaalsContact C-N 3.26Å; H312-Q314 PolarHBondContact O-N 3.34Å
313	S	37.8	Very low	63.1	Low	110 Å²	110	81.9 Å²	81.9	77%	0.769	44%	0.436	S	S	*	.	S	Bend	trans	35.5	38.5	141.6	60.3	0	0	0	0	119.5	S311	S311-S313 PolarHBondContact O-N 2.88Å
314	Q	40.5	Very low	63.5	Low	146 Å²	146	81.3 Å²	81.3	68%	0.682	43%	0.433	S	S	*	.			trans	-137	96	168.4	-77.4	-170.9	-8.9	0	0	109.4	H312 N316	H312-Q314 VanDerWaalsContact C-N 3.26Å; H312-Q314 PolarHBondContact O-N 3.34Å; Q314-N316 PolarHBondContact O-N 2.89Å
315	E	47	Very low	64.3	Low	195 Å²	195	80.6 Å²	80.6	91%	0.911	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	12.7	178.2	-62.6	178.4	151.5	0	0	114.3
316	N	52.2	Low	65.4	Low	154 Å²	154	77.4 Å²	77.4	82%	0.824	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.6	48.1	-178.9	-79.1	-58.9	0	0	0	112.3	Q314 A318	Q314-N316 PolarHBondContact O-N 2.89Å; N316-A318 VanDerWaalsContact C-N 3.34Å; N316-A318 PolarHBondContact O-N 3.24Å
317	L	57.2	Low	66.7	Low	61 Å²	61	77.8 Å²	77.8	32%	0.319	41%	0.412	S	S	.	.			trans	-77.1	85.3	176.7	-151.7	72.3	0	0	0	110.2	R215 D309 L319	R215-L317 VanDerWaalsContact CZ-CG 3.47Å; R215-L317 VanDerWaalsContact NH1-CD2 3.27Å; R215-L317 VanDerWaalsContact NH1-CG 3.35Å; D309-L317 HydrophobicContact CB-CD2 3.85Å; L317-L319 PolarHBondContact O-N 3.15Å; L317-L319 VanDerWaalsContact O-N 3.15Å
318	A	67.2	Low	68.5	Low	85 Å²	85	77.5 Å²	77.5	70%	0.702	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-60.3	119.8	173	0	0	0	0	0	109.3	N316 K320	N316-A318 VanDerWaalsContact C-N 3.34Å; N316-A318 PolarHBondContact O-N 3.24Å; A318-K320 PolarHBondContact O-N 3.26Å
319	L	75.1	Confident	70.3	Confident	62 Å²	62	73.2 Å²	73.2	33%	0.325	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-61.6	126.2	178	-68.8	170.2	0	0	0	109.8	Q302 V305 L317	Q302-L319 HydrophobicContact CG-CB 4.07Å; Q302-L319 VanDerWaalsContact NE2-CB 3.32Å; V305-L319 HydrophobicContact CG2-CD1 3.91Å; V305-L319 HydrophobicContact CG2-CD2 3.6Å; V305-L319 HydrophobicContact CG2-CG 4.28Å; L317-L319 PolarHBondContact O-N 3.15Å; L317-L319 VanDerWaalsContact O-N 3.15Å
320	K	85.7	Confident	72.1	Confident	99 Å²	99	72.6 Å²	72.6	43%	0.43	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-76.4	141.9	177	-71.1	-156.8	-166.3	162.7	0	110	I214 R215 E303 A318	I214-K320 HydrophobicContact CG2-CB 4.25Å; R215-K320 HydrophobicContact CG-CD 4.45Å; R215-K320 PolarHBondContact O-NZ 2.82Å; E303-K320 PolarHBondContact N-O 3.13Å; A318-K320 PolarHBondContact O-N 3.26Å
321	T	90.7	Very high	74	Confident	74 Å²	74	69.3 Å²	69.3	45%	0.454	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	147.7	169.8	55.1	0	0	0	0	109.4	R300 V301 Q302	R300-T321 HydrophobicContact CG-CG2 4.38Å; V301-T321 CarbonylContact O-C 3.54Å; V301-T321 VanDerWaalsContact O-CA 3.26Å; V301-T321 WeakPolarHBondContact O-CA 3.29Å; Q302-T321 HydrophobicContact CB-CG2 4.02Å; Q302-T321 HydrophobicContact CG-CG2 4.12Å
322	I	92.3	Very high	76	Confident	17 Å²	17	67.8 Å²	67.8	9%	0.087	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.8	175.8	-166.7	154.4	0	0	0	109.8	I214 I217 F228 V301 I366	I214-I322 HydrophobicContact CD1-CG2 4.16Å; I214-I322 HydrophobicContact CG2-CB 4.02Å; I214-I322 HydrophobicContact CG2-CG2 3.96Å; I217-I322 HydrophobicContact CD1-CD1 4.18Å; F228-I322 HydrophobicContact CE2-CG2 3.89Å; F228-I322 HydrophobicContact CZ-CG2 3.95Å; V301-I322 HydrophobicContact CB-CG2 4.43Å; V301-I322 PolarHBondContact N-O 3.36Å; V301-I322 PolarHBondContact O-N 3Å; I322-I366 HydrophobicContact CD1-CD1 3.47Å; I322-I366 VanDerWaalsContact CD1-CD1 3.47Å; I322-I366 HydrophobicContact CD1-CG1 3.78Å; I322-I366 HydrophobicContact CG1-CD1 4.12Å; I322-I366 HydrophobicContact CG1-CG1 4.2Å
323	D	93.6	Very high	78.1	Confident	37 Å²	37	63.6 Å²	63.6	20%	0.198	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	131.8	177.2	-70.2	-16.2	0	0	0	109.3	Q298 L299 R300 F365 I366	Q298-D323 PolarHBondContact NE2-OD2 3.36Å; L299-D323 CarbonylContact O-C 3.55Å; L299-D323 WeakPolarHBondContact O-CA 3.45Å; R300-D323 IonicContact CZ-OD1 3.96Å; R300-D323 IonicContact CZ-OD2 3.94Å; R300-D323 IonicContact NE-OD1 3.42Å; R300-D323 PolarHBondContact NE-OD1 3.45Å; R300-D323 IonicContact NH2-OD1 2.78Å; R300-D323 PolarHBondContact NH2-OD1 3.22Å; R300-D323 IonicContact NH2-OD2 2.73Å; R300-D323 PolarHBondContact NH2-OD2 2.76Å; D323-F365 CarbonylContact O-C 3.52Å; D323-F365 VanDerWaalsContact O-CA 3.29Å; D323-F365 WeakPolarHBondContact O-CA 3.34Å; D323-I366 PolarHBondContact O-N 2.92Å
324	C	94.7	Very high	80.5	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.7	-178	-59.1	0	0	0	0	108.9	L299 I342 I366 V368	L299-C324 HydrophobicContact CB-CB 4.26Å; L299-C324 PolarHBondContact N-O 3.38Å; L299-C324 PolarHBondContact O-N 3.35Å; C324-I342 HydrophobicContact CB-CD1 4.36Å; C324-I366 CarbonylContact C-O 3.54Å; C324-I366 WeakPolarHBondContact CA-O 3.49Å; C324-V368 HydrophobicContact CB-CG2 3.72Å
325	E	93.9	Very high	82.7	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.3	178	-65.6	-169.6	176.7	0	0	110	W296 K349 F365 I366 V368	W296-E325 HydrophobicContact CZ2-CG 4.22Å; W296-E325 PolarHBondContact NE1-OE2 3.46Å; W296-E325 VanDerWaalsContact NE1-OE2 3.14Å; E325-K349 IonicContact OE1-NZ 3.11Å; E325-F365 HydrophobicContact CB-CD2 4.36Å; E325-F365 VanDerWaalsContact CD-CE2 3.48Å; E325-F365 HydrophobicContact CG-CD2 3.73Å; E325-F365 HydrophobicContact CG-CE2 4.07Å; E325-I366 PolarHBondContact N-O 2.91Å; E325-V368 WeakPolarHBondContact O-CB 3.32Å; E325-V368 WeakPolarHBondContact O-CG2 3.48Å; E325-V368 PolarHBondContact O-N 3.08Å
326	L	93.8	Very high	84.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	144.7	173	-55.7	179.3	0	0	0	109.7	W296 Q297 L299 L330 V331 V368 V371	W296-L326 WeakPolarHBondContact CA-O 3.44Å; Q297-L326 HydrophobicContact CB-CB 4.35Å; Q297-L326 PolarHBondContact N-O 3.02Å; Q297-L326 PolarHBondContact O-N 3.3Å; L299-L326 HydrophobicContact CD1-CD1 3.33Å; L299-L326 HydrophobicContact CD1-CD2 3.94Å; L299-L326 HydrophobicContact CD1-CG 3.69Å; L299-L326 HydrophobicContact CD2-CD1 4.19Å; L299-L326 HydrophobicContact CG-CD1 3.68Å; L299-L326 HydrophobicContact CG-CG 3.97Å; L326-L330 HydrophobicContact CB-CB 4.14Å; L326-L330 WeakPolarHBondContact CD1-O 3.4Å; L326-L330 HydrophobicContact CD2-CB 4.12Å; L326-V331 HydrophobicContact CB-CG2 4.28Å; L326-V368 HydrophobicContact CD2-CB 3.78Å; L326-V368 HydrophobicContact CD2-CG1 3.9Å; L326-V368 HydrophobicContact CD2-CG2 3.87Å; L326-V371 HydrophobicContact CD2-CG2 3.63Å
327	V	90.3	Very high	86.1	Confident	32 Å²	32	38.5 Å²	38.5	19%	0.194	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.8	180	-173.3	0	0	0	0	109.7	R204 V294 D295 D329 L330	R204-V327 PolarHBondContact NH2-O 2.73Å; R204-V327 VanDerWaalsContact NH2-O 3.1Å; V294-V327 HydrophobicContact CB-CG1 4.16Å; V294-V327 HydrophobicContact CG2-CG1 3.67Å; D295-V327 CarbonylContact O-C 3.58Å; D295-V327 WeakPolarHBondContact O-CA 3.46Å; V327-D329 PolarHBondContact O-N 3.29Å; V327-L330 PolarHBondContact O-N 2.95Å
328	D	87.7	Confident	87.5	Confident	50 Å²	50	36.7 Å²	36.7	27%	0.267	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	61.1	-121.5	173	-159.4	13.2	0	0	0	112.4	D295 L330 V331	D295-D328 PolarHBondContact O-N 2.9Å; D328-L330 PolarHBondContact O-N 2.69Å; D328-L330 VanDerWaalsContact O-N 3.1Å; D328-V331 WeakPolarHBondContact O-CB 3.44Å; D328-V331 WeakPolarHBondContact O-CG2 3.37Å; D328-V331 PolarHBondContact O-N 2.99Å; D328-V331 VanDerWaalsContact O-N 3.08Å
329	D	87.6	Confident	88.5	Confident	49 Å²	49	33 Å²	33	26%	0.262	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-59.5	-22.6	-177.7	58.6	-74.5	0	0	0	115	H144 R204 V327 V331	H144-D329 IonicContact CD2-OD2 3.74Å; H144-D329 IonicContact CE1-OD2 3.94Å; H144-D329 IonicContact CG-OD1 3.46Å; H144-D329 IonicContact CG-OD2 3.63Å; H144-D329 IonicContact ND1-OD1 3.41Å; H144-D329 IonicContact ND1-OD2 2.96Å; H144-D329 IonicContact NE2-OD2 2.66Å; R204-D329 IonicContact CZ-OD1 3.13Å; R204-D329 VanDerWaalsContact CZ-OD1 3.28Å; R204-D329 IonicContact CZ-OD2 2.72Å; R204-D329 IonicContact NE-OD1 2.82Å; R204-D329 PolarHBondContact NE-OD1 3.41Å; R204-D329 IonicContact NE-OD2 3.75Å; R204-D329 PolarHBondContact NE-OD2 3.13Å; R204-D329 IonicContact NH2-OD1 3.37Å; R204-D329 PolarHBondContact NH2-OD1 2.67Å; R204-D329 IonicContact NH2-OD2 3.44Å; V327-D329 PolarHBondContact O-N 3.29Å; D329-V331 VanDerWaalsContact C-N 3.26Å; D329-V331 PolarHBondContact O-N 3.48Å
330	L	89.3	Confident	89.3	Confident	13 Å²	13	30.1 Å²	30.1	7%	0.068	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-75.9	-17	179.8	-62.4	-179.4	0	0	0	112.6	R204 L326 V327 D328 G332 C333 V368	R204-L330 VanDerWaalsContact NH1-CD1 3.3Å; L326-L330 HydrophobicContact CB-CB 4.14Å; L326-L330 WeakPolarHBondContact CD1-O 3.4Å; L326-L330 HydrophobicContact CD2-CB 4.12Å; V327-L330 PolarHBondContact O-N 2.95Å; D328-L330 PolarHBondContact O-N 2.69Å; D328-L330 VanDerWaalsContact O-N 3.1Å; L330-G332 PolarHBondContact O-N 2.94Å; L330-C333 WeakPolarHBondContact O-CB 3.49Å; L330-C333 PolarHBondContact O-N 3.31Å; L330-C333 PolarHBondContact O-SG 3.43Å; L330-V368 HydrophobicContact CD1-CB 4.39Å; L330-V368 HydrophobicContact CD1-CG1 4.03Å; L330-V368 WeakPolarHBondContact CD1-O 3.35Å
331	V	89.9	Confident	89.6	Confident	30 Å²	30	26.1 Å²	26.1	18%	0.182	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	132.1	-179.3	175.4	0	0	0	0	110	C238 D295 Q297 L326 D328 D329 C333	C238-V331 HydrophobicContact CB-CG1 4.05Å; D295-V331 HydrophobicContact CB-CB 4.46Å; D295-V331 HydrophobicContact CB-CG2 4.09Å; Q297-V331 HydrophobicContact CB-CB 4.41Å; Q297-V331 HydrophobicContact CB-CG1 3.91Å; Q297-V331 HydrophobicContact CB-CG2 3.94Å; L326-V331 HydrophobicContact CB-CG2 4.28Å; D328-V331 WeakPolarHBondContact O-CB 3.44Å; D328-V331 WeakPolarHBondContact O-CG2 3.37Å; D328-V331 PolarHBondContact O-N 2.99Å; D328-V331 VanDerWaalsContact O-N 3.08Å; D329-V331 VanDerWaalsContact C-N 3.26Å; D329-V331 PolarHBondContact O-N 3.48Å; V331-C333 VanDerWaalsContact C-N 3.27Å; V331-C333 PolarHBondContact O-N 3.49Å
332	G	87.4	Confident	89.7	Confident	58 Å²	58	22.6 Å²	22.6	60%	0.598	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	6.8	-179.1	0	0	0	0	0	115.7	L330 C334	L330-G332 PolarHBondContact O-N 2.94Å; G332-C334 VanDerWaalsContact C-N 3.28Å; G332-C334 PolarHBondContact O-N 3.2Å
333	C	87.4	Confident	89.7	Confident	55 Å²	55	22 Å²	22	37%	0.372	15%	0.147	S	C	.	.	S	Bend	trans	-69.4	-22.2	-179.9	71.3	0	0	0	0	114.4	L330 V331	L330-C333 WeakPolarHBondContact O-CB 3.49Å; L330-C333 PolarHBondContact O-N 3.31Å; L330-C333 PolarHBondContact O-SG 3.43Å; V331-C333 VanDerWaalsContact C-N 3.27Å; V331-C333 PolarHBondContact O-N 3.49Å
334	C	87.5	Confident	89.7	Confident	13 Å²	13	20.2 Å²	20.2	9%	0.088	14%	0.137	C	C	.	.			trans	-128.1	151.4	-175.5	62.7	0	0	0	0	112.5	I235 L299 G332 V340 V373	I235-C334 WeakPolarHBondContact CD1-O 3.32Å; L299-C334 VanDerWaalsContact CD1-SG 3.53Å; G332-C334 VanDerWaalsContact C-N 3.28Å; G332-C334 PolarHBondContact O-N 3.2Å; C334-V340 HydrophobicContact CB-CG1 4.15Å; C334-V373 HydrophobicContact CB-CG2 4.14Å
335	S	86.5	Confident	89.6	Confident	51 Å²	51	20.2 Å²	20.2	36%	0.357	14%	0.138	S	C	.	.			trans	-106.7	156.1	173.1	59.3	0	0	0	0	111.8	I235 G337 S338	I235-S335 VanDerWaalsContact CD1-C 3.48Å; S335-G337 PolarHBondContact O-N 3.4Å; S335-S338 WeakPolarHBondContact O-CB 3.4Å; S335-S338 PolarHBondContact O-N 3.44Å; S335-S338 VanDerWaalsContact O-N 3.09Å; S335-S338 PolarHBondContact O-OG 3.41Å; S335-S338 VanDerWaalsContact O-OG 3.12Å; S335-S338 PolarHBondContact OG-OG 3Å
336	S	87.6	Confident	89.6	Confident	6 Å²	6	19.8 Å²	19.8	4%	0.042	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	136.6	177.7	-49.1	0	0	0	0	110.3	I235 S338 V520	I235-S336 WeakPolarHBondContact CD1-OG 3.44Å; I235-S336 WeakPolarHBondContact CG1-OG 3.46Å; S336-S338 VanDerWaalsContact C-N 3.32Å; S336-V520 WeakPolarHBondContact O-CG1 3.5Å
337	G	84.1	Confident	89.4	Confident	7 Å²	7	22.2 Å²	22.2	7%	0.072	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-7.8	-173.9	0	0	0	0	0	115.1	V232 S335	V232-G337 PolarHBondContact O-N 2.8Å; S335-G337 PolarHBondContact O-N 3.4Å
338	S	86.6	Confident	89.3	Confident	23 Å²	23	22.9 Å²	22.9	16%	0.161	15%	0.148	C	C	.	.			trans	-69.2	138	175.6	-68.3	0	0	0	0	111.6	V232 S335 S336	V232-S338 PolarHBondContact N-O 2.83Å; S335-S338 WeakPolarHBondContact O-CB 3.4Å; S335-S338 PolarHBondContact O-N 3.44Å; S335-S338 VanDerWaalsContact O-N 3.09Å; S335-S338 PolarHBondContact O-OG 3.41Å; S335-S338 VanDerWaalsContact O-OG 3.12Å; S335-S338 PolarHBondContact OG-OG 3Å; S336-S338 VanDerWaalsContact C-N 3.32Å
339	V	88.2	Confident	89.1	Confident	9 Å²	9	25.9 Å²	25.9	6%	0.055	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.6	167.2	-172.1	0	0	0	0	108.5	V229 G230 V231 K374 V380 I486	V229-V339 HydrophobicContact CG1-CG1 3.94Å; G230-V339 WeakPolarHBondContact O-CA 3.46Å; V231-V339 HydrophobicContact CG2-CG2 4.09Å; V339-K374 PolarHBondContact O-N 3.14Å; V339-V380 HydrophobicContact CB-CG2 3.78Å; V339-V380 HydrophobicContact CG1-CG1 4.13Å; V339-V380 HydrophobicContact CG1-CG2 3.84Å; V339-V380 HydrophobicContact CG2-CG1 4.35Å; V339-V380 HydrophobicContact CG2-CG2 3.86Å; V339-I486 HydrophobicContact CG2-CD1 3.83Å
340	V	91	Very high	88.5	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.9	-176.1	-65.1	0	0	0	0	110.2	V229 G230 V232 V301 C334 I342 V371 V373	V229-V340 WeakPolarHBondContact CA-O 3.43Å; G230-V340 PolarHBondContact N-O 2.98Å; G230-V340 PolarHBondContact O-N 3.26Å; V232-V340 HydrophobicContact CG2-CB 4.42Å; V232-V340 HydrophobicContact CG2-CG1 3.85Å; V232-V340 HydrophobicContact CG2-CG2 3.62Å; V301-V340 HydrophobicContact CG1-CG2 4.47Å; V301-V340 HydrophobicContact CG2-CG2 4.42Å; C334-V340 HydrophobicContact CB-CG1 4.15Å; V340-I342 HydrophobicContact CB-CG1 4.27Å; V340-I342 HydrophobicContact CG2-CD1 3.76Å; V340-I342 HydrophobicContact CG2-CG1 3.79Å; V340-V371 HydrophobicContact CB-CG1 4.19Å; V340-V371 HydrophobicContact CG1-CG1 4.09Å; V340-V373 HydrophobicContact CG1-CG2 4.19Å
341	C	90.9	Very high	87.6	Confident	16 Å²	16	30.3 Å²	30.3	11%	0.108	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.5	162.2	-176.1	0	0	0	0	107.3	F228 V229 A372 K374	F228-C341 WeakPolarHBondContact O-CA 3.31Å; V229-C341 HydrophobicContact CG2-CB 4.2Å; C341-A372 HydrophobicContact CB-CB 4.29Å; C341-A372 PolarHBondContact N-O 3.33Å; C341-A372 PolarHBondContact O-N 3.18Å; C341-K374 HydrophobicContact CB-CG 4.5Å
342	I	92.8	Very high	86.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.3	-177.5	-67.2	176.3	0	0	0	107.7	S227 F228 V301 C324 V340 I366 V368	S227-I342 VanDerWaalsContact CA-O 3.31Å; S227-I342 WeakPolarHBondContact CA-O 3.27Å; F228-I342 HydrophobicContact CD1-CB 4.48Å; F228-I342 HydrophobicContact CE1-CB 3.8Å; F228-I342 HydrophobicContact CE1-CG2 3.69Å; F228-I342 HydrophobicContact CE2-CB 4.24Å; F228-I342 HydrophobicContact CE2-CD1 4.3Å; F228-I342 HydrophobicContact CZ-CB 3.69Å; F228-I342 HydrophobicContact CZ-CD1 4.02Å; F228-I342 HydrophobicContact CZ-CG1 4.41Å; F228-I342 HydrophobicContact CZ-CG2 3.77Å; F228-I342 PolarHBondContact N-O 3.21Å; F228-I342 PolarHBondContact O-N 2.73Å; V301-I342 HydrophobicContact CB-CD1 4.35Å; V301-I342 HydrophobicContact CG1-CD1 4.42Å; V301-I342 HydrophobicContact CG2-CD1 3.42Å; V301-I342 VanDerWaalsContact CG2-CD1 3.42Å; C324-I342 HydrophobicContact CB-CD1 4.36Å; V340-I342 HydrophobicContact CB-CG1 4.27Å; V340-I342 HydrophobicContact CG2-CD1 3.76Å; V340-I342 HydrophobicContact CG2-CG1 3.79Å; I342-I366 HydrophobicContact CG2-CG2 4.45Å; I342-V368 HydrophobicContact CG2-CB 4.42Å; I342-V368 HydrophobicContact CG2-CG1 3.9Å; I342-V368 HydrophobicContact CG2-CG2 3.75Å
343	T	93.1	Very high	85.2	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.4	168.4	-52.4	0	0	0	0	108.3	F208 L225 V226 S227 T369 S370	F208-T343 HydrophobicContact CB-CG2 3.85Å; L225-T343 HydrophobicContact CD1-CG2 4.05Å; L225-T343 HydrophobicContact CD2-CG2 4.16Å; L225-T343 HydrophobicContact CG-CG2 4.04Å; V226-T343 WeakPolarHBondContact O-CA 3.3Å; S227-T343 PolarHBondContact OG-OG1 3.21Å; S227-T343 VanDerWaalsContact OG-OG1 3.1Å; T343-T369 PolarHBondContact O-N 3.5Å; T343-S370 PolarHBondContact N-O 3.01Å; T343-S370 PolarHBondContact O-N 3.48Å
344	G	93.4	Very high	83.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	173.4	-175.5	0	0	0	0	0	113.4	V226 S367	V226-G344 PolarHBondContact N-O 3.23Å; V226-G344 PolarHBondContact O-N 3.05Å; G344-S367 CarbonylContact C-O 3.52Å; G344-S367 WeakPolarHBondContact CA-O 3.41Å
345	V	92.8	Very high	82.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.6	-179.4	-176.2	0	0	0	0	109.1	A172 I176 L225 K347 I366 S367	A172-V345 HydrophobicContact CB-CG1 4.34Å; A172-V345 HydrophobicContact CB-CG2 3.73Å; I176-V345 HydrophobicContact CD1-CG2 3.72Å; L225-V345 HydrophobicContact CD1-CG2 4.01Å; V345-K347 HydrophobicContact CG1-CG 4.46Å; V345-K347 PolarHBondContact O-N 3.23Å; V345-I366 WeakPolarHBondContact O-CA 3.41Å; V345-S367 PolarHBondContact N-O 3.46Å; V345-S367 PolarHBondContact O-N 3.02Å
346	V	93.6	Very high	81	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	122.9	176.4	-175	0	0	0	0	109.3	I217 D221 N223 R224 V226 M364 I366	I217-V346 HydrophobicContact CG2-CG1 4.48Å; I217-V346 HydrophobicContact CG2-CG2 4.17Å; D221-V346 HydrophobicContact CB-CG2 4.48Å; D221-V346 WeakPolarHBondContact O-CB 3.31Å; N223-V346 PolarHBondContact N-O 3.27Å; R224-V346 PolarHBondContact O-N 3.27Å; V226-V346 HydrophobicContact CB-CG2 4.36Å; V226-V346 HydrophobicContact CG1-CG2 3.87Å; V226-V346 HydrophobicContact CG2-CG2 3.53Å; V346-M364 HydrophobicContact CG1-CE 3.54Å; V346-I366 HydrophobicContact CG2-CG1 4.49Å
347	K	90.9	Very high	79.6	Confident	50 Å²	50	65.9 Å²	65.9	22%	0.217	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	168	177.8	-60.8	-163	-172.9	-162.2	0	110.8	D173 V345 M364 F365	D173-K347 IonicContact OD1-NZ 2.75Å; D173-K347 WeakPolarHBondContact OD2-CE 3.47Å; D173-K347 IonicContact OD2-NZ 3.61Å; D173-K347 PolarHBondContact OD2-NZ 3.42Å; V345-K347 HydrophobicContact CG1-CG 4.46Å; V345-K347 PolarHBondContact O-N 3.23Å; K347-M364 WeakPolarHBondContact O-CA 3.34Å; K347-F365 HydrophobicContact CB-CD1 4.15Å; K347-F365 HydrophobicContact CB-CD2 4.47Å; K347-F365 HydrophobicContact CB-CE1 3.57Å; K347-F365 HydrophobicContact CB-CE2 3.96Å; K347-F365 HydrophobicContact CB-CZ 3.49Å; K347-F365 VanDerWaalsContact CB-CZ 3.49Å; K347-F365 HydrophobicContact CD-CZ 4.24Å; K347-F365 HydrophobicContact CG-CZ 4.39Å; K347-F365 PolarHBondContact N-O 3.4Å; K347-F365 PolarHBondContact O-N 3.49Å
348	M	87.4	Confident	78.4	Confident	46 Å²	46	71.1 Å²	71.1	23%	0.227	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131	179.7	-64.9	-175.8	-170.1	0	0	110.6	F219 C222 Y362 A363 M364	F219-M348 HydrophobicContact CB-CE 4.14Å; F219-M348 HydrophobicContact CD1-CE 4.37Å; F219-M348 HydrophobicContact CD2-CE 2.99Å; F219-M348 HydrophobicContact CD2-SD 3.46Å; F219-M348 WeakPolarHBondContact CD2-SD 3.35Å; F219-M348 HydrophobicContact CE2-CE 3.27Å; F219-M348 HydrophobicContact CE2-SD 3.17Å; F219-M348 WeakPolarHBondContact CE2-SD 3.48Å; F219-M348 HydrophobicContact CG-CE 3.6Å; F219-M348 HydrophobicContact CZ-CE 4.06Å; F219-M348 HydrophobicContact CZ-SD 4.1Å; C222-M348 HydrophobicContact CB-CE 3.62Å; M348-Y362 HydrophobicContact CB-CD1 4.3Å; M348-A363 WeakPolarHBondContact CA-O 3.39Å; M348-M364 HydrophobicContact CE-CG 4.21Å; M348-M364 HydrophobicContact CG-CG 4.23Å
349	K	82.3	Confident	77.1	Confident	113 Å²	113	77 Å²	77	49%	0.491	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.5	176.3	-165	169.6	-174.6	169.3	0	109.4	E325 Y362 A363 F365	E325-K349 IonicContact OE1-NZ 3.11Å; K349-Y362 CarbonylContact O-C 3.59Å; K349-Y362 WeakPolarHBondContact O-CA 3.48Å; K349-A363 PolarHBondContact N-O 3.27Å; K349-A363 PolarHBondContact O-N 2.86Å; K349-F365 HydrophobicContact CB-CD1 3.74Å; K349-F365 HydrophobicContact CB-CE1 3.67Å
350	K	76.8	Confident	76.1	Confident	94 Å²	94	85.9 Å²	85.9	41%	0.409	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.9	171.2	-170.7	175.2	-174.8	169.8	0	109.1	E352 R359 Y362	K350-E352 PolarHBondContact O-N 3.01Å; K350-R359 WeakPolarHBondContact CE-O 3.28Å; K350-Y362 HydrophobicContact CB-CD1 4.46Å; K350-Y362 HydrophobicContact CB-CE1 4.21Å
351	N	70.2	Confident	75.3	Confident	61 Å²	61	90.5 Å²	90.5	33%	0.326	39%	0.385	S	S	.	.			trans	-78.6	102.2	175.9	-168.9	-10.7	0	0	0	110.1	E353 A354 Q361	N351-E353 PolarHBondContact OD1-N 3.45Å; N351-A354 HydrophobicContact CB-CB 4.41Å; N351-Q361 WeakPolarHBondContact CB-O 3.36Å; N351-Q361 PolarHBondContact N-O 3.46Å; N351-Q361 VanDerWaalsContact N-O 3.17Å
352	E	65.5	Low	74.7	Confident	174 Å²	174	96.6 Å²	96.6	81%	0.813	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-25.3	-179.7	-61.6	-159.3	143.9	0	0	113.3	K350 A354	K350-E352 PolarHBondContact O-N 3.01Å; E352-A354 VanDerWaalsContact C-N 3.25Å; E352-A354 PolarHBondContact O-N 3.49Å
353	E	59.8	Low	74.4	Confident	147 Å²	147	99 Å²	99	69%	0.687	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-11.6	-179.8	-64.4	-175.3	166.3	0	0	112.8	N351 R355 S508	N351-E353 PolarHBondContact OD1-N 3.45Å; E353-R355 PolarHBondContact O-N 2.91Å; E353-S508 WeakPolarHBondContact OE1-CB 3.32Å; E353-S508 PolarHBondContact OE1-OG 3.19Å
354	A	56.2	Low	74.2	Confident	15 Å²	15	101.8 Å²	101.8	12%	0.124	44%	0.441	C	S	.	.	S	Bend	trans	-65.6	120.1	176.8	0	0	0	0	0	110.5	N351 E352 K356	N351-A354 HydrophobicContact CB-CB 4.41Å; E352-A354 VanDerWaalsContact C-N 3.25Å; E352-A354 PolarHBondContact O-N 3.49Å; A354-K356 PolarHBondContact O-N 3Å
355	R	57.8	Low	74.1	Confident	220 Å²	220	102.8 Å²	102.8	83%	0.83	45%	0.445	S	S	*	.			trans	-42.5	142	172.5	-73.5	-179.8	175.1	167.9	-1.1	109.9	E353 R357 Y358	E353-R355 PolarHBondContact O-N 2.91Å; R355-R357 PolarHBondContact O-N 2.82Å; R355-Y358 PolarHBondContact O-N 2.79Å
356	K	60.3	Low	74.2	Confident	186 Å²	186	102.7 Å²	102.7	81%	0.809	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-36.7	-29.5	-172.4	-74.8	-176.8	177.7	-178.9	0	116.7	A354	A354-K356 PolarHBondContact O-N 3Å
357	R	58.8	Low	74.2	Confident	218 Å²	218	104.1 Å²	104.1	82%	0.823	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-72	-18.4	177.3	-82.5	-168.8	-92.8	-178.9	-7.2	116.5	R355	R355-R357 PolarHBondContact O-N 2.82Å
358	Y	56.9	Low	74.3	Confident	117 Å²	117	102.1 Å²	102.1	46%	0.459	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-121.1	28.4	-174.3	-58.4	-68.6	0	0	0	113.7	R355 W360 Q361	R355-Y358 PolarHBondContact O-N 2.79Å; Y358-W360 AromaticContact CD1-NE1 3.99Å; Y358-W360 PolarHBondContact O-N 3.39Å; Y358-Q361 PolarHBondContact O-N 3.48Å
359	R	60.4	Low	74.5	Confident	146 Å²	146	100.3 Å²	100.3	55%	0.551	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-13.6	-177.9	-113.7	-179.3	158.7	80.6	1.4	115.4	K350	K350-R359 WeakPolarHBondContact CE-O 3.28Å
360	W	67.7	Low	74.9	Confident	197 Å²	197	95.3 Å²	95.3	75%	0.746	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.5	176	58.9	3.7	0	0	0	114.7	Y358 Y362	Y358-W360 AromaticContact CD1-NE1 3.99Å; Y358-W360 PolarHBondContact O-N 3.39Å; W360-Y362 VanDerWaalsContact O-CD2 3.27Å; W360-Y362 WeakPolarHBondContact O-CD2 3.44Å; W360-Y362 PolarHBondContact O-N 2.9Å
361	Q	72.9	Confident	75.6	Confident	96 Å²	96	92 Å²	92	45%	0.449	41%	0.405	S	S	.	.			trans	-79.8	113.9	178.1	-73.8	179.9	-18.9	0	0	109.6	N351 Y358	N351-Q361 WeakPolarHBondContact CB-O 3.36Å; N351-Q361 PolarHBondContact N-O 3.46Å; N351-Q361 VanDerWaalsContact N-O 3.17Å; Y358-Q361 PolarHBondContact O-N 3.48Å
362	Y	79.6	Confident	76.5	Confident	145 Å²	145	91.1 Å²	91.1	57%	0.569	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.2	170.7	-70.1	-95.3	0	0	0	109.4	M348 K349 K350 W360	M348-Y362 HydrophobicContact CB-CD1 4.3Å; K349-Y362 CarbonylContact O-C 3.59Å; K349-Y362 WeakPolarHBondContact O-CA 3.48Å; K350-Y362 HydrophobicContact CB-CD1 4.46Å; K350-Y362 HydrophobicContact CB-CE1 4.21Å; W360-Y362 VanDerWaalsContact O-CD2 3.27Å; W360-Y362 WeakPolarHBondContact O-CD2 3.44Å; W360-Y362 PolarHBondContact O-N 2.9Å
363	A	85.4	Confident	77.5	Confident	51 Å²	51	85.1 Å²	85.1	42%	0.421	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130	169.4	0	0	0	0	0	108.4	M348 K349	M348-A363 WeakPolarHBondContact CA-O 3.39Å; K349-A363 PolarHBondContact N-O 3.27Å; K349-A363 PolarHBondContact O-N 2.86Å
364	M	89	Confident	78.5	Confident	61 Å²	61	80.9 Å²	80.9	30%	0.3	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	138.9	171.7	-67.4	174.3	62.4	0	0	109.5	I217 Q218 V346 K347 M348	I217-M364 HydrophobicContact CG2-CE 3.83Å; Q218-M364 WeakPolarHBondContact O-CE 3.41Å; V346-M364 HydrophobicContact CG1-CE 3.54Å; K347-M364 WeakPolarHBondContact O-CA 3.34Å; M348-M364 HydrophobicContact CE-CG 4.21Å; M348-M364 HydrophobicContact CG-CG 4.23Å
365	F	92.6	Very high	79.3	Confident	20 Å²	20	88.8 Å²	88.8	9%	0.088	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	160.6	172.6	73.5	-81.5	0	0	0	109.6	D323 E325 K347 K349	D323-F365 CarbonylContact O-C 3.52Å; D323-F365 VanDerWaalsContact O-CA 3.29Å; D323-F365 WeakPolarHBondContact O-CA 3.34Å; E325-F365 HydrophobicContact CB-CD2 4.36Å; E325-F365 VanDerWaalsContact CD-CE2 3.48Å; E325-F365 HydrophobicContact CG-CD2 3.73Å; E325-F365 HydrophobicContact CG-CE2 4.07Å; K347-F365 HydrophobicContact CB-CD1 4.15Å; K347-F365 HydrophobicContact CB-CD2 4.47Å; K347-F365 HydrophobicContact CB-CE1 3.57Å; K347-F365 HydrophobicContact CB-CE2 3.96Å; K347-F365 HydrophobicContact CB-CZ 3.49Å; K347-F365 VanDerWaalsContact CB-CZ 3.49Å; K347-F365 HydrophobicContact CD-CZ 4.24Å; K347-F365 HydrophobicContact CG-CZ 4.39Å; K347-F365 PolarHBondContact N-O 3.4Å; K347-F365 PolarHBondContact O-N 3.49Å; K349-F365 HydrophobicContact CB-CD1 3.74Å; K349-F365 HydrophobicContact CB-CE1 3.67Å
366	I	93.6	Very high	79.6	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.7	179.4	-63.3	-178.9	0	0	0	108.9	I217 V226 F228 I322 D323 C324 E325 I342 V345 V346 V368	I217-I366 HydrophobicContact CD1-CD1 4.15Å; V226-I366 HydrophobicContact CG2-CD1 4.08Å; F228-I366 HydrophobicContact CD1-CD1 3.93Å; F228-I366 HydrophobicContact CE1-CD1 3.17Å; F228-I366 HydrophobicContact CE1-CG1 4.45Å; F228-I366 HydrophobicContact CE1-CG2 4.37Å; F228-I366 HydrophobicContact CZ-CD1 3.67Å; I322-I366 HydrophobicContact CD1-CD1 3.47Å; I322-I366 VanDerWaalsContact CD1-CD1 3.47Å; I322-I366 HydrophobicContact CD1-CG1 3.78Å; I322-I366 HydrophobicContact CG1-CD1 4.12Å; I322-I366 HydrophobicContact CG1-CG1 4.2Å; D323-I366 PolarHBondContact O-N 2.92Å; C324-I366 CarbonylContact C-O 3.54Å; C324-I366 WeakPolarHBondContact CA-O 3.49Å; E325-I366 PolarHBondContact N-O 2.91Å; I342-I366 HydrophobicContact CG2-CG2 4.45Å; V345-I366 WeakPolarHBondContact O-CA 3.41Å; V346-I366 HydrophobicContact CG2-CG1 4.49Å; I366-V368 HydrophobicContact CG2-CG2 4.42Å; I366-V368 PolarHBondContact O-N 3.31Å
367	S	93.2	Very high	79.8	Confident	30 Å²	30	71.4 Å²	71.4	21%	0.21	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	110.7	168.2	-174.7	0	0	0	0	108	G344 V345	G344-S367 CarbonylContact C-O 3.52Å; G344-S367 WeakPolarHBondContact CA-O 3.41Å; V345-S367 PolarHBondContact N-O 3.46Å; V345-S367 PolarHBondContact O-N 3.02Å
368	V	93.9	Very high	79.9	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129	-168.7	-177.8	0	0	0	0	111	C324 E325 L326 L330 I342 I366 S370 V371	C324-V368 HydrophobicContact CB-CG2 3.72Å; E325-V368 WeakPolarHBondContact O-CB 3.32Å; E325-V368 WeakPolarHBondContact O-CG2 3.48Å; E325-V368 PolarHBondContact O-N 3.08Å; L326-V368 HydrophobicContact CD2-CB 3.78Å; L326-V368 HydrophobicContact CD2-CG1 3.9Å; L326-V368 HydrophobicContact CD2-CG2 3.87Å; L330-V368 HydrophobicContact CD1-CB 4.39Å; L330-V368 HydrophobicContact CD1-CG1 4.03Å; L330-V368 WeakPolarHBondContact CD1-O 3.35Å; I342-V368 HydrophobicContact CG2-CB 4.42Å; I342-V368 HydrophobicContact CG2-CG1 3.9Å; I342-V368 HydrophobicContact CG2-CG2 3.75Å; I366-V368 HydrophobicContact CG2-CG2 4.42Å; I366-V368 PolarHBondContact O-N 3.31Å; V368-S370 WeakPolarHBondContact CG1-O 3.5Å; V368-V371 HydrophobicContact CG1-CG2 3.54Å
369	T	91.6	Very high	80.1	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-39.5	174.4	-43.5	0	0	0	0	111	I176 A203 R204 F205 T343	I176-T369 HydrophobicContact CD1-CG2 4.07Å; I176-T369 HydrophobicContact CG2-CG2 4.42Å; A203-T369 WeakPolarHBondContact O-CG2 3.4Å; R204-T369 WeakPolarHBondContact CD-O 3.34Å; R204-T369 PolarHBondContact NH1-O 3.25Å; F205-T369 HydrophobicContact CB-CG2 3.99Å; F205-T369 HydrophobicContact CD2-CG2 4.17Å; F205-T369 HydrophobicContact CG-CG2 4.46Å; T343-T369 PolarHBondContact O-N 3.5Å
370	S	91.2	Very high	80.3	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.049	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	149	172.9	70.3	0	0	0	0	112.3	F205 T343 V368	F205-S370 WeakPolarHBondContact O-CB 3.48Å; F205-S370 PolarHBondContact O-OG 2.79Å; T343-S370 PolarHBondContact N-O 3.01Å; T343-S370 PolarHBondContact O-N 3.48Å; V368-S370 WeakPolarHBondContact CG1-O 3.5Å
371	V	91	Very high	79.8	Confident	26 Å²	26	42.3 Å²	42.3	16%	0.158	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.8	173	-177.5	0	0	0	0	108.3	L326 V340 V368 V373	L326-V371 HydrophobicContact CD2-CG2 3.63Å; V340-V371 HydrophobicContact CB-CG1 4.19Å; V340-V371 HydrophobicContact CG1-CG1 4.09Å; V368-V371 HydrophobicContact CG1-CG2 3.54Å; V371-V373 HydrophobicContact CG1-CG2 4.39Å
372	A	88.4	Confident	79.5	Confident	41 Å²	41	40.6 Å²	40.6	34%	0.339	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	105.9	171.1	0	0	0	0	0	109.6	C341 K374	C341-A372 HydrophobicContact CB-CB 4.29Å; C341-A372 PolarHBondContact N-O 3.33Å; C341-A372 PolarHBondContact O-N 3.18Å; A372-K374 PolarHBondContact O-N 2.89Å
373	V	87.2	Confident	78.6	Confident	48 Å²	48	34.6 Å²	34.6	29%	0.291	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	116.5	175.3	-176.5	0	0	0	0	109.2	C334 V340 V371 K375	C334-V373 HydrophobicContact CB-CG2 4.14Å; V340-V373 HydrophobicContact CG1-CG2 4.19Å; V371-V373 HydrophobicContact CG1-CG2 4.39Å; V373-K375 HydrophobicContact CG1-CG 4.42Å; V373-K375 PolarHBondContact O-N 2.94Å
374	K	81.6	Confident	77.5	Confident	58 Å²	58	34.3 Å²	34.3	25%	0.252	19%	0.191	S	C	.	.			trans	-85.6	98	-178.9	-62.8	-71.8	177.4	171.3	0	108.6	V339 C341 A372 S379 V380 S383	V339-K374 PolarHBondContact O-N 3.14Å; C341-K374 HydrophobicContact CB-CG 4.5Å; A372-K374 PolarHBondContact O-N 2.89Å; K374-S379 WeakPolarHBondContact CD-OG 3.28Å; K374-V380 HydrophobicContact CB-CG2 4.04Å; K374-S383 VanDerWaalsContact CE-OG 3.3Å; K374-S383 WeakPolarHBondContact CE-OG 3.44Å; K374-S383 PolarHBondContact NZ-OG 3.14Å
375	K	72.4	Confident	76.2	Confident	181 Å²	181	32.7 Å²	32.7	79%	0.787	19%	0.186	S	C	*	.			trans	-81.8	128	176.5	-66.1	-177	-178.3	176.5	0	110.2	V373	V373-K375 HydrophobicContact CG1-CG 4.42Å; V373-K375 PolarHBondContact O-N 2.94Å
376	G	64.4	Low	74.3	Confident	33 Å²	33	35.4 Å²	35.4	34%	0.34	21%	0.207	S	C	.	.	S	Bend	trans	82.6	154.6	174.8	0	0	0	0	0	114.3	F378 S379 V380	G376-F378 VanDerWaalsContact C-N 3.32Å; G376-F378 PolarHBondContact O-N 3.35Å; G376-S379 PolarHBondContact O-N 3.47Å; G376-V380 PolarHBondContact O-N 3.34Å
377	L	63.7	Low	72.4	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-35.3	-169.7	-148.7	72.9	0	0	0	113.7	V380 A381 P485 I486 I676 A677	L377-V380 PolarHBondContact O-N 3.13Å; L377-A381 WeakPolarHBondContact O-CB 3.47Å; L377-A381 PolarHBondContact O-N 2.74Å; L377-P485 HydrophobicContact CD1-CG 3.61Å; L377-P485 HydrophobicContact CD2-CG 3.39Å; L377-P485 HydrophobicContact CG-CB 4.39Å; L377-P485 HydrophobicContact CG-CG 3.24Å; L377-I486 HydrophobicContact CD1-CB 4.3Å; L377-I486 HydrophobicContact CD1-CD1 3.96Å; L377-I486 HydrophobicContact CD1-CG1 3.97Å; L377-I676 HydrophobicContact CD2-CG2 4.34Å; L377-A677 HydrophobicContact CD2-CB 4.49Å; L377-A677 HydrophobicContact CG-CB 4.47Å
378	F	60.8	Low	70.5	Confident	23 Å²	23	42.3 Å²	42.3	10%	0.101	25%	0.25	C	C	.	.	H	α-helix	trans	-63.3	-46.6	178.4	-177.2	-103.8	0	0	0	112.8	G376 V380 A381 H382 F678 H681	G376-F378 VanDerWaalsContact C-N 3.32Å; G376-F378 PolarHBondContact O-N 3.35Å; F378-V380 PolarHBondContact O-N 2.85Å; F378-A381 PolarHBondContact O-N 2.73Å; F378-H382 WeakPolarHBondContact O-CB 3.49Å; F378-H382 PolarHBondContact O-N 3.04Å; F378-F678 HydrophobicContact CD2-CB 4.17Å; F378-F678 HydrophobicContact CD2-CD2 4.33Å; F378-F678 HydrophobicContact CE2-CB 4.18Å; F378-F678 AromaticContact CE2-CD2 3.77Å; F378-F678 HydrophobicContact CE2-CD2 3.77Å; F378-F678 HydrophobicContact CE2-CG 4.49Å; F378-F678 HydrophobicContact CZ-CD2 4.4Å; F378-H681 HydrophobicContact CB-CB 3.65Å; F378-H681 AromaticContact CD1-CD2 3.99Å; F378-H681 HydrophobicContact CG-CB 4.1Å
379	S	61.3	Low	68.8	Low	37 Å²	37	45 Å²	45	26%	0.259	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-35.3	179.3	-160.8	0	0	0	0	111.3	K374 G376 S383	K374-S379 WeakPolarHBondContact CD-OG 3.28Å; G376-S379 PolarHBondContact O-N 3.47Å; S379-S383 WeakPolarHBondContact O-CB 3.48Å; S379-S383 PolarHBondContact O-N 3.05Å; S379-S383 VanDerWaalsContact O-N 3.15Å; S379-S383 PolarHBondContact O-OG 3.2Å
380	V	64.2	Low	67.4	Low	2 Å²	2	51.3 Å²	51.3	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-70.5	-51.9	176	177	0	0	0	0	111.1	L304 V339 K374 G376 L377 F378 H382 S383 L384 I486	L304-V380 HydrophobicContact CD2-CG1 4.2Å; V339-V380 HydrophobicContact CB-CG2 3.78Å; V339-V380 HydrophobicContact CG1-CG1 4.13Å; V339-V380 HydrophobicContact CG1-CG2 3.84Å; V339-V380 HydrophobicContact CG2-CG1 4.35Å; V339-V380 HydrophobicContact CG2-CG2 3.86Å; K374-V380 HydrophobicContact CB-CG2 4.04Å; G376-V380 PolarHBondContact O-N 3.34Å; L377-V380 PolarHBondContact O-N 3.13Å; F378-V380 PolarHBondContact O-N 2.85Å; V380-H382 VanDerWaalsContact C-N 3.32Å; V380-H382 PolarHBondContact O-N 3.25Å; V380-S383 PolarHBondContact O-N 3.09Å; V380-S383 VanDerWaalsContact O-N 3.1Å; V380-L384 HydrophobicContact CG1-CD1 3.76Å; V380-L384 VanDerWaalsContact O-CD1 3.31Å; V380-L384 WeakPolarHBondContact O-CD1 3.3Å; V380-L384 WeakPolarHBondContact O-CG 3.43Å; V380-L384 PolarHBondContact O-N 2.81Å; V380-I486 HydrophobicContact CG1-CD1 4.29Å; V380-I486 HydrophobicContact CG1-CG1 4.12Å; V380-I486 HydrophobicContact CG2-CD1 4.35Å
381	A	58.7	Low	66	Low	5 Å²	5	58 Å²	58	4%	0.041	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-41.9	179.5	0	0	0	0	0	112.9	L377 F378 L384 S385 P485 A677	L377-A381 WeakPolarHBondContact O-CB 3.47Å; L377-A381 PolarHBondContact O-N 2.74Å; F378-A381 PolarHBondContact O-N 2.73Å; A381-L384 PolarHBondContact O-N 3.5Å; A381-S385 PolarHBondContact O-N 3.18Å; A381-S385 PolarHBondContact O-OG 2.93Å; A381-P485 HydrophobicContact CB-CB 4.24Å; A381-A677 HydrophobicContact CB-CB 3.5Å; A381-A677 VanDerWaalsContact CB-CB 3.5Å
382	H	66.4	Low	64.9	Low	61 Å²	61	61 Å²	61	28%	0.282	34%	0.337	S	S	.	.	H	α-helix	trans	-68.5	-37.7	176.8	-170.6	-59.8	0	0	0	111.7	F378 V380 L384 S385 E393	F378-H382 WeakPolarHBondContact O-CB 3.49Å; F378-H382 PolarHBondContact O-N 3.04Å; V380-H382 VanDerWaalsContact C-N 3.32Å; V380-H382 PolarHBondContact O-N 3.25Å; H382-L384 VanDerWaalsContact C-N 3.28Å; H382-L384 PolarHBondContact O-N 3.25Å; H382-S385 PolarHBondContact O-N 3.01Å; H382-E393 IonicContact CD2-OE2 2.7Å
383	S	59.9	Low	63.8	Low	18 Å²	18	60 Å²	60	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-69.5	-26.7	179	-57.1	0	0	0	0	112.7	K374 S379 V380 S385	K374-S383 VanDerWaalsContact CE-OG 3.3Å; K374-S383 WeakPolarHBondContact CE-OG 3.44Å; K374-S383 PolarHBondContact NZ-OG 3.14Å; S379-S383 WeakPolarHBondContact O-CB 3.48Å; S379-S383 PolarHBondContact O-N 3.05Å; S379-S383 VanDerWaalsContact O-N 3.15Å; S379-S383 PolarHBondContact O-OG 3.2Å; V380-S383 PolarHBondContact O-N 3.09Å; V380-S383 VanDerWaalsContact O-N 3.1Å; S383-S385 VanDerWaalsContact C-N 3.34Å
384	L	62.8	Low	63.1	Low	46 Å²	46	61 Å²	61	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-76.5	-20.3	176.2	-71.6	153.9	0	0	0	113.4	L304 T306 V380 A381 H382	L304-L384 HydrophobicContact CB-CD2 4.07Å; L304-L384 HydrophobicContact CD2-CD1 3.5Å; L304-L384 HydrophobicContact CD2-CD2 3.61Å; L304-L384 HydrophobicContact CD2-CG 4.09Å; L304-L384 HydrophobicContact CG-CD2 4.45Å; T306-L384 HydrophobicContact CG2-CB 4.37Å; T306-L384 HydrophobicContact CG2-CD2 3.58Å; V380-L384 HydrophobicContact CG1-CD1 3.76Å; V380-L384 VanDerWaalsContact O-CD1 3.31Å; V380-L384 WeakPolarHBondContact O-CD1 3.3Å; V380-L384 WeakPolarHBondContact O-CG 3.43Å; V380-L384 PolarHBondContact O-N 2.81Å; A381-L384 PolarHBondContact O-N 3.5Å; H382-L384 VanDerWaalsContact C-N 3.28Å; H382-L384 PolarHBondContact O-N 3.25Å
385	S	62	Low	62.9	Low	26 Å²	26	61.4 Å²	61.4	18%	0.182	34%	0.336	C	S	.	.			trans	-121.4	52.5	-170.6	56.4	0	0	0	0	111.4	A381 H382 S383 S387 I388 K674	A381-S385 PolarHBondContact O-N 3.18Å; A381-S385 PolarHBondContact O-OG 2.93Å; H382-S385 PolarHBondContact O-N 3.01Å; S383-S385 VanDerWaalsContact C-N 3.34Å; S385-S387 PolarHBondContact O-N 3.25Å; S385-I388 PolarHBondContact O-N 3.24Å; S385-K674 VanDerWaalsContact CB-NZ 3.3Å; S385-K674 WeakPolarHBondContact OG-CE 3.44Å; S385-K674 PolarHBondContact OG-NZ 3.42Å
386	S	53	Low	62.9	Low	78 Å²	78	55.2 Å²	55.2	55%	0.545	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	6.3	-174	49.6	0	0	0	0	117.1
387	S	52.5	Low	63.5	Low	110 Å²	110	54.4 Å²	54.4	77%	0.769	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-8.6	-171.9	-35.5	0	0	0	0	115	S385	S385-S387 PolarHBondContact O-N 3.25Å
388	I	52.7	Low	64.3	Low	65 Å²	65	60.1 Å²	60.1	33%	0.333	33%	0.326	S	S	.	.	S	Bend	trans	-117	120.1	-174.1	-52.9	-176.6	0	0	0	109.2	S385 N392 E393	S385-I388 PolarHBondContact O-N 3.24Å; I388-N392 HydrophobicContact CG2-CB 3.67Å; I388-E393 HydrophobicContact CB-CG 4.36Å; I388-E393 HydrophobicContact CG2-CG 3.75Å
389	S	58.2	Low	65.2	Low	62 Å²	62	65.4 Å²	65.4	43%	0.434	35%	0.351	S	S	.	.			trans	-57.6	143.5	173.3	-178.9	0	0	0	0	110.2	E391 N392 E393	S389-E391 PolarHBondContact O-N 2.91Å; S389-E391 VanDerWaalsContact O-N 3.08Å; S389-N392 PolarHBondContact O-N 3.34Å; S389-E393 PolarHBondContact O-N 3.2Å
390	R	62.2	Low	66	Low	143 Å²	143	64.5 Å²	64.5	54%	0.54	34%	0.343	S	S	.	.	H	α-helix	trans	-52	-32.5	176.9	-170.2	179.3	176.3	120.6	-0.6	112.4	E393 L394	R390-E393 PolarHBondContact O-N 3.49Å; R390-L394 WeakPolarHBondContact O-CG 3.37Å; R390-L394 PolarHBondContact O-N 2.97Å
391	E	62.7	Low	66.7	Low	146 Å²	146	68.8 Å²	68.8	68%	0.682	36%	0.364	S	S	*	.	H	α-helix	trans	-65.4	-47.7	177.3	-67.5	171.8	176.8	0	0	111.9	S389 E393 L394 T395	S389-E391 PolarHBondContact O-N 2.91Å; S389-E391 VanDerWaalsContact O-N 3.08Å; E391-E393 VanDerWaalsContact C-N 3.25Å; E391-E393 PolarHBondContact O-N 3.34Å; E391-L394 PolarHBondContact O-N 3.47Å; E391-L394 VanDerWaalsContact O-N 3.14Å; E391-T395 PolarHBondContact O-N 3.05Å; E391-T395 VanDerWaalsContact O-N 3.17Å; E391-T395 PolarHBondContact O-OG1 3.35Å; E391-T395 VanDerWaalsContact O-OG1 3.04Å
392	N	66.9	Low	67.7	Low	91 Å²	91	72.9 Å²	72.9	49%	0.487	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-36.4	178.5	-69.4	-3.6	0	0	0	111.4	I388 S389 L394 T395 I396	I388-N392 HydrophobicContact CG2-CB 3.67Å; S389-N392 PolarHBondContact O-N 3.34Å; N392-L394 VanDerWaalsContact C-N 3.35Å; N392-T395 VanDerWaalsContact CA-OG1 3.29Å; N392-T395 WeakPolarHBondContact CA-OG1 3.33Å; N392-T395 PolarHBondContact O-N 3.2Å; N392-T395 PolarHBondContact O-OG1 2.91Å; N392-I396 WeakPolarHBondContact O-CG1 3.2Å; N392-I396 PolarHBondContact O-N 3.48Å
393	E	66.1	Low	68.3	Low	20 Å²	20	73.2 Å²	73.2	9%	0.093	40%	0.396	C	S	.	.	H	α-helix	trans	-62.3	-41.8	176.3	-61.2	-170.5	152.1	0	0	112.1	H382 I388 S389 R390 E391 I396 V397 K674	H382-E393 IonicContact CD2-OE2 2.7Å; I388-E393 HydrophobicContact CB-CG 4.36Å; I388-E393 HydrophobicContact CG2-CG 3.75Å; S389-E393 PolarHBondContact O-N 3.2Å; R390-E393 PolarHBondContact O-N 3.49Å; E391-E393 VanDerWaalsContact C-N 3.25Å; E391-E393 PolarHBondContact O-N 3.34Å; E393-I396 PolarHBondContact O-N 3.31Å; E393-V397 VanDerWaalsContact O-CG2 3.29Å; E393-V397 WeakPolarHBondContact O-CG2 3.31Å; E393-V397 PolarHBondContact O-N 3.42Å; E393-V397 VanDerWaalsContact O-N 3.1Å; E393-K674 IonicContact OE1-NZ 3.92Å; E393-K674 PolarHBondContact OE1-NZ 3.37Å
394	L	73.5	Confident	69	Low	67 Å²	67	80.4 Å²	80.4	35%	0.351	43%	0.428	S	S	.	.	H	α-helix	trans	-66	-42.4	179	-69.7	170	0	0	0	111.7	R390 E391 N392 I396 V397 E398 F678	R390-L394 WeakPolarHBondContact O-CG 3.37Å; R390-L394 PolarHBondContact O-N 2.97Å; E391-L394 PolarHBondContact O-N 3.47Å; E391-L394 VanDerWaalsContact O-N 3.14Å; N392-L394 VanDerWaalsContact C-N 3.35Å; L394-I396 VanDerWaalsContact C-N 3.31Å; L394-I396 PolarHBondContact O-N 3.06Å; L394-V397 WeakPolarHBondContact O-CB 3.38Å; L394-V397 PolarHBondContact O-N 3.35Å; L394-V397 VanDerWaalsContact O-N 3.09Å; L394-E398 WeakPolarHBondContact O-CG 3.45Å; L394-E398 PolarHBondContact O-N 3.29Å; L394-F678 HydrophobicContact CD2-CE2 3.7Å; L394-F678 HydrophobicContact CD2-CZ 3.82Å
395	T	76.3	Confident	69.9	Low	67 Å²	67	79.4 Å²	79.4	41%	0.411	42%	0.423	S	S	.	.	H	α-helix	trans	-58.1	-42.4	174.6	16	0	0	0	0	112.6	E391 N392 V397 E398 E399	E391-T395 PolarHBondContact O-N 3.05Å; E391-T395 VanDerWaalsContact O-N 3.17Å; E391-T395 PolarHBondContact O-OG1 3.35Å; E391-T395 VanDerWaalsContact O-OG1 3.04Å; N392-T395 VanDerWaalsContact CA-OG1 3.29Å; N392-T395 WeakPolarHBondContact CA-OG1 3.33Å; N392-T395 PolarHBondContact O-N 3.2Å; N392-T395 PolarHBondContact O-OG1 2.91Å; T395-V397 VanDerWaalsContact C-N 3.29Å; T395-V397 PolarHBondContact O-N 2.88Å; T395-E398 PolarHBondContact O-N 3.42Å; T395-E399 WeakPolarHBondContact O-CG 3.48Å; T395-E399 PolarHBondContact O-N 3.24Å
396	I	72.7	Confident	71.1	Confident	52 Å²	52	78.4 Å²	78.4	27%	0.267	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-38.9	177.4	-64	166	0	0	0	110.5	N392 E393 L394 E399 L400 I671	N392-I396 WeakPolarHBondContact O-CG1 3.2Å; N392-I396 PolarHBondContact O-N 3.48Å; E393-I396 PolarHBondContact O-N 3.31Å; L394-I396 VanDerWaalsContact C-N 3.31Å; L394-I396 PolarHBondContact O-N 3.06Å; I396-E399 PolarHBondContact O-N 3.03Å; I396-L400 HydrophobicContact CG2-CD1 4.32Å; I396-L400 VanDerWaalsContact O-CG 3.31Å; I396-L400 WeakPolarHBondContact O-CG 3Å; I396-L400 PolarHBondContact O-N 3.49Å; I396-L400 VanDerWaalsContact O-N 3.09Å; I396-I671 HydrophobicContact CG2-CD1 4.33Å; I396-I671 HydrophobicContact CG2-CG2 3.53Å
397	V	76.4	Confident	72.9	Confident	15 Å²	15	74.7 Å²	74.7	9%	0.091	39%	0.389	C	S	.	.	H	α-helix	trans	-64.1	-45	176.4	172	0	0	0	0	110.8	E393 L394 T395 E399 L400 M401 Y675 F678 L733	E393-V397 VanDerWaalsContact O-CG2 3.29Å; E393-V397 WeakPolarHBondContact O-CG2 3.31Å; E393-V397 PolarHBondContact O-N 3.42Å; E393-V397 VanDerWaalsContact O-N 3.1Å; L394-V397 WeakPolarHBondContact O-CB 3.38Å; L394-V397 PolarHBondContact O-N 3.35Å; L394-V397 VanDerWaalsContact O-N 3.09Å; T395-V397 VanDerWaalsContact C-N 3.29Å; T395-V397 PolarHBondContact O-N 2.88Å; V397-E399 PolarHBondContact O-N 3.45Å; V397-L400 PolarHBondContact O-N 2.99Å; V397-M401 HydrophobicContact CG1-CG 4.48Å; V397-M401 HydrophobicContact CG1-SD 4.44Å; V397-M401 WeakPolarHBondContact O-CG 3.16Å; V397-M401 PolarHBondContact O-N 3.32Å; V397-Y675 HydrophobicContact CG1-CD2 4.4Å; V397-Y675 HydrophobicContact CG1-CE2 4.12Å; V397-Y675 HydrophobicContact CG2-CD2 4.18Å; V397-F678 HydrophobicContact CG1-CD1 4Å; V397-F678 HydrophobicContact CG1-CE1 3.78Å; V397-F678 HydrophobicContact CG2-CD1 4.18Å; V397-F678 HydrophobicContact CG2-CG 4.42Å; V397-L733 HydrophobicContact CG1-CD1 3.63Å
398	E	80	Confident	74.7	Confident	128 Å²	128	69.4 Å²	69.4	60%	0.598	35%	0.353	S	S	*	.	H	α-helix	trans	-61.4	-42.5	177.9	-72.4	173.9	-177.5	0	0	111.9	L394 T395 L400 M401 S402	L394-E398 WeakPolarHBondContact O-CG 3.45Å; L394-E398 PolarHBondContact O-N 3.29Å; T395-E398 PolarHBondContact O-N 3.42Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 2.98Å; E398-M401 PolarHBondContact O-N 3.28Å; E398-S402 PolarHBondContact O-N 2.75Å
399	E	80.3	Confident	76.4	Confident	134 Å²	134	67 Å²	67	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-59.7	-43.8	174.2	-75.5	179.4	178.6	0	0	111.7	T395 I396 V397 M401 S402	T395-E399 WeakPolarHBondContact O-CG 3.48Å; T395-E399 PolarHBondContact O-N 3.24Å; I396-E399 PolarHBondContact O-N 3.03Å; V397-E399 PolarHBondContact O-N 3.45Å; E399-M401 VanDerWaalsContact C-N 3.34Å; E399-M401 PolarHBondContact O-N 2.94Å; E399-S402 WeakPolarHBondContact O-CB 3.45Å; E399-S402 PolarHBondContact O-N 3.37Å; E399-S402 PolarHBondContact O-OG 2.91Å
400	L	79.5	Confident	78	Confident	18 Å²	18	64 Å²	64	9%	0.094	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-38.2	176.9	-70.4	172.4	0	0	0	112.2	I396 V397 E398 S402 N403 L406 I667 I671 Y675	I396-L400 HydrophobicContact CG2-CD1 4.32Å; I396-L400 VanDerWaalsContact O-CG 3.31Å; I396-L400 WeakPolarHBondContact O-CG 3Å; I396-L400 PolarHBondContact O-N 3.49Å; I396-L400 VanDerWaalsContact O-N 3.09Å; V397-L400 PolarHBondContact O-N 2.99Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 2.98Å; L400-S402 PolarHBondContact O-N 2.94Å; L400-N403 PolarHBondContact O-N 3.25Å; L400-L406 HydrophobicContact CB-CD1 4.16Å; L400-L406 WeakPolarHBondContact O-CD1 3.21Å; L400-I667 HydrophobicContact CD2-CD1 3.71Å; L400-I667 HydrophobicContact CD2-CG1 3.86Å; L400-I671 HydrophobicContact CD1-CG2 4.03Å; L400-Y675 HydrophobicContact CD1-CD2 4Å; L400-Y675 HydrophobicContact CD1-CG 4.4Å
401	M	77.7	Confident	79.4	Confident	93 Å²	93	57.3 Å²	57.3	46%	0.458	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-24.2	178.1	-73.1	-169	74.8	0	0	113.6	V397 E398 E399 N403 L733	V397-M401 HydrophobicContact CG1-CG 4.48Å; V397-M401 HydrophobicContact CG1-SD 4.44Å; V397-M401 WeakPolarHBondContact O-CG 3.16Å; V397-M401 PolarHBondContact O-N 3.32Å; E398-M401 PolarHBondContact O-N 3.28Å; E399-M401 VanDerWaalsContact C-N 3.34Å; E399-M401 PolarHBondContact O-N 2.94Å; M401-N403 PolarHBondContact O-N 3.13Å; M401-L733 HydrophobicContact CE-CB 3.82Å; M401-L733 HydrophobicContact CE-CD1 4.24Å; M401-L733 HydrophobicContact CG-CD1 3.93Å; M401-L733 HydrophobicContact SD-CB 4.11Å; M401-L733 HydrophobicContact SD-CD1 3.4Å; M401-L733 WeakPolarHBondContact SD-CD1 3.42Å; M401-L733 HydrophobicContact SD-CG 4.37Å
402	S	79.1	Confident	80.5	Confident	91 Å²	91	50.7 Å²	50.7	64%	0.636	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.1	178.6	75.4	0	0	0	0	113.4	E398 E399 L400 Q404	E398-S402 PolarHBondContact O-N 2.75Å; E399-S402 WeakPolarHBondContact O-CB 3.45Å; E399-S402 PolarHBondContact O-N 3.37Å; E399-S402 PolarHBondContact O-OG 2.91Å; L400-S402 PolarHBondContact O-N 2.94Å; S402-Q404 PolarHBondContact O-N 3.13Å
403	N	79.3	Confident	81.5	Confident	67 Å²	67	46.9 Å²	46.9	36%	0.358	25%	0.245	S	C	.	.			trans	-79.6	119.5	-178.7	-67.8	-29.2	0	0	0	112.1	L400 M401 N405 L406 Q409	L400-N403 PolarHBondContact O-N 3.25Å; M401-N403 PolarHBondContact O-N 3.13Å; N403-N405 PolarHBondContact O-N 3.44Å; N403-N405 VanDerWaalsContact O-N 3.1Å; N403-L406 PolarHBondContact O-N 2.96Å; N403-Q409 PolarHBondContact ND2-OE1 2.98Å
404	Q	74.4	Confident	82.5	Confident	169 Å²	169	45.9 Å²	45.9	79%	0.79	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.4	-178.6	-66.4	-177.8	7.4	0	0	114.7	S402	S402-Q404 PolarHBondContact O-N 3.13Å
405	N	82.4	Confident	82.9	Confident	26 Å²	26	43 Å²	43	14%	0.139	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	41.1	179.2	-72.4	-41.7	0	0	0	112	N403 F407 A408 Q409 E660	N403-N405 PolarHBondContact O-N 3.44Å; N403-N405 VanDerWaalsContact O-N 3.1Å; N405-F407 VanDerWaalsContact C-N 3.26Å; N405-F407 PolarHBondContact O-N 2.73Å; N405-F407 VanDerWaalsContact O-N 3.14Å; N405-A408 HydrophobicContact CB-CB 4.22Å; N405-A408 WeakPolarHBondContact O-CB 3.42Å; N405-A408 PolarHBondContact O-N 2.87Å; N405-Q409 PolarHBondContact O-N 3.46Å; N405-Q409 VanDerWaalsContact O-N 3.12Å; N405-E660 HydrophobicContact CB-CG 4.4Å
406	L	88	Confident	83.1	Confident	4 Å²	4	42 Å²	42	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-50.1	-42.1	-175.8	177.8	57.4	0	0	0	113.6	L400 N403 A408 Q409 L410 I667 Y675 E732	L400-L406 HydrophobicContact CB-CD1 4.16Å; L400-L406 WeakPolarHBondContact O-CD1 3.21Å; N403-L406 PolarHBondContact O-N 2.96Å; L406-A408 PolarHBondContact O-N 3.3Å; L406-Q409 WeakPolarHBondContact O-CB 3.36Å; L406-Q409 PolarHBondContact O-N 3.48Å; L406-L410 HydrophobicContact CD1-CD1 4.32Å; L406-L410 HydrophobicContact CD1-CG 4.13Å; L406-L410 HydrophobicContact CG-CD1 4.05Å; L406-L410 HydrophobicContact CG-CG 4.35Å; L406-L410 VanDerWaalsContact O-CG 3.32Å; L406-L410 WeakPolarHBondContact O-CG 3.27Å; L406-L410 PolarHBondContact O-N 3.27Å; L406-I667 HydrophobicContact CD1-CD1 4.5Å; L406-Y675 VanDerWaalsContact CD2-OH 3.3Å; L406-Y675 WeakPolarHBondContact CD2-OH 3.49Å; L406-E732 HydrophobicContact CB-CG 4.38Å
407	F	90.8	Very high	83.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-42	177.8	179.5	-110.4	0	0	0	113.7	N405 Q409 L410 V411 A426 V429 L430 L653 R728 C731	N405-F407 VanDerWaalsContact C-N 3.26Å; N405-F407 PolarHBondContact O-N 2.73Å; N405-F407 VanDerWaalsContact O-N 3.14Å; F407-Q409 VanDerWaalsContact C-N 3.25Å; F407-Q409 PolarHBondContact O-N 3.05Å; F407-L410 PolarHBondContact O-N 3.22Å; F407-V411 HydrophobicContact CD1-CG2 4.38Å; F407-V411 HydrophobicContact CD2-CG2 4.32Å; F407-V411 HydrophobicContact CE1-CG2 4.07Å; F407-V411 HydrophobicContact CE2-CG2 3.99Å; F407-V411 HydrophobicContact CZ-CG2 3.86Å; F407-V411 VanDerWaalsContact O-CG2 3.27Å; F407-V411 WeakPolarHBondContact O-CG2 3.45Å; F407-V411 PolarHBondContact O-N 2.91Å; F407-A426 HydrophobicContact CE1-CB 4.26Å; F407-A426 HydrophobicContact CZ-CB 3.99Å; F407-V429 HydrophobicContact CE2-CG1 4.37Å; F407-L430 HydrophobicContact CE2-CD2 3.62Å; F407-L430 HydrophobicContact CE2-CG 3.94Å; F407-L430 HydrophobicContact CZ-CD1 4.24Å; F407-L430 HydrophobicContact CZ-CD2 3.96Å; F407-L430 HydrophobicContact CZ-CG 3.95Å; F407-L653 HydrophobicContact CD1-CD1 3.84Å; F407-L653 HydrophobicContact CE1-CD1 3.81Å; F407-L653 HydrophobicContact CE1-CD2 4.15Å; F407-R728 VanDerWaalsContact CB-NH2 3.26Å; F407-R728 VanDerWaalsContact CD1-CZ 3.44Å; F407-C731 HydrophobicContact CD2-CB 4.02Å
408	A	89.6	Confident	83.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.4	-38.6	176.5	0	0	0	0	0	110.8	N405 L406 V411 A412 R656 I657 E660	N405-A408 HydrophobicContact CB-CB 4.22Å; N405-A408 WeakPolarHBondContact O-CB 3.42Å; N405-A408 PolarHBondContact O-N 2.87Å; L406-A408 PolarHBondContact O-N 3.3Å; A408-V411 PolarHBondContact O-N 3.34Å; A408-A412 WeakPolarHBondContact O-CB 3.42Å; A408-A412 PolarHBondContact O-N 3.15Å; A408-R656 HydrophobicContact CB-CB 4.17Å; A408-I657 HydrophobicContact CB-CG1 4.03Å; A408-E660 HydrophobicContact CB-CB 4.43Å; A408-E660 HydrophobicContact CB-CG 3.79Å
409	Q	88.8	Confident	83.5	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.065	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-42.3	174.1	-169.3	-173	8	0	0	112.5	N403 N405 L406 F407 V411 A412 S413 C665 I667	N403-Q409 PolarHBondContact ND2-OE1 2.98Å; N405-Q409 PolarHBondContact O-N 3.46Å; N405-Q409 VanDerWaalsContact O-N 3.12Å; L406-Q409 WeakPolarHBondContact O-CB 3.36Å; L406-Q409 PolarHBondContact O-N 3.48Å; F407-Q409 VanDerWaalsContact C-N 3.25Å; F407-Q409 PolarHBondContact O-N 3.05Å; Q409-V411 VanDerWaalsContact C-N 3.32Å; Q409-V411 PolarHBondContact O-N 3.08Å; Q409-A412 PolarHBondContact O-N 2.95Å; Q409-S413 VanDerWaalsContact O-CB 3.3Å; Q409-S413 WeakPolarHBondContact O-CB 3.46Å; Q409-S413 PolarHBondContact O-N 2.75Å; Q409-S413 PolarHBondContact O-OG 3.03Å; Q409-C665 WeakPolarHBondContact CG-O 3.45Å; Q409-C665 PolarHBondContact NE2-O 3.02Å; Q409-I667 HydrophobicContact CG-CD1 4.21Å; Q409-I667 HydrophobicContact CG-CG1 4.41Å
410	L	90.7	Very high	83.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-42.3	175.2	-71.3	167.4	0	0	0	111	L406 F407 S413 F414 F433 I667 F672 Y675 C731	L406-L410 HydrophobicContact CD1-CD1 4.32Å; L406-L410 HydrophobicContact CD1-CG 4.13Å; L406-L410 HydrophobicContact CG-CD1 4.05Å; L406-L410 HydrophobicContact CG-CG 4.35Å; L406-L410 VanDerWaalsContact O-CG 3.32Å; L406-L410 WeakPolarHBondContact O-CG 3.27Å; L406-L410 PolarHBondContact O-N 3.27Å; F407-L410 PolarHBondContact O-N 3.22Å; L410-S413 PolarHBondContact O-N 3.42Å; L410-F414 WeakPolarHBondContact O-CB 3.42Å; L410-F414 PolarHBondContact O-N 2.98Å; L410-F433 HydrophobicContact CD1-CE2 4.45Å; L410-F433 HydrophobicContact CD1-CZ 4.2Å; L410-I667 HydrophobicContact CD2-CD1 3.59Å; L410-I667 HydrophobicContact CG-CD1 4.24Å; L410-F672 HydrophobicContact CB-CZ 4.1Å; L410-F672 HydrophobicContact CD2-CD2 3.86Å; L410-F672 HydrophobicContact CD2-CE1 4.43Å; L410-F672 HydrophobicContact CD2-CE2 3.6Å; L410-F672 HydrophobicContact CD2-CG 4.44Å; L410-F672 HydrophobicContact CD2-CZ 3.9Å; L410-F672 WeakPolarHBondContact O-CE1 3.24Å; L410-Y675 HydrophobicContact CD1-CD1 4.49Å; L410-Y675 HydrophobicContact CD1-CE1 3.95Å; L410-Y675 HydrophobicContact CD2-CD1 4.2Å; L410-Y675 HydrophobicContact CD2-CE1 4.38Å; L410-C731 HydrophobicContact CD1-CB 4.43Å
411	V	91.3	Very high	83.6	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-69.1	-37.1	177.4	177.1	0	0	0	0	112	F407 A408 Q409 S413 F414 K425 A426 V429 I657	F407-V411 HydrophobicContact CD1-CG2 4.38Å; F407-V411 HydrophobicContact CD2-CG2 4.32Å; F407-V411 HydrophobicContact CE1-CG2 4.07Å; F407-V411 HydrophobicContact CE2-CG2 3.99Å; F407-V411 HydrophobicContact CZ-CG2 3.86Å; F407-V411 VanDerWaalsContact O-CG2 3.27Å; F407-V411 WeakPolarHBondContact O-CG2 3.45Å; F407-V411 PolarHBondContact O-N 2.91Å; A408-V411 PolarHBondContact O-N 3.34Å; Q409-V411 VanDerWaalsContact C-N 3.32Å; Q409-V411 PolarHBondContact O-N 3.08Å; V411-S413 VanDerWaalsContact C-N 3.34Å; V411-F414 WeakPolarHBondContact O-CB 3.28Å; V411-F414 PolarHBondContact O-N 3.07Å; V411-K425 HydrophobicContact CG1-CB 3.76Å; V411-A426 HydrophobicContact CG1-CB 4.19Å; V411-A426 HydrophobicContact CG2-CB 3.98Å; V411-V429 HydrophobicContact CG2-CB 4.37Å; V411-V429 HydrophobicContact CG2-CG2 4.31Å; V411-I657 HydrophobicContact CB-CD1 4.38Å; V411-I657 HydrophobicContact CB-CG1 4.43Å; V411-I657 HydrophobicContact CG1-CD1 3.89Å; V411-I657 HydrophobicContact CG1-CG1 4.32Å; V411-I657 HydrophobicContact CG1-CG2 4.11Å
412	A	86.7	Confident	84.1	Confident	8 Å²	8	29.7 Å²	29.7	7%	0.066	16%	0.164	C	C	.	.	H	α-helix	trans	-65.9	-38.5	173	0	0	0	0	0	111.9	A408 Q409 F414 E660 V661	A408-A412 WeakPolarHBondContact O-CB 3.42Å; A408-A412 PolarHBondContact O-N 3.15Å; Q409-A412 PolarHBondContact O-N 2.95Å; A412-F414 VanDerWaalsContact C-N 3.28Å; A412-F414 PolarHBondContact O-N 3.06Å; A412-E660 HydrophobicContact CB-CB 4.36Å; A412-V661 HydrophobicContact CB-CG2 3.59Å
413	S	87.3	Confident	84.6	Confident	10 Å²	10	26.4 Å²	26.4	7%	0.07	14%	0.139	C	C	.	.	H	α-helix	trans	-71.9	-22.8	176.8	-55.4	0	0	0	0	112.6	Q409 L410 V411 C415 I667	Q409-S413 VanDerWaalsContact O-CB 3.3Å; Q409-S413 WeakPolarHBondContact O-CB 3.46Å; Q409-S413 PolarHBondContact O-N 2.75Å; Q409-S413 PolarHBondContact O-OG 3.03Å; L410-S413 PolarHBondContact O-N 3.42Å; V411-S413 VanDerWaalsContact C-N 3.34Å; S413-C415 PolarHBondContact O-N 2.73Å; S413-I667 PolarHBondContact OG-N 3.4Å
414	F	86.8	Confident	85.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-69.9	111.9	175.9	-176.6	-89.8	0	0	0	110.8	L410 V411 A412 K425 L428 V429 L432 L476 A479 C480 L483 F672	L410-F414 WeakPolarHBondContact O-CB 3.42Å; L410-F414 PolarHBondContact O-N 2.98Å; V411-F414 WeakPolarHBondContact O-CB 3.28Å; V411-F414 PolarHBondContact O-N 3.07Å; A412-F414 VanDerWaalsContact C-N 3.28Å; A412-F414 PolarHBondContact O-N 3.06Å; F414-K425 HydrophobicContact CD1-CB 3.82Å; F414-K425 HydrophobicContact CD1-CD 4.17Å; F414-K425 HydrophobicContact CD1-CG 3.8Å; F414-K425 HydrophobicContact CE1-CB 4.44Å; F414-K425 HydrophobicContact CE1-CG 4.26Å; F414-K425 PolarHBondContact O-NZ 3.45Å; F414-K425 VanDerWaalsContact O-NZ 3.13Å; F414-L428 HydrophobicContact CE1-CB 4.17Å; F414-L428 HydrophobicContact CE1-CD1 3.87Å; F414-L428 HydrophobicContact CE2-CB 4.49Å; F414-L428 HydrophobicContact CZ-CB 3.93Å; F414-L428 HydrophobicContact CZ-CD1 3.97Å; F414-V429 HydrophobicContact CB-CG2 3.6Å; F414-V429 HydrophobicContact CD1-CG2 4.44Å; F414-V429 HydrophobicContact CD2-CG2 3.59Å; F414-V429 HydrophobicContact CE2-CG2 4.44Å; F414-V429 HydrophobicContact CG-CG2 3.62Å; F414-L432 HydrophobicContact CE2-CD1 4.26Å; F414-L476 HydrophobicContact CE1-CD2 3.81Å; F414-A479 HydrophobicContact CZ-CB 4.33Å; F414-C480 VanDerWaalsContact CZ-SG 3.52Å; F414-L483 HydrophobicContact CD2-CD1 3.31Å; F414-L483 HydrophobicContact CE2-CD1 3.65Å; F414-L483 HydrophobicContact CG-CD1 4.3Å; F414-F672 HydrophobicContact CB-CE1 4.33Å
415	C	83.4	Confident	86	Confident	7 Å²	7	15.7 Å²	15.7	5%	0.047	9%	0.086	C	C	.	.			trans	50.4	71.2	177	-163.4	0	0	0	0	112.7	S413 T417 I418 K425 H475 A479	S413-C415 PolarHBondContact O-N 2.73Å; C415-T417 PolarHBondContact O-N 3Å; C415-T417 VanDerWaalsContact O-N 3.15Å; C415-T417 PolarHBondContact SG-OG1 3.49Å; C415-I418 PolarHBondContact O-N 3.01Å; C415-K425 PolarHBondContact O-NZ 3Å; C415-H475 VanDerWaalsContact SG-CD2 3.53Å; C415-A479 HydrophobicContact CB-CB 3.83Å
416	P	79.7	Confident	86.5	Confident	44 Å²	44	14.5 Å²	14.5	29%	0.286	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.1	-175.5	32.7	-37.9	0	0	0	112.3	I418 H620 Y632 L666	P416-I418 PolarHBondContact O-N 3.29Å; P416-H620 PolarHBondContact O-CE1 2.92Å; P416-H620 PolarHBondContact O-NE2 3.22Å; P416-Y632 WeakPolarHBondContact CB-OH 3.22Å; P416-L666 HydrophobicContact CB-CD1 3.91Å; P416-L666 HydrophobicContact CG-CD1 4.46Å
417	T	79.5	Confident	86.7	Confident	51 Å²	51	14.3 Å²	14.3	31%	0.313	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.3	173.6	52.8	0	0	0	0	113.5	C415 H475 H620 L624	C415-T417 PolarHBondContact O-N 3Å; C415-T417 VanDerWaalsContact O-N 3.15Å; C415-T417 PolarHBondContact SG-OG1 3.49Å; T417-H475 PolarHBondContact OG1-CD2 2.95Å; T417-H475 PolarHBondContact OG1-NE2 3.49Å; T417-H620 PolarHBondContact O-CD2 3.34Å; T417-L624 HydrophobicContact CG2-CD2 4.18Å; T417-L624 WeakPolarHBondContact O-CD1 3.49Å
418	I	79.4	Confident	86.9	Confident	8 Å²	8	14.3 Å²	14.3	4%	0.041	8%	0.079	C	C	.	.	S	Bend	trans	-100.1	118.6	-178	-62.2	174.6	0	0	0	109.2	C415 P416 K425 R472 H475 L476	C415-I418 PolarHBondContact O-N 3.01Å; P416-I418 PolarHBondContact O-N 3.29Å; I418-K425 WeakPolarHBondContact O-CE 3.28Å; I418-K425 PolarHBondContact O-NZ 3.49Å; I418-R472 HydrophobicContact CD1-CG 4.41Å; I418-R472 HydrophobicContact CG2-CG 4.13Å; I418-H475 HydrophobicContact CD1-CB 4.22Å; I418-L476 HydrophobicContact CD1-CD1 4.45Å; I418-L476 HydrophobicContact CD1-CD2 3.84Å; I418-L476 HydrophobicContact CD1-CG 3.6Å
419	Y	79.5	Confident	87.1	Confident	62 Å²	62	14.3 Å²	14.3	24%	0.243	8%	0.079	C	C	.	.			trans	-75.1	138.1	171.1	-175	-100.1	0	0	0	111.1	R472 R616 I617 H620	Y419-R472 PolarHBondContact O-NH2 2.87Å; Y419-R616 HydrophobicContact CD1-CB 4.15Å; Y419-R616 HydrophobicContact CE1-CB 3.56Å; Y419-R616 HydrophobicContact CE1-CG 4.44Å; Y419-R616 VanDerWaalsContact OH-CD 3.23Å; Y419-R616 WeakPolarHBondContact OH-CD 3.27Å; Y419-I617 HydrophobicContact CD1-CG1 4.03Å; Y419-H620 HydrophobicContact CD2-CB 4.3Å; Y419-H620 HydrophobicContact CG-CB 4.31Å
420	G	79.8	Confident	87.4	Confident	12 Å²	12	13.6 Å²	13.6	12%	0.124	8%	0.076	C	C	.	.	S	Bend	trans	77.3	-156.4	174.3	0	0	0	0	0	115.4	H422 K425	G420-H422 PolarHBondContact O-N 3.25Å; G420-K425 WeakPolarHBondContact O-CE 3.35Å
421	E	81.7	Confident	87.6	Confident	30 Å²	30	13.6 Å²	13.6	14%	0.14	8%	0.076	C	C	.	.			trans	49.3	41.7	-176.7	-58.2	-51.4	137.1	0	0	114.1	M423 V424 K425 L605 R613	E421-M423 PolarHBondContact O-N 3.48Å; E421-M423 VanDerWaalsContact O-N 3.14Å; E421-V424 HydrophobicContact CB-CB 4.27Å; E421-V424 HydrophobicContact CB-CG2 4.19Å; E421-V424 PolarHBondContact O-N 2.96Å; E421-V424 VanDerWaalsContact O-N 3.09Å; E421-K425 PolarHBondContact O-N 3.22Å; E421-L605 HydrophobicContact CG-CD2 4.16Å; E421-R613 IonicContact OE1-CZ 3.82Å; E421-R613 IonicContact OE1-NH2 3.28Å; E421-R613 PolarHBondContact OE1-NH2 3.43Å
422	H	87.6	Confident	87.6	Confident	20 Å²	20	13.8 Å²	13.8	9%	0.093	8%	0.077	C	C	.	.	H	α-helix	trans	-54.7	-35.5	-175.6	-56.7	-61.1	0	0	0	113.4	G420 A426 I657	G420-H422 PolarHBondContact O-N 3.25Å; H422-A426 VanDerWaalsContact O-CB 3.32Å; H422-A426 WeakPolarHBondContact O-CB 3.42Å; H422-A426 PolarHBondContact O-N 3.22Å; H422-I657 HydrophobicContact CB-CB 4.33Å; H422-I657 HydrophobicContact CB-CD1 3.95Å; H422-I657 HydrophobicContact CB-CG2 3.92Å; H422-I657 WeakPolarHBondContact ND1-CG2 3.37Å
423	M	89.6	Confident	87.9	Confident	22 Å²	22	13.4 Å²	13.4	11%	0.108	7%	0.073	C	C	.	.	H	α-helix	trans	-71.6	-38.9	179.7	-62.2	-58.7	153.6	0	0	112.8	E421 A426 A427 F603 L653 K654 E747 I748 S751	E421-M423 PolarHBondContact O-N 3.48Å; E421-M423 VanDerWaalsContact O-N 3.14Å; M423-A426 PolarHBondContact O-N 3.49Å; M423-A427 PolarHBondContact O-N 2.98Å; M423-F603 HydrophobicContact CB-CE1 4.37Å; M423-L653 HydrophobicContact CE-CB 4.36Å; M423-L653 HydrophobicContact CE-CD2 4.4Å; M423-L653 HydrophobicContact CE-CG 4.36Å; M423-L653 HydrophobicContact SD-CD2 4.15Å; M423-K654 HydrophobicContact CE-CB 3.49Å; M423-K654 VanDerWaalsContact CE-CB 3.49Å; M423-K654 HydrophobicContact CE-CG 4.12Å; M423-E747 HydrophobicContact CE-CG 4.28Å; M423-E747 VanDerWaalsContact CE-OE1 3.3Å; M423-E747 WeakPolarHBondContact CE-OE1 3.46Å; M423-I748 HydrophobicContact SD-CG1 3.98Å; M423-S751 VanDerWaalsContact CB-OG 3.22Å; M423-S751 WeakPolarHBondContact CB-OG 3.49Å; M423-S751 WeakPolarHBondContact CG-OG 3.18Å
424	V	90.6	Very high	88	Confident	2 Å²	2	13.2 Å²	13.2	1%	0.012	7%	0.073	C	C	.	.	H	α-helix	trans	-64.3	-46.8	174.9	-175.5	0	0	0	0	109.5	E421 A426 A427 L428 I451 L476 F603 L605	E421-V424 HydrophobicContact CB-CB 4.27Å; E421-V424 HydrophobicContact CB-CG2 4.19Å; E421-V424 PolarHBondContact O-N 2.96Å; E421-V424 VanDerWaalsContact O-N 3.09Å; V424-A426 VanDerWaalsContact C-N 3.32Å; V424-A426 PolarHBondContact O-N 2.96Å; V424-A427 PolarHBondContact O-N 3.15Å; V424-L428 HydrophobicContact CG1-CD1 4.16Å; V424-L428 HydrophobicContact CG1-CG 4.5Å; V424-L428 VanDerWaalsContact O-CG 3.32Å; V424-L428 WeakPolarHBondContact O-CG 3.49Å; V424-L428 PolarHBondContact O-N 3.24Å; V424-I451 HydrophobicContact CG1-CD1 4.11Å; V424-L476 HydrophobicContact CG1-CD1 4.38Å; V424-F603 HydrophobicContact CB-CD2 4.49Å; V424-F603 HydrophobicContact CB-CG 4.48Å; V424-F603 HydrophobicContact CG1-CD2 4.17Å; V424-F603 HydrophobicContact CG1-CG 4.41Å; V424-F603 HydrophobicContact CG2-CB 4.16Å; V424-F603 HydrophobicContact CG2-CD1 3.76Å; V424-F603 HydrophobicContact CG2-CD2 4.28Å; V424-F603 HydrophobicContact CG2-CE1 4.18Å; V424-F603 HydrophobicContact CG2-CG 3.8Å; V424-L605 HydrophobicContact CG2-CD2 4.09Å
425	K	91.9	Very high	88	Confident	9 Å²	9	13.3 Å²	13.3	4%	0.039	7%	0.073	C	C	.	.	H	α-helix	trans	-59.3	-43	175.6	-65.1	-174	177.9	-161.7	0	111.9	V411 F414 C415 I418 G420 E421 A427 L428 V429 L476	V411-K425 HydrophobicContact CG1-CB 3.76Å; F414-K425 HydrophobicContact CD1-CB 3.82Å; F414-K425 HydrophobicContact CD1-CD 4.17Å; F414-K425 HydrophobicContact CD1-CG 3.8Å; F414-K425 HydrophobicContact CE1-CB 4.44Å; F414-K425 HydrophobicContact CE1-CG 4.26Å; F414-K425 PolarHBondContact O-NZ 3.45Å; F414-K425 VanDerWaalsContact O-NZ 3.13Å; C415-K425 PolarHBondContact O-NZ 3Å; I418-K425 WeakPolarHBondContact O-CE 3.28Å; I418-K425 PolarHBondContact O-NZ 3.49Å; G420-K425 WeakPolarHBondContact O-CE 3.35Å; E421-K425 PolarHBondContact O-N 3.22Å; K425-A427 PolarHBondContact O-N 3.34Å; K425-L428 PolarHBondContact O-N 3.31Å; K425-V429 VanDerWaalsContact O-CG2 3.32Å; K425-V429 WeakPolarHBondContact O-CG2 3.25Å; K425-V429 PolarHBondContact O-N 3.4Å; K425-L476 HydrophobicContact CG-CD2 4.32Å
426	A	93.5	Very high	88.1	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.3	-48.4	177.4	0	0	0	0	0	111.9	F407 V411 H422 M423 V424 L428 V429 L430 I748	F407-A426 HydrophobicContact CE1-CB 4.26Å; F407-A426 HydrophobicContact CZ-CB 3.99Å; V411-A426 HydrophobicContact CG1-CB 4.19Å; V411-A426 HydrophobicContact CG2-CB 3.98Å; H422-A426 VanDerWaalsContact O-CB 3.32Å; H422-A426 WeakPolarHBondContact O-CB 3.42Å; H422-A426 PolarHBondContact O-N 3.22Å; M423-A426 PolarHBondContact O-N 3.49Å; V424-A426 VanDerWaalsContact C-N 3.32Å; V424-A426 PolarHBondContact O-N 2.96Å; A426-L428 PolarHBondContact O-N 3.38Å; A426-V429 PolarHBondContact O-N 3.07Å; A426-L430 VanDerWaalsContact O-CG 3.28Å; A426-L430 WeakPolarHBondContact O-CG 3.42Å; A426-L430 PolarHBondContact O-N 2.89Å; A426-I748 HydrophobicContact CB-CD1 3.82Å; A426-I748 HydrophobicContact CB-CG1 4.26Å
427	A	93.1	Very high	87.8	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65	-39	177.3	0	0	0	0	0	113.3	M423 V424 K425 L430 S431 F603 I748	M423-A427 PolarHBondContact O-N 2.98Å; V424-A427 PolarHBondContact O-N 3.15Å; K425-A427 PolarHBondContact O-N 3.34Å; A427-L430 PolarHBondContact O-N 3.16Å; A427-S431 PolarHBondContact O-N 2.89Å; A427-F603 HydrophobicContact CB-CE2 3.33Å; A427-F603 HydrophobicContact CB-CZ 3.49Å; A427-F603 VanDerWaalsContact CB-CZ 3.49Å; A427-I748 HydrophobicContact CB-CG2 4.02Å
428	L	94.1	Very high	87.2	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.6	-44.4	175.3	-70	174.4	0	0	0	111.3	F414 V424 K425 A426 L430 S431 L432 V449 I451 L476 I569	F414-L428 HydrophobicContact CE1-CB 4.17Å; F414-L428 HydrophobicContact CE1-CD1 3.87Å; F414-L428 HydrophobicContact CE2-CB 4.49Å; F414-L428 HydrophobicContact CZ-CB 3.93Å; F414-L428 HydrophobicContact CZ-CD1 3.97Å; V424-L428 HydrophobicContact CG1-CD1 4.16Å; V424-L428 HydrophobicContact CG1-CG 4.5Å; V424-L428 VanDerWaalsContact O-CG 3.32Å; V424-L428 WeakPolarHBondContact O-CG 3.49Å; V424-L428 PolarHBondContact O-N 3.24Å; K425-L428 PolarHBondContact O-N 3.31Å; A426-L428 PolarHBondContact O-N 3.38Å; L428-L430 PolarHBondContact O-N 3.21Å; L428-S431 WeakPolarHBondContact O-CB 3.22Å; L428-S431 PolarHBondContact O-N 2.67Å; L428-S431 VanDerWaalsContact O-N 3.13Å; L428-S431 PolarHBondContact O-OG 3.25Å; L428-L432 PolarHBondContact O-N 2.98Å; L428-V449 HydrophobicContact CD2-CB 4.37Å; L428-V449 HydrophobicContact CD2-CG1 4.14Å; L428-I451 HydrophobicContact CD1-CD1 4.36Å; L428-I451 HydrophobicContact CD2-CD1 4.35Å; L428-L476 HydrophobicContact CD1-CB 4.14Å; L428-L476 HydrophobicContact CD1-CD2 4Å; L428-L476 HydrophobicContact CD1-CG 4.47Å; L428-I569 HydrophobicContact CD2-CD1 4.16Å; L428-I569 HydrophobicContact CD2-CG2 3.5Å
429	V	94.4	Very high	86.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.3	-48.7	174.5	171.9	0	0	0	0	110.6	F407 V411 F414 K425 A426 S431 L432 F433 F672	F407-V429 HydrophobicContact CE2-CG1 4.37Å; V411-V429 HydrophobicContact CG2-CB 4.37Å; V411-V429 HydrophobicContact CG2-CG2 4.31Å; F414-V429 HydrophobicContact CB-CG2 3.6Å; F414-V429 HydrophobicContact CD1-CG2 4.44Å; F414-V429 HydrophobicContact CD2-CG2 3.59Å; F414-V429 HydrophobicContact CE2-CG2 4.44Å; F414-V429 HydrophobicContact CG-CG2 3.62Å; K425-V429 VanDerWaalsContact O-CG2 3.32Å; K425-V429 WeakPolarHBondContact O-CG2 3.25Å; K425-V429 PolarHBondContact O-N 3.4Å; A426-V429 PolarHBondContact O-N 3.07Å; V429-S431 PolarHBondContact O-N 3.2Å; V429-L432 WeakPolarHBondContact O-CB 3.49Å; V429-L432 PolarHBondContact O-N 2.86Å; V429-F433 HydrophobicContact CG1-CD2 4.04Å; V429-F433 HydrophobicContact CG1-CE2 3.71Å; V429-F433 VanDerWaalsContact O-CD2 3.31Å; V429-F433 WeakPolarHBondContact O-CD2 3.16Å; V429-F433 PolarHBondContact O-N 3.15Å; V429-F672 HydrophobicContact CG1-CZ 4.18Å; V429-F672 HydrophobicContact CG2-CZ 4.24Å
430	L	94.8	Very high	84.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56	-36.9	176.2	-68.1	173.3	0	0	0	112.1	F407 A426 A427 L428 L432 F433 G434 L724 A727 R728 I748	F407-L430 HydrophobicContact CE2-CD2 3.62Å; F407-L430 HydrophobicContact CE2-CG 3.94Å; F407-L430 HydrophobicContact CZ-CD1 4.24Å; F407-L430 HydrophobicContact CZ-CD2 3.96Å; F407-L430 HydrophobicContact CZ-CG 3.95Å; A426-L430 VanDerWaalsContact O-CG 3.28Å; A426-L430 WeakPolarHBondContact O-CG 3.42Å; A426-L430 PolarHBondContact O-N 2.89Å; A427-L430 PolarHBondContact O-N 3.16Å; L428-L430 PolarHBondContact O-N 3.21Å; L430-L432 VanDerWaalsContact C-N 3.29Å; L430-L432 PolarHBondContact O-N 3.38Å; L430-F433 PolarHBondContact O-N 2.86Å; L430-G434 PolarHBondContact O-N 3.14Å; L430-L724 HydrophobicContact CB-CD2 4.25Å; L430-L724 HydrophobicContact CD1-CD2 3.98Å; L430-A727 HydrophobicContact CB-CB 4.31Å; L430-A727 HydrophobicContact CD2-CB 4.12Å; L430-R728 VanDerWaalsContact CD2-CA 3.46Å; L430-R728 HydrophobicContact CD2-CB 3.82Å; L430-I748 HydrophobicContact CD1-CD1 3.77Å
431	S	93.8	Very high	83.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-28.9	178.7	82.7	0	0	0	0	114.5	A427 L428 V429 S567 I569	A427-S431 PolarHBondContact O-N 2.89Å; L428-S431 WeakPolarHBondContact O-CB 3.22Å; L428-S431 PolarHBondContact O-N 2.67Å; L428-S431 VanDerWaalsContact O-N 3.13Å; L428-S431 PolarHBondContact O-OG 3.25Å; V429-S431 PolarHBondContact O-N 3.2Å; S431-S567 PolarHBondContact O-OG 2.85Å; S431-I569 WeakPolarHBondContact OG-CD1 3.37Å
432	L	92.3	Very high	82.1	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-75	-34.8	177.5	-64.3	175.8	0	0	0	112	F414 L428 V429 L430 L483 C526 I676 R680	F414-L432 HydrophobicContact CE2-CD1 4.26Å; L428-L432 PolarHBondContact O-N 2.98Å; V429-L432 WeakPolarHBondContact O-CB 3.49Å; V429-L432 PolarHBondContact O-N 2.86Å; L430-L432 VanDerWaalsContact C-N 3.29Å; L430-L432 PolarHBondContact O-N 3.38Å; L432-L483 HydrophobicContact CD1-CB 4.11Å; L432-C526 HydrophobicContact CD2-CB 4.16Å; L432-I676 HydrophobicContact CB-CD1 4.18Å; L432-I676 HydrophobicContact CB-CG2 4.45Å; L432-I676 HydrophobicContact CD1-CD1 4.08Å; L432-R680 WeakPolarHBondContact O-CD 2.93Å; L432-R680 PolarHBondContact O-NH1 3.16Å
433	F	92.1	Very high	81.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-77.6	-38.1	175.9	-73.3	-85.7	0	0	0	112.6	L410 V429 L430 F672 Y675 I676 C679 R680 R730 C731	L410-F433 HydrophobicContact CD1-CE2 4.45Å; L410-F433 HydrophobicContact CD1-CZ 4.2Å; V429-F433 HydrophobicContact CG1-CD2 4.04Å; V429-F433 HydrophobicContact CG1-CE2 3.71Å; V429-F433 VanDerWaalsContact O-CD2 3.31Å; V429-F433 WeakPolarHBondContact O-CD2 3.16Å; V429-F433 PolarHBondContact O-N 3.15Å; L430-F433 PolarHBondContact O-N 2.86Å; F433-F672 HydrophobicContact CE2-CE2 4.15Å; F433-F672 HydrophobicContact CZ-CE2 4.22Å; F433-Y675 AromaticContact CE1-CD1 3.96Å; F433-Y675 HydrophobicContact CE1-CD1 3.96Å; F433-Y675 AromaticContact CE1-CE1 3.9Å; F433-Y675 HydrophobicContact CE1-CE1 3.9Å; F433-Y675 AromaticContact CZ-CD1 3.78Å; F433-Y675 HydrophobicContact CZ-CD1 3.78Å; F433-Y675 AromaticContact CZ-CE1 3.81Å; F433-Y675 HydrophobicContact CZ-CE1 3.81Å; F433-I676 HydrophobicContact CE1-CB 4.33Å; F433-I676 HydrophobicContact CE1-CG1 4.02Å; F433-I676 HydrophobicContact CE2-CG1 4Å; F433-I676 HydrophobicContact CZ-CG1 3.72Å; F433-C679 HydrophobicContact CD1-CB 3.8Å; F433-C679 HydrophobicContact CE1-CB 3.73Å; F433-R680 VanDerWaalsContact O-CD 3.28Å; F433-R680 WeakPolarHBondContact O-CD 3.35Å; F433-R680 WeakPolarHBondContact O-CG 3.08Å; F433-R730 HydrophobicContact CD1-CG 4.42Å; F433-R730 PolarHBondContact O-NH1 3.13Å; F433-C731 WeakPolarHBondContact CD2-SG 3.4Å; F433-C731 HydrophobicContact CE2-CB 4.44Å
434	G	90	Very high	80.7	Confident	5 Å²	5	41.6 Å²	41.6	5%	0.052	22%	0.216	C	C	.	.			trans	64.1	173.8	-178.9	0	0	0	0	0	114.3	L430 A727 R730	L430-G434 PolarHBondContact O-N 3.14Å; G434-A727 WeakPolarHBondContact O-CA 3.36Å; G434-A727 WeakPolarHBondContact O-CB 3.46Å; G434-R730 PolarHBondContact O-NH1 3.46Å
435	A	87.5	Confident	80.5	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.017	22%	0.222	C	C	.	.			trans	-91.4	174.3	-174.7	0	0	0	0	0	113.6	N445 R723 Q726 R730	A435-N445 HydrophobicContact CB-CB 4.46Å; A435-N445 WeakPolarHBondContact CB-O 3.46Å; A435-N445 PolarHBondContact N-O 2.85Å; A435-R723 HydrophobicContact CB-CB 3.74Å; A435-R723 HydrophobicContact CB-CG 3.83Å; A435-Q726 HydrophobicContact CB-CB 4.25Å; A435-R730 VanDerWaalsContact C-NH1 3.3Å; A435-R730 PolarHBondContact O-NH1 2.97Å; A435-R730 PolarHBondContact O-NH2 3.49Å
436	S	84.6	Confident	80.5	Confident	13 Å²	13	42.4 Å²	42.4	9%	0.091	22%	0.221	C	C	.	.			trans	-69.5	144.2	177.9	-169.4	0	0	0	0	111.5	N445 N684 P685 Q726	S436-N445 WeakPolarHBondContact O-CB 3.49Å; S436-N684 WeakPolarHBondContact OG-CB 3.44Å; S436-P685 WeakPolarHBondContact CB-O 3.5Å; S436-P685 PolarHBondContact OG-O 3.29Å; S436-Q726 VanDerWaalsContact N-OE1 3.1Å
437	S	74	Confident	80.4	Confident	69 Å²	69	42.4 Å²	42.4	48%	0.483	22%	0.221	S	C	.	.	S	Bend	trans	-97	-10	-178.9	-168.6	0	0	0	0	114.1
438	K	66	Low	80.5	Confident	163 Å²	163	42.5 Å²	42.5	71%	0.709	22%	0.222	S	C	*	.			trans	-98.9	-9	-164.3	-75.4	-175.3	177	179.6	0	115.1
439	E	57.3	Low	80.4	Confident	82 Å²	82	42.5 Å²	42.5	38%	0.383	22%	0.222	S	C	.	.	S	Bend	trans	-83.1	141.1	-178.9	-94.6	-178.4	163.3	0	0	113.5	S441 Q726	E439-S441 VanDerWaalsContact C-N 3.31Å; E439-S441 PolarHBondContact O-N 3.32Å; E439-Q726 PolarHBondContact OE2-NE2 3.35Å
440	F	49	Very low	80.3	Confident	213 Å²	213	42.5 Å²	42.5	93%	0.934	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	10.3	-150.1	-109.4	-90.8	0	0	0	118.6
441	S	51	Low	80	Confident	102 Å²	102	42.5 Å²	42.5	71%	0.713	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-150.7	-6.3	-173.4	56.7	0	0	0	0	116.4	E439	E439-S441 VanDerWaalsContact C-N 3.31Å; E439-S441 PolarHBondContact O-N 3.32Å
442	L	56.2	Low	79.7	Confident	43 Å²	43	42.5 Å²	42.5	23%	0.225	22%	0.222	C	C	.	.			trans	-105.2	100.6	179.5	-66	171.3	0	0	0	109.2	R444 E719 I722	L442-R444 PolarHBondContact O-N 3.24Å; L442-E719 HydrophobicContact CD2-CB 3.95Å; L442-E719 VanDerWaalsContact CD2-CD 3.42Å; L442-E719 HydrophobicContact CD2-CG 3.49Å; L442-E719 VanDerWaalsContact CD2-CG 3.49Å; L442-I722 HydrophobicContact CD1-CG2 3.82Å
443	N	66.4	Low	79.1	Confident	150 Å²	150	42.4 Å²	42.4	80%	0.802	22%	0.222	S	C	*	.	S	Bend	trans	-58.5	-12.8	175.9	-72.5	-19.7	0	0	0	113.3	Q549	N443-Q549 PolarHBondContact O-OE1 2.86Å
444	R	82.6	Confident	78.2	Confident	15 Å²	15	43.5 Å²	43.5	6%	0.057	23%	0.227	C	C	.	.			trans	-127.8	125.2	-173.7	173.2	173.1	164.3	-147.4	-22	111.9	L442 T446 H448 M546 Q549 R598 D600 R723	L442-R444 PolarHBondContact O-N 3.24Å; R444-T446 PolarHBondContact NE-O 3.15Å; R444-T446 PolarHBondContact NH2-O 3.29Å; R444-H448 PolarHBondContact NE-NE2 3.44Å; R444-H448 PolarHBondContact NH1-CD2 2.78Å; R444-H448 VanDerWaalsContact NH1-CD2 3.34Å; R444-H448 PolarHBondContact NH2-CD2 3.03Å; R444-H448 PolarHBondContact NH2-NE2 2.71Å; R444-M546 WeakPolarHBondContact CD-O 3.41Å; R444-M546 PolarHBondContact NE-O 2.94Å; R444-M546 PolarHBondContact NH1-O 3.46Å; R444-M546 VanDerWaalsContact NH1-O 3.08Å; R444-Q549 HydrophobicContact CB-CG 4.43Å; R444-Q549 HydrophobicContact CG-CG 4.27Å; R444-R598 PolarHBondContact NH1-O 3.33Å; R444-R598 PolarHBondContact NH2-O 3.48Å; R444-D600 IonicContact CZ-OD2 3.9Å; R444-D600 IonicContact NH2-OD1 2.92Å; R444-D600 PolarHBondContact NH2-OD1 3.46Å; R444-D600 IonicContact NH2-OD2 3.54Å; R444-D600 PolarHBondContact NH2-OD2 2.82Å; R444-R723 PolarHBondContact O-NE 3.23Å
445	N	85.9	Confident	77	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.123	23%	0.234	C	C	.	.			trans	-110.5	-3.8	176.7	65.3	-7.2	0	0	0	114.1	A435 S436 Q549	A435-N445 HydrophobicContact CB-CB 4.46Å; A435-N445 WeakPolarHBondContact CB-O 3.46Å; A435-N445 PolarHBondContact N-O 2.85Å; S436-N445 WeakPolarHBondContact O-CB 3.49Å; N445-Q549 PolarHBondContact OD1-NE2 3.31Å
446	T	91.1	Very high	75.3	Confident	5 Å²	5	46 Å²	46	3%	0.031	25%	0.248	C	C	.	.			trans	-88.4	142.8	-179.5	50.5	0	0	0	0	111.5	R444 H448 Q549	R444-T446 PolarHBondContact NE-O 3.15Å; R444-T446 PolarHBondContact NH2-O 3.29Å; T446-H448 PolarHBondContact OG1-CE1 2.76Å; T446-H448 VanDerWaalsContact OG1-CE1 3.32Å; T446-Q549 VanDerWaalsContact CG2-NE2 3.31Å; T446-Q549 PolarHBondContact OG1-NE2 2.63Å
447	I	92.9	Very high	73.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.282	C	S	.	.			trans	-100	135.1	177	-61.4	165.6	0	0	0	108.2	V449 S567 D600 R723 L724 A727	I447-V449 HydrophobicContact CG2-CG2 4.32Å; I447-S567 WeakPolarHBondContact O-CB 3.18Å; I447-S567 PolarHBondContact O-OG 3.05Å; I447-D600 VanDerWaalsContact CA-OD2 3.22Å; I447-D600 WeakPolarHBondContact CA-OD2 3.13Å; I447-D600 HydrophobicContact CG2-CB 4.3Å; I447-R723 HydrophobicContact CG1-CB 4.05Å; I447-L724 HydrophobicContact CD1-CD2 4.08Å; I447-L724 HydrophobicContact CG2-CD2 3.96Å; I447-A727 HydrophobicContact CD1-CB 3.52Å
448	H	94.1	Very high	71.4	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.009	27%	0.27	C	S	.	.			trans	-117.5	130.5	179.3	-62.6	-17.3	0	0	0	109.9	R444 T446 M546 V566 V568 F599 D600 V601	R444-H448 PolarHBondContact NE-NE2 3.44Å; R444-H448 PolarHBondContact NH1-CD2 2.78Å; R444-H448 VanDerWaalsContact NH1-CD2 3.34Å; R444-H448 PolarHBondContact NH2-CD2 3.03Å; R444-H448 PolarHBondContact NH2-NE2 2.71Å; T446-H448 PolarHBondContact OG1-CE1 2.76Å; T446-H448 VanDerWaalsContact OG1-CE1 3.32Å; H448-M546 HydrophobicContact CB-CE 3.99Å; H448-M546 WeakPolarHBondContact CD2-CE 3.12Å; H448-V566 PolarHBondContact CE1-O 3.18Å; H448-V568 VanDerWaalsContact CA-O 3.29Å; H448-V568 WeakPolarHBondContact CA-O 3.1Å; H448-V568 PolarHBondContact ND1-N 3.15Å; H448-V568 VanDerWaalsContact ND1-N 3.12Å; H448-F599 HydrophobicContact CB-CD1 3.81Å; H448-F599 HydrophobicContact CB-CE1 4.4Å; H448-D600 PolarHBondContact N-OD2 2.82Å; H448-D600 PolarHBondContact O-N 3.29Å; H448-V601 PolarHBondContact O-N 3.13Å
449	V	92.9	Very high	70.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.8	-176.8	-177.9	0	0	0	0	108.9	L428 I447 I451 V568 I569 A570 V601 F603	L428-V449 HydrophobicContact CD2-CB 4.37Å; L428-V449 HydrophobicContact CD2-CG1 4.14Å; I447-V449 HydrophobicContact CG2-CG2 4.32Å; V449-I451 HydrophobicContact CG1-CG1 4.35Å; V449-V568 PolarHBondContact N-O 3.25Å; V449-V568 VanDerWaalsContact N-O 3.12Å; V449-I569 HydrophobicContact CB-CG2 4.49Å; V449-I569 WeakPolarHBondContact O-CA 3.35Å; V449-A570 PolarHBondContact O-N 3.34Å; V449-V601 WeakPolarHBondContact CA-O 3.26Å; V449-F603 HydrophobicContact CG1-CD2 4Å; V449-F603 HydrophobicContact CG1-CE2 4.12Å
450	L	91.4	Very high	69.7	Low	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.5	172.3	-178.2	64.5	0	0	0	109.3	I452 A570 I572 L596 F599 V601 I602 F603	L450-I452 HydrophobicContact CD2-CD1 4.47Å; L450-I452 HydrophobicContact CD2-CG1 4.28Å; L450-I452 HydrophobicContact CG-CG1 4.25Å; L450-A570 CarbonylContact C-O 3.58Å; L450-A570 WeakPolarHBondContact CA-O 3.43Å; L450-A570 HydrophobicContact CD1-CB 3.77Å; L450-I572 HydrophobicContact CD1-CB 4.26Å; L450-I572 HydrophobicContact CD1-CG2 3.78Å; L450-I572 HydrophobicContact CD2-CG2 4.45Å; L450-I572 HydrophobicContact CG-CG2 4.2Å; L450-L596 HydrophobicContact CD2-CD2 3.66Å; L450-F599 HydrophobicContact CB-CB 4.22Å; L450-F599 HydrophobicContact CB-CD1 3.76Å; L450-F599 HydrophobicContact CB-CD2 4.2Å; L450-F599 HydrophobicContact CB-CE1 4.11Å; L450-F599 HydrophobicContact CB-CG 3.8Å; L450-F599 HydrophobicContact CB-CZ 4.48Å; L450-F599 HydrophobicContact CD1-CE1 4.5Å; L450-F599 HydrophobicContact CD1-CE2 4.48Å; L450-F599 HydrophobicContact CD1-CZ 4.26Å; L450-F599 HydrophobicContact CD2-CD2 4.16Å; L450-F599 HydrophobicContact CD2-CE2 4.3Å; L450-V601 PolarHBondContact N-O 3.02Å; L450-I602 HydrophobicContact CB-CG1 4.31Å; L450-I602 HydrophobicContact CB-CG2 4.47Å; L450-I602 HydrophobicContact CD2-CG2 4.23Å; L450-I602 CarbonylContact O-C 3.49Å; L450-I602 WeakPolarHBondContact O-CA 3.37Å; L450-F603 PolarHBondContact O-N 3.12Å
451	I	89.7	Confident	69.3	Low	0 Å²	0	46.5 Å²	46.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.6	174.6	-56.6	175.7	0	0	0	107.6	V424 L428 V449 K473 A570 A571 I572 L605	V424-I451 HydrophobicContact CG1-CD1 4.11Å; L428-I451 HydrophobicContact CD1-CD1 4.36Å; L428-I451 HydrophobicContact CD2-CD1 4.35Å; V449-I451 HydrophobicContact CG1-CG1 4.35Å; I451-K473 HydrophobicContact CG2-CG 4.25Å; I451-A570 PolarHBondContact N-O 3.33Å; I451-A571 CarbonylContact O-C 3.53Å; I451-A571 VanDerWaalsContact O-CA 3.32Å; I451-A571 WeakPolarHBondContact O-CA 3.4Å; I451-I572 PolarHBondContact O-N 2.84Å; I451-L605 HydrophobicContact CG2-CD1 3.43Å; I451-L605 VanDerWaalsContact CG2-CD1 3.43Å; I451-L605 HydrophobicContact CG2-CG 3.98Å
452	I	86.4	Confident	68.9	Low	1 Å²	1	45.1 Å²	45.1	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	132.7	172.8	-54.7	162.8	0	0	0	107.1	L450 I572 Y579 V585 V589 I602 F603 L604 L605	L450-I452 HydrophobicContact CD2-CD1 4.47Å; L450-I452 HydrophobicContact CD2-CG1 4.28Å; L450-I452 HydrophobicContact CG-CG1 4.25Å; I452-I572 WeakPolarHBondContact CA-O 3.43Å; I452-I572 HydrophobicContact CB-CG2 3.98Å; I452-I572 HydrophobicContact CG1-CG2 3.44Å; I452-I572 VanDerWaalsContact CG1-CG2 3.44Å; I452-I572 HydrophobicContact CG2-CG2 4.21Å; I452-Y579 HydrophobicContact CG2-CD2 4.43Å; I452-V585 HydrophobicContact CD1-CG1 3.8Å; I452-V589 HydrophobicContact CD1-CG2 3.84Å; I452-V589 HydrophobicContact CG1-CG2 4.21Å; I452-V589 HydrophobicContact CG2-CG2 4.16Å; I452-I602 HydrophobicContact CD1-CG2 3.48Å; I452-I602 VanDerWaalsContact CD1-CG2 3.48Å; I452-I602 HydrophobicContact CG1-CG2 4.2Å; I452-F603 PolarHBondContact N-O 3.38Å; I452-L604 HydrophobicContact CB-CD2 4.02Å; I452-L604 HydrophobicContact CD1-CD2 3.82Å; I452-L604 HydrophobicContact CD1-CG 4.48Å; I452-L604 HydrophobicContact CG2-CD2 4.09Å; I452-L605 PolarHBondContact O-N 2.91Å
453	G	79.8	Confident	68.4	Low	2 Å²	2	50.5 Å²	50.5	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	162.8	166.1	0	0	0	0	0	111.9	K473 I572 N573 P574 L605	G453-K473 PolarHBondContact O-NZ 2.9Å; G453-I572 PolarHBondContact N-O 2.81Å; G453-N573 PolarHBondContact O-OD1 2.55Å; G453-P574 WeakPolarHBondContact O-CD 3.46Å; G453-L605 VanDerWaalsContact CA-O 3.28Å; G453-L605 WeakPolarHBondContact CA-O 3.14Å
454	D	73	Confident	67.4	Low	23 Å²	23	50.2 Å²	50.2	12%	0.123	30%	0.295	C	S	.	.			trans	-64.3	131.7	-176.4	-60	-42.9	0	0	0	111.4	K473 P574 N578 Y579	D454-K473 PolarHBondContact O-NZ 3.08Å; D454-P574 WeakPolarHBondContact OD1-CG 3.35Å; D454-N578 WeakPolarHBondContact OD1-CA 3.25Å; D454-Y579 WeakPolarHBondContact OD1-CB 3.4Å; D454-Y579 PolarHBondContact OD1-N 3.37Å
455	P	65.1	Low	65.6	Low	29 Å²	29	50.1 Å²	50.1	19%	0.188	30%	0.295	C	S	.	.			trans	-63.4	141.1	166.1	25	-35.4	0	0	0	108.7	L457 N573 G577	P455-L457 PolarHBondContact O-N 2.93Å; P455-N573 HydrophobicContact CB-CB 4.18Å; P455-N573 HydrophobicContact CG-CB 4.04Å; P455-G577 WeakPolarHBondContact CD-O 3.49Å; P455-G577 VanDerWaalsContact CG-O 3.25Å; P455-G577 WeakPolarHBondContact CG-O 3.39Å
456	G	51.7	Low	63.7	Low	30 Å²	30	50.4 Å²	50.4	31%	0.309	30%	0.297	S	S	.	.	S	Bend	trans	-68.6	42.7	-176	0	0	0	0	0	115.3	L466	G456-L466 WeakPolarHBondContact O-CD2 3.46Å
457	L	39.8	Very low	61.7	Low	153 Å²	153	57.6 Å²	57.6	80%	0.801	33%	0.328	S	S	*	.			trans	-139.7	79.9	179.6	-68.6	170.8	0	0	0	109.6	P455	P455-L457 PolarHBondContact O-N 2.93Å
458	G	37.7	Very low	59.9	Low	22 Å²	22	59.3 Å²	59.3	23%	0.227	34%	0.336	C	S	.	.			trans	-126.6	135.4	169.7	0	0	0	0	0	108.8	S460 L466	G458-S460 PolarHBondContact O-N 3Å; G458-L466 VanDerWaalsContact N-CD2 3.35Å
459	E	44.6	Very low	58	Low	207 Å²	207	59.9 Å²	59.9	97%	0.967	34%	0.34	S	S	*	.	S	Bend	trans	-62.9	-0.1	-179.7	-66.1	-179.2	151.3	0	0	114	G461	E459-G461 PolarHBondContact O-N 3.01Å
460	S	42.1	Very low	56.2	Low	88 Å²	88	61.7 Å²	61.7	62%	0.615	35%	0.354	S	S	*	.	S	Bend	trans	-96.2	85.2	-174.6	-48.5	0	0	0	0	112.4	G458 T462	G458-S460 PolarHBondContact O-N 3Å; S460-T462 VanDerWaalsContact C-N 3.34Å; S460-T462 PolarHBondContact O-N 2.74Å
461	G	41.9	Very low	55	Low	81 Å²	81	66.8 Å²	66.8	84%	0.835	38%	0.377	S	S	*	.	S	Bend	trans	67.1	-24.1	136	0	0	0	0	0	122.6	E459	E459-G461 PolarHBondContact O-N 3.01Å
462	T	42.7	Very low	54.2	Low	73 Å²	73	68.1 Å²	68.1	45%	0.448	38%	0.382	S	S	.	.			trans	-129.6	77.5	-175.3	-39.4	0	0	0	0	111.8	S460 F464 N465	S460-T462 VanDerWaalsContact C-N 3.34Å; S460-T462 PolarHBondContact O-N 2.74Å; T462-F464 PolarHBondContact O-N 2.67Å; T462-N465 PolarHBondContact O-N 2.93Å
463	I	44.1	Very low	53.8	Low	156 Å²	156	68.3 Å²	68.3	80%	0.8	38%	0.382	S	S	*	.	H	α-helix	trans	-54.4	-21.9	-179.3	-122	155.5	0	0	0	113.7
464	F	45.3	Very low	53.7	Low	145 Å²	145	70.7 Å²	70.7	64%	0.636	40%	0.397	S	S	*	.	H	α-helix	trans	-76.2	-42.9	-176.8	-155.3	-96.3	0	0	0	113	T462	T462-F464 PolarHBondContact O-N 2.67Å
465	N	44.6	Very low	54.2	Low	12 Å²	12	72.6 Å²	72.6	6%	0.064	41%	0.405	C	S	.	.	H	α-helix	trans	-74.8	-31.5	-179.3	-71.6	-7.7	0	0	0	111.9	T462 F467 F468 C469 D607 D614	T462-N465 PolarHBondContact O-N 2.93Å; N465-F467 PolarHBondContact O-N 3.33Å; N465-F468 WeakPolarHBondContact O-CB 3.5Å; N465-F468 PolarHBondContact O-N 2.8Å; N465-F468 VanDerWaalsContact O-N 3.13Å; N465-C469 PolarHBondContact O-N 2.91Å; N465-C469 VanDerWaalsContact O-N 3.13Å; N465-D607 WeakPolarHBondContact CB-OD1 3.38Å; N465-D607 WeakPolarHBondContact CB-OD2 3.41Å; N465-D614 PolarHBondContact ND2-OD2 2.91Å; N465-D614 PolarHBondContact OD1-OD1 3.17Å; N465-D614 PolarHBondContact OD1-OD2 2.87Å
466	L	46.6	Very low	55.3	Low	30 Å²	30	71.3 Å²	71.3	16%	0.157	40%	0.397	C	S	.	.	H	α-helix	trans	-60.7	-46	177	-102	75.7	0	0	0	114.1	G456 G458 F468	G456-L466 WeakPolarHBondContact O-CD2 3.46Å; G458-L466 VanDerWaalsContact N-CD2 3.35Å; L466-F468 PolarHBondContact O-N 3.19Å
467	F	48.8	Very low	57.1	Low	155 Å²	155	69.9 Å²	69.9	68%	0.68	38%	0.382	S	S	*	.	H	α-helix	trans	-66	-31.7	177.8	-164.4	-97.8	0	0	0	110.8	N465 F471	N465-F467 PolarHBondContact O-N 3.33Å; F467-F471 HydrophobicContact CE1-CD2 4.24Å; F467-F471 WeakPolarHBondContact O-CB 3.34Å; F467-F471 PolarHBondContact O-N 3.33Å
468	F	56.4	Low	59.4	Low	37 Å²	37	65.2 Å²	65.2	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-70.8	-40.1	-177.1	-150.4	-104.3	0	0	0	112.7	N465 L466 F471 R472 I617 V621	N465-F468 WeakPolarHBondContact O-CB 3.5Å; N465-F468 PolarHBondContact O-N 2.8Å; N465-F468 VanDerWaalsContact O-N 3.13Å; L466-F468 PolarHBondContact O-N 3.19Å; F468-F471 PolarHBondContact O-N 3.2Å; F468-R472 HydrophobicContact CD1-CG 3.98Å; F468-R472 HydrophobicContact CE1-CG 3.92Å; F468-R472 VanDerWaalsContact O-CB 3.26Å; F468-R472 WeakPolarHBondContact O-CB 3.48Å; F468-R472 WeakPolarHBondContact O-CG 3.44Å; F468-R472 PolarHBondContact O-N 2.82Å; F468-I617 HydrophobicContact CD1-CD1 4.39Å; F468-I617 HydrophobicContact CD1-CG2 3.97Å; F468-I617 HydrophobicContact CD2-CG2 4.32Å; F468-I617 HydrophobicContact CE1-CB 4.44Å; F468-I617 HydrophobicContact CE1-CD1 4.1Å; F468-I617 HydrophobicContact CE1-CG1 4.3Å; F468-I617 HydrophobicContact CE1-CG2 3.31Å; F468-I617 HydrophobicContact CE2-CG2 3.75Å; F468-I617 HydrophobicContact CG-CG2 4.44Å; F468-I617 HydrophobicContact CZ-CG2 3.21Å; F468-V621 HydrophobicContact CE2-CG2 3.78Å; F468-V621 HydrophobicContact CZ-CG2 4Å
469	C	53.6	Low	61.7	Low	14 Å²	14	64.8 Å²	64.8	10%	0.095	35%	0.35	C	S	.	.	H	α-helix	trans	-67.7	-44.7	-179.8	-162.3	0	0	0	0	112.1	N465 R472 K473	N465-C469 PolarHBondContact O-N 2.91Å; N465-C469 VanDerWaalsContact O-N 3.13Å; C469-R472 PolarHBondContact O-N 2.96Å; C469-K473 WeakPolarHBondContact O-CE 3.35Å; C469-K473 WeakPolarHBondContact O-CG 3.16Å; C469-K473 PolarHBondContact O-N 3.41Å
470	A	55.5	Low	63.9	Low	37 Å²	37	55 Å²	55	31%	0.306	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-46.8	174.4	0	0	0	0	0	111.5	R472 K473 T474	A470-R472 VanDerWaalsContact C-N 3.32Å; A470-R472 PolarHBondContact O-N 3.49Å; A470-K473 PolarHBondContact O-N 3.48Å; A470-T474 PolarHBondContact O-N 3.13Å
471	F	65.4	Low	66.1	Low	107 Å²	107	51.2 Å²	51.2	47%	0.469	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-40.9	178	-171	-93.3	0	0	0	112.1	F467 F468 H475	F467-F471 HydrophobicContact CE1-CD2 4.24Å; F467-F471 WeakPolarHBondContact O-CB 3.34Å; F467-F471 PolarHBondContact O-N 3.33Å; F468-F471 PolarHBondContact O-N 3.2Å; F471-H475 HydrophobicContact CE1-CB 4.41Å; F471-H475 WeakPolarHBondContact O-CB 3.49Å; F471-H475 PolarHBondContact O-N 2.88Å
472	R	72.3	Confident	68.1	Low	28 Å²	28	49.1 Å²	49.1	11%	0.106	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-48.7	176.9	-85.5	174.9	146.1	170	-0.1	112.4	I418 Y419 F468 C469 A470 H475 L476	I418-R472 HydrophobicContact CD1-CG 4.41Å; I418-R472 HydrophobicContact CG2-CG 4.13Å; Y419-R472 PolarHBondContact O-NH2 2.87Å; F468-R472 HydrophobicContact CD1-CG 3.98Å; F468-R472 HydrophobicContact CE1-CG 3.92Å; F468-R472 VanDerWaalsContact O-CB 3.26Å; F468-R472 WeakPolarHBondContact O-CB 3.48Å; F468-R472 WeakPolarHBondContact O-CG 3.44Å; F468-R472 PolarHBondContact O-N 2.82Å; C469-R472 PolarHBondContact O-N 2.96Å; A470-R472 VanDerWaalsContact C-N 3.32Å; A470-R472 PolarHBondContact O-N 3.49Å; R472-H475 PolarHBondContact O-N 2.95Å; R472-L476 WeakPolarHBondContact O-CB 3.33Å; R472-L476 VanDerWaalsContact O-CG 3.27Å; R472-L476 WeakPolarHBondContact O-CG 3.38Å; R472-L476 PolarHBondContact O-N 2.69Å
473	K	78.5	Confident	70.1	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.022	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-55.9	-177.6	-71.6	178	-120.9	164.9	0	111.1	I451 G453 D454 C469 A470 H475 L476 L477 A571 N573 L605	I451-K473 HydrophobicContact CG2-CG 4.25Å; G453-K473 PolarHBondContact O-NZ 2.9Å; D454-K473 PolarHBondContact O-NZ 3.08Å; C469-K473 WeakPolarHBondContact O-CE 3.35Å; C469-K473 WeakPolarHBondContact O-CG 3.16Å; C469-K473 PolarHBondContact O-N 3.41Å; A470-K473 PolarHBondContact O-N 3.48Å; K473-H475 VanDerWaalsContact C-N 3.31Å; K473-H475 PolarHBondContact O-N 2.98Å; K473-L476 PolarHBondContact O-N 2.82Å; K473-L477 WeakPolarHBondContact O-CG 3.07Å; K473-L477 PolarHBondContact O-N 3.29Å; K473-L477 VanDerWaalsContact O-N 3.1Å; K473-A571 HydrophobicContact CB-CB 4.48Å; K473-N573 PolarHBondContact NZ-OD1 3.27Å; K473-L605 HydrophobicContact CG-CD1 4.19Å
474	T	78.2	Confident	72.1	Confident	53 Å²	53	39.3 Å²	39.3	33%	0.325	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-38.5	-178.6	-53.3	0	0	0	0	111.6	A470 L477 Q478 D530	A470-T474 PolarHBondContact O-N 3.13Å; T474-L477 PolarHBondContact O-N 2.72Å; T474-Q478 WeakPolarHBondContact O-CB 3.35Å; T474-Q478 PolarHBondContact O-N 3.01Å; T474-D530 PolarHBondContact OG1-OD2 3.16Å; T474-D530 VanDerWaalsContact OG1-OD2 3.09Å
475	H	83.5	Confident	73.7	Confident	62 Å²	62	32.8 Å²	32.8	29%	0.287	17%	0.167	S	C	.	.	H	α-helix	trans	-71.6	-34.8	-179.8	-159	78.4	0	0	0	112.9	C415 T417 I418 F471 R472 K473 Q478 A479	C415-H475 VanDerWaalsContact SG-CD2 3.53Å; T417-H475 PolarHBondContact OG1-CD2 2.95Å; T417-H475 PolarHBondContact OG1-NE2 3.49Å; I418-H475 HydrophobicContact CD1-CB 4.22Å; F471-H475 HydrophobicContact CE1-CB 4.41Å; F471-H475 WeakPolarHBondContact O-CB 3.49Å; F471-H475 PolarHBondContact O-N 2.88Å; R472-H475 PolarHBondContact O-N 2.95Å; K473-H475 VanDerWaalsContact C-N 3.31Å; K473-H475 PolarHBondContact O-N 2.98Å; H475-Q478 PolarHBondContact O-N 3.41Å; H475-A479 WeakPolarHBondContact O-CB 3.37Å; H475-A479 PolarHBondContact O-N 2.85Å
476	L	87.8	Confident	75.6	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-44.9	170.7	-76.6	165.7	0	0	0	111.5	F414 I418 V424 K425 L428 R472 K473 A479 C480	F414-L476 HydrophobicContact CE1-CD2 3.81Å; I418-L476 HydrophobicContact CD1-CD1 4.45Å; I418-L476 HydrophobicContact CD1-CD2 3.84Å; I418-L476 HydrophobicContact CD1-CG 3.6Å; V424-L476 HydrophobicContact CG1-CD1 4.38Å; K425-L476 HydrophobicContact CG-CD2 4.32Å; L428-L476 HydrophobicContact CD1-CB 4.14Å; L428-L476 HydrophobicContact CD1-CD2 4Å; L428-L476 HydrophobicContact CD1-CG 4.47Å; R472-L476 WeakPolarHBondContact O-CB 3.33Å; R472-L476 VanDerWaalsContact O-CG 3.27Å; R472-L476 WeakPolarHBondContact O-CG 3.38Å; R472-L476 PolarHBondContact O-N 2.69Å; K473-L476 PolarHBondContact O-N 2.82Å; L476-A479 PolarHBondContact O-N 3.38Å; L476-C480 PolarHBondContact O-N 3.49Å; L476-C480 PolarHBondContact O-SG 3.45Å
477	L	89.3	Confident	77.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-45.2	176.3	-69.3	-177	0	0	0	111.2	K473 T474 A479 C480 V481 Y489 C528 D530 I569 A571	K473-L477 WeakPolarHBondContact O-CG 3.07Å; K473-L477 PolarHBondContact O-N 3.29Å; K473-L477 VanDerWaalsContact O-N 3.1Å; T474-L477 PolarHBondContact O-N 2.72Å; L477-A479 VanDerWaalsContact C-N 3.33Å; L477-A479 PolarHBondContact O-N 3.42Å; L477-C480 WeakPolarHBondContact O-CB 3.15Å; L477-C480 PolarHBondContact O-N 3.13Å; L477-C480 VanDerWaalsContact O-N 3.16Å; L477-V481 WeakPolarHBondContact O-CG2 3.43Å; L477-V481 PolarHBondContact O-N 3.13Å; L477-V481 VanDerWaalsContact O-N 3.08Å; L477-Y489 HydrophobicContact CB-CD2 4.48Å; L477-Y489 HydrophobicContact CB-CE2 4.14Å; L477-Y489 HydrophobicContact CD1-CE2 4.32Å; L477-C528 HydrophobicContact CB-CB 4.08Å; L477-C528 HydrophobicContact CD2-CB 4.08Å; L477-C528 PolarHBondContact O-SG 2.6Å; L477-D530 HydrophobicContact CD1-CB 4.1Å; L477-I569 HydrophobicContact CD2-CB 4.18Å; L477-I569 HydrophobicContact CD2-CG2 3.45Å; L477-I569 VanDerWaalsContact CD2-CG2 3.45Å; L477-A571 HydrophobicContact CD1-CB 3.75Å
478	Q	87.6	Confident	79.5	Confident	54 Å²	54	26.9 Å²	26.9	25%	0.252	15%	0.149	S	C	.	.	H	α-helix	trans	-62.8	-41.2	178.3	-162	67.6	11.7	0	0	111.9	T474 H475 C480 V481 D482	T474-Q478 WeakPolarHBondContact O-CB 3.35Å; T474-Q478 PolarHBondContact O-N 3.01Å; H475-Q478 PolarHBondContact O-N 3.41Å; Q478-C480 VanDerWaalsContact C-N 3.29Å; Q478-C480 PolarHBondContact O-N 3.38Å; Q478-V481 PolarHBondContact O-N 3.01Å; Q478-D482 PolarHBondContact O-N 3.49Å
479	A	86.8	Confident	81.1	Confident	14 Å²	14	28.9 Å²	28.9	12%	0.116	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-36.1	175.5	0	0	0	0	0	112.5	F414 C415 H475 L476 L477 D482 L483	F414-A479 HydrophobicContact CZ-CB 4.33Å; C415-A479 HydrophobicContact CB-CB 3.83Å; H475-A479 WeakPolarHBondContact O-CB 3.37Å; H475-A479 PolarHBondContact O-N 2.85Å; L476-A479 PolarHBondContact O-N 3.38Å; L477-A479 VanDerWaalsContact C-N 3.33Å; L477-A479 PolarHBondContact O-N 3.42Å; A479-D482 PolarHBondContact O-N 3.28Å; A479-L483 WeakPolarHBondContact O-CB 3.41Å; A479-L483 WeakPolarHBondContact O-CG 3.29Å; A479-L483 PolarHBondContact O-N 3.44Å
480	C	90	Very high	82.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-45.7	174	-64.9	0	0	0	0	111.7	F414 L476 L477 Q478 D482 L483 S484 I569	F414-C480 VanDerWaalsContact CZ-SG 3.52Å; L476-C480 PolarHBondContact O-N 3.49Å; L476-C480 PolarHBondContact O-SG 3.45Å; L477-C480 WeakPolarHBondContact O-CB 3.15Å; L477-C480 PolarHBondContact O-N 3.13Å; L477-C480 VanDerWaalsContact O-N 3.16Å; Q478-C480 VanDerWaalsContact C-N 3.29Å; Q478-C480 PolarHBondContact O-N 3.38Å; C480-D482 PolarHBondContact O-N 2.81Å; C480-L483 PolarHBondContact O-N 3.27Å; C480-S484 WeakPolarHBondContact O-CB 3.46Å; C480-S484 PolarHBondContact O-N 3.15Å; C480-I569 HydrophobicContact CB-CD1 3.89Å
481	V	88.5	Confident	84.4	Confident	9 Å²	9	28.1 Å²	28.1	6%	0.055	15%	0.149	C	C	.	.	H	α-helix	trans	-60.4	-37.1	178.2	170	0	0	0	0	111	L477 Q478 C528	L477-V481 WeakPolarHBondContact O-CG2 3.43Å; L477-V481 PolarHBondContact O-N 3.13Å; L477-V481 VanDerWaalsContact O-N 3.08Å; Q478-V481 PolarHBondContact O-N 3.01Å; V481-C528 HydrophobicContact CG2-CB 3.67Å
482	D	83.7	Confident	85.2	Confident	38 Å²	38	23.1 Å²	23.1	20%	0.203	13%	0.128	C	C	.	.	H	α-helix	trans	-75.8	-46.8	-177.5	-65.9	-6.2	0	0	0	110.9	R310 Q478 A479 C480 S484 R673	R310-D482 IonicContact CZ-OD1 3.7Å; R310-D482 IonicContact CZ-OD2 3.32Å; R310-D482 IonicContact NH1-OD1 2.81Å; R310-D482 PolarHBondContact NH1-OD1 3.31Å; R310-D482 IonicContact NH1-OD2 3.07Å; R310-D482 PolarHBondContact NH1-OD2 3.13Å; R310-D482 IonicContact NH2-OD1 2.71Å; R310-D482 PolarHBondContact NH2-OD1 3.39Å; Q478-D482 PolarHBondContact O-N 3.49Å; A479-D482 PolarHBondContact O-N 3.28Å; C480-D482 PolarHBondContact O-N 2.81Å; D482-S484 PolarHBondContact O-N 3.1Å; D482-R673 PolarHBondContact O-NE 3.13Å; D482-R673 PolarHBondContact O-NH2 3.01Å
483	L	85.4	Confident	85.8	Confident	15 Å²	15	26.3 Å²	26.3	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-25.3	178.4	-68.3	171.6	0	0	0	112.9	F414 L432 A479 C480 F672 R673	F414-L483 HydrophobicContact CD2-CD1 3.31Å; F414-L483 HydrophobicContact CE2-CD1 3.65Å; F414-L483 HydrophobicContact CG-CD1 4.3Å; L432-L483 HydrophobicContact CD1-CB 4.11Å; A479-L483 WeakPolarHBondContact O-CB 3.41Å; A479-L483 WeakPolarHBondContact O-CG 3.29Å; A479-L483 PolarHBondContact O-N 3.44Å; C480-L483 PolarHBondContact O-N 3.27Å; L483-F672 HydrophobicContact CD1-CD1 4.08Å; L483-F672 HydrophobicContact CD1-CE1 4Å; L483-F672 HydrophobicContact CD2-CB 4.08Å; L483-F672 HydrophobicContact CD2-CD1 3.78Å; L483-F672 HydrophobicContact CD2-CG 4.09Å; L483-R673 WeakPolarHBondContact O-CA 3.33Å; L483-R673 WeakPolarHBondContact O-CB 3.24Å; L483-R673 WeakPolarHBondContact O-CG 3.39Å
484	S	85.9	Confident	86.1	Confident	8 Å²	8	31.2 Å²	31.2	6%	0.056	18%	0.177	C	C	.	.	S	Bend	trans	-73.2	134.1	171.7	-173	0	0	0	0	110.9	C480 D482 I486 C526	C480-S484 WeakPolarHBondContact O-CB 3.46Å; C480-S484 PolarHBondContact O-N 3.15Å; D482-S484 PolarHBondContact O-N 3.1Å; S484-I486 PolarHBondContact O-N 3.4Å; S484-I486 VanDerWaalsContact OG-C 3.26Å; S484-I486 PolarHBondContact OG-N 3.34Å; S484-I486 PolarHBondContact OG-O 2.94Å; S484-C526 WeakPolarHBondContact CB-SG 3.32Å
485	P	80.2	Confident	86.5	Confident	8 Å²	8	30 Å²	30	5%	0.052	17%	0.17	C	C	.	.	S	Bend	trans	-68.9	-23.4	171.7	26.8	-33	0	0	0	113	L377 A381 R673	L377-P485 HydrophobicContact CD1-CG 3.61Å; L377-P485 HydrophobicContact CD2-CG 3.39Å; L377-P485 HydrophobicContact CG-CB 4.39Å; L377-P485 HydrophobicContact CG-CG 3.24Å; A381-P485 HydrophobicContact CB-CB 4.24Å; P485-R673 HydrophobicContact CB-CG 3.81Å; P485-R673 HydrophobicContact CG-CG 4.28Å
486	I	84.3	Confident	86.7	Confident	12 Å²	12	30.7 Å²	30.7	6%	0.062	18%	0.179	C	C	.	.	S	Bend	trans	-127.3	95.8	169.4	-54.9	178.7	0	0	0	106.9	V339 L377 V380 S484 I521 G525 C526	V339-I486 HydrophobicContact CG2-CD1 3.83Å; L377-I486 HydrophobicContact CD1-CB 4.3Å; L377-I486 HydrophobicContact CD1-CD1 3.96Å; L377-I486 HydrophobicContact CD1-CG1 3.97Å; V380-I486 HydrophobicContact CG1-CD1 4.29Å; V380-I486 HydrophobicContact CG1-CG1 4.12Å; V380-I486 HydrophobicContact CG2-CD1 4.35Å; S484-I486 PolarHBondContact O-N 3.4Å; S484-I486 VanDerWaalsContact OG-C 3.26Å; S484-I486 PolarHBondContact OG-N 3.34Å; S484-I486 PolarHBondContact OG-O 2.94Å; I486-I521 WeakPolarHBondContact CG2-O 3.32Å; I486-G525 VanDerWaalsContact O-CA 3.24Å; I486-G525 WeakPolarHBondContact O-CA 3.42Å; I486-C526 PolarHBondContact O-N 3.44Å
487	G	87	Confident	86.5	Confident	27 Å²	27	33.5 Å²	33.5	28%	0.278	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.5	178.5	0	0	0	0	0	110.7	C526	G487-C526 WeakPolarHBondContact CA-O 3.32Å
488	V	88.9	Confident	86.3	Confident	33 Å²	33	36.1 Å²	36.1	20%	0.2	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.9	171.9	-176.4	0	0	0	0	108.9	V490 A518 I521 C526 C528	V488-V490 HydrophobicContact CG1-CG2 3.83Å; V488-A518 HydrophobicContact CG1-CB 3.94Å; V488-I521 HydrophobicContact CG2-CG2 4.01Å; V488-C526 PolarHBondContact N-O 3.06Å; V488-C526 VanDerWaalsContact N-O 3.1Å; V488-C528 PolarHBondContact O-N 3.41Å
489	Y	90.7	Very high	86.2	Confident	80 Å²	80	35.2 Å²	35.2	31%	0.314	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.8	173.6	-177	-96.3	0	0	0	110.2	L477 C528 D530	L477-Y489 HydrophobicContact CB-CD2 4.48Å; L477-Y489 HydrophobicContact CB-CE2 4.14Å; L477-Y489 HydrophobicContact CD1-CE2 4.32Å; Y489-C528 HydrophobicContact CD2-CB 4.2Å; Y489-D530 HydrophobicContact CE2-CB 4.3Å; Y489-D530 VanDerWaalsContact OH-CB 3.25Å; Y489-D530 WeakPolarHBondContact OH-CB 3.43Å; Y489-D530 PolarHBondContact OH-OD2 3.31Å; Y489-D530 VanDerWaalsContact OH-OD2 3.07Å
490	V	90.4	Very high	86.2	Confident	8 Å²	8	34.6 Å²	34.6	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	130	-171.3	-176.5	0	0	0	0	109.4	V488 T495 L500 A518 C528 I529 D530	V488-V490 HydrophobicContact CG1-CG2 3.83Å; V490-T495 HydrophobicContact CB-CG2 4.46Å; V490-T495 HydrophobicContact CG1-CG2 3.09Å; V490-L500 HydrophobicContact CG1-CD2 4.45Å; V490-A518 HydrophobicContact CG2-CB 3.79Å; V490-C528 PolarHBondContact N-O 2.96Å; V490-I529 HydrophobicContact CB-CG1 4.46Å; V490-I529 CarbonylContact O-C 3.59Å; V490-I529 VanDerWaalsContact O-CA 3.28Å; V490-I529 WeakPolarHBondContact O-CA 3.26Å; V490-D530 PolarHBondContact O-N 2.81Å
491	S	88.7	Confident	86.2	Confident	26 Å²	26	35.1 Å²	35.1	18%	0.182	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131	171.1	158.7	0	0	0	0	110.4	N493 T494 T495 E531	S491-N493 VanDerWaalsContact C-N 3.27Å; S491-N493 PolarHBondContact O-N 2.96Å; S491-T494 PolarHBondContact O-N 2.97Å; S491-T494 VanDerWaalsContact O-N 3.13Å; S491-T494 PolarHBondContact O-OG1 3.39Å; S491-T495 WeakPolarHBondContact O-CG2 3.48Å; S491-T495 PolarHBondContact O-N 2.99Å; S491-T495 PolarHBondContact O-OG1 3.22Å; S491-E531 PolarHBondContact OG-OE2 3.29Å; S491-E531 VanDerWaalsContact OG-OE2 3.14Å
492	G	82.6	Confident	86.2	Confident	3 Å²	3	35 Å²	35	3%	0.031	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36	-176.3	0	0	0	0	0	114.2	T494 T495 D530	G492-T494 PolarHBondContact O-N 3.48Å; G492-T495 PolarHBondContact O-OG1 3.08Å; G492-D530 PolarHBondContact N-O 2.92Å
493	N	84.9	Confident	86.4	Confident	94 Å²	94	35.2 Å²	35.2	50%	0.503	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-34.3	178.8	-80.8	-34.9	0	0	0	113.8	S491 E531 K534	S491-N493 VanDerWaalsContact C-N 3.27Å; S491-N493 PolarHBondContact O-N 2.96Å; N493-E531 VanDerWaalsContact ND2-CD 3.27Å; N493-E531 PolarHBondContact ND2-OE1 3.34Å; N493-E531 PolarHBondContact ND2-OE2 2.88Å; N493-K534 WeakPolarHBondContact OD1-CB 3.04Å; N493-K534 WeakPolarHBondContact OD1-CG 3.48Å
494	T	84.4	Confident	86.5	Confident	108 Å²	108	35.4 Å²	35.4	66%	0.663	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.7	-174.3	61.2	0	0	0	0	113.1	S491 G492	S491-T494 PolarHBondContact O-N 2.97Å; S491-T494 VanDerWaalsContact O-N 3.13Å; S491-T494 PolarHBondContact O-OG1 3.39Å; G492-T494 PolarHBondContact O-N 3.48Å
495	T	85	Confident	86.4	Confident	28 Å²	28	35.9 Å²	35.9	17%	0.172	23%	0.226	C	C	.	.			trans	-96.3	144.5	-169.1	54.3	0	0	0	0	113.1	V490 S491 G492 Q538	V490-T495 HydrophobicContact CB-CG2 4.46Å; V490-T495 HydrophobicContact CG1-CG2 3.09Å; S491-T495 WeakPolarHBondContact O-CG2 3.48Å; S491-T495 PolarHBondContact O-N 2.99Å; S491-T495 PolarHBondContact O-OG1 3.22Å; G492-T495 PolarHBondContact O-OG1 3.08Å; T495-Q538 PolarHBondContact O-NE2 3.35Å; T495-Q538 PolarHBondContact OG1-NE2 3.39Å
496	T	88	Confident	86.6	Confident	77 Å²	77	41.1 Å²	41.1	47%	0.472	25%	0.25	S	C	.	.			trans	-115.2	160.8	175.1	56.1	0	0	0	0	108.8	S498 G499 L500	T496-S498 PolarHBondContact O-N 3.16Å; T496-S498 PolarHBondContact OG1-OG 3.36Å; T496-G499 PolarHBondContact O-N 3.05Å; T496-G499 PolarHBondContact OG1-N 2.93Å; T496-L500 PolarHBondContact O-N 3.48Å
497	V	84.9	Confident	86.4	Confident	61 Å²	61	42.9 Å²	42.9	37%	0.37	26%	0.259	S	S	.	.	H	α-helix	trans	-52.2	-41.2	174.3	177.9	0	0	0	0	110.9	L500 T501 Q538 V541	V497-L500 PolarHBondContact O-N 3.36Å; V497-T501 WeakPolarHBondContact O-CB 3.47Å; V497-T501 PolarHBondContact O-N 3.1Å; V497-T501 PolarHBondContact O-OG1 3.43Å; V497-Q538 HydrophobicContact CB-CG 4.46Å; V497-Q538 HydrophobicContact CG2-CG 3.67Å; V497-V541 HydrophobicContact CG1-CG2 3.96Å
498	S	83.9	Confident	85.9	Confident	56 Å²	56	46 Å²	46	39%	0.392	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-37.5	174.9	35.5	0	0	0	0	113.9	T496 T503	T496-S498 PolarHBondContact O-N 3.16Å; T496-S498 PolarHBondContact OG1-OG 3.36Å; S498-T503 WeakPolarHBondContact CA-OG1 3.25Å; S498-T503 WeakPolarHBondContact CB-OG1 3.23Å; S498-T503 PolarHBondContact O-OG1 3.2Å
499	G	85.7	Confident	85	Confident	35 Å²	35	48.5 Å²	48.5	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-76	-25.3	178	0	0	0	0	0	113.8	T496 G517 A518	T496-G499 PolarHBondContact O-N 3.05Å; T496-G499 PolarHBondContact OG1-N 2.93Å; G499-G517 CarbonylContact O-C 3.53Å; G499-G517 VanDerWaalsContact O-CA 3.24Å; G499-G517 WeakPolarHBondContact O-CA 3.47Å; G499-A518 PolarHBondContact O-N 3.33Å
500	L	87.5	Confident	84.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-84.8	-40	175.4	-83.4	140	0	0	0	112.9	V490 T496 V497 A518 L519 M535 Q538	V490-L500 HydrophobicContact CG1-CD2 4.45Å; T496-L500 PolarHBondContact O-N 3.48Å; V497-L500 PolarHBondContact O-N 3.36Å; L500-A518 PolarHBondContact O-N 2.84Å; L500-L519 HydrophobicContact CB-CD1 4.23Å; L500-L519 HydrophobicContact CD2-CD1 4.11Å; L500-L519 HydrophobicContact CD2-CD2 4.48Å; L500-L519 HydrophobicContact CD2-CG 4.08Å; L500-L519 VanDerWaalsContact O-CB 3.27Å; L500-L519 WeakPolarHBondContact O-CB 3.34Å; L500-L519 WeakPolarHBondContact O-CG 3.35Å; L500-L519 PolarHBondContact O-N 2.7Å; L500-M535 HydrophobicContact CD1-SD 4.08Å; L500-Q538 HydrophobicContact CD1-CB 4.08Å; L500-Q538 HydrophobicContact CD1-CG 3.57Å
501	T	88.9	Confident	84	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	31%	0.314	C	S	.	.	S	Bend	trans	-97.9	-122	-171.2	57.7	0	0	0	0	113.3	V497 G517 V541 V551	V497-T501 WeakPolarHBondContact O-CB 3.47Å; V497-T501 PolarHBondContact O-N 3.1Å; V497-T501 PolarHBondContact O-OG1 3.43Å; T501-G517 WeakPolarHBondContact O-CA 3.45Å; T501-G517 PolarHBondContact O-N 3.31Å; T501-V541 HydrophobicContact CG2-CB 4.01Å; T501-V541 HydrophobicContact CG2-CG1 3.05Å; T501-V541 HydrophobicContact CG2-CG2 3.8Å; T501-V551 HydrophobicContact CG2-CG1 4.25Å
502	V	88.6	Confident	83.8	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.6	176.5	176.3	0	0	0	0	106.4	I514 D515 V520 V553 F562	V502-I514 HydrophobicContact CG1-CG2 3.37Å; V502-D515 CarbonylContact C-O 3.57Å; V502-D515 VanDerWaalsContact CA-O 3.25Å; V502-D515 WeakPolarHBondContact CA-O 3.45Å; V502-D515 WeakPolarHBondContact CG1-O 3.44Å; V502-V520 HydrophobicContact CG2-CB 4.31Å; V502-V520 HydrophobicContact CG2-CG2 3.53Å; V502-V553 HydrophobicContact CB-CG2 3.99Å; V502-F562 HydrophobicContact CB-CD2 4.33Å; V502-F562 HydrophobicContact CB-CE2 4.2Å; V502-F562 HydrophobicContact CG1-CD2 4.4Å; V502-F562 HydrophobicContact CG1-CE2 3.82Å; V502-F562 HydrophobicContact CG1-CZ 4.15Å; V502-F562 HydrophobicContact CG2-CD2 3.67Å; V502-F562 HydrophobicContact CG2-CE2 3.96Å; V502-F562 HydrophobicContact CG2-CG 4.11Å
503	T	88	Confident	84.1	Confident	43 Å²	43	49.8 Å²	49.8	26%	0.264	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.3	178	-55.2	0	0	0	0	109.1	S498 D515	S498-T503 WeakPolarHBondContact CA-OG1 3.25Å; S498-T503 WeakPolarHBondContact CB-OG1 3.23Å; S498-T503 PolarHBondContact O-OG1 3.2Å; T503-D515 PolarHBondContact N-O 3.46Å; T503-D515 PolarHBondContact O-N 3.36Å
504	I	87.2	Confident	84.3	Confident	19 Å²	19	47 Å²	47	10%	0.097	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	111	168.3	-52.9	-171.2	0	0	0	107.4	T513 V553 K555	I504-T513 CarbonylContact C-O 3.55Å; I504-T513 VanDerWaalsContact CA-O 3.31Å; I504-T513 WeakPolarHBondContact CA-O 3.38Å; I504-V553 HydrophobicContact CD1-CG1 4.05Å; I504-V553 HydrophobicContact CG1-CG1 4.23Å; I504-K555 HydrophobicContact CD1-CB 3.92Å; I504-K555 WeakPolarHBondContact CD1-O 3.38Å
505	G	85.6	Confident	84.5	Confident	17 Å²	17	43.4 Å²	43.4	18%	0.175	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	176.7	173.1	0	0	0	0	0	111.5	S512 T513	G505-S512 CarbonylContact O-C 3.54Å; G505-S512 WeakPolarHBondContact O-CA 3.45Å; G505-T513 VanDerWaalsContact C-OG1 3.24Å; G505-T513 WeakPolarHBondContact CA-OG1 3.41Å; G505-T513 PolarHBondContact N-O 3.28Å; G505-T513 PolarHBondContact O-N 3.47Å; G505-T513 PolarHBondContact O-OG1 2.92Å
506	H	84.6	Confident	84.7	Confident	119 Å²	119	42.5 Å²	42.5	55%	0.551	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.1	168.6	-69.6	-80.9	0	0	0	109.3	G510 D511	H506-G510 PolarHBondContact ND1-O 3.32Å; H506-D511 CarbonylContact C-O 3.57Å; H506-D511 VanDerWaalsContact CA-O 3.25Å; H506-D511 WeakPolarHBondContact CA-O 3.36Å
507	D	78.9	Confident	84.8	Confident	48 Å²	48	39.2 Å²	39.2	26%	0.257	26%	0.256	S	S	.	.			trans	-74.3	171	173.1	-166.8	21.4	0	0	0	111.1	R239 C509 G510 D511 T513	R239-D507 IonicContact CZ-OD2 3.09Å; R239-D507 IonicContact NH1-OD2 2.72Å; R239-D507 PolarHBondContact NH1-OD2 3.37Å; R239-D507 VanDerWaalsContact NH1-OD2 3.11Å; R239-D507 IonicContact NH2-OD2 3.32Å; R239-D507 PolarHBondContact NH2-OD2 3.4Å; D507-C509 PolarHBondContact O-N 3.3Å; D507-C509 VanDerWaalsContact O-N 3.12Å; D507-G510 PolarHBondContact O-N 2.91Å; D507-D511 PolarHBondContact N-O 3.41Å; D507-T513 HydrophobicContact CB-CG2 3.88Å
508	S	76.7	Confident	85	Confident	92 Å²	92	36.9 Å²	36.9	64%	0.643	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.6	177.9	56.1	0	0	0	0	113.2	E353 G510	E353-S508 WeakPolarHBondContact OE1-CB 3.32Å; E353-S508 PolarHBondContact OE1-OG 3.19Å; S508-G510 VanDerWaalsContact C-N 3.31Å
509	C	70.9	Confident	85.4	Confident	86 Å²	86	34.2 Å²	34.2	58%	0.581	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-8.4	173.1	-164.1	0	0	0	0	114.2	D507	D507-C509 PolarHBondContact O-N 3.3Å; D507-C509 VanDerWaalsContact O-N 3.12Å
510	G	77.6	Confident	85.6	Confident	45 Å²	45	32.7 Å²	32.7	46%	0.464	21%	0.208	S	C	.	.	S	Bend	trans	91.9	-7.1	-178.4	0	0	0	0	0	115.2	H506 D507 S508	H506-G510 PolarHBondContact ND1-O 3.32Å; D507-G510 PolarHBondContact O-N 2.91Å; S508-G510 VanDerWaalsContact C-N 3.31Å
511	D	81.9	Confident	85.7	Confident	56 Å²	56	34 Å²	34	30%	0.299	22%	0.215	S	C	.	.			trans	-72.3	147.2	178.9	-66.3	-27.6	0	0	0	112.8	S237 R239 H506 D507 T513	S237-D511 WeakPolarHBondContact OG-CB 3.13Å; S237-D511 VanDerWaalsContact OG-CG 3.28Å; S237-D511 PolarHBondContact OG-OD2 3.35Å; R239-D511 IonicContact CZ-OD2 3.03Å; R239-D511 IonicContact NE-OD2 2.92Å; R239-D511 PolarHBondContact NE-OD2 3.45Å; R239-D511 IonicContact NH2-OD2 2.56Å; R239-D511 PolarHBondContact NH2-OD2 3.28Å; R239-D511 VanDerWaalsContact NH2-OD2 3.09Å; H506-D511 CarbonylContact C-O 3.57Å; H506-D511 VanDerWaalsContact CA-O 3.25Å; H506-D511 WeakPolarHBondContact CA-O 3.36Å; D507-D511 PolarHBondContact N-O 3.41Å; D511-T513 PolarHBondContact O-N 2.66Å
512	S	84.3	Confident	85.7	Confident	41 Å²	41	33.5 Å²	33.5	29%	0.287	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	128.1	176	-57.6	0	0	0	0	111.3	G505	G505-S512 CarbonylContact O-C 3.54Å; G505-S512 WeakPolarHBondContact O-CA 3.45Å
513	T	88.3	Confident	85.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	148.1	171.7	52.6	0	0	0	0	109.2	I504 G505 D507 D511	I504-T513 CarbonylContact C-O 3.55Å; I504-T513 VanDerWaalsContact CA-O 3.31Å; I504-T513 WeakPolarHBondContact CA-O 3.38Å; G505-T513 VanDerWaalsContact C-OG1 3.24Å; G505-T513 WeakPolarHBondContact CA-OG1 3.41Å; G505-T513 PolarHBondContact N-O 3.28Å; G505-T513 PolarHBondContact O-N 3.47Å; G505-T513 PolarHBondContact O-OG1 2.92Å; D507-T513 HydrophobicContact CB-CG2 3.88Å; D511-T513 PolarHBondContact O-N 2.66Å
514	I	88.8	Confident	85.6	Confident	35 Å²	35	34.9 Å²	34.9	18%	0.179	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.8	-177.7	-58.9	179.5	0	0	0	108.9	R234 I235 V502 F562	R234-I514 WeakPolarHBondContact CA-O 3.19Å; I235-I514 PolarHBondContact N-O 3.28Å; I235-I514 PolarHBondContact O-N 3.38Å; V502-I514 HydrophobicContact CG1-CG2 3.37Å; I514-F562 HydrophobicContact CD1-CZ 4.29Å; I514-F562 HydrophobicContact CG2-CE1 4.17Å; I514-F562 HydrophobicContact CG2-CE2 4.37Å; I514-F562 HydrophobicContact CG2-CZ 3.59Å
515	D	89.9	Confident	85.7	Confident	32 Å²	32	34 Å²	34	17%	0.171	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.1	178.2	-68	-25.7	0	0	0	110.7	V233 R234 V502 T503	V233-D515 CarbonylContact O-C 3.52Å; V233-D515 WeakPolarHBondContact O-CA 3.22Å; R234-D515 WeakPolarHBondContact CB-OD1 3.47Å; R234-D515 WeakPolarHBondContact CD-OD1 3.25Å; R234-D515 WeakPolarHBondContact CG-OD1 3.39Å; R234-D515 IonicContact CZ-OD1 3.87Å; R234-D515 IonicContact CZ-OD2 2.7Å; R234-D515 IonicContact NE-OD1 2.89Å; R234-D515 PolarHBondContact NE-OD1 2.83Å; R234-D515 IonicContact NE-OD2 3.42Å; R234-D515 IonicContact NH2-OD1 3.48Å; R234-D515 PolarHBondContact NH2-OD1 2.97Å; R234-D515 IonicContact NH2-OD2 3.48Å; R234-D515 PolarHBondContact NH2-OD2 2.92Å; V502-D515 CarbonylContact C-O 3.57Å; V502-D515 VanDerWaalsContact CA-O 3.25Å; V502-D515 WeakPolarHBondContact CA-O 3.45Å; V502-D515 WeakPolarHBondContact CG1-O 3.44Å; T503-D515 PolarHBondContact N-O 3.46Å; T503-D515 PolarHBondContact O-N 3.36Å
516	A	89	Confident	85.9	Confident	10 Å²	10	33.3 Å²	33.3	8%	0.083	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133.4	173.3	0	0	0	0	0	111.3	V233 V520 I521	V233-A516 PolarHBondContact O-N 2.89Å; A516-V520 HydrophobicContact CB-CB 4.24Å; A516-V520 HydrophobicContact CB-CG1 4.18Å; A516-I521 HydrophobicContact CB-CG1 4.02Å
517	G	90.1	Very high	86.4	Confident	7 Å²	7	27.6 Å²	27.6	7%	0.072	18%	0.179	C	C	.	.			trans	-95.4	-175.5	169.7	0	0	0	0	0	112.4	G499 T501 L519 V520 I521	G499-G517 CarbonylContact O-C 3.53Å; G499-G517 VanDerWaalsContact O-CA 3.24Å; G499-G517 WeakPolarHBondContact O-CA 3.47Å; T501-G517 WeakPolarHBondContact O-CA 3.45Å; T501-G517 PolarHBondContact O-N 3.31Å; G517-L519 VanDerWaalsContact C-N 3.33Å; G517-L519 PolarHBondContact O-N 3.3Å; G517-V520 PolarHBondContact O-N 2.77Å; G517-I521 WeakPolarHBondContact O-CG1 3.31Å; G517-I521 PolarHBondContact O-N 2.99Å; G517-I521 VanDerWaalsContact O-N 3.08Å
518	A	89.7	Confident	87.1	Confident	13 Å²	13	25.3 Å²	25.3	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-56.3	-40.2	-169.5	0	0	0	0	0	114.2	V488 V490 G499 L500 S522	V488-A518 HydrophobicContact CG1-CB 3.94Å; V490-A518 HydrophobicContact CG2-CB 3.79Å; G499-A518 PolarHBondContact O-N 3.33Å; L500-A518 PolarHBondContact O-N 2.84Å; A518-S522 WeakPolarHBondContact O-CB 3.49Å; A518-S522 PolarHBondContact O-N 3.23Å; A518-S522 VanDerWaalsContact O-N 3.09Å; A518-S522 PolarHBondContact O-OG 3.37Å
519	L	91.4	Very high	87.8	Confident	0 Å²	0	21 Å²	21	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-71.5	-33.3	-177.1	-65.1	170.5	0	0	0	112.7	L500 G517 S522 C527 V541 L542 V545 V566	L500-L519 HydrophobicContact CB-CD1 4.23Å; L500-L519 HydrophobicContact CD2-CD1 4.11Å; L500-L519 HydrophobicContact CD2-CD2 4.48Å; L500-L519 HydrophobicContact CD2-CG 4.08Å; L500-L519 VanDerWaalsContact O-CB 3.27Å; L500-L519 WeakPolarHBondContact O-CB 3.34Å; L500-L519 WeakPolarHBondContact O-CG 3.35Å; L500-L519 PolarHBondContact O-N 2.7Å; G517-L519 VanDerWaalsContact C-N 3.33Å; G517-L519 PolarHBondContact O-N 3.3Å; L519-S522 WeakPolarHBondContact CA-OG 3.44Å; L519-S522 PolarHBondContact O-OG 2.81Å; L519-C527 HydrophobicContact CD2-CB 4.17Å; L519-V541 HydrophobicContact CD1-CG1 4.3Å; L519-L542 HydrophobicContact CD1-CD2 4.05Å; L519-V545 HydrophobicContact CD1-CG2 4.1Å; L519-V566 HydrophobicContact CD2-CG1 4.07Å
520	V	90.6	Very high	88.7	Confident	2 Å²	2	17.9 Å²	17.9	1%	0.012	11%	0.114	C	C	.	.	H	α-helix	trans	-80.2	-34.9	-179.9	-179.1	0	0	0	0	110.8	S336 V502 A516 G517 S522 N523 V551 F562	S336-V520 WeakPolarHBondContact O-CG1 3.5Å; V502-V520 HydrophobicContact CG2-CB 4.31Å; V502-V520 HydrophobicContact CG2-CG2 3.53Å; A516-V520 HydrophobicContact CB-CB 4.24Å; A516-V520 HydrophobicContact CB-CG1 4.18Å; G517-V520 PolarHBondContact O-N 2.77Å; V520-S522 VanDerWaalsContact C-N 3.28Å; V520-S522 PolarHBondContact O-N 3.06Å; V520-N523 WeakPolarHBondContact O-CB 3.3Å; V520-N523 PolarHBondContact O-N 2.81Å; V520-V551 HydrophobicContact CG2-CG2 4.26Å; V520-F562 HydrophobicContact CG1-CB 4.06Å; V520-F562 HydrophobicContact CG1-CD1 4.47Å; V520-F562 HydrophobicContact CG1-CG 4.44Å; V520-F562 HydrophobicContact CG2-CB 4.16Å
521	I	88.7	Confident	89.2	Confident	29 Å²	29	18.3 Å²	18.3	15%	0.149	10%	0.104	C	C	.	.	H	α-helix	trans	-64.7	-34.3	172.6	-68.2	167.6	0	0	0	111.4	V231 I486 V488 A516 G517 N523	V231-I521 HydrophobicContact CG1-CG1 4.27Å; V231-I521 HydrophobicContact CG1-CG2 4.18Å; I486-I521 WeakPolarHBondContact CG2-O 3.32Å; V488-I521 HydrophobicContact CG2-CG2 4.01Å; A516-I521 HydrophobicContact CB-CG1 4.02Å; G517-I521 WeakPolarHBondContact O-CG1 3.31Å; G517-I521 PolarHBondContact O-N 2.99Å; G517-I521 VanDerWaalsContact O-N 3.08Å; I521-N523 VanDerWaalsContact C-N 3.27Å; I521-N523 PolarHBondContact O-N 3.03Å
522	S	88.6	Confident	89.5	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	19.3	-179.3	52.4	0	0	0	0	114.2	A518 L519 V520 D524 G525 V566	A518-S522 WeakPolarHBondContact O-CB 3.49Å; A518-S522 PolarHBondContact O-N 3.23Å; A518-S522 VanDerWaalsContact O-N 3.09Å; A518-S522 PolarHBondContact O-OG 3.37Å; L519-S522 WeakPolarHBondContact CA-OG 3.44Å; L519-S522 PolarHBondContact O-OG 2.81Å; V520-S522 VanDerWaalsContact C-N 3.28Å; V520-S522 PolarHBondContact O-N 3.06Å; S522-D524 PolarHBondContact O-N 2.75Å; S522-G525 WeakPolarHBondContact O-CA 3.48Å; S522-G525 PolarHBondContact O-N 3.07Å; S522-V566 VanDerWaalsContact O-CG2 3.29Å; S522-V566 WeakPolarHBondContact O-CG2 3.38Å; S522-V566 WeakPolarHBondContact OG-CG2 3.32Å
523	N	88.4	Confident	89.5	Confident	36 Å²	36	15.3 Å²	15.3	19%	0.193	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	137.6	177.5	-178	56.2	0	0	0	111.8	V520 I521 G525 P563 K565	V520-N523 WeakPolarHBondContact O-CB 3.3Å; V520-N523 PolarHBondContact O-N 2.81Å; I521-N523 VanDerWaalsContact C-N 3.27Å; I521-N523 PolarHBondContact O-N 3.03Å; N523-G525 PolarHBondContact O-N 3.43Å; N523-G525 VanDerWaalsContact O-N 3.07Å; N523-P563 PolarHBondContact OD1-O 3.17Å; N523-K565 PolarHBondContact OD1-N 2.91Å
524	D	86.6	Confident	89.3	Confident	42 Å²	42	20.3 Å²	20.3	23%	0.225	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	0.5	-169.3	-67.1	-46.1	0	0	0	115.6	S522 K565 R680	S522-D524 PolarHBondContact O-N 2.75Å; D524-K565 WeakPolarHBondContact CA-O 3.45Å; D524-K565 PolarHBondContact N-O 3.36Å; D524-R680 PolarHBondContact O-NH1 3.17Å; D524-R680 PolarHBondContact O-NH2 3.08Å
525	G	88.8	Confident	89	Confident	2 Å²	2	18.7 Å²	18.7	2%	0.021	10%	0.098	C	C	.	.	S	Bend	trans	-105.9	-147.2	-178.7	0	0	0	0	0	114.2	I486 S522 N523 S567	I486-G525 VanDerWaalsContact O-CA 3.24Å; I486-G525 WeakPolarHBondContact O-CA 3.42Å; S522-G525 WeakPolarHBondContact O-CA 3.48Å; S522-G525 PolarHBondContact O-N 3.07Å; N523-G525 PolarHBondContact O-N 3.43Å; N523-G525 VanDerWaalsContact O-N 3.07Å; G525-S567 PolarHBondContact O-N 2.92Å
526	C	91.3	Very high	88.4	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.007	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142	172.5	72.2	0	0	0	0	111.8	L432 S484 I486 G487 V488 S567 I569	L432-C526 HydrophobicContact CD2-CB 4.16Å; S484-C526 WeakPolarHBondContact CB-SG 3.32Å; I486-C526 PolarHBondContact O-N 3.44Å; G487-C526 WeakPolarHBondContact CA-O 3.32Å; V488-C526 PolarHBondContact N-O 3.06Å; V488-C526 VanDerWaalsContact N-O 3.1Å; C526-S567 WeakPolarHBondContact CA-O 3.32Å; C526-I569 HydrophobicContact CB-CD1 4.42Å
527	C	93.3	Very high	87.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.8	170.6	-177	0	0	0	0	108	L519 V566 S567 I569	L519-C527 HydrophobicContact CD2-CB 4.17Å; C527-V566 HydrophobicContact CB-CG2 3.63Å; C527-S567 PolarHBondContact N-O 3.4Å; C527-I569 PolarHBondContact O-N 3.4Å
528	C	93.9	Very high	87.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.8	177.8	-70.1	0	0	0	0	109.4	L477 V481 V488 Y489 V490 I569	L477-C528 HydrophobicContact CB-CB 4.08Å; L477-C528 HydrophobicContact CD2-CB 4.08Å; L477-C528 PolarHBondContact O-SG 2.6Å; V481-C528 HydrophobicContact CG2-CB 3.67Å; V488-C528 PolarHBondContact O-N 3.41Å; Y489-C528 HydrophobicContact CD2-CB 4.2Å; V490-C528 PolarHBondContact N-O 2.96Å; C528-I569 CarbonylContact C-O 3.56Å; C528-I569 VanDerWaalsContact CA-O 3.28Å; C528-I569 WeakPolarHBondContact CA-O 3.24Å
529	I	92.6	Very high	87.1	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115.8	-176.5	-53	-179.1	0	0	0	109.1	V490 F532 M535 L542 V568 I569 A570 A571	V490-I529 HydrophobicContact CB-CG1 4.46Å; V490-I529 CarbonylContact O-C 3.59Å; V490-I529 VanDerWaalsContact O-CA 3.28Å; V490-I529 WeakPolarHBondContact O-CA 3.26Å; I529-F532 HydrophobicContact CB-CD2 4.4Å; I529-F532 HydrophobicContact CD1-CD2 4.41Å; I529-F532 HydrophobicContact CD1-CE2 4.45Å; I529-F532 HydrophobicContact CG2-CD2 4.02Å; I529-M535 HydrophobicContact CD1-CE 3.99Å; I529-M535 HydrophobicContact CG2-CE 3.45Å; I529-M535 VanDerWaalsContact CG2-CE 3.45Å; I529-M535 HydrophobicContact CG2-SD 3.89Å; I529-L542 HydrophobicContact CD1-CD2 4.4Å; I529-V568 HydrophobicContact CD1-CG1 4.02Å; I529-I569 PolarHBondContact N-O 3.03Å; I529-A570 CarbonylContact O-C 3.55Å; I529-A570 WeakPolarHBondContact O-CA 3.13Å; I529-A571 PolarHBondContact O-N 3.17Å
530	D	89.9	Confident	86.8	Confident	21 Å²	21	36.9 Å²	36.9	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	155.9	169.6	-157.2	-2.7	0	0	0	110.6	T474 L477 Y489 V490 G492 F532	T474-D530 PolarHBondContact OG1-OD2 3.16Å; T474-D530 VanDerWaalsContact OG1-OD2 3.09Å; L477-D530 HydrophobicContact CD1-CB 4.1Å; Y489-D530 HydrophobicContact CE2-CB 4.3Å; Y489-D530 VanDerWaalsContact OH-CB 3.25Å; Y489-D530 WeakPolarHBondContact OH-CB 3.43Å; Y489-D530 PolarHBondContact OH-OD2 3.31Å; Y489-D530 VanDerWaalsContact OH-OD2 3.07Å; V490-D530 PolarHBondContact O-N 2.81Å; G492-D530 PolarHBondContact N-O 2.92Å; D530-F532 VanDerWaalsContact C-N 3.34Å; D530-F532 PolarHBondContact O-N 2.92Å
531	E	86.8	Confident	86.5	Confident	54 Å²	54	38 Å²	38	25%	0.252	19%	0.191	S	C	.	.			trans	53.1	47.6	179.7	-54.1	-180	129.4	0	0	113.2	S491 N493 D533 K534 A571	S491-E531 PolarHBondContact OG-OE2 3.29Å; S491-E531 VanDerWaalsContact OG-OE2 3.14Å; N493-E531 VanDerWaalsContact ND2-CD 3.27Å; N493-E531 PolarHBondContact ND2-OE1 3.34Å; N493-E531 PolarHBondContact ND2-OE2 2.88Å; E531-D533 PolarHBondContact O-N 3.12Å; E531-D533 VanDerWaalsContact O-N 3.11Å; E531-K534 HydrophobicContact CB-CG 4.14Å; E531-K534 WeakPolarHBondContact O-CB 3.25Å; E531-K534 PolarHBondContact O-N 3.17Å; E531-A571 PolarHBondContact N-O 2.82Å
532	F	88.4	Confident	86.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-58.9	-26.8	-175.6	-171.4	-84.9	0	0	0	113.2	I529 D530 K534 M535 H539 L542 A570 A571 I572 I591 F599	I529-F532 HydrophobicContact CB-CD2 4.4Å; I529-F532 HydrophobicContact CD1-CD2 4.41Å; I529-F532 HydrophobicContact CD1-CE2 4.45Å; I529-F532 HydrophobicContact CG2-CD2 4.02Å; D530-F532 VanDerWaalsContact C-N 3.34Å; D530-F532 PolarHBondContact O-N 2.92Å; F532-K534 PolarHBondContact O-N 3.35Å; F532-M535 HydrophobicContact CD2-CE 3.42Å; F532-M535 VanDerWaalsContact CD2-CE 3.42Å; F532-M535 HydrophobicContact CE2-CE 3.64Å; F532-M535 HydrophobicContact CG-CE 4.11Å; F532-M535 HydrophobicContact CZ-CE 4.46Å; F532-M535 PolarHBondContact O-N 3.41Å; F532-H539 AromaticContact CE1-NE2 3.85Å; F532-L542 HydrophobicContact CE2-CD1 3.64Å; F532-L542 HydrophobicContact CZ-CD1 3.81Å; F532-A570 HydrophobicContact CB-CB 4.22Å; F532-A570 HydrophobicContact CD2-CB 3.67Å; F532-A570 HydrophobicContact CE2-CB 4.3Å; F532-A570 HydrophobicContact CG-CB 4.09Å; F532-A571 WeakPolarHBondContact CB-O 3.28Å; F532-A571 PolarHBondContact N-O 2.72Å; F532-I572 HydrophobicContact CB-CB 4.33Å; F532-I572 HydrophobicContact CB-CD1 4.4Å; F532-I572 HydrophobicContact CD1-CD1 4.21Å; F532-I591 HydrophobicContact CD1-CD1 3.56Å; F532-I591 HydrophobicContact CE1-CD1 3.64Å; F532-F599 HydrophobicContact CE2-CZ 4.32Å; F532-F599 HydrophobicContact CZ-CZ 4.23Å
533	D	85.2	Confident	86.6	Confident	34 Å²	34	38.4 Å²	38.4	18%	0.182	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-61.4	-24.2	177.3	64.1	-58.8	0	0	0	113.3	E531 M535 I572	E531-D533 PolarHBondContact O-N 3.12Å; E531-D533 VanDerWaalsContact O-N 3.11Å; D533-M535 VanDerWaalsContact C-N 3.29Å; D533-M535 PolarHBondContact O-N 3.32Å; D533-I572 HydrophobicContact CB-CD1 3.74Å; D533-I572 HydrophobicContact CB-CG1 3.85Å
534	K	83.5	Confident	86.6	Confident	109 Å²	109	38.9 Å²	38.9	47%	0.474	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-81.5	-8	-177.3	-56.7	-62.9	-174.4	-128.3	0	113.4	N493 E531 F532 T536	N493-K534 WeakPolarHBondContact OD1-CB 3.04Å; N493-K534 WeakPolarHBondContact OD1-CG 3.48Å; E531-K534 HydrophobicContact CB-CG 4.14Å; E531-K534 WeakPolarHBondContact O-CB 3.25Å; E531-K534 PolarHBondContact O-N 3.17Å; F532-K534 PolarHBondContact O-N 3.35Å; K534-T536 PolarHBondContact O-N 3.48Å
535	M	83.3	Confident	86.8	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.			trans	-97.6	38.7	-173.4	-67.7	-161.7	-47.4	0	0	115.3	L500 I529 F532 D533 N537 Q538 H539 L542	L500-M535 HydrophobicContact CD1-SD 4.08Å; I529-M535 HydrophobicContact CD1-CE 3.99Å; I529-M535 HydrophobicContact CG2-CE 3.45Å; I529-M535 VanDerWaalsContact CG2-CE 3.45Å; I529-M535 HydrophobicContact CG2-SD 3.89Å; F532-M535 HydrophobicContact CD2-CE 3.42Å; F532-M535 VanDerWaalsContact CD2-CE 3.42Å; F532-M535 HydrophobicContact CE2-CE 3.64Å; F532-M535 HydrophobicContact CG-CE 4.11Å; F532-M535 HydrophobicContact CZ-CE 4.46Å; F532-M535 PolarHBondContact O-N 3.41Å; D533-M535 VanDerWaalsContact C-N 3.29Å; D533-M535 PolarHBondContact O-N 3.32Å; M535-N537 VanDerWaalsContact C-N 3.26Å; M535-N537 PolarHBondContact O-N 2.88Å; M535-N537 VanDerWaalsContact O-N 3.12Å; M535-Q538 HydrophobicContact CB-CB 4.38Å; M535-Q538 PolarHBondContact O-N 2.92Å; M535-Q538 PolarHBondContact O-OE1 3.34Å; M535-H539 PolarHBondContact O-CD2 3.18Å; M535-H539 PolarHBondContact O-NE2 3.37Å; M535-L542 HydrophobicContact CE-CD1 3.78Å
536	T	76.9	Confident	86.9	Confident	92 Å²	92	37 Å²	37	56%	0.564	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-34	-171.3	54.8	0	0	0	0	114.4	K534	K534-T536 PolarHBondContact O-N 3.48Å
537	N	78.6	Confident	86.6	Confident	139 Å²	139	40.3 Å²	40.3	74%	0.743	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-21.1	179.9	-66.9	-35.2	0	0	0	113.6	M535	M535-N537 VanDerWaalsContact C-N 3.26Å; M535-N537 PolarHBondContact O-N 2.88Å; M535-N537 VanDerWaalsContact O-N 3.12Å
538	Q	81.9	Confident	86.3	Confident	11 Å²	11	45.2 Å²	45.2	5%	0.051	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.5	-178.6	-64.6	121.7	-50	0	0	113.3	T495 V497 L500 M535 K540 V541 L542	T495-Q538 PolarHBondContact O-NE2 3.35Å; T495-Q538 PolarHBondContact OG1-NE2 3.39Å; V497-Q538 HydrophobicContact CB-CG 4.46Å; V497-Q538 HydrophobicContact CG2-CG 3.67Å; L500-Q538 HydrophobicContact CD1-CB 4.08Å; L500-Q538 HydrophobicContact CD1-CG 3.57Å; M535-Q538 HydrophobicContact CB-CB 4.38Å; M535-Q538 PolarHBondContact O-N 2.92Å; M535-Q538 PolarHBondContact O-OE1 3.34Å; Q538-K540 PolarHBondContact O-N 3.45Å; Q538-K540 VanDerWaalsContact O-N 3.15Å; Q538-V541 WeakPolarHBondContact O-CB 3.06Å; Q538-V541 PolarHBondContact O-N 3.32Å; Q538-L542 PolarHBondContact O-N 3.29Å; Q538-L542 VanDerWaalsContact O-N 3.13Å
539	H	81.2	Confident	86.1	Confident	29 Å²	29	45.8 Å²	45.8	13%	0.134	23%	0.225	C	C	.	.	H	α-helix	trans	-52.5	-39.4	-178.1	-73.7	-176.2	0	0	0	113.5	F532 M535 V541 L542 L543 L595	F532-H539 AromaticContact CE1-NE2 3.85Å; M535-H539 PolarHBondContact O-CD2 3.18Å; M535-H539 PolarHBondContact O-NE2 3.37Å; H539-V541 VanDerWaalsContact C-N 3.33Å; H539-V541 PolarHBondContact O-N 2.94Å; H539-L542 PolarHBondContact O-N 3.41Å; H539-L543 WeakPolarHBondContact O-CG 3.44Å; H539-L543 PolarHBondContact O-N 3.33Å; H539-L595 HydrophobicContact CB-CD1 3.54Å
540	K	83.7	Confident	86	Confident	173 Å²	173	48.8 Å²	48.8	75%	0.752	24%	0.239	S	C	*	.	H	α-helix	trans	-61.2	-41.6	179.5	-172.8	-179.2	177.1	-174.8	0	112.6	Q538 E544	Q538-K540 PolarHBondContact O-N 3.45Å; Q538-K540 VanDerWaalsContact O-N 3.15Å; K540-E544 PolarHBondContact O-N 3.28Å
541	V	86	Confident	86	Confident	25 Å²	25	47.9 Å²	47.9	15%	0.152	23%	0.234	C	C	.	.	H	α-helix	trans	-67.6	-46.4	177.4	165.2	0	0	0	0	110.3	V497 T501 L519 Q538 H539 L543 E544 V545	V497-V541 HydrophobicContact CG1-CG2 3.96Å; T501-V541 HydrophobicContact CG2-CB 4.01Å; T501-V541 HydrophobicContact CG2-CG1 3.05Å; T501-V541 HydrophobicContact CG2-CG2 3.8Å; L519-V541 HydrophobicContact CD1-CG1 4.3Å; Q538-V541 WeakPolarHBondContact O-CB 3.06Å; Q538-V541 PolarHBondContact O-N 3.32Å; H539-V541 VanDerWaalsContact C-N 3.33Å; H539-V541 PolarHBondContact O-N 2.94Å; V541-L543 PolarHBondContact O-N 2.99Å; V541-E544 WeakPolarHBondContact O-CA 3.43Å; V541-E544 WeakPolarHBondContact O-CB 3.43Å; V541-E544 PolarHBondContact O-N 3.19Å; V541-V545 HydrophobicContact CG1-CG2 4.25Å; V541-V545 WeakPolarHBondContact O-CG2 3.29Å; V541-V545 PolarHBondContact O-N 2.97Å
542	L	89.3	Confident	86	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-35.6	-178.8	-68.2	167.6	0	0	0	111.4	L519 I529 F532 M535 Q538 H539 E544 V545 M546 L595	L519-L542 HydrophobicContact CD1-CD2 4.05Å; I529-L542 HydrophobicContact CD1-CD2 4.4Å; F532-L542 HydrophobicContact CE2-CD1 3.64Å; F532-L542 HydrophobicContact CZ-CD1 3.81Å; M535-L542 HydrophobicContact CE-CD1 3.78Å; Q538-L542 PolarHBondContact O-N 3.29Å; Q538-L542 VanDerWaalsContact O-N 3.13Å; H539-L542 PolarHBondContact O-N 3.41Å; L542-E544 VanDerWaalsContact C-N 3.28Å; L542-E544 PolarHBondContact O-N 3.28Å; L542-V545 PolarHBondContact O-N 3.37Å; L542-M546 HydrophobicContact CB-SD 4.45Å; L542-M546 VanDerWaalsContact O-CB 3.25Å; L542-M546 WeakPolarHBondContact O-CB 3.39Å; L542-M546 WeakPolarHBondContact O-CG 3.35Å; L542-M546 PolarHBondContact O-N 3.27Å; L542-L595 HydrophobicContact CB-CD2 4.34Å
543	L	89.1	Confident	85.9	Confident	38 Å²	38	48 Å²	48	20%	0.199	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-37.5	172.2	-72.9	167.4	0	0	0	112.7	H539 V541 E547 A594 L595 R598	H539-L543 WeakPolarHBondContact O-CG 3.44Å; H539-L543 PolarHBondContact O-N 3.33Å; V541-L543 PolarHBondContact O-N 2.99Å; L543-E547 VanDerWaalsContact O-CB 3.23Å; L543-E547 WeakPolarHBondContact O-CB 3.17Å; L543-A594 HydrophobicContact CD2-CB 4.31Å; L543-L595 HydrophobicContact CD2-CB 4.39Å; L543-L595 HydrophobicContact CD2-CD2 3.53Å; L543-L595 HydrophobicContact CD2-CG 3.62Å; L543-L595 HydrophobicContact CG-CD2 3.62Å; L543-L595 HydrophobicContact CG-CG 3.87Å; L543-R598 PolarHBondContact O-NE 2.92Å
544	E	89.3	Confident	85.8	Confident	45 Å²	45	53.3 Å²	53.3	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-71.2	-50.4	176.9	-174.4	-176.5	162.7	0	0	110.7	K540 V541 L542 E547 Q548 S552	K540-E544 PolarHBondContact O-N 3.28Å; V541-E544 WeakPolarHBondContact O-CA 3.43Å; V541-E544 WeakPolarHBondContact O-CB 3.43Å; V541-E544 PolarHBondContact O-N 3.19Å; L542-E544 VanDerWaalsContact C-N 3.28Å; L542-E544 PolarHBondContact O-N 3.28Å; E544-E547 PolarHBondContact O-N 3.02Å; E544-Q548 WeakPolarHBondContact O-CB 3.47Å; E544-Q548 PolarHBondContact O-N 2.7Å; E544-S552 VanDerWaalsContact OE1-CB 3.3Å; E544-S552 WeakPolarHBondContact OE1-CB 3.22Å; E544-S552 PolarHBondContact OE1-N 2.89Å; E544-S552 PolarHBondContact OE1-OG 3.42Å
545	V	90.7	Very high	85.7	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-46.2	-178	179.2	0	0	0	0	112.1	L519 V541 L542 E547 Q549 V551 A564 V566	L519-V545 HydrophobicContact CD1-CG2 4.1Å; V541-V545 HydrophobicContact CG1-CG2 4.25Å; V541-V545 WeakPolarHBondContact O-CG2 3.29Å; V541-V545 PolarHBondContact O-N 2.97Å; L542-V545 PolarHBondContact O-N 3.37Å; V545-E547 PolarHBondContact O-N 2.88Å; V545-Q549 WeakPolarHBondContact O-CA 3.43Å; V545-Q549 PolarHBondContact O-N 3.26Å; V545-V551 HydrophobicContact CG2-CG2 3.42Å; V545-V551 VanDerWaalsContact CG2-CG2 3.42Å; V545-A564 HydrophobicContact CG1-CB 3.95Å; V545-V566 HydrophobicContact CG1-CG1 4.16Å
546	M	90.1	Very high	85.2	Confident	1 Å²	1	57 Å²	57	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-14.2	-178	-66.6	172.6	75.3	0	0	113.6	R444 H448 L542 V568 L595 R598 F599	R444-M546 WeakPolarHBondContact CD-O 3.41Å; R444-M546 PolarHBondContact NE-O 2.94Å; R444-M546 PolarHBondContact NH1-O 3.46Å; R444-M546 VanDerWaalsContact NH1-O 3.08Å; H448-M546 HydrophobicContact CB-CE 3.99Å; H448-M546 WeakPolarHBondContact CD2-CE 3.12Å; L542-M546 HydrophobicContact CB-SD 4.45Å; L542-M546 VanDerWaalsContact O-CB 3.25Å; L542-M546 WeakPolarHBondContact O-CB 3.39Å; L542-M546 WeakPolarHBondContact O-CG 3.35Å; L542-M546 PolarHBondContact O-N 3.27Å; M546-V568 HydrophobicContact CG-CG2 4.09Å; M546-L595 HydrophobicContact SD-CD2 4.42Å; M546-R598 HydrophobicContact CB-CB 4.33Å; M546-R598 HydrophobicContact CE-CB 3.77Å; M546-F599 HydrophobicContact CE-CD1 3.84Å; M546-F599 HydrophobicContact CE-CD2 4.08Å; M546-F599 HydrophobicContact CE-CE1 3.69Å; M546-F599 HydrophobicContact CE-CE2 3.95Å; M546-F599 HydrophobicContact CE-CG 4.04Å; M546-F599 HydrophobicContact CE-CZ 3.75Å; M546-F599 HydrophobicContact SD-CZ 4.4Å
547	E	85.1	Confident	85	Confident	71 Å²	71	57 Å²	57	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-100.8	-52.4	178.7	-169	75.3	-162.2	0	0	111.5	L543 E544 V545 R598 R716	L543-E547 VanDerWaalsContact O-CB 3.23Å; L543-E547 WeakPolarHBondContact O-CB 3.17Å; E544-E547 PolarHBondContact O-N 3.02Å; V545-E547 PolarHBondContact O-N 2.88Å; E547-R598 IonicContact OE2-CZ 3.57Å; E547-R598 IonicContact OE2-NE 2.81Å; E547-R598 PolarHBondContact OE2-NE 3.37Å; E547-R598 IonicContact OE2-NH2 3.54Å; E547-R598 PolarHBondContact OE2-NH2 2.65Å; E547-R716 IonicContact OE1-CZ 2.71Å; E547-R716 IonicContact OE1-NH2 2.67Å; E547-R716 PolarHBondContact OE1-NH2 3.14Å; E547-R716 IonicContact OE2-CZ 3.16Å; E547-R716 IonicContact OE2-NH1 3.77Å; E547-R716 PolarHBondContact OE2-NH1 3.23Å; E547-R716 IonicContact OE2-NH2 3.64Å; E547-R716 PolarHBondContact OE2-NH2 3.2Å
548	Q	87.3	Confident	84.8	Confident	103 Å²	103	52.6 Å²	52.6	48%	0.481	29%	0.285	S	S	.	.	H	α-helix	trans	-99.1	-7.3	-171.3	-58.4	-177.6	-5.7	0	0	112.8	E544 Q550	E544-Q548 WeakPolarHBondContact O-CB 3.47Å; E544-Q548 PolarHBondContact O-N 2.7Å; Q548-Q550 HydrophobicContact CB-CG 3.69Å; Q548-Q550 PolarHBondContact O-N 2.7Å
549	Q	89.7	Confident	85	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.056	30%	0.304	C	S	.	.	S	Bend	trans	53.4	32.1	-175.8	-58.9	-172.7	-39.4	0	0	113.7	N443 R444 N445 T446 V545 A564 K565	N443-Q549 PolarHBondContact O-OE1 2.86Å; R444-Q549 HydrophobicContact CB-CG 4.43Å; R444-Q549 HydrophobicContact CG-CG 4.27Å; N445-Q549 PolarHBondContact OD1-NE2 3.31Å; T446-Q549 VanDerWaalsContact CG2-NE2 3.31Å; T446-Q549 PolarHBondContact OG1-NE2 2.63Å; V545-Q549 WeakPolarHBondContact O-CA 3.43Å; V545-Q549 PolarHBondContact O-N 3.26Å; Q549-A564 CarbonylContact O-C 3.58Å; Q549-A564 VanDerWaalsContact O-C 3.31Å; Q549-A564 PolarHBondContact O-N 3.08Å; Q549-K565 HydrophobicContact CB-CG 3.98Å
550	Q	90	Very high	85.1	Confident	63 Å²	63	56.5 Å²	56.5	29%	0.294	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157.8	-179.8	65.5	-173.1	-4.2	0	0	110.5	Q548 F562	Q548-Q550 HydrophobicContact CB-CG 3.69Å; Q548-Q550 PolarHBondContact O-N 2.7Å; Q550-F562 CarbonylContact C-O 3.53Å; Q550-F562 WeakPolarHBondContact CA-O 3.33Å
551	V	89.7	Confident	85.3	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.1	172.8	177.1	0	0	0	0	108.1	T501 V520 V545 V553 Q561 F562 A564	T501-V551 HydrophobicContact CG2-CG1 4.25Å; V520-V551 HydrophobicContact CG2-CG2 4.26Å; V545-V551 HydrophobicContact CG2-CG2 3.42Å; V545-V551 VanDerWaalsContact CG2-CG2 3.42Å; V551-V553 HydrophobicContact CG1-CG2 4.05Å; V551-Q561 WeakPolarHBondContact O-CA 3.15Å; V551-F562 PolarHBondContact N-O 2.99Å; V551-F562 PolarHBondContact O-N 3.37Å; V551-A564 HydrophobicContact CG2-CB 3.89Å
552	S	87.8	Confident	85.4	Confident	35 Å²	35	53.1 Å²	53.1	25%	0.245	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.4	171.6	67.1	0	0	0	0	110.9	E544	E544-S552 VanDerWaalsContact OE1-CB 3.3Å; E544-S552 WeakPolarHBondContact OE1-CB 3.22Å; E544-S552 PolarHBondContact OE1-N 2.89Å; E544-S552 PolarHBondContact OE1-OG 3.42Å
553	V	85.8	Confident	85.3	Confident	20 Å²	20	56.1 Å²	56.1	12%	0.121	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.6	174.6	-178.2	0	0	0	0	109.5	V502 I504 V551 K555 H559 S560	V502-V553 HydrophobicContact CB-CG2 3.99Å; I504-V553 HydrophobicContact CD1-CG1 4.05Å; I504-V553 HydrophobicContact CG1-CG1 4.23Å; V551-V553 HydrophobicContact CG1-CG2 4.05Å; V553-K555 HydrophobicContact CG1-CB 4.18Å; V553-H559 WeakPolarHBondContact O-CA 3.48Å; V553-S560 PolarHBondContact N-O 2.82Å; V553-S560 PolarHBondContact O-N 2.79Å
554	F	82	Confident	85.3	Confident	147 Å²	147	54.3 Å²	54.3	65%	0.645	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	96.4	170.8	-68.9	-94.5	0	0	0	108.6	H559	F554-H559 HydrophobicContact CD1-CB 3.85Å; F554-H559 AromaticContact CD1-CD2 3.48Å; F554-H559 VanDerWaalsContact CD1-CD2 3.48Å; F554-H559 WeakPolarHBondContact CD1-CD2 3.24Å; F554-H559 AromaticContact CD1-CG 3.86Å; F554-H559 AromaticContact CD2-CD2 3.82Å; F554-H559 HydrophobicContact CE1-CB 3.78Å; F554-H559 AromaticContact CE1-CD2 2.98Å; F554-H559 WeakPolarHBondContact CE1-CD2 3.48Å; F554-H559 AromaticContact CE1-CG 3.36Å; F554-H559 AromaticContact CE1-NE2 3.61Å; F554-H559 AromaticContact CE2-CD2 3.35Å; F554-H559 WeakPolarHBondContact CE2-CD2 3.42Å; F554-H559 AromaticContact CE2-NE2 3.53Å; F554-H559 AromaticContact CG-CD2 3.89Å; F554-H559 AromaticContact CZ-CD2 2.93Å; F554-H559 WeakPolarHBondContact CZ-CD2 3.29Å; F554-H559 AromaticContact CZ-CE1 3.93Å; F554-H559 AromaticContact CZ-CG 3.74Å; F554-H559 AromaticContact CZ-NE2 3.08Å; F554-H559 WeakPolarHBondContact CZ-NE2 3.32Å
555	K	81.3	Confident	85.3	Confident	127 Å²	127	55.8 Å²	55.8	55%	0.552	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.6	148.5	178.2	-164.7	173.3	-177.3	-175.7	0	110.7	I504 V553 G557 T558	I504-K555 HydrophobicContact CD1-CB 3.92Å; I504-K555 WeakPolarHBondContact CD1-O 3.38Å; V553-K555 HydrophobicContact CG1-CB 4.18Å; K555-G557 PolarHBondContact O-N 3.2Å; K555-G557 VanDerWaalsContact O-N 3.13Å; K555-T558 PolarHBondContact N-O 3.18Å; K555-T558 VanDerWaalsContact N-O 3.15Å; K555-T558 PolarHBondContact O-N 3.48Å
556	A	73.2	Confident	85.3	Confident	60 Å²	60	55.7 Å²	55.7	50%	0.496	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	37.5	178.7	0	0	0	0	0	113.9	T558	A556-T558 PolarHBondContact O-N 3.24Å
557	G	73.8	Confident	85.5	Confident	90 Å²	90	55.8 Å²	55.8	93%	0.928	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	2.5	-179.2	0	0	0	0	0	115.2	K555	K555-G557 PolarHBondContact O-N 3.2Å; K555-G557 VanDerWaalsContact O-N 3.13Å
558	T	74	Confident	85.9	Confident	47 Å²	47	52.4 Å²	52.4	29%	0.288	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	128.2	177.7	-47.9	0	0	0	0	109.5	K555 A556	K555-T558 PolarHBondContact N-O 3.18Å; K555-T558 VanDerWaalsContact N-O 3.15Å; K555-T558 PolarHBondContact O-N 3.48Å; A556-T558 PolarHBondContact O-N 3.24Å
559	H	85.6	Confident	86.2	Confident	96 Å²	96	47.5 Å²	47.5	44%	0.444	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.2	167.9	173.1	-125	0	0	0	108.3	V553 F554 Q561	V553-H559 WeakPolarHBondContact O-CA 3.48Å; F554-H559 HydrophobicContact CD1-CB 3.85Å; F554-H559 AromaticContact CD1-CD2 3.48Å; F554-H559 VanDerWaalsContact CD1-CD2 3.48Å; F554-H559 WeakPolarHBondContact CD1-CD2 3.24Å; F554-H559 AromaticContact CD1-CG 3.86Å; F554-H559 AromaticContact CD2-CD2 3.82Å; F554-H559 HydrophobicContact CE1-CB 3.78Å; F554-H559 AromaticContact CE1-CD2 2.98Å; F554-H559 WeakPolarHBondContact CE1-CD2 3.48Å; F554-H559 AromaticContact CE1-CG 3.36Å; F554-H559 AromaticContact CE1-NE2 3.61Å; F554-H559 AromaticContact CE2-CD2 3.35Å; F554-H559 WeakPolarHBondContact CE2-CD2 3.42Å; F554-H559 AromaticContact CE2-NE2 3.53Å; F554-H559 AromaticContact CG-CD2 3.89Å; F554-H559 AromaticContact CZ-CD2 2.93Å; F554-H559 WeakPolarHBondContact CZ-CD2 3.29Å; F554-H559 AromaticContact CZ-CE1 3.93Å; F554-H559 AromaticContact CZ-CG 3.74Å; F554-H559 AromaticContact CZ-NE2 3.08Å; F554-H559 WeakPolarHBondContact CZ-NE2 3.32Å; H559-Q561 PolarHBondContact CE1-NE2 3.44Å; H559-Q561 PolarHBondContact NE2-NE2 3.04Å
560	S	83.3	Confident	86.4	Confident	26 Å²	26	46.9 Å²	46.9	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.6	177.2	-57.9	0	0	0	0	110.1	V553	V553-S560 PolarHBondContact N-O 2.82Å; V553-S560 PolarHBondContact O-N 2.79Å
561	Q	87.8	Confident	86.4	Confident	110 Å²	110	43.9 Å²	43.9	51%	0.514	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.5	176.7	-66.1	-179.8	-16.3	0	0	108.6	V551 H559	V551-Q561 WeakPolarHBondContact O-CA 3.15Å; H559-Q561 PolarHBondContact CE1-NE2 3.44Å; H559-Q561 PolarHBondContact NE2-NE2 3.04Å
562	F	88	Confident	86.3	Confident	17 Å²	17	43.8 Å²	43.8	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.1	179.6	-59.3	-85.6	0	0	0	109.5	V502 I514 V520 Q550 V551 A564	V502-F562 HydrophobicContact CB-CD2 4.33Å; V502-F562 HydrophobicContact CB-CE2 4.2Å; V502-F562 HydrophobicContact CG1-CD2 4.4Å; V502-F562 HydrophobicContact CG1-CE2 3.82Å; V502-F562 HydrophobicContact CG1-CZ 4.15Å; V502-F562 HydrophobicContact CG2-CD2 3.67Å; V502-F562 HydrophobicContact CG2-CE2 3.96Å; V502-F562 HydrophobicContact CG2-CG 4.11Å; I514-F562 HydrophobicContact CD1-CZ 4.29Å; I514-F562 HydrophobicContact CG2-CE1 4.17Å; I514-F562 HydrophobicContact CG2-CE2 4.37Å; I514-F562 HydrophobicContact CG2-CZ 3.59Å; V520-F562 HydrophobicContact CG1-CB 4.06Å; V520-F562 HydrophobicContact CG1-CD1 4.47Å; V520-F562 HydrophobicContact CG1-CG 4.44Å; V520-F562 HydrophobicContact CG2-CB 4.16Å; Q550-F562 CarbonylContact C-O 3.53Å; Q550-F562 WeakPolarHBondContact CA-O 3.33Å; V551-F562 PolarHBondContact N-O 2.99Å; V551-F562 PolarHBondContact O-N 3.37Å; F562-A564 PolarHBondContact O-N 3.13Å
563	P	87.8	Confident	86.2	Confident	64 Å²	64	43.6 Å²	43.6	42%	0.416	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.7	172	28.9	-33.2	0	0	0	109.6	N523	N523-P563 PolarHBondContact OD1-O 3.17Å
564	A	88.7	Confident	86.1	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	24%	0.243	C	C	.	.			trans	-138.7	58.9	-180	0	0	0	0	0	109.7	V545 Q549 V551 F562 V566	V545-A564 HydrophobicContact CG1-CB 3.95Å; Q549-A564 CarbonylContact O-C 3.58Å; Q549-A564 VanDerWaalsContact O-C 3.31Å; Q549-A564 PolarHBondContact O-N 3.08Å; V551-A564 HydrophobicContact CG2-CB 3.89Å; F562-A564 PolarHBondContact O-N 3.13Å; A564-V566 PolarHBondContact O-N 3.35Å
565	K	89.5	Confident	86	Confident	75 Å²	75	38 Å²	38	33%	0.326	23%	0.23	S	C	.	.			trans	-75.5	67.2	176.5	-63.5	-177.2	179.1	-176.4	0	110.5	N523 D524 Q549	N523-K565 PolarHBondContact OD1-N 2.91Å; D524-K565 WeakPolarHBondContact CA-O 3.45Å; D524-K565 PolarHBondContact N-O 3.36Å; Q549-K565 HydrophobicContact CB-CG 3.98Å
566	V	91.2	Very high	85.8	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	23%	0.233	C	C	.	.			trans	-105.9	142.3	-176.2	75.3	0	0	0	0	111.4	H448 L519 S522 C527 V545 A564 V568	H448-V566 PolarHBondContact CE1-O 3.18Å; L519-V566 HydrophobicContact CD2-CG1 4.07Å; S522-V566 VanDerWaalsContact O-CG2 3.29Å; S522-V566 WeakPolarHBondContact O-CG2 3.38Å; S522-V566 WeakPolarHBondContact OG-CG2 3.32Å; C527-V566 HydrophobicContact CB-CG2 3.63Å; V545-V566 HydrophobicContact CG1-CG1 4.16Å; A564-V566 PolarHBondContact O-N 3.35Å; V566-V568 HydrophobicContact CG1-CG2 3.94Å
567	S	93	Very high	85.9	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	112.9	163.8	-68.4	0	0	0	0	109.3	S431 I447 G525 C526 C527	S431-S567 PolarHBondContact O-OG 2.85Å; I447-S567 WeakPolarHBondContact O-CB 3.18Å; I447-S567 PolarHBondContact O-OG 3.05Å; G525-S567 PolarHBondContact O-N 2.92Å; C526-S567 WeakPolarHBondContact CA-O 3.32Å; C527-S567 PolarHBondContact N-O 3.4Å
568	V	94.3	Very high	86	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.9	175.7	-177.4	0	0	0	0	109.6	H448 V449 I529 M546 V566 F599	H448-V568 VanDerWaalsContact CA-O 3.29Å; H448-V568 WeakPolarHBondContact CA-O 3.1Å; H448-V568 PolarHBondContact ND1-N 3.15Å; H448-V568 VanDerWaalsContact ND1-N 3.12Å; V449-V568 PolarHBondContact N-O 3.25Å; V449-V568 VanDerWaalsContact N-O 3.12Å; I529-V568 HydrophobicContact CD1-CG1 4.02Å; M546-V568 HydrophobicContact CG-CG2 4.09Å; V566-V568 HydrophobicContact CG1-CG2 3.94Å; V568-F599 HydrophobicContact CG1-CE1 4.38Å
569	I	94.6	Very high	86.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.1	173.1	-53	174	0	0	0	106.7	L428 S431 V449 L477 C480 C526 C527 C528 I529	L428-I569 HydrophobicContact CD2-CD1 4.16Å; L428-I569 HydrophobicContact CD2-CG2 3.5Å; S431-I569 WeakPolarHBondContact OG-CD1 3.37Å; V449-I569 HydrophobicContact CB-CG2 4.49Å; V449-I569 WeakPolarHBondContact O-CA 3.35Å; L477-I569 HydrophobicContact CD2-CB 4.18Å; L477-I569 HydrophobicContact CD2-CG2 3.45Å; L477-I569 VanDerWaalsContact CD2-CG2 3.45Å; C480-I569 HydrophobicContact CB-CD1 3.89Å; C526-I569 HydrophobicContact CB-CD1 4.42Å; C527-I569 PolarHBondContact O-N 3.4Å; C528-I569 CarbonylContact C-O 3.56Å; C528-I569 VanDerWaalsContact CA-O 3.28Å; C528-I569 WeakPolarHBondContact CA-O 3.24Å; I529-I569 PolarHBondContact N-O 3.03Å
570	A	92.7	Very high	85.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	140.1	-174	0	0	0	0	0	111.2	V449 L450 I451 I529 F532 F599	V449-A570 PolarHBondContact O-N 3.34Å; L450-A570 CarbonylContact C-O 3.58Å; L450-A570 WeakPolarHBondContact CA-O 3.43Å; L450-A570 HydrophobicContact CD1-CB 3.77Å; I451-A570 PolarHBondContact N-O 3.33Å; I529-A570 CarbonylContact O-C 3.55Å; I529-A570 WeakPolarHBondContact O-CA 3.13Å; F532-A570 HydrophobicContact CB-CB 4.22Å; F532-A570 HydrophobicContact CD2-CB 3.67Å; F532-A570 HydrophobicContact CE2-CB 4.3Å; F532-A570 HydrophobicContact CG-CB 4.09Å; A570-F599 HydrophobicContact CB-CE1 4.06Å; A570-F599 HydrophobicContact CB-CZ 4.12Å
571	A	90.9	Very high	85.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.6	165.2	0	0	0	0	0	110	I451 K473 L477 I529 E531 F532	I451-A571 CarbonylContact O-C 3.53Å; I451-A571 VanDerWaalsContact O-CA 3.32Å; I451-A571 WeakPolarHBondContact O-CA 3.4Å; K473-A571 HydrophobicContact CB-CB 4.48Å; L477-A571 HydrophobicContact CD1-CB 3.75Å; I529-A571 PolarHBondContact O-N 3.17Å; E531-A571 PolarHBondContact N-O 2.82Å; F532-A571 WeakPolarHBondContact CB-O 3.28Å; F532-A571 PolarHBondContact N-O 2.72Å
572	I	87.6	Confident	85.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148	178	-170.3	151.6	0	0	0	112.2	L450 I451 I452 G453 F532 D533 V589 I591	L450-I572 HydrophobicContact CD1-CB 4.26Å; L450-I572 HydrophobicContact CD1-CG2 3.78Å; L450-I572 HydrophobicContact CD2-CG2 4.45Å; L450-I572 HydrophobicContact CG-CG2 4.2Å; I451-I572 PolarHBondContact O-N 2.84Å; I452-I572 WeakPolarHBondContact CA-O 3.43Å; I452-I572 HydrophobicContact CB-CG2 3.98Å; I452-I572 HydrophobicContact CG1-CG2 3.44Å; I452-I572 VanDerWaalsContact CG1-CG2 3.44Å; I452-I572 HydrophobicContact CG2-CG2 4.21Å; G453-I572 PolarHBondContact N-O 2.81Å; F532-I572 HydrophobicContact CB-CB 4.33Å; F532-I572 HydrophobicContact CB-CD1 4.4Å; F532-I572 HydrophobicContact CD1-CD1 4.21Å; D533-I572 HydrophobicContact CB-CD1 3.74Å; D533-I572 HydrophobicContact CB-CG1 3.85Å; I572-V589 HydrophobicContact CD1-CG1 3.23Å; I572-V589 HydrophobicContact CG1-CG1 3.88Å; I572-V589 HydrophobicContact CG2-CG1 4.11Å; I572-I591 HydrophobicContact CD1-CD1 3.21Å; I572-I591 HydrophobicContact CD1-CG1 4Å
573	N	84.7	Confident	84.6	Confident	31 Å²	31	41 Å²	41	17%	0.166	21%	0.209	C	C	.	.			trans	-104	136.1	174.7	-68.6	-36.2	0	0	0	109.5	G453 P455 K473	G453-N573 PolarHBondContact O-OD1 2.55Å; P455-N573 HydrophobicContact CB-CB 4.18Å; P455-N573 HydrophobicContact CG-CB 4.04Å; K473-N573 PolarHBondContact NZ-OD1 3.27Å
574	P	83.8	Confident	84.1	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.032	21%	0.205	C	C	.	.			trans	-59.3	146.3	173.1	23.8	-33.4	0	0	0	111.2	G453 D454 Q576 G577 Y579	G453-P574 WeakPolarHBondContact O-CD 3.46Å; D454-P574 WeakPolarHBondContact OD1-CG 3.35Å; P574-Q576 PolarHBondContact O-N 2.56Å; P574-G577 PolarHBondContact O-N 3.38Å; P574-G577 VanDerWaalsContact O-N 3.08Å; P574-Y579 HydrophobicContact CB-CD2 4.48Å
575	A	79.7	Confident	83.5	Confident	45 Å²	45	40.9 Å²	40.9	37%	0.372	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-24.6	-170	0	0	0	0	0	114.3	N588 K590	A575-N588 WeakPolarHBondContact CB-O 3.44Å; A575-N588 PolarHBondContact N-O 2.92Å; A575-K590 HydrophobicContact CB-CB 4.44Å; A575-K590 HydrophobicContact CB-CD 3.53Å; A575-K590 HydrophobicContact CB-CG 3.71Å
576	Q	78	Confident	82.9	Confident	132 Å²	132	38.4 Å²	38.4	62%	0.617	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	4.2	178.5	-61.1	-168.4	14.2	0	0	113.3	P574 N578	P574-Q576 PolarHBondContact O-N 2.56Å; Q576-N578 PolarHBondContact O-N 3.28Å; Q576-N578 VanDerWaalsContact O-N 3.12Å
577	G	74.5	Confident	82.3	Confident	16 Å²	16	42.7 Å²	42.7	17%	0.165	22%	0.224	C	C	.	.	S	Bend	trans	81.9	-31.3	-176	0	0	0	0	0	114.1	P455 P574	P455-G577 WeakPolarHBondContact CD-O 3.49Å; P455-G577 VanDerWaalsContact CG-O 3.25Å; P455-G577 WeakPolarHBondContact CG-O 3.39Å; P574-G577 PolarHBondContact O-N 3.38Å; P574-G577 VanDerWaalsContact O-N 3.08Å
578	N	75.7	Confident	81.8	Confident	73 Å²	73	42.8 Å²	42.8	39%	0.39	22%	0.224	S	C	.	.	S	Bend	trans	-119.5	147.3	167.7	-69.3	-15.1	0	0	0	109.7	D454 Q576 D580	D454-N578 WeakPolarHBondContact OD1-CA 3.25Å; Q576-N578 PolarHBondContact O-N 3.28Å; Q576-N578 VanDerWaalsContact O-N 3.12Å; N578-D580 PolarHBondContact O-N 3.41Å
579	Y	77.4	Confident	81	Confident	26 Å²	26	43 Å²	43	10%	0.102	23%	0.225	C	C	.	.			trans	-75.2	111.8	175	-170.7	-88.2	0	0	0	110.6	I452 D454 P574 R581 V585 N588 L604 L606	I452-Y579 HydrophobicContact CG2-CD2 4.43Å; D454-Y579 WeakPolarHBondContact OD1-CB 3.4Å; D454-Y579 PolarHBondContact OD1-N 3.37Å; P574-Y579 HydrophobicContact CB-CD2 4.48Å; Y579-R581 PolarHBondContact O-N 3.43Å; Y579-V585 VanDerWaalsContact OH-CG2 3.25Å; Y579-V585 WeakPolarHBondContact OH-CG2 3.3Å; Y579-N588 HydrophobicContact CD2-CB 4.09Å; Y579-N588 HydrophobicContact CE2-CB 3.77Å; Y579-N588 WeakPolarHBondContact CE2-ND2 3.45Å; Y579-N588 VanDerWaalsContact CZ-ND2 3.26Å; Y579-L604 HydrophobicContact CD2-CD2 4.07Å; Y579-L604 HydrophobicContact CE2-CD2 3.49Å; Y579-L604 VanDerWaalsContact CE2-CD2 3.49Å; Y579-L606 HydrophobicContact CD1-CD2 3.67Å; Y579-L606 HydrophobicContact CD2-CD2 4.45Å; Y579-L606 HydrophobicContact CG-CD2 3.64Å
580	D	80	Confident	80.4	Confident	52 Å²	52	50.8 Å²	50.8	28%	0.278	26%	0.259	S	S	.	.			trans	-80.4	114.4	175.8	-171.3	-6.5	0	0	0	110.1	N578 Q582 M583 N588	N578-D580 PolarHBondContact O-N 3.41Å; D580-Q582 PolarHBondContact O-N 2.95Å; D580-Q582 WeakPolarHBondContact OD1-CB 3.35Å; D580-Q582 PolarHBondContact OD1-N 2.88Å; D580-M583 HydrophobicContact CB-CB 4.35Å; D580-M583 HydrophobicContact CB-CG 4.16Å; D580-M583 PolarHBondContact O-N 3.28Å; D580-N588 PolarHBondContact N-OD1 2.9Å; D580-N588 PolarHBondContact O-ND2 3.32Å
581	R	77.3	Confident	79.7	Confident	107 Å²	107	51.4 Å²	51.4	40%	0.404	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.6	179.8	-60.9	179.7	-176.6	-160.6	-6.6	112.9	Y579 E608 F759	Y579-R581 PolarHBondContact O-N 3.43Å; R581-E608 IonicContact CZ-OE1 2.63Å; R581-E608 IonicContact NH1-OE1 2.79Å; R581-E608 IonicContact NH2-OE1 3.81Å; R581-E608 PolarHBondContact NH2-OE1 3.16Å; R581-F759 HydrophobicContact CB-CB 4.27Å
582	Q	78.2	Confident	79.2	Confident	161 Å²	161	55.7 Å²	55.7	75%	0.752	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-19.7	178.7	-57.2	-171.1	-1.2	0	0	112.7	D580	D580-Q582 PolarHBondContact O-N 2.95Å; D580-Q582 WeakPolarHBondContact OD1-CB 3.35Å; D580-Q582 PolarHBondContact OD1-N 2.88Å
583	M	77.3	Confident	78.8	Confident	69 Å²	69	59 Å²	59	34%	0.34	31%	0.308	S	S	.	.	S	Bend	trans	-93.6	156	179.1	-66.3	-166.6	77.3	0	0	111.6	D580 D587 N588	D580-M583 HydrophobicContact CB-CB 4.35Å; D580-M583 HydrophobicContact CB-CG 4.16Å; D580-M583 PolarHBondContact O-N 3.28Å; M583-D587 HydrophobicContact CE-CB 3.61Å; M583-N588 PolarHBondContact O-ND2 3.43Å
584	T	76.2	Confident	78.7	Confident	52 Å²	52	59 Å²	59	32%	0.319	31%	0.313	S	S	.	.			trans	-69.1	155.9	173.6	73.3	0	0	0	0	110.7	A586 D587 N588	T584-A586 PolarHBondContact O-N 3.22Å; T584-D587 PolarHBondContact O-N 3.36Å; T584-D587 PolarHBondContact OG1-N 2.92Å; T584-D587 PolarHBondContact OG1-OD2 3.09Å; T584-N588 WeakPolarHBondContact O-CB 3.48Å; T584-N588 PolarHBondContact O-N 3.34Å; T584-N588 PolarHBondContact O-ND2 2.7Å
585	V	76.5	Confident	78.8	Confident	11 Å²	11	58.8 Å²	58.8	7%	0.067	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-41.3	176.5	-178.6	0	0	0	0	110.9	I452 Y579 D587 N588 V589 L604 A756	I452-V585 HydrophobicContact CD1-CG1 3.8Å; Y579-V585 VanDerWaalsContact OH-CG2 3.25Å; Y579-V585 WeakPolarHBondContact OH-CG2 3.3Å; V585-D587 PolarHBondContact O-N 3.06Å; V585-N588 PolarHBondContact O-N 3.02Å; V585-V589 HydrophobicContact CG1-CG2 4.44Å; V585-V589 WeakPolarHBondContact O-CB 3.19Å; V585-V589 VanDerWaalsContact O-CG2 3.26Å; V585-V589 WeakPolarHBondContact O-CG2 3.44Å; V585-V589 PolarHBondContact O-N 2.94Å; V585-L604 HydrophobicContact CG2-CD1 4.46Å; V585-A756 HydrophobicContact CG2-CB 4.38Å
586	A	77.5	Confident	79	Confident	23 Å²	23	57.3 Å²	57.3	19%	0.19	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-42.5	-179.8	0	0	0	0	0	112	T584 K590 L596	T584-A586 PolarHBondContact O-N 3.22Å; A586-K590 PolarHBondContact O-N 3.24Å; A586-K590 VanDerWaalsContact O-N 3.08Å; A586-L596 HydrophobicContact CB-CD1 4.11Å
587	D	79.4	Confident	79.2	Confident	92 Å²	92	52.4 Å²	52.4	49%	0.492	28%	0.277	S	S	.	.	H	α-helix	trans	-73.3	-37.1	180	-61.2	-39.4	0	0	0	112.3	M583 T584 V585 V589	M583-D587 HydrophobicContact CE-CB 3.61Å; T584-D587 PolarHBondContact O-N 3.36Å; T584-D587 PolarHBondContact OG1-N 2.92Å; T584-D587 PolarHBondContact OG1-OD2 3.09Å; V585-D587 PolarHBondContact O-N 3.06Å; D587-V589 VanDerWaalsContact C-N 3.27Å; D587-V589 PolarHBondContact O-N 3.36Å
588	N	82	Confident	79.8	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-38.5	175.9	-89.2	-43.7	0	0	0	112.3	A575 Y579 D580 M583 T584 V585	A575-N588 WeakPolarHBondContact CB-O 3.44Å; A575-N588 PolarHBondContact N-O 2.92Å; Y579-N588 HydrophobicContact CD2-CB 4.09Å; Y579-N588 HydrophobicContact CE2-CB 3.77Å; Y579-N588 WeakPolarHBondContact CE2-ND2 3.45Å; Y579-N588 VanDerWaalsContact CZ-ND2 3.26Å; D580-N588 PolarHBondContact N-OD1 2.9Å; D580-N588 PolarHBondContact O-ND2 3.32Å; M583-N588 PolarHBondContact O-ND2 3.43Å; T584-N588 WeakPolarHBondContact O-CB 3.48Å; T584-N588 PolarHBondContact O-N 3.34Å; T584-N588 PolarHBondContact O-ND2 2.7Å; V585-N588 PolarHBondContact O-N 3.02Å
589	V	78	Confident	80.5	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-93.3	-17	-172.8	-177	0	0	0	0	112.3	I452 I572 V585 D587 I591	I452-V589 HydrophobicContact CD1-CG2 3.84Å; I452-V589 HydrophobicContact CG1-CG2 4.21Å; I452-V589 HydrophobicContact CG2-CG2 4.16Å; I572-V589 HydrophobicContact CD1-CG1 3.23Å; I572-V589 HydrophobicContact CG1-CG1 3.88Å; I572-V589 HydrophobicContact CG2-CG1 4.11Å; V585-V589 HydrophobicContact CG1-CG2 4.44Å; V585-V589 WeakPolarHBondContact O-CB 3.19Å; V585-V589 VanDerWaalsContact O-CG2 3.26Å; V585-V589 WeakPolarHBondContact O-CG2 3.44Å; V585-V589 PolarHBondContact O-N 2.94Å; D587-V589 VanDerWaalsContact C-N 3.27Å; D587-V589 PolarHBondContact O-N 3.36Å; V589-I591 HydrophobicContact CG1-CB 4.24Å; V589-I591 HydrophobicContact CG1-CD1 3.62Å; V589-I591 HydrophobicContact CG1-CG1 3.83Å; V589-I591 PolarHBondContact O-N 2.76Å
590	K	80.7	Confident	81	Confident	165 Å²	165	49.4 Å²	49.4	72%	0.717	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	29.3	-176.2	-64.6	-175	-178.8	172.1	0	114.4	A575 A586	A575-K590 HydrophobicContact CB-CB 4.44Å; A575-K590 HydrophobicContact CB-CD 3.53Å; A575-K590 HydrophobicContact CB-CG 3.71Å; A586-K590 PolarHBondContact O-N 3.24Å; A586-K590 VanDerWaalsContact O-N 3.08Å
591	I	79.3	Confident	81.5	Confident	12 Å²	12	47 Å²	47	6%	0.062	24%	0.243	C	C	.	.			trans	-99.2	145.8	173.8	-71.1	175.9	0	0	0	110.3	F532 I572 V589 S593 L595 L596	F532-I591 HydrophobicContact CD1-CD1 3.56Å; F532-I591 HydrophobicContact CE1-CD1 3.64Å; I572-I591 HydrophobicContact CD1-CD1 3.21Å; I572-I591 HydrophobicContact CD1-CG1 4Å; V589-I591 HydrophobicContact CG1-CB 4.24Å; V589-I591 HydrophobicContact CG1-CD1 3.62Å; V589-I591 HydrophobicContact CG1-CG1 3.83Å; V589-I591 PolarHBondContact O-N 2.76Å; I591-S593 PolarHBondContact O-N 3.35Å; I591-L595 HydrophobicContact CG2-CB 3.65Å; I591-L595 HydrophobicContact CG2-CD1 4.07Å; I591-L596 HydrophobicContact CB-CD1 4.41Å; I591-L596 HydrophobicContact CB-CG 4.25Å; I591-L596 HydrophobicContact CG2-CD2 4.49Å; I591-L596 HydrophobicContact CG2-CG 3.96Å
592	N	79.6	Confident	82	Confident	91 Å²	91	43 Å²	43	49%	0.487	23%	0.229	S	C	.	.			trans	-56.8	129.1	171.8	-175.2	-12.5	0	0	0	110.9	A594 L595 L596	N592-A594 PolarHBondContact O-N 2.98Å; N592-A594 PolarHBondContact OD1-N 3.1Å; N592-L595 PolarHBondContact O-N 2.9Å; N592-L596 PolarHBondContact O-N 2.88Å
593	S	79	Confident	82.4	Confident	68 Å²	68	35.4 Å²	35.4	48%	0.476	19%	0.194	S	C	.	.	H	α-helix	trans	-51.6	-30.5	176.8	58.8	0	0	0	0	113.3	I591 L595 L596 S597	I591-S593 PolarHBondContact O-N 3.35Å; S593-L595 PolarHBondContact O-N 2.85Å; S593-L596 PolarHBondContact O-N 3.12Å; S593-S597 WeakPolarHBondContact O-CB 3.13Å; S593-S597 PolarHBondContact O-N 2.85Å
594	A	81.9	Confident	82.7	Confident	32 Å²	32	32.3 Å²	32.3	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-61.5	-38.2	174.8	0	0	0	0	0	113.3	L543 N592 S597 R598	L543-A594 HydrophobicContact CD2-CB 4.31Å; N592-A594 PolarHBondContact O-N 2.98Å; N592-A594 PolarHBondContact OD1-N 3.1Å; A594-S597 PolarHBondContact O-OG 3.25Å; A594-R598 PolarHBondContact O-NH1 3.41Å
595	L	85.7	Confident	82.9	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-73.8	-44.6	175.4	-89.4	174.3	0	0	0	111.2	H539 L542 L543 M546 I591 N592 S593 S597 R598 F599	H539-L595 HydrophobicContact CB-CD1 3.54Å; L542-L595 HydrophobicContact CB-CD2 4.34Å; L543-L595 HydrophobicContact CD2-CB 4.39Å; L543-L595 HydrophobicContact CD2-CD2 3.53Å; L543-L595 HydrophobicContact CD2-CG 3.62Å; L543-L595 HydrophobicContact CG-CD2 3.62Å; L543-L595 HydrophobicContact CG-CG 3.87Å; M546-L595 HydrophobicContact SD-CD2 4.42Å; I591-L595 HydrophobicContact CG2-CB 3.65Å; I591-L595 HydrophobicContact CG2-CD1 4.07Å; N592-L595 PolarHBondContact O-N 2.9Å; S593-L595 PolarHBondContact O-N 2.85Å; L595-S597 PolarHBondContact O-N 2.95Å; L595-R598 WeakPolarHBondContact O-CB 3.28Å; L595-R598 PolarHBondContact O-N 3.32Å; L595-F599 WeakPolarHBondContact O-CD2 3.34Å
596	L	84	Confident	82.8	Confident	13 Å²	13	31.4 Å²	31.4	7%	0.068	17%	0.172	C	C	.	.	H	α-helix	trans	-56.9	-40.1	178.2	-74.3	169.1	0	0	0	111.6	L450 A586 I591 N592 S593 R598 F599 I602	L450-L596 HydrophobicContact CD2-CD2 3.66Å; A586-L596 HydrophobicContact CB-CD1 4.11Å; I591-L596 HydrophobicContact CB-CD1 4.41Å; I591-L596 HydrophobicContact CB-CG 4.25Å; I591-L596 HydrophobicContact CG2-CD2 4.49Å; I591-L596 HydrophobicContact CG2-CG 3.96Å; N592-L596 PolarHBondContact O-N 2.88Å; S593-L596 PolarHBondContact O-N 3.12Å; L596-R598 PolarHBondContact O-N 3.46Å; L596-R598 VanDerWaalsContact O-N 3.13Å; L596-F599 PolarHBondContact O-N 2.89Å; L596-I602 HydrophobicContact CD2-CD1 4.4Å
597	S	82.5	Confident	82.5	Confident	29 Å²	29	33.1 Å²	33.1	20%	0.203	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.2	177	76.7	0	0	0	0	115.6	S593 A594 L595 R716	S593-S597 WeakPolarHBondContact O-CB 3.13Å; S593-S597 PolarHBondContact O-N 2.85Å; A594-S597 PolarHBondContact O-OG 3.25Å; L595-S597 PolarHBondContact O-N 2.95Å; S597-R716 PolarHBondContact OG-NH1 3.24Å
598	R	87.6	Confident	82.2	Confident	39 Å²	39	32.5 Å²	32.5	15%	0.147	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-15.2	179.9	-71.8	174.2	168.1	67.2	-0.8	113.2	R444 L543 M546 E547 A594 L595 L596	R444-R598 PolarHBondContact NH1-O 3.33Å; R444-R598 PolarHBondContact NH2-O 3.48Å; L543-R598 PolarHBondContact O-NE 2.92Å; M546-R598 HydrophobicContact CB-CB 4.33Å; M546-R598 HydrophobicContact CE-CB 3.77Å; E547-R598 IonicContact OE2-CZ 3.57Å; E547-R598 IonicContact OE2-NE 2.81Å; E547-R598 PolarHBondContact OE2-NE 3.37Å; E547-R598 IonicContact OE2-NH2 3.54Å; E547-R598 PolarHBondContact OE2-NH2 2.65Å; A594-R598 PolarHBondContact O-NH1 3.41Å; L595-R598 WeakPolarHBondContact O-CB 3.28Å; L595-R598 PolarHBondContact O-N 3.32Å; L596-R598 PolarHBondContact O-N 3.46Å; L596-R598 VanDerWaalsContact O-N 3.13Å
599	F	89.7	Confident	81.7	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	21%	0.207	C	C	.	.			trans	-77.8	132.2	169.6	-68.4	-79.6	0	0	0	108.7	H448 L450 F532 M546 V568 A570 L595 L596 I602	H448-F599 HydrophobicContact CB-CD1 3.81Å; H448-F599 HydrophobicContact CB-CE1 4.4Å; L450-F599 HydrophobicContact CB-CB 4.22Å; L450-F599 HydrophobicContact CB-CD1 3.76Å; L450-F599 HydrophobicContact CB-CD2 4.2Å; L450-F599 HydrophobicContact CB-CE1 4.11Å; L450-F599 HydrophobicContact CB-CG 3.8Å; L450-F599 HydrophobicContact CB-CZ 4.48Å; L450-F599 HydrophobicContact CD1-CE1 4.5Å; L450-F599 HydrophobicContact CD1-CE2 4.48Å; L450-F599 HydrophobicContact CD1-CZ 4.26Å; L450-F599 HydrophobicContact CD2-CD2 4.16Å; L450-F599 HydrophobicContact CD2-CE2 4.3Å; F532-F599 HydrophobicContact CE2-CZ 4.32Å; F532-F599 HydrophobicContact CZ-CZ 4.23Å; M546-F599 HydrophobicContact CE-CD1 3.84Å; M546-F599 HydrophobicContact CE-CD2 4.08Å; M546-F599 HydrophobicContact CE-CE1 3.69Å; M546-F599 HydrophobicContact CE-CE2 3.95Å; M546-F599 HydrophobicContact CE-CG 4.04Å; M546-F599 HydrophobicContact CE-CZ 3.75Å; M546-F599 HydrophobicContact SD-CZ 4.4Å; V568-F599 HydrophobicContact CG1-CE1 4.38Å; A570-F599 HydrophobicContact CB-CE1 4.06Å; A570-F599 HydrophobicContact CB-CZ 4.12Å; L595-F599 WeakPolarHBondContact O-CD2 3.34Å; L596-F599 PolarHBondContact O-N 2.89Å; F599-I602 HydrophobicContact CB-CG1 4.21Å
600	D	89.3	Confident	81.7	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.027	22%	0.223	C	C	.	.	S	Bend	trans	-79.3	-33.6	-179.4	-54.4	-71.2	0	0	0	110.5	R444 I447 H448 S720 R723	R444-D600 IonicContact CZ-OD2 3.9Å; R444-D600 IonicContact NH2-OD1 2.92Å; R444-D600 PolarHBondContact NH2-OD1 3.46Å; R444-D600 IonicContact NH2-OD2 3.54Å; R444-D600 PolarHBondContact NH2-OD2 2.82Å; I447-D600 VanDerWaalsContact CA-OD2 3.22Å; I447-D600 WeakPolarHBondContact CA-OD2 3.13Å; I447-D600 HydrophobicContact CG2-CB 4.3Å; H448-D600 PolarHBondContact N-OD2 2.82Å; H448-D600 PolarHBondContact O-N 3.29Å; D600-S720 WeakPolarHBondContact CA-OG 3.21Å; D600-S720 PolarHBondContact OD1-OG 3.1Å; D600-R723 IonicContact OD1-NH1 3.72Å; D600-R723 PolarHBondContact OD1-NH1 3.38Å
601	V	88.9	Confident	81.7	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.8	179.7	-168.8	0	0	0	0	110.8	H448 V449 L450 F603 L724 L749	H448-V601 PolarHBondContact O-N 3.13Å; V449-V601 WeakPolarHBondContact CA-O 3.26Å; L450-V601 PolarHBondContact N-O 3.02Å; V601-F603 HydrophobicContact CB-CE2 4.22Å; V601-F603 HydrophobicContact CG1-CD2 3.9Å; V601-F603 HydrophobicContact CG1-CE1 4.17Å; V601-F603 HydrophobicContact CG1-CE2 3.28Å; V601-F603 HydrophobicContact CG1-CZ 3.45Å; V601-F603 VanDerWaalsContact CG1-CZ 3.45Å; V601-L724 HydrophobicContact CG2-CD1 3.6Å; V601-L724 HydrophobicContact CG2-CD2 4.08Å; V601-L724 HydrophobicContact CG2-CG 4.42Å; V601-L749 HydrophobicContact CG2-CD1 4.33Å
602	I	88.3	Confident	81.9	Confident	24 Å²	24	43 Å²	43	12%	0.123	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	111.4	179.7	-55.3	174.9	0	0	0	109.1	L450 I452 L596 F599 S752	L450-I602 HydrophobicContact CB-CG1 4.31Å; L450-I602 HydrophobicContact CB-CG2 4.47Å; L450-I602 HydrophobicContact CD2-CG2 4.23Å; L450-I602 CarbonylContact O-C 3.49Å; L450-I602 WeakPolarHBondContact O-CA 3.37Å; I452-I602 HydrophobicContact CD1-CG2 3.48Å; I452-I602 VanDerWaalsContact CD1-CG2 3.48Å; I452-I602 HydrophobicContact CG1-CG2 4.2Å; L596-I602 HydrophobicContact CD2-CD1 4.4Å; F599-I602 HydrophobicContact CB-CG1 4.21Å; I602-S752 WeakPolarHBondContact O-CB 3.42Å; I602-S752 PolarHBondContact O-OG 3Å
603	F	87.7	Confident	81.7	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	140.7	177.1	-69.3	-74.1	0	0	0	112	M423 V424 A427 V449 L450 I452 V601 I748	M423-F603 HydrophobicContact CB-CE1 4.37Å; V424-F603 HydrophobicContact CB-CD2 4.49Å; V424-F603 HydrophobicContact CB-CG 4.48Å; V424-F603 HydrophobicContact CG1-CD2 4.17Å; V424-F603 HydrophobicContact CG1-CG 4.41Å; V424-F603 HydrophobicContact CG2-CB 4.16Å; V424-F603 HydrophobicContact CG2-CD1 3.76Å; V424-F603 HydrophobicContact CG2-CD2 4.28Å; V424-F603 HydrophobicContact CG2-CE1 4.18Å; V424-F603 HydrophobicContact CG2-CG 3.8Å; A427-F603 HydrophobicContact CB-CE2 3.33Å; A427-F603 HydrophobicContact CB-CZ 3.49Å; A427-F603 VanDerWaalsContact CB-CZ 3.49Å; V449-F603 HydrophobicContact CG1-CD2 4Å; V449-F603 HydrophobicContact CG1-CE2 4.12Å; L450-F603 PolarHBondContact O-N 3.12Å; I452-F603 PolarHBondContact N-O 3.38Å; V601-F603 HydrophobicContact CB-CE2 4.22Å; V601-F603 HydrophobicContact CG1-CD2 3.9Å; V601-F603 HydrophobicContact CG1-CE1 4.17Å; V601-F603 HydrophobicContact CG1-CE2 3.28Å; V601-F603 HydrophobicContact CG1-CZ 3.45Å; V601-F603 VanDerWaalsContact CG1-CZ 3.45Å; F603-I748 HydrophobicContact CZ-CG2 3.96Å
604	L	82.4	Confident	81.8	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	92.3	176.9	-73.4	157	0	0	0	109.4	I452 Y579 V585 L606 Q755 A756	I452-L604 HydrophobicContact CB-CD2 4.02Å; I452-L604 HydrophobicContact CD1-CD2 3.82Å; I452-L604 HydrophobicContact CD1-CG 4.48Å; I452-L604 HydrophobicContact CG2-CD2 4.09Å; Y579-L604 HydrophobicContact CD2-CD2 4.07Å; Y579-L604 HydrophobicContact CE2-CD2 3.49Å; Y579-L604 VanDerWaalsContact CE2-CD2 3.49Å; V585-L604 HydrophobicContact CG2-CD1 4.46Å; L604-L606 VanDerWaalsContact C-N 3.35Å; L604-L606 PolarHBondContact O-N 3.2Å; L604-Q755 HydrophobicContact CB-CB 3.94Å; L604-Q755 HydrophobicContact CD1-CB 4.29Å; L604-Q755 PolarHBondContact O-NE2 2.9Å; L604-Q755 PolarHBondContact O-OE1 3.08Å; L604-A756 HydrophobicContact CD1-CB 3.78Å
605	L	80.9	Confident	81.9	Confident	13 Å²	13	46 Å²	46	7%	0.068	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	85.5	173.2	-65.1	179.5	0	0	0	109.7	E421 V424 I451 I452 G453 K473	E421-L605 HydrophobicContact CG-CD2 4.16Å; V424-L605 HydrophobicContact CG2-CD2 4.09Å; I451-L605 HydrophobicContact CG2-CD1 3.43Å; I451-L605 VanDerWaalsContact CG2-CD1 3.43Å; I451-L605 HydrophobicContact CG2-CG 3.98Å; I452-L605 PolarHBondContact O-N 2.91Å; G453-L605 VanDerWaalsContact CA-O 3.28Å; G453-L605 WeakPolarHBondContact CA-O 3.14Å; K473-L605 HydrophobicContact CG-CD1 4.19Å
606	L	75.6	Confident	81.8	Confident	31 Å²	31	50.6 Å²	50.6	16%	0.162	25%	0.248	C	C	.	.			trans	-83.9	136.5	172.4	-58.4	177.4	0	0	0	110.1	Y579 L604 E608	Y579-L606 HydrophobicContact CD1-CD2 3.67Å; Y579-L606 HydrophobicContact CD2-CD2 4.45Å; Y579-L606 HydrophobicContact CG-CD2 3.64Å; L604-L606 VanDerWaalsContact C-N 3.35Å; L604-L606 PolarHBondContact O-N 3.2Å; L606-E608 HydrophobicContact CB-CG 4.49Å; L606-E608 PolarHBondContact O-N 2.88Å
607	D	70.8	Confident	81.6	Confident	59 Å²	59	50.5 Å²	50.5	32%	0.316	25%	0.248	S	C	.	.			trans	-82.1	102.6	171.1	-166.5	9.2	0	0	0	109.1	N465	N465-D607 WeakPolarHBondContact CB-OD1 3.38Å; N465-D607 WeakPolarHBondContact CB-OD2 3.41Å
608	E	72	Confident	81.5	Confident	78 Å²	78	51 Å²	51	36%	0.364	25%	0.251	S	S	.	.			trans	-108.6	124.6	173.2	-62.1	-166.9	146.1	0	0	108.6	R581 L606 D610 F759	R581-E608 IonicContact CZ-OE1 2.63Å; R581-E608 IonicContact NH1-OE1 2.79Å; R581-E608 IonicContact NH2-OE1 3.81Å; R581-E608 PolarHBondContact NH2-OE1 3.16Å; L606-E608 HydrophobicContact CB-CG 4.49Å; L606-E608 PolarHBondContact O-N 2.88Å; E608-D610 PolarHBondContact O-N 3.32Å; E608-F759 WeakPolarHBondContact OE1-CZ 3.43Å
609	A	71.6	Confident	81.3	Confident	92 Å²	92	50.5 Å²	50.5	76%	0.76	26%	0.255	S	S	*	.			trans	-65.2	107	176.6	0	0	0	0	0	110
610	D	77.4	Confident	80.8	Confident	69 Å²	69	51.5 Å²	51.5	37%	0.369	26%	0.26	S	S	.	.			trans	-132.8	107.4	176.2	175.1	-1.9	0	0	0	108.3	E608 E612 R613 D614	E608-D610 PolarHBondContact O-N 3.32Å; D610-E612 PolarHBondContact O-N 3.4Å; D610-E612 WeakPolarHBondContact OD1-CB 3.22Å; D610-E612 PolarHBondContact OD1-N 2.95Å; D610-R613 HydrophobicContact CB-CB 3.87Å; D610-R613 PolarHBondContact O-N 3.22Å; D610-R613 PolarHBondContact OD1-N 2.86Å; D610-R613 WeakPolarHBondContact OD2-CB 3.47Å; D610-D614 WeakPolarHBondContact O-CB 3.49Å; D610-D614 VanDerWaalsContact O-CG 3.28Å; D610-D614 PolarHBondContact O-N 3.49Å
611	E	81.1	Confident	80.3	Confident	160 Å²	160	53.3 Å²	53.3	75%	0.748	27%	0.271	S	S	*	.	H	α-helix	trans	-57.2	-35.6	-177.7	-68.7	-171.7	171.4	0	0	112.8	R615	E611-R615 VanDerWaalsContact O-CB 3.23Å; E611-R615 WeakPolarHBondContact O-CB 3.39Å; E611-R615 PolarHBondContact O-N 2.96Å
612	E	84.1	Confident	79.9	Confident	85 Å²	85	57.9 Å²	57.9	40%	0.397	30%	0.295	S	S	.	.	H	α-helix	trans	-71.2	-43	-177.7	-156.3	73.9	-153.3	0	0	110	D610 R615 R616	D610-E612 PolarHBondContact O-N 3.4Å; D610-E612 WeakPolarHBondContact OD1-CB 3.22Å; D610-E612 PolarHBondContact OD1-N 2.95Å; E612-R615 PolarHBondContact O-N 3.46Å; E612-R615 IonicContact OE1-NH1 3.81Å; E612-R615 PolarHBondContact OE1-NH1 3.08Å; E612-R615 IonicContact OE2-CZ 3.29Å; E612-R615 IonicContact OE2-NH1 2.97Å; E612-R615 PolarHBondContact OE2-NH1 3.32Å; E612-R615 IonicContact OE2-NH2 2.74Å; E612-R616 WeakPolarHBondContact O-CG 3.4Å; E612-R616 PolarHBondContact O-N 2.84Å; E612-R616 VanDerWaalsContact O-N 3.08Å
613	R	76.3	Confident	79.4	Confident	82 Å²	82	59 Å²	59	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-44.4	176.2	-168	-176.1	-140.8	159.6	-2.1	111.1	E421 D610 R615 R616 I617	E421-R613 IonicContact OE1-CZ 3.82Å; E421-R613 IonicContact OE1-NH2 3.28Å; E421-R613 PolarHBondContact OE1-NH2 3.43Å; D610-R613 HydrophobicContact CB-CB 3.87Å; D610-R613 PolarHBondContact O-N 3.22Å; D610-R613 PolarHBondContact OD1-N 2.86Å; D610-R613 WeakPolarHBondContact OD2-CB 3.47Å; R613-R615 VanDerWaalsContact C-N 3.34Å; R613-R615 PolarHBondContact O-N 3.39Å; R613-R616 PolarHBondContact O-N 2.94Å; R613-I617 HydrophobicContact CG-CD1 3.96Å; R613-I617 WeakPolarHBondContact O-CB 3.42Å; R613-I617 VanDerWaalsContact O-CG1 3.24Å; R613-I617 WeakPolarHBondContact O-CG1 3.4Å; R613-I617 PolarHBondContact O-N 3.39Å
614	D	79.9	Confident	78.8	Confident	43 Å²	43	62.2 Å²	62.2	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-36.9	179.3	-68.8	-13	0	0	0	111.5	N465 D610 I617 S618	N465-D614 PolarHBondContact ND2-OD2 2.91Å; N465-D614 PolarHBondContact OD1-OD1 3.17Å; N465-D614 PolarHBondContact OD1-OD2 2.87Å; D610-D614 WeakPolarHBondContact O-CB 3.49Å; D610-D614 VanDerWaalsContact O-CG 3.28Å; D610-D614 PolarHBondContact O-N 3.49Å; D614-I617 PolarHBondContact O-N 3.36Å; D614-S618 VanDerWaalsContact O-CB 3.31Å; D614-S618 WeakPolarHBondContact O-CB 3.23Å; D614-S618 PolarHBondContact O-N 3.38Å; D614-S618 PolarHBondContact O-OG 3.12Å
615	R	84.6	Confident	78.3	Confident	129 Å²	129	72.1 Å²	72.1	49%	0.487	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-46.3	172.5	-167.4	-172.7	-54.3	132.1	8.5	111.7	E611 E612 R613 S618 A619	E611-R615 VanDerWaalsContact O-CB 3.23Å; E611-R615 WeakPolarHBondContact O-CB 3.39Å; E611-R615 PolarHBondContact O-N 2.96Å; E612-R615 PolarHBondContact O-N 3.46Å; E612-R615 IonicContact OE1-NH1 3.81Å; E612-R615 PolarHBondContact OE1-NH1 3.08Å; E612-R615 IonicContact OE2-CZ 3.29Å; E612-R615 IonicContact OE2-NH1 2.97Å; E612-R615 PolarHBondContact OE2-NH1 3.32Å; E612-R615 IonicContact OE2-NH2 2.74Å; R613-R615 VanDerWaalsContact C-N 3.34Å; R613-R615 PolarHBondContact O-N 3.39Å; R615-S618 WeakPolarHBondContact CA-OG 3.47Å; R615-S618 PolarHBondContact O-OG 2.72Å; R615-A619 WeakPolarHBondContact O-CB 3.47Å; R615-A619 PolarHBondContact O-N 3.24Å
616	R	82.8	Confident	77.9	Confident	96 Å²	96	78.9 Å²	78.9	36%	0.362	38%	0.378	S	S	.	.	H	α-helix	trans	-66.3	-41.5	177.7	-66.8	-172	-160.7	113.7	-4.7	112	Y419 E612 R613 A619 H620	Y419-R616 HydrophobicContact CD1-CB 4.15Å; Y419-R616 HydrophobicContact CE1-CB 3.56Å; Y419-R616 HydrophobicContact CE1-CG 4.44Å; Y419-R616 VanDerWaalsContact OH-CD 3.23Å; Y419-R616 WeakPolarHBondContact OH-CD 3.27Å; E612-R616 WeakPolarHBondContact O-CG 3.4Å; E612-R616 PolarHBondContact O-N 2.84Å; E612-R616 VanDerWaalsContact O-N 3.08Å; R613-R616 PolarHBondContact O-N 2.94Å; R616-A619 PolarHBondContact O-N 2.97Å; R616-H620 WeakPolarHBondContact O-CB 3.33Å; R616-H620 PolarHBondContact O-N 2.99Å
617	I	80	Confident	76.9	Confident	11 Å²	11	83.1 Å²	83.1	6%	0.056	41%	0.407	C	S	.	.	H	α-helix	trans	-60.8	-50.8	176.3	-73	168.7	0	0	0	110.7	Y419 F468 R613 D614 A619 H620 V621	Y419-I617 HydrophobicContact CD1-CG1 4.03Å; F468-I617 HydrophobicContact CD1-CD1 4.39Å; F468-I617 HydrophobicContact CD1-CG2 3.97Å; F468-I617 HydrophobicContact CD2-CG2 4.32Å; F468-I617 HydrophobicContact CE1-CB 4.44Å; F468-I617 HydrophobicContact CE1-CD1 4.1Å; F468-I617 HydrophobicContact CE1-CG1 4.3Å; F468-I617 HydrophobicContact CE1-CG2 3.31Å; F468-I617 HydrophobicContact CE2-CG2 3.75Å; F468-I617 HydrophobicContact CG-CG2 4.44Å; F468-I617 HydrophobicContact CZ-CG2 3.21Å; R613-I617 HydrophobicContact CG-CD1 3.96Å; R613-I617 WeakPolarHBondContact O-CB 3.42Å; R613-I617 VanDerWaalsContact O-CG1 3.24Å; R613-I617 WeakPolarHBondContact O-CG1 3.4Å; R613-I617 PolarHBondContact O-N 3.39Å; D614-I617 PolarHBondContact O-N 3.36Å; I617-A619 VanDerWaalsContact C-N 3.34Å; I617-A619 PolarHBondContact O-N 2.9Å; I617-H620 WeakPolarHBondContact O-CB 3.49Å; I617-H620 PolarHBondContact O-N 3.34Å; I617-V621 HydrophobicContact CG2-CG2 4.41Å; I617-V621 WeakPolarHBondContact O-CG2 3.3Å; I617-V621 PolarHBondContact O-N 3.23Å
618	S	79.9	Confident	76	Confident	40 Å²	40	89 Å²	89	28%	0.28	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-42	-179.1	55.2	0	0	0	0	111.7	D614 R615 H620 V621 I622	D614-S618 VanDerWaalsContact O-CB 3.31Å; D614-S618 WeakPolarHBondContact O-CB 3.23Å; D614-S618 PolarHBondContact O-N 3.38Å; D614-S618 PolarHBondContact O-OG 3.12Å; R615-S618 WeakPolarHBondContact CA-OG 3.47Å; R615-S618 PolarHBondContact O-OG 2.72Å; S618-H620 PolarHBondContact O-N 3.45Å; S618-V621 PolarHBondContact O-N 3.4Å; S618-I622 WeakPolarHBondContact O-CB 3.33Å; S618-I622 WeakPolarHBondContact O-CD1 3.32Å; S618-I622 WeakPolarHBondContact O-CG1 3.47Å; S618-I622 PolarHBondContact O-N 2.73Å
619	A	83.1	Confident	74.6	Confident	28 Å²	28	88.4 Å²	88.4	23%	0.231	44%	0.437	C	S	.	.	H	α-helix	trans	-57.4	-47.3	173.8	0	0	0	0	0	112.1	R615 R616 I617 I622 Q623 F635	R615-A619 WeakPolarHBondContact O-CB 3.47Å; R615-A619 PolarHBondContact O-N 3.24Å; R616-A619 PolarHBondContact O-N 2.97Å; I617-A619 VanDerWaalsContact C-N 3.34Å; I617-A619 PolarHBondContact O-N 2.9Å; A619-I622 PolarHBondContact O-N 3.4Å; A619-Q623 WeakPolarHBondContact O-CB 3.39Å; A619-Q623 PolarHBondContact O-N 3.45Å; A619-F635 HydrophobicContact CB-CE2 4.25Å; A619-F635 HydrophobicContact CB-CZ 3.97Å
620	H	80.1	Confident	73.3	Confident	30 Å²	30	89.2 Å²	89.2	14%	0.139	44%	0.444	C	S	.	.	H	α-helix	trans	-61	-46.4	178.3	-171	73.2	0	0	0	112.5	P416 T417 Y419 R616 I617 S618 I622 Q623 L624	P416-H620 PolarHBondContact O-CE1 2.92Å; P416-H620 PolarHBondContact O-NE2 3.22Å; T417-H620 PolarHBondContact O-CD2 3.34Å; Y419-H620 HydrophobicContact CD2-CB 4.3Å; Y419-H620 HydrophobicContact CG-CB 4.31Å; R616-H620 WeakPolarHBondContact O-CB 3.33Å; R616-H620 PolarHBondContact O-N 2.99Å; I617-H620 WeakPolarHBondContact O-CB 3.49Å; I617-H620 PolarHBondContact O-N 3.34Å; S618-H620 PolarHBondContact O-N 3.45Å; H620-I622 PolarHBondContact O-N 2.87Å; H620-Q623 PolarHBondContact O-N 3.01Å; H620-L624 VanDerWaalsContact CD2-CD1 3.43Å; H620-L624 WeakPolarHBondContact CD2-CD1 3.46Å; H620-L624 WeakPolarHBondContact NE2-CD1 3.2Å; H620-L624 PolarHBondContact O-N 3.39Å
621	V	79.1	Confident	71.3	Confident	42 Å²	42	89 Å²	89	26%	0.255	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-40.3	180	174.2	0	0	0	0	111.7	F468 I617 S618 Q623 L624 R625	F468-V621 HydrophobicContact CE2-CG2 3.78Å; F468-V621 HydrophobicContact CZ-CG2 4Å; I617-V621 HydrophobicContact CG2-CG2 4.41Å; I617-V621 WeakPolarHBondContact O-CG2 3.3Å; I617-V621 PolarHBondContact O-N 3.23Å; S618-V621 PolarHBondContact O-N 3.4Å; V621-Q623 VanDerWaalsContact C-N 3.3Å; V621-Q623 PolarHBondContact O-N 2.74Å; V621-L624 PolarHBondContact O-N 3.3Å; V621-R625 PolarHBondContact O-N 2.99Å
622	I	79.8	Confident	69.6	Low	98 Å²	98	86 Å²	86	50%	0.503	43%	0.434	S	S	.	.	H	α-helix	trans	-62.6	-41.9	175.6	-70.2	165.7	0	0	0	110.1	S618 A619 H620 R625 R626	S618-I622 WeakPolarHBondContact O-CB 3.33Å; S618-I622 WeakPolarHBondContact O-CD1 3.32Å; S618-I622 WeakPolarHBondContact O-CG1 3.47Å; S618-I622 PolarHBondContact O-N 2.73Å; A619-I622 PolarHBondContact O-N 3.4Å; H620-I622 PolarHBondContact O-N 2.87Å; I622-R625 PolarHBondContact O-N 3.5Å; I622-R626 PolarHBondContact O-N 3.5Å
623	Q	78.4	Confident	67.4	Low	47 Å²	47	88.1 Å²	88.1	22%	0.22	45%	0.447	C	S	.	.	H	α-helix	trans	-64.6	-42.2	179.9	-167.9	161.7	-5.1	0	0	112.1	A619 H620 V621 R625 R626 L633	A619-Q623 WeakPolarHBondContact O-CB 3.39Å; A619-Q623 PolarHBondContact O-N 3.45Å; H620-Q623 PolarHBondContact O-N 3.01Å; V621-Q623 VanDerWaalsContact C-N 3.3Å; V621-Q623 PolarHBondContact O-N 2.74Å; Q623-R625 PolarHBondContact O-N 3.28Å; Q623-R626 PolarHBondContact O-N 3.11Å; Q623-L633 PolarHBondContact NE2-O 2.81Å
624	L	74.1	Confident	65.6	Low	70 Å²	70	87 Å²	87	37%	0.366	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-29.6	174.2	-86.8	151.2	0	0	0	114	T417 H620 V621	T417-L624 HydrophobicContact CG2-CD2 4.18Å; T417-L624 WeakPolarHBondContact O-CD1 3.49Å; H620-L624 VanDerWaalsContact CD2-CD1 3.43Å; H620-L624 WeakPolarHBondContact CD2-CD1 3.46Å; H620-L624 WeakPolarHBondContact NE2-CD1 3.2Å; H620-L624 PolarHBondContact O-N 3.39Å; V621-L624 PolarHBondContact O-N 3.3Å
625	R	72.5	Confident	63.6	Low	212 Å²	212	91.5 Å²	91.5	80%	0.8	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-5.1	-178.3	-69.5	-172.1	-179.4	-154.8	1.6	114	V621 I622 Q623	V621-R625 PolarHBondContact O-N 2.99Å; I622-R625 PolarHBondContact O-N 3.5Å; Q623-R625 PolarHBondContact O-N 3.28Å
626	R	73.2	Confident	61	Low	154 Å²	154	91.4 Å²	91.4	58%	0.581	49%	0.485	S	S	*	.			trans	-73.5	124.4	177.8	-78.2	-175.2	178.6	145.9	0.6	110.1	I622 Q623 H628	I622-R626 PolarHBondContact O-N 3.5Å; Q623-R626 PolarHBondContact O-N 3.11Å; R626-H628 PolarHBondContact O-N 3.42Å
627	P	53.9	Low	58.8	Low	120 Å²	120	93.6 Å²	93.6	78%	0.779	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	0.2	-169.2	25.4	-33.6	0	0	0	115.8
628	H	51.3	Low	56.5	Low	183 Å²	183	101.3 Å²	101.3	85%	0.847	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	9.4	-174	-71.4	-38	0	0	0	115.9	R626	R626-H628 PolarHBondContact O-N 3.42Å
629	S	44.2	Very low	54.2	Low	66 Å²	66	105.5 Å²	105.5	46%	0.462	56%	0.561	S	S	.	*			trans	-111.7	76.6	176.9	-67.7	0	0	0	0	111.2	A631	S629-A631 PolarHBondContact O-N 3.47Å
630	A	42.5	Very low	51.8	Low	109 Å²	109	109.4 Å²	109.4	90%	0.901	58%	0.577	S	S	*	*			trans	-72.5	-5.8	156.2	0	0	0	0	0	112.1
631	A	37	Very low	49.5	Very low	65 Å²	65	114.5 Å²	114.5	54%	0.537	61%	0.606	S	S	.	*	S	Bend	trans	-98.4	107.3	170.7	0	0	0	0	0	109.6	S629 L633	S629-A631 PolarHBondContact O-N 3.47Å; A631-L633 PolarHBondContact O-N 3.32Å
632	Y	45.4	Very low	47.4	Very low	96 Å²	96	119.7 Å²	119.7	38%	0.376	63%	0.629	S	S	.	*			trans	-60.4	113.1	162.8	-89.1	-101.1	0	0	0	108.1	P416 L666	P416-Y632 WeakPolarHBondContact CB-OH 3.22Å; Y632-L666 HydrophobicContact CD1-CD1 4.3Å; Y632-L666 HydrophobicContact CD2-CD1 3.85Å; Y632-L666 HydrophobicContact CE1-CD1 4.21Å; Y632-L666 HydrophobicContact CE2-CD1 3.76Å; Y632-L666 HydrophobicContact CG-CD1 4.14Å
633	L	36.9	Very low	45.2	Very low	129 Å²	129	122.1 Å²	122.1	68%	0.675	64%	0.643	S	S	*	*			trans	-110.5	127.8	161.2	-74.8	173.4	0	0	0	107.2	Q623 A631	Q623-L633 PolarHBondContact NE2-O 2.81Å; A631-L633 PolarHBondContact O-N 3.32Å
634	P	39.1	Very low	43.2	Very low	59 Å²	59	122.7 Å²	122.7	38%	0.383	65%	0.652	S	S	.	*			trans	-77.1	152.7	169.3	10.3	6.8	0	0	0	109.4	E662	P634-E662 HydrophobicContact CB-CB 4.44Å; P634-E662 HydrophobicContact CB-CG 4.48Å; P634-E662 HydrophobicContact CG-CB 4.46Å; P634-E662 WeakPolarHBondContact CG-O 3.38Å
635	F	37.2	Very low	41.4	Very low	137 Å²	137	125.4 Å²	125.4	60%	0.601	67%	0.666	S	S	*	*			trans	-55.4	135.9	165.7	-72.8	-93.3	0	0	0	109.6	A619 E637	A619-F635 HydrophobicContact CB-CE2 4.25Å; A619-F635 HydrophobicContact CB-CZ 3.97Å; F635-E637 PolarHBondContact O-N 3.01Å
636	P	31.3	Very low	39.7	Very low	128 Å²	128	122 Å²	122	83%	0.831	67%	0.669	S	S	*	*			trans	-72.4	97.1	165.4	28.8	-28.2	0	0	0	107.6
637	E	36.7	Very low	38.1	Very low	141 Å²	141	118.2 Å²	118.2	66%	0.659	67%	0.666	S	S	*	*			trans	-74	150.9	150.1	-75.7	-171.9	177.9	0	0	108.1	F635	F635-E637 PolarHBondContact O-N 3.01Å
638	Q	31.5	Very low	37.6	Very low	174 Å²	174	115.1 Å²	115.1	81%	0.813	65%	0.648	S	S	*	*			trans	-45.4	149.9	-168.9	-66.8	172.1	-18	0	0	113.3	I640	Q638-I640 PolarHBondContact O-N 3.35Å
639	P	30	Very low	37.3	Very low	127 Å²	127	109.6 Å²	109.6	83%	0.825	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-55.2	117.3	-179.5	23.7	-32.2	0	0	0	109.3	D641	P639-D641 PolarHBondContact O-N 3.1Å
640	I	33.7	Very low	37.7	Very low	111 Å²	111	114.2 Å²	114.2	57%	0.569	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-61.4	124.7	165.9	-60.5	169	0	0	0	105.8	Q638 M642	Q638-I640 PolarHBondContact O-N 3.35Å; I640-M642 PolarHBondContact O-N 3Å; I640-M642 VanDerWaalsContact O-N 3.07Å
641	D	31.4	Very low	38.9	Very low	137 Å²	137	110.6 Å²	110.6	73%	0.733	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-49.6	118.7	168.5	-86.3	-36.8	0	0	0	108.8	P639 D643 S644	P639-D641 PolarHBondContact O-N 3.1Å; D641-D643 PolarHBondContact O-N 2.7Å; D641-S644 PolarHBondContact O-N 3.43Å; D641-S644 PolarHBondContact O-OG 2.91Å
642	M	34.6	Very low	41	Very low	150 Å²	150	110.3 Å²	110.3	74%	0.739	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-58.6	-4.2	-178	-88.5	-74.9	-64.8	0	0	114.3	I640 S644 L645	I640-M642 PolarHBondContact O-N 3Å; I640-M642 VanDerWaalsContact O-N 3.07Å; M642-S644 VanDerWaalsContact C-N 3.29Å; M642-S644 PolarHBondContact O-N 3.07Å; M642-L645 HydrophobicContact SD-CD1 4.29Å
643	D	34	Very low	42.8	Very low	150 Å²	150	105.7 Å²	105.7	80%	0.802	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-81.9	1.7	-178.1	-73.1	-13.6	0	0	0	114.3	D641	D641-D643 PolarHBondContact O-N 2.7Å
644	S	36.9	Very low	45	Very low	58 Å²	58	104.7 Å²	104.7	41%	0.406	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-98.4	0.7	-176.2	45.8	0	0	0	0	115.4	D641 M642 T646 S647	D641-S644 PolarHBondContact O-N 3.43Å; D641-S644 PolarHBondContact O-OG 2.91Å; M642-S644 VanDerWaalsContact C-N 3.29Å; M642-S644 PolarHBondContact O-N 3.07Å; S644-T646 PolarHBondContact O-N 3.34Å; S644-T646 VanDerWaalsContact O-N 3.14Å; S644-S647 PolarHBondContact O-N 3.02Å
645	L	36.7	Very low	47	Very low	127 Å²	127	106.5 Å²	106.5	67%	0.665	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-63	-21	-179.4	-95	82.6	0	0	0	114.3	M642	M642-L645 HydrophobicContact SD-CD1 4.29Å
646	T	36.5	Very low	49.2	Very low	140 Å²	140	100.2 Å²	100.2	86%	0.859	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-84.1	-4.9	-176.1	45.2	0	0	0	0	114.7	S644	S644-T646 PolarHBondContact O-N 3.34Å; S644-T646 VanDerWaalsContact O-N 3.14Å
647	S	39.6	Very low	51.6	Low	76 Å²	76	94.1 Å²	94.1	53%	0.531	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-112.1	6	178.8	75	0	0	0	0	115	S644 A649 L650	S644-S647 PolarHBondContact O-N 3.02Å; S647-A649 PolarHBondContact O-N 3.47Å; S647-L650 PolarHBondContact O-N 3.01Å; S647-L650 VanDerWaalsContact O-N 3.07Å
648	S	43.9	Very low	53.7	Low	55 Å²	55	90.7 Å²	90.7	39%	0.385	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.8	-170.2	99	0	0	0	0	115.1	S651	S648-S651 PolarHBondContact O-OG 2.86Å
649	A	44.2	Very low	56.1	Low	66 Å²	66	84.3 Å²	84.3	55%	0.545	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-27.9	176.9	0	0	0	0	0	112.8	S647 R740	S647-A649 PolarHBondContact O-N 3.47Å; A649-R740 PolarHBondContact O-NE 2.88Å; A649-R740 PolarHBondContact O-NH2 2.6Å
650	L	52.4	Low	58.3	Low	164 Å²	164	79 Å²	79	86%	0.859	44%	0.443	S	S	*	.	S	Bend	trans	-111.9	9.3	-173.1	-142.2	81.3	0	0	0	113.9	S647	S647-L650 PolarHBondContact O-N 3.01Å; S647-L650 VanDerWaalsContact O-N 3.07Å
651	S	68.7	Low	60.1	Low	33 Å²	33	76.4 Å²	76.4	23%	0.231	43%	0.432	C	S	.	.	S	Bend	trans	-74.6	142.3	175.4	60.8	0	0	0	0	110.9	S648 R656	S648-S651 PolarHBondContact O-OG 2.86Å; S651-R656 WeakPolarHBondContact OG-CG 3.31Å
652	S	80.5	Confident	62	Low	58 Å²	58	74 Å²	74	41%	0.406	42%	0.416	S	S	.	.			trans	-52.4	148.6	178.2	71.3	0	0	0	0	112.4	K654 H655 R656	S652-K654 PolarHBondContact O-N 2.89Å; S652-H655 PolarHBondContact O-N 3Å; S652-H655 VanDerWaalsContact O-N 3.11Å; S652-R656 PolarHBondContact O-N 2.87Å
653	L	82.7	Confident	63.8	Low	0 Å²	0	72.5 Å²	72.5	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-55	-39.4	179	175.3	65	0	0	0	110.9	F407 M423 H655 R656 I657 D744 E747 I748	F407-L653 HydrophobicContact CD1-CD1 3.84Å; F407-L653 HydrophobicContact CE1-CD1 3.81Å; F407-L653 HydrophobicContact CE1-CD2 4.15Å; M423-L653 HydrophobicContact CE-CB 4.36Å; M423-L653 HydrophobicContact CE-CD2 4.4Å; M423-L653 HydrophobicContact CE-CG 4.36Å; M423-L653 HydrophobicContact SD-CD2 4.15Å; L653-H655 VanDerWaalsContact C-N 3.33Å; L653-H655 PolarHBondContact O-N 2.88Å; L653-R656 PolarHBondContact O-N 3.4Å; L653-I657 HydrophobicContact CD1-CD1 4.01Å; L653-I657 HydrophobicContact CD1-CG1 4.24Å; L653-I657 HydrophobicContact CD2-CD1 4.4Å; L653-I657 HydrophobicContact CG-CD1 3.81Å; L653-I657 HydrophobicContact CG-CG1 4.45Å; L653-I657 WeakPolarHBondContact O-CG1 3.36Å; L653-I657 PolarHBondContact O-N 2.74Å; L653-D744 HydrophobicContact CD2-CB 4.34Å; L653-E747 WeakPolarHBondContact CB-OE2 3.44Å; L653-E747 PolarHBondContact N-OE1 3.26Å; L653-E747 PolarHBondContact N-OE2 2.87Å; L653-I748 HydrophobicContact CD2-CD1 3.85Å; L653-I748 HydrophobicContact CD2-CG1 3.73Å
654	K	82.5	Confident	65.4	Low	108 Å²	108	66.6 Å²	66.6	47%	0.47	38%	0.38	S	S	.	.	H	α-helix	trans	-55.1	-47	177.6	-167	178.3	176.8	-177	0	112.6	M423 S652 I657 Q658 E747	M423-K654 HydrophobicContact CE-CB 3.49Å; M423-K654 VanDerWaalsContact CE-CB 3.49Å; M423-K654 HydrophobicContact CE-CG 4.12Å; S652-K654 PolarHBondContact O-N 2.89Å; K654-I657 PolarHBondContact O-N 3.14Å; K654-Q658 PolarHBondContact O-N 3.3Å; K654-Q658 VanDerWaalsContact O-N 3.1Å; K654-E747 PolarHBondContact N-OE1 2.9Å; K654-E747 VanDerWaalsContact N-OE1 3.17Å
655	H	82.3	Confident	67	Low	97 Å²	97	67.4 Å²	67.4	45%	0.449	39%	0.385	S	S	.	.	H	α-helix	trans	-64.9	-43.7	-178.8	-172.2	-71.4	0	0	0	110.7	S652 L653 I657 Q658 T659	S652-H655 PolarHBondContact O-N 3Å; S652-H655 VanDerWaalsContact O-N 3.11Å; L653-H655 VanDerWaalsContact C-N 3.33Å; L653-H655 PolarHBondContact O-N 2.88Å; H655-I657 VanDerWaalsContact C-N 3.3Å; H655-I657 PolarHBondContact O-N 2.84Å; H655-Q658 PolarHBondContact O-N 2.82Å; H655-T659 PolarHBondContact ND1-OG1 3.08Å; H655-T659 PolarHBondContact O-N 3.09Å; H655-T659 PolarHBondContact O-OG1 3.46Å
656	R	83.9	Confident	68.8	Low	5 Å²	5	63.9 Å²	63.9	2%	0.019	37%	0.367	C	S	.	.	H	α-helix	trans	-59.9	-40.9	178.2	-64.6	-169.7	-68.1	136.2	-0.4	112	A408 S651 S652 L653 E660 D744	A408-R656 HydrophobicContact CB-CB 4.17Å; S651-R656 WeakPolarHBondContact OG-CG 3.31Å; S652-R656 PolarHBondContact O-N 2.87Å; L653-R656 PolarHBondContact O-N 3.4Å; R656-E660 WeakPolarHBondContact O-CG 3.45Å; R656-E660 PolarHBondContact O-N 2.8Å; R656-D744 IonicContact CZ-OD1 3.86Å; R656-D744 IonicContact CZ-OD2 3.76Å; R656-D744 IonicContact NH2-OD1 4Å; R656-D744 PolarHBondContact NH2-OD1 3.03Å; R656-D744 IonicContact NH2-OD2 3.65Å; R656-D744 PolarHBondContact NH2-OD2 3.41Å
657	I	81.2	Confident	70.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.3	-43.9	176.9	-62.7	164	0	0	0	111	A408 V411 H422 L653 K654 H655 T659 E660 V661	A408-I657 HydrophobicContact CB-CG1 4.03Å; V411-I657 HydrophobicContact CB-CD1 4.38Å; V411-I657 HydrophobicContact CB-CG1 4.43Å; V411-I657 HydrophobicContact CG1-CD1 3.89Å; V411-I657 HydrophobicContact CG1-CG1 4.32Å; V411-I657 HydrophobicContact CG1-CG2 4.11Å; H422-I657 HydrophobicContact CB-CB 4.33Å; H422-I657 HydrophobicContact CB-CD1 3.95Å; H422-I657 HydrophobicContact CB-CG2 3.92Å; H422-I657 WeakPolarHBondContact ND1-CG2 3.37Å; L653-I657 HydrophobicContact CD1-CD1 4.01Å; L653-I657 HydrophobicContact CD1-CG1 4.24Å; L653-I657 HydrophobicContact CD2-CD1 4.4Å; L653-I657 HydrophobicContact CG-CD1 3.81Å; L653-I657 HydrophobicContact CG-CG1 4.45Å; L653-I657 WeakPolarHBondContact O-CG1 3.36Å; L653-I657 PolarHBondContact O-N 2.74Å; K654-I657 PolarHBondContact O-N 3.14Å; H655-I657 VanDerWaalsContact C-N 3.3Å; H655-I657 PolarHBondContact O-N 2.84Å; I657-T659 PolarHBondContact O-N 3.09Å; I657-E660 PolarHBondContact O-N 3.05Å; I657-V661 HydrophobicContact CG2-CG2 4.39Å; I657-V661 WeakPolarHBondContact O-CG2 3.41Å; I657-V661 PolarHBondContact O-N 3.11Å
658	Q	81.4	Confident	72.9	Confident	68 Å²	68	57.9 Å²	57.9	32%	0.318	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-44	178.9	-74.5	177.4	-66.7	0	0	112	K654 H655 E660 V661 E662	K654-Q658 PolarHBondContact O-N 3.3Å; K654-Q658 VanDerWaalsContact O-N 3.1Å; H655-Q658 PolarHBondContact O-N 2.82Å; Q658-E660 VanDerWaalsContact C-N 3.29Å; Q658-E660 PolarHBondContact O-N 3.19Å; Q658-V661 WeakPolarHBondContact O-CB 3.38Å; Q658-V661 PolarHBondContact O-N 3.01Å; Q658-V661 VanDerWaalsContact O-N 3.16Å; Q658-E662 WeakPolarHBondContact O-CG 3.38Å; Q658-E662 PolarHBondContact O-N 3.1Å
659	T	80.4	Confident	74.6	Confident	40 Å²	40	56.3 Å²	56.3	25%	0.245	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-39.3	176.1	-51.1	0	0	0	0	112.3	H655 I657 E662 K663	H655-T659 PolarHBondContact ND1-OG1 3.08Å; H655-T659 PolarHBondContact O-N 3.09Å; H655-T659 PolarHBondContact O-OG1 3.46Å; I657-T659 PolarHBondContact O-N 3.09Å; T659-E662 PolarHBondContact O-N 2.93Å; T659-K663 WeakPolarHBondContact O-CG 3.34Å; T659-K663 PolarHBondContact O-N 2.93Å
660	E	76.5	Confident	76.1	Confident	17 Å²	17	56.2 Å²	56.2	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-73.9	-33	177.9	-65.1	-54.5	136.5	0	0	112.9	N405 A408 A412 R656 I657 Q658 E662 K663 G664	N405-E660 HydrophobicContact CB-CG 4.4Å; A408-E660 HydrophobicContact CB-CB 4.43Å; A408-E660 HydrophobicContact CB-CG 3.79Å; A412-E660 HydrophobicContact CB-CB 4.36Å; R656-E660 WeakPolarHBondContact O-CG 3.45Å; R656-E660 PolarHBondContact O-N 2.8Å; I657-E660 PolarHBondContact O-N 3.05Å; Q658-E660 VanDerWaalsContact C-N 3.29Å; Q658-E660 PolarHBondContact O-N 3.19Å; E660-E662 VanDerWaalsContact C-N 3.26Å; E660-E662 PolarHBondContact O-N 3.21Å; E660-K663 PolarHBondContact O-N 3.12Å; E660-K663 IonicContact OE1-NZ 2.8Å; E660-K663 PolarHBondContact OE1-NZ 3.33Å; E660-K663 WeakPolarHBondContact OE2-CD 3.38Å; E660-K663 IonicContact OE2-NZ 3.77Å; E660-G664 PolarHBondContact O-N 3.02Å
661	V	72.7	Confident	77.5	Confident	55 Å²	55	50.9 Å²	50.9	33%	0.333	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-39.2	171	173.1	0	0	0	0	110.5	A412 I657 Q658 G664	A412-V661 HydrophobicContact CB-CG2 3.59Å; I657-V661 HydrophobicContact CG2-CG2 4.39Å; I657-V661 WeakPolarHBondContact O-CG2 3.41Å; I657-V661 PolarHBondContact O-N 3.11Å; Q658-V661 WeakPolarHBondContact O-CB 3.38Å; Q658-V661 PolarHBondContact O-N 3.01Å; Q658-V661 VanDerWaalsContact O-N 3.16Å; V661-G664 PolarHBondContact O-N 3.12Å
662	E	70.2	Confident	78.3	Confident	86 Å²	86	49.4 Å²	49.4	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-72.9	-22.7	175.8	-70.4	164.6	-163.6	0	0	113.5	P634 Q658 T659 E660 G664	P634-E662 HydrophobicContact CB-CB 4.44Å; P634-E662 HydrophobicContact CB-CG 4.48Å; P634-E662 HydrophobicContact CG-CB 4.46Å; P634-E662 WeakPolarHBondContact CG-O 3.38Å; Q658-E662 WeakPolarHBondContact O-CG 3.38Å; Q658-E662 PolarHBondContact O-N 3.1Å; T659-E662 PolarHBondContact O-N 2.93Å; E660-E662 VanDerWaalsContact C-N 3.26Å; E660-E662 PolarHBondContact O-N 3.21Å; E662-G664 VanDerWaalsContact C-N 3.3Å
663	K	72.7	Confident	78.4	Confident	120 Å²	120	48.4 Å²	48.4	52%	0.522	26%	0.262	S	S	.	.	H	α-helix	trans	-74.3	-23.4	172.4	-75.2	173.4	-176.5	171.9	0	112.9	T659 E660 C665	T659-K663 WeakPolarHBondContact O-CG 3.34Å; T659-K663 PolarHBondContact O-N 2.93Å; E660-K663 PolarHBondContact O-N 3.12Å; E660-K663 IonicContact OE1-NZ 2.8Å; E660-K663 PolarHBondContact OE1-NZ 3.33Å; E660-K663 WeakPolarHBondContact OE2-CD 3.38Å; E660-K663 IonicContact OE2-NZ 3.77Å; K663-C665 PolarHBondContact O-N 2.97Å
664	G	68.4	Low	78.3	Confident	25 Å²	25	50 Å²	50	26%	0.258	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	7.3	178.3	0	0	0	0	0	115.3	E660 V661 E662 L666	E660-G664 PolarHBondContact O-N 3.02Å; V661-G664 PolarHBondContact O-N 3.12Å; E662-G664 VanDerWaalsContact C-N 3.3Å; G664-L666 VanDerWaalsContact C-N 3.34Å; G664-L666 PolarHBondContact O-N 3.38Å
665	C	69.2	Low	78.5	Confident	75 Å²	75	45 Å²	45	51%	0.507	25%	0.247	S	C	.	.			trans	-80.2	75.3	178.9	-70.3	0	0	0	0	111.8	Q409 K663	Q409-C665 WeakPolarHBondContact CG-O 3.45Å; Q409-C665 PolarHBondContact NE2-O 3.02Å; K663-C665 PolarHBondContact O-N 2.97Å
666	L	75.1	Confident	78.8	Confident	54 Å²	54	40.4 Å²	40.4	28%	0.283	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-83.9	139.7	-178.9	-55.6	175.6	0	0	0	112.4	P416 Y632 G664	P416-L666 HydrophobicContact CB-CD1 3.91Å; P416-L666 HydrophobicContact CG-CD1 4.46Å; Y632-L666 HydrophobicContact CD1-CD1 4.3Å; Y632-L666 HydrophobicContact CD2-CD1 3.85Å; Y632-L666 HydrophobicContact CE1-CD1 4.21Å; Y632-L666 HydrophobicContact CE2-CD1 3.76Å; Y632-L666 HydrophobicContact CG-CD1 4.14Å; G664-L666 VanDerWaalsContact C-N 3.34Å; G664-L666 PolarHBondContact O-N 3.38Å
667	I	81	Confident	78.9	Confident	14 Å²	14	40.2 Å²	40.2	7%	0.072	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-86.3	127.1	177.1	-58.5	165.9	0	0	0	109.3	L400 L406 Q409 L410 S413 I671 F672	L400-I667 HydrophobicContact CD2-CD1 3.71Å; L400-I667 HydrophobicContact CD2-CG1 3.86Å; L406-I667 HydrophobicContact CD1-CD1 4.5Å; Q409-I667 HydrophobicContact CG-CD1 4.21Å; Q409-I667 HydrophobicContact CG-CG1 4.41Å; L410-I667 HydrophobicContact CD2-CD1 3.59Å; L410-I667 HydrophobicContact CG-CD1 4.24Å; S413-I667 PolarHBondContact OG-N 3.4Å; I667-I671 HydrophobicContact CG2-CB 4.26Å; I667-I671 HydrophobicContact CG2-CG2 4.08Å; I667-F672 HydrophobicContact CG2-CB 4.12Å
668	P	81.3	Confident	79.2	Confident	75 Å²	75	42 Å²	42	49%	0.487	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-60.4	139.9	174.9	-24.6	34.4	0	0	0	112.9	I671 F672	P668-I671 HydrophobicContact CB-CD1 4.38Å; P668-I671 HydrophobicContact CG-CD1 4.15Å; P668-I671 PolarHBondContact O-N 3.02Å; P668-I671 VanDerWaalsContact O-N 3.07Å; P668-F672 PolarHBondContact O-N 2.81Å
669	G	79.9	Confident	79.5	Confident	22 Å²	22	38.7 Å²	38.7	23%	0.227	22%	0.218	C	C	.	.	H	α-helix	trans	-49	-45.2	-179.7	0	0	0	0	0	115.7	I671 F672 R673	G669-I671 VanDerWaalsContact C-N 3.34Å; G669-I671 PolarHBondContact O-N 3.24Å; G669-F672 PolarHBondContact O-N 2.93Å; G669-R673 WeakPolarHBondContact O-CB 3.28Å; G669-R673 PolarHBondContact O-N 3.46Å
670	P	75.5	Confident	79.9	Confident	64 Å²	64	39.1 Å²	39.1	42%	0.416	22%	0.215	S	C	.	.	H	α-helix	trans	-62.3	-39.2	178.5	-24.6	33.4	0	0	0	113.6	E307 K674	E307-P670 WeakPolarHBondContact OE2-CD 3.35Å; E307-P670 WeakPolarHBondContact OE2-CG 2.9Å; P670-K674 WeakPolarHBondContact O-CG 3.22Å; P670-K674 PolarHBondContact O-N 3.22Å
671	I	80.6	Confident	80.2	Confident	53 Å²	53	43.8 Å²	43.8	27%	0.272	24%	0.236	S	C	.	.	H	α-helix	trans	-69.9	-43.4	177.6	-65	173.8	0	0	0	109.1	I396 L400 I667 P668 G669 R673 K674 Y675	I396-I671 HydrophobicContact CG2-CD1 4.33Å; I396-I671 HydrophobicContact CG2-CG2 3.53Å; L400-I671 HydrophobicContact CD1-CG2 4.03Å; I667-I671 HydrophobicContact CG2-CB 4.26Å; I667-I671 HydrophobicContact CG2-CG2 4.08Å; P668-I671 HydrophobicContact CB-CD1 4.38Å; P668-I671 HydrophobicContact CG-CD1 4.15Å; P668-I671 PolarHBondContact O-N 3.02Å; P668-I671 VanDerWaalsContact O-N 3.07Å; G669-I671 VanDerWaalsContact C-N 3.34Å; G669-I671 PolarHBondContact O-N 3.24Å; I671-R673 PolarHBondContact O-N 3.36Å; I671-K674 PolarHBondContact O-N 3.06Å; I671-Y675 WeakPolarHBondContact O-CB 3.38Å; I671-Y675 PolarHBondContact O-N 2.88Å
672	F	85.4	Confident	80.9	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-47.1	177.1	-165.2	171.1	0	0	0	111.4	L410 F414 V429 F433 L483 I667 P668 G669 K674 Y675 I676	L410-F672 HydrophobicContact CB-CZ 4.1Å; L410-F672 HydrophobicContact CD2-CD2 3.86Å; L410-F672 HydrophobicContact CD2-CE1 4.43Å; L410-F672 HydrophobicContact CD2-CE2 3.6Å; L410-F672 HydrophobicContact CD2-CG 4.44Å; L410-F672 HydrophobicContact CD2-CZ 3.9Å; L410-F672 WeakPolarHBondContact O-CE1 3.24Å; F414-F672 HydrophobicContact CB-CE1 4.33Å; V429-F672 HydrophobicContact CG1-CZ 4.18Å; V429-F672 HydrophobicContact CG2-CZ 4.24Å; F433-F672 HydrophobicContact CE2-CE2 4.15Å; F433-F672 HydrophobicContact CZ-CE2 4.22Å; L483-F672 HydrophobicContact CD1-CD1 4.08Å; L483-F672 HydrophobicContact CD1-CE1 4Å; L483-F672 HydrophobicContact CD2-CB 4.08Å; L483-F672 HydrophobicContact CD2-CD1 3.78Å; L483-F672 HydrophobicContact CD2-CG 4.09Å; I667-F672 HydrophobicContact CG2-CB 4.12Å; P668-F672 PolarHBondContact O-N 2.81Å; G669-F672 PolarHBondContact O-N 2.93Å; F672-K674 VanDerWaalsContact C-N 3.31Å; F672-K674 PolarHBondContact O-N 3.4Å; F672-Y675 WeakPolarHBondContact O-CB 3.25Å; F672-Y675 PolarHBondContact O-N 3.26Å; F672-Y675 VanDerWaalsContact O-N 3.14Å; F672-I676 HydrophobicContact CD2-CD1 3.7Å; F672-I676 HydrophobicContact CD2-CG1 3.81Å; F672-I676 HydrophobicContact CE2-CD1 3.66Å; F672-I676 HydrophobicContact CE2-CG1 3.76Å; F672-I676 WeakPolarHBondContact O-CG1 3.07Å; F672-I676 PolarHBondContact O-N 2.9Å
673	R	83.5	Confident	81.7	Confident	37 Å²	37	40.2 Å²	40.2	14%	0.14	22%	0.223	C	C	.	.	H	α-helix	trans	-55.8	-44.8	176.1	-177.2	-172.2	-68.9	124.1	-3	112.2	E307 D482 L483 P485 G669 I671 A677	E307-R673 VanDerWaalsContact CG-NH2 3.31Å; E307-R673 IonicContact OE1-CZ 3.87Å; E307-R673 IonicContact OE1-NH1 3.13Å; E307-R673 IonicContact OE1-NH2 3.89Å; E307-R673 PolarHBondContact OE1-NH2 3.29Å; E307-R673 IonicContact OE2-NH1 3.41Å; E307-R673 IonicContact OE2-NH2 2.73Å; D482-R673 PolarHBondContact O-NE 3.13Å; D482-R673 PolarHBondContact O-NH2 3.01Å; L483-R673 WeakPolarHBondContact O-CA 3.33Å; L483-R673 WeakPolarHBondContact O-CB 3.24Å; L483-R673 WeakPolarHBondContact O-CG 3.39Å; P485-R673 HydrophobicContact CB-CG 3.81Å; P485-R673 HydrophobicContact CG-CG 4.28Å; G669-R673 WeakPolarHBondContact O-CB 3.28Å; G669-R673 PolarHBondContact O-N 3.46Å; I671-R673 PolarHBondContact O-N 3.36Å; R673-A677 PolarHBondContact O-N 2.85Å
674	K	80.6	Confident	82.5	Confident	34 Å²	34	36.9 Å²	36.9	15%	0.148	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-43.6	176.6	-73	-179.4	179.2	-140.4	0	111.9	S385 E393 P670 I671 F672 I676 A677 F678	S385-K674 VanDerWaalsContact CB-NZ 3.3Å; S385-K674 WeakPolarHBondContact OG-CE 3.44Å; S385-K674 PolarHBondContact OG-NZ 3.42Å; E393-K674 IonicContact OE1-NZ 3.92Å; E393-K674 PolarHBondContact OE1-NZ 3.37Å; P670-K674 WeakPolarHBondContact O-CG 3.22Å; P670-K674 PolarHBondContact O-N 3.22Å; I671-K674 PolarHBondContact O-N 3.06Å; F672-K674 VanDerWaalsContact C-N 3.31Å; F672-K674 PolarHBondContact O-N 3.4Å; K674-I676 PolarHBondContact O-N 3.15Å; K674-A677 WeakPolarHBondContact O-CB 3.33Å; K674-A677 PolarHBondContact O-N 2.6Å; K674-A677 VanDerWaalsContact O-N 3.13Å; K674-F678 WeakPolarHBondContact O-CB 3.36Å; K674-F678 PolarHBondContact O-N 2.83Å
675	Y	86.5	Confident	83.6	Confident	3 Å²	3	35.8 Å²	35.8	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-46.4	178.3	-175.8	-100.3	0	0	0	111.4	V397 L400 L406 L410 F433 I671 F672 A677 F678 C679 C731 L733	V397-Y675 HydrophobicContact CG1-CD2 4.4Å; V397-Y675 HydrophobicContact CG1-CE2 4.12Å; V397-Y675 HydrophobicContact CG2-CD2 4.18Å; L400-Y675 HydrophobicContact CD1-CD2 4Å; L400-Y675 HydrophobicContact CD1-CG 4.4Å; L406-Y675 VanDerWaalsContact CD2-OH 3.3Å; L406-Y675 WeakPolarHBondContact CD2-OH 3.49Å; L410-Y675 HydrophobicContact CD1-CD1 4.49Å; L410-Y675 HydrophobicContact CD1-CE1 3.95Å; L410-Y675 HydrophobicContact CD2-CD1 4.2Å; L410-Y675 HydrophobicContact CD2-CE1 4.38Å; F433-Y675 AromaticContact CE1-CD1 3.96Å; F433-Y675 HydrophobicContact CE1-CD1 3.96Å; F433-Y675 AromaticContact CE1-CE1 3.9Å; F433-Y675 HydrophobicContact CE1-CE1 3.9Å; F433-Y675 AromaticContact CZ-CD1 3.78Å; F433-Y675 HydrophobicContact CZ-CD1 3.78Å; F433-Y675 AromaticContact CZ-CE1 3.81Å; F433-Y675 HydrophobicContact CZ-CE1 3.81Å; I671-Y675 WeakPolarHBondContact O-CB 3.38Å; I671-Y675 PolarHBondContact O-N 2.88Å; F672-Y675 WeakPolarHBondContact O-CB 3.25Å; F672-Y675 PolarHBondContact O-N 3.26Å; F672-Y675 VanDerWaalsContact O-N 3.14Å; Y675-A677 VanDerWaalsContact C-N 3.29Å; Y675-A677 PolarHBondContact O-N 2.91Å; Y675-F678 PolarHBondContact O-N 3.45Å; Y675-C679 WeakPolarHBondContact CE1-SG 3.46Å; Y675-C679 PolarHBondContact O-N 3.1Å; Y675-C679 PolarHBondContact O-SG 2.88Å; Y675-C731 WeakPolarHBondContact CE1-O 3.06Å; Y675-C731 PolarHBondContact OH-O 3.22Å; Y675-L733 HydrophobicContact CE2-CD1 4.02Å
676	I	89.1	Confident	84.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-55.5	-47.3	174.2	-66.5	162.4	0	0	0	110.8	L377 L432 F433 F672 K674 F678 C679 R680	L377-I676 HydrophobicContact CD2-CG2 4.34Å; L432-I676 HydrophobicContact CB-CD1 4.18Å; L432-I676 HydrophobicContact CB-CG2 4.45Å; L432-I676 HydrophobicContact CD1-CD1 4.08Å; F433-I676 HydrophobicContact CE1-CB 4.33Å; F433-I676 HydrophobicContact CE1-CG1 4.02Å; F433-I676 HydrophobicContact CE2-CG1 4Å; F433-I676 HydrophobicContact CZ-CG1 3.72Å; F672-I676 HydrophobicContact CD2-CD1 3.7Å; F672-I676 HydrophobicContact CD2-CG1 3.81Å; F672-I676 HydrophobicContact CE2-CD1 3.66Å; F672-I676 HydrophobicContact CE2-CG1 3.76Å; F672-I676 WeakPolarHBondContact O-CG1 3.07Å; F672-I676 PolarHBondContact O-N 2.9Å; K674-I676 PolarHBondContact O-N 3.15Å; I676-F678 VanDerWaalsContact C-N 3.35Å; I676-F678 PolarHBondContact O-N 3.39Å; I676-C679 PolarHBondContact O-N 3.29Å; I676-R680 WeakPolarHBondContact O-CG 3.5Å; I676-R680 PolarHBondContact O-N 3.35Å; I676-R680 VanDerWaalsContact O-N 3.15Å
677	A	85.7	Confident	85.4	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-40	-178.5	0	0	0	0	0	112	L377 A381 R673 K674 Y675 H681	L377-A677 HydrophobicContact CD2-CB 4.49Å; L377-A677 HydrophobicContact CG-CB 4.47Å; A381-A677 HydrophobicContact CB-CB 3.5Å; A381-A677 VanDerWaalsContact CB-CB 3.5Å; R673-A677 PolarHBondContact O-N 2.85Å; K674-A677 WeakPolarHBondContact O-CB 3.33Å; K674-A677 PolarHBondContact O-N 2.6Å; K674-A677 VanDerWaalsContact O-N 3.13Å; Y675-A677 VanDerWaalsContact C-N 3.29Å; Y675-A677 PolarHBondContact O-N 2.91Å; A677-H681 PolarHBondContact O-N 2.94Å
678	F	86.6	Confident	86	Confident	37 Å²	37	34.8 Å²	34.8	16%	0.162	19%	0.187	C	C	.	.	H	α-helix	trans	-63.8	-51.1	175.6	-178.4	-98.8	0	0	0	111.6	F378 L394 V397 K674 Y675 I676 R680 H681 S682 L733	F378-F678 HydrophobicContact CD2-CB 4.17Å; F378-F678 HydrophobicContact CD2-CD2 4.33Å; F378-F678 HydrophobicContact CE2-CB 4.18Å; F378-F678 AromaticContact CE2-CD2 3.77Å; F378-F678 HydrophobicContact CE2-CD2 3.77Å; F378-F678 HydrophobicContact CE2-CG 4.49Å; F378-F678 HydrophobicContact CZ-CD2 4.4Å; L394-F678 HydrophobicContact CD2-CE2 3.7Å; L394-F678 HydrophobicContact CD2-CZ 3.82Å; V397-F678 HydrophobicContact CG1-CD1 4Å; V397-F678 HydrophobicContact CG1-CE1 3.78Å; V397-F678 HydrophobicContact CG2-CD1 4.18Å; V397-F678 HydrophobicContact CG2-CG 4.42Å; K674-F678 WeakPolarHBondContact O-CB 3.36Å; K674-F678 PolarHBondContact O-N 2.83Å; Y675-F678 PolarHBondContact O-N 3.45Å; I676-F678 VanDerWaalsContact C-N 3.35Å; I676-F678 PolarHBondContact O-N 3.39Å; F678-R680 VanDerWaalsContact C-N 3.28Å; F678-R680 PolarHBondContact O-N 3.01Å; F678-H681 PolarHBondContact O-N 2.83Å; F678-S682 WeakPolarHBondContact CE2-OG 2.98Å; F678-S682 WeakPolarHBondContact CZ-OG 3.48Å; F678-S682 PolarHBondContact O-N 3.49Å; F678-S682 PolarHBondContact O-OG 3.48Å; F678-L733 HydrophobicContact CD1-CD1 4.14Å; F678-L733 HydrophobicContact CD1-CD2 3.93Å; F678-L733 HydrophobicContact CE1-CD1 3.88Å; F678-L733 HydrophobicContact CE1-CD2 3.85Å
679	C	89	Confident	86.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-37.4	-179.1	-62.4	0	0	0	0	113	F433 Y675 I676 H681 V683 R730 L733	F433-C679 HydrophobicContact CD1-CB 3.8Å; F433-C679 HydrophobicContact CE1-CB 3.73Å; Y675-C679 WeakPolarHBondContact CE1-SG 3.46Å; Y675-C679 PolarHBondContact O-N 3.1Å; Y675-C679 PolarHBondContact O-SG 2.88Å; I676-C679 PolarHBondContact O-N 3.29Å; C679-H681 VanDerWaalsContact C-N 3.29Å; C679-H681 PolarHBondContact O-N 2.87Å; C679-V683 PolarHBondContact O-N 3.15Å; C679-R730 HydrophobicContact CB-CG 4.02Å; C679-L733 HydrophobicContact CB-CD2 4Å; C679-L733 VanDerWaalsContact SG-CD2 3.52Å
680	R	87.7	Confident	87.3	Confident	48 Å²	48	36.6 Å²	36.6	18%	0.181	20%	0.2	C	C	.	.	H	α-helix	trans	-69.2	-26	176.9	-73.7	-175	67.8	-179.5	-7.4	113.7	L432 F433 D524 I676 F678	L432-R680 WeakPolarHBondContact O-CD 2.93Å; L432-R680 PolarHBondContact O-NH1 3.16Å; F433-R680 VanDerWaalsContact O-CD 3.28Å; F433-R680 WeakPolarHBondContact O-CD 3.35Å; F433-R680 WeakPolarHBondContact O-CG 3.08Å; D524-R680 PolarHBondContact O-NH1 3.17Å; D524-R680 PolarHBondContact O-NH2 3.08Å; I676-R680 WeakPolarHBondContact O-CG 3.5Å; I676-R680 PolarHBondContact O-N 3.35Å; I676-R680 VanDerWaalsContact O-N 3.15Å; F678-R680 VanDerWaalsContact C-N 3.28Å; F678-R680 PolarHBondContact O-N 3.01Å
681	H	84	Confident	88.2	Confident	116 Å²	116	33.6 Å²	33.6	54%	0.537	18%	0.18	S	C	.	.	H	α-helix	trans	-85.5	-44.2	178.1	-178.6	61.8	0	0	0	112.1	F378 A677 F678 C679	F378-H681 HydrophobicContact CB-CB 3.65Å; F378-H681 AromaticContact CD1-CD2 3.99Å; F378-H681 HydrophobicContact CG-CB 4.1Å; A677-H681 PolarHBondContact O-N 2.94Å; F678-H681 PolarHBondContact O-N 2.83Å; C679-H681 VanDerWaalsContact C-N 3.29Å; C679-H681 PolarHBondContact O-N 2.87Å
682	S	85.9	Confident	88.7	Confident	55 Å²	55	33.8 Å²	33.8	39%	0.385	19%	0.186	S	C	.	.	H	α-helix	trans	-81.9	-36.3	-168.8	-56	0	0	0	0	113.4	F678	F678-S682 WeakPolarHBondContact CE2-OG 2.98Å; F678-S682 WeakPolarHBondContact CZ-OG 3.48Å; F678-S682 PolarHBondContact O-N 3.49Å; F678-S682 PolarHBondContact O-OG 3.48Å
683	V	87.9	Confident	89.2	Confident	10 Å²	10	38.5 Å²	38.5	6%	0.061	21%	0.211	C	C	.	.			trans	-123.3	134.8	-163.9	177.1	0	0	0	0	113.1	C679 R730 L733 R734	C679-V683 PolarHBondContact O-N 3.15Å; V683-R730 PolarHBondContact O-NE 2.63Å; V683-R730 PolarHBondContact O-NH2 3.45Å; V683-L733 HydrophobicContact CB-CD2 4.38Å; V683-L733 HydrophobicContact CG2-CB 4.15Å; V683-L733 HydrophobicContact CG2-CD2 3.55Å; V683-L733 HydrophobicContact CG2-CG 4.49Å; V683-R734 WeakPolarHBondContact CG1-O 3.08Å
684	N	89.7	Confident	89.7	Confident	51 Å²	51	38 Å²	38	27%	0.273	21%	0.212	S	C	.	.			trans	-129.8	87.4	177.9	-73.1	-60.7	0	0	0	109.9	S436 R730	S436-N684 WeakPolarHBondContact OG-CB 3.44Å; N684-R730 PolarHBondContact OD1-NH2 3.35Å; N684-R730 VanDerWaalsContact OD1-NH2 3.13Å
685	P	92.1	Very high	90.3	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	21%	0.206	C	C	.	.			trans	-70.3	145.1	-170.6	23.4	-27.7	0	0	0	112.9	S436 Q726 A729 R730 D735	S436-P685 WeakPolarHBondContact CB-O 3.5Å; S436-P685 PolarHBondContact OG-O 3.29Å; P685-Q726 HydrophobicContact CG-CB 4.04Å; P685-Q726 WeakPolarHBondContact CG-O 3.49Å; P685-A729 HydrophobicContact CB-CB 3.96Å; P685-A729 HydrophobicContact CG-CB 4.42Å; P685-R730 HydrophobicContact CG-CB 4.06Å; P685-D735 CarbonylContact C-O 3.57Å; P685-D735 WeakPolarHBondContact CA-O 3.36Å
686	H	91.2	Very high	90.5	Very high	87 Å²	87	37.9 Å²	37.9	40%	0.403	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	156.1	170.3	61.1	-79	0	0	0	110.3	D735 A737	H686-D735 PolarHBondContact CE1-O 3.36Å; H686-D735 PolarHBondContact N-O 3.37Å; H686-D735 PolarHBondContact ND1-O 3Å; H686-A737 PolarHBondContact O-N 2.84Å
687	L	90.7	Very high	90.6	Very high	25 Å²	25	42.1 Å²	42.1	13%	0.131	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135	178.9	-76.7	98.4	0	0	0	112.2	A691 L695 I722 T725 Q726	L687-A691 HydrophobicContact CD2-CB 4.49Å; L687-L695 HydrophobicContact CD2-CD1 3.63Å; L687-I722 HydrophobicContact CD1-CG2 3.73Å; L687-I722 HydrophobicContact CD2-CG1 4.4Å; L687-T725 HydrophobicContact CD2-CG2 4.5Å; L687-Q726 HydrophobicContact CD1-CG 3.9Å
688	S	94.2	Very high	90.7	Very high	11 Å²	11	42.5 Å²	42.5	8%	0.077	24%	0.242	C	C	.	.			trans	-69.8	154.2	165.8	66	0	0	0	0	111.4	A690 A691 C692 E736 A737	S688-A690 VanDerWaalsContact C-N 3.26Å; S688-A690 PolarHBondContact O-N 3.47Å; S688-A691 PolarHBondContact O-N 3.21Å; S688-A691 VanDerWaalsContact OG-CB 3.26Å; S688-A691 WeakPolarHBondContact OG-CB 3.32Å; S688-A691 PolarHBondContact OG-N 3.01Å; S688-A691 VanDerWaalsContact OG-N 3.15Å; S688-C692 PolarHBondContact O-N 2.87Å; S688-C692 PolarHBondContact O-SG 3.15Å; S688-C692 VanDerWaalsContact O-SG 3.38Å; S688-E736 WeakPolarHBondContact CB-OE1 3.46Å; S688-A737 WeakPolarHBondContact CB-O 3.35Å; S688-A737 PolarHBondContact N-O 2.97Å; S688-A737 PolarHBondContact OG-O 3.48Å
689	S	93.4	Very high	90.7	Very high	96 Å²	96	42.5 Å²	42.5	67%	0.671	24%	0.242	S	C	*	.	H	α-helix	trans	-61	-35.6	175.3	55.7	0	0	0	0	112.6	C692 N693	S689-C692 PolarHBondContact O-N 2.96Å; S689-N693 PolarHBondContact O-N 3.33Å; S689-N693 VanDerWaalsContact O-N 3.17Å; S689-N693 PolarHBondContact O-ND2 3.41Å
690	A	94.6	Very high	90.5	Very high	39 Å²	39	47.8 Å²	47.8	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-46.4	175.8	0	0	0	0	0	111.9	S688 C692 N693 V694 E739	S688-A690 VanDerWaalsContact C-N 3.26Å; S688-A690 PolarHBondContact O-N 3.47Å; A690-C692 VanDerWaalsContact C-N 3.32Å; A690-C692 PolarHBondContact O-N 3.22Å; A690-N693 PolarHBondContact O-N 3.18Å; A690-V694 PolarHBondContact O-N 3.34Å; A690-E739 HydrophobicContact CB-CB 4.3Å
691	A	93.6	Very high	90.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-41.5	175.5	0	0	0	0	0	111.8	L687 S688 N693 V694 L695 A742	L687-A691 HydrophobicContact CD2-CB 4.49Å; S688-A691 PolarHBondContact O-N 3.21Å; S688-A691 VanDerWaalsContact OG-CB 3.26Å; S688-A691 WeakPolarHBondContact OG-CB 3.32Å; S688-A691 PolarHBondContact OG-N 3.01Å; S688-A691 VanDerWaalsContact OG-N 3.15Å; A691-N693 VanDerWaalsContact C-N 3.31Å; A691-N693 PolarHBondContact O-N 3.23Å; A691-V694 PolarHBondContact O-N 2.86Å; A691-L695 VanDerWaalsContact O-CG 3.31Å; A691-L695 WeakPolarHBondContact O-CG 3.47Å; A691-L695 PolarHBondContact O-N 3.21Å; A691-A742 HydrophobicContact CB-CB 4.26Å
692	C	92.2	Very high	90.1	Very high	58 Å²	58	44.6 Å²	44.6	39%	0.392	25%	0.254	S	S	.	.	H	α-helix	trans	-57.6	-42.2	176.3	-73.8	0	0	0	0	112.6	S688 S689 A690 A696	S688-C692 PolarHBondContact O-N 2.87Å; S688-C692 PolarHBondContact O-SG 3.15Å; S688-C692 VanDerWaalsContact O-SG 3.38Å; S689-C692 PolarHBondContact O-N 2.96Å; A690-C692 VanDerWaalsContact C-N 3.32Å; A690-C692 PolarHBondContact O-N 3.22Å; C692-A696 VanDerWaalsContact O-CB 3.28Å; C692-A696 WeakPolarHBondContact O-CB 3.33Å; C692-A696 PolarHBondContact O-N 3.36Å
693	N	94.8	Very high	89.5	Confident	100 Å²	100	44.6 Å²	44.6	54%	0.535	25%	0.25	S	S	.	.	H	α-helix	trans	-65.1	-47.2	178.8	-66.6	-22.5	0	0	0	111.4	S689 A690 A691 L695 A696 D697	S689-N693 PolarHBondContact O-N 3.33Å; S689-N693 VanDerWaalsContact O-N 3.17Å; S689-N693 PolarHBondContact O-ND2 3.41Å; A690-N693 PolarHBondContact O-N 3.18Å; A691-N693 VanDerWaalsContact C-N 3.31Å; A691-N693 PolarHBondContact O-N 3.23Å; N693-L695 VanDerWaalsContact C-N 3.32Å; N693-L695 PolarHBondContact O-N 3.38Å; N693-A696 WeakPolarHBondContact O-CB 3.27Å; N693-A696 PolarHBondContact O-N 3.01Å; N693-A696 VanDerWaalsContact O-N 3.14Å; N693-D697 VanDerWaalsContact O-CG 3.31Å; N693-D697 PolarHBondContact O-N 3.01Å
694	V	94.3	Very high	88.7	Confident	26 Å²	26	51.6 Å²	51.6	16%	0.158	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-40.3	178.8	171.2	0	0	0	0	112	A690 A691 F698 E739 A742 L743 I746	A690-V694 PolarHBondContact O-N 3.34Å; A691-V694 PolarHBondContact O-N 2.86Å; V694-F698 WeakPolarHBondContact O-CB 3.34Å; V694-F698 PolarHBondContact O-N 2.83Å; V694-F698 VanDerWaalsContact O-N 3.08Å; V694-E739 HydrophobicContact CG2-CG 3.72Å; V694-A742 HydrophobicContact CB-CB 4.48Å; V694-A742 HydrophobicContact CG1-CB 4.19Å; V694-L743 HydrophobicContact CG1-CD2 3.92Å; V694-L743 HydrophobicContact CG1-CG 4.41Å; V694-I746 HydrophobicContact CG1-CD1 3.61Å
695	L	92.5	Very high	87.6	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-67.4	-38.9	175	-67.8	-177.7	0	0	0	112.2	L687 A691 N693 F699 M718 L721 I722 A742 I746	L687-L695 HydrophobicContact CD2-CD1 3.63Å; A691-L695 VanDerWaalsContact O-CG 3.31Å; A691-L695 WeakPolarHBondContact O-CG 3.47Å; A691-L695 PolarHBondContact O-N 3.21Å; N693-L695 VanDerWaalsContact C-N 3.32Å; N693-L695 PolarHBondContact O-N 3.38Å; L695-F699 VanDerWaalsContact O-CB 3.3Å; L695-F699 WeakPolarHBondContact O-CB 3.22Å; L695-F699 PolarHBondContact O-N 3.27Å; L695-M718 HydrophobicContact CB-SD 4.37Å; L695-L721 HydrophobicContact CD1-CB 4.49Å; L695-L721 HydrophobicContact CD2-CB 4.05Å; L695-L721 HydrophobicContact CD2-CD1 4.48Å; L695-L721 HydrophobicContact CD2-CD2 4.23Å; L695-L721 HydrophobicContact CD2-CG 4.5Å; L695-I722 HydrophobicContact CD1-CG1 4.39Å; L695-A742 HydrophobicContact CD2-CB 3.84Å; L695-A742 HydrophobicContact CG-CB 3.99Å; L695-I746 HydrophobicContact CD2-CD1 4.49Å
696	A	90.5	Very high	85.9	Confident	32 Å²	32	56.9 Å²	56.9	26%	0.264	30%	0.304	S	S	.	.	H	α-helix	trans	-63.6	-45.2	177	0	0	0	0	0	111.9	C692 N693 F699 Q700	C692-A696 VanDerWaalsContact O-CB 3.28Å; C692-A696 WeakPolarHBondContact O-CB 3.33Å; C692-A696 PolarHBondContact O-N 3.36Å; N693-A696 WeakPolarHBondContact O-CB 3.27Å; N693-A696 PolarHBondContact O-N 3.01Å; N693-A696 VanDerWaalsContact O-N 3.14Å; A696-F699 PolarHBondContact O-N 3.11Å; A696-Q700 WeakPolarHBondContact O-CG 3.15Å; A696-Q700 PolarHBondContact O-N 3.36Å
697	D	91.7	Very high	84	Confident	90 Å²	90	58.5 Å²	58.5	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-62.7	-48.1	178.1	-68.4	-19.4	0	0	0	110.6	N693 F699 Q700 E701	N693-D697 VanDerWaalsContact O-CG 3.31Å; N693-D697 PolarHBondContact O-N 3.01Å; D697-F699 VanDerWaalsContact C-N 3.34Å; D697-F699 PolarHBondContact O-N 3.5Å; D697-Q700 WeakPolarHBondContact O-CB 3.5Å; D697-Q700 PolarHBondContact O-N 2.97Å; D697-Q700 VanDerWaalsContact O-N 3.13Å; D697-E701 PolarHBondContact O-N 2.95Å
698	F	88.8	Confident	81.8	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.035	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-37.8	177.2	179.2	-113.9	0	0	0	112.9	V694 Q700 E701 L702 L721 I746 L749 R750	V694-F698 WeakPolarHBondContact O-CB 3.34Å; V694-F698 PolarHBondContact O-N 2.83Å; V694-F698 VanDerWaalsContact O-N 3.08Å; F698-Q700 VanDerWaalsContact C-N 3.31Å; F698-Q700 PolarHBondContact O-N 3.46Å; F698-E701 WeakPolarHBondContact O-CB 3.5Å; F698-E701 PolarHBondContact O-N 3.32Å; F698-L702 HydrophobicContact CD1-CD1 3.92Å; F698-L702 HydrophobicContact CD1-CG 4.35Å; F698-L702 HydrophobicContact CE1-CD1 3.43Å; F698-L702 VanDerWaalsContact CE1-CD1 3.43Å; F698-L702 HydrophobicContact CE1-CD2 4.4Å; F698-L702 HydrophobicContact CE1-CG 3.93Å; F698-L702 HydrophobicContact CE2-CD2 4.25Å; F698-L702 HydrophobicContact CE2-CG 4.13Å; F698-L702 HydrophobicContact CZ-CD1 3.78Å; F698-L702 HydrophobicContact CZ-CD2 3.86Å; F698-L702 HydrophobicContact CZ-CG 3.8Å; F698-L702 WeakPolarHBondContact O-CG 3.34Å; F698-L702 PolarHBondContact O-N 2.91Å; F698-L721 HydrophobicContact CD1-CD1 3.88Å; F698-L721 HydrophobicContact CD1-CD2 4.2Å; F698-L721 HydrophobicContact CE1-CD1 4.28Å; F698-L721 HydrophobicContact CE1-CD2 4.13Å; F698-I746 HydrophobicContact CB-CD1 3.77Å; F698-I746 HydrophobicContact CB-CG1 4.21Å; F698-I746 HydrophobicContact CD1-CD1 4.22Å; F698-I746 HydrophobicContact CD1-CG1 3.69Å; F698-I746 HydrophobicContact CD1-CG2 4.34Å; F698-I746 HydrophobicContact CD2-CG1 4.39Å; F698-I746 HydrophobicContact CD2-CG2 3.77Å; F698-I746 HydrophobicContact CE1-CG1 4.1Å; F698-I746 HydrophobicContact CE1-CG2 4.27Å; F698-I746 HydrophobicContact CE2-CG2 3.74Å; F698-I746 HydrophobicContact CG-CD1 3.92Å; F698-I746 HydrophobicContact CG-CG1 3.83Å; F698-I746 HydrophobicContact CG-CG2 4.08Å; F698-I746 HydrophobicContact CZ-CG2 3.99Å; F698-L749 HydrophobicContact CE1-CD2 3.77Å; F698-L749 HydrophobicContact CZ-CD2 4.25Å; F698-R750 HydrophobicContact CE2-CG 3.97Å; F698-R750 HydrophobicContact CZ-CG 4.07Å
699	F	86	Confident	79.7	Confident	36 Å²	36	64.5 Å²	64.5	16%	0.158	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-34.6	175.3	-178	-107.3	0	0	0	112.4	L695 A696 D697 L702 N703 G714 Q717 M718	L695-F699 VanDerWaalsContact O-CB 3.3Å; L695-F699 WeakPolarHBondContact O-CB 3.22Å; L695-F699 PolarHBondContact O-N 3.27Å; A696-F699 PolarHBondContact O-N 3.11Å; D697-F699 VanDerWaalsContact C-N 3.34Å; D697-F699 PolarHBondContact O-N 3.5Å; F699-L702 PolarHBondContact O-N 3.21Å; F699-N703 VanDerWaalsContact CD1-ND2 3.33Å; F699-N703 WeakPolarHBondContact CD1-ND2 3.26Å; F699-N703 WeakPolarHBondContact CE1-ND2 3.46Å; F699-N703 VanDerWaalsContact CZ-ND2 3.26Å; F699-N703 WeakPolarHBondContact CZ-ND2 3.4Å; F699-N703 PolarHBondContact O-N 3.22Å; F699-N703 VanDerWaalsContact O-N 3.09Å; F699-N703 PolarHBondContact O-ND2 2.93Å; F699-G714 WeakPolarHBondContact CE2-O 3.24Å; F699-Q717 HydrophobicContact CD2-CB 4.47Å; F699-Q717 HydrophobicContact CE2-CB 4.08Å; F699-M718 HydrophobicContact CB-CE 3.33Å; F699-M718 HydrophobicContact CB-SD 4.4Å; F699-M718 HydrophobicContact CD1-CE 3.73Å; F699-M718 HydrophobicContact CD2-CB 4.06Å; F699-M718 HydrophobicContact CD2-CE 4.3Å; F699-M718 HydrophobicContact CE2-CB 4.06Å; F699-M718 HydrophobicContact CG-CB 4.41Å; F699-M718 HydrophobicContact CG-CE 3.53Å; F699-M718 HydrophobicContact CZ-CB 4.39Å
700	Q	85.1	Confident	77.7	Confident	112 Å²	112	62.4 Å²	62.4	52%	0.523	35%	0.348	S	S	.	.	H	α-helix	trans	-66.9	-42	172.6	-71.6	179.7	26	0	0	111.6	A696 D697 F698 L702 N703 Q704	A696-Q700 WeakPolarHBondContact O-CG 3.15Å; A696-Q700 PolarHBondContact O-N 3.36Å; D697-Q700 WeakPolarHBondContact O-CB 3.5Å; D697-Q700 PolarHBondContact O-N 2.97Å; D697-Q700 VanDerWaalsContact O-N 3.13Å; F698-Q700 VanDerWaalsContact C-N 3.31Å; F698-Q700 PolarHBondContact O-N 3.46Å; Q700-L702 PolarHBondContact O-N 3.17Å; Q700-N703 PolarHBondContact O-N 3.43Å; Q700-Q704 WeakPolarHBondContact O-CG 3.4Å; Q700-Q704 PolarHBondContact O-N 2.79Å
701	E	84.1	Confident	75.8	Confident	90 Å²	90	62.3 Å²	62.3	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-56.2	-49.4	172.6	-68.3	177.3	-179.2	0	0	110.8	D697 F698 N703 Q704 E705 R750	D697-E701 PolarHBondContact O-N 2.95Å; F698-E701 WeakPolarHBondContact O-CB 3.5Å; F698-E701 PolarHBondContact O-N 3.32Å; E701-N703 VanDerWaalsContact C-N 3.34Å; E701-N703 PolarHBondContact O-N 3.12Å; E701-Q704 PolarHBondContact O-N 3.19Å; E701-Q704 VanDerWaalsContact O-N 3.09Å; E701-E705 PolarHBondContact O-N 3.45Å; E701-R750 IonicContact OE2-NH2 3.83Å; E701-R750 PolarHBondContact OE2-NH2 2.85Å; E701-R750 VanDerWaalsContact OE2-NH2 3.08Å
702	L	78.8	Confident	73.9	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-58.7	-42.1	179.1	-76.2	177.3	0	0	0	112.7	F698 F699 Q700 Q704 E705 Y706 L749 M753	F698-L702 HydrophobicContact CD1-CD1 3.92Å; F698-L702 HydrophobicContact CD1-CG 4.35Å; F698-L702 HydrophobicContact CE1-CD1 3.43Å; F698-L702 VanDerWaalsContact CE1-CD1 3.43Å; F698-L702 HydrophobicContact CE1-CD2 4.4Å; F698-L702 HydrophobicContact CE1-CG 3.93Å; F698-L702 HydrophobicContact CE2-CD2 4.25Å; F698-L702 HydrophobicContact CE2-CG 4.13Å; F698-L702 HydrophobicContact CZ-CD1 3.78Å; F698-L702 HydrophobicContact CZ-CD2 3.86Å; F698-L702 HydrophobicContact CZ-CG 3.8Å; F698-L702 WeakPolarHBondContact O-CG 3.34Å; F698-L702 PolarHBondContact O-N 2.91Å; F699-L702 PolarHBondContact O-N 3.21Å; Q700-L702 PolarHBondContact O-N 3.17Å; L702-Q704 PolarHBondContact O-N 3.23Å; L702-E705 PolarHBondContact O-N 2.89Å; L702-Y706 HydrophobicContact CB-CD2 4.46Å; L702-Y706 HydrophobicContact CD2-CD2 3.74Å; L702-Y706 HydrophobicContact CD2-CE2 3.51Å; L702-Y706 WeakPolarHBondContact O-CB 3.36Å; L702-Y706 VanDerWaalsContact O-CD2 3.29Å; L702-Y706 WeakPolarHBondContact O-CD2 3.42Å; L702-Y706 PolarHBondContact O-N 2.84Å; L702-L749 HydrophobicContact CD1-CD2 4.17Å; L702-M753 HydrophobicContact CD2-CE 4.2Å; L702-M753 HydrophobicContact CD2-SD 3.58Å; L702-M753 VanDerWaalsContact CD2-SD 3.58Å
703	N	72.9	Confident	72.3	Confident	56 Å²	56	64.8 Å²	64.8	30%	0.299	36%	0.359	S	S	.	.	H	α-helix	trans	-68.7	-23.1	179.7	-73.7	-46.9	0	0	0	113.2	F699 Q700 E701 S713	F699-N703 VanDerWaalsContact CD1-ND2 3.33Å; F699-N703 WeakPolarHBondContact CD1-ND2 3.26Å; F699-N703 WeakPolarHBondContact CE1-ND2 3.46Å; F699-N703 VanDerWaalsContact CZ-ND2 3.26Å; F699-N703 WeakPolarHBondContact CZ-ND2 3.4Å; F699-N703 PolarHBondContact O-N 3.22Å; F699-N703 VanDerWaalsContact O-N 3.09Å; F699-N703 PolarHBondContact O-ND2 2.93Å; Q700-N703 PolarHBondContact O-N 3.43Å; E701-N703 VanDerWaalsContact C-N 3.34Å; E701-N703 PolarHBondContact O-N 3.12Å; N703-S713 WeakPolarHBondContact OD1-CB 3.34Å
704	Q	71.8	Confident	71.1	Confident	156 Å²	156	61.5 Å²	61.5	73%	0.729	35%	0.348	S	S	*	.	H	α-helix	trans	-81.4	-36.2	177.3	-68.3	174.5	26.2	0	0	112.3	Q700 E701 L702	Q700-Q704 WeakPolarHBondContact O-CG 3.4Å; Q700-Q704 PolarHBondContact O-N 2.79Å; E701-Q704 PolarHBondContact O-N 3.19Å; E701-Q704 VanDerWaalsContact O-N 3.09Å; L702-Q704 PolarHBondContact O-N 3.23Å
705	E	65.8	Low	70.4	Confident	137 Å²	137	65.3 Å²	65.3	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-86	-30.6	-174.5	-72.9	-172.4	157.2	0	0	114.2	E701 L702	E701-E705 PolarHBondContact O-N 3.45Å; L702-E705 PolarHBondContact O-N 2.89Å
706	Y	57.6	Low	69.8	Low	26 Å²	26	68.5 Å²	68.5	10%	0.102	38%	0.383	C	S	.	.			trans	-107.5	9.9	-157.7	-70.9	-89.1	0	0	0	117.6	L702 V708 Q709 M753 T757	L702-Y706 HydrophobicContact CB-CD2 4.46Å; L702-Y706 HydrophobicContact CD2-CD2 3.74Å; L702-Y706 HydrophobicContact CD2-CE2 3.51Å; L702-Y706 WeakPolarHBondContact O-CB 3.36Å; L702-Y706 VanDerWaalsContact O-CD2 3.29Å; L702-Y706 WeakPolarHBondContact O-CD2 3.42Å; L702-Y706 PolarHBondContact O-N 2.84Å; Y706-V708 PolarHBondContact O-N 3.43Å; Y706-Q709 PolarHBondContact O-N 3.37Å; Y706-M753 HydrophobicContact CE1-CB 4.39Å; Y706-M753 HydrophobicContact CE1-SD 4.16Å; Y706-M753 HydrophobicContact CE2-SD 4.42Å; Y706-T757 HydrophobicContact CD1-CG2 4.49Å; Y706-T757 HydrophobicContact CE1-CG2 3.48Å; Y706-T757 VanDerWaalsContact CE1-CG2 3.48Å
707	T	50.9	Low	69.5	Low	121 Å²	121	68.4 Å²	68.4	74%	0.742	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-11	171.1	-33.8	0	0	0	0	113.3
708	V	44.3	Very low	69.3	Low	128 Å²	128	66.1 Å²	66.1	78%	0.776	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-18.9	-168.1	-172.7	0	0	0	0	114.3	Y706	Y706-V708 PolarHBondContact O-N 3.43Å
709	Q	50.9	Low	69.2	Low	35 Å²	35	68.5 Å²	68.5	16%	0.164	38%	0.375	C	S	.	.	S	Bend	trans	-107.8	4.4	-168.7	-67.7	-157.2	-31.8	0	0	116.4	Y706 I711 A756	Y706-Q709 PolarHBondContact O-N 3.37Å; Q709-I711 PolarHBondContact O-N 3.36Å; Q709-I711 VanDerWaalsContact O-N 3.16Å; Q709-A756 PolarHBondContact NE2-O 3.15Å
710	G	51	Low	69.3	Low	51 Å²	51	67 Å²	67	53%	0.526	37%	0.37	S	S	.	.	S	Bend	trans	72.2	3.6	174.7	0	0	0	0	0	115.5
711	I	55	Low	69.6	Low	38 Å²	38	61.7 Å²	61.7	20%	0.195	35%	0.345	C	S	.	.	S	Bend	trans	-80.2	119.5	164	-57	174.4	0	0	0	106.4	Q709 S713	Q709-I711 PolarHBondContact O-N 3.36Å; Q709-I711 VanDerWaalsContact O-N 3.16Å; I711-S713 PolarHBondContact O-N 3.21Å
712	P	52.4	Low	70	Confident	62 Å²	62	59.2 Å²	59.2	40%	0.403	33%	0.334	S	S	.	.			trans	-67.1	104.9	-177	23.6	-29.9	0	0	0	110.2	G714	P712-G714 PolarHBondContact O-N 2.81Å
713	S	59.9	Low	70.6	Confident	48 Å²	48	59.3 Å²	59.3	34%	0.336	33%	0.334	S	S	.	.			trans	-74.4	118.9	165.9	54.3	0	0	0	0	108.4	N703 I711	N703-S713 WeakPolarHBondContact OD1-CB 3.34Å; I711-S713 PolarHBondContact O-N 3.21Å
714	G	68.2	Low	71.6	Confident	30 Å²	30	56.7 Å²	56.7	31%	0.309	32%	0.32	S	S	.	.	S	Bend	trans	-163.9	-179.9	-175.9	0	0	0	0	0	110.7	F699 P712 R716 Q717	F699-G714 WeakPolarHBondContact CE2-O 3.24Å; P712-G714 PolarHBondContact O-N 2.81Å; G714-R716 PolarHBondContact O-N 3.48Å; G714-Q717 WeakPolarHBondContact O-CB 3.5Å; G714-Q717 PolarHBondContact O-N 3.04Å
715	T	79.8	Confident	72.7	Confident	106 Å²	106	49.3 Å²	49.3	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-52.5	-30.7	-177.9	55.3	0	0	0	0	113.3	Q717 M718 E719	T715-Q717 VanDerWaalsContact C-N 3.3Å; T715-Q717 PolarHBondContact O-N 3.32Å; T715-M718 WeakPolarHBondContact O-CB 3.4Å; T715-M718 PolarHBondContact O-N 3.25Å; T715-E719 WeakPolarHBondContact O-CG 3.35Å; T715-E719 PolarHBondContact O-N 2.73Å
716	R	80.8	Confident	74	Confident	71 Å²	71	43 Å²	43	27%	0.268	26%	0.256	S	S	.	.	H	α-helix	trans	-58.8	-33.8	176.9	-67.5	-178.8	175.3	-145	-16.3	114.6	E547 S597 G714 M718 E719 S720	E547-R716 IonicContact OE1-CZ 2.71Å; E547-R716 IonicContact OE1-NH2 2.67Å; E547-R716 PolarHBondContact OE1-NH2 3.14Å; E547-R716 IonicContact OE2-CZ 3.16Å; E547-R716 IonicContact OE2-NH1 3.77Å; E547-R716 PolarHBondContact OE2-NH1 3.23Å; E547-R716 IonicContact OE2-NH2 3.64Å; E547-R716 PolarHBondContact OE2-NH2 3.2Å; S597-R716 PolarHBondContact OG-NH1 3.24Å; G714-R716 PolarHBondContact O-N 3.48Å; R716-M718 VanDerWaalsContact C-N 3.34Å; R716-E719 PolarHBondContact O-N 3.13Å; R716-S720 WeakPolarHBondContact O-CB 3.48Å; R716-S720 PolarHBondContact O-N 3.18Å; R716-S720 PolarHBondContact O-OG 3.48Å
717	Q	83.2	Confident	75.7	Confident	29 Å²	29	41.7 Å²	41.7	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-39.5	175.6	-79.4	-101.9	-18	0	0	110.8	F699 G714 T715 S720 L721 M753	F699-Q717 HydrophobicContact CD2-CB 4.47Å; F699-Q717 HydrophobicContact CE2-CB 4.08Å; G714-Q717 WeakPolarHBondContact O-CB 3.5Å; G714-Q717 PolarHBondContact O-N 3.04Å; T715-Q717 VanDerWaalsContact C-N 3.3Å; T715-Q717 PolarHBondContact O-N 3.32Å; Q717-S720 VanDerWaalsContact O-CB 3.3Å; Q717-S720 WeakPolarHBondContact O-CB 3.48Å; Q717-S720 PolarHBondContact O-N 3.05Å; Q717-L721 WeakPolarHBondContact O-CG 3.4Å; Q717-L721 PolarHBondContact O-N 3.44Å; Q717-M753 VanDerWaalsContact OE1-CE 3.27Å
718	M	87.2	Confident	77.8	Confident	42 Å²	42	36 Å²	36	21%	0.207	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-44.3	172.7	-178.5	61.2	86.8	0	0	111.1	L695 F699 T715 R716 S720 L721 I722	L695-M718 HydrophobicContact CB-SD 4.37Å; F699-M718 HydrophobicContact CB-CE 3.33Å; F699-M718 HydrophobicContact CB-SD 4.4Å; F699-M718 HydrophobicContact CD1-CE 3.73Å; F699-M718 HydrophobicContact CD2-CB 4.06Å; F699-M718 HydrophobicContact CD2-CE 4.3Å; F699-M718 HydrophobicContact CE2-CB 4.06Å; F699-M718 HydrophobicContact CG-CB 4.41Å; F699-M718 HydrophobicContact CG-CE 3.53Å; F699-M718 HydrophobicContact CZ-CB 4.39Å; T715-M718 WeakPolarHBondContact O-CB 3.4Å; T715-M718 PolarHBondContact O-N 3.25Å; R716-M718 VanDerWaalsContact C-N 3.34Å; M718-S720 VanDerWaalsContact C-N 3.25Å; M718-S720 PolarHBondContact O-N 2.78Å; M718-L721 WeakPolarHBondContact O-CB 3.48Å; M718-L721 PolarHBondContact O-N 3.36Å; M718-I722 HydrophobicContact CG-CD1 4.06Å; M718-I722 WeakPolarHBondContact O-CG1 3.46Å; M718-I722 PolarHBondContact O-N 3.46Å; M718-I722 HydrophobicContact SD-CD1 4.47Å
719	E	87.5	Confident	80.2	Confident	58 Å²	58	30 Å²	30	27%	0.271	18%	0.179	S	C	.	.	H	α-helix	trans	-60.2	-37.8	175.1	-56.3	-177	-177.8	0	0	112.2	L442 T715 R716 I722 R723	L442-E719 HydrophobicContact CD2-CB 3.95Å; L442-E719 VanDerWaalsContact CD2-CD 3.42Å; L442-E719 HydrophobicContact CD2-CG 3.49Å; L442-E719 VanDerWaalsContact CD2-CG 3.49Å; T715-E719 WeakPolarHBondContact O-CG 3.35Å; T715-E719 PolarHBondContact O-N 2.73Å; R716-E719 PolarHBondContact O-N 3.13Å; E719-I722 PolarHBondContact O-N 2.7Å; E719-R723 VanDerWaalsContact O-CG 3.28Å; E719-R723 WeakPolarHBondContact O-CG 3.46Å; E719-R723 PolarHBondContact O-N 2.95Å; E719-R723 IonicContact OE2-CZ 3.23Å; E719-R723 IonicContact OE2-NH1 2.82Å; E719-R723 IonicContact OE2-NH2 2.74Å; E719-R723 PolarHBondContact OE2-NH2 3.01Å
720	S	89.2	Confident	82.2	Confident	5 Å²	5	28.7 Å²	28.7	4%	0.035	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-47.4	176.9	-58.6	0	0	0	0	111.3	D600 R716 Q717 M718 I722 R723 L724	D600-S720 WeakPolarHBondContact CA-OG 3.21Å; D600-S720 PolarHBondContact OD1-OG 3.1Å; R716-S720 WeakPolarHBondContact O-CB 3.48Å; R716-S720 PolarHBondContact O-N 3.18Å; R716-S720 PolarHBondContact O-OG 3.48Å; Q717-S720 VanDerWaalsContact O-CB 3.3Å; Q717-S720 WeakPolarHBondContact O-CB 3.48Å; Q717-S720 PolarHBondContact O-N 3.05Å; M718-S720 VanDerWaalsContact C-N 3.25Å; M718-S720 PolarHBondContact O-N 2.78Å; S720-I722 PolarHBondContact O-N 3.32Å; S720-R723 PolarHBondContact O-N 3.46Å; S720-L724 WeakPolarHBondContact O-CB 3.17Å; S720-L724 WeakPolarHBondContact O-CG 3.21Å; S720-L724 PolarHBondContact O-N 2.66Å
721	L	90.9	Very high	84.1	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-45.7	176	-76.3	170.1	0	0	0	111.8	L695 F698 Q717 M718 L724 T725 V745 L749	L695-L721 HydrophobicContact CD1-CB 4.49Å; L695-L721 HydrophobicContact CD2-CB 4.05Å; L695-L721 HydrophobicContact CD2-CD1 4.48Å; L695-L721 HydrophobicContact CD2-CD2 4.23Å; L695-L721 HydrophobicContact CD2-CG 4.5Å; F698-L721 HydrophobicContact CD1-CD1 3.88Å; F698-L721 HydrophobicContact CD1-CD2 4.2Å; F698-L721 HydrophobicContact CE1-CD1 4.28Å; F698-L721 HydrophobicContact CE1-CD2 4.13Å; Q717-L721 WeakPolarHBondContact O-CG 3.4Å; Q717-L721 PolarHBondContact O-N 3.44Å; M718-L721 WeakPolarHBondContact O-CB 3.48Å; M718-L721 PolarHBondContact O-N 3.36Å; L721-L724 PolarHBondContact O-N 3.34Å; L721-T725 VanDerWaalsContact O-CB 3.31Å; L721-T725 WeakPolarHBondContact O-CB 3.35Å; L721-T725 PolarHBondContact O-N 2.95Å; L721-T725 PolarHBondContact O-OG1 3.05Å; L721-V745 HydrophobicContact CD2-CG1 3.92Å; L721-L749 HydrophobicContact CD2-CD2 3.98Å; L721-L749 HydrophobicContact CG-CD2 4.49Å
722	I	91.8	Very high	85.9	Confident	38 Å²	38	26.2 Å²	26.2	20%	0.195	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-50	176.2	-73	169.7	0	0	0	110.5	L442 L687 L695 M718 E719 S720 L724 T725 Q726	L442-I722 HydrophobicContact CD1-CG2 3.82Å; L687-I722 HydrophobicContact CD1-CG2 3.73Å; L687-I722 HydrophobicContact CD2-CG1 4.4Å; L695-I722 HydrophobicContact CD1-CG1 4.39Å; M718-I722 HydrophobicContact CG-CD1 4.06Å; M718-I722 WeakPolarHBondContact O-CG1 3.46Å; M718-I722 PolarHBondContact O-N 3.46Å; M718-I722 HydrophobicContact SD-CD1 4.47Å; E719-I722 PolarHBondContact O-N 2.7Å; S720-I722 PolarHBondContact O-N 3.32Å; I722-L724 PolarHBondContact O-N 3.2Å; I722-T725 PolarHBondContact O-N 2.95Å; I722-Q726 WeakPolarHBondContact O-CB 3.41Å; I722-Q726 WeakPolarHBondContact O-CG 3.48Å; I722-Q726 PolarHBondContact O-N 2.91Å
723	R	91.9	Very high	87.6	Confident	9 Å²	9	24.3 Å²	24.3	3%	0.034	13%	0.133	C	C	.	.	H	α-helix	trans	-60.3	-46	179.9	-72.9	174.2	-167.3	126.4	14.7	112.3	A435 R444 I447 D600 E719 S720 Q726 A727	A435-R723 HydrophobicContact CB-CB 3.74Å; A435-R723 HydrophobicContact CB-CG 3.83Å; R444-R723 PolarHBondContact O-NE 3.23Å; I447-R723 HydrophobicContact CG1-CB 4.05Å; D600-R723 IonicContact OD1-NH1 3.72Å; D600-R723 PolarHBondContact OD1-NH1 3.38Å; E719-R723 VanDerWaalsContact O-CG 3.28Å; E719-R723 WeakPolarHBondContact O-CG 3.46Å; E719-R723 PolarHBondContact O-N 2.95Å; E719-R723 IonicContact OE2-CZ 3.23Å; E719-R723 IonicContact OE2-NH1 2.82Å; E719-R723 IonicContact OE2-NH2 2.74Å; E719-R723 PolarHBondContact OE2-NH2 3.01Å; S720-R723 PolarHBondContact O-N 3.46Å; R723-Q726 PolarHBondContact O-N 3.17Å; R723-A727 WeakPolarHBondContact O-CB 3.46Å; R723-A727 PolarHBondContact O-N 3.24Å
724	L	93.3	Very high	89.1	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-41.2	179.2	-74	162.5	0	0	0	111.6	L430 I447 V601 S720 L721 I722 A727 R728 V745 L749	L430-L724 HydrophobicContact CB-CD2 4.25Å; L430-L724 HydrophobicContact CD1-CD2 3.98Å; I447-L724 HydrophobicContact CD1-CD2 4.08Å; I447-L724 HydrophobicContact CG2-CD2 3.96Å; V601-L724 HydrophobicContact CG2-CD1 3.6Å; V601-L724 HydrophobicContact CG2-CD2 4.08Å; V601-L724 HydrophobicContact CG2-CG 4.42Å; S720-L724 WeakPolarHBondContact O-CB 3.17Å; S720-L724 WeakPolarHBondContact O-CG 3.21Å; S720-L724 PolarHBondContact O-N 2.66Å; L721-L724 PolarHBondContact O-N 3.34Å; I722-L724 PolarHBondContact O-N 3.2Å; L724-A727 PolarHBondContact O-N 3.46Å; L724-R728 WeakPolarHBondContact O-CB 3.39Å; L724-R728 PolarHBondContact O-N 3.01Å; L724-V745 HydrophobicContact CB-CB 4.4Å; L724-V745 HydrophobicContact CB-CG1 3.52Å; L724-V745 HydrophobicContact CB-CG2 3.89Å; L724-V745 HydrophobicContact CD1-CG1 4.02Å; L724-V745 HydrophobicContact CG-CG1 4.41Å; L724-L749 HydrophobicContact CD1-CD1 4.49Å
725	T	94.8	Very high	90.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.7	-41.9	179.7	-54.4	0	0	0	0	111.1	L687 L721 I722 R728 A729 A737 D741 A742	L687-T725 HydrophobicContact CD2-CG2 4.5Å; L721-T725 VanDerWaalsContact O-CB 3.31Å; L721-T725 WeakPolarHBondContact O-CB 3.35Å; L721-T725 PolarHBondContact O-N 2.95Å; L721-T725 PolarHBondContact O-OG1 3.05Å; I722-T725 PolarHBondContact O-N 2.95Å; T725-R728 WeakPolarHBondContact O-CB 3.33Å; T725-R728 PolarHBondContact O-N 3.04Å; T725-A729 PolarHBondContact O-N 3.29Å; T725-A729 VanDerWaalsContact O-N 3.12Å; T725-A737 HydrophobicContact CG2-CB 4.08Å; T725-D741 HydrophobicContact CG2-CB 3.97Å; T725-A742 HydrophobicContact CG2-CB 4.18Å
726	Q	93.6	Very high	90.8	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.019	13%	0.129	C	C	.	.	H	α-helix	trans	-62.8	-45.3	171.7	-74.3	178.8	-4.6	0	0	112.1	A435 S436 E439 P685 L687 I722 R723 R728 A729 R730	A435-Q726 HydrophobicContact CB-CB 4.25Å; S436-Q726 VanDerWaalsContact N-OE1 3.1Å; E439-Q726 PolarHBondContact OE2-NE2 3.35Å; P685-Q726 HydrophobicContact CG-CB 4.04Å; P685-Q726 WeakPolarHBondContact CG-O 3.49Å; L687-Q726 HydrophobicContact CD1-CG 3.9Å; I722-Q726 WeakPolarHBondContact O-CB 3.41Å; I722-Q726 WeakPolarHBondContact O-CG 3.48Å; I722-Q726 PolarHBondContact O-N 2.91Å; R723-Q726 PolarHBondContact O-N 3.17Å; Q726-R728 PolarHBondContact O-N 3.3Å; Q726-A729 PolarHBondContact O-N 3.25Å; Q726-R730 PolarHBondContact O-N 3.18Å
727	A	94.1	Very high	91.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-36.7	176.9	0	0	0	0	0	111.8	L430 G434 I447 R723 L724 R730 C731	L430-A727 HydrophobicContact CB-CB 4.31Å; L430-A727 HydrophobicContact CD2-CB 4.12Å; G434-A727 WeakPolarHBondContact O-CA 3.36Å; G434-A727 WeakPolarHBondContact O-CB 3.46Å; I447-A727 HydrophobicContact CD1-CB 3.52Å; R723-A727 WeakPolarHBondContact O-CB 3.46Å; R723-A727 PolarHBondContact O-N 3.24Å; L724-A727 PolarHBondContact O-N 3.46Å; A727-R730 PolarHBondContact O-N 2.92Å; A727-C731 PolarHBondContact O-N 3.5Å; A727-C731 PolarHBondContact O-SG 3.19Å
728	R	94.6	Very high	92	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-43.3	177.7	178.7	65.2	-168.7	90.9	-0.8	112.1	F407 L430 L724 T725 Q726 C731 E732 D741 D744 V745	F407-R728 VanDerWaalsContact CB-NH2 3.26Å; F407-R728 VanDerWaalsContact CD1-CZ 3.44Å; L430-R728 VanDerWaalsContact CD2-CA 3.46Å; L430-R728 HydrophobicContact CD2-CB 3.82Å; L724-R728 WeakPolarHBondContact O-CB 3.39Å; L724-R728 PolarHBondContact O-N 3.01Å; T725-R728 WeakPolarHBondContact O-CB 3.33Å; T725-R728 PolarHBondContact O-N 3.04Å; Q726-R728 PolarHBondContact O-N 3.3Å; R728-C731 WeakPolarHBondContact O-CB 3.47Å; R728-C731 PolarHBondContact O-N 3Å; R728-E732 IonicContact CZ-OE1 3.48Å; R728-E732 VanDerWaalsContact CZ-OE1 3.23Å; R728-E732 VanDerWaalsContact NH1-CD 3.3Å; R728-E732 IonicContact NH1-OE1 3.17Å; R728-E732 PolarHBondContact NH1-OE1 3.34Å; R728-E732 IonicContact NH1-OE2 2.94Å; R728-E732 IonicContact NH2-OE1 3.21Å; R728-E732 PolarHBondContact NH2-OE1 2.84Å; R728-D741 HydrophobicContact CB-CB 4.24Å; R728-D741 HydrophobicContact CG-CB 3.81Å; R728-D741 WeakPolarHBondContact CG-OD1 3.39Å; R728-D744 IonicContact CZ-OD2 3.99Å; R728-D744 IonicContact NE-OD2 3.8Å; R728-D744 PolarHBondContact NE-OD2 2.84Å; R728-D744 VanDerWaalsContact NE-OD2 3.13Å; R728-D744 IonicContact NH2-OD2 3.79Å; R728-D744 PolarHBondContact NH2-OD2 2.79Å; R728-V745 HydrophobicContact CB-CG2 4.27Å
729	A	93.8	Very high	92.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.8	-40.9	174.2	0	0	0	0	0	112	P685 T725 Q726 C731 E732 L733 R734 A737	P685-A729 HydrophobicContact CB-CB 3.96Å; P685-A729 HydrophobicContact CG-CB 4.42Å; T725-A729 PolarHBondContact O-N 3.29Å; T725-A729 VanDerWaalsContact O-N 3.12Å; Q726-A729 PolarHBondContact O-N 3.25Å; A729-C731 VanDerWaalsContact C-N 3.27Å; A729-C731 PolarHBondContact O-N 3.21Å; A729-E732 PolarHBondContact O-N 3.22Å; A729-E732 VanDerWaalsContact O-N 3.13Å; A729-L733 PolarHBondContact O-N 3.16Å; A729-R734 PolarHBondContact O-N 3.47Å; A729-A737 HydrophobicContact CB-CB 3.72Å
730	R	93	Very high	92.5	Very high	9 Å²	9	29.4 Å²	29.4	3%	0.034	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-33.6	176.2	178.7	175.7	-80	161.9	-2.5	113	F433 G434 A435 C679 V683 N684 P685 Q726 A727 E732 L733	F433-R730 HydrophobicContact CD1-CG 4.42Å; F433-R730 PolarHBondContact O-NH1 3.13Å; G434-R730 PolarHBondContact O-NH1 3.46Å; A435-R730 VanDerWaalsContact C-NH1 3.3Å; A435-R730 PolarHBondContact O-NH1 2.97Å; A435-R730 PolarHBondContact O-NH2 3.49Å; C679-R730 HydrophobicContact CB-CG 4.02Å; V683-R730 PolarHBondContact O-NE 2.63Å; V683-R730 PolarHBondContact O-NH2 3.45Å; N684-R730 PolarHBondContact OD1-NH2 3.35Å; N684-R730 VanDerWaalsContact OD1-NH2 3.13Å; P685-R730 HydrophobicContact CG-CB 4.06Å; Q726-R730 PolarHBondContact O-N 3.18Å; A727-R730 PolarHBondContact O-N 2.92Å; R730-E732 PolarHBondContact O-N 2.95Å; R730-E732 VanDerWaalsContact O-N 3.17Å; R730-L733 PolarHBondContact O-N 3.25Å; R730-L733 VanDerWaalsContact O-N 3.07Å
731	C	91.7	Very high	92.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.9	177.8	-67.7	0	0	0	0	112.8	F407 L410 F433 Y675 A727 R728 A729	F407-C731 HydrophobicContact CD2-CB 4.02Å; L410-C731 HydrophobicContact CD1-CB 4.43Å; F433-C731 WeakPolarHBondContact CD2-SG 3.4Å; F433-C731 HydrophobicContact CE2-CB 4.44Å; Y675-C731 WeakPolarHBondContact CE1-O 3.06Å; Y675-C731 PolarHBondContact OH-O 3.22Å; A727-C731 PolarHBondContact O-N 3.5Å; A727-C731 PolarHBondContact O-SG 3.19Å; R728-C731 WeakPolarHBondContact O-CB 3.47Å; R728-C731 PolarHBondContact O-N 3Å; A729-C731 VanDerWaalsContact C-N 3.27Å; A729-C731 PolarHBondContact O-N 3.21Å
732	E	91.3	Very high	92.9	Very high	36 Å²	36	29.2 Å²	29.2	17%	0.168	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	16.3	179.9	-71.6	171.7	-166.5	0	0	112.5	L406 R728 A729 R730 R734	L406-E732 HydrophobicContact CB-CG 4.38Å; R728-E732 IonicContact CZ-OE1 3.48Å; R728-E732 VanDerWaalsContact CZ-OE1 3.23Å; R728-E732 VanDerWaalsContact NH1-CD 3.3Å; R728-E732 IonicContact NH1-OE1 3.17Å; R728-E732 PolarHBondContact NH1-OE1 3.34Å; R728-E732 IonicContact NH1-OE2 2.94Å; R728-E732 IonicContact NH2-OE1 3.21Å; R728-E732 PolarHBondContact NH2-OE1 2.84Å; A729-E732 PolarHBondContact O-N 3.22Å; A729-E732 VanDerWaalsContact O-N 3.13Å; R730-E732 PolarHBondContact O-N 2.95Å; R730-E732 VanDerWaalsContact O-N 3.17Å; E732-R734 HydrophobicContact CB-CG 4.27Å; E732-R734 PolarHBondContact O-N 3.33Å; E732-R734 IonicContact OE2-CZ 3.98Å; E732-R734 VanDerWaalsContact OE2-CZ 3.29Å; E732-R734 IonicContact OE2-NE 3.88Å; E732-R734 PolarHBondContact OE2-NE 3.21Å; E732-R734 IonicContact OE2-NH2 2.74Å; E732-R734 PolarHBondContact OE2-NH2 3.12Å
733	L	90	Very high	93	Very high	23 Å²	23	31.3 Å²	31.3	12%	0.12	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	31.3	-179.2	-69	161.8	0	0	0	113.5	V397 M401 Y675 F678 C679 V683 A729 R730	V397-L733 HydrophobicContact CG1-CD1 3.63Å; M401-L733 HydrophobicContact CE-CB 3.82Å; M401-L733 HydrophobicContact CE-CD1 4.24Å; M401-L733 HydrophobicContact CG-CD1 3.93Å; M401-L733 HydrophobicContact SD-CB 4.11Å; M401-L733 HydrophobicContact SD-CD1 3.4Å; M401-L733 WeakPolarHBondContact SD-CD1 3.42Å; M401-L733 HydrophobicContact SD-CG 4.37Å; Y675-L733 HydrophobicContact CE2-CD1 4.02Å; F678-L733 HydrophobicContact CD1-CD1 4.14Å; F678-L733 HydrophobicContact CD1-CD2 3.93Å; F678-L733 HydrophobicContact CE1-CD1 3.88Å; F678-L733 HydrophobicContact CE1-CD2 3.85Å; C679-L733 HydrophobicContact CB-CD2 4Å; C679-L733 VanDerWaalsContact SG-CD2 3.52Å; V683-L733 HydrophobicContact CB-CD2 4.38Å; V683-L733 HydrophobicContact CG2-CB 4.15Å; V683-L733 HydrophobicContact CG2-CD2 3.55Å; V683-L733 HydrophobicContact CG2-CG 4.49Å; A729-L733 PolarHBondContact O-N 3.16Å; R730-L733 PolarHBondContact O-N 3.25Å; R730-L733 VanDerWaalsContact O-N 3.07Å
734	R	90.6	Very high	93	Very high	62 Å²	62	31.3 Å²	31.3	23%	0.234	15%	0.149	C	C	.	.			trans	-91.5	134.3	177.1	-67.2	-170	-79.9	118	-5.4	111.3	V683 A729 E732 E736 T738 D741	V683-R734 WeakPolarHBondContact CG1-O 3.08Å; A729-R734 PolarHBondContact O-N 3.47Å; E732-R734 HydrophobicContact CB-CG 4.27Å; E732-R734 PolarHBondContact O-N 3.33Å; E732-R734 IonicContact OE2-CZ 3.98Å; E732-R734 VanDerWaalsContact OE2-CZ 3.29Å; E732-R734 IonicContact OE2-NE 3.88Å; E732-R734 PolarHBondContact OE2-NE 3.21Å; E732-R734 IonicContact OE2-NH2 2.74Å; E732-R734 PolarHBondContact OE2-NH2 3.12Å; R734-E736 PolarHBondContact NH1-O 3.31Å; R734-T738 PolarHBondContact NH1-OG1 3.49Å; R734-D741 IonicContact CZ-OD1 2.75Å; R734-D741 IonicContact CZ-OD2 2.63Å; R734-D741 IonicContact NH1-OD1 2.89Å; R734-D741 IonicContact NH1-OD2 3.78Å; R734-D741 PolarHBondContact NH1-OD2 2.91Å; R734-D741 VanDerWaalsContact NH2-CG 3.29Å; R734-D741 IonicContact NH2-OD1 3.08Å; R734-D741 PolarHBondContact NH2-OD1 2.97Å; R734-D741 IonicContact NH2-OD2 3.47Å; R734-D741 PolarHBondContact NH2-OD2 2.96Å; R734-D741 VanDerWaalsContact NH2-OD2 3.16Å
735	D	91	Very high	93	Very high	99 Å²	99	31.3 Å²	31.3	53%	0.529	15%	0.149	S	C	.	.	S	Bend	trans	-78.2	-19.4	175.9	-73.5	-37.9	0	0	0	113.1	P685 H686	P685-D735 CarbonylContact C-O 3.57Å; P685-D735 WeakPolarHBondContact CA-O 3.36Å; H686-D735 PolarHBondContact CE1-O 3.36Å; H686-D735 PolarHBondContact N-O 3.37Å; H686-D735 PolarHBondContact ND1-O 3Å
736	E	93.5	Very high	92.8	Very high	95 Å²	95	31.7 Å²	31.7	44%	0.444	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131.1	178.2	-171.5	179.1	-176.9	0	0	110.5	S688 R734	S688-E736 WeakPolarHBondContact CB-OE1 3.46Å; R734-E736 PolarHBondContact NH1-O 3.31Å
737	A	93.4	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.9	175.5	0	0	0	0	0	110.5	H686 S688 T725 A729	H686-A737 PolarHBondContact O-N 2.84Å; S688-A737 WeakPolarHBondContact CB-O 3.35Å; S688-A737 PolarHBondContact N-O 2.97Å; S688-A737 PolarHBondContact OG-O 3.48Å; T725-A737 HydrophobicContact CG2-CB 4.08Å; A729-A737 HydrophobicContact CB-CB 3.72Å
738	T	94.3	Very high	92.5	Very high	50 Å²	50	34.1 Å²	34.1	31%	0.307	16%	0.163	S	C	.	.			trans	-91.1	167.8	-171.6	64	0	0	0	0	111.9	R734 R740 D741 A742	R734-T738 PolarHBondContact NH1-OG1 3.49Å; T738-R740 PolarHBondContact O-N 2.77Å; T738-D741 PolarHBondContact N-OD2 3.09Å; T738-D741 WeakPolarHBondContact O-CB 3.49Å; T738-D741 PolarHBondContact O-N 3.43Å; T738-D741 VanDerWaalsContact O-N 3.09Å; T738-D741 PolarHBondContact OG1-OD2 3.5Å; T738-A742 PolarHBondContact O-N 3.4Å
739	E	94.3	Very high	92.2	Very high	96 Å²	96	34.1 Å²	34.1	45%	0.449	16%	0.163	S	C	.	.	H	α-helix	trans	-54.8	-38.6	173.5	-176.1	180	172.7	0	0	112.8	A690 V694 D741 A742 L743	A690-E739 HydrophobicContact CB-CB 4.3Å; V694-E739 HydrophobicContact CG2-CG 3.72Å; E739-D741 PolarHBondContact O-N 2.86Å; E739-A742 WeakPolarHBondContact O-CB 3.44Å; E739-A742 PolarHBondContact O-N 2.95Å; E739-A742 VanDerWaalsContact O-N 3.11Å; E739-L743 HydrophobicContact CG-CD1 4.35Å; E739-L743 WeakPolarHBondContact O-CG 3.27Å; E739-L743 PolarHBondContact O-N 3.13Å
740	R	91.4	Very high	91.7	Very high	88 Å²	88	39.6 Å²	39.6	33%	0.332	18%	0.184	S	C	.	.	H	α-helix	trans	-60.1	-36.5	178.3	-169.9	178.6	-171.2	-175.6	2.7	112.2	A649 T738 L743 D744	A649-R740 PolarHBondContact O-NE 2.88Å; A649-R740 PolarHBondContact O-NH2 2.6Å; T738-R740 PolarHBondContact O-N 2.77Å; R740-L743 PolarHBondContact O-N 2.92Å; R740-D744 PolarHBondContact O-N 3.34Å
741	D	94	Very high	91.2	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-67.3	-40	177.6	-57.6	-50.9	0	0	0	111.2	T725 R728 R734 T738 E739 D744 V745	T725-D741 HydrophobicContact CG2-CB 3.97Å; R728-D741 HydrophobicContact CB-CB 4.24Å; R728-D741 HydrophobicContact CG-CB 3.81Å; R728-D741 WeakPolarHBondContact CG-OD1 3.39Å; R734-D741 IonicContact CZ-OD1 2.75Å; R734-D741 IonicContact CZ-OD2 2.63Å; R734-D741 IonicContact NH1-OD1 2.89Å; R734-D741 IonicContact NH1-OD2 3.78Å; R734-D741 PolarHBondContact NH1-OD2 2.91Å; R734-D741 VanDerWaalsContact NH2-CG 3.29Å; R734-D741 IonicContact NH2-OD1 3.08Å; R734-D741 PolarHBondContact NH2-OD1 2.97Å; R734-D741 IonicContact NH2-OD2 3.47Å; R734-D741 PolarHBondContact NH2-OD2 2.96Å; R734-D741 VanDerWaalsContact NH2-OD2 3.16Å; T738-D741 PolarHBondContact N-OD2 3.09Å; T738-D741 WeakPolarHBondContact O-CB 3.49Å; T738-D741 PolarHBondContact O-N 3.43Å; T738-D741 VanDerWaalsContact O-N 3.09Å; T738-D741 PolarHBondContact OG1-OD2 3.5Å; E739-D741 PolarHBondContact O-N 2.86Å; D741-D744 PolarHBondContact O-N 2.87Å; D741-V745 VanDerWaalsContact O-CG2 3.3Å; D741-V745 WeakPolarHBondContact O-CG2 3.22Å; D741-V745 PolarHBondContact O-N 2.89Å; D741-V745 VanDerWaalsContact O-N 3.08Å
742	A	94.2	Very high	90.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-43.6	175.7	0	0	0	0	0	111.1	A691 V694 L695 T725 T738 E739 V745 I746	A691-A742 HydrophobicContact CB-CB 4.26Å; V694-A742 HydrophobicContact CB-CB 4.48Å; V694-A742 HydrophobicContact CG1-CB 4.19Å; L695-A742 HydrophobicContact CD2-CB 3.84Å; L695-A742 HydrophobicContact CG-CB 3.99Å; T725-A742 HydrophobicContact CG2-CB 4.18Å; T738-A742 PolarHBondContact O-N 3.4Å; E739-A742 WeakPolarHBondContact O-CB 3.44Å; E739-A742 PolarHBondContact O-N 2.95Å; E739-A742 VanDerWaalsContact O-N 3.11Å; A742-V745 PolarHBondContact O-N 2.92Å; A742-I746 VanDerWaalsContact O-CG1 3.23Å; A742-I746 WeakPolarHBondContact O-CG1 3.28Å; A742-I746 PolarHBondContact O-N 2.82Å
743	L	93.8	Very high	89.3	Confident	83 Å²	83	40.2 Å²	40.2	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-62.9	-43.2	177.2	-68	172.7	0	0	0	112.5	V694 E739 R740 V745 I746 E747	V694-L743 HydrophobicContact CG1-CD2 3.92Å; V694-L743 HydrophobicContact CG1-CG 4.41Å; E739-L743 HydrophobicContact CG-CD1 4.35Å; E739-L743 WeakPolarHBondContact O-CG 3.27Å; E739-L743 PolarHBondContact O-N 3.13Å; R740-L743 PolarHBondContact O-N 2.92Å; L743-V745 VanDerWaalsContact C-N 3.31Å; L743-V745 PolarHBondContact O-N 3.44Å; L743-I746 PolarHBondContact O-N 2.88Å; L743-E747 PolarHBondContact O-N 3.32Å
744	D	92.8	Very high	87.4	Confident	9 Å²	9	41.6 Å²	41.6	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-57.8	-44.6	174.5	-80.1	-7.5	0	0	0	111.1	L653 R656 R728 R740 D741 E747 I748	L653-D744 HydrophobicContact CD2-CB 4.34Å; R656-D744 IonicContact CZ-OD1 3.86Å; R656-D744 IonicContact CZ-OD2 3.76Å; R656-D744 IonicContact NH2-OD1 4Å; R656-D744 PolarHBondContact NH2-OD1 3.03Å; R656-D744 IonicContact NH2-OD2 3.65Å; R656-D744 PolarHBondContact NH2-OD2 3.41Å; R728-D744 IonicContact CZ-OD2 3.99Å; R728-D744 IonicContact NE-OD2 3.8Å; R728-D744 PolarHBondContact NE-OD2 2.84Å; R728-D744 VanDerWaalsContact NE-OD2 3.13Å; R728-D744 IonicContact NH2-OD2 3.79Å; R728-D744 PolarHBondContact NH2-OD2 2.79Å; R740-D744 PolarHBondContact O-N 3.34Å; D741-D744 PolarHBondContact O-N 2.87Å; D744-E747 PolarHBondContact O-N 2.99Å; D744-I748 WeakPolarHBondContact O-CG1 3.16Å; D744-I748 PolarHBondContact O-N 3.38Å; D744-I748 VanDerWaalsContact O-N 3.12Å
745	V	92.7	Very high	85.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-38.8	178.9	168.8	0	0	0	0	111.8	L721 L724 R728 D741 A742 L743 E747 I748 L749	L721-V745 HydrophobicContact CD2-CG1 3.92Å; L724-V745 HydrophobicContact CB-CB 4.4Å; L724-V745 HydrophobicContact CB-CG1 3.52Å; L724-V745 HydrophobicContact CB-CG2 3.89Å; L724-V745 HydrophobicContact CD1-CG1 4.02Å; L724-V745 HydrophobicContact CG-CG1 4.41Å; R728-V745 HydrophobicContact CB-CG2 4.27Å; D741-V745 VanDerWaalsContact O-CG2 3.3Å; D741-V745 WeakPolarHBondContact O-CG2 3.22Å; D741-V745 PolarHBondContact O-N 2.89Å; D741-V745 VanDerWaalsContact O-N 3.08Å; A742-V745 PolarHBondContact O-N 2.92Å; L743-V745 VanDerWaalsContact C-N 3.31Å; L743-V745 PolarHBondContact O-N 3.44Å; V745-E747 VanDerWaalsContact C-N 3.31Å; V745-E747 PolarHBondContact O-N 2.94Å; V745-I748 PolarHBondContact O-N 3.1Å; V745-L749 PolarHBondContact O-N 2.8Å
746	I	91.2	Very high	83.1	Confident	7 Å²	7	37.3 Å²	37.3	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-40.8	174.7	-70.7	165.7	0	0	0	110.5	V694 L695 F698 A742 L743 L749 R750	V694-I746 HydrophobicContact CG1-CD1 3.61Å; L695-I746 HydrophobicContact CD2-CD1 4.49Å; F698-I746 HydrophobicContact CB-CD1 3.77Å; F698-I746 HydrophobicContact CB-CG1 4.21Å; F698-I746 HydrophobicContact CD1-CD1 4.22Å; F698-I746 HydrophobicContact CD1-CG1 3.69Å; F698-I746 HydrophobicContact CD1-CG2 4.34Å; F698-I746 HydrophobicContact CD2-CG1 4.39Å; F698-I746 HydrophobicContact CD2-CG2 3.77Å; F698-I746 HydrophobicContact CE1-CG1 4.1Å; F698-I746 HydrophobicContact CE1-CG2 4.27Å; F698-I746 HydrophobicContact CE2-CG2 3.74Å; F698-I746 HydrophobicContact CG-CD1 3.92Å; F698-I746 HydrophobicContact CG-CG1 3.83Å; F698-I746 HydrophobicContact CG-CG2 4.08Å; F698-I746 HydrophobicContact CZ-CG2 3.99Å; A742-I746 VanDerWaalsContact O-CG1 3.23Å; A742-I746 WeakPolarHBondContact O-CG1 3.28Å; A742-I746 PolarHBondContact O-N 2.82Å; L743-I746 PolarHBondContact O-N 2.88Å; I746-L749 PolarHBondContact O-N 3.32Å; I746-R750 HydrophobicContact CG2-CG 4.24Å; I746-R750 VanDerWaalsContact O-CB 3.32Å; I746-R750 WeakPolarHBondContact O-CB 3.45Å; I746-R750 WeakPolarHBondContact O-CG 3.29Å; I746-R750 PolarHBondContact O-N 2.74Å
747	E	91	Very high	80.4	Confident	53 Å²	53	34.4 Å²	34.4	25%	0.248	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-44.1	175.5	-169.1	179.1	154.8	0	0	111.4	M423 L653 K654 L743 D744 V745 S751	M423-E747 HydrophobicContact CE-CG 4.28Å; M423-E747 VanDerWaalsContact CE-OE1 3.3Å; M423-E747 WeakPolarHBondContact CE-OE1 3.46Å; L653-E747 WeakPolarHBondContact CB-OE2 3.44Å; L653-E747 PolarHBondContact N-OE1 3.26Å; L653-E747 PolarHBondContact N-OE2 2.87Å; K654-E747 PolarHBondContact N-OE1 2.9Å; K654-E747 VanDerWaalsContact N-OE1 3.17Å; L743-E747 PolarHBondContact O-N 3.32Å; D744-E747 PolarHBondContact O-N 2.99Å; V745-E747 VanDerWaalsContact C-N 3.31Å; V745-E747 PolarHBondContact O-N 2.94Å; E747-S751 PolarHBondContact O-N 2.62Å
748	I	90.5	Very high	77.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-48.7	175.4	-64.9	167.6	0	0	0	110.4	M423 A426 A427 L430 F603 L653 D744 V745 S751 S752	M423-I748 HydrophobicContact SD-CG1 3.98Å; A426-I748 HydrophobicContact CB-CD1 3.82Å; A426-I748 HydrophobicContact CB-CG1 4.26Å; A427-I748 HydrophobicContact CB-CG2 4.02Å; L430-I748 HydrophobicContact CD1-CD1 3.77Å; F603-I748 HydrophobicContact CZ-CG2 3.96Å; L653-I748 HydrophobicContact CD2-CD1 3.85Å; L653-I748 HydrophobicContact CD2-CG1 3.73Å; D744-I748 WeakPolarHBondContact O-CG1 3.16Å; D744-I748 PolarHBondContact O-N 3.38Å; D744-I748 VanDerWaalsContact O-N 3.12Å; V745-I748 PolarHBondContact O-N 3.1Å; I748-S751 PolarHBondContact O-N 2.63Å; I748-S751 PolarHBondContact O-OG 2.89Å; I748-S752 PolarHBondContact O-N 2.83Å; I748-S752 VanDerWaalsContact O-N 3.15Å
749	L	87	Confident	75	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-67.6	-41.5	-177.5	-154.5	83.3	0	0	0	112	V601 F698 L702 L721 L724 V745 I746 S751 S752 M753	V601-L749 HydrophobicContact CG2-CD1 4.33Å; F698-L749 HydrophobicContact CE1-CD2 3.77Å; F698-L749 HydrophobicContact CZ-CD2 4.25Å; L702-L749 HydrophobicContact CD1-CD2 4.17Å; L721-L749 HydrophobicContact CD2-CD2 3.98Å; L721-L749 HydrophobicContact CG-CD2 4.49Å; L724-L749 HydrophobicContact CD1-CD1 4.49Å; V745-L749 PolarHBondContact O-N 2.8Å; I746-L749 PolarHBondContact O-N 3.32Å; L749-S751 VanDerWaalsContact C-N 3.27Å; L749-S751 PolarHBondContact O-N 3.08Å; L749-S752 WeakPolarHBondContact O-CB 3.47Å; L749-S752 PolarHBondContact O-N 3.01Å; L749-S752 VanDerWaalsContact O-N 3.13Å; L749-M753 HydrophobicContact CD2-CE 3.83Å; L749-M753 HydrophobicContact CG-CE 4.17Å; L749-M753 WeakPolarHBondContact O-CG 3.34Å; L749-M753 PolarHBondContact O-N 2.88Å
750	R	84.8	Confident	72.1	Confident	115 Å²	115	39.4 Å²	39.4	43%	0.434	21%	0.208	S	C	.	.	H	α-helix	trans	-59.2	-39.1	173.4	-78.9	-178.3	175.9	152	1.3	111.1	F698 E701 I746 S752 M753 C754	F698-R750 HydrophobicContact CE2-CG 3.97Å; F698-R750 HydrophobicContact CZ-CG 4.07Å; E701-R750 IonicContact OE2-NH2 3.83Å; E701-R750 PolarHBondContact OE2-NH2 2.85Å; E701-R750 VanDerWaalsContact OE2-NH2 3.08Å; I746-R750 HydrophobicContact CG2-CG 4.24Å; I746-R750 VanDerWaalsContact O-CB 3.32Å; I746-R750 WeakPolarHBondContact O-CB 3.45Å; I746-R750 WeakPolarHBondContact O-CG 3.29Å; I746-R750 PolarHBondContact O-N 2.74Å; R750-S752 VanDerWaalsContact C-N 3.32Å; R750-S752 PolarHBondContact O-N 2.86Å; R750-M753 PolarHBondContact O-N 2.83Å; R750-C754 VanDerWaalsContact O-CB 3.25Å; R750-C754 WeakPolarHBondContact O-CB 3.41Å; R750-C754 PolarHBondContact O-N 3.35Å; R750-C754 PolarHBondContact O-SG 3.46Å; R750-C754 VanDerWaalsContact O-SG 3.36Å
751	S	81.1	Confident	69.3	Low	34 Å²	34	42.3 Å²	42.3	24%	0.238	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-36.7	176.4	78.4	0	0	0	0	113	M423 E747 I748 L749	M423-S751 VanDerWaalsContact CB-OG 3.22Å; M423-S751 WeakPolarHBondContact CB-OG 3.49Å; M423-S751 WeakPolarHBondContact CG-OG 3.18Å; E747-S751 PolarHBondContact O-N 2.62Å; I748-S751 PolarHBondContact O-N 2.63Å; I748-S751 PolarHBondContact O-OG 2.89Å; L749-S751 VanDerWaalsContact C-N 3.27Å; L749-S751 PolarHBondContact O-N 3.08Å
752	S	77.4	Confident	66.3	Low	9 Å²	9	50.3 Å²	50.3	6%	0.063	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-37.7	173.7	150.9	0	0	0	0	111.8	I602 I748 L749 R750	I602-S752 WeakPolarHBondContact O-CB 3.42Å; I602-S752 PolarHBondContact O-OG 3Å; I748-S752 PolarHBondContact O-N 2.83Å; I748-S752 VanDerWaalsContact O-N 3.15Å; L749-S752 WeakPolarHBondContact O-CB 3.47Å; L749-S752 PolarHBondContact O-N 3.01Å; L749-S752 VanDerWaalsContact O-N 3.13Å; R750-S752 VanDerWaalsContact C-N 3.32Å; R750-S752 PolarHBondContact O-N 2.86Å
753	M	66.4	Low	63.2	Low	15 Å²	15	55.8 Å²	55.8	7%	0.074	30%	0.298	C	S	.	.	H	α-helix	trans	-88	-35.4	-177.7	-65	-166.8	176.8	0	0	114.8	L702 Y706 Q717 L749 R750 Q755 A756 T757	L702-M753 HydrophobicContact CD2-CE 4.2Å; L702-M753 HydrophobicContact CD2-SD 3.58Å; L702-M753 VanDerWaalsContact CD2-SD 3.58Å; Y706-M753 HydrophobicContact CE1-CB 4.39Å; Y706-M753 HydrophobicContact CE1-SD 4.16Å; Y706-M753 HydrophobicContact CE2-SD 4.42Å; Q717-M753 VanDerWaalsContact OE1-CE 3.27Å; L749-M753 HydrophobicContact CD2-CE 3.83Å; L749-M753 HydrophobicContact CG-CE 4.17Å; L749-M753 WeakPolarHBondContact O-CG 3.34Å; L749-M753 PolarHBondContact O-N 2.88Å; R750-M753 PolarHBondContact O-N 2.83Å; M753-Q755 PolarHBondContact O-N 3.23Å; M753-A756 WeakPolarHBondContact O-CA 3.2Å; M753-A756 WeakPolarHBondContact O-CB 3.46Å; M753-A756 PolarHBondContact O-N 2.8Å; M753-T757 PolarHBondContact O-N 3.13Å
754	C	50.7	Low	60.2	Low	52 Å²	52	59.7 Å²	59.7	35%	0.351	31%	0.311	S	S	.	.	H	α-helix	trans	-65.1	-26	-176	-81.3	0	0	0	0	113.3	R750 A756 T757 N758	R750-C754 VanDerWaalsContact O-CB 3.25Å; R750-C754 WeakPolarHBondContact O-CB 3.41Å; R750-C754 PolarHBondContact O-N 3.35Å; R750-C754 PolarHBondContact O-SG 3.46Å; R750-C754 VanDerWaalsContact O-SG 3.36Å; C754-A756 PolarHBondContact O-N 2.84Å; C754-T757 WeakPolarHBondContact CA-OG1 3.42Å; C754-T757 PolarHBondContact O-N 3.03Å; C754-T757 PolarHBondContact O-OG1 2.85Å; C754-N758 PolarHBondContact O-N 2.99Å
755	Q	49.2	Very low	57.1	Low	55 Å²	55	68.1 Å²	68.1	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-25.4	171.5	-71.7	173.8	-30.3	0	0	112.1	L604 M753	L604-Q755 HydrophobicContact CB-CB 3.94Å; L604-Q755 HydrophobicContact CD1-CB 4.29Å; L604-Q755 PolarHBondContact O-NE2 2.9Å; L604-Q755 PolarHBondContact O-OE1 3.08Å; M753-Q755 PolarHBondContact O-N 3.23Å
756	A	41.3	Very low	54	Low	16 Å²	16	76.2 Å²	76.2	13%	0.132	39%	0.388	C	S	.	.	H	α-helix	trans	-87.4	-30.3	175.4	0	0	0	0	0	113.6	V585 L604 Q709 M753 C754	V585-A756 HydrophobicContact CG2-CB 4.38Å; L604-A756 HydrophobicContact CD1-CB 3.78Å; Q709-A756 PolarHBondContact NE2-O 3.15Å; M753-A756 WeakPolarHBondContact O-CA 3.2Å; M753-A756 WeakPolarHBondContact O-CB 3.46Å; M753-A756 PolarHBondContact O-N 2.8Å; C754-A756 PolarHBondContact O-N 2.84Å
757	T	37.6	Very low	51	Low	34 Å²	34	84.6 Å²	84.6	21%	0.209	43%	0.427	C	S	.	.	H	α-helix	trans	-88.8	-30.1	-171.4	57.1	0	0	0	0	114.8	Y706 M753 C754 F759 A760	Y706-T757 HydrophobicContact CD1-CG2 4.49Å; Y706-T757 HydrophobicContact CE1-CG2 3.48Å; Y706-T757 VanDerWaalsContact CE1-CG2 3.48Å; M753-T757 PolarHBondContact O-N 3.13Å; C754-T757 WeakPolarHBondContact CA-OG1 3.42Å; C754-T757 PolarHBondContact O-N 3.03Å; C754-T757 PolarHBondContact O-OG1 2.85Å; T757-F759 PolarHBondContact O-N 3.3Å; T757-A760 PolarHBondContact O-N 2.93Å
758	N	36.5	Very low	47.9	Very low	115 Å²	115	87.4 Å²	87.4	62%	0.615	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.8	-172.4	-82.2	-19.3	0	0	0	115	C754	C754-N758 PolarHBondContact O-N 2.99Å
759	F	38.3	Very low	44.9	Very low	69 Å²	69	93.8 Å²	93.8	30%	0.303	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-9.1	-175.9	-59.7	-67.6	0	0	0	115.2	R581 E608 T757 Q761	R581-F759 HydrophobicContact CB-CB 4.27Å; E608-F759 WeakPolarHBondContact OE1-CZ 3.43Å; T757-F759 PolarHBondContact O-N 3.3Å; F759-Q761 PolarHBondContact O-N 3Å
760	A	33.4	Very low	42.1	Very low	67 Å²	67	104 Å²	104	55%	0.554	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	6.1	175.7	0	0	0	0	0	113.9	T757 H762	T757-A760 PolarHBondContact O-N 2.93Å; A760-H762 PolarHBondContact O-N 3.17Å
761	Q	32.5	Very low	39.5	Very low	149 Å²	149	108.1 Å²	108.1	70%	0.696	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	16	174	-68.3	-163.2	13	0	0	114.4	F759 P763	F759-Q761 PolarHBondContact O-N 3Å; Q761-P763 WeakPolarHBondContact O-CD 3.48Å
762	H	30.2	Very low	37.2	Very low	168 Å²	168	114.7 Å²	114.7	78%	0.778	58%	0.584	S	S	*	*	S	Bend	trans	-96.4	101	159.2	-74	-70	0	0	0	108.9	A760 F764	A760-H762 PolarHBondContact O-N 3.17Å; H762-F764 PolarHBondContact O-N 3.09Å; H762-F764 VanDerWaalsContact O-N 3.08Å
763	P	28.9	Very low	35.2	Very low	115 Å²	115	116.5 Å²	116.5	75%	0.747	60%	0.596	S	S	*	*			trans	-69.6	112.7	170.1	21.8	-13.4	0	0	0	106.7	Q761 Q765	Q761-P763 WeakPolarHBondContact O-CD 3.48Å; P763-Q765 PolarHBondContact O-N 3.16Å; P763-Q765 VanDerWaalsContact O-N 3.15Å
764	F	30.5	Very low	34.2	Very low	165 Å²	165	123.5 Å²	123.5	72%	0.724	63%	0.626	S	S	*	*			trans	-46.5	122.4	161.2	-156.3	-96.1	0	0	0	107.5	H762 Q766	H762-F764 PolarHBondContact O-N 3.09Å; H762-F764 VanDerWaalsContact O-N 3.08Å; F764-Q766 HydrophobicContact CD1-CG 4.38Å; F764-Q766 PolarHBondContact O-N 3.32Å
765	Q	27	Very low	34	Very low	186 Å²	186	131.4 Å²	131.4	87%	0.869	65%	0.648	S	S	*	*			trans	-62	82.9	172.8	-79	178.2	-25.2	0	0	108.7	P763 Q767	P763-Q765 PolarHBondContact O-N 3.16Å; P763-Q765 VanDerWaalsContact O-N 3.15Å; Q765-Q767 PolarHBondContact O-N 3.25Å
766	Q	29.4	Very low	34.2	Very low	172 Å²	172	131.4 Å²	131.4	80%	0.804	66%	0.663	S	S	*	*			trans	-77.6	112.1	153.7	-78.3	-173.2	-5.7	0	0	106.8	F764 S768	F764-Q766 HydrophobicContact CD1-CG 4.38Å; F764-Q766 PolarHBondContact O-N 3.32Å; Q766-S768 PolarHBondContact O-N 3.41Å
767	Q	26.6	Very low	35	Very low	183 Å²	183	135.9 Å²	135.9	86%	0.855	68%	0.681	S	S	*	*	S	Bend	trans	-46.7	135.6	171.1	-69.4	168.3	-11.5	0	0	110	Q765	Q765-Q767 PolarHBondContact O-N 3.25Å
768	S	26.7	Very low	36.2	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	68%	0.683	S	S	*	*			trans	71.7	90.9	168.1	-61.4	0	0	0	0	117	Q766	Q766-S768 PolarHBondContact O-N 3.41Å
769	T	27.6	Very low	37.6	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	67%	0.671	S	S	*	*				177	134	115.4	37.9	0	0	0	0	111.1	K771	T769-K771 PolarHBondContact O-N 2.79Å
770	K	27.8	Very low	39.1	Very low	216 Å²	216	134.6 Å²	134.6	94%	0.939	67%	0.67	S	S	*	*			trans	-56.9	111.7	-177	-66.4	172.4	176.5	176.4	0	112.1
771	K	31.6	Very low	41	Very low	203 Å²	203	138.4 Å²	138.4	88%	0.883	67%	0.671	S	S	*	*			trans	-137.1	136.6	162.3	-80.7	-173.4	177.7	176.1	0	111.6	T769	T769-K771 PolarHBondContact O-N 2.79Å
772	Q	32.6	Very low	43.1	Very low	171 Å²	171	139.3 Å²	139.3	80%	0.799	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-67.5	150.9	-171	-69.2	-173	-26.1	0	0	113.8
773	P	35.2	Very low	45.5	Very low	47 Å²	47	131.3 Å²	131.3	31%	0.305	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-76	158	180	29.4	-30.5	0	0	0	112.6	Q777 Q778 Y781	P773-Q777 HydrophobicContact CB-CB 4.16Å; P773-Q778 HydrophobicContact CG-CG 3.98Å; P773-Q778 VanDerWaalsContact O-CD 3.27Å; P773-Q778 WeakPolarHBondContact O-CG 3.44Å; P773-Q778 PolarHBondContact O-NE2 2.87Å; P773-Y781 HydrophobicContact CG-CD2 4.26Å
774	K	44	Very low	47.9	Very low	162 Å²	162	127 Å²	127	70%	0.704	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-65.6	154	-179.6	-66.9	-178.1	178.5	-178.9	0	112.2	G776 Q777 Q778	K774-G776 VanDerWaalsContact C-N 3.27Å; K774-G776 PolarHBondContact O-N 2.08Å; K774-Q777 PolarHBondContact O-N 2.7Å; K774-Q778 PolarHBondContact O-N 2.82Å
775	R	46.7	Very low	50.2	Low	219 Å²	219	123.8 Å²	123.8	83%	0.826	59%	0.588	S	S	*	*	H	α-helix	trans	-46.9	-32.9	-169.4	-81.8	-178.6	173.1	178	-2	116.6
776	G	53.7	Low	52.8	Low	54 Å²	54	115.8 Å²	115.8	56%	0.557	55%	0.554	S	S	*	*	H	α-helix	trans	-76.2	-39.3	176.7	0	0	0	0	0	114	K774	K774-G776 VanDerWaalsContact C-N 3.27Å; K774-G776 PolarHBondContact O-N 2.08Å
777	Q	57.6	Low	55.2	Low	111 Å²	111	107.7 Å²	107.7	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-77.1	-26	176.3	-75.2	174.1	-10.6	0	0	112.3	P773 K774 K779 I780 Y781	P773-Q777 HydrophobicContact CB-CB 4.16Å; K774-Q777 PolarHBondContact O-N 2.7Å; Q777-K779 VanDerWaalsContact C-N 3.26Å; Q777-K779 PolarHBondContact O-N 2.94Å; Q777-I780 PolarHBondContact O-N 2.97Å; Q777-Y781 WeakPolarHBondContact O-CB 3.42Å; Q777-Y781 PolarHBondContact O-N 3.16Å
778	Q	62.8	Low	57.6	Low	54 Å²	54	102.5 Å²	102.5	25%	0.252	49%	0.491	S	S	.	.	H	α-helix	trans	-58.9	-36.6	171.8	-82.8	178.6	-5.8	0	0	112.8	P773 K774 R782	P773-Q778 HydrophobicContact CG-CG 3.98Å; P773-Q778 VanDerWaalsContact O-CD 3.27Å; P773-Q778 WeakPolarHBondContact O-CG 3.44Å; P773-Q778 PolarHBondContact O-NE2 2.87Å; K774-Q778 PolarHBondContact O-N 2.82Å; Q778-R782 WeakPolarHBondContact O-CB 3.49Å; Q778-R782 VanDerWaalsContact O-CG 3.29Å; Q778-R782 WeakPolarHBondContact O-CG 3.08Å; Q778-R782 PolarHBondContact O-N 3.17Å
779	K	66.7	Low	60	Low	83 Å²	83	105.1 Å²	105.1	36%	0.361	48%	0.484	S	S	.	.	H	α-helix	trans	-64.6	-45.6	177.6	-72.8	-175.7	176.8	-174.6	0	111.3	Q777 R782 F783 L815 E816	Q777-K779 VanDerWaalsContact C-N 3.26Å; Q777-K779 PolarHBondContact O-N 2.94Å; K779-R782 PolarHBondContact O-N 2.85Å; K779-F783 PolarHBondContact O-N 3.31Å; K779-L815 HydrophobicContact CB-CD2 3.68Å; K779-L815 HydrophobicContact CD-CD2 4.44Å; K779-L815 HydrophobicContact CG-CD2 3.96Å; K779-E816 PolarHBondContact NZ-O 3.1Å
780	I	70.6	Confident	62.3	Low	53 Å²	53	101.1 Å²	101.1	27%	0.272	46%	0.455	S	S	.	.	H	α-helix	trans	-65.1	-45.4	176.7	-63.8	170.7	0	0	0	110.6	Q777 R782 F783 I784 F824 L828	Q777-I780 PolarHBondContact O-N 2.97Å; I780-R782 PolarHBondContact O-N 3.33Å; I780-F783 WeakPolarHBondContact O-CB 3.31Å; I780-F783 PolarHBondContact O-N 2.92Å; I780-I784 HydrophobicContact CG2-CD1 3.69Å; I780-I784 HydrophobicContact CG2-CG1 4.41Å; I780-I784 WeakPolarHBondContact O-CG1 3.34Å; I780-I784 PolarHBondContact O-N 3.3Å; I780-F824 HydrophobicContact CG1-CE2 4.07Å; I780-F824 HydrophobicContact CG1-CZ 4.45Å; I780-L828 HydrophobicContact CG2-CD2 3.92Å
781	Y	72.2	Confident	64.3	Low	148 Å²	148	91.8 Å²	91.8	58%	0.58	42%	0.416	S	S	*	.	H	α-helix	trans	-61.2	-43.7	177.3	-102.1	-82.9	0	0	0	112.5	P773 Q777 F783 I784 E785	P773-Y781 HydrophobicContact CG-CD2 4.26Å; Q777-Y781 WeakPolarHBondContact O-CB 3.42Å; Q777-Y781 PolarHBondContact O-N 3.16Å; Y781-F783 VanDerWaalsContact C-N 3.32Å; Y781-F783 PolarHBondContact O-N 3.07Å; Y781-I784 PolarHBondContact O-N 3.02Å; Y781-E785 VanDerWaalsContact O-CB 3.31Å; Y781-E785 WeakPolarHBondContact O-CB 3.48Å; Y781-E785 PolarHBondContact O-N 3Å
782	R	76.9	Confident	66.2	Low	168 Å²	168	88.1 Å²	88.1	63%	0.634	41%	0.41	S	S	*	.	H	α-helix	trans	-61.8	-40.2	175.8	-77.9	-178.4	-178.7	-175.5	1.9	112.2	Q778 K779 I780 E785 A786	Q778-R782 WeakPolarHBondContact O-CB 3.49Å; Q778-R782 VanDerWaalsContact O-CG 3.29Å; Q778-R782 WeakPolarHBondContact O-CG 3.08Å; Q778-R782 PolarHBondContact O-N 3.17Å; K779-R782 PolarHBondContact O-N 2.85Å; I780-R782 PolarHBondContact O-N 3.33Å; R782-E785 PolarHBondContact O-N 2.9Å; R782-A786 WeakPolarHBondContact O-CB 3.46Å; R782-A786 PolarHBondContact O-N 2.66Å
783	F	81.4	Confident	68	Low	0 Å²	0	84 Å²	84	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-64	-45.7	176.9	-173.3	-108.7	0	0	0	111.8	K779 I780 Y781 A786 L787 L806 L809 A810 L813 L815 F824 L828 L834	K779-F783 PolarHBondContact O-N 3.31Å; I780-F783 WeakPolarHBondContact O-CB 3.31Å; I780-F783 PolarHBondContact O-N 2.92Å; Y781-F783 VanDerWaalsContact C-N 3.32Å; Y781-F783 PolarHBondContact O-N 3.07Å; F783-A786 PolarHBondContact O-N 2.73Å; F783-L787 HydrophobicContact CD1-CD1 3.91Å; F783-L787 HydrophobicContact CE1-CD1 3.53Å; F783-L787 HydrophobicContact CZ-CD1 4Å; F783-L787 PolarHBondContact O-N 2.71Å; F783-L806 HydrophobicContact CE1-CD2 4.5Å; F783-L806 HydrophobicContact CZ-CB 4.36Å; F783-L806 HydrophobicContact CZ-CD2 4.03Å; F783-L809 HydrophobicContact CE2-CB 4.45Å; F783-L809 HydrophobicContact CE2-CD2 4.19Å; F783-A810 HydrophobicContact CD2-CB 4.42Å; F783-A810 HydrophobicContact CE2-CB 3.89Å; F783-L813 HydrophobicContact CD2-CD1 4.03Å; F783-L815 HydrophobicContact CB-CD1 3.91Å; F783-L815 HydrophobicContact CD2-CD1 3.56Å; F783-L815 HydrophobicContact CE2-CD1 4.48Å; F783-L815 HydrophobicContact CG-CD1 4.07Å; F783-F824 HydrophobicContact CD1-CE1 4.05Å; F783-F824 HydrophobicContact CD1-CZ 4.32Å; F783-F824 HydrophobicContact CE1-CE1 4.12Å; F783-F824 HydrophobicContact CG-CE1 4.39Å; F783-L828 HydrophobicContact CD1-CD1 4.03Å; F783-L828 HydrophobicContact CE1-CD1 3.98Å; F783-L834 HydrophobicContact CE1-CD1 4.17Å
784	I	78.2	Confident	69.5	Low	25 Å²	25	86.4 Å²	86.4	13%	0.128	41%	0.405	C	S	.	.	H	α-helix	trans	-65.8	-40.8	177.5	-65.3	166.9	0	0	0	111.1	I780 Y781 L787 K788 T833	I780-I784 HydrophobicContact CG2-CD1 3.69Å; I780-I784 HydrophobicContact CG2-CG1 4.41Å; I780-I784 WeakPolarHBondContact O-CG1 3.34Å; I780-I784 PolarHBondContact O-N 3.3Å; Y781-I784 PolarHBondContact O-N 3.02Å; I784-L787 WeakPolarHBondContact O-CB 3.47Å; I784-L787 PolarHBondContact O-N 3.35Å; I784-K788 WeakPolarHBondContact O-CG 3.36Å; I784-K788 PolarHBondContact O-N 2.77Å; I784-T833 HydrophobicContact CD1-CG2 3.58Å; I784-T833 HydrophobicContact CG1-CG2 4.5Å
785	E	79.9	Confident	70	Confident	97 Å²	97	84.2 Å²	84.2	45%	0.453	41%	0.41	S	S	.	.	H	α-helix	trans	-66.6	-37.9	179.7	-160.2	-173.1	155.9	0	0	112	Y781 R782 K788 R789	Y781-E785 VanDerWaalsContact O-CB 3.31Å; Y781-E785 WeakPolarHBondContact O-CB 3.48Å; Y781-E785 PolarHBondContact O-N 3Å; R782-E785 PolarHBondContact O-N 2.9Å; E785-K788 PolarHBondContact O-N 3.14Å; E785-R789 WeakPolarHBondContact O-CG 3.17Å; E785-R789 PolarHBondContact O-N 2.83Å; E785-R789 VanDerWaalsContact O-N 3.13Å; E785-R789 IonicContact OE1-CZ 3.5Å; E785-R789 IonicContact OE1-NH2 3.31Å; E785-R789 PolarHBondContact OE1-NH2 2.84Å
786	A	80.9	Confident	70.4	Confident	18 Å²	18	79.4 Å²	79.4	15%	0.149	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-41.6	172.3	0	0	0	0	0	112.1	R782 F783 K788 R789 E790 L809 L813	R782-A786 WeakPolarHBondContact O-CB 3.46Å; R782-A786 PolarHBondContact O-N 2.66Å; F783-A786 PolarHBondContact O-N 2.73Å; A786-K788 VanDerWaalsContact C-N 3.32Å; A786-K788 PolarHBondContact O-N 3.46Å; A786-R789 PolarHBondContact O-N 3.29Å; A786-E790 PolarHBondContact O-N 3.1Å; A786-L809 HydrophobicContact CB-CD2 4.24Å; A786-L813 HydrophobicContact CB-CD1 3.6Å; A786-L813 HydrophobicContact CB-CD2 4.08Å; A786-L813 HydrophobicContact CB-CG 4.34Å
787	L	79.8	Confident	70.4	Confident	2 Å²	2	82.4 Å²	82.4	1%	0.01	41%	0.413	C	S	.	.	H	α-helix	trans	-58.3	-42.6	173	-97.8	161.5	0	0	0	112.3	F783 I784 R789 E790 M791 F801 L806 L809 L834	F783-L787 HydrophobicContact CD1-CD1 3.91Å; F783-L787 HydrophobicContact CE1-CD1 3.53Å; F783-L787 HydrophobicContact CZ-CD1 4Å; F783-L787 PolarHBondContact O-N 2.71Å; I784-L787 WeakPolarHBondContact O-CB 3.47Å; I784-L787 PolarHBondContact O-N 3.35Å; L787-R789 VanDerWaalsContact C-N 3.35Å; L787-R789 PolarHBondContact O-N 2.95Å; L787-E790 PolarHBondContact O-N 2.74Å; L787-M791 WeakPolarHBondContact O-CG 3.49Å; L787-M791 PolarHBondContact O-N 3.48Å; L787-F801 HydrophobicContact CD2-CD1 4.34Å; L787-F801 HydrophobicContact CD2-CD2 3.93Å; L787-F801 HydrophobicContact CD2-CE1 4.19Å; L787-F801 HydrophobicContact CD2-CE2 3.77Å; L787-F801 HydrophobicContact CD2-CG 4.21Å; L787-F801 HydrophobicContact CD2-CZ 3.9Å; L787-L806 HydrophobicContact CD1-CD2 3.84Å; L787-L806 HydrophobicContact CD2-CD2 3.63Å; L787-L806 HydrophobicContact CG-CD2 4.13Å; L787-L809 HydrophobicContact CB-CD2 4.48Å; L787-L809 HydrophobicContact CD2-CD2 4.26Å; L787-L809 HydrophobicContact CG-CD2 3.72Å; L787-L834 HydrophobicContact CD1-CD1 4.35Å; L787-L834 HydrophobicContact CD1-CD2 4.38Å
788	K	77.4	Confident	70.3	Confident	74 Å²	74	81.6 Å²	81.6	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-61.8	-40.3	175.1	-74.1	-173.9	175.3	-154.5	0	112.3	I784 E785 A786 M791 V792 L844 L848	I784-K788 WeakPolarHBondContact O-CG 3.36Å; I784-K788 PolarHBondContact O-N 2.77Å; E785-K788 PolarHBondContact O-N 3.14Å; A786-K788 VanDerWaalsContact C-N 3.32Å; A786-K788 PolarHBondContact O-N 3.46Å; K788-M791 WeakPolarHBondContact O-CB 2.85Å; K788-M791 PolarHBondContact O-N 2.9Å; K788-V792 WeakPolarHBondContact O-CG2 3.46Å; K788-V792 PolarHBondContact O-N 2.83Å; K788-V792 VanDerWaalsContact O-N 3.09Å; K788-L844 HydrophobicContact CG-CD2 4.45Å; K788-L848 WeakPolarHBondContact CE-O 3.2Å; K788-L848 PolarHBondContact NZ-O 3.32Å
789	R	77.4	Confident	70.5	Confident	166 Å²	166	81.5 Å²	81.5	63%	0.626	42%	0.421	S	S	*	.	H	α-helix	trans	-66.6	-40.9	177.7	-70	179.7	-164.9	171.6	5.6	112.1	E785 A786 L787 M791 V792 S793	E785-R789 WeakPolarHBondContact O-CG 3.17Å; E785-R789 PolarHBondContact O-N 2.83Å; E785-R789 VanDerWaalsContact O-N 3.13Å; E785-R789 IonicContact OE1-CZ 3.5Å; E785-R789 IonicContact OE1-NH2 3.31Å; E785-R789 PolarHBondContact OE1-NH2 2.84Å; A786-R789 PolarHBondContact O-N 3.29Å; L787-R789 VanDerWaalsContact C-N 3.35Å; L787-R789 PolarHBondContact O-N 2.95Å; R789-M791 VanDerWaalsContact C-N 3.32Å; R789-M791 PolarHBondContact O-N 3.08Å; R789-V792 PolarHBondContact O-N 3.18Å; R789-S793 PolarHBondContact O-N 2.75Å; R789-S793 VanDerWaalsContact O-N 3.08Å
790	E	74.3	Confident	70.9	Confident	52 Å²	52	81.9 Å²	81.9	24%	0.243	42%	0.424	C	S	.	.	H	α-helix	trans	-58.5	-42.7	173	-93.4	-97.1	131.3	0	0	111.4	A786 L787 S793 K794 Q805 L809	A786-E790 PolarHBondContact O-N 3.1Å; L787-E790 PolarHBondContact O-N 2.74Å; E790-S793 PolarHBondContact O-N 2.83Å; E790-S793 PolarHBondContact O-OG 2.79Å; E790-K794 PolarHBondContact O-N 3.45Å; E790-K794 IonicContact OE1-NZ 3.5Å; E790-K794 IonicContact OE2-NZ 2.73Å; E790-K794 PolarHBondContact OE2-NZ 3.22Å; E790-Q805 PolarHBondContact OE2-NE2 3.09Å; E790-L809 HydrophobicContact CG-CD1 4.06Å
791	M	71.2	Confident	71.5	Confident	21 Å²	21	80 Å²	80	10%	0.103	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-46.6	175.8	-73.5	179.5	165	0	0	113	L787 K788 R789 S793 K794 L799 F801 L844 L849	L787-M791 WeakPolarHBondContact O-CG 3.49Å; L787-M791 PolarHBondContact O-N 3.48Å; K788-M791 WeakPolarHBondContact O-CB 2.85Å; K788-M791 PolarHBondContact O-N 2.9Å; R789-M791 VanDerWaalsContact C-N 3.32Å; R789-M791 PolarHBondContact O-N 3.08Å; M791-S793 PolarHBondContact O-N 2.73Å; M791-K794 PolarHBondContact O-N 2.83Å; M791-L799 HydrophobicContact CB-CD2 4.37Å; M791-L799 HydrophobicContact CE-CB 3.89Å; M791-L799 HydrophobicContact CE-CD2 3.16Å; M791-L799 HydrophobicContact CE-CG 4.05Å; M791-L799 HydrophobicContact CG-CD2 3.72Å; M791-L799 HydrophobicContact SD-CD2 3.31Å; M791-L799 WeakPolarHBondContact SD-CD2 3.29Å; M791-F801 HydrophobicContact CE-CE2 3.32Å; M791-F801 HydrophobicContact CE-CZ 3.61Å; M791-F801 HydrophobicContact CG-CE2 4.34Å; M791-F801 HydrophobicContact CG-CZ 3.64Å; M791-F801 HydrophobicContact SD-CZ 4.46Å; M791-L844 HydrophobicContact CE-CB 3.44Å; M791-L844 VanDerWaalsContact CE-CB 3.44Å; M791-L844 HydrophobicContact CE-CD2 4.11Å; M791-L844 HydrophobicContact CE-CG 4.38Å; M791-L844 HydrophobicContact SD-CD2 4.15Å; M791-L849 HydrophobicContact SD-CD2 3.78Å
792	V	71.3	Confident	72.2	Confident	126 Å²	126	75.5 Å²	75.5	76%	0.764	40%	0.403	S	S	*	.	H	α-helix	trans	-62.6	-33.4	179.9	174.4	0	0	0	0	111.1	K788 R789	K788-V792 WeakPolarHBondContact O-CG2 3.46Å; K788-V792 PolarHBondContact O-N 2.83Å; K788-V792 VanDerWaalsContact O-N 3.09Å; R789-V792 PolarHBondContact O-N 3.18Å
793	S	69.7	Low	72.5	Confident	83 Å²	83	68.2 Å²	68.2	58%	0.58	38%	0.378	S	S	*	.	H	α-helix	trans	-73.9	-24.5	-179.9	73	0	0	0	0	114.8	R789 E790 M791	R789-S793 PolarHBondContact O-N 2.75Å; R789-S793 VanDerWaalsContact O-N 3.08Å; E790-S793 PolarHBondContact O-N 2.83Å; E790-S793 PolarHBondContact O-OG 2.79Å; M791-S793 PolarHBondContact O-N 2.73Å
794	K	66.1	Low	72.6	Confident	99 Å²	99	71.7 Å²	71.7	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-99.7	-3.8	-170.1	-78.5	177	177.8	158.4	0	115.3	E790 M791 D796	E790-K794 PolarHBondContact O-N 3.45Å; E790-K794 IonicContact OE1-NZ 3.5Å; E790-K794 IonicContact OE2-NZ 2.73Å; E790-K794 PolarHBondContact OE2-NZ 3.22Å; M791-K794 PolarHBondContact O-N 2.83Å; K794-D796 PolarHBondContact O-N 2.73Å
795	S	55.3	Low	72.8	Confident	115 Å²	115	73 Å²	73	80%	0.804	41%	0.413	S	S	*	.			trans	41.5	31.3	175.6	60.1	0	0	0	0	115.6
796	D	54.7	Low	73	Confident	118 Å²	118	68.5 Å²	68.5	63%	0.631	39%	0.392	S	S	*	.			trans	-120.1	118.4	178	-102.3	-23.1	0	0	0	108.1	K794 S798	K794-D796 PolarHBondContact O-N 2.73Å; D796-S798 PolarHBondContact O-N 3.14Å
797	S	54.6	Low	73.2	Confident	117 Å²	117	72.6 Å²	72.6	82%	0.818	41%	0.406	S	S	*	.	S	Bend	trans	-77.3	1.2	-178.9	42.8	0	0	0	0	113.5	L799	S797-L799 PolarHBondContact O-N 3.37Å
798	S	55.9	Low	73.5	Confident	95 Å²	95	78.1 Å²	78.1	66%	0.664	43%	0.432	S	S	*	.			trans	-91.4	88.6	172.3	67.1	0	0	0	0	110.5	D796 E800	D796-S798 PolarHBondContact O-N 3.14Å; S798-E800 VanDerWaalsContact C-N 3.31Å; S798-E800 PolarHBondContact O-N 2.89Å
799	L	65.3	Low	73.7	Confident	52 Å²	52	75.4 Å²	75.4	27%	0.272	42%	0.421	S	S	.	.			trans	-82.9	61.7	-167.2	-61.2	151.7	0	0	0	112.1	M791 S797 A843 L849	M791-L799 HydrophobicContact CB-CD2 4.37Å; M791-L799 HydrophobicContact CE-CB 3.89Å; M791-L799 HydrophobicContact CE-CD2 3.16Å; M791-L799 HydrophobicContact CE-CG 4.05Å; M791-L799 HydrophobicContact CG-CD2 3.72Å; M791-L799 HydrophobicContact SD-CD2 3.31Å; M791-L799 WeakPolarHBondContact SD-CD2 3.29Å; S797-L799 PolarHBondContact O-N 3.37Å; L799-A843 WeakPolarHBondContact O-CA 3.24Å; L799-A843 WeakPolarHBondContact O-CB 3.33Å; L799-L849 HydrophobicContact CD1-CD1 3.74Å; L799-L849 HydrophobicContact CD2-CD1 4.48Å
800	E	76.3	Confident	74	Confident	90 Å²	90	67.8 Å²	67.8	42%	0.421	39%	0.394	S	S	.	.			trans	-118.4	121.5	174.5	-66.6	-172.7	174.2	0	0	111.7	S798 R841	S798-E800 VanDerWaalsContact C-N 3.31Å; S798-E800 PolarHBondContact O-N 2.89Å; E800-R841 WeakPolarHBondContact OE2-CD 3.03Å; E800-R841 IonicContact OE2-NH1 2.77Å; E800-R841 PolarHBondContact OE2-NH1 2.93Å
801	F	83.1	Confident	74.4	Confident	14 Å²	14	71.5 Å²	71.5	6%	0.061	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.8	175.2	-54.3	-84.2	0	0	0	111	L787 M791 L806 R841 Y842	L787-F801 HydrophobicContact CD2-CD1 4.34Å; L787-F801 HydrophobicContact CD2-CD2 3.93Å; L787-F801 HydrophobicContact CD2-CE1 4.19Å; L787-F801 HydrophobicContact CD2-CE2 3.77Å; L787-F801 HydrophobicContact CD2-CG 4.21Å; L787-F801 HydrophobicContact CD2-CZ 3.9Å; M791-F801 HydrophobicContact CE-CE2 3.32Å; M791-F801 HydrophobicContact CE-CZ 3.61Å; M791-F801 HydrophobicContact CG-CE2 4.34Å; M791-F801 HydrophobicContact CG-CZ 3.64Å; M791-F801 HydrophobicContact SD-CZ 4.46Å; F801-L806 HydrophobicContact CB-CD1 4.14Å; F801-L806 HydrophobicContact CB-CD2 4.06Å; F801-L806 HydrophobicContact CB-CG 3.89Å; F801-L806 HydrophobicContact CG-CD2 4.36Å; F801-R841 CarbonylContact O-C 3.56Å; F801-R841 WeakPolarHBondContact O-CA 3.29Å; F801-Y842 PolarHBondContact N-O 3.47Å; F801-Y842 PolarHBondContact O-N 3.08Å
802	P	85.6	Confident	74.9	Confident	54 Å²	54	76.4 Å²	76.4	35%	0.351	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	144.4	167.4	25.3	-29.5	0	0	0	110.9	A804 Q805 L806	P802-A804 PolarHBondContact O-N 2.78Å; P802-A804 VanDerWaalsContact O-N 3.07Å; P802-Q805 HydrophobicContact CG-CB 4.05Å; P802-Q805 WeakPolarHBondContact O-CB 3.25Å; P802-Q805 PolarHBondContact O-N 2.79Å; P802-L806 PolarHBondContact O-N 2.84Å
803	A	84	Confident	75.2	Confident	14 Å²	14	73.7 Å²	73.7	12%	0.116	42%	0.416	C	S	.	.	H	α-helix	trans	-53.5	-32.1	-179.5	0	0	0	0	0	113.5	L806 K807 L825 Q840 Y842	A803-L806 PolarHBondContact O-N 3.12Å; A803-K807 WeakPolarHBondContact O-CB 3.27Å; A803-K807 PolarHBondContact O-N 2.89Å; A803-L825 HydrophobicContact CB-CD1 4.31Å; A803-Q840 HydrophobicContact CB-CB 3.99Å; A803-Q840 WeakPolarHBondContact CB-O 3.4Å; A803-Q840 PolarHBondContact N-O 2.82Å; A803-Y842 HydrophobicContact CB-CE2 4.06Å
804	A	83.7	Confident	75.5	Confident	74 Å²	74	80.4 Å²	80.4	61%	0.612	43%	0.429	S	S	*	.	H	α-helix	trans	-62.4	-41.7	175.9	0	0	0	0	0	112.7	P802 K807 Q808	P802-A804 PolarHBondContact O-N 2.78Å; P802-A804 VanDerWaalsContact O-N 3.07Å; A804-K807 WeakPolarHBondContact O-CB 3.39Å; A804-K807 PolarHBondContact O-N 2.72Å; A804-Q808 PolarHBondContact O-N 3.37Å
805	Q	82.9	Confident	75.8	Confident	53 Å²	53	76.9 Å²	76.9	25%	0.248	42%	0.415	C	S	.	.	H	α-helix	trans	-68.7	-38.9	177.3	-172.7	-177.9	-7.2	0	0	110.9	E790 P802 K807 Q808 L809	E790-Q805 PolarHBondContact OE2-NE2 3.09Å; P802-Q805 HydrophobicContact CG-CB 4.05Å; P802-Q805 WeakPolarHBondContact O-CB 3.25Å; P802-Q805 PolarHBondContact O-N 2.79Å; Q805-K807 VanDerWaalsContact C-N 3.31Å; Q805-K807 PolarHBondContact O-N 2.94Å; Q805-Q808 PolarHBondContact O-N 3.34Å; Q805-L809 PolarHBondContact O-N 3.11Å
806	L	84.4	Confident	76.2	Confident	1 Å²	1	79 Å²	79	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-64	-37.3	174.2	-68	171.1	0	0	0	112	F783 L787 F801 P802 A803 L809 A810 F821 L825 Y842	F783-L806 HydrophobicContact CE1-CD2 4.5Å; F783-L806 HydrophobicContact CZ-CB 4.36Å; F783-L806 HydrophobicContact CZ-CD2 4.03Å; L787-L806 HydrophobicContact CD1-CD2 3.84Å; L787-L806 HydrophobicContact CD2-CD2 3.63Å; L787-L806 HydrophobicContact CG-CD2 4.13Å; F801-L806 HydrophobicContact CB-CD1 4.14Å; F801-L806 HydrophobicContact CB-CD2 4.06Å; F801-L806 HydrophobicContact CB-CG 3.89Å; F801-L806 HydrophobicContact CG-CD2 4.36Å; P802-L806 PolarHBondContact O-N 2.84Å; A803-L806 PolarHBondContact O-N 3.12Å; L806-L809 PolarHBondContact O-N 3.29Å; L806-A810 WeakPolarHBondContact O-CB 3.39Å; L806-A810 PolarHBondContact O-N 2.98Å; L806-F821 VanDerWaalsContact C-CZ 3.45Å; L806-F821 HydrophobicContact CB-CE1 4.39Å; L806-F821 HydrophobicContact CB-CZ 3.92Å; L806-F821 WeakPolarHBondContact O-CZ 3.47Å; L806-L825 HydrophobicContact CD1-CD2 3.84Å; L806-Y842 HydrophobicContact CD1-CD2 3.78Å; L806-Y842 HydrophobicContact CD1-CG 4Å
807	K	85	Confident	76.6	Confident	104 Å²	104	76 Å²	76	45%	0.452	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-41.8	175.7	-168.1	175.3	-178.9	177.5	0	111.3	A803 A804 Q805 A810 M811 F821	A803-K807 WeakPolarHBondContact O-CB 3.27Å; A803-K807 PolarHBondContact O-N 2.89Å; A804-K807 WeakPolarHBondContact O-CB 3.39Å; A804-K807 PolarHBondContact O-N 2.72Å; Q805-K807 VanDerWaalsContact C-N 3.31Å; Q805-K807 PolarHBondContact O-N 2.94Å; K807-A810 PolarHBondContact O-N 3.18Å; K807-M811 HydrophobicContact CG-CE 4.25Å; K807-M811 WeakPolarHBondContact O-CG 3.28Å; K807-M811 PolarHBondContact O-N 2.74Å; K807-F821 VanDerWaalsContact CA-CZ 3.47Å; K807-F821 HydrophobicContact CB-CD1 3.9Å; K807-F821 HydrophobicContact CB-CE1 3.55Å; K807-F821 HydrophobicContact CB-CZ 4.04Å; K807-F821 HydrophobicContact CD-CD1 4.27Å; K807-F821 HydrophobicContact CG-CD1 3.92Å; K807-F821 HydrophobicContact CG-CE1 4.09Å; K807-F821 HydrophobicContact CG-CG 4.29Å
808	Q	84.2	Confident	76.9	Confident	118 Å²	118	76.6 Å²	76.6	55%	0.551	40%	0.399	S	S	*	.	H	α-helix	trans	-63	-45.2	175.6	-172.2	174.6	-12.4	0	0	111.4	A804 Q805 A810 M811 E812	A804-Q808 PolarHBondContact O-N 3.37Å; Q805-Q808 PolarHBondContact O-N 3.34Å; Q808-A810 VanDerWaalsContact C-N 3.3Å; Q808-A810 PolarHBondContact O-N 3.01Å; Q808-M811 WeakPolarHBondContact O-CB 3.29Å; Q808-M811 PolarHBondContact O-N 3.17Å; Q808-M811 VanDerWaalsContact O-N 3.14Å; Q808-E812 WeakPolarHBondContact O-CG 3.4Å; Q808-E812 PolarHBondContact O-N 3.49Å
809	L	82.8	Confident	77.7	Confident	17 Å²	17	75.9 Å²	75.9	9%	0.089	39%	0.386	C	S	.	.	H	α-helix	trans	-61.2	-38.6	175.5	-165.3	77.1	0	0	0	112.1	F783 A786 L787 E790 Q805 L806 M811 E812 L813	F783-L809 HydrophobicContact CE2-CB 4.45Å; F783-L809 HydrophobicContact CE2-CD2 4.19Å; A786-L809 HydrophobicContact CB-CD2 4.24Å; L787-L809 HydrophobicContact CB-CD2 4.48Å; L787-L809 HydrophobicContact CD2-CD2 4.26Å; L787-L809 HydrophobicContact CG-CD2 3.72Å; E790-L809 HydrophobicContact CG-CD1 4.06Å; Q805-L809 PolarHBondContact O-N 3.11Å; L806-L809 PolarHBondContact O-N 3.29Å; L809-M811 VanDerWaalsContact C-N 3.35Å; L809-E812 PolarHBondContact O-N 3.22Å; L809-L813 HydrophobicContact CG-CD1 4.32Å; L809-L813 VanDerWaalsContact O-CG 3.3Å; L809-L813 WeakPolarHBondContact O-CG 3.36Å; L809-L813 PolarHBondContact O-N 2.95Å; L809-L813 VanDerWaalsContact O-N 3.08Å
810	A	82.6	Confident	78.3	Confident	7 Å²	7	78 Å²	78	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-66.6	-36.1	176.1	0	0	0	0	0	112.8	F783 L806 K807 Q808 R814 L815 F821	F783-A810 HydrophobicContact CD2-CB 4.42Å; F783-A810 HydrophobicContact CE2-CB 3.89Å; L806-A810 WeakPolarHBondContact O-CB 3.39Å; L806-A810 PolarHBondContact O-N 2.98Å; K807-A810 PolarHBondContact O-N 3.18Å; Q808-A810 VanDerWaalsContact C-N 3.3Å; Q808-A810 PolarHBondContact O-N 3.01Å; A810-R814 PolarHBondContact O-N 3.23Å; A810-L815 HydrophobicContact CB-CD1 4.3Å; A810-L815 PolarHBondContact O-N 3.23Å; A810-F821 HydrophobicContact CB-CD2 4.15Å; A810-F821 HydrophobicContact CB-CE2 3.55Å; A810-F821 HydrophobicContact CB-CZ 4.34Å
811	M	82.8	Confident	78.5	Confident	130 Å²	130	75.1 Å²	75.1	64%	0.64	39%	0.389	S	S	*	.	H	α-helix	trans	-67.7	-43.7	173.7	-72.7	177.5	171.8	0	0	111.7	K807 Q808 L809 L813 R814	K807-M811 HydrophobicContact CG-CE 4.25Å; K807-M811 WeakPolarHBondContact O-CG 3.28Å; K807-M811 PolarHBondContact O-N 2.74Å; Q808-M811 WeakPolarHBondContact O-CB 3.29Å; Q808-M811 PolarHBondContact O-N 3.17Å; Q808-M811 VanDerWaalsContact O-N 3.14Å; L809-M811 VanDerWaalsContact C-N 3.35Å; M811-L813 VanDerWaalsContact C-N 3.27Å; M811-L813 PolarHBondContact O-N 2.91Å; M811-R814 PolarHBondContact O-N 3.4Å
812	E	82.5	Confident	78.5	Confident	123 Å²	123	81.3 Å²	81.3	58%	0.575	42%	0.418	S	S	*	.	H	α-helix	trans	-59.7	-37.4	176.3	-75.2	174.6	-168.6	0	0	112	Q808 L809 R814	Q808-E812 WeakPolarHBondContact O-CG 3.4Å; Q808-E812 PolarHBondContact O-N 3.49Å; L809-E812 PolarHBondContact O-N 3.22Å; E812-R814 VanDerWaalsContact C-N 3.28Å; E812-R814 PolarHBondContact O-N 3.03Å
813	L	77.5	Confident	78.1	Confident	70 Å²	70	81.2 Å²	81.2	37%	0.366	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-1.2	177.4	-65.6	168.2	0	0	0	114.4	F783 A786 L809 M811 L815	F783-L813 HydrophobicContact CD2-CD1 4.03Å; A786-L813 HydrophobicContact CB-CD1 3.6Å; A786-L813 HydrophobicContact CB-CD2 4.08Å; A786-L813 HydrophobicContact CB-CG 4.34Å; L809-L813 HydrophobicContact CG-CD1 4.32Å; L809-L813 VanDerWaalsContact O-CG 3.3Å; L809-L813 WeakPolarHBondContact O-CG 3.36Å; L809-L813 PolarHBondContact O-N 2.95Å; L809-L813 VanDerWaalsContact O-N 3.08Å; M811-L813 VanDerWaalsContact C-N 3.27Å; M811-L813 PolarHBondContact O-N 2.91Å; L813-L815 VanDerWaalsContact C-N 3.27Å; L813-L815 HydrophobicContact CB-CD1 4.17Å; L813-L815 HydrophobicContact CB-CG 4.09Å; L813-L815 HydrophobicContact CD1-CD1 4.27Å; L813-L815 PolarHBondContact O-N 3.4Å
814	R	75.7	Confident	78.1	Confident	223 Å²	223	81.5 Å²	81.5	84%	0.842	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	46.3	-175.9	-61.5	-176.5	-179.7	178.5	0	112.8	A810 M811 E812 E816	A810-R814 PolarHBondContact O-N 3.23Å; M811-R814 PolarHBondContact O-N 3.4Å; E812-R814 VanDerWaalsContact C-N 3.28Å; E812-R814 PolarHBondContact O-N 3.03Å; R814-E816 PolarHBondContact O-N 3.43Å; R814-E816 VanDerWaalsContact O-N 3.11Å
815	L	71.9	Confident	78.1	Confident	25 Å²	25	78.1 Å²	78.1	13%	0.131	39%	0.388	C	S	.	.			trans	-73.8	101.6	176.7	-74.2	163.2	0	0	0	109.9	K779 F783 A810 L813 L817	K779-L815 HydrophobicContact CB-CD2 3.68Å; K779-L815 HydrophobicContact CD-CD2 4.44Å; K779-L815 HydrophobicContact CG-CD2 3.96Å; F783-L815 HydrophobicContact CB-CD1 3.91Å; F783-L815 HydrophobicContact CD2-CD1 3.56Å; F783-L815 HydrophobicContact CE2-CD1 4.48Å; F783-L815 HydrophobicContact CG-CD1 4.07Å; A810-L815 HydrophobicContact CB-CD1 4.3Å; A810-L815 PolarHBondContact O-N 3.23Å; L813-L815 VanDerWaalsContact C-N 3.27Å; L813-L815 HydrophobicContact CB-CD1 4.17Å; L813-L815 HydrophobicContact CB-CG 4.09Å; L813-L815 HydrophobicContact CD1-CD1 4.27Å; L813-L815 PolarHBondContact O-N 3.4Å; L815-L817 HydrophobicContact CB-CG 4.45Å; L815-L817 PolarHBondContact O-N 2.93Å
816	E	64	Low	78	Confident	161 Å²	161	78 Å²	78	75%	0.752	39%	0.393	S	S	*	.			trans	-67.1	99.1	167.6	-69.7	175	-178.6	0	0	109.4	K779 R814	K779-E816 PolarHBondContact NZ-O 3.1Å; R814-E816 PolarHBondContact O-N 3.43Å; R814-E816 VanDerWaalsContact O-N 3.11Å
817	L	63.4	Low	77.8	Confident	55 Å²	55	82.2 Å²	82.2	29%	0.288	41%	0.411	S	S	.	.			trans	-93.1	126.9	175.9	-64.5	170.3	0	0	0	108.8	L815 Q819 F821 F824	L815-L817 HydrophobicContact CB-CG 4.45Å; L815-L817 PolarHBondContact O-N 2.93Å; L817-Q819 WeakPolarHBondContact CB-O 3.45Å; L817-Q819 PolarHBondContact O-N 2.9Å; L817-F821 HydrophobicContact CD1-CD2 3.75Å; L817-F824 HydrophobicContact CD1-CB 4.14Å; L817-F824 HydrophobicContact CD1-CD1 4.18Å; L817-F824 HydrophobicContact CD1-CG 4.09Å; L817-F824 HydrophobicContact CD2-CB 4.29Å; L817-F824 HydrophobicContact CD2-CD1 4.3Å; L817-F824 HydrophobicContact CD2-CD2 3.52Å; L817-F824 HydrophobicContact CD2-CE2 3.82Å; L817-F824 HydrophobicContact CD2-CG 3.78Å; L817-F824 HydrophobicContact CD2-CZ 4.33Å
818	S	60.8	Low	77.6	Confident	128 Å²	128	77.4 Å²	77.4	90%	0.895	39%	0.391	S	S	*	.	S	Bend	trans	-74.2	-4.8	174.9	54	0	0	0	0	113.4
819	Q	72	Confident	77.7	Confident	81 Å²	81	74.6 Å²	74.6	38%	0.379	38%	0.379	S	S	.	.	S	Bend	trans	-133	158.4	-176.6	-65.9	-171.3	-25.9	0	0	110.1	L817 C823	L817-Q819 WeakPolarHBondContact CB-O 3.45Å; L817-Q819 PolarHBondContact O-N 2.9Å; Q819-C823 HydrophobicContact CB-CB 4.37Å
820	P	78.5	Confident	77.5	Confident	95 Å²	95	80.2 Å²	80.2	62%	0.617	41%	0.405	S	S	*	.			trans	-51.8	141.3	173.1	-23.1	32.1	0	0	0	111.3	E822 C823 F824	P820-E822 PolarHBondContact O-N 2.61Å; P820-E822 VanDerWaalsContact O-N 3.11Å; P820-C823 WeakPolarHBondContact O-CB 3.32Å; P820-C823 PolarHBondContact O-N 2.99Å; P820-F824 PolarHBondContact O-N 3.06Å
821	F	81.4	Confident	77.2	Confident	31 Å²	31	85.5 Å²	85.5	14%	0.136	43%	0.432	C	S	.	.	H	α-helix	trans	-55.5	-32	-176.9	-179.4	-107	0	0	0	113.4	L806 K807 A810 L817 F824 L825	L806-F821 VanDerWaalsContact C-CZ 3.45Å; L806-F821 HydrophobicContact CB-CE1 4.39Å; L806-F821 HydrophobicContact CB-CZ 3.92Å; L806-F821 WeakPolarHBondContact O-CZ 3.47Å; K807-F821 VanDerWaalsContact CA-CZ 3.47Å; K807-F821 HydrophobicContact CB-CD1 3.9Å; K807-F821 HydrophobicContact CB-CE1 3.55Å; K807-F821 HydrophobicContact CB-CZ 4.04Å; K807-F821 HydrophobicContact CD-CD1 4.27Å; K807-F821 HydrophobicContact CG-CD1 3.92Å; K807-F821 HydrophobicContact CG-CE1 4.09Å; K807-F821 HydrophobicContact CG-CG 4.29Å; A810-F821 HydrophobicContact CB-CD2 4.15Å; A810-F821 HydrophobicContact CB-CE2 3.55Å; A810-F821 HydrophobicContact CB-CZ 4.34Å; L817-F821 HydrophobicContact CD1-CD2 3.75Å; F821-F824 HydrophobicContact CD2-CD1 4.32Å; F821-F824 HydrophobicContact CE2-CD1 4.16Å; F821-F824 WeakPolarHBondContact O-CB 3.37Å; F821-F824 PolarHBondContact O-N 3.48Å; F821-L825 HydrophobicContact CD1-CD1 3.88Å; F821-L825 HydrophobicContact CD1-CG 4.45Å; F821-L825 HydrophobicContact CE1-CD1 3.32Å; F821-L825 HydrophobicContact CE1-CG 3.93Å; F821-L825 HydrophobicContact CZ-CD1 3.86Å; F821-L825 HydrophobicContact CZ-CD2 4.38Å; F821-L825 HydrophobicContact CZ-CG 4Å; F821-L825 PolarHBondContact O-N 3.46Å
822	E	81.5	Confident	76.8	Confident	143 Å²	143	80.5 Å²	80.5	67%	0.668	41%	0.414	S	S	*	.	H	α-helix	trans	-65.3	-38.4	176.4	-65.3	174.6	-177.7	0	0	112.2	P820 F824 L825 S826	P820-E822 PolarHBondContact O-N 2.61Å; P820-E822 VanDerWaalsContact O-N 3.11Å; E822-F824 VanDerWaalsContact C-N 3.31Å; E822-F824 PolarHBondContact O-N 2.95Å; E822-L825 PolarHBondContact O-N 2.8Å; E822-S826 PolarHBondContact O-N 2.97Å
823	C	79.2	Confident	76.6	Confident	52 Å²	52	75.6 Å²	75.6	35%	0.351	39%	0.393	S	S	.	.	H	α-helix	trans	-69.3	-33.1	176	-160.9	0	0	0	0	111.3	Q819 P820 S826 K827	Q819-C823 HydrophobicContact CB-CB 4.37Å; P820-C823 WeakPolarHBondContact O-CB 3.32Å; P820-C823 PolarHBondContact O-N 2.99Å; C823-S826 PolarHBondContact O-N 3.22Å; C823-K827 WeakPolarHBondContact O-CG 3.43Å; C823-K827 PolarHBondContact O-N 3.39Å; C823-K827 VanDerWaalsContact O-N 3.09Å
824	F	82.7	Confident	76.7	Confident	21 Å²	21	72.4 Å²	72.4	9%	0.092	38%	0.376	C	S	.	.	H	α-helix	trans	-65.8	-42.2	172.1	176.3	-103.5	0	0	0	112	I780 F783 L817 P820 F821 E822 K827 L828	I780-F824 HydrophobicContact CG1-CE2 4.07Å; I780-F824 HydrophobicContact CG1-CZ 4.45Å; F783-F824 HydrophobicContact CD1-CE1 4.05Å; F783-F824 HydrophobicContact CD1-CZ 4.32Å; F783-F824 HydrophobicContact CE1-CE1 4.12Å; F783-F824 HydrophobicContact CG-CE1 4.39Å; L817-F824 HydrophobicContact CD1-CB 4.14Å; L817-F824 HydrophobicContact CD1-CD1 4.18Å; L817-F824 HydrophobicContact CD1-CG 4.09Å; L817-F824 HydrophobicContact CD2-CB 4.29Å; L817-F824 HydrophobicContact CD2-CD1 4.3Å; L817-F824 HydrophobicContact CD2-CD2 3.52Å; L817-F824 HydrophobicContact CD2-CE2 3.82Å; L817-F824 HydrophobicContact CD2-CG 3.78Å; L817-F824 HydrophobicContact CD2-CZ 4.33Å; P820-F824 PolarHBondContact O-N 3.06Å; F821-F824 HydrophobicContact CD2-CD1 4.32Å; F821-F824 HydrophobicContact CE2-CD1 4.16Å; F821-F824 WeakPolarHBondContact O-CB 3.37Å; F821-F824 PolarHBondContact O-N 3.48Å; E822-F824 VanDerWaalsContact C-N 3.31Å; E822-F824 PolarHBondContact O-N 2.95Å; F824-K827 PolarHBondContact O-N 3.46Å; F824-L828 HydrophobicContact CD1-CD1 4.16Å; F824-L828 HydrophobicContact CE1-CD1 3.59Å; F824-L828 HydrophobicContact CE1-CG 4.48Å; F824-L828 HydrophobicContact CZ-CD1 3.8Å; F824-L828 HydrophobicContact CZ-CG 4.42Å; F824-L828 PolarHBondContact O-N 3.44Å; F824-L828 VanDerWaalsContact O-N 3.15Å
825	L	84	Confident	77	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-65.4	-39.7	173.4	-80.7	171	0	0	0	112.6	A803 L806 F821 E822 K827 L828 N829 L834 Y842	A803-L825 HydrophobicContact CB-CD1 4.31Å; L806-L825 HydrophobicContact CD1-CD2 3.84Å; F821-L825 HydrophobicContact CD1-CD1 3.88Å; F821-L825 HydrophobicContact CD1-CG 4.45Å; F821-L825 HydrophobicContact CE1-CD1 3.32Å; F821-L825 HydrophobicContact CE1-CG 3.93Å; F821-L825 HydrophobicContact CZ-CD1 3.86Å; F821-L825 HydrophobicContact CZ-CD2 4.38Å; F821-L825 HydrophobicContact CZ-CG 4Å; F821-L825 PolarHBondContact O-N 3.46Å; E822-L825 PolarHBondContact O-N 2.8Å; L825-K827 VanDerWaalsContact C-N 3.32Å; L825-K827 PolarHBondContact O-N 2.96Å; L825-L828 PolarHBondContact O-N 2.88Å; L825-N829 PolarHBondContact O-N 3.23Å; L825-L834 HydrophobicContact CD2-CD1 4.07Å; L825-Y842 HydrophobicContact CB-CE1 4.14Å; L825-Y842 HydrophobicContact CD1-CE2 3.82Å; L825-Y842 HydrophobicContact CD2-CD1 4.37Å; L825-Y842 HydrophobicContact CD2-CD2 4.37Å; L825-Y842 HydrophobicContact CD2-CE1 4.27Å; L825-Y842 HydrophobicContact CD2-CE2 4.29Å; L825-Y842 HydrophobicContact CD2-CG 4.42Å; L825-Y842 HydrophobicContact CG-CE2 4.48Å
826	S	81.5	Confident	77.6	Confident	49 Å²	49	67.2 Å²	67.2	34%	0.343	36%	0.364	S	S	.	.	H	α-helix	trans	-58.5	-45.5	174.7	-164.7	0	0	0	0	111.2	E822 C823 L828 N829 E830	E822-S826 PolarHBondContact O-N 2.97Å; C823-S826 PolarHBondContact O-N 3.22Å; S826-L828 VanDerWaalsContact C-N 3.34Å; S826-L828 PolarHBondContact O-N 3.45Å; S826-N829 CarbonylContact O-C 3.48Å; S826-N829 WeakPolarHBondContact O-CA 3.39Å; S826-N829 WeakPolarHBondContact O-CB 3.33Å; S826-N829 PolarHBondContact O-N 3.4Å; S826-E830 WeakPolarHBondContact O-CG 3.5Å; S826-E830 PolarHBondContact O-N 2.83Å; S826-E830 PolarHBondContact OG-OE1 3.21Å
827	K	79.9	Confident	78.3	Confident	90 Å²	90	65.8 Å²	65.8	39%	0.391	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-38.1	176.3	-77.2	176.4	173.2	176.7	0	113.3	C823 F824 L825 N829 N831	C823-K827 WeakPolarHBondContact O-CG 3.43Å; C823-K827 PolarHBondContact O-N 3.39Å; C823-K827 VanDerWaalsContact O-N 3.09Å; F824-K827 PolarHBondContact O-N 3.46Å; L825-K827 VanDerWaalsContact C-N 3.32Å; L825-K827 PolarHBondContact O-N 2.96Å; K827-N829 VanDerWaalsContact C-N 3.29Å; K827-N831 VanDerWaalsContact O-CB 3.24Å; K827-N831 WeakPolarHBondContact O-CB 3.37Å; K827-N831 PolarHBondContact O-N 3.48Å; K827-N831 PolarHBondContact O-ND2 3.35Å; K827-N831 VanDerWaalsContact O-ND2 3.1Å
828	L	81.4	Confident	78.8	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-70.2	-28	175.2	-69.1	176.9	0	0	0	112.5	I780 F783 F824 L825 S826 G832 T833 L834	I780-L828 HydrophobicContact CG2-CD2 3.92Å; F783-L828 HydrophobicContact CD1-CD1 4.03Å; F783-L828 HydrophobicContact CE1-CD1 3.98Å; F824-L828 HydrophobicContact CD1-CD1 4.16Å; F824-L828 HydrophobicContact CE1-CD1 3.59Å; F824-L828 HydrophobicContact CE1-CG 4.48Å; F824-L828 HydrophobicContact CZ-CD1 3.8Å; F824-L828 HydrophobicContact CZ-CG 4.42Å; F824-L828 PolarHBondContact O-N 3.44Å; F824-L828 VanDerWaalsContact O-N 3.15Å; L825-L828 PolarHBondContact O-N 2.88Å; S826-L828 VanDerWaalsContact C-N 3.34Å; S826-L828 PolarHBondContact O-N 3.45Å; L828-G832 PolarHBondContact O-N 3.1Å; L828-T833 PolarHBondContact O-N 2.93Å; L828-T833 PolarHBondContact O-OG1 3.03Å; L828-T833 VanDerWaalsContact O-OG1 3.13Å; L828-L834 HydrophobicContact CB-CB 4.19Å; L828-L834 HydrophobicContact CB-CD1 4.18Å; L828-L834 HydrophobicContact CD1-CD1 3.73Å; L828-L834 PolarHBondContact O-N 2.85Å; L828-L834 VanDerWaalsContact O-N 3.08Å
829	N	84.5	Confident	79.7	Confident	58 Å²	58	67.6 Å²	67.6	31%	0.31	36%	0.356	S	S	.	.	H	α-helix	trans	-75.3	-43.8	173.4	-174.4	56.4	0	0	0	112.4	L825 S826 K827 N831 G832 L834 I835 L836	L825-N829 PolarHBondContact O-N 3.23Å; S826-N829 CarbonylContact O-C 3.48Å; S826-N829 WeakPolarHBondContact O-CA 3.39Å; S826-N829 WeakPolarHBondContact O-CB 3.33Å; S826-N829 PolarHBondContact O-N 3.4Å; K827-N829 VanDerWaalsContact C-N 3.29Å; N829-N831 VanDerWaalsContact C-N 3.31Å; N829-N831 PolarHBondContact O-N 2.77Å; N829-G832 PolarHBondContact O-N 2.98Å; N829-L834 WeakPolarHBondContact CA-O 3.34Å; N829-L834 WeakPolarHBondContact CB-O 3.35Å; N829-L834 PolarHBondContact OD1-O 3.34Å; N829-L834 VanDerWaalsContact OD1-O 3.11Å; N829-I835 WeakPolarHBondContact OD1-CA 3.41Å; N829-L836 PolarHBondContact OD1-N 2.83Å
830	E	79.9	Confident	80.1	Confident	135 Å²	135	69.8 Å²	69.8	63%	0.631	37%	0.367	S	S	*	.	H	α-helix	trans	-60.5	-40.6	172.7	-72.3	160.3	-146.6	0	0	111.6	S826 G832	S826-E830 WeakPolarHBondContact O-CG 3.5Å; S826-E830 PolarHBondContact O-N 2.83Å; S826-E830 PolarHBondContact OG-OE1 3.21Å; E830-G832 PolarHBondContact O-N 3.45Å
831	N	75.3	Confident	80.4	Confident	118 Å²	118	71 Å²	71	63%	0.631	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	3.2	175.7	-68.7	-25.1	0	0	0	113.7	K827 N829 T833	K827-N831 VanDerWaalsContact O-CB 3.24Å; K827-N831 WeakPolarHBondContact O-CB 3.37Å; K827-N831 PolarHBondContact O-N 3.48Å; K827-N831 PolarHBondContact O-ND2 3.35Å; K827-N831 VanDerWaalsContact O-ND2 3.1Å; N829-N831 VanDerWaalsContact C-N 3.31Å; N829-N831 PolarHBondContact O-N 2.77Å; N831-T833 PolarHBondContact O-N 3.49Å; N831-T833 VanDerWaalsContact O-N 3.14Å
832	G	74.3	Confident	80.6	Confident	26 Å²	26	70.9 Å²	70.9	27%	0.268	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	19.6	178.7	0	0	0	0	0	114.7	L828 N829 E830 N845	L828-G832 PolarHBondContact O-N 3.1Å; N829-G832 PolarHBondContact O-N 2.98Å; E830-G832 PolarHBondContact O-N 3.45Å; G832-N845 WeakPolarHBondContact O-CB 3.45Å; G832-N845 PolarHBondContact O-ND2 2.67Å
833	T	78.9	Confident	80.6	Confident	19 Å²	19	64.6 Å²	64.6	12%	0.117	33%	0.33	C	S	.	.	S	Bend	trans	-86.6	-41.8	-178.8	-7.9	0	0	0	0	111.2	I784 L828 N831 N845 L848	I784-T833 HydrophobicContact CD1-CG2 3.58Å; I784-T833 HydrophobicContact CG1-CG2 4.5Å; L828-T833 PolarHBondContact O-N 2.93Å; L828-T833 PolarHBondContact O-OG1 3.03Å; L828-T833 VanDerWaalsContact O-OG1 3.13Å; N831-T833 PolarHBondContact O-N 3.49Å; N831-T833 VanDerWaalsContact O-N 3.14Å; T833-N845 PolarHBondContact O-N 3.47Å; T833-N845 VanDerWaalsContact O-N 3.14Å; T833-L848 HydrophobicContact CG2-CD1 3.32Å
834	L	80.5	Confident	80.7	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	113.5	174.1	-79.8	170.9	0	0	0	109.6	F783 L787 L825 L828 N829 Y842 A843 L844	F783-L834 HydrophobicContact CE1-CD1 4.17Å; L787-L834 HydrophobicContact CD1-CD1 4.35Å; L787-L834 HydrophobicContact CD1-CD2 4.38Å; L825-L834 HydrophobicContact CD2-CD1 4.07Å; L828-L834 HydrophobicContact CB-CB 4.19Å; L828-L834 HydrophobicContact CB-CD1 4.18Å; L828-L834 HydrophobicContact CD1-CD1 3.73Å; L828-L834 PolarHBondContact O-N 2.85Å; L828-L834 VanDerWaalsContact O-N 3.08Å; N829-L834 WeakPolarHBondContact CA-O 3.34Å; N829-L834 WeakPolarHBondContact CB-O 3.35Å; N829-L834 PolarHBondContact OD1-O 3.34Å; N829-L834 VanDerWaalsContact OD1-O 3.11Å; L834-Y842 HydrophobicContact CB-CD1 4.29Å; L834-A843 CarbonylContact C-O 3.6Å; L834-A843 WeakPolarHBondContact CA-O 3.43Å; L834-L844 HydrophobicContact CD2-CB 4.38Å; L834-L844 HydrophobicContact CD2-CD1 3.88Å; L834-L844 HydrophobicContact CG-CD1 4.41Å
835	I	81.2	Confident	80.3	Confident	59 Å²	59	63.3 Å²	63.3	30%	0.303	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.5	-176.9	-57.3	171.2	0	0	0	109.6	N829 K837 Y842 A843 N845	N829-I835 WeakPolarHBondContact OD1-CA 3.41Å; I835-K837 PolarHBondContact O-N 2.92Å; I835-Y842 CarbonylContact O-C 3.17Å; I835-Y842 WeakPolarHBondContact O-CA 3.07Å; I835-A843 PolarHBondContact N-O 3.03Å; I835-A843 PolarHBondContact O-N 3.5Å; I835-N845 HydrophobicContact CD1-CB 4.17Å; I835-N845 HydrophobicContact CG1-CB 4.49Å
836	L	84.8	Confident	79.6	Confident	80 Å²	80	67.6 Å²	67.6	42%	0.419	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	120.3	173	-176.2	71.8	0	0	0	110.5	N829 Y842	N829-L836 PolarHBondContact OD1-N 2.83Å; L836-Y842 HydrophobicContact CB-CD1 4.29Å; L836-Y842 HydrophobicContact CB-CE1 4.14Å; L836-Y842 HydrophobicContact CD1-CD1 4.15Å; L836-Y842 HydrophobicContact CD1-CD2 4.35Å; L836-Y842 HydrophobicContact CD1-CE1 3.74Å; L836-Y842 HydrophobicContact CD1-CE2 3.93Å; L836-Y842 HydrophobicContact CD1-CG 4.44Å
837	K	79.4	Confident	78.8	Confident	131 Å²	131	69.7 Å²	69.7	57%	0.57	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	3.1	-179.4	-71.1	-72.6	-176.8	175.1	0	114.2	I835 R841 A843	I835-K837 PolarHBondContact O-N 2.92Å; K837-R841 PolarHBondContact N-O 3.44Å; K837-A843 HydrophobicContact CG-CB 3.89Å
838	G	73.5	Confident	77.9	Confident	32 Å²	32	68.6 Å²	68.6	33%	0.33	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	103.9	159.2	-178.2	0	0	0	0	0	113	Q840 R841	G838-Q840 VanDerWaalsContact C-N 3.32Å; G838-Q840 PolarHBondContact O-N 3.09Å; G838-R841 WeakPolarHBondContact O-CB 3.36Å; G838-R841 PolarHBondContact O-N 3.18Å
839	H	78.9	Confident	76.7	Confident	190 Å²	190	74.4 Å²	74.4	88%	0.88	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	43	-177.9	-60.1	92.8	0	0	0	114.9	R841	H839-R841 PolarHBondContact O-N 3.07Å
840	Q	81	Confident	76.3	Confident	126 Å²	126	75.3 Å²	75.3	59%	0.589	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	29.5	-176.5	-62.5	-166.1	-16.6	0	0	114.4	A803 G838	A803-Q840 HydrophobicContact CB-CB 3.99Å; A803-Q840 WeakPolarHBondContact CB-O 3.4Å; A803-Q840 PolarHBondContact N-O 2.82Å; G838-Q840 VanDerWaalsContact C-N 3.32Å; G838-Q840 PolarHBondContact O-N 3.09Å
841	R	83.6	Confident	76.1	Confident	122 Å²	122	72.1 Å²	72.1	46%	0.46	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.2	171.3	-64	-174.6	171.7	-165.4	-2.7	111.1	E800 F801 K837 G838 H839	E800-R841 WeakPolarHBondContact OE2-CD 3.03Å; E800-R841 IonicContact OE2-NH1 2.77Å; E800-R841 PolarHBondContact OE2-NH1 2.93Å; F801-R841 CarbonylContact O-C 3.56Å; F801-R841 WeakPolarHBondContact O-CA 3.29Å; K837-R841 PolarHBondContact N-O 3.44Å; G838-R841 WeakPolarHBondContact O-CB 3.36Å; G838-R841 PolarHBondContact O-N 3.18Å; H839-R841 PolarHBondContact O-N 3.07Å
842	Y	86.1	Confident	76.1	Confident	27 Å²	27	69.6 Å²	69.6	11%	0.106	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.2	-179.4	-63.5	-98.1	0	0	0	109.9	F801 A803 L806 L825 L834 I835 L836	F801-Y842 PolarHBondContact N-O 3.47Å; F801-Y842 PolarHBondContact O-N 3.08Å; A803-Y842 HydrophobicContact CB-CE2 4.06Å; L806-Y842 HydrophobicContact CD1-CD2 3.78Å; L806-Y842 HydrophobicContact CD1-CG 4Å; L825-Y842 HydrophobicContact CB-CE1 4.14Å; L825-Y842 HydrophobicContact CD1-CE2 3.82Å; L825-Y842 HydrophobicContact CD2-CD1 4.37Å; L825-Y842 HydrophobicContact CD2-CD2 4.37Å; L825-Y842 HydrophobicContact CD2-CE1 4.27Å; L825-Y842 HydrophobicContact CD2-CE2 4.29Å; L825-Y842 HydrophobicContact CD2-CG 4.42Å; L825-Y842 HydrophobicContact CG-CE2 4.48Å; L834-Y842 HydrophobicContact CB-CD1 4.29Å; I835-Y842 CarbonylContact O-C 3.17Å; I835-Y842 WeakPolarHBondContact O-CA 3.07Å; L836-Y842 HydrophobicContact CB-CD1 4.29Å; L836-Y842 HydrophobicContact CB-CE1 4.14Å; L836-Y842 HydrophobicContact CD1-CD1 4.15Å; L836-Y842 HydrophobicContact CD1-CD2 4.35Å; L836-Y842 HydrophobicContact CD1-CE1 3.74Å; L836-Y842 HydrophobicContact CD1-CE2 3.93Å; L836-Y842 HydrophobicContact CD1-CG 4.44Å
843	A	82.6	Confident	76.3	Confident	11 Å²	11	72.1 Å²	72.1	9%	0.091	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.3	173.8	0	0	0	0	0	110.2	L799 L834 I835 K837 N845	L799-A843 WeakPolarHBondContact O-CA 3.24Å; L799-A843 WeakPolarHBondContact O-CB 3.33Å; L834-A843 CarbonylContact C-O 3.6Å; L834-A843 WeakPolarHBondContact CA-O 3.43Å; I835-A843 PolarHBondContact N-O 3.03Å; I835-A843 PolarHBondContact O-N 3.5Å; K837-A843 HydrophobicContact CG-CB 3.89Å; A843-N845 PolarHBondContact O-N 2.99Å
844	L	80.3	Confident	76.1	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	135.8	172.6	-161.8	82.4	0	0	0	108.9	K788 M791 L834 P846 L849	K788-L844 HydrophobicContact CG-CD2 4.45Å; M791-L844 HydrophobicContact CE-CB 3.44Å; M791-L844 VanDerWaalsContact CE-CB 3.44Å; M791-L844 HydrophobicContact CE-CD2 4.11Å; M791-L844 HydrophobicContact CE-CG 4.38Å; M791-L844 HydrophobicContact SD-CD2 4.15Å; L834-L844 HydrophobicContact CD2-CB 4.38Å; L834-L844 HydrophobicContact CD2-CD1 3.88Å; L834-L844 HydrophobicContact CG-CD1 4.41Å; L844-P846 WeakPolarHBondContact O-CD 3.09Å; L844-L849 HydrophobicContact CD2-CD2 4.39Å; L844-L849 HydrophobicContact CD2-CG 4.21Å
845	N	74.3	Confident	75.8	Confident	42 Å²	42	80.3 Å²	80.3	23%	0.225	42%	0.417	C	S	.	.			trans	-60	124.8	177.8	-173.8	-12.9	0	0	0	109.9	G832 T833 I835 A843 S847 L848	G832-N845 WeakPolarHBondContact O-CB 3.45Å; G832-N845 PolarHBondContact O-ND2 2.67Å; T833-N845 PolarHBondContact O-N 3.47Å; T833-N845 VanDerWaalsContact O-N 3.14Å; I835-N845 HydrophobicContact CD1-CB 4.17Å; I835-N845 HydrophobicContact CG1-CB 4.49Å; A843-N845 PolarHBondContact O-N 2.99Å; N845-S847 PolarHBondContact ND2-OG 3.18Å; N845-S847 PolarHBondContact O-N 2.76Å; N845-S847 PolarHBondContact OD1-N 2.99Å; N845-S847 PolarHBondContact OD1-OG 2.71Å; N845-S847 VanDerWaalsContact OD1-OG 3.07Å; N845-L848 HydrophobicContact CB-CD1 4.19Å; N845-L848 WeakPolarHBondContact O-CB 3.17Å; N845-L848 PolarHBondContact O-N 3.26Å
846	P	69	Low	75.4	Confident	94 Å²	94	81.8 Å²	81.8	61%	0.61	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-57	-25	-178.1	-6.6	3.9	0	0	0	113.8	L844 L848 L849	L844-P846 WeakPolarHBondContact O-CD 3.09Å; P846-L848 PolarHBondContact O-N 3.47Å; P846-L849 PolarHBondContact O-N 2.65Å
847	S	64.9	Low	74.7	Confident	92 Å²	92	81.9 Å²	81.9	64%	0.643	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-70.5	-8.7	177.1	65.5	0	0	0	0	114.2	N845	N845-S847 PolarHBondContact ND2-OG 3.18Å; N845-S847 PolarHBondContact O-N 2.76Å; N845-S847 PolarHBondContact OD1-N 2.99Å; N845-S847 PolarHBondContact OD1-OG 2.71Å; N845-S847 VanDerWaalsContact OD1-OG 3.07Å
848	L	61.3	Low	74.3	Confident	68 Å²	68	77.8 Å²	77.8	36%	0.356	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-105.5	-6.3	179.1	-67.7	171	0	0	0	113.2	K788 T833 N845 P846	K788-L848 WeakPolarHBondContact CE-O 3.2Å; K788-L848 PolarHBondContact NZ-O 3.32Å; T833-L848 HydrophobicContact CG2-CD1 3.32Å; N845-L848 HydrophobicContact CB-CD1 4.19Å; N845-L848 WeakPolarHBondContact O-CB 3.17Å; N845-L848 PolarHBondContact O-N 3.26Å; P846-L848 PolarHBondContact O-N 3.47Å
849	L	56.2	Low	74.4	Confident	126 Å²	126	82 Å²	82	66%	0.66	42%	0.422	S	S	*	.			trans	-73.8	0	168.3	-81.7	162.1	0	0	0	109.1	M791 L799 L844 P846	M791-L849 HydrophobicContact SD-CD2 3.78Å; L799-L849 HydrophobicContact CD1-CD1 3.74Å; L799-L849 HydrophobicContact CD2-CD1 4.48Å; L844-L849 HydrophobicContact CD2-CD2 4.39Å; L844-L849 HydrophobicContact CD2-CG 4.21Å; P846-L849 PolarHBondContact O-N 2.65Å

Retrieved 849 of 849 residues in 1730.4 ms (Link to these results)

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